Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
547909 | 2lj0 RC | 17912 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLN 1 H1 GLN 1 -15.645 1.767 -4.434
2 H2 GLN 1 H2 GLN 1 -14.236 1.899 -5.370
3 H3 GLN 1 H3 GLN 1 -14.268 0.867 -4.027
4 HA GLN 1 HA GLN 1 -15.792 -0.590 -5.049
5 HB2 GLN 1 HB2 GLN 1 -17.102 1.161 -6.199
6 HB3 GLN 1 HB3 GLN 1 -15.792 1.383 -7.345
7 HG2 GLN 1 HG2 GLN 1 -17.733 0.037 -8.173
8 HG3 GLN 1 HG3 GLN 1 -16.159 -0.741 -8.325
9 HE21 GLN 1 HE22 GLN 1 -15.747 -2.591 -7.204
10 HE22 GLN 1 HE21 GLN 1 -16.948 -3.453 -6.301
11 H THR 2 H THR 2 -13.545 -1.347 -4.610
12 HA THR 2 HA THR 2 -11.796 -1.528 -6.928
13 HB THR 2 HB THR 2 -10.447 -3.029 -5.379
14 HG1 THR 2 HG1 THR 2 -11.116 -2.661 -3.083
15 HG21 THR 2 HG21 THR 2 -9.618 -1.171 -4.010
16 HG22 THR 2 HG22 THR 2 -11.064 -0.236 -4.403
17 HG23 THR 2 HG23 THR 2 -9.914 -0.659 -5.673
18 H SER 3 H SER 3 -13.897 -3.511 -4.974
19 HA SER 3 HA SER 3 -14.612 -5.204 -7.155
20 HB2 SER 3 HB2 SER 3 -12.423 -6.211 -6.348
21 HB3 SER 3 HB3 SER 3 -13.227 -6.526 -4.811
22 HG SER 3 HG SER 3 -13.223 -8.047 -6.956
23 H GLN 4 H GLN 4 -14.374 -5.527 -3.685
24 HA GLN 4 HA GLN 4 -16.684 -4.250 -2.936
25 HB2 GLN 4 HB2 GLN 4 -17.993 -5.968 -4.053
26 HB3 GLN 4 HB3 GLN 4 -17.110 -7.235 -3.209
27 HG2 GLN 4 HG2 GLN 4 -18.015 -6.521 -1.103
28 HG3 GLN 4 HG3 GLN 4 -18.840 -5.165 -1.876
29 HE21 GLN 4 HE22 GLN 4 -19.850 -7.419 -0.303
30 HE22 GLN 4 HE21 GLN 4 -21.030 -8.209 -1.306
31 H ASP 5 H ASP 5 -16.306 -7.401 -1.566
32 HA ASP 5 HA ASP 5 -14.603 -6.293 0.569
33 HB2 ASP 5 HB2 ASP 5 -16.345 -8.763 0.719
34 HB3 ASP 5 HB3 ASP 5 -15.489 -7.997 2.048
35 H LEU 6 H LEU 6 -13.038 -6.739 -1.310
36 HA LEU 6 HA LEU 6 -12.480 -9.495 -1.897
37 HB2 LEU 6 HB2 LEU 6 -12.227 -7.739 -3.604
38 HB3 LEU 6 HB3 LEU 6 -10.955 -7.000 -2.647
39 HG LEU 6 HG LEU 6 -9.554 -8.998 -2.957
40 HD11 LEU 6 HD11 LEU 6 -10.232 -10.713 -4.574
41 HD12 LEU 6 HD12 LEU 6 -11.819 -9.954 -4.702
42 HD13 LEU 6 HD13 LEU 6 -11.305 -10.672 -3.174
43 HD21 LEU 6 HD21 LEU 6 -9.373 -7.134 -4.520
44 HD22 LEU 6 HD22 LEU 6 -10.629 -7.853 -5.527
45 HD23 LEU 6 HD23 LEU 6 -9.081 -8.675 -5.328
46 H PHE 7 H PHE 7 -10.161 -6.994 -0.888
47 HA PHE 7 HA PHE 7 -9.372 -8.507 1.423
48 HB2 PHE 7 HB2 PHE 7 -8.074 -9.093 -1.004
49 HB3 PHE 7 HB3 PHE 7 -6.953 -8.068 -0.105
50 HD1 PHE 7 HD2 PHE 7 -6.561 -8.742 2.382
51 HD2 PHE 7 HD1 PHE 7 -8.153 -11.358 -0.572
52 HE1 PHE 7 HE2 PHE 7 -5.906 -10.680 3.751
53 HE2 PHE 7 HE1 PHE 7 -7.508 -13.300 0.797
54 HZ PHE 7 HZ PHE 7 -6.380 -12.961 2.959
55 H SER 8 H SER 8 -8.790 -7.104 2.935
56 HA SER 8 HA SER 8 -7.827 -4.468 2.067
57 HB2 SER 8 HB2 SER 8 -10.159 -4.449 2.982
58 HB3 SER 8 HB3 SER 8 -9.524 -5.050 4.509
59 HG SER 8 HG SER 8 -9.409 -2.544 3.368
60 H TYR 9 H TYR 9 -6.039 -3.677 3.079
61 HA TYR 9 HA TYR 9 -4.955 -5.287 5.300
62 HB2 TYR 9 HB2 TYR 9 -3.367 -3.812 3.185
63 HB3 TYR 9 HB3 TYR 9 -2.692 -4.675 4.556
64 HD1 TYR 9 HD2 TYR 9 -4.423 -7.133 4.468
65 HD2 TYR 9 HD1 TYR 9 -2.432 -4.971 1.403
66 HE1 TYR 9 HE2 TYR 9 -4.313 -9.175 3.109
67 HE2 TYR 9 HE1 TYR 9 -2.328 -7.004 0.025
68 HH TYR 9 HH TYR 9 -3.883 -10.004 1.078
69 H GLN 10 H GLN 10 -3.785 -4.169 6.885
70 HA GLN 10 HA GLN 10 -4.310 -1.278 6.968
71 HB2 GLN 10 HB2 GLN 10 -5.250 -2.331 8.889
72 HB3 GLN 10 HB3 GLN 10 -3.804 -3.297 9.150
73 HG2 GLN 10 HG2 GLN 10 -2.569 -1.425 9.883
74 HG3 GLN 10 HG3 GLN 10 -3.812 -0.309 9.334
75 HE21 GLN 10 HE22 GLN 10 -5.985 -1.955 10.357
76 HE22 GLN 10 HE21 GLN 10 -5.978 -1.764 12.076
77 H ALA 11 H ALA 11 -2.642 0.125 7.183
78 HA ALA 11 HA ALA 11 -0.087 -0.818 6.313
79 HB1 ALA 11 HB1 ALA 11 0.541 1.576 6.450
80 HB2 ALA 11 HB2 ALA 11 -1.054 1.899 7.137
81 HB3 ALA 11 HB3 ALA 11 -0.912 1.275 5.495
82 H LEU 12 H LEU 12 1.635 -1.269 7.428
83 HA LEU 12 HA LEU 12 1.650 -1.154 10.323
84 HB2 LEU 12 HB2 LEU 12 3.625 -2.147 8.273
85 HB3 LEU 12 HB3 LEU 12 3.919 -2.209 9.997
86 HG LEU 12 HG LEU 12 1.391 -3.439 9.268
87 HD11 LEU 12 HD11 LEU 12 3.931 -4.483 8.044
88 HD12 LEU 12 HD12 LEU 12 2.442 -4.008 7.217
89 HD13 LEU 12 HD13 LEU 12 2.463 -5.440 8.247
90 HD21 LEU 12 HD21 LEU 12 3.866 -4.440 10.670
91 HD22 LEU 12 HD22 LEU 12 2.289 -5.234 10.656
92 HD23 LEU 12 HD23 LEU 12 2.481 -3.665 11.441
93 H TYR 13 H TYR 13 2.947 0.626 7.652
94 HA TYR 13 HA TYR 13 4.474 2.352 9.474
95 HB2 TYR 13 HB2 TYR 13 5.528 1.377 6.804
96 HB3 TYR 13 HB3 TYR 13 6.358 2.427 7.939
97 HD1 TYR 13 HD1 TYR 13 5.297 -1.023 7.261
98 HD2 TYR 13 HD2 TYR 13 7.533 1.525 9.827
99 HE1 TYR 13 HE1 TYR 13 6.424 -2.985 8.214
100 HE2 TYR 13 HE2 TYR 13 8.661 -0.433 10.795
101 HH TYR 13 HH TYR 13 8.442 -2.768 11.027
102 H SER 14 H SER 14 5.166 4.375 8.346
103 HA SER 14 HA SER 14 3.185 5.240 6.370
104 HB2 SER 14 HB2 SER 14 4.217 7.523 6.846
105 HB3 SER 14 HB3 SER 14 3.362 6.773 8.196
106 HG SER 14 HG SER 14 6.159 6.513 7.805
107 H TYR 15 H TYR 15 3.756 5.169 4.295
108 HA TYR 15 HA TYR 15 6.640 5.109 3.652
109 HB2 TYR 15 HB2 TYR 15 5.731 2.946 3.197
110 HB3 TYR 15 HB3 TYR 15 4.335 3.634 2.392
111 HD1 TYR 15 HD2 TYR 15 7.996 3.111 2.053
112 HD2 TYR 15 HD1 TYR 15 4.350 4.083 0.108
113 HE1 TYR 15 HE2 TYR 15 9.098 2.856 -0.137
114 HE2 TYR 15 HE1 TYR 15 5.428 3.818 -2.079
115 HH TYR 15 HH TYR 15 7.431 3.668 -3.135
116 H ILE 16 H ILE 16 7.395 6.305 2.037
117 HA ILE 16 HA ILE 16 5.589 8.324 0.929
118 HB ILE 16 HB ILE 16 8.600 8.316 1.186
119 HG12 ILE 16 HG12 ILE 16 7.478 8.665 3.318
120 HG13 ILE 16 HG13 ILE 16 8.226 10.166 2.781
121 HG21 ILE 16 HG21 ILE 16 6.797 10.490 0.124
122 HG22 ILE 16 HG22 ILE 16 7.880 9.494 -0.842
123 HG23 ILE 16 HG23 ILE 16 8.541 10.608 0.352
124 HD11 ILE 16 HD11 ILE 16 6.048 10.967 2.012
125 HD12 ILE 16 HD12 ILE 16 6.032 10.570 3.730
126 HD13 ILE 16 HD13 ILE 16 5.307 9.465 2.564
127 HA PRO 17 HA PRO 17 5.794 5.640 -2.678
128 HB2 PRO 17 HB3 PRO 17 4.266 7.948 -3.775
129 HB3 PRO 17 HB2 PRO 17 3.888 6.221 -3.822
130 HG2 PRO 17 HG2 PRO 17 2.580 7.818 -2.167
131 HG3 PRO 17 HG3 PRO 17 3.096 6.204 -1.630
132 HD2 PRO 17 HD2 PRO 17 4.315 8.879 -1.049
133 HD3 PRO 17 HD3 PRO 17 4.062 7.495 0.035
134 H GLN 18 H GLN 18 6.967 5.577 -4.504
135 HA GLN 18 HA GLN 18 8.968 7.621 -4.865
136 HB2 GLN 18 HB2 GLN 18 8.416 5.158 -6.533
137 HB3 GLN 18 HB3 GLN 18 9.885 6.123 -6.548
138 HG2 GLN 18 HG2 GLN 18 8.887 4.603 -4.151
139 HG3 GLN 18 HG3 GLN 18 10.063 3.982 -5.303
140 HE21 GLN 18 HE22 GLN 18 11.655 3.788 -3.764
141 HE22 GLN 18 HE21 GLN 18 12.464 5.155 -3.072
142 H ASN 19 H ASN 19 5.911 6.878 -6.127
143 HA ASN 19 HA ASN 19 6.108 9.051 -8.051
144 HB2 ASN 19 HB2 ASN 19 4.822 7.575 -9.722
145 HB3 ASN 19 HB3 ASN 19 6.539 7.317 -9.554
146 HD21 ASN 19 HD22 ASN 19 7.310 5.453 -8.627
147 HD22 ASN 19 HD21 ASN 19 6.307 4.072 -8.345
148 H ASP 20 H ASP 20 3.999 9.716 -8.867
149 HA ASP 20 HA ASP 20 2.046 9.767 -6.767
150 HB2 ASP 20 HB2 ASP 20 0.756 11.208 -8.252
151 HB3 ASP 20 HB3 ASP 20 2.440 11.717 -8.241
152 H ASP 21 H ASP 21 2.752 7.624 -9.214
153 HA ASP 21 HA ASP 21 0.066 6.628 -9.586
154 HB2 ASP 21 HB2 ASP 21 1.839 6.524 -11.373
155 HB3 ASP 21 HB3 ASP 21 2.678 5.330 -10.387
156 H GLU 22 H GLU 22 2.659 6.254 -7.385
157 HA GLU 22 HA GLU 22 1.596 3.767 -6.300
158 HB2 GLU 22 HB2 GLU 22 3.878 5.557 -5.547
159 HB3 GLU 22 HB3 GLU 22 3.289 4.361 -4.413
160 HG2 GLU 22 HG2 GLU 22 3.842 2.578 -5.864
161 HG3 GLU 22 HG3 GLU 22 4.179 3.680 -7.197
162 H LEU 23 H LEU 23 1.099 3.649 -3.994
163 HA LEU 23 HA LEU 23 -0.833 5.772 -3.385
164 HB2 LEU 23 HB2 LEU 23 -1.439 3.262 -3.736
165 HB3 LEU 23 HB3 LEU 23 -0.784 3.038 -2.129
166 HG LEU 23 HG LEU 23 -3.310 3.295 -2.322
167 HD11 LEU 23 HD11 LEU 23 -3.483 4.630 -0.295
168 HD12 LEU 23 HD12 LEU 23 -1.825 5.191 -0.515
169 HD13 LEU 23 HD13 LEU 23 -2.145 3.484 -0.197
170 HD21 LEU 23 HD21 LEU 23 -3.311 5.101 -3.945
171 HD22 LEU 23 HD22 LEU 23 -2.516 6.161 -2.783
172 HD23 LEU 23 HD23 LEU 23 -4.157 5.585 -2.472
173 H GLU 24 H GLU 24 -0.802 6.854 -1.494
174 HA GLU 24 HA GLU 24 1.629 6.780 0.016
175 HB2 GLU 24 HB2 GLU 24 -0.624 8.579 -0.297
176 HB3 GLU 24 HB3 GLU 24 -0.145 8.416 1.390
177 HG2 GLU 24 HG2 GLU 24 2.169 8.936 0.740
178 HG3 GLU 24 HG3 GLU 24 1.615 9.200 -0.915
179 H LEU 25 H LEU 25 1.997 5.383 1.520
180 HA LEU 25 HA LEU 25 -0.227 4.222 3.016
181 HB2 LEU 25 HB2 LEU 25 2.682 3.451 3.070
182 HB3 LEU 25 HB3 LEU 25 1.352 2.560 3.777
183 HG LEU 25 HG LEU 25 1.667 3.036 0.818
184 HD11 LEU 25 HD11 LEU 25 2.366 0.630 2.487
185 HD12 LEU 25 HD12 LEU 25 3.484 1.666 1.596
186 HD13 LEU 25 HD13 LEU 25 2.321 0.666 0.722
187 HD21 LEU 25 HD21 LEU 25 -0.011 1.192 0.700
188 HD22 LEU 25 HD22 LEU 25 -0.623 2.686 1.414
189 HD23 LEU 25 HD23 LEU 25 -0.199 1.325 2.448
190 H ARG 26 H ARG 26 -0.513 4.603 5.127
191 HA ARG 26 HA ARG 26 1.519 6.152 6.551
192 HB2 ARG 26 HB2 ARG 26 -1.445 6.787 6.428
193 HB3 ARG 26 HB3 ARG 26 -0.303 7.552 7.530
194 HG2 ARG 26 HG2 ARG 26 0.868 8.581 5.751
195 HG3 ARG 26 HG3 ARG 26 0.023 7.609 4.544
196 HD2 ARG 26 HD2 ARG 26 -2.097 8.715 5.298
197 HD3 ARG 26 HD3 ARG 26 -1.102 9.806 6.265
198 HE ARG 26 HE ARG 26 -0.025 9.965 3.765
199 HH11 ARG 26 HH11 ARG 26 -3.216 10.513 5.093
200 HH12 ARG 26 HH12 ARG 26 -3.675 11.638 3.858
201 HH21 ARG 26 HH22 ARG 26 -0.608 11.432 2.144
202 HH22 ARG 26 HH21 ARG 26 -2.199 12.154 2.160
203 H ASP 27 H ASP 27 1.682 5.694 8.698
204 HA ASP 27 HA ASP 27 1.183 3.094 9.478
205 HB2 ASP 27 HB2 ASP 27 2.910 4.292 10.571
206 HB3 ASP 27 HB3 ASP 27 1.811 5.555 11.096
207 H GLY 28 H GLY 28 -0.736 2.186 9.611
208 HA2 GLY 28 HA2 GLY 28 -2.574 1.651 11.009
209 HA3 GLY 28 HA3 GLY 28 -2.675 3.336 11.493
210 H ASP 29 H ASP 29 -2.275 3.561 8.286
211 HA ASP 29 HA ASP 29 -5.084 4.013 7.797
212 HB2 ASP 29 HB2 ASP 29 -2.968 5.255 6.813
213 HB3 ASP 29 HB3 ASP 29 -3.036 3.975 5.608
214 H ILE 30 H ILE 30 -6.342 2.916 6.182
215 HA ILE 30 HA ILE 30 -5.477 0.131 5.819
216 HB ILE 30 HB ILE 30 -8.246 1.314 6.017
217 HG12 ILE 30 HG12 ILE 30 -8.316 -0.583 7.790
218 HG13 ILE 30 HG13 ILE 30 -6.565 -0.525 7.671
219 HG21 ILE 30 HG21 ILE 30 -7.516 -1.532 5.341
220 HG22 ILE 30 HG22 ILE 30 -8.253 -0.377 4.235
221 HG23 ILE 30 HG23 ILE 30 -9.140 -0.928 5.655
222 HD11 ILE 30 HD11 ILE 30 -7.349 0.794 9.536
223 HD12 ILE 30 HD12 ILE 30 -8.375 1.744 8.463
224 HD13 ILE 30 HD13 ILE 30 -6.623 1.834 8.315
225 H VAL 31 H VAL 31 -5.440 -0.787 3.862
226 HA VAL 31 HA VAL 31 -6.400 0.793 1.570
227 HB VAL 31 HB VAL 31 -3.708 -0.552 1.803
228 HG11 VAL 31 HG11 VAL 31 -3.387 -0.048 -0.581
229 HG12 VAL 31 HG12 VAL 31 -5.069 0.469 -0.691
230 HG13 VAL 31 HG13 VAL 31 -4.685 -1.212 -0.331
231 HG21 VAL 31 HG21 VAL 31 -2.861 1.625 1.172
232 HG22 VAL 31 HG22 VAL 31 -3.911 1.781 2.579
233 HG23 VAL 31 HG23 VAL 31 -4.507 2.232 0.978
234 H ASP 32 H ASP 32 -7.736 -0.290 0.316
235 HA ASP 32 HA ASP 32 -8.026 -3.168 0.608
236 HB2 ASP 32 HB2 ASP 32 -9.531 -1.259 -1.184
237 HB3 ASP 32 HB3 ASP 32 -9.977 -2.923 -0.832
238 H VAL 33 H VAL 33 -6.880 -4.509 -0.613
239 HA VAL 33 HA VAL 33 -5.609 -3.506 -3.039
240 HB VAL 33 HB VAL 33 -4.125 -4.681 -1.567
241 HG11 VAL 33 HG11 VAL 33 -6.218 -6.816 -1.549
242 HG12 VAL 33 HG12 VAL 33 -5.429 -6.003 -0.188
243 HG13 VAL 33 HG13 VAL 33 -4.536 -7.174 -1.157
244 HG21 VAL 33 HG21 VAL 33 -4.793 -6.525 -3.855
245 HG22 VAL 33 HG22 VAL 33 -3.250 -6.411 -3.014
246 HG23 VAL 33 HG23 VAL 33 -3.827 -5.055 -3.987
247 H MET 34 H MET 34 -6.199 -4.012 -5.019
248 HA MET 34 HA MET 34 -8.444 -5.872 -5.354
249 HB2 MET 34 HB2 MET 34 -8.954 -4.696 -7.413
250 HB3 MET 34 HB3 MET 34 -8.831 -3.553 -6.080
251 HG2 MET 34 HG2 MET 34 -6.846 -2.658 -6.850
252 HG3 MET 34 HG3 MET 34 -6.462 -4.083 -7.809
253 HE1 MET 34 HE1 MET 34 -8.531 -3.747 -10.982
254 HE2 MET 34 HE2 MET 34 -8.976 -4.698 -9.561
255 HE3 MET 34 HE3 MET 34 -7.289 -4.623 -10.082
256 H GLU 35 H GLU 35 -5.210 -5.098 -6.534
257 HA GLU 35 HA GLU 35 -5.222 -7.649 -7.992
258 HB2 GLU 35 HB2 GLU 35 -5.481 -5.775 -9.579
259 HB3 GLU 35 HB3 GLU 35 -3.974 -5.087 -8.981
260 HG2 GLU 35 HG2 GLU 35 -3.540 -6.253 -11.029
261 HG3 GLU 35 HG3 GLU 35 -2.807 -7.134 -9.691
262 H LYS 36 H LYS 36 -3.281 -8.745 -8.077
263 HA LYS 36 HA LYS 36 -1.326 -7.860 -6.058
264 HB2 LYS 36 HB2 LYS 36 -2.414 -10.610 -6.623
265 HB3 LYS 36 HB3 LYS 36 -0.946 -10.351 -5.696
266 HG2 LYS 36 HG2 LYS 36 -2.203 -9.061 -4.054
267 HG3 LYS 36 HG3 LYS 36 -3.679 -9.310 -4.991
268 HD2 LYS 36 HD2 LYS 36 -3.622 -11.657 -4.600
269 HD3 LYS 36 HD3 LYS 36 -1.999 -11.565 -3.912
270 HE2 LYS 36 HE2 LYS 36 -4.475 -10.306 -2.739
271 HE3 LYS 36 HE3 LYS 36 -3.732 -11.806 -2.184
272 HZ1 LYS 36 HZ1 LYS 36 -2.307 -9.214 -2.252
273 HZ2 LYS 36 HZ2 LYS 36 -1.798 -10.647 -1.506
274 HZ3 LYS 36 HZ3 LYS 36 -3.119 -9.787 -0.885
275 H CYS 37 H CYS 37 0.604 -7.445 -6.906
276 HA CYS 37 HA CYS 37 1.526 -8.869 -9.268
277 HB2 CYS 37 HB2 CYS 37 3.098 -6.959 -7.529
278 HB3 CYS 37 HB3 CYS 37 3.442 -7.430 -9.191
279 HG CYS 37 HG CYS 37 2.606 -4.879 -9.508
280 H ASP 38 H ASP 38 2.951 -10.552 -9.208
281 HA ASP 38 HA ASP 38 3.252 -11.963 -6.760
282 HB2 ASP 38 HB2 ASP 38 4.315 -13.650 -8.014
283 HB3 ASP 38 HB3 ASP 38 3.167 -12.932 -9.138
284 H ASP 39 H ASP 39 4.914 -9.365 -8.046
285 HA ASP 39 HA ASP 39 7.518 -9.997 -7.009
286 HB2 ASP 39 HB2 ASP 39 7.133 -8.483 -8.965
287 HB3 ASP 39 HB3 ASP 39 6.424 -7.308 -7.862
288 H GLY 40 H GLY 40 4.584 -8.834 -5.670
289 HA2 GLY 40 HA2 GLY 40 4.615 -9.176 -3.221
290 HA3 GLY 40 HA3 GLY 40 6.125 -8.281 -3.202
291 H TRP 41 H TRP 41 5.160 -6.303 -5.136
292 HA TRP 41 HA TRP 41 3.701 -4.638 -3.285
293 HB2 TRP 41 HB2 TRP 41 4.345 -3.949 -6.150
294 HB3 TRP 41 HB3 TRP 41 4.067 -2.852 -4.804
295 HD1 TRP 41 HD1 TRP 41 6.696 -3.143 -6.813
296 HE1 TRP 41 HE1 TRP 41 9.018 -3.204 -5.709
297 HE3 TRP 41 HE3 TRP 41 5.337 -4.531 -2.048
298 HZ2 TRP 41 HZ2 TRP 41 10.124 -3.769 -3.200
299 HZ3 TRP 41 HZ3 TRP 41 7.111 -4.811 -0.378
300 HH2 TRP 41 HH2 TRP 41 9.453 -4.438 -0.940
301 H PHE 42 H PHE 42 1.596 -3.770 -3.715
302 HA PHE 42 HA PHE 42 0.023 -5.501 -5.492
303 HB2 PHE 42 HB2 PHE 42 -0.696 -4.575 -2.705
304 HB3 PHE 42 HB3 PHE 42 -1.724 -5.518 -3.770
305 HD1 PHE 42 HD1 PHE 42 0.337 -7.430 -4.843
306 HD2 PHE 42 HD2 PHE 42 -0.429 -6.024 -0.897
307 HE1 PHE 42 HE1 PHE 42 1.280 -9.506 -3.924
308 HE2 PHE 42 HE2 PHE 42 0.522 -8.095 0.027
309 HZ PHE 42 HZ PHE 42 1.378 -9.839 -1.486
310 H VAL 43 H VAL 43 -2.192 -4.575 -5.918
311 HA VAL 43 HA VAL 43 -2.016 -1.645 -6.170
312 HB VAL 43 HB VAL 43 -3.225 -3.728 -7.954
313 HG11 VAL 43 HG11 VAL 43 -4.094 -0.835 -7.922
314 HG12 VAL 43 HG12 VAL 43 -5.095 -2.189 -7.399
315 HG13 VAL 43 HG13 VAL 43 -4.587 -2.066 -9.085
316 HG21 VAL 43 HG21 VAL 43 -2.181 -2.339 -9.655
317 HG22 VAL 43 HG22 VAL 43 -1.016 -2.754 -8.390
318 HG23 VAL 43 HG23 VAL 43 -1.769 -1.155 -8.412
319 H GLY 44 H GLY 44 -3.509 -0.409 -5.225
320 HA2 GLY 44 HA2 GLY 44 -5.944 -1.563 -4.121
321 HA3 GLY 44 HA3 GLY 44 -4.707 -1.169 -2.937
322 H THR 45 H THR 45 -6.748 0.120 -2.338
323 HA THR 45 HA THR 45 -6.330 2.846 -3.335
324 HB THR 45 HB THR 45 -8.981 1.537 -2.751
325 HG1 THR 45 HG1 THR 45 -7.536 2.055 -5.029
326 HG21 THR 45 HG21 THR 45 -9.942 3.734 -3.498
327 HG22 THR 45 HG22 THR 45 -8.316 4.408 -3.373
328 HG23 THR 45 HG23 THR 45 -9.122 3.782 -1.937
329 H SER 46 H SER 46 -6.357 4.404 -1.779
330 HA SER 46 HA SER 46 -5.900 3.530 0.911
331 HB2 SER 46 HB2 SER 46 -4.618 5.396 -0.013
332 HB3 SER 46 HB3 SER 46 -6.104 6.310 -0.272
333 HG SER 46 HG SER 46 -4.765 5.713 2.123
334 H ARG 47 H ARG 47 -7.324 3.448 2.535
335 HA ARG 47 HA ARG 47 -10.098 3.875 2.078
336 HB2 ARG 47 HB2 ARG 47 -9.324 2.156 3.590
337 HB3 ARG 47 HB3 ARG 47 -8.504 3.346 4.588
338 HG2 ARG 47 HG2 ARG 47 -10.829 4.351 4.949
339 HG3 ARG 47 HG3 ARG 47 -11.427 2.811 4.320
340 HD2 ARG 47 HD2 ARG 47 -10.203 1.606 6.026
341 HD3 ARG 47 HD3 ARG 47 -9.510 3.114 6.616
342 HE ARG 47 HE ARG 47 -12.346 2.362 6.819
343 HH11 ARG 47 HH11 ARG 47 -9.583 4.234 7.869
344 HH12 ARG 47 HH12 ARG 47 -10.385 4.851 9.287
345 HH21 ARG 47 HH22 ARG 47 -13.407 3.177 8.682
346 HH22 ARG 47 HH21 ARG 47 -12.555 4.271 9.734
347 H ARG 48 H ARG 48 -7.534 5.824 3.430
348 HA ARG 48 HA ARG 48 -9.351 7.643 4.750
349 HB2 ARG 48 HB2 ARG 48 -7.128 7.105 5.688
350 HB3 ARG 48 HB3 ARG 48 -6.371 7.855 4.298
351 HG2 ARG 48 HG2 ARG 48 -7.314 10.006 4.912
352 HG3 ARG 48 HG3 ARG 48 -8.123 9.263 6.295
353 HD2 ARG 48 HD2 ARG 48 -6.084 8.793 7.366
354 HD3 ARG 48 HD3 ARG 48 -5.159 9.094 5.896
355 HE ARG 48 HE ARG 48 -6.622 11.386 6.850
356 HH11 ARG 48 HH11 ARG 48 -3.661 9.543 7.247
357 HH12 ARG 48 HH12 ARG 48 -2.707 10.935 7.696
358 HH21 ARG 48 HH22 ARG 48 -5.365 13.215 7.415
359 HH22 ARG 48 HH21 ARG 48 -3.668 13.019 7.760
360 H THR 49 H THR 49 -7.140 7.804 1.968
361 HA THR 49 HA THR 49 -8.344 10.399 1.315
362 HB THR 49 HB THR 49 -6.107 10.843 1.636
363 HG1 THR 49 HG1 THR 49 -6.604 10.384 -1.104
364 HG21 THR 49 HG21 THR 49 -4.253 9.453 0.878
365 HG22 THR 49 HG22 THR 49 -5.399 8.315 0.170
366 HG23 THR 49 HG23 THR 49 -5.360 8.551 1.918
367 H LYS 50 H LYS 50 -8.428 7.227 0.371
368 HA LYS 50 HA LYS 50 -9.517 6.163 -1.281
369 HB2 LYS 50 HB2 LYS 50 -10.751 8.854 -1.837
370 HB3 LYS 50 HB3 LYS 50 -11.366 7.304 -2.381
371 HG2 LYS 50 HG2 LYS 50 -11.311 8.426 0.395
372 HG3 LYS 50 HG3 LYS 50 -12.696 7.889 -0.550
373 HD2 LYS 50 HD2 LYS 50 -10.562 6.178 0.723
374 HD3 LYS 50 HD3 LYS 50 -12.267 6.268 1.158
375 HE2 LYS 50 HE2 LYS 50 -11.136 5.205 -1.422
376 HE3 LYS 50 HE3 LYS 50 -11.779 4.240 -0.096
377 HZ1 LYS 50 HZ1 LYS 50 -13.944 5.234 -0.450
378 HZ2 LYS 50 HZ2 LYS 50 -13.393 4.487 -1.870
379 HZ3 LYS 50 HZ3 LYS 50 -13.339 6.175 -1.727
380 H GLN 51 H GLN 51 -6.942 7.088 -1.946
381 HA GLN 51 HA GLN 51 -7.217 7.762 -4.776
382 HB2 GLN 51 HB2 GLN 51 -4.565 7.762 -4.455
383 HB3 GLN 51 HB3 GLN 51 -5.564 9.166 -4.109
384 HG2 GLN 51 HG2 GLN 51 -5.587 8.544 -1.744
385 HG3 GLN 51 HG3 GLN 51 -4.548 7.168 -2.112
386 HE21 GLN 51 HE22 GLN 51 -4.275 10.296 -3.654
387 HE22 GLN 51 HE21 GLN 51 -2.758 10.727 -2.945
388 H PHE 52 H PHE 52 -6.047 6.533 -6.355
389 HA PHE 52 HA PHE 52 -5.902 3.694 -5.571
390 HB2 PHE 52 HB2 PHE 52 -7.915 3.987 -6.798
391 HB3 PHE 52 HB3 PHE 52 -7.123 4.989 -8.003
392 HD1 PHE 52 HD2 PHE 52 -6.848 1.521 -6.611
393 HD2 PHE 52 HD1 PHE 52 -6.695 4.054 -10.030
394 HE1 PHE 52 HE2 PHE 52 -6.540 -0.446 -8.050
395 HE2 PHE 52 HE1 PHE 52 -6.384 2.089 -11.475
396 HZ PHE 52 HZ PHE 52 -6.305 -0.163 -10.485
397 H GLY 53 H GLY 53 -4.260 2.480 -6.325
398 HA2 GLY 53 HA2 GLY 53 -2.766 2.810 -8.609
399 HA3 GLY 53 HA3 GLY 53 -1.939 3.767 -7.385
400 H THR 54 H THR 54 -0.150 2.448 -7.422
401 HA THR 54 HA THR 54 -0.542 -0.278 -6.397
402 HB THR 54 HB THR 54 0.711 -0.352 -8.403
403 HG1 THR 54 HG1 THR 54 1.931 -0.919 -6.055
404 HG21 THR 54 HG21 THR 54 2.931 1.011 -8.468
405 HG22 THR 54 HG22 THR 54 2.114 2.025 -7.275
406 HG23 THR 54 HG23 THR 54 1.404 1.797 -8.877
407 H PHE 55 H PHE 55 0.384 -0.906 -4.522
408 HA PHE 55 HA PHE 55 2.090 1.004 -3.113
409 HB2 PHE 55 HB2 PHE 55 0.856 0.808 -1.055
410 HB3 PHE 55 HB3 PHE 55 -0.271 1.290 -2.314
411 HD1 PHE 55 HD1 PHE 55 -1.659 -0.565 -3.410
412 HD2 PHE 55 HD2 PHE 55 0.410 -1.050 0.274
413 HE1 PHE 55 HE1 PHE 55 -3.106 -2.476 -2.849
414 HE2 PHE 55 HE2 PHE 55 -1.033 -2.962 0.839
415 HZ PHE 55 HZ PHE 55 -2.792 -3.679 -0.725
416 HA PRO 56 HA PRO 56 4.427 -2.682 -2.298
417 HB2 PRO 56 HB3 PRO 56 5.411 -1.173 0.041
418 HB3 PRO 56 HB2 PRO 56 6.310 -1.875 -1.308
419 HG2 PRO 56 HG2 PRO 56 5.967 0.773 -1.083
420 HG3 PRO 56 HG3 PRO 56 5.980 -0.029 -2.664
421 HD2 PRO 56 HD2 PRO 56 3.653 0.961 -1.058
422 HD3 PRO 56 HD3 PRO 56 3.917 1.019 -2.812
423 H GLY 57 H GLY 57 3.128 -4.275 -1.528
424 HA2 GLY 57 HA2 GLY 57 1.578 -3.981 0.874
425 HA3 GLY 57 HA3 GLY 57 1.716 -5.443 -0.089
426 H ASN 58 H ASN 58 4.519 -3.797 1.011
427 HA ASN 58 HA ASN 58 5.195 -5.979 2.832
428 HB2 ASN 58 HB2 ASN 58 6.750 -5.157 0.971
429 HB3 ASN 58 HB3 ASN 58 6.946 -3.685 1.921
430 HD21 ASN 58 HD22 ASN 58 8.177 -3.735 3.788
431 HD22 ASN 58 HD21 ASN 58 9.150 -5.092 4.232
432 H TYR 59 H TYR 59 3.791 -2.982 2.826
433 HA TYR 59 HA TYR 59 4.624 -2.396 5.597
434 HB2 TYR 59 HB2 TYR 59 3.539 -0.450 3.546
435 HB3 TYR 59 HB3 TYR 59 4.085 -0.056 5.168
436 HD1 TYR 59 HD2 TYR 59 6.566 -0.442 5.701
437 HD2 TYR 59 HD1 TYR 59 5.008 -0.400 1.745
438 HE1 TYR 59 HE2 TYR 59 8.819 0.003 4.826
439 HE2 TYR 59 HE1 TYR 59 7.252 0.047 0.858
440 HH TYR 59 HH TYR 59 9.392 1.024 1.654
441 H VAL 60 H VAL 60 2.429 -4.145 4.516
442 HA VAL 60 HA VAL 60 0.265 -2.912 6.029
443 HB VAL 60 HB VAL 60 -1.423 -3.590 4.308
444 HG11 VAL 60 HG11 VAL 60 0.594 -1.614 3.247
445 HG12 VAL 60 HG12 VAL 60 -0.550 -1.249 4.540
446 HG13 VAL 60 HG13 VAL 60 -1.141 -1.653 2.920
447 HG21 VAL 60 HG21 VAL 60 1.047 -4.089 2.662
448 HG22 VAL 60 HG22 VAL 60 -0.565 -3.883 1.976
449 HG23 VAL 60 HG23 VAL 60 -0.237 -5.226 3.068
450 H LYS 61 H LYS 61 -1.356 -4.416 6.691
451 HA LYS 61 HA LYS 61 -0.342 -7.178 6.894
452 HB2 LYS 61 HB2 LYS 61 -1.749 -6.890 9.203
453 HB3 LYS 61 HB3 LYS 61 -0.011 -6.678 9.068
454 HG2 LYS 61 HG2 LYS 61 -0.195 -4.338 9.009
455 HG3 LYS 61 HG3 LYS 61 -1.933 -4.394 8.726
456 HD2 LYS 61 HD2 LYS 61 -1.453 -3.725 10.995
457 HD3 LYS 61 HD3 LYS 61 -2.259 -5.292 10.991
458 HE2 LYS 61 HE2 LYS 61 0.726 -4.947 11.208
459 HE3 LYS 61 HE3 LYS 61 -0.340 -5.006 12.607
460 HZ1 LYS 61 HZ1 LYS 61 0.353 -7.168 12.415
461 HZ2 LYS 61 HZ2 LYS 61 0.363 -7.149 10.718
462 HZ3 LYS 61 HZ3 LYS 61 -1.111 -7.222 11.556
463 HA PRO 62 HA PRO 62 -4.216 -8.471 5.264
464 HB2 PRO 62 HB3 PRO 62 -3.783 -10.933 6.826
465 HB3 PRO 62 HB2 PRO 62 -3.970 -10.727 5.086
466 HG2 PRO 62 HG2 PRO 62 -1.594 -11.309 6.161
467 HG3 PRO 62 HG3 PRO 62 -1.737 -10.216 4.773
468 HD2 PRO 62 HD2 PRO 62 -1.306 -9.561 7.660
469 HD3 PRO 62 HD3 PRO 62 -0.577 -8.831 6.214
470 H LEU 63 H LEU 63 -6.053 -7.676 6.019
471 HA LEU 63 HA LEU 63 -6.772 -8.049 8.831
472 HB2 LEU 63 HB2 LEU 63 -8.037 -6.355 6.673
473 HB3 LEU 63 HB3 LEU 63 -8.541 -6.394 8.348
474 HG LEU 63 HG LEU 63 -5.859 -5.428 7.362
475 HD11 LEU 63 HD11 LEU 63 -8.149 -3.833 8.490
476 HD12 LEU 63 HD12 LEU 63 -7.859 -4.038 6.764
477 HD13 LEU 63 HD13 LEU 63 -6.657 -3.223 7.771
478 HD21 LEU 63 HD21 LEU 63 -7.105 -5.403 10.112
479 HD22 LEU 63 HD22 LEU 63 -5.595 -4.606 9.669
480 HD23 LEU 63 HD23 LEU 63 -5.716 -6.365 9.603
481 H TYR 64 H TYR 64 -9.461 -7.882 8.698
482 HA TYR 64 HA TYR 64 -10.357 -10.150 7.066
483 HB2 TYR 64 HB2 TYR 64 -10.840 -9.697 10.015
484 HB3 TYR 64 HB3 TYR 64 -11.860 -10.753 9.046
485 HD1 TYR 64 HD1 TYR 64 -8.496 -10.311 10.474
486 HD2 TYR 64 HD2 TYR 64 -11.088 -12.906 8.317
487 HE1 TYR 64 HE1 TYR 64 -6.921 -12.169 10.830
488 HE2 TYR 64 HE2 TYR 64 -9.523 -14.768 8.667
489 HH TYR 64 HH TYR 64 -7.268 -15.201 9.183
490 H LEU 65 H LEU 65 -12.843 -10.200 7.037
491 HA LEU 65 HA LEU 65 -14.030 -7.559 7.189
492 HB2 LEU 65 HB2 LEU 65 -14.787 -7.749 4.764
493 HB3 LEU 65 HB3 LEU 65 -13.127 -7.274 5.060
494 HG LEU 65 HG LEU 65 -12.759 -9.914 4.776
495 HD11 LEU 65 HD11 LEU 65 -15.080 -9.300 2.956
496 HD12 LEU 65 HD12 LEU 65 -15.144 -10.348 4.375
497 HD13 LEU 65 HD13 LEU 65 -14.134 -10.791 2.997
498 HD21 LEU 65 HD21 LEU 65 -11.588 -8.158 3.565
499 HD22 LEU 65 HD22 LEU 65 -12.992 -7.924 2.524
500 HD23 LEU 65 HD23 LEU 65 -12.100 -9.444 2.472
Start of MODEL 2
1 H1 GLN 1 H1 GLN 1 -20.619 -2.845 -9.061
2 H2 GLN 1 H2 GLN 1 -20.587 -1.249 -8.485
3 H3 GLN 1 H3 GLN 1 -21.733 -2.346 -7.880
4 HA GLN 1 HA GLN 1 -19.966 -2.001 -6.302
5 HB2 GLN 1 HB2 GLN 1 -21.050 -4.183 -6.341
6 HB3 GLN 1 HB3 GLN 1 -19.962 -4.729 -7.612
7 HG2 GLN 1 HG2 GLN 1 -18.066 -4.465 -6.061
8 HG3 GLN 1 HG3 GLN 1 -19.197 -4.007 -4.788
9 HE21 GLN 1 HE22 GLN 1 -17.329 -6.244 -4.946
10 HE22 GLN 1 HE21 GLN 1 -18.287 -7.679 -4.766
11 H THR 2 H THR 2 -18.078 -0.987 -6.334
12 HA THR 2 HA THR 2 -15.951 -2.005 -8.086
13 HB THR 2 HB THR 2 -15.774 0.490 -6.391
14 HG1 THR 2 HG1 THR 2 -17.463 0.059 -8.441
15 HG21 THR 2 HG21 THR 2 -14.203 1.202 -8.143
16 HG22 THR 2 HG22 THR 2 -14.467 -0.320 -8.995
17 HG23 THR 2 HG23 THR 2 -13.697 -0.320 -7.409
18 H SER 3 H SER 3 -13.696 -1.535 -6.645
19 HA SER 3 HA SER 3 -13.509 -3.631 -4.871
20 HB2 SER 3 HB2 SER 3 -11.834 -1.114 -4.837
21 HB3 SER 3 HB3 SER 3 -11.367 -2.699 -4.220
22 HG SER 3 HG SER 3 -10.506 -2.346 -6.281
23 H GLN 4 H GLN 4 -14.715 -3.883 -3.106
24 HA GLN 4 HA GLN 4 -15.038 -1.615 -1.265
25 HB2 GLN 4 HB2 GLN 4 -17.161 -2.520 -1.821
26 HB3 GLN 4 HB3 GLN 4 -16.588 -4.173 -1.651
27 HG2 GLN 4 HG2 GLN 4 -16.362 -3.834 0.760
28 HG3 GLN 4 HG3 GLN 4 -17.007 -2.198 0.582
29 HE21 GLN 4 HE22 GLN 4 -19.191 -1.922 0.143
30 HE22 GLN 4 HE21 GLN 4 -20.342 -3.205 0.337
31 H ASP 5 H ASP 5 -15.251 -5.003 -0.383
32 HA ASP 5 HA ASP 5 -12.682 -4.804 1.040
33 HB2 ASP 5 HB2 ASP 5 -15.306 -5.959 1.950
34 HB3 ASP 5 HB3 ASP 5 -13.788 -6.530 2.624
35 H LEU 6 H LEU 6 -12.079 -5.604 -1.165
36 HA LEU 6 HA LEU 6 -12.787 -8.339 -1.818
37 HB2 LEU 6 HB2 LEU 6 -12.437 -6.627 -3.573
38 HB3 LEU 6 HB3 LEU 6 -10.764 -6.472 -3.074
39 HG LEU 6 HG LEU 6 -10.390 -8.842 -3.719
40 HD11 LEU 6 HD11 LEU 6 -12.072 -9.973 -5.089
41 HD12 LEU 6 HD12 LEU 6 -13.196 -8.642 -4.810
42 HD13 LEU 6 HD13 LEU 6 -12.675 -9.653 -3.462
43 HD21 LEU 6 HD21 LEU 6 -11.484 -7.035 -5.871
44 HD22 LEU 6 HD22 LEU 6 -10.463 -8.446 -6.144
45 HD23 LEU 6 HD23 LEU 6 -9.829 -7.058 -5.262
46 H PHE 7 H PHE 7 -9.982 -6.500 -0.786
47 HA PHE 7 HA PHE 7 -9.089 -8.581 0.936
48 HB2 PHE 7 HB2 PHE 7 -8.202 -8.969 -1.612
49 HB3 PHE 7 HB3 PHE 7 -6.942 -7.903 -0.992
50 HD1 PHE 7 HD2 PHE 7 -6.193 -8.622 1.522
51 HD2 PHE 7 HD1 PHE 7 -7.768 -11.202 -1.474
52 HE1 PHE 7 HE2 PHE 7 -5.134 -10.548 2.625
53 HE2 PHE 7 HE1 PHE 7 -6.718 -13.129 -0.368
54 HZ PHE 7 HZ PHE 7 -5.398 -12.802 1.685
55 H SER 8 H SER 8 -8.623 -7.301 2.638
56 HA SER 8 HA SER 8 -7.488 -4.662 1.994
57 HB2 SER 8 HB2 SER 8 -9.841 -4.626 2.811
58 HB3 SER 8 HB3 SER 8 -9.290 -5.341 4.326
59 HG SER 8 HG SER 8 -8.221 -2.944 3.284
60 H TYR 9 H TYR 9 -5.830 -3.879 3.117
61 HA TYR 9 HA TYR 9 -4.837 -5.430 5.420
62 HB2 TYR 9 HB2 TYR 9 -3.110 -3.833 3.521
63 HB3 TYR 9 HB3 TYR 9 -2.562 -4.863 4.832
64 HD1 TYR 9 HD2 TYR 9 -4.050 -7.364 4.349
65 HD2 TYR 9 HD1 TYR 9 -2.249 -4.663 1.626
66 HE1 TYR 9 HE2 TYR 9 -3.784 -9.195 2.723
67 HE2 TYR 9 HE1 TYR 9 -1.976 -6.466 -0.017
68 HH TYR 9 HH TYR 9 -1.837 -8.883 -0.071
69 H GLN 10 H GLN 10 -3.789 -4.126 7.040
70 HA GLN 10 HA GLN 10 -4.489 -1.264 6.878
71 HB2 GLN 10 HB2 GLN 10 -5.462 -2.598 8.778
72 HB3 GLN 10 HB3 GLN 10 -3.821 -2.843 9.363
73 HG2 GLN 10 HG2 GLN 10 -3.549 -0.399 9.511
74 HG3 GLN 10 HG3 GLN 10 -5.232 -0.209 9.030
75 HE21 GLN 10 HE22 GLN 10 -5.738 0.827 10.969
76 HE22 GLN 10 HE21 GLN 10 -5.901 -0.050 12.454
77 H ALA 11 H ALA 11 -2.863 0.218 7.051
78 HA ALA 11 HA ALA 11 -0.281 -0.688 6.297
79 HB1 ALA 11 HB1 ALA 11 0.299 1.705 6.348
80 HB2 ALA 11 HB2 ALA 11 -1.273 2.036 7.082
81 HB3 ALA 11 HB3 ALA 11 -1.184 1.378 5.447
82 H LEU 12 H LEU 12 1.537 -0.868 7.378
83 HA LEU 12 HA LEU 12 1.451 -0.906 10.277
84 HB2 LEU 12 HB2 LEU 12 3.442 -1.795 8.207
85 HB3 LEU 12 HB3 LEU 12 3.830 -1.791 9.916
86 HG LEU 12 HG LEU 12 1.361 -3.212 9.096
87 HD11 LEU 12 HD11 LEU 12 4.143 -4.210 8.535
88 HD12 LEU 12 HD12 LEU 12 2.835 -3.954 7.376
89 HD13 LEU 12 HD13 LEU 12 2.706 -5.233 8.584
90 HD21 LEU 12 HD21 LEU 12 3.590 -3.834 11.028
91 HD22 LEU 12 HD22 LEU 12 2.076 -4.723 10.869
92 HD23 LEU 12 HD23 LEU 12 2.063 -3.055 11.443
93 H TYR 13 H TYR 13 2.892 0.917 7.670
94 HA TYR 13 HA TYR 13 4.070 2.804 9.572
95 HB2 TYR 13 HB2 TYR 13 5.679 1.715 7.249
96 HB3 TYR 13 HB3 TYR 13 6.238 2.776 8.536
97 HD1 TYR 13 HD2 TYR 13 6.508 1.833 10.863
98 HD2 TYR 13 HD1 TYR 13 5.705 -0.624 7.484
99 HE1 TYR 13 HE2 TYR 13 7.244 -0.147 12.129
100 HE2 TYR 13 HE1 TYR 13 6.439 -2.601 8.737
101 HH TYR 13 HH TYR 13 7.689 -3.245 10.588
102 H SER 14 H SER 14 4.833 4.794 8.407
103 HA SER 14 HA SER 14 2.996 5.422 6.231
104 HB2 SER 14 HB2 SER 14 4.812 7.218 7.859
105 HB3 SER 14 HB3 SER 14 3.681 7.768 6.625
106 HG SER 14 HG SER 14 3.213 7.271 9.203
107 H TYR 15 H TYR 15 3.686 5.246 4.189
108 HA TYR 15 HA TYR 15 6.581 5.505 3.653
109 HB2 TYR 15 HB2 TYR 15 5.841 3.195 3.310
110 HB3 TYR 15 HB3 TYR 15 4.575 3.744 2.229
111 HD1 TYR 15 HD2 TYR 15 8.239 3.421 2.608
112 HD2 TYR 15 HD1 TYR 15 5.009 4.192 -0.044
113 HE1 TYR 15 HE2 TYR 15 9.768 3.214 0.693
114 HE2 TYR 15 HE1 TYR 15 6.522 3.982 -1.961
115 HH TYR 15 HH TYR 15 8.947 4.223 -2.421
116 H ILE 16 H ILE 16 7.200 6.928 2.250
117 HA ILE 16 HA ILE 16 5.205 8.495 0.803
118 HB ILE 16 HB ILE 16 8.159 8.953 1.242
119 HG12 ILE 16 HG12 ILE 16 6.861 9.215 3.281
120 HG13 ILE 16 HG13 ILE 16 7.416 10.786 2.713
121 HG21 ILE 16 HG21 ILE 16 6.118 10.744 -0.072
122 HG22 ILE 16 HG22 ILE 16 7.474 9.939 -0.863
123 HG23 ILE 16 HG23 ILE 16 7.773 11.203 0.330
124 HD11 ILE 16 HD11 ILE 16 5.204 11.234 1.790
125 HD12 ILE 16 HD12 ILE 16 5.128 10.889 3.518
126 HD13 ILE 16 HD13 ILE 16 4.652 9.655 2.350
127 HA PRO 17 HA PRO 17 6.083 5.810 -2.704
128 HB2 PRO 17 HB3 PRO 17 4.392 7.861 -4.029
129 HB3 PRO 17 HB2 PRO 17 4.221 6.103 -4.016
130 HG2 PRO 17 HG2 PRO 17 2.588 7.629 -2.577
131 HG3 PRO 17 HG3 PRO 17 3.193 6.089 -1.931
132 HD2 PRO 17 HD2 PRO 17 4.074 8.883 -1.315
133 HD3 PRO 17 HD3 PRO 17 3.864 7.499 -0.221
134 H GLN 18 H GLN 18 7.448 5.907 -4.402
135 HA GLN 18 HA GLN 18 8.789 8.479 -4.835
136 HB2 GLN 18 HB2 GLN 18 9.787 5.671 -5.344
137 HB3 GLN 18 HB3 GLN 18 10.705 7.143 -5.631
138 HG2 GLN 18 HG2 GLN 18 9.687 6.223 -2.948
139 HG3 GLN 18 HG3 GLN 18 11.338 6.019 -3.540
140 HE21 GLN 18 HE22 GLN 18 8.985 8.251 -2.317
141 HE22 GLN 18 HE21 GLN 18 10.061 9.586 -2.083
142 H ASN 19 H ASN 19 6.575 6.474 -6.098
143 HA ASN 19 HA ASN 19 7.127 7.325 -8.865
144 HB2 ASN 19 HB2 ASN 19 5.691 4.873 -7.841
145 HB3 ASN 19 HB3 ASN 19 5.771 5.338 -9.539
146 HD21 ASN 19 HD22 ASN 19 7.501 4.086 -6.811
147 HD22 ASN 19 HD21 ASN 19 8.887 3.523 -7.690
148 H ASP 20 H ASP 20 5.298 7.864 -10.135
149 HA ASP 20 HA ASP 20 3.292 9.330 -8.649
150 HB2 ASP 20 HB2 ASP 20 4.372 10.237 -10.693
151 HB3 ASP 20 HB3 ASP 20 3.641 8.945 -11.637
152 H ASP 21 H ASP 21 3.604 6.213 -9.482
153 HA ASP 21 HA ASP 21 0.773 5.749 -10.110
154 HB2 ASP 21 HB2 ASP 21 2.486 4.887 -11.686
155 HB3 ASP 21 HB3 ASP 21 3.153 3.915 -10.382
156 H GLU 22 H GLU 22 2.836 5.765 -7.525
157 HA GLU 22 HA GLU 22 1.831 3.332 -6.280
158 HB2 GLU 22 HB2 GLU 22 3.974 5.292 -5.524
159 HB3 GLU 22 HB3 GLU 22 3.376 4.113 -4.371
160 HG2 GLU 22 HG2 GLU 22 4.079 2.306 -5.763
161 HG3 GLU 22 HG3 GLU 22 4.537 3.409 -7.055
162 H LEU 23 H LEU 23 1.243 3.412 -3.992
163 HA LEU 23 HA LEU 23 -0.736 5.539 -3.565
164 HB2 LEU 23 HB2 LEU 23 -1.343 3.019 -3.715
165 HB3 LEU 23 HB3 LEU 23 -0.643 2.902 -2.118
166 HG LEU 23 HG LEU 23 -3.188 3.150 -2.254
167 HD11 LEU 23 HD11 LEU 23 -1.742 5.202 -0.605
168 HD12 LEU 23 HD12 LEU 23 -1.849 3.491 -0.206
169 HD13 LEU 23 HD13 LEU 23 -3.313 4.469 -0.271
170 HD21 LEU 23 HD21 LEU 23 -3.236 4.868 -3.966
171 HD22 LEU 23 HD22 LEU 23 -2.395 5.981 -2.887
172 HD23 LEU 23 HD23 LEU 23 -4.027 5.430 -2.490
173 H GLU 24 H GLU 24 -0.766 6.705 -1.712
174 HA GLU 24 HA GLU 24 1.662 6.837 -0.211
175 HB2 GLU 24 HB2 GLU 24 -0.713 8.474 -0.570
176 HB3 GLU 24 HB3 GLU 24 -0.182 8.424 1.106
177 HG2 GLU 24 HG2 GLU 24 2.103 9.016 0.300
178 HG3 GLU 24 HG3 GLU 24 1.390 9.291 -1.295
179 H LEU 25 H LEU 25 2.094 5.475 1.337
180 HA LEU 25 HA LEU 25 -0.086 4.185 2.781
181 HB2 LEU 25 HB2 LEU 25 2.881 3.676 2.913
182 HB3 LEU 25 HB3 LEU 25 1.638 2.709 3.678
183 HG LEU 25 HG LEU 25 1.927 3.053 0.694
184 HD11 LEU 25 HD11 LEU 25 2.727 0.758 2.472
185 HD12 LEU 25 HD12 LEU 25 3.826 1.843 1.618
186 HD13 LEU 25 HD13 LEU 25 2.769 0.759 0.709
187 HD21 LEU 25 HD21 LEU 25 0.233 1.171 2.328
188 HD22 LEU 25 HD22 LEU 25 0.326 1.231 0.568
189 HD23 LEU 25 HD23 LEU 25 -0.354 2.592 1.463
190 H ARG 26 H ARG 26 -0.600 4.717 4.814
191 HA ARG 26 HA ARG 26 1.312 6.337 6.332
192 HB2 ARG 26 HB2 ARG 26 -1.652 6.887 6.235
193 HB3 ARG 26 HB3 ARG 26 -0.430 7.848 7.050
194 HG2 ARG 26 HG2 ARG 26 0.588 8.346 4.854
195 HG3 ARG 26 HG3 ARG 26 -0.747 7.491 4.082
196 HD2 ARG 26 HD2 ARG 26 -2.332 9.055 4.992
197 HD3 ARG 26 HD3 ARG 26 -1.057 9.854 5.916
198 HE ARG 26 HE ARG 26 -0.275 9.953 3.262
199 HH11 ARG 26 HH11 ARG 26 -2.911 11.183 5.207
200 HH12 ARG 26 HH12 ARG 26 -3.217 12.544 4.167
201 HH21 ARG 26 HH22 ARG 26 -0.637 11.729 1.911
202 HH22 ARG 26 HH21 ARG 26 -1.918 12.854 2.280
203 H ASP 27 H ASP 27 1.372 5.961 8.454
204 HA ASP 27 HA ASP 27 0.872 3.400 9.343
205 HB2 ASP 27 HB2 ASP 27 2.525 4.645 10.471
206 HB3 ASP 27 HB3 ASP 27 1.405 5.950 10.847
207 H GLY 28 H GLY 28 -1.007 2.436 9.515
208 HA2 GLY 28 HA2 GLY 28 -2.818 1.931 10.952
209 HA3 GLY 28 HA3 GLY 28 -2.987 3.641 11.311
210 H ASP 29 H ASP 29 -2.617 3.670 8.090
211 HA ASP 29 HA ASP 29 -5.458 3.925 7.644
212 HB2 ASP 29 HB2 ASP 29 -3.830 5.448 6.544
213 HB3 ASP 29 HB3 ASP 29 -3.221 4.082 5.614
214 H ILE 30 H ILE 30 -6.681 2.728 6.139
215 HA ILE 30 HA ILE 30 -5.711 -0.022 5.832
216 HB ILE 30 HB ILE 30 -8.469 1.151 5.994
217 HG12 ILE 30 HG12 ILE 30 -8.593 -0.827 7.669
218 HG13 ILE 30 HG13 ILE 30 -6.841 -0.802 7.570
219 HG21 ILE 30 HG21 ILE 30 -7.855 -1.686 5.221
220 HG22 ILE 30 HG22 ILE 30 -8.421 -0.442 4.110
221 HG23 ILE 30 HG23 ILE 30 -9.449 -0.966 5.443
222 HD11 ILE 30 HD11 ILE 30 -7.626 0.453 9.486
223 HD12 ILE 30 HD12 ILE 30 -8.603 1.479 8.435
224 HD13 ILE 30 HD13 ILE 30 -6.844 1.519 8.319
225 H VAL 31 H VAL 31 -5.572 -0.963 3.873
226 HA VAL 31 HA VAL 31 -6.464 0.597 1.544
227 HB VAL 31 HB VAL 31 -3.785 -0.752 1.873
228 HG11 VAL 31 HG11 VAL 31 -3.341 -0.180 -0.460
229 HG12 VAL 31 HG12 VAL 31 -4.994 0.411 -0.632
230 HG13 VAL 31 HG13 VAL 31 -4.698 -1.300 -0.329
231 HG21 VAL 31 HG21 VAL 31 -2.876 1.428 1.405
232 HG22 VAL 31 HG22 VAL 31 -4.016 1.548 2.746
233 HG23 VAL 31 HG23 VAL 31 -4.495 2.075 1.130
234 H ASP 32 H ASP 32 -7.807 -0.506 0.332
235 HA ASP 32 HA ASP 32 -7.967 -3.409 0.477
236 HB2 ASP 32 HB2 ASP 32 -10.055 -2.097 0.332
237 HB3 ASP 32 HB3 ASP 32 -9.500 -1.413 -1.195
238 H VAL 33 H VAL 33 -6.792 -4.653 -0.803
239 HA VAL 33 HA VAL 33 -5.585 -3.488 -3.194
240 HB VAL 33 HB VAL 33 -3.936 -4.558 -1.906
241 HG11 VAL 33 HG11 VAL 33 -5.919 -6.761 -1.531
242 HG12 VAL 33 HG12 VAL 33 -5.015 -5.844 -0.316
243 HG13 VAL 33 HG13 VAL 33 -4.191 -7.041 -1.315
244 HG21 VAL 33 HG21 VAL 33 -4.733 -6.597 -3.967
245 HG22 VAL 33 HG22 VAL 33 -3.115 -6.313 -3.322
246 HG23 VAL 33 HG23 VAL 33 -3.901 -5.082 -4.313
247 H MET 34 H MET 34 -6.392 -3.829 -5.106
248 HA MET 34 HA MET 34 -8.531 -5.766 -5.430
249 HB2 MET 34 HB2 MET 34 -9.095 -4.660 -7.453
250 HB3 MET 34 HB3 MET 34 -8.708 -3.396 -6.292
251 HG2 MET 34 HG2 MET 34 -6.685 -2.902 -7.314
252 HG3 MET 34 HG3 MET 34 -6.626 -4.443 -8.160
253 HE1 MET 34 HE1 MET 34 -5.816 -2.372 -10.116
254 HE2 MET 34 HE2 MET 34 -6.939 -2.742 -11.426
255 HE3 MET 34 HE3 MET 34 -6.268 -4.050 -10.440
256 H GLU 35 H GLU 35 -5.266 -5.098 -6.581
257 HA GLU 35 HA GLU 35 -5.302 -7.721 -7.909
258 HB2 GLU 35 HB2 GLU 35 -5.418 -5.906 -9.573
259 HB3 GLU 35 HB3 GLU 35 -3.910 -5.254 -8.947
260 HG2 GLU 35 HG2 GLU 35 -2.821 -7.403 -9.509
261 HG3 GLU 35 HG3 GLU 35 -4.326 -7.929 -10.255
262 H LYS 36 H LYS 36 -3.738 -9.003 -7.421
263 HA LYS 36 HA LYS 36 -1.618 -8.012 -5.651
264 HB2 LYS 36 HB2 LYS 36 -2.696 -10.797 -6.114
265 HB3 LYS 36 HB3 LYS 36 -1.292 -10.447 -5.115
266 HG2 LYS 36 HG2 LYS 36 -2.665 -9.091 -3.631
267 HG3 LYS 36 HG3 LYS 36 -4.077 -9.401 -4.643
268 HD2 LYS 36 HD2 LYS 36 -2.467 -11.556 -3.282
269 HD3 LYS 36 HD3 LYS 36 -3.926 -10.837 -2.598
270 HE2 LYS 36 HE2 LYS 36 -5.242 -11.624 -4.453
271 HE3 LYS 36 HE3 LYS 36 -3.801 -12.208 -5.283
272 HZ1 LYS 36 HZ1 LYS 36 -5.090 -13.967 -4.151
273 HZ2 LYS 36 HZ2 LYS 36 -4.740 -13.242 -2.659
274 HZ3 LYS 36 HZ3 LYS 36 -3.485 -13.863 -3.614
275 H CYS 37 H CYS 37 0.169 -7.490 -6.697
276 HA CYS 37 HA CYS 37 0.721 -8.373 -9.331
277 HB2 CYS 37 HB2 CYS 37 2.589 -6.989 -7.403
278 HB3 CYS 37 HB3 CYS 37 2.748 -7.062 -9.156
279 HG CYS 37 HG CYS 37 0.594 -5.444 -9.721
280 H ASP 38 H ASP 38 2.975 -9.184 -9.882
281 HA ASP 38 HA ASP 38 3.183 -11.806 -8.739
282 HB2 ASP 38 HB2 ASP 38 3.478 -11.375 -11.148
283 HB3 ASP 38 HB3 ASP 38 4.905 -10.406 -10.799
284 H ASP 39 H ASP 39 5.005 -8.823 -8.590
285 HA ASP 39 HA ASP 39 7.347 -10.038 -7.470
286 HB2 ASP 39 HB2 ASP 39 8.111 -7.647 -7.332
287 HB3 ASP 39 HB3 ASP 39 7.621 -8.191 -8.938
288 H GLY 40 H GLY 40 4.426 -8.887 -6.056
289 HA2 GLY 40 HA2 GLY 40 4.260 -9.684 -3.721
290 HA3 GLY 40 HA3 GLY 40 5.849 -8.985 -3.465
291 H TRP 41 H TRP 41 5.179 -6.558 -5.038
292 HA TRP 41 HA TRP 41 3.734 -5.131 -2.989
293 HB2 TRP 41 HB2 TRP 41 4.445 -4.062 -5.721
294 HB3 TRP 41 HB3 TRP 41 4.155 -3.149 -4.248
295 HD1 TRP 41 HD1 TRP 41 6.826 -3.361 -6.286
296 HE1 TRP 41 HE1 TRP 41 9.117 -3.558 -5.147
297 HE3 TRP 41 HE3 TRP 41 5.343 -4.987 -1.621
298 HZ2 TRP 41 HZ2 TRP 41 10.167 -4.300 -2.660
299 HZ3 TRP 41 HZ3 TRP 41 7.078 -5.410 0.053
300 HH2 TRP 41 HH2 TRP 41 9.439 -5.072 -0.452
301 H PHE 42 H PHE 42 1.661 -4.013 -3.437
302 HA PHE 42 HA PHE 42 0.086 -5.623 -5.322
303 HB2 PHE 42 HB2 PHE 42 -0.670 -4.795 -2.519
304 HB3 PHE 42 HB3 PHE 42 -1.712 -5.644 -3.644
305 HD1 PHE 42 HD1 PHE 42 0.222 -7.625 -4.784
306 HD2 PHE 42 HD2 PHE 42 -0.406 -6.301 -0.783
307 HE1 PHE 42 HE1 PHE 42 1.061 -9.775 -3.942
308 HE2 PHE 42 HE2 PHE 42 0.447 -8.448 0.061
309 HZ PHE 42 HZ PHE 42 1.181 -10.190 -1.518
310 H VAL 43 H VAL 43 -2.087 -4.649 -5.798
311 HA VAL 43 HA VAL 43 -1.837 -1.722 -6.041
312 HB VAL 43 HB VAL 43 -2.966 -3.812 -7.851
313 HG11 VAL 43 HG11 VAL 43 -3.903 -0.943 -7.939
314 HG12 VAL 43 HG12 VAL 43 -4.884 -2.271 -7.321
315 HG13 VAL 43 HG13 VAL 43 -4.381 -2.257 -9.013
316 HG21 VAL 43 HG21 VAL 43 -1.912 -2.373 -9.515
317 HG22 VAL 43 HG22 VAL 43 -0.781 -2.789 -8.221
318 HG23 VAL 43 HG23 VAL 43 -1.559 -1.205 -8.240
319 H GLY 44 H GLY 44 -3.303 -0.454 -5.072
320 HA2 GLY 44 HA2 GLY 44 -5.833 -1.547 -4.122
321 HA3 GLY 44 HA3 GLY 44 -4.639 -1.250 -2.872
322 H THR 45 H THR 45 -6.634 0.065 -2.272
323 HA THR 45 HA THR 45 -6.217 2.814 -3.216
324 HB THR 45 HB THR 45 -8.859 1.480 -2.649
325 HG1 THR 45 HG1 THR 45 -7.410 2.021 -4.921
326 HG21 THR 45 HG21 THR 45 -9.861 3.651 -3.359
327 HG22 THR 45 HG22 THR 45 -8.248 4.360 -3.301
328 HG23 THR 45 HG23 THR 45 -8.989 3.739 -1.827
329 H SER 46 H SER 46 -6.225 4.341 -1.670
330 HA SER 46 HA SER 46 -5.782 3.503 1.029
331 HB2 SER 46 HB2 SER 46 -4.471 5.319 0.115
332 HB3 SER 46 HB3 SER 46 -5.927 6.236 -0.271
333 HG SER 46 HG SER 46 -5.086 5.511 2.364
334 H ARG 47 H ARG 47 -7.263 3.393 2.638
335 HA ARG 47 HA ARG 47 -10.006 4.052 2.205
336 HB2 ARG 47 HB2 ARG 47 -9.335 2.203 3.648
337 HB3 ARG 47 HB3 ARG 47 -8.537 3.315 4.744
338 HG2 ARG 47 HG2 ARG 47 -10.831 4.390 5.046
339 HG3 ARG 47 HG3 ARG 47 -11.468 2.946 4.252
340 HD2 ARG 47 HD2 ARG 47 -10.348 1.553 5.943
341 HD3 ARG 47 HD3 ARG 47 -9.778 3.013 6.740
342 HE ARG 47 HE ARG 47 -12.555 2.058 6.638
343 HH11 ARG 47 HH11 ARG 47 -10.152 4.294 7.898
344 HH12 ARG 47 HH12 ARG 47 -11.161 4.819 9.217
345 HH21 ARG 47 HH22 ARG 47 -13.883 2.785 8.352
346 HH22 ARG 47 HH21 ARG 47 -13.297 4.005 9.437
347 H ARG 48 H ARG 48 -7.288 5.728 3.559
348 HA ARG 48 HA ARG 48 -8.847 7.652 5.021
349 HB2 ARG 48 HB2 ARG 48 -6.581 6.963 5.714
350 HB3 ARG 48 HB3 ARG 48 -5.919 7.697 4.267
351 HG2 ARG 48 HG2 ARG 48 -6.639 9.890 5.028
352 HG3 ARG 48 HG3 ARG 48 -7.340 9.159 6.478
353 HD2 ARG 48 HD2 ARG 48 -5.172 8.364 7.171
354 HD3 ARG 48 HD3 ARG 48 -4.451 8.955 5.676
355 HE ARG 48 HE ARG 48 -5.481 11.209 6.732
356 HH11 ARG 48 HH11 ARG 48 -3.508 8.660 8.133
357 HH12 ARG 48 HH12 ARG 48 -2.683 9.736 9.224
358 HH21 ARG 48 HH22 ARG 48 -4.406 12.604 8.201
359 HH22 ARG 48 HH21 ARG 48 -3.203 11.959 9.273
360 H THR 49 H THR 49 -6.923 7.763 2.015
361 HA THR 49 HA THR 49 -8.110 10.407 1.508
362 HB THR 49 HB THR 49 -5.883 10.878 1.549
363 HG1 THR 49 HG1 THR 49 -5.177 10.411 -0.900
364 HG21 THR 49 HG21 THR 49 -4.081 9.423 0.775
365 HG22 THR 49 HG22 THR 49 -5.274 8.229 0.264
366 HG23 THR 49 HG23 THR 49 -5.100 8.622 1.974
367 H LYS 50 H LYS 50 -8.176 7.213 0.436
368 HA LYS 50 HA LYS 50 -9.416 6.181 -1.140
369 HB2 LYS 50 HB2 LYS 50 -10.585 8.899 -1.701
370 HB3 LYS 50 HB3 LYS 50 -11.250 7.356 -2.208
371 HG2 LYS 50 HG2 LYS 50 -11.097 8.499 0.559
372 HG3 LYS 50 HG3 LYS 50 -12.522 8.017 -0.355
373 HD2 LYS 50 HD2 LYS 50 -10.419 6.211 0.827
374 HD3 LYS 50 HD3 LYS 50 -12.091 6.384 1.361
375 HE2 LYS 50 HE2 LYS 50 -11.136 5.275 -1.269
376 HE3 LYS 50 HE3 LYS 50 -11.802 4.349 0.073
377 HZ1 LYS 50 HZ1 LYS 50 -13.877 5.752 -0.234
378 HZ2 LYS 50 HZ2 LYS 50 -13.552 4.605 -1.444
379 HZ3 LYS 50 HZ3 LYS 50 -13.213 6.240 -1.717
380 H GLN 51 H GLN 51 -6.829 6.969 -1.833
381 HA GLN 51 HA GLN 51 -7.106 7.644 -4.670
382 HB2 GLN 51 HB2 GLN 51 -4.491 7.685 -4.446
383 HB3 GLN 51 HB3 GLN 51 -5.458 9.068 -3.952
384 HG2 GLN 51 HG2 GLN 51 -5.340 8.172 -1.617
385 HG3 GLN 51 HG3 GLN 51 -4.187 6.976 -2.215
386 HE21 GLN 51 HE22 GLN 51 -2.177 7.730 -3.072
387 HE22 GLN 51 HE21 GLN 51 -1.532 9.253 -2.564
388 H PHE 52 H PHE 52 -5.983 6.400 -6.237
389 HA PHE 52 HA PHE 52 -5.744 3.575 -5.434
390 HB2 PHE 52 HB2 PHE 52 -7.705 3.876 -6.768
391 HB3 PHE 52 HB3 PHE 52 -6.837 4.855 -7.939
392 HD1 PHE 52 HD2 PHE 52 -6.694 1.412 -6.481
393 HD2 PHE 52 HD1 PHE 52 -6.286 3.884 -9.924
394 HE1 PHE 52 HE2 PHE 52 -6.313 -0.579 -7.860
395 HE2 PHE 52 HE1 PHE 52 -5.906 1.889 -11.312
396 HZ PHE 52 HZ PHE 52 -5.918 -0.347 -10.280
397 H GLY 53 H GLY 53 -4.048 2.373 -6.177
398 HA2 GLY 53 HA2 GLY 53 -2.441 2.831 -8.376
399 HA3 GLY 53 HA3 GLY 53 -1.672 3.693 -7.050
400 H THR 54 H THR 54 0.099 2.277 -7.293
401 HA THR 54 HA THR 54 -0.367 -0.430 -6.248
402 HB THR 54 HB THR 54 0.838 -0.465 -8.322
403 HG1 THR 54 HG1 THR 54 2.111 -1.181 -5.981
404 HG21 THR 54 HG21 THR 54 3.252 0.669 -8.140
405 HG22 THR 54 HG22 THR 54 2.343 1.777 -7.105
406 HG23 THR 54 HG23 THR 54 1.845 1.517 -8.781
407 H PHE 55 H PHE 55 0.503 -1.036 -4.336
408 HA PHE 55 HA PHE 55 2.258 0.882 -2.991
409 HB2 PHE 55 HB2 PHE 55 1.026 0.704 -0.927
410 HB3 PHE 55 HB3 PHE 55 -0.099 1.166 -2.195
411 HD1 PHE 55 HD1 PHE 55 -1.487 -0.705 -3.260
412 HD2 PHE 55 HD2 PHE 55 0.585 -1.137 0.426
413 HE1 PHE 55 HE1 PHE 55 -2.938 -2.606 -2.672
414 HE2 PHE 55 HE2 PHE 55 -0.854 -3.041 1.022
415 HZ PHE 55 HZ PHE 55 -2.619 -3.780 -0.531
416 HA PRO 56 HA PRO 56 4.692 -2.714 -2.132
417 HB2 PRO 56 HB3 PRO 56 5.513 -1.204 0.279
418 HB3 PRO 56 HB2 PRO 56 6.504 -1.869 -1.022
419 HG2 PRO 56 HG2 PRO 56 6.077 0.760 -0.818
420 HG3 PRO 56 HG3 PRO 56 6.161 -0.037 -2.400
421 HD2 PRO 56 HD2 PRO 56 3.761 0.883 -0.863
422 HD3 PRO 56 HD3 PRO 56 4.077 0.960 -2.610
423 H GLY 57 H GLY 57 3.491 -4.389 -1.446
424 HA2 GLY 57 HA2 GLY 57 1.709 -4.260 0.786
425 HA3 GLY 57 HA3 GLY 57 2.105 -5.692 -0.148
426 H ASN 58 H ASN 58 4.601 -3.813 1.274
427 HA ASN 58 HA ASN 58 5.220 -5.987 3.131
428 HB2 ASN 58 HB2 ASN 58 6.922 -5.298 1.437
429 HB3 ASN 58 HB3 ASN 58 6.940 -3.694 2.164
430 HD21 ASN 58 HD22 ASN 58 6.671 -6.646 4.044
431 HD22 ASN 58 HD21 ASN 58 8.217 -6.511 4.803
432 H TYR 59 H TYR 59 4.144 -2.742 2.922
433 HA TYR 59 HA TYR 59 4.802 -2.202 5.734
434 HB2 TYR 59 HB2 TYR 59 3.833 -0.326 3.570
435 HB3 TYR 59 HB3 TYR 59 4.213 0.143 5.220
436 HD1 TYR 59 HD2 TYR 59 6.685 -0.529 5.983
437 HD2 TYR 59 HD1 TYR 59 5.418 -0.017 1.954
438 HE1 TYR 59 HE2 TYR 59 9.017 -0.124 5.306
439 HE2 TYR 59 HE1 TYR 59 7.735 0.391 1.267
440 HH TYR 59 HH TYR 59 10.387 -0.302 3.233
441 H VAL 60 H VAL 60 2.596 -3.953 4.714
442 HA VAL 60 HA VAL 60 0.454 -2.659 6.211
443 HB VAL 60 HB VAL 60 -1.245 -3.479 4.572
444 HG11 VAL 60 HG11 VAL 60 0.705 -1.527 3.343
445 HG12 VAL 60 HG12 VAL 60 -0.422 -1.111 4.635
446 HG13 VAL 60 HG13 VAL 60 -1.034 -1.630 3.061
447 HG21 VAL 60 HG21 VAL 60 1.223 -4.077 2.963
448 HG22 VAL 60 HG22 VAL 60 -0.367 -3.852 2.228
449 HG23 VAL 60 HG23 VAL 60 -0.111 -5.149 3.387
450 H LYS 61 H LYS 61 -1.156 -4.169 6.960
451 HA LYS 61 HA LYS 61 -0.001 -6.845 7.314
452 HB2 LYS 61 HB2 LYS 61 -1.171 -6.752 9.616
453 HB3 LYS 61 HB3 LYS 61 0.348 -5.898 9.407
454 HG2 LYS 61 HG2 LYS 61 -0.928 -3.799 9.088
455 HG3 LYS 61 HG3 LYS 61 -2.413 -4.692 9.429
456 HD2 LYS 61 HD2 LYS 61 -2.042 -4.652 11.635
457 HD3 LYS 61 HD3 LYS 61 -0.361 -5.147 11.436
458 HE2 LYS 61 HE2 LYS 61 -0.293 -3.020 12.461
459 HE3 LYS 61 HE3 LYS 61 0.139 -2.764 10.772
460 HZ1 LYS 61 HZ1 LYS 61 -2.499 -2.217 12.030
461 HZ2 LYS 61 HZ2 LYS 61 -2.163 -2.051 10.376
462 HZ3 LYS 61 HZ3 LYS 61 -1.370 -1.065 11.500
463 HA PRO 62 HA PRO 62 -3.650 -8.275 5.322
464 HB2 PRO 62 HB3 PRO 62 -2.988 -10.752 6.805
465 HB3 PRO 62 HB2 PRO 62 -3.259 -10.514 5.078
466 HG2 PRO 62 HG2 PRO 62 -0.801 -10.877 6.034
467 HG3 PRO 62 HG3 PRO 62 -1.110 -9.732 4.716
468 HD2 PRO 62 HD2 PRO 62 -0.595 -9.203 7.606
469 HD3 PRO 62 HD3 PRO 62 -0.074 -8.287 6.179
470 H LEU 63 H LEU 63 -5.655 -7.953 5.911
471 HA LEU 63 HA LEU 63 -6.485 -8.429 8.675
472 HB2 LEU 63 HB2 LEU 63 -7.913 -7.080 6.379
473 HB3 LEU 63 HB3 LEU 63 -8.527 -7.204 8.015
474 HG LEU 63 HG LEU 63 -6.024 -5.712 7.215
475 HD11 LEU 63 HD11 LEU 63 -8.706 -4.632 8.056
476 HD12 LEU 63 HD12 LEU 63 -8.139 -4.732 6.390
477 HD13 LEU 63 HD13 LEU 63 -7.290 -3.709 7.549
478 HD21 LEU 63 HD21 LEU 63 -7.486 -5.882 9.851
479 HD22 LEU 63 HD22 LEU 63 -6.123 -4.820 9.501
480 HD23 LEU 63 HD23 LEU 63 -5.902 -6.568 9.489
481 H TYR 64 H TYR 64 -9.227 -8.870 8.119
482 HA TYR 64 HA TYR 64 -9.053 -11.687 7.479
483 HB2 TYR 64 HB2 TYR 64 -11.350 -9.987 8.453
484 HB3 TYR 64 HB3 TYR 64 -11.467 -11.720 8.156
485 HD1 TYR 64 HD1 TYR 64 -9.759 -9.161 10.229
486 HD2 TYR 64 HD2 TYR 64 -10.711 -13.284 9.767
487 HE1 TYR 64 HE1 TYR 64 -8.927 -9.598 12.499
488 HE2 TYR 64 HE2 TYR 64 -9.881 -13.732 12.041
489 HH TYR 64 HH TYR 64 -8.310 -12.720 13.666
490 H LEU 65 H LEU 65 -11.142 -9.034 6.402
491 HA LEU 65 HA LEU 65 -11.518 -10.386 3.851
492 HB2 LEU 65 HB2 LEU 65 -12.691 -7.779 4.831
493 HB3 LEU 65 HB3 LEU 65 -13.159 -8.652 3.389
494 HG LEU 65 HG LEU 65 -13.560 -9.613 6.223
495 HD11 LEU 65 HD11 LEU 65 -15.014 -7.746 5.640
496 HD12 LEU 65 HD12 LEU 65 -15.930 -9.247 5.772
497 HD13 LEU 65 HD13 LEU 65 -15.532 -8.594 4.183
498 HD21 LEU 65 HD21 LEU 65 -14.858 -11.415 5.202
499 HD22 LEU 65 HD22 LEU 65 -13.179 -11.453 4.665
500 HD23 LEU 65 HD23 LEU 65 -14.431 -10.819 3.598
Start of MODEL 3
1 H1 GLN 1 H1 GLN 1 -19.392 -4.300 -8.665
2 H2 GLN 1 H2 GLN 1 -18.628 -2.842 -9.070
3 H3 GLN 1 H3 GLN 1 -18.921 -3.224 -7.444
4 HA GLN 1 HA GLN 1 -17.403 -5.073 -7.558
5 HB2 GLN 1 HB2 GLN 1 -16.954 -4.086 -10.390
6 HB3 GLN 1 HB3 GLN 1 -15.973 -5.303 -9.581
7 HG2 GLN 1 HG2 GLN 1 -17.834 -6.807 -9.464
8 HG3 GLN 1 HG3 GLN 1 -18.926 -5.572 -10.089
9 HE21 GLN 1 HE22 GLN 1 -16.391 -7.818 -10.858
10 HE22 GLN 1 HE21 GLN 1 -16.564 -7.737 -12.579
11 H THR 2 H THR 2 -16.591 -3.791 -5.930
12 HA THR 2 HA THR 2 -14.649 -1.738 -6.759
13 HB THR 2 HB THR 2 -16.777 -0.703 -5.928
14 HG1 THR 2 HG1 THR 2 -15.236 0.230 -3.954
15 HG21 THR 2 HG21 THR 2 -17.246 -0.773 -3.516
16 HG22 THR 2 HG22 THR 2 -15.964 -1.965 -3.308
17 HG23 THR 2 HG23 THR 2 -17.395 -2.369 -4.255
18 H SER 3 H SER 3 -13.334 -1.110 -4.661
19 HA SER 3 HA SER 3 -12.006 -3.538 -3.873
20 HB2 SER 3 HB2 SER 3 -11.418 -0.716 -2.954
21 HB3 SER 3 HB3 SER 3 -10.314 -2.094 -2.965
22 HG SER 3 HG SER 3 -11.114 -1.909 -5.422
23 H GLN 4 H GLN 4 -14.020 -4.293 -2.728
24 HA GLN 4 HA GLN 4 -14.159 -3.193 -0.006
25 HB2 GLN 4 HB2 GLN 4 -16.286 -4.754 0.025
26 HB3 GLN 4 HB3 GLN 4 -16.347 -3.142 -0.673
27 HG2 GLN 4 HG2 GLN 4 -16.175 -4.029 -2.891
28 HG3 GLN 4 HG3 GLN 4 -15.878 -5.651 -2.266
29 HE21 GLN 4 HE22 GLN 4 -17.844 -5.588 -0.208
30 HE22 GLN 4 HE21 GLN 4 -19.393 -5.631 -0.976
31 H ASP 5 H ASP 5 -15.334 -6.370 -0.765
32 HA ASP 5 HA ASP 5 -13.680 -7.449 1.356
33 HB2 ASP 5 HB2 ASP 5 -15.846 -8.775 -0.288
34 HB3 ASP 5 HB3 ASP 5 -15.098 -9.434 1.163
35 H LEU 6 H LEU 6 -12.686 -6.777 -1.452
36 HA LEU 6 HA LEU 6 -11.996 -9.210 -2.727
37 HB2 LEU 6 HB2 LEU 6 -12.030 -6.843 -3.672
38 HB3 LEU 6 HB3 LEU 6 -10.489 -6.609 -2.884
39 HG LEU 6 HG LEU 6 -10.264 -7.092 -5.289
40 HD11 LEU 6 HD11 LEU 6 -8.431 -7.729 -3.834
41 HD12 LEU 6 HD12 LEU 6 -8.609 -8.879 -5.160
42 HD13 LEU 6 HD13 LEU 6 -9.183 -9.297 -3.545
43 HD21 LEU 6 HD21 LEU 6 -11.492 -9.751 -4.596
44 HD22 LEU 6 HD22 LEU 6 -10.801 -9.303 -6.157
45 HD23 LEU 6 HD23 LEU 6 -12.238 -8.474 -5.557
46 H PHE 7 H PHE 7 -9.903 -6.882 -1.062
47 HA PHE 7 HA PHE 7 -8.901 -8.690 0.851
48 HB2 PHE 7 HB2 PHE 7 -7.722 -9.142 -1.587
49 HB3 PHE 7 HB3 PHE 7 -6.624 -7.961 -0.880
50 HD1 PHE 7 HD2 PHE 7 -6.674 -8.691 1.962
51 HD2 PHE 7 HD1 PHE 7 -6.621 -11.158 -1.506
52 HE1 PHE 7 HE2 PHE 7 -5.616 -10.491 3.265
53 HE2 PHE 7 HE1 PHE 7 -5.568 -12.963 -0.208
54 HZ PHE 7 HZ PHE 7 -5.062 -12.629 2.177
55 H SER 8 H SER 8 -8.365 -7.372 2.512
56 HA SER 8 HA SER 8 -7.510 -4.644 1.821
57 HB2 SER 8 HB2 SER 8 -9.861 -4.839 2.747
58 HB3 SER 8 HB3 SER 8 -9.138 -5.377 4.261
59 HG SER 8 HG SER 8 -9.248 -2.860 3.113
60 H TYR 9 H TYR 9 -5.778 -3.825 2.867
61 HA TYR 9 HA TYR 9 -4.671 -5.416 5.090
62 HB2 TYR 9 HB2 TYR 9 -3.050 -3.846 3.072
63 HB3 TYR 9 HB3 TYR 9 -2.420 -4.783 4.413
64 HD1 TYR 9 HD2 TYR 9 -4.017 -7.287 4.128
65 HD2 TYR 9 HD1 TYR 9 -2.120 -4.835 1.236
66 HE1 TYR 9 HE2 TYR 9 -3.793 -9.231 2.641
67 HE2 TYR 9 HE1 TYR 9 -1.898 -6.759 -0.271
68 HH TYR 9 HH TYR 9 -1.803 -9.228 -0.099
69 H GLN 10 H GLN 10 -3.576 -4.215 6.706
70 HA GLN 10 HA GLN 10 -4.207 -1.338 6.708
71 HB2 GLN 10 HB2 GLN 10 -5.110 -2.753 8.602
72 HB3 GLN 10 HB3 GLN 10 -3.440 -3.025 9.093
73 HG2 GLN 10 HG2 GLN 10 -3.152 -0.580 9.297
74 HG3 GLN 10 HG3 GLN 10 -4.861 -0.380 8.935
75 HE21 GLN 10 HE22 GLN 10 -3.368 0.367 11.311
76 HE22 GLN 10 HE21 GLN 10 -4.135 -0.429 12.637
77 H ALA 11 H ALA 11 -2.559 0.093 6.794
78 HA ALA 11 HA ALA 11 0.037 -0.827 6.103
79 HB1 ALA 11 HB1 ALA 11 0.637 1.554 6.179
80 HB2 ALA 11 HB2 ALA 11 -0.939 1.900 6.904
81 HB3 ALA 11 HB3 ALA 11 -0.840 1.265 5.258
82 H LEU 12 H LEU 12 1.623 -1.410 7.338
83 HA LEU 12 HA LEU 12 1.472 -1.537 10.155
84 HB2 LEU 12 HB2 LEU 12 3.682 -1.976 8.159
85 HB3 LEU 12 HB3 LEU 12 3.977 -2.093 9.883
86 HG LEU 12 HG LEU 12 1.714 -3.698 8.915
87 HD11 LEU 12 HD11 LEU 12 4.537 -4.256 8.039
88 HD12 LEU 12 HD12 LEU 12 3.108 -4.031 7.026
89 HD13 LEU 12 HD13 LEU 12 3.248 -5.459 8.050
90 HD21 LEU 12 HD21 LEU 12 4.125 -4.262 10.639
91 HD22 LEU 12 HD22 LEU 12 2.765 -5.353 10.395
92 HD23 LEU 12 HD23 LEU 12 2.519 -3.809 11.210
93 H TYR 13 H TYR 13 3.072 0.633 7.917
94 HA TYR 13 HA TYR 13 3.193 2.684 9.899
95 HB2 TYR 13 HB2 TYR 13 5.702 3.033 9.595
96 HB3 TYR 13 HB3 TYR 13 5.197 1.717 10.640
97 HD1 TYR 13 HD1 TYR 13 5.256 -0.638 9.711
98 HD2 TYR 13 HD2 TYR 13 7.146 2.644 7.775
99 HE1 TYR 13 HE1 TYR 13 6.701 -2.201 8.493
100 HE2 TYR 13 HE2 TYR 13 8.591 1.082 6.539
101 HH TYR 13 HH TYR 13 9.456 -1.233 6.807
102 H SER 14 H SER 14 4.288 4.680 8.972
103 HA SER 14 HA SER 14 2.882 5.241 6.564
104 HB2 SER 14 HB2 SER 14 4.860 6.955 8.089
105 HB3 SER 14 HB3 SER 14 3.741 7.522 6.849
106 HG SER 14 HG SER 14 3.018 7.789 9.076
107 H TYR 15 H TYR 15 3.681 5.798 4.529
108 HA TYR 15 HA TYR 15 6.551 5.627 4.039
109 HB2 TYR 15 HB2 TYR 15 5.778 3.297 3.789
110 HB3 TYR 15 HB3 TYR 15 4.597 3.817 2.606
111 HD1 TYR 15 HD2 TYR 15 8.261 3.685 3.228
112 HD2 TYR 15 HD1 TYR 15 5.139 3.936 0.351
113 HE1 TYR 15 HE2 TYR 15 9.908 3.400 1.423
114 HE2 TYR 15 HE1 TYR 15 6.774 3.647 -1.458
115 HH TYR 15 HH TYR 15 9.243 4.050 -1.786
116 H ILE 16 H ILE 16 7.209 6.871 2.432
117 HA ILE 16 HA ILE 16 5.179 8.344 0.914
118 HB ILE 16 HB ILE 16 8.089 8.960 1.428
119 HG12 ILE 16 HG12 ILE 16 6.717 9.296 3.397
120 HG13 ILE 16 HG13 ILE 16 7.189 10.860 2.740
121 HG21 ILE 16 HG21 ILE 16 6.028 10.587 -0.062
122 HG22 ILE 16 HG22 ILE 16 7.419 9.769 -0.773
123 HG23 ILE 16 HG23 ILE 16 7.662 11.118 0.339
124 HD11 ILE 16 HD11 ILE 16 4.987 11.101 1.725
125 HD12 ILE 16 HD12 ILE 16 4.872 10.860 3.469
126 HD13 ILE 16 HD13 ILE 16 4.515 9.528 2.368
127 HA PRO 17 HA PRO 17 6.253 5.713 -2.539
128 HB2 PRO 17 HB3 PRO 17 4.802 7.796 -4.062
129 HB3 PRO 17 HB2 PRO 17 4.504 6.059 -3.971
130 HG2 PRO 17 HG2 PRO 17 2.893 7.804 -2.760
131 HG3 PRO 17 HG3 PRO 17 3.281 6.238 -2.021
132 HD2 PRO 17 HD2 PRO 17 4.367 8.959 -1.390
133 HD3 PRO 17 HD3 PRO 17 3.927 7.637 -0.290
134 H GLN 18 H GLN 18 7.782 5.698 -4.056
135 HA GLN 18 HA GLN 18 9.362 8.133 -4.331
136 HB2 GLN 18 HB2 GLN 18 10.068 5.259 -4.933
137 HB3 GLN 18 HB3 GLN 18 11.156 6.628 -5.139
138 HG2 GLN 18 HG2 GLN 18 10.972 7.112 -2.740
139 HG3 GLN 18 HG3 GLN 18 9.938 5.694 -2.552
140 HE21 GLN 18 HE22 GLN 18 12.554 6.400 -1.410
141 HE22 GLN 18 HE21 GLN 18 13.598 5.069 -1.784
142 H ASN 19 H ASN 19 7.181 6.178 -5.984
143 HA ASN 19 HA ASN 19 7.796 7.614 -8.481
144 HB2 ASN 19 HB2 ASN 19 6.511 4.969 -7.926
145 HB3 ASN 19 HB3 ASN 19 6.077 5.853 -9.387
146 HD21 ASN 19 HD22 ASN 19 6.948 4.266 -10.693
147 HD22 ASN 19 HD21 ASN 19 8.665 4.077 -10.890
148 H ASP 20 H ASP 20 6.246 8.901 -9.370
149 HA ASP 20 HA ASP 20 4.014 9.620 -7.664
150 HB2 ASP 20 HB2 ASP 20 5.389 11.336 -8.911
151 HB3 ASP 20 HB3 ASP 20 4.673 10.726 -10.402
152 H ASP 21 H ASP 21 2.953 7.675 -7.756
153 HA ASP 21 HA ASP 21 1.109 7.010 -9.720
154 HB2 ASP 21 HB2 ASP 21 3.024 6.607 -11.186
155 HB3 ASP 21 HB3 ASP 21 3.758 5.558 -9.981
156 H GLU 22 H GLU 22 3.211 6.229 -7.118
157 HA GLU 22 HA GLU 22 1.768 3.821 -6.386
158 HB2 GLU 22 HB2 GLU 22 4.089 5.294 -5.125
159 HB3 GLU 22 HB3 GLU 22 3.386 3.827 -4.457
160 HG2 GLU 22 HG2 GLU 22 4.136 2.512 -6.201
161 HG3 GLU 22 HG3 GLU 22 4.366 3.885 -7.276
162 H LEU 23 H LEU 23 1.246 3.640 -3.973
163 HA LEU 23 HA LEU 23 -0.648 5.800 -3.413
164 HB2 LEU 23 HB2 LEU 23 -1.250 3.286 -3.636
165 HB3 LEU 23 HB3 LEU 23 -0.524 3.108 -2.054
166 HG LEU 23 HG LEU 23 -3.050 3.316 -2.107
167 HD11 LEU 23 HD11 LEU 23 -3.176 4.742 -0.156
168 HD12 LEU 23 HD12 LEU 23 -1.553 5.348 -0.487
169 HD13 LEU 23 HD13 LEU 23 -1.792 3.653 -0.064
170 HD21 LEU 23 HD21 LEU 23 -3.213 5.009 -3.820
171 HD22 LEU 23 HD22 LEU 23 -2.373 6.163 -2.783
172 HD23 LEU 23 HD23 LEU 23 -3.970 5.562 -2.322
173 H GLU 24 H GLU 24 -0.540 7.017 -1.605
174 HA GLU 24 HA GLU 24 1.877 6.966 -0.063
175 HB2 GLU 24 HB2 GLU 24 -0.507 8.724 -0.234
176 HB3 GLU 24 HB3 GLU 24 0.403 8.749 1.273
177 HG2 GLU 24 HG2 GLU 24 2.422 9.288 0.072
178 HG3 GLU 24 HG3 GLU 24 1.549 9.233 -1.462
179 H LEU 25 H LEU 25 2.248 5.930 1.749
180 HA LEU 25 HA LEU 25 -0.049 4.556 2.960
181 HB2 LEU 25 HB2 LEU 25 2.883 3.918 3.158
182 HB3 LEU 25 HB3 LEU 25 1.589 2.987 3.879
183 HG LEU 25 HG LEU 25 1.887 3.416 0.908
184 HD11 LEU 25 HD11 LEU 25 2.742 1.097 2.626
185 HD12 LEU 25 HD12 LEU 25 3.777 2.163 1.674
186 HD13 LEU 25 HD13 LEU 25 2.655 1.070 0.864
187 HD21 LEU 25 HD21 LEU 25 0.153 1.561 2.535
188 HD22 LEU 25 HD22 LEU 25 0.306 1.529 0.778
189 HD23 LEU 25 HD23 LEU 25 -0.386 2.940 1.577
190 H ARG 26 H ARG 26 -0.410 4.598 5.110
191 HA ARG 26 HA ARG 26 1.135 6.497 6.726
192 HB2 ARG 26 HB2 ARG 26 -0.617 7.911 6.395
193 HB3 ARG 26 HB3 ARG 26 -1.668 6.615 5.872
194 HG2 ARG 26 HG2 ARG 26 -1.785 5.983 8.363
195 HG3 ARG 26 HG3 ARG 26 -1.175 7.621 8.636
196 HD2 ARG 26 HD2 ARG 26 -3.047 8.584 7.519
197 HD3 ARG 26 HD3 ARG 26 -3.578 7.014 6.924
198 HE ARG 26 HE ARG 26 -3.554 7.607 9.814
199 HH11 ARG 26 HH11 ARG 26 -5.252 6.574 6.902
200 HH12 ARG 26 HH12 ARG 26 -6.712 6.177 7.767
201 HH21 ARG 26 HH22 ARG 26 -5.496 7.071 10.919
202 HH22 ARG 26 HH21 ARG 26 -6.859 6.480 10.011
203 H ASP 27 H ASP 27 1.348 5.919 8.814
204 HA ASP 27 HA ASP 27 1.118 3.265 9.631
205 HB2 ASP 27 HB2 ASP 27 2.512 5.064 10.729
206 HB3 ASP 27 HB3 ASP 27 1.038 5.665 11.481
207 H GLY 28 H GLY 28 -0.802 2.232 9.486
208 HA2 GLY 28 HA2 GLY 28 -2.742 1.567 10.680
209 HA3 GLY 28 HA3 GLY 28 -2.954 3.223 11.224
210 H ASP 29 H ASP 29 -2.246 3.572 8.073
211 HA ASP 29 HA ASP 29 -4.967 4.051 7.316
212 HB2 ASP 29 HB2 ASP 29 -2.809 5.220 6.445
213 HB3 ASP 29 HB3 ASP 29 -2.690 3.844 5.355
214 H ILE 30 H ILE 30 -6.360 2.683 6.335
215 HA ILE 30 HA ILE 30 -5.408 0.014 5.708
216 HB ILE 30 HB ILE 30 -8.107 1.232 6.036
217 HG12 ILE 30 HG12 ILE 30 -8.326 -1.032 7.313
218 HG13 ILE 30 HG13 ILE 30 -6.573 -1.046 7.212
219 HG21 ILE 30 HG21 ILE 30 -9.172 -0.856 5.224
220 HG22 ILE 30 HG22 ILE 30 -7.617 -1.325 4.553
221 HG23 ILE 30 HG23 ILE 30 -8.425 0.116 3.961
222 HD11 ILE 30 HD11 ILE 30 -7.161 -0.119 9.302
223 HD12 ILE 30 HD12 ILE 30 -8.319 0.987 8.559
224 HD13 ILE 30 HD13 ILE 30 -6.595 1.203 8.281
225 H VAL 31 H VAL 31 -5.226 -0.815 3.731
226 HA VAL 31 HA VAL 31 -6.137 0.809 1.462
227 HB VAL 31 HB VAL 31 -3.428 -0.497 1.756
228 HG11 VAL 31 HG11 VAL 31 -3.040 0.114 -0.608
229 HG12 VAL 31 HG12 VAL 31 -4.745 0.547 -0.752
230 HG13 VAL 31 HG13 VAL 31 -4.284 -1.123 -0.422
231 HG21 VAL 31 HG21 VAL 31 -2.596 1.716 1.217
232 HG22 VAL 31 HG22 VAL 31 -3.698 1.810 2.592
233 HG23 VAL 31 HG23 VAL 31 -4.244 2.301 0.987
234 H ASP 32 H ASP 32 -7.518 -0.272 0.303
235 HA ASP 32 HA ASP 32 -7.719 -3.155 0.551
236 HB2 ASP 32 HB2 ASP 32 -9.373 -1.346 -1.211
237 HB3 ASP 32 HB3 ASP 32 -9.798 -2.947 -0.611
238 H VAL 33 H VAL 33 -6.570 -4.422 -0.738
239 HA VAL 33 HA VAL 33 -5.448 -3.331 -3.190
240 HB VAL 33 HB VAL 33 -3.838 -4.476 -1.898
241 HG11 VAL 33 HG11 VAL 33 -5.849 -6.693 -1.674
242 HG12 VAL 33 HG12 VAL 33 -5.118 -5.738 -0.379
243 HG13 VAL 33 HG13 VAL 33 -4.143 -6.899 -1.280
244 HG21 VAL 33 HG21 VAL 33 -4.701 -6.426 -4.019
245 HG22 VAL 33 HG22 VAL 33 -3.079 -6.229 -3.355
246 HG23 VAL 33 HG23 VAL 33 -3.802 -4.938 -4.320
247 H MET 34 H MET 34 -6.256 -3.686 -5.126
248 HA MET 34 HA MET 34 -8.417 -5.637 -5.387
249 HB2 MET 34 HB2 MET 34 -9.240 -4.420 -7.201
250 HB3 MET 34 HB3 MET 34 -8.673 -3.194 -6.089
251 HG2 MET 34 HG2 MET 34 -7.851 -2.356 -8.019
252 HG3 MET 34 HG3 MET 34 -6.487 -3.370 -7.548
253 HE1 MET 34 HE1 MET 34 -6.641 -2.373 -10.405
254 HE2 MET 34 HE2 MET 34 -6.486 -3.805 -11.425
255 HE3 MET 34 HE3 MET 34 -5.459 -3.622 -10.003
256 H GLU 35 H GLU 35 -5.236 -4.811 -6.649
257 HA GLU 35 HA GLU 35 -5.226 -7.434 -7.985
258 HB2 GLU 35 HB2 GLU 35 -5.245 -5.752 -9.694
259 HB3 GLU 35 HB3 GLU 35 -3.938 -4.873 -8.924
260 HG2 GLU 35 HG2 GLU 35 -2.342 -6.320 -9.658
261 HG3 GLU 35 HG3 GLU 35 -3.454 -7.687 -9.728
262 H LYS 36 H LYS 36 -3.666 -8.761 -7.450
263 HA LYS 36 HA LYS 36 -1.573 -7.737 -5.655
264 HB2 LYS 36 HB2 LYS 36 -2.796 -10.498 -5.786
265 HB3 LYS 36 HB3 LYS 36 -1.474 -10.033 -4.723
266 HG2 LYS 36 HG2 LYS 36 -2.943 -8.400 -3.632
267 HG3 LYS 36 HG3 LYS 36 -4.265 -8.908 -4.682
268 HD2 LYS 36 HD2 LYS 36 -2.798 -10.665 -2.712
269 HD3 LYS 36 HD3 LYS 36 -4.397 -9.962 -2.469
270 HE2 LYS 36 HE2 LYS 36 -3.689 -11.851 -4.705
271 HE3 LYS 36 HE3 LYS 36 -4.423 -12.348 -3.185
272 HZ1 LYS 36 HZ1 LYS 36 -6.032 -12.052 -5.004
273 HZ2 LYS 36 HZ2 LYS 36 -5.644 -10.405 -5.076
274 HZ3 LYS 36 HZ3 LYS 36 -6.354 -11.051 -3.681
275 H CYS 37 H CYS 37 0.210 -7.440 -6.845
276 HA CYS 37 HA CYS 37 0.964 -9.133 -9.011
277 HB2 CYS 37 HB2 CYS 37 2.727 -7.238 -7.446
278 HB3 CYS 37 HB3 CYS 37 3.007 -7.851 -9.075
279 HG CYS 37 HG CYS 37 2.271 -5.369 -9.716
280 H ASP 38 H ASP 38 2.795 -10.477 -9.099
281 HA ASP 38 HA ASP 38 2.773 -12.351 -6.964
282 HB2 ASP 38 HB2 ASP 38 2.923 -13.023 -9.312
283 HB3 ASP 38 HB3 ASP 38 4.481 -12.220 -9.456
284 H ASP 39 H ASP 39 4.916 -9.740 -7.851
285 HA ASP 39 HA ASP 39 7.109 -10.761 -6.286
286 HB2 ASP 39 HB2 ASP 39 7.407 -9.326 -8.329
287 HB3 ASP 39 HB3 ASP 39 6.823 -7.962 -7.380
288 H GLY 40 H GLY 40 4.256 -9.034 -5.527
289 HA2 GLY 40 HA2 GLY 40 3.794 -9.192 -3.120
290 HA3 GLY 40 HA3 GLY 40 5.440 -8.646 -2.838
291 H TRP 41 H TRP 41 4.981 -6.669 -5.146
292 HA TRP 41 HA TRP 41 3.814 -4.578 -3.531
293 HB2 TRP 41 HB2 TRP 41 4.455 -4.305 -6.458
294 HB3 TRP 41 HB3 TRP 41 4.494 -3.071 -5.204
295 HD1 TRP 41 HD1 TRP 41 6.826 -4.429 -7.331
296 HE1 TRP 41 HE1 TRP 41 9.163 -4.761 -6.319
297 HE3 TRP 41 HE3 TRP 41 5.617 -4.233 -2.342
298 HZ2 TRP 41 HZ2 TRP 41 10.339 -4.923 -3.776
299 HZ3 TRP 41 HZ3 TRP 41 7.422 -4.488 -0.700
300 HH2 TRP 41 HH2 TRP 41 9.733 -4.826 -1.399
301 H PHE 42 H PHE 42 1.739 -3.717 -3.823
302 HA PHE 42 HA PHE 42 0.048 -5.367 -5.569
303 HB2 PHE 42 HB2 PHE 42 -0.573 -4.351 -2.794
304 HB3 PHE 42 HB3 PHE 42 -1.665 -5.266 -3.817
305 HD1 PHE 42 HD1 PHE 42 0.101 -7.371 -4.883
306 HD2 PHE 42 HD2 PHE 42 -0.154 -5.699 -0.975
307 HE1 PHE 42 HE1 PHE 42 0.960 -9.467 -3.935
308 HE2 PHE 42 HE2 PHE 42 0.718 -7.796 -0.022
309 HZ PHE 42 HZ PHE 42 1.275 -9.682 -1.505
310 H VAL 43 H VAL 43 -2.082 -4.380 -6.040
311 HA VAL 43 HA VAL 43 -1.898 -1.449 -6.255
312 HB VAL 43 HB VAL 43 -3.067 -3.527 -8.057
313 HG11 VAL 43 HG11 VAL 43 -4.063 -0.677 -7.974
314 HG12 VAL 43 HG12 VAL 43 -4.994 -2.081 -7.451
315 HG13 VAL 43 HG13 VAL 43 -4.520 -1.915 -9.143
316 HG21 VAL 43 HG21 VAL 43 -2.119 -2.023 -9.746
317 HG22 VAL 43 HG22 VAL 43 -0.918 -2.493 -8.537
318 HG23 VAL 43 HG23 VAL 43 -1.683 -0.903 -8.453
319 H GLY 44 H GLY 44 -3.348 -0.244 -5.217
320 HA2 GLY 44 HA2 GLY 44 -5.792 -1.413 -4.151
321 HA3 GLY 44 HA3 GLY 44 -4.541 -1.115 -2.956
322 H THR 45 H THR 45 -6.536 0.154 -2.243
323 HA THR 45 HA THR 45 -6.236 2.915 -3.178
324 HB THR 45 HB THR 45 -8.817 1.479 -2.583
325 HG1 THR 45 HG1 THR 45 -7.419 2.043 -4.859
326 HG21 THR 45 HG21 THR 45 -9.897 3.622 -3.260
327 HG22 THR 45 HG22 THR 45 -8.304 4.377 -3.207
328 HG23 THR 45 HG23 THR 45 -9.014 3.712 -1.736
329 H SER 46 H SER 46 -6.212 4.409 -1.598
330 HA SER 46 HA SER 46 -5.726 3.555 1.088
331 HB2 SER 46 HB2 SER 46 -4.560 5.492 0.131
332 HB3 SER 46 HB3 SER 46 -6.099 6.329 -0.071
333 HG SER 46 HG SER 46 -5.013 5.481 2.437
334 H ARG 47 H ARG 47 -7.126 3.490 2.784
335 HA ARG 47 HA ARG 47 -9.923 3.684 2.279
336 HB2 ARG 47 HB2 ARG 47 -8.663 2.208 4.008
337 HB3 ARG 47 HB3 ARG 47 -8.725 3.630 5.034
338 HG2 ARG 47 HG2 ARG 47 -11.116 3.622 5.002
339 HG3 ARG 47 HG3 ARG 47 -11.134 2.313 3.817
340 HD2 ARG 47 HD2 ARG 47 -9.915 0.903 5.482
341 HD3 ARG 47 HD3 ARG 47 -10.140 2.192 6.647
342 HE ARG 47 HE ARG 47 -12.600 1.350 5.431
343 HH11 ARG 47 HH11 ARG 47 -10.340 0.690 8.022
344 HH12 ARG 47 HH12 ARG 47 -11.477 -0.227 8.961
345 HH21 ARG 47 HH22 ARG 47 -14.096 0.124 6.641
346 HH22 ARG 47 HH21 ARG 47 -13.623 -0.535 8.183
347 H ARG 48 H ARG 48 -7.534 5.861 3.538
348 HA ARG 48 HA ARG 48 -9.407 7.611 4.856
349 HB2 ARG 48 HB2 ARG 48 -7.246 7.413 5.820
350 HB3 ARG 48 HB3 ARG 48 -6.453 7.709 4.284
351 HG2 ARG 48 HG2 ARG 48 -7.227 10.031 4.338
352 HG3 ARG 48 HG3 ARG 48 -7.989 9.722 5.902
353 HD2 ARG 48 HD2 ARG 48 -5.905 9.299 6.938
354 HD3 ARG 48 HD3 ARG 48 -5.076 9.228 5.387
355 HE ARG 48 HE ARG 48 -5.877 11.733 5.325
356 HH11 ARG 48 HH11 ARG 48 -4.627 9.929 8.042
357 HH12 ARG 48 HH12 ARG 48 -3.820 11.290 8.755
358 HH21 ARG 48 HH22 ARG 48 -4.864 13.550 6.283
359 HH22 ARG 48 HH21 ARG 48 -3.997 13.361 7.781
360 H THR 49 H THR 49 -7.345 7.818 1.968
361 HA THR 49 HA THR 49 -8.745 10.294 1.248
362 HB THR 49 HB THR 49 -6.588 10.969 1.253
363 HG1 THR 49 HG1 THR 49 -5.637 10.493 -0.971
364 HG21 THR 49 HG21 THR 49 -4.643 9.558 0.761
365 HG22 THR 49 HG22 THR 49 -5.730 8.210 0.430
366 HG23 THR 49 HG23 THR 49 -5.651 8.900 2.052
367 H LYS 50 H LYS 50 -8.567 7.061 0.449
368 HA LYS 50 HA LYS 50 -9.492 5.772 -1.142
369 HB2 LYS 50 HB2 LYS 50 -11.029 8.261 -1.889
370 HB3 LYS 50 HB3 LYS 50 -11.399 6.634 -2.428
371 HG2 LYS 50 HG2 LYS 50 -11.675 7.803 0.317
372 HG3 LYS 50 HG3 LYS 50 -12.919 7.099 -0.709
373 HD2 LYS 50 HD2 LYS 50 -10.717 5.668 0.774
374 HD3 LYS 50 HD3 LYS 50 -12.453 5.547 1.045
375 HE2 LYS 50 HE2 LYS 50 -10.933 4.586 -1.368
376 HE3 LYS 50 HE3 LYS 50 -11.630 3.578 -0.108
377 HZ1 LYS 50 HZ1 LYS 50 -13.835 4.356 -0.771
378 HZ2 LYS 50 HZ2 LYS 50 -13.029 3.602 -2.061
379 HZ3 LYS 50 HZ3 LYS 50 -13.142 5.289 -2.011
380 H GLN 51 H GLN 51 -7.030 7.080 -1.734
381 HA GLN 51 HA GLN 51 -7.177 7.727 -4.555
382 HB2 GLN 51 HB2 GLN 51 -4.566 7.776 -4.183
383 HB3 GLN 51 HB3 GLN 51 -5.582 9.109 -3.654
384 HG2 GLN 51 HG2 GLN 51 -5.595 8.131 -1.380
385 HG3 GLN 51 HG3 GLN 51 -4.481 6.889 -1.950
386 HE21 GLN 51 HE22 GLN 51 -2.881 7.537 -0.503
387 HE22 GLN 51 HE21 GLN 51 -1.982 8.997 -0.723
388 H PHE 52 H PHE 52 -6.218 6.518 -6.179
389 HA PHE 52 HA PHE 52 -5.932 3.675 -5.471
390 HB2 PHE 52 HB2 PHE 52 -7.990 3.989 -6.644
391 HB3 PHE 52 HB3 PHE 52 -7.219 4.995 -7.860
392 HD1 PHE 52 HD2 PHE 52 -6.816 1.542 -6.470
393 HD2 PHE 52 HD1 PHE 52 -6.931 4.050 -9.909
394 HE1 PHE 52 HE2 PHE 52 -6.520 -0.426 -7.911
395 HE2 PHE 52 HE1 PHE 52 -6.631 2.082 -11.355
396 HZ PHE 52 HZ PHE 52 -6.425 -0.156 -10.353
397 H GLY 53 H GLY 53 -4.175 2.624 -6.112
398 HA2 GLY 53 HA2 GLY 53 -2.744 3.039 -8.474
399 HA3 GLY 53 HA3 GLY 53 -1.932 3.957 -7.209
400 H THR 54 H THR 54 -0.121 2.650 -7.370
401 HA THR 54 HA THR 54 -0.460 -0.113 -6.439
402 HB THR 54 HB THR 54 0.744 -0.047 -8.492
403 HG1 THR 54 HG1 THR 54 1.941 -0.835 -6.218
404 HG21 THR 54 HG21 THR 54 3.015 1.273 -8.443
405 HG22 THR 54 HG22 THR 54 2.179 2.236 -7.222
406 HG23 THR 54 HG23 THR 54 1.509 2.096 -8.852
407 H PHE 55 H PHE 55 0.401 -0.757 -4.556
408 HA PHE 55 HA PHE 55 2.203 1.084 -3.156
409 HB2 PHE 55 HB2 PHE 55 1.052 0.780 -1.060
410 HB3 PHE 55 HB3 PHE 55 -0.114 1.343 -2.244
411 HD1 PHE 55 HD1 PHE 55 -1.473 -0.552 -3.453
412 HD2 PHE 55 HD2 PHE 55 0.543 -1.016 0.263
413 HE1 PHE 55 HE1 PHE 55 -2.909 -2.483 -2.914
414 HE2 PHE 55 HE2 PHE 55 -0.885 -2.940 0.806
415 HZ PHE 55 HZ PHE 55 -2.616 -3.677 -0.782
416 HA PRO 56 HA PRO 56 4.541 -2.650 -2.581
417 HB2 PRO 56 HB3 PRO 56 5.699 -1.231 -0.273
418 HB3 PRO 56 HB2 PRO 56 6.496 -1.875 -1.712
419 HG2 PRO 56 HG2 PRO 56 6.178 0.766 -1.321
420 HG3 PRO 56 HG3 PRO 56 6.122 0.046 -2.937
421 HD2 PRO 56 HD2 PRO 56 3.873 0.967 -1.191
422 HD3 PRO 56 HD3 PRO 56 4.060 1.093 -2.953
423 H GLY 57 H GLY 57 3.331 -4.265 -1.736
424 HA2 GLY 57 HA2 GLY 57 1.794 -3.948 0.668
425 HA3 GLY 57 HA3 GLY 57 1.963 -5.427 -0.267
426 H ASN 58 H ASN 58 4.748 -3.740 0.772
427 HA ASN 58 HA ASN 58 5.458 -5.904 2.591
428 HB2 ASN 58 HB2 ASN 58 6.933 -5.074 0.656
429 HB3 ASN 58 HB3 ASN 58 7.212 -3.640 1.638
430 HD21 ASN 58 HD22 ASN 58 7.691 -7.086 1.413
431 HD22 ASN 58 HD21 ASN 58 9.005 -7.169 2.539
432 H TYR 59 H TYR 59 4.058 -2.909 2.618
433 HA TYR 59 HA TYR 59 5.014 -2.275 5.337
434 HB2 TYR 59 HB2 TYR 59 3.780 -0.372 3.330
435 HB3 TYR 59 HB3 TYR 59 4.471 0.048 4.892
436 HD1 TYR 59 HD2 TYR 59 7.017 -0.678 5.174
437 HD2 TYR 59 HD1 TYR 59 5.068 -0.057 1.451
438 HE1 TYR 59 HE2 TYR 59 9.197 -0.316 4.100
439 HE2 TYR 59 HE1 TYR 59 7.239 0.307 0.364
440 HH TYR 59 HH TYR 59 9.501 0.976 0.954
441 H VAL 60 H VAL 60 2.760 -4.037 4.317
442 HA VAL 60 HA VAL 60 0.608 -2.824 5.864
443 HB VAL 60 HB VAL 60 -1.090 -3.514 4.166
444 HG11 VAL 60 HG11 VAL 60 0.891 -1.553 3.021
445 HG12 VAL 60 HG12 VAL 60 -0.179 -1.172 4.369
446 HG13 VAL 60 HG13 VAL 60 -0.859 -1.582 2.791
447 HG21 VAL 60 HG21 VAL 60 1.365 -4.023 2.499
448 HG22 VAL 60 HG22 VAL 60 -0.250 -3.811 1.822
449 HG23 VAL 60 HG23 VAL 60 0.077 -5.153 2.915
450 H LYS 61 H LYS 61 -1.019 -4.375 6.516
451 HA LYS 61 HA LYS 61 0.128 -7.078 6.746
452 HB2 LYS 61 HB2 LYS 61 -0.721 -7.131 9.038
453 HB3 LYS 61 HB3 LYS 61 0.417 -5.817 8.795
454 HG2 LYS 61 HG2 LYS 61 -1.925 -4.560 8.278
455 HG3 LYS 61 HG3 LYS 61 -2.432 -5.747 9.478
456 HD2 LYS 61 HD2 LYS 61 -0.393 -3.561 9.749
457 HD3 LYS 61 HD3 LYS 61 -1.838 -3.844 10.719
458 HE2 LYS 61 HE2 LYS 61 -0.776 -5.965 11.518
459 HE3 LYS 61 HE3 LYS 61 0.700 -5.467 10.682
460 HZ1 LYS 61 HZ1 LYS 61 0.724 -4.891 13.047
461 HZ2 LYS 61 HZ2 LYS 61 -0.652 -3.918 12.834
462 HZ3 LYS 61 HZ3 LYS 61 0.803 -3.507 12.071
463 HA PRO 62 HA PRO 62 -3.658 -8.532 5.041
464 HB2 PRO 62 HB3 PRO 62 -3.267 -10.998 6.591
465 HB3 PRO 62 HB2 PRO 62 -3.289 -10.764 4.843
466 HG2 PRO 62 HG2 PRO 62 -1.014 -11.305 6.168
467 HG3 PRO 62 HG3 PRO 62 -1.046 -10.243 4.749
468 HD2 PRO 62 HD2 PRO 62 -0.902 -9.524 7.652
469 HD3 PRO 62 HD3 PRO 62 -0.053 -8.809 6.264
470 H LEU 63 H LEU 63 -5.567 -7.827 5.711
471 HA LEU 63 HA LEU 63 -6.381 -8.276 8.491
472 HB2 LEU 63 HB2 LEU 63 -7.652 -6.557 6.365
473 HB3 LEU 63 HB3 LEU 63 -8.157 -6.657 8.037
474 HG LEU 63 HG LEU 63 -5.518 -5.552 7.077
475 HD11 LEU 63 HD11 LEU 63 -7.852 -4.093 8.287
476 HD12 LEU 63 HD12 LEU 63 -7.628 -4.272 6.549
477 HD13 LEU 63 HD13 LEU 63 -6.422 -3.408 7.511
478 HD21 LEU 63 HD21 LEU 63 -6.759 -5.626 9.826
479 HD22 LEU 63 HD22 LEU 63 -5.254 -4.816 9.392
480 HD23 LEU 63 HD23 LEU 63 -5.370 -6.574 9.297
481 H TYR 64 H TYR 64 -9.005 -8.280 8.392
482 HA TYR 64 HA TYR 64 -10.057 -10.043 6.373
483 HB2 TYR 64 HB2 TYR 64 -10.966 -11.468 8.474
484 HB3 TYR 64 HB3 TYR 64 -9.528 -11.907 7.563
485 HD1 TYR 64 HD1 TYR 64 -10.626 -10.043 10.603
486 HD2 TYR 64 HD2 TYR 64 -7.489 -12.137 8.639
487 HE1 TYR 64 HE1 TYR 64 -9.285 -9.962 12.664
488 HE2 TYR 64 HE2 TYR 64 -6.144 -12.057 10.687
489 HH TYR 64 HH TYR 64 -5.972 -10.710 12.721
490 H LEU 65 H LEU 65 -12.040 -9.368 5.938
491 HA LEU 65 HA LEU 65 -13.317 -7.534 7.830
492 HB2 LEU 65 HB2 LEU 65 -12.856 -7.023 5.334
493 HB3 LEU 65 HB3 LEU 65 -14.214 -8.080 5.008
494 HG LEU 65 HG LEU 65 -14.425 -5.623 6.753
495 HD11 LEU 65 HD11 LEU 65 -15.047 -5.911 3.815
496 HD12 LEU 65 HD12 LEU 65 -13.724 -4.975 4.507
497 HD13 LEU 65 HD13 LEU 65 -15.393 -4.500 4.817
498 HD21 LEU 65 HD21 LEU 65 -16.820 -5.848 6.304
499 HD22 LEU 65 HD22 LEU 65 -16.179 -7.290 7.092
500 HD23 LEU 65 HD23 LEU 65 -16.510 -7.304 5.359
Start of MODEL 4
1 H1 GLN 1 H1 GLN 1 -18.185 -4.569 -6.586
2 H2 GLN 1 H2 GLN 1 -16.941 -5.051 -7.628
3 H3 GLN 1 H3 GLN 1 -16.749 -3.671 -6.663
4 HA GLN 1 HA GLN 1 -16.838 -5.007 -4.673
5 HB2 GLN 1 HB2 GLN 1 -16.869 -7.412 -4.745
6 HB3 GLN 1 HB3 GLN 1 -18.251 -6.813 -5.644
7 HG2 GLN 1 HG2 GLN 1 -15.683 -7.816 -6.859
8 HG3 GLN 1 HG3 GLN 1 -17.179 -8.735 -6.721
9 HE21 GLN 1 HE22 GLN 1 -18.912 -8.234 -8.063
10 HE22 GLN 1 HE21 GLN 1 -18.729 -7.219 -9.459
11 H THR 2 H THR 2 -15.081 -5.458 -7.712
12 HA THR 2 HA THR 2 -12.758 -6.557 -6.544
13 HB THR 2 HB THR 2 -13.271 -6.739 -8.962
14 HG1 THR 2 HG1 THR 2 -10.822 -5.868 -7.941
15 HG21 THR 2 HG21 THR 2 -12.442 -3.836 -9.054
16 HG22 THR 2 HG22 THR 2 -14.058 -4.468 -9.378
17 HG23 THR 2 HG23 THR 2 -12.722 -4.870 -10.456
18 H SER 3 H SER 3 -13.872 -3.271 -6.910
19 HA SER 3 HA SER 3 -11.341 -2.322 -5.735
20 HB2 SER 3 HB2 SER 3 -13.453 -0.631 -7.083
21 HB3 SER 3 HB3 SER 3 -11.790 -0.181 -6.703
22 HG SER 3 HG SER 3 -11.089 -1.242 -8.418
23 H GLN 4 H GLN 4 -13.702 -3.577 -4.393
24 HA GLN 4 HA GLN 4 -14.284 -1.395 -2.523
25 HB2 GLN 4 HB2 GLN 4 -16.194 -1.760 -4.126
26 HB3 GLN 4 HB3 GLN 4 -16.359 -3.382 -3.471
27 HG2 GLN 4 HG2 GLN 4 -16.854 -2.467 -1.281
28 HG3 GLN 4 HG3 GLN 4 -16.649 -0.828 -1.907
29 HE21 GLN 4 HE22 GLN 4 -18.699 -3.624 -1.791
30 HE22 GLN 4 HE21 GLN 4 -20.083 -2.888 -2.532
31 H ASP 5 H ASP 5 -16.115 -4.131 -1.883
32 HA ASP 5 HA ASP 5 -14.488 -4.783 0.397
33 HB2 ASP 5 HB2 ASP 5 -17.112 -5.922 -0.588
34 HB3 ASP 5 HB3 ASP 5 -16.331 -6.398 0.915
35 H LEU 6 H LEU 6 -12.767 -5.389 -1.335
36 HA LEU 6 HA LEU 6 -13.063 -8.205 -2.092
37 HB2 LEU 6 HB2 LEU 6 -12.342 -6.585 -3.818
38 HB3 LEU 6 HB3 LEU 6 -10.912 -6.235 -2.864
39 HG LEU 6 HG LEU 6 -10.186 -8.590 -3.123
40 HD11 LEU 6 HD11 LEU 6 -12.590 -8.788 -4.935
41 HD12 LEU 6 HD12 LEU 6 -12.353 -9.642 -3.409
42 HD13 LEU 6 HD13 LEU 6 -11.316 -10.000 -4.790
43 HD21 LEU 6 HD21 LEU 6 -9.538 -8.426 -5.458
44 HD22 LEU 6 HD22 LEU 6 -9.398 -6.856 -4.664
45 HD23 LEU 6 HD23 LEU 6 -10.765 -7.188 -5.728
46 H PHE 7 H PHE 7 -10.375 -6.179 -0.905
47 HA PHE 7 HA PHE 7 -10.058 -7.791 1.450
48 HB2 PHE 7 HB2 PHE 7 -8.823 -8.974 -0.558
49 HB3 PHE 7 HB3 PHE 7 -7.615 -7.711 -0.294
50 HD1 PHE 7 HD2 PHE 7 -6.602 -7.496 2.024
51 HD2 PHE 7 HD1 PHE 7 -8.900 -10.861 0.809
52 HE1 PHE 7 HE2 PHE 7 -5.657 -8.806 3.876
53 HE2 PHE 7 HE1 PHE 7 -7.960 -12.175 2.659
54 HZ PHE 7 HZ PHE 7 -6.336 -11.149 4.197
55 H SER 8 H SER 8 -9.094 -6.612 3.034
56 HA SER 8 HA SER 8 -7.878 -4.061 2.217
57 HB2 SER 8 HB2 SER 8 -9.445 -4.555 4.755
58 HB3 SER 8 HB3 SER 8 -8.864 -3.007 4.144
59 HG SER 8 HG SER 8 -10.351 -3.078 2.504
60 H TYR 9 H TYR 9 -5.904 -3.589 3.032
61 HA TYR 9 HA TYR 9 -4.902 -5.228 5.279
62 HB2 TYR 9 HB2 TYR 9 -3.316 -3.633 3.250
63 HB3 TYR 9 HB3 TYR 9 -2.635 -4.513 4.604
64 HD1 TYR 9 HD2 TYR 9 -4.009 -7.109 4.449
65 HD2 TYR 9 HD1 TYR 9 -2.508 -4.605 1.374
66 HE1 TYR 9 HE2 TYR 9 -3.690 -9.079 3.007
67 HE2 TYR 9 HE1 TYR 9 -2.184 -6.552 -0.081
68 HH TYR 9 HH TYR 9 -3.470 -9.651 0.665
69 H GLN 10 H GLN 10 -3.691 -4.103 6.917
70 HA GLN 10 HA GLN 10 -4.258 -1.215 7.003
71 HB2 GLN 10 HB2 GLN 10 -5.184 -2.224 8.952
72 HB3 GLN 10 HB3 GLN 10 -3.748 -3.204 9.221
73 HG2 GLN 10 HG2 GLN 10 -2.491 -1.349 9.943
74 HG3 GLN 10 HG3 GLN 10 -3.688 -0.205 9.346
75 HE21 GLN 10 HE22 GLN 10 -5.562 0.145 10.537
76 HE22 GLN 10 HE21 GLN 10 -5.714 -0.349 12.190
77 H ALA 11 H ALA 11 -2.617 0.194 7.047
78 HA ALA 11 HA ALA 11 -0.054 -0.709 6.223
79 HB1 ALA 11 HB1 ALA 11 0.539 1.678 6.295
80 HB2 ALA 11 HB2 ALA 11 -1.004 2.011 7.092
81 HB3 ALA 11 HB3 ALA 11 -0.978 1.387 5.441
82 H LEU 12 H LEU 12 1.646 -1.181 7.339
83 HA LEU 12 HA LEU 12 1.603 -1.148 10.220
84 HB2 LEU 12 HB2 LEU 12 3.525 -2.163 8.144
85 HB3 LEU 12 HB3 LEU 12 3.894 -2.220 9.858
86 HG LEU 12 HG LEU 12 1.318 -3.407 8.997
87 HD11 LEU 12 HD11 LEU 12 4.009 -4.588 8.362
88 HD12 LEU 12 HD12 LEU 12 2.637 -4.326 7.274
89 HD13 LEU 12 HD13 LEU 12 2.546 -5.560 8.531
90 HD21 LEU 12 HD21 LEU 12 3.466 -4.218 10.951
91 HD22 LEU 12 HD22 LEU 12 1.908 -5.020 10.739
92 HD23 LEU 12 HD23 LEU 12 1.973 -3.364 11.341
93 H TYR 13 H TYR 13 3.072 0.653 7.630
94 HA TYR 13 HA TYR 13 4.380 2.432 9.544
95 HB2 TYR 13 HB2 TYR 13 5.894 1.250 7.197
96 HB3 TYR 13 HB3 TYR 13 6.529 2.328 8.433
97 HD1 TYR 13 HD2 TYR 13 6.773 1.463 10.790
98 HD2 TYR 13 HD1 TYR 13 5.867 -1.078 7.502
99 HE1 TYR 13 HE2 TYR 13 7.468 -0.490 12.113
100 HE2 TYR 13 HE1 TYR 13 6.564 -3.033 8.811
101 HH TYR 13 HH TYR 13 7.962 -3.572 10.692
102 H SER 14 H SER 14 5.196 4.412 8.428
103 HA SER 14 HA SER 14 3.374 5.162 6.287
104 HB2 SER 14 HB2 SER 14 5.311 6.858 7.879
105 HB3 SER 14 HB3 SER 14 4.099 7.456 6.743
106 HG SER 14 HG SER 14 3.730 7.166 9.253
107 H TYR 15 H TYR 15 4.014 4.939 4.268
108 HA TYR 15 HA TYR 15 6.910 4.909 3.691
109 HB2 TYR 15 HB2 TYR 15 6.012 2.718 3.337
110 HB3 TYR 15 HB3 TYR 15 4.644 3.353 2.448
111 HD1 TYR 15 HD2 TYR 15 8.307 2.794 2.271
112 HD2 TYR 15 HD1 TYR 15 4.751 3.714 0.143
113 HE1 TYR 15 HE2 TYR 15 9.491 2.435 0.143
114 HE2 TYR 15 HE1 TYR 15 5.914 3.351 -1.984
115 HH TYR 15 HH TYR 15 8.105 3.310 -2.894
116 H ILE 16 H ILE 16 7.685 6.074 2.073
117 HA ILE 16 HA ILE 16 5.856 7.927 0.725
118 HB ILE 16 HB ILE 16 8.843 8.070 1.154
119 HG12 ILE 16 HG12 ILE 16 7.580 8.514 3.189
120 HG13 ILE 16 HG13 ILE 16 8.290 10.008 2.586
121 HG21 ILE 16 HG21 ILE 16 8.691 10.328 0.180
122 HG22 ILE 16 HG22 ILE 16 6.996 10.028 -0.207
123 HG23 ILE 16 HG23 ILE 16 8.259 9.068 -0.979
124 HD11 ILE 16 HD11 ILE 16 6.136 10.652 1.649
125 HD12 ILE 16 HD12 ILE 16 6.028 10.359 3.384
126 HD13 ILE 16 HD13 ILE 16 5.427 9.152 2.246
127 HA PRO 17 HA PRO 17 6.330 5.077 -2.691
128 HB2 PRO 17 HB3 PRO 17 5.012 7.362 -4.079
129 HB3 PRO 17 HB2 PRO 17 4.575 5.650 -4.069
130 HG2 PRO 17 HG2 PRO 17 3.163 7.370 -2.644
131 HG3 PRO 17 HG3 PRO 17 3.581 5.783 -1.962
132 HD2 PRO 17 HD2 PRO 17 4.819 8.458 -1.427
133 HD3 PRO 17 HD3 PRO 17 4.423 7.151 -0.290
134 H GLN 18 H GLN 18 7.764 4.803 -4.217
135 HA GLN 18 HA GLN 18 9.686 6.910 -4.764
136 HB2 GLN 18 HB2 GLN 18 9.615 4.019 -5.645
137 HB3 GLN 18 HB3 GLN 18 10.967 5.122 -5.867
138 HG2 GLN 18 HG2 GLN 18 11.313 5.259 -3.497
139 HG3 GLN 18 HG3 GLN 18 9.862 4.299 -3.194
140 HE21 GLN 18 HE22 GLN 18 12.042 3.567 -5.818
141 HE22 GLN 18 HE21 GLN 18 12.683 2.110 -5.134
142 H ASN 19 H ASN 19 7.242 4.973 -6.254
143 HA ASN 19 HA ASN 19 7.507 6.427 -8.788
144 HB2 ASN 19 HB2 ASN 19 6.271 3.849 -7.943
145 HB3 ASN 19 HB3 ASN 19 5.554 4.693 -9.313
146 HD21 ASN 19 HD22 ASN 19 6.643 4.791 -11.231
147 HD22 ASN 19 HD21 ASN 19 8.111 3.913 -11.540
148 H ASP 20 H ASP 20 5.854 7.659 -9.583
149 HA ASP 20 HA ASP 20 4.016 8.789 -7.708
150 HB2 ASP 20 HB2 ASP 20 5.046 10.078 -9.563
151 HB3 ASP 20 HB3 ASP 20 4.141 9.106 -10.719
152 H ASP 21 H ASP 21 4.054 5.986 -9.387
153 HA ASP 21 HA ASP 21 1.237 5.729 -9.988
154 HB2 ASP 21 HB2 ASP 21 3.356 3.575 -9.922
155 HB3 ASP 21 HB3 ASP 21 1.830 3.545 -10.795
156 H GLU 22 H GLU 22 3.113 5.545 -7.233
157 HA GLU 22 HA GLU 22 1.785 3.192 -6.140
158 HB2 GLU 22 HB2 GLU 22 4.125 4.818 -5.163
159 HB3 GLU 22 HB3 GLU 22 3.403 3.510 -4.238
160 HG2 GLU 22 HG2 GLU 22 3.954 1.924 -5.949
161 HG3 GLU 22 HG3 GLU 22 4.559 3.200 -6.996
162 H LEU 23 H LEU 23 1.141 3.232 -3.877
163 HA LEU 23 HA LEU 23 -0.567 5.561 -3.368
164 HB2 LEU 23 HB2 LEU 23 -1.381 3.094 -3.526
165 HB3 LEU 23 HB3 LEU 23 -0.670 2.908 -1.941
166 HG LEU 23 HG LEU 23 -3.166 3.322 -1.985
167 HD11 LEU 23 HD11 LEU 23 -1.551 5.359 -0.478
168 HD12 LEU 23 HD12 LEU 23 -1.797 3.688 0.021
169 HD13 LEU 23 HD13 LEU 23 -3.171 4.787 -0.082
170 HD21 LEU 23 HD21 LEU 23 -3.152 4.965 -3.784
171 HD22 LEU 23 HD22 LEU 23 -2.291 6.094 -2.737
172 HD23 LEU 23 HD23 LEU 23 -3.933 5.583 -2.325
173 H GLU 24 H GLU 24 -0.398 6.746 -1.522
174 HA GLU 24 HA GLU 24 2.066 6.526 -0.075
175 HB2 GLU 24 HB2 GLU 24 -0.043 8.510 -0.359
176 HB3 GLU 24 HB3 GLU 24 0.527 8.359 1.300
177 HG2 GLU 24 HG2 GLU 24 2.862 8.523 0.351
178 HG3 GLU 24 HG3 GLU 24 2.091 9.046 -1.152
179 H LEU 25 H LEU 25 2.321 5.069 1.401
180 HA LEU 25 HA LEU 25 0.054 4.064 2.919
181 HB2 LEU 25 HB2 LEU 25 2.952 3.252 3.065
182 HB3 LEU 25 HB3 LEU 25 1.597 2.400 3.768
183 HG LEU 25 HG LEU 25 1.931 2.802 0.799
184 HD11 LEU 25 HD11 LEU 25 2.685 0.439 2.507
185 HD12 LEU 25 HD12 LEU 25 3.789 1.484 1.609
186 HD13 LEU 25 HD13 LEU 25 2.647 0.453 0.745
187 HD21 LEU 25 HD21 LEU 25 0.156 0.994 2.435
188 HD22 LEU 25 HD22 LEU 25 0.280 0.987 0.677
189 HD23 LEU 25 HD23 LEU 25 -0.355 2.407 1.508
190 H ARG 26 H ARG 26 -0.295 4.531 5.028
191 HA ARG 26 HA ARG 26 1.757 6.050 6.457
192 HB2 ARG 26 HB2 ARG 26 -1.170 6.814 6.261
193 HB3 ARG 26 HB3 ARG 26 0.002 7.577 7.331
194 HG2 ARG 26 HG2 ARG 26 1.235 8.441 5.492
195 HG3 ARG 26 HG3 ARG 26 0.300 7.487 4.342
196 HD2 ARG 26 HD2 ARG 26 -1.724 8.758 5.100
197 HD3 ARG 26 HD3 ARG 26 -0.632 9.818 5.994
198 HE ARG 26 HE ARG 26 0.416 9.861 3.507
199 HH11 ARG 26 HH11 ARG 26 -2.819 10.470 4.726
200 HH12 ARG 26 HH12 ARG 26 -3.247 11.514 3.402
201 HH21 ARG 26 HH22 ARG 26 -0.120 11.252 1.812
202 HH22 ARG 26 HH21 ARG 26 -1.717 11.947 1.734
203 H ASP 27 H ASP 27 1.886 5.645 8.575
204 HA ASP 27 HA ASP 27 1.279 3.151 9.521
205 HB2 ASP 27 HB2 ASP 27 2.971 4.457 10.564
206 HB3 ASP 27 HB3 ASP 27 1.831 5.724 10.990
207 H GLY 28 H GLY 28 -0.683 2.282 9.589
208 HA2 GLY 28 HA2 GLY 28 -2.513 1.807 11.007
209 HA3 GLY 28 HA3 GLY 28 -2.607 3.505 11.438
210 H ASP 29 H ASP 29 -2.276 3.603 8.190
211 HA ASP 29 HA ASP 29 -5.125 3.958 7.815
212 HB2 ASP 29 HB2 ASP 29 -3.494 5.497 6.726
213 HB3 ASP 29 HB3 ASP 29 -2.925 4.150 5.743
214 H ILE 30 H ILE 30 -6.411 2.820 6.302
215 HA ILE 30 HA ILE 30 -5.449 0.090 5.831
216 HB ILE 30 HB ILE 30 -8.234 1.205 6.083
217 HG12 ILE 30 HG12 ILE 30 -8.316 -0.794 7.722
218 HG13 ILE 30 HG13 ILE 30 -6.563 -0.759 7.602
219 HG21 ILE 30 HG21 ILE 30 -7.499 -1.574 5.185
220 HG22 ILE 30 HG22 ILE 30 -8.226 -0.324 4.178
221 HG23 ILE 30 HG23 ILE 30 -9.126 -0.994 5.538
222 HD11 ILE 30 HD11 ILE 30 -7.129 0.481 9.520
223 HD12 ILE 30 HD12 ILE 30 -8.396 1.361 8.666
224 HD13 ILE 30 HD13 ILE 30 -6.706 1.664 8.282
225 H VAL 31 H VAL 31 -5.384 -0.764 3.842
226 HA VAL 31 HA VAL 31 -6.370 0.888 1.610
227 HB VAL 31 HB VAL 31 -3.676 -0.453 1.822
228 HG11 VAL 31 HG11 VAL 31 -3.339 0.030 -0.557
229 HG12 VAL 31 HG12 VAL 31 -5.016 0.563 -0.689
230 HG13 VAL 31 HG13 VAL 31 -4.652 -1.121 -0.318
231 HG21 VAL 31 HG21 VAL 31 -2.856 1.738 1.167
232 HG22 VAL 31 HG22 VAL 31 -3.887 1.870 2.594
233 HG23 VAL 31 HG23 VAL 31 -4.514 2.321 1.004
234 H ASP 32 H ASP 32 -7.663 -0.143 0.267
235 HA ASP 32 HA ASP 32 -8.120 -2.993 0.606
236 HB2 ASP 32 HB2 ASP 32 -9.416 -1.136 -1.396
237 HB3 ASP 32 HB3 ASP 32 -10.015 -2.696 -0.849
238 H VAL 33 H VAL 33 -6.945 -4.416 -0.513
239 HA VAL 33 HA VAL 33 -5.535 -3.532 -2.898
240 HB VAL 33 HB VAL 33 -4.176 -4.768 -1.394
241 HG11 VAL 33 HG11 VAL 33 -6.427 -6.714 -1.326
242 HG12 VAL 33 HG12 VAL 33 -5.507 -5.995 0.004
243 HG13 VAL 33 HG13 VAL 33 -4.782 -7.256 -0.997
244 HG21 VAL 33 HG21 VAL 33 -4.910 -6.577 -3.687
245 HG22 VAL 33 HG22 VAL 33 -3.392 -6.601 -2.786
246 HG23 VAL 33 HG23 VAL 33 -3.811 -5.197 -3.776
247 H MET 34 H MET 34 -6.159 -3.897 -4.858
248 HA MET 34 HA MET 34 -8.441 -5.682 -5.331
249 HB2 MET 34 HB2 MET 34 -8.860 -4.389 -7.339
250 HB3 MET 34 HB3 MET 34 -8.728 -3.310 -5.956
251 HG2 MET 34 HG2 MET 34 -6.700 -2.450 -6.650
252 HG3 MET 34 HG3 MET 34 -6.338 -3.854 -7.645
253 HE1 MET 34 HE1 MET 34 -8.322 -3.372 -10.845
254 HE2 MET 34 HE2 MET 34 -8.720 -4.394 -9.462
255 HE3 MET 34 HE3 MET 34 -7.044 -4.247 -9.995
256 H GLU 35 H GLU 35 -5.162 -4.935 -6.354
257 HA GLU 35 HA GLU 35 -5.242 -7.299 -8.105
258 HB2 GLU 35 HB2 GLU 35 -5.183 -5.141 -9.344
259 HB3 GLU 35 HB3 GLU 35 -3.632 -4.796 -8.589
260 HG2 GLU 35 HG2 GLU 35 -3.255 -5.656 -10.788
261 HG3 GLU 35 HG3 GLU 35 -2.741 -6.858 -9.604
262 H LYS 36 H LYS 36 -3.529 -8.633 -8.068
263 HA LYS 36 HA LYS 36 -1.628 -8.165 -5.874
264 HB2 LYS 36 HB2 LYS 36 -2.606 -10.794 -6.984
265 HB3 LYS 36 HB3 LYS 36 -1.463 -10.599 -5.663
266 HG2 LYS 36 HG2 LYS 36 -3.189 -9.502 -4.324
267 HG3 LYS 36 HG3 LYS 36 -4.330 -9.693 -5.657
268 HD2 LYS 36 HD2 LYS 36 -3.949 -12.159 -5.536
269 HD3 LYS 36 HD3 LYS 36 -2.986 -11.883 -4.084
270 HE2 LYS 36 HE2 LYS 36 -5.881 -11.103 -4.407
271 HE3 LYS 36 HE3 LYS 36 -5.318 -12.572 -3.613
272 HZ1 LYS 36 HZ1 LYS 36 -4.931 -9.770 -2.746
273 HZ2 LYS 36 HZ2 LYS 36 -4.038 -11.058 -2.088
274 HZ3 LYS 36 HZ3 LYS 36 -5.725 -11.024 -1.924
275 H CYS 37 H CYS 37 0.252 -7.522 -6.687
276 HA CYS 37 HA CYS 37 1.178 -8.360 -9.277
277 HB2 CYS 37 HB2 CYS 37 1.679 -6.121 -8.407
278 HB3 CYS 37 HB3 CYS 37 2.592 -6.832 -7.085
279 HG CYS 37 HG CYS 37 4.091 -5.604 -9.320
280 H ASP 38 H ASP 38 3.129 -9.472 -9.647
281 HA ASP 38 HA ASP 38 3.379 -11.807 -7.987
282 HB2 ASP 38 HB2 ASP 38 3.473 -11.772 -10.527
283 HB3 ASP 38 HB3 ASP 38 5.080 -11.072 -10.374
284 H ASP 39 H ASP 39 4.921 -8.782 -8.228
285 HA ASP 39 HA ASP 39 7.441 -9.713 -7.132
286 HB2 ASP 39 HB2 ASP 39 7.238 -7.915 -8.914
287 HB3 ASP 39 HB3 ASP 39 6.651 -6.846 -7.644
288 H GLY 40 H GLY 40 4.443 -8.741 -5.904
289 HA2 GLY 40 HA2 GLY 40 4.147 -9.220 -3.546
290 HA3 GLY 40 HA3 GLY 40 5.730 -8.520 -3.257
291 H TRP 41 H TRP 41 4.957 -6.269 -5.174
292 HA TRP 41 HA TRP 41 3.610 -4.659 -3.162
293 HB2 TRP 41 HB2 TRP 41 4.235 -3.459 -5.794
294 HB3 TRP 41 HB3 TRP 41 4.507 -2.830 -4.173
295 HD1 TRP 41 HD1 TRP 41 6.322 -4.167 -7.055
296 HE1 TRP 41 HE1 TRP 41 8.747 -4.767 -6.450
297 HE3 TRP 41 HE3 TRP 41 5.967 -3.997 -1.932
298 HZ2 TRP 41 HZ2 TRP 41 10.303 -5.103 -4.130
299 HZ3 TRP 41 HZ3 TRP 41 7.983 -4.474 -0.609
300 HH2 TRP 41 HH2 TRP 41 10.104 -5.016 -1.686
301 H PHE 42 H PHE 42 1.498 -4.582 -3.126
302 HA PHE 42 HA PHE 42 0.021 -5.685 -5.374
303 HB2 PHE 42 HB2 PHE 42 -0.912 -5.032 -2.573
304 HB3 PHE 42 HB3 PHE 42 -1.814 -5.924 -3.792
305 HD1 PHE 42 HD1 PHE 42 0.142 -7.775 -4.875
306 HD2 PHE 42 HD2 PHE 42 -0.452 -6.492 -0.858
307 HE1 PHE 42 HE1 PHE 42 1.120 -9.881 -4.063
308 HE2 PHE 42 HE2 PHE 42 0.535 -8.592 -0.040
309 HZ PHE 42 HZ PHE 42 1.319 -10.291 -1.642
310 H VAL 43 H VAL 43 -2.201 -4.703 -5.775
311 HA VAL 43 HA VAL 43 -1.879 -1.776 -5.915
312 HB VAL 43 HB VAL 43 -3.009 -3.753 -7.853
313 HG11 VAL 43 HG11 VAL 43 -3.807 -0.841 -7.845
314 HG12 VAL 43 HG12 VAL 43 -4.872 -2.151 -7.337
315 HG13 VAL 43 HG13 VAL 43 -4.295 -2.077 -9.005
316 HG21 VAL 43 HG21 VAL 43 -1.819 -2.332 -9.425
317 HG22 VAL 43 HG22 VAL 43 -0.756 -2.812 -8.094
318 HG23 VAL 43 HG23 VAL 43 -1.476 -1.200 -8.116
319 H GLY 44 H GLY 44 -3.388 -0.497 -5.045
320 HA2 GLY 44 HA2 GLY 44 -6.066 -1.373 -4.581
321 HA3 GLY 44 HA3 GLY 44 -5.127 -1.392 -3.100
322 H THR 45 H THR 45 -6.679 0.149 -2.341
323 HA THR 45 HA THR 45 -6.215 2.885 -3.303
324 HB THR 45 HB THR 45 -8.869 1.574 -2.745
325 HG1 THR 45 HG1 THR 45 -7.409 2.093 -5.000
326 HG21 THR 45 HG21 THR 45 -9.864 3.740 -3.422
327 HG22 THR 45 HG22 THR 45 -8.248 4.446 -3.383
328 HG23 THR 45 HG23 THR 45 -8.973 3.820 -1.903
329 H SER 46 H SER 46 -6.280 4.471 -1.723
330 HA SER 46 HA SER 46 -5.865 3.649 0.991
331 HB2 SER 46 HB2 SER 46 -4.740 5.644 0.040
332 HB3 SER 46 HB3 SER 46 -6.304 6.416 -0.171
333 HG SER 46 HG SER 46 -5.172 5.616 2.329
334 H ARG 47 H ARG 47 -7.305 3.620 2.652
335 HA ARG 47 HA ARG 47 -10.078 3.552 2.040
336 HB2 ARG 47 HB2 ARG 47 -8.859 2.234 3.836
337 HB3 ARG 47 HB3 ARG 47 -8.833 3.708 4.782
338 HG2 ARG 47 HG2 ARG 47 -11.279 3.750 4.767
339 HG3 ARG 47 HG3 ARG 47 -11.285 2.236 3.855
340 HD2 ARG 47 HD2 ARG 47 -10.063 1.146 5.670
341 HD3 ARG 47 HD3 ARG 47 -10.072 2.658 6.570
342 HE ARG 47 HE ARG 47 -12.584 1.319 5.813
343 HH11 ARG 47 HH11 ARG 47 -10.449 2.669 8.245
344 HH12 ARG 47 HH12 ARG 47 -11.587 2.464 9.538
345 HH21 ARG 47 HH22 ARG 47 -14.089 1.054 7.505
346 HH22 ARG 47 HH21 ARG 47 -13.679 1.566 9.115
347 H ARG 48 H ARG 48 -7.967 6.037 3.237
348 HA ARG 48 HA ARG 48 -10.155 7.599 4.296
349 HB2 ARG 48 HB2 ARG 48 -8.108 9.315 4.430
350 HB3 ARG 48 HB3 ARG 48 -8.462 8.122 5.677
351 HG2 ARG 48 HG2 ARG 48 -6.888 6.617 4.522
352 HG3 ARG 48 HG3 ARG 48 -6.446 7.961 3.463
353 HD2 ARG 48 HD2 ARG 48 -4.834 8.051 5.152
354 HD3 ARG 48 HD3 ARG 48 -6.037 9.243 5.654
355 HE ARG 48 HE ARG 48 -6.355 6.554 6.712
356 HH11 ARG 48 HH11 ARG 48 -5.177 9.812 7.256
357 HH12 ARG 48 HH12 ARG 48 -5.121 9.634 8.983
358 HH21 ARG 48 HH22 ARG 48 -6.290 6.337 8.993
359 HH22 ARG 48 HH21 ARG 48 -5.753 7.670 9.961
360 H THR 49 H THR 49 -7.702 8.013 1.792
361 HA THR 49 HA THR 49 -9.144 10.353 0.826
362 HB THR 49 HB THR 49 -7.087 11.173 0.647
363 HG1 THR 49 HG1 THR 49 -5.831 10.449 -1.160
364 HG21 THR 49 HG21 THR 49 -5.060 9.919 1.009
365 HG22 THR 49 HG22 THR 49 -5.932 8.410 0.777
366 HG23 THR 49 HG23 THR 49 -6.288 9.420 2.175
367 H LYS 50 H LYS 50 -8.856 7.096 0.126
368 HA LYS 50 HA LYS 50 -9.535 5.743 -1.535
369 HB2 LYS 50 HB2 LYS 50 -11.157 8.095 -2.517
370 HB3 LYS 50 HB3 LYS 50 -11.411 6.405 -2.918
371 HG2 LYS 50 HG2 LYS 50 -11.956 7.836 -0.354
372 HG3 LYS 50 HG3 LYS 50 -13.051 6.877 -1.343
373 HD2 LYS 50 HD2 LYS 50 -10.804 5.883 0.410
374 HD3 LYS 50 HD3 LYS 50 -12.531 5.664 0.669
375 HE2 LYS 50 HE2 LYS 50 -10.950 4.509 -1.624
376 HE3 LYS 50 HE3 LYS 50 -11.403 3.635 -0.168
377 HZ1 LYS 50 HZ1 LYS 50 -13.748 4.043 -0.747
378 HZ2 LYS 50 HZ2 LYS 50 -12.932 3.102 -1.897
379 HZ3 LYS 50 HZ3 LYS 50 -13.255 4.738 -2.217
380 H GLN 51 H GLN 51 -7.133 7.174 -1.888
381 HA GLN 51 HA GLN 51 -6.956 7.789 -4.703
382 HB2 GLN 51 HB2 GLN 51 -4.425 7.877 -4.073
383 HB3 GLN 51 HB3 GLN 51 -5.497 9.158 -3.531
384 HG2 GLN 51 HG2 GLN 51 -5.652 8.064 -1.338
385 HG3 GLN 51 HG3 GLN 51 -4.542 6.814 -1.896
386 HE21 GLN 51 HE22 GLN 51 -3.016 7.309 -0.317
387 HE22 GLN 51 HE21 GLN 51 -2.059 8.748 -0.383
388 H PHE 52 H PHE 52 -5.686 6.576 -6.176
389 HA PHE 52 HA PHE 52 -5.659 3.723 -5.465
390 HB2 PHE 52 HB2 PHE 52 -7.591 4.089 -6.810
391 HB3 PHE 52 HB3 PHE 52 -6.698 5.084 -7.950
392 HD1 PHE 52 HD2 PHE 52 -6.565 1.609 -6.563
393 HD2 PHE 52 HD1 PHE 52 -6.186 4.148 -9.958
394 HE1 PHE 52 HE2 PHE 52 -6.193 -0.356 -7.987
395 HE2 PHE 52 HE1 PHE 52 -5.804 2.185 -11.388
396 HZ PHE 52 HZ PHE 52 -5.807 -0.073 -10.403
397 H GLY 53 H GLY 53 -4.016 2.481 -6.173
398 HA2 GLY 53 HA2 GLY 53 -2.370 2.870 -8.358
399 HA3 GLY 53 HA3 GLY 53 -1.579 3.694 -7.018
400 H THR 54 H THR 54 0.134 2.225 -7.163
401 HA THR 54 HA THR 54 -0.475 -0.479 -6.191
402 HB THR 54 HB THR 54 0.808 -0.610 -8.181
403 HG1 THR 54 HG1 THR 54 2.580 -0.894 -5.971
404 HG21 THR 54 HG21 THR 54 3.160 0.560 -8.127
405 HG22 THR 54 HG22 THR 54 2.350 1.648 -6.996
406 HG23 THR 54 HG23 THR 54 1.721 1.447 -8.635
407 H PHE 55 H PHE 55 0.430 -1.206 -4.293
408 HA PHE 55 HA PHE 55 2.106 0.679 -2.824
409 HB2 PHE 55 HB2 PHE 55 0.782 0.511 -0.813
410 HB3 PHE 55 HB3 PHE 55 -0.257 1.046 -2.123
411 HD1 PHE 55 HD1 PHE 55 -1.693 -0.723 -3.275
412 HD2 PHE 55 HD2 PHE 55 0.221 -1.342 0.467
413 HE1 PHE 55 HE1 PHE 55 -3.250 -2.567 -2.792
414 HE2 PHE 55 HE2 PHE 55 -1.326 -3.188 0.960
415 HZ PHE 55 HZ PHE 55 -3.065 -3.805 -0.672
416 HA PRO 56 HA PRO 56 4.455 -2.970 -2.026
417 HB2 PRO 56 HB3 PRO 56 5.343 -1.432 0.351
418 HB3 PRO 56 HB2 PRO 56 6.304 -2.160 -0.941
419 HG2 PRO 56 HG2 PRO 56 5.953 0.483 -0.814
420 HG3 PRO 56 HG3 PRO 56 5.981 -0.364 -2.371
421 HD2 PRO 56 HD2 PRO 56 3.641 0.679 -0.824
422 HD3 PRO 56 HD3 PRO 56 3.925 0.683 -2.577
423 H GLY 57 H GLY 57 3.343 -4.675 -1.252
424 HA2 GLY 57 HA2 GLY 57 1.585 -4.613 0.965
425 HA3 GLY 57 HA3 GLY 57 2.227 -6.062 0.202
426 H ASN 58 H ASN 58 4.861 -4.454 0.850
427 HA ASN 58 HA ASN 58 5.723 -6.063 2.985
428 HB2 ASN 58 HB2 ASN 58 7.060 -4.896 1.106
429 HB3 ASN 58 HB3 ASN 58 7.026 -3.482 2.157
430 HD21 ASN 58 HD22 ASN 58 8.274 -6.659 1.666
431 HD22 ASN 58 HD21 ASN 58 9.457 -6.613 2.937
432 H TYR 59 H TYR 59 4.052 -3.044 2.888
433 HA TYR 59 HA TYR 59 4.726 -2.526 5.719
434 HB2 TYR 59 HB2 TYR 59 3.847 -0.499 3.661
435 HB3 TYR 59 HB3 TYR 59 4.348 -0.167 5.311
436 HD1 TYR 59 HD2 TYR 59 6.783 -0.696 5.929
437 HD2 TYR 59 HD1 TYR 59 5.373 -0.508 1.925
438 HE1 TYR 59 HE2 TYR 59 9.089 -0.374 5.140
439 HE2 TYR 59 HE1 TYR 59 7.662 -0.183 1.121
440 HH TYR 59 HH TYR 59 10.399 -0.680 3.128
441 H VAL 60 H VAL 60 2.490 -4.144 4.534
442 HA VAL 60 HA VAL 60 0.379 -2.809 6.021
443 HB VAL 60 HB VAL 60 -1.330 -3.413 4.297
444 HG11 VAL 60 HG11 VAL 60 0.736 -1.511 3.207
445 HG12 VAL 60 HG12 VAL 60 -0.329 -1.114 4.557
446 HG13 VAL 60 HG13 VAL 60 -1.011 -1.470 2.966
447 HG21 VAL 60 HG21 VAL 60 1.126 -4.027 2.675
448 HG22 VAL 60 HG22 VAL 60 -0.448 -3.683 1.954
449 HG23 VAL 60 HG23 VAL 60 -0.257 -5.065 3.023
450 H LYS 61 H LYS 61 -1.338 -4.299 6.627
451 HA LYS 61 HA LYS 61 -0.263 -7.022 6.880
452 HB2 LYS 61 HB2 LYS 61 -0.957 -7.038 9.203
453 HB3 LYS 61 HB3 LYS 61 0.167 -5.729 8.891
454 HG2 LYS 61 HG2 LYS 61 -2.049 -4.332 8.596
455 HG3 LYS 61 HG3 LYS 61 -2.723 -5.631 9.586
456 HD2 LYS 61 HD2 LYS 61 -0.533 -3.693 10.265
457 HD3 LYS 61 HD3 LYS 61 -2.054 -3.976 11.113
458 HE2 LYS 61 HE2 LYS 61 0.225 -5.941 10.897
459 HE3 LYS 61 HE3 LYS 61 -0.110 -4.920 12.299
460 HZ1 LYS 61 HZ1 LYS 61 -2.287 -6.021 12.489
461 HZ2 LYS 61 HZ2 LYS 61 -0.993 -7.100 12.673
462 HZ3 LYS 61 HZ3 LYS 61 -1.867 -7.063 11.221
463 HA PRO 62 HA PRO 62 -4.141 -8.364 5.333
464 HB2 PRO 62 HB3 PRO 62 -3.717 -10.815 6.913
465 HB3 PRO 62 HB2 PRO 62 -3.873 -10.618 5.167
466 HG2 PRO 62 HG2 PRO 62 -1.518 -11.192 6.303
467 HG3 PRO 62 HG3 PRO 62 -1.635 -10.131 4.888
468 HD2 PRO 62 HD2 PRO 62 -1.254 -9.417 7.767
469 HD3 PRO 62 HD3 PRO 62 -0.498 -8.718 6.320
470 H LEU 63 H LEU 63 -5.961 -7.551 6.097
471 HA LEU 63 HA LEU 63 -6.714 -8.011 8.899
472 HB2 LEU 63 HB2 LEU 63 -7.864 -6.115 6.845
473 HB3 LEU 63 HB3 LEU 63 -8.379 -6.235 8.514
474 HG LEU 63 HG LEU 63 -5.657 -5.325 7.587
475 HD11 LEU 63 HD11 LEU 63 -7.931 -3.774 8.806
476 HD12 LEU 63 HD12 LEU 63 -7.501 -3.772 7.098
477 HD13 LEU 63 HD13 LEU 63 -6.370 -3.133 8.291
478 HD21 LEU 63 HD21 LEU 63 -5.613 -6.480 9.761
479 HD22 LEU 63 HD22 LEU 63 -6.862 -5.384 10.353
480 HD23 LEU 63 HD23 LEU 63 -5.271 -4.757 9.917
481 H TYR 64 H TYR 64 -9.449 -7.645 8.594
482 HA TYR 64 HA TYR 64 -10.284 -9.902 6.915
483 HB2 TYR 64 HB2 TYR 64 -12.054 -10.188 8.862
484 HB3 TYR 64 HB3 TYR 64 -10.463 -10.932 8.971
485 HD1 TYR 64 HD1 TYR 64 -12.354 -7.884 10.001
486 HD2 TYR 64 HD2 TYR 64 -9.088 -10.495 10.794
487 HE1 TYR 64 HE1 TYR 64 -11.939 -6.713 12.123
488 HE2 TYR 64 HE2 TYR 64 -8.662 -9.328 12.915
489 HH TYR 64 HH TYR 64 -9.084 -7.096 13.902
490 H LEU 65 H LEU 65 -12.146 -9.636 5.803
491 HA LEU 65 HA LEU 65 -13.905 -7.403 6.403
492 HB2 LEU 65 HB2 LEU 65 -12.152 -6.479 4.895
493 HB3 LEU 65 HB3 LEU 65 -12.582 -7.686 3.699
494 HG LEU 65 HG LEU 65 -14.865 -6.699 3.586
495 HD11 LEU 65 HD11 LEU 65 -15.228 -4.478 4.537
496 HD12 LEU 65 HD12 LEU 65 -13.656 -4.559 5.329
497 HD13 LEU 65 HD13 LEU 65 -14.937 -5.679 5.794
498 HD21 LEU 65 HD21 LEU 65 -13.140 -6.102 1.964
499 HD22 LEU 65 HD22 LEU 65 -12.596 -4.798 3.017
500 HD23 LEU 65 HD23 LEU 65 -14.206 -4.738 2.299
Start of MODEL 5
1 H1 GLN 1 H1 GLN 1 -15.231 -8.841 -5.262
2 H2 GLN 1 H2 GLN 1 -15.112 -7.914 -6.678
3 H3 GLN 1 H3 GLN 1 -15.429 -9.577 -6.778
4 HA GLN 1 HA GLN 1 -17.404 -8.230 -7.167
5 HB2 GLN 1 HB2 GLN 1 -17.476 -10.534 -6.161
6 HB3 GLN 1 HB3 GLN 1 -17.528 -9.790 -4.571
7 HG2 GLN 1 HG2 GLN 1 -19.577 -8.953 -6.540
8 HG3 GLN 1 HG3 GLN 1 -19.703 -10.576 -5.866
9 HE21 GLN 1 HE22 GLN 1 -21.439 -8.241 -5.537
10 HE22 GLN 1 HE21 GLN 1 -21.524 -7.967 -3.827
11 H THR 2 H THR 2 -17.401 -6.095 -6.962
12 HA THR 2 HA THR 2 -17.334 -4.010 -6.173
13 HB THR 2 HB THR 2 -19.656 -4.514 -5.752
14 HG1 THR 2 HG1 THR 2 -19.632 -2.996 -3.648
15 HG21 THR 2 HG21 THR 2 -18.847 -5.226 -2.929
16 HG22 THR 2 HG22 THR 2 -19.477 -6.342 -4.140
17 HG23 THR 2 HG23 THR 2 -20.501 -5.049 -3.515
18 H SER 3 H SER 3 -17.297 -5.760 -3.027
19 HA SER 3 HA SER 3 -14.784 -4.543 -2.313
20 HB2 SER 3 HB2 SER 3 -17.306 -3.732 -0.821
21 HB3 SER 3 HB3 SER 3 -15.660 -3.259 -0.404
22 HG SER 3 HG SER 3 -15.894 -2.561 -2.878
23 H GLN 4 H GLN 4 -15.180 -4.845 0.534
24 HA GLN 4 HA GLN 4 -15.244 -6.333 2.214
25 HB2 GLN 4 HB2 GLN 4 -17.573 -6.657 1.656
26 HB3 GLN 4 HB3 GLN 4 -17.153 -7.783 0.374
27 HG2 GLN 4 HG2 GLN 4 -17.936 -9.065 2.189
28 HG3 GLN 4 HG3 GLN 4 -16.187 -9.273 2.110
29 HE21 GLN 4 HE22 GLN 4 -18.000 -9.692 4.325
30 HE22 GLN 4 HE21 GLN 4 -17.468 -8.663 5.609
31 H ASP 5 H ASP 5 -15.741 -9.093 0.190
32 HA ASP 5 HA ASP 5 -13.230 -10.228 0.946
33 HB2 ASP 5 HB2 ASP 5 -15.348 -11.199 -0.984
34 HB3 ASP 5 HB3 ASP 5 -13.947 -12.137 -0.484
35 H LEU 6 H LEU 6 -12.227 -8.169 -0.173
36 HA LEU 6 HA LEU 6 -11.327 -9.088 -2.821
37 HB2 LEU 6 HB2 LEU 6 -12.704 -7.037 -2.917
38 HB3 LEU 6 HB3 LEU 6 -11.568 -6.248 -1.842
39 HG LEU 6 HG LEU 6 -9.811 -6.433 -3.551
40 HD11 LEU 6 HD11 LEU 6 -10.375 -7.170 -5.814
41 HD12 LEU 6 HD12 LEU 6 -11.986 -7.631 -5.261
42 HD13 LEU 6 HD13 LEU 6 -10.566 -8.473 -4.642
43 HD21 LEU 6 HD21 LEU 6 -11.184 -4.430 -3.496
44 HD22 LEU 6 HD22 LEU 6 -12.372 -5.194 -4.550
45 HD23 LEU 6 HD23 LEU 6 -10.756 -4.838 -5.157
46 H PHE 7 H PHE 7 -10.558 -8.711 0.315
47 HA PHE 7 HA PHE 7 -8.638 -9.025 1.480
48 HB2 PHE 7 HB2 PHE 7 -7.685 -9.589 -1.070
49 HB3 PHE 7 HB3 PHE 7 -6.621 -8.305 -0.493
50 HD1 PHE 7 HD2 PHE 7 -6.686 -9.004 2.445
51 HD2 PHE 7 HD1 PHE 7 -6.217 -11.411 -1.033
52 HE1 PHE 7 HE2 PHE 7 -5.429 -10.658 3.763
53 HE2 PHE 7 HE1 PHE 7 -4.964 -13.070 0.280
54 HZ PHE 7 HZ PHE 7 -4.567 -12.694 2.681
55 H SER 8 H SER 8 -8.522 -7.463 2.879
56 HA SER 8 HA SER 8 -7.555 -4.829 1.958
57 HB2 SER 8 HB2 SER 8 -9.292 -5.456 4.362
58 HB3 SER 8 HB3 SER 8 -8.740 -3.854 3.881
59 HG SER 8 HG SER 8 -9.873 -4.741 1.742
60 H TYR 9 H TYR 9 -5.782 -3.960 2.966
61 HA TYR 9 HA TYR 9 -4.673 -5.490 5.237
62 HB2 TYR 9 HB2 TYR 9 -3.089 -3.839 3.265
63 HB3 TYR 9 HB3 TYR 9 -2.448 -4.843 4.553
64 HD1 TYR 9 HD2 TYR 9 -4.084 -7.337 4.116
65 HD2 TYR 9 HD1 TYR 9 -2.126 -4.737 1.400
66 HE1 TYR 9 HE2 TYR 9 -3.859 -9.187 2.510
67 HE2 TYR 9 HE1 TYR 9 -1.900 -6.569 -0.218
68 HH TYR 9 HH TYR 9 -3.560 -9.510 0.105
69 H GLN 10 H GLN 10 -3.622 -4.275 6.879
70 HA GLN 10 HA GLN 10 -4.316 -1.415 6.873
71 HB2 GLN 10 HB2 GLN 10 -5.214 -2.784 8.775
72 HB3 GLN 10 HB3 GLN 10 -3.551 -3.085 9.273
73 HG2 GLN 10 HG2 GLN 10 -3.217 -0.643 9.450
74 HG3 GLN 10 HG3 GLN 10 -4.923 -0.418 9.084
75 HE21 GLN 10 HE22 GLN 10 -3.358 0.301 11.442
76 HE22 GLN 10 HE21 GLN 10 -4.175 -0.419 12.781
77 H ALA 11 H ALA 11 -2.748 0.063 6.966
78 HA ALA 11 HA ALA 11 -0.116 -0.752 6.246
79 HB1 ALA 11 HB1 ALA 11 0.358 1.649 6.205
80 HB2 ALA 11 HB2 ALA 11 -1.203 1.958 6.977
81 HB3 ALA 11 HB3 ALA 11 -1.140 1.265 5.353
82 H LEU 12 H LEU 12 1.606 -1.000 7.409
83 HA LEU 12 HA LEU 12 1.527 -0.775 10.292
84 HB2 LEU 12 HB2 LEU 12 3.581 -1.763 8.323
85 HB3 LEU 12 HB3 LEU 12 3.860 -1.731 10.052
86 HG LEU 12 HG LEU 12 1.394 -3.099 9.230
87 HD11 LEU 12 HD11 LEU 12 4.104 -4.144 8.453
88 HD12 LEU 12 HD12 LEU 12 2.709 -3.853 7.405
89 HD13 LEU 12 HD13 LEU 12 2.665 -5.154 8.599
90 HD21 LEU 12 HD21 LEU 12 3.694 -3.854 11.027
91 HD22 LEU 12 HD22 LEU 12 2.146 -4.692 10.911
92 HD23 LEU 12 HD23 LEU 12 2.213 -3.045 11.539
93 H TYR 13 H TYR 13 2.739 1.039 7.616
94 HA TYR 13 HA TYR 13 4.129 2.879 9.440
95 HB2 TYR 13 HB2 TYR 13 5.285 1.912 6.814
96 HB3 TYR 13 HB3 TYR 13 6.019 3.072 7.906
97 HD1 TYR 13 HD1 TYR 13 5.268 -0.476 7.351
98 HD2 TYR 13 HD2 TYR 13 7.202 2.347 9.874
99 HE1 TYR 13 HE1 TYR 13 6.526 -2.299 8.413
100 HE2 TYR 13 HE2 TYR 13 8.460 0.531 10.948
101 HH TYR 13 HH TYR 13 8.575 -2.636 9.648
102 H SER 14 H SER 14 4.623 4.962 8.386
103 HA SER 14 HA SER 14 2.646 5.670 6.341
104 HB2 SER 14 HB2 SER 14 4.459 7.469 7.977
105 HB3 SER 14 HB3 SER 14 3.169 7.994 6.894
106 HG SER 14 HG SER 14 3.015 7.235 9.472
107 H TYR 15 H TYR 15 3.308 5.624 4.288
108 HA TYR 15 HA TYR 15 6.196 5.926 3.753
109 HB2 TYR 15 HB2 TYR 15 5.485 3.554 3.626
110 HB3 TYR 15 HB3 TYR 15 4.305 3.988 2.403
111 HD1 TYR 15 HD2 TYR 15 7.944 3.867 3.101
112 HD2 TYR 15 HD1 TYR 15 4.900 4.125 0.142
113 HE1 TYR 15 HE2 TYR 15 9.627 3.512 1.346
114 HE2 TYR 15 HE1 TYR 15 6.572 3.766 -1.619
115 HH TYR 15 HH TYR 15 9.708 2.669 -0.982
116 H ILE 16 H ILE 16 6.754 7.227 2.175
117 HA ILE 16 HA ILE 16 4.627 8.501 0.612
118 HB ILE 16 HB ILE 16 7.446 9.416 1.200
119 HG12 ILE 16 HG12 ILE 16 5.989 9.611 3.134
120 HG13 ILE 16 HG13 ILE 16 6.315 11.213 2.482
121 HG21 ILE 16 HG21 ILE 16 5.262 10.821 -0.341
122 HG22 ILE 16 HG22 ILE 16 6.741 10.143 -1.022
123 HG23 ILE 16 HG23 ILE 16 6.828 11.512 0.087
124 HD11 ILE 16 HD11 ILE 16 4.139 11.238 1.415
125 HD12 ILE 16 HD12 ILE 16 3.988 10.954 3.149
126 HD13 ILE 16 HD13 ILE 16 3.811 9.612 2.017
127 HA PRO 17 HA PRO 17 6.090 5.842 -2.683
128 HB2 PRO 17 HB3 PRO 17 4.215 7.499 -4.256
129 HB3 PRO 17 HB2 PRO 17 4.258 5.746 -4.040
130 HG2 PRO 17 HG2 PRO 17 2.384 7.235 -2.867
131 HG3 PRO 17 HG3 PRO 17 3.097 5.837 -2.041
132 HD2 PRO 17 HD2 PRO 17 3.666 8.753 -1.668
133 HD3 PRO 17 HD3 PRO 17 3.506 7.466 -0.454
134 H GLN 18 H GLN 18 7.351 6.023 -4.491
135 HA GLN 18 HA GLN 18 8.518 8.667 -4.928
136 HB2 GLN 18 HB2 GLN 18 9.507 5.946 -5.795
137 HB3 GLN 18 HB3 GLN 18 10.373 7.465 -5.989
138 HG2 GLN 18 HG2 GLN 18 9.644 6.144 -3.383
139 HG3 GLN 18 HG3 GLN 18 11.249 6.213 -4.113
140 HE21 GLN 18 HE22 GLN 18 12.346 8.204 -4.162
141 HE22 GLN 18 HE21 GLN 18 11.926 9.488 -3.075
142 H ASN 19 H ASN 19 6.443 6.390 -6.235
143 HA ASN 19 HA ASN 19 6.371 7.853 -8.795
144 HB2 ASN 19 HB2 ASN 19 5.742 4.979 -8.124
145 HB3 ASN 19 HB3 ASN 19 5.212 5.731 -9.627
146 HD21 ASN 19 HD22 ASN 19 6.960 3.477 -9.254
147 HD22 ASN 19 HD21 ASN 19 8.472 3.894 -9.979
148 H ASP 20 H ASP 20 4.365 8.603 -9.467
149 HA ASP 20 HA ASP 20 2.305 8.768 -7.453
150 HB2 ASP 20 HB2 ASP 20 1.086 10.141 -9.085
151 HB3 ASP 20 HB3 ASP 20 2.746 10.696 -8.902
152 H ASP 21 H ASP 21 3.215 6.515 -9.657
153 HA ASP 21 HA ASP 21 0.662 5.328 -10.206
154 HB2 ASP 21 HB2 ASP 21 2.482 4.837 -11.699
155 HB3 ASP 21 HB3 ASP 21 3.515 4.329 -10.370
156 H GLU 22 H GLU 22 2.711 5.574 -7.522
157 HA GLU 22 HA GLU 22 1.776 3.106 -6.280
158 HB2 GLU 22 HB2 GLU 22 3.841 5.147 -5.471
159 HB3 GLU 22 HB3 GLU 22 3.360 3.807 -4.439
160 HG2 GLU 22 HG2 GLU 22 4.202 2.213 -5.963
161 HG3 GLU 22 HG3 GLU 22 4.438 3.425 -7.215
162 H LEU 23 H LEU 23 1.186 3.256 -3.937
163 HA LEU 23 HA LEU 23 -0.819 5.381 -3.649
164 HB2 LEU 23 HB2 LEU 23 -1.435 2.873 -3.714
165 HB3 LEU 23 HB3 LEU 23 -0.744 2.795 -2.111
166 HG LEU 23 HG LEU 23 -3.325 3.118 -2.400
167 HD11 LEU 23 HD11 LEU 23 -3.428 4.336 -0.306
168 HD12 LEU 23 HD12 LEU 23 -1.740 4.812 -0.488
169 HD13 LEU 23 HD13 LEU 23 -2.158 3.113 -0.262
170 HD21 LEU 23 HD21 LEU 23 -3.139 5.013 -3.930
171 HD22 LEU 23 HD22 LEU 23 -2.321 5.943 -2.676
172 HD23 LEU 23 HD23 LEU 23 -4.006 5.460 -2.460
173 H GLU 24 H GLU 24 -0.877 6.662 -1.875
174 HA GLU 24 HA GLU 24 1.479 6.827 -0.255
175 HB2 GLU 24 HB2 GLU 24 -1.000 8.423 -0.593
176 HB3 GLU 24 HB3 GLU 24 -0.132 8.589 0.929
177 HG2 GLU 24 HG2 GLU 24 1.881 9.181 -0.255
178 HG3 GLU 24 HG3 GLU 24 1.053 8.982 -1.803
179 H LEU 25 H LEU 25 1.842 5.897 1.589
180 HA LEU 25 HA LEU 25 -0.398 4.486 2.873
181 HB2 LEU 25 HB2 LEU 25 2.568 3.981 3.081
182 HB3 LEU 25 HB3 LEU 25 1.318 3.040 3.869
183 HG LEU 25 HG LEU 25 1.602 3.293 0.876
184 HD11 LEU 25 HD11 LEU 25 2.494 1.091 2.729
185 HD12 LEU 25 HD12 LEU 25 3.535 2.160 1.783
186 HD13 LEU 25 HD13 LEU 25 2.480 1.005 0.966
187 HD21 LEU 25 HD21 LEU 25 0.058 1.416 0.815
188 HD22 LEU 25 HD22 LEU 25 -0.662 2.787 1.661
189 HD23 LEU 25 HD23 LEU 25 -0.034 1.418 2.577
190 H ARG 26 H ARG 26 -0.837 4.771 5.024
191 HA ARG 26 HA ARG 26 1.033 6.406 6.584
192 HB2 ARG 26 HB2 ARG 26 -0.914 7.831 5.901
193 HB3 ARG 26 HB3 ARG 26 -1.968 6.695 6.735
194 HG2 ARG 26 HG2 ARG 26 -0.845 7.170 8.833
195 HG3 ARG 26 HG3 ARG 26 0.232 8.298 8.004
196 HD2 ARG 26 HD2 ARG 26 -1.777 9.580 7.302
197 HD3 ARG 26 HD3 ARG 26 -2.751 8.529 8.333
198 HE ARG 26 HE ARG 26 -0.507 10.031 9.496
199 HH11 ARG 26 HH11 ARG 26 -3.943 9.370 9.311
200 HH12 ARG 26 HH12 ARG 26 -4.338 10.321 10.713
201 HH21 ARG 26 HH22 ARG 26 -1.011 11.269 11.341
202 HH22 ARG 26 HH21 ARG 26 -2.667 11.405 11.865
203 H ASP 27 H ASP 27 1.249 5.828 8.678
204 HA ASP 27 HA ASP 27 0.889 3.189 9.430
205 HB2 ASP 27 HB2 ASP 27 2.472 4.775 10.494
206 HB3 ASP 27 HB3 ASP 27 1.120 5.591 11.259
207 H GLY 28 H GLY 28 -0.998 2.194 9.494
208 HA2 GLY 28 HA2 GLY 28 -2.832 1.574 10.839
209 HA3 GLY 28 HA3 GLY 28 -3.019 3.246 11.340
210 H ASP 29 H ASP 29 -2.581 3.538 8.138
211 HA ASP 29 HA ASP 29 -5.410 3.787 7.629
212 HB2 ASP 29 HB2 ASP 29 -3.776 5.380 6.645
213 HB3 ASP 29 HB3 ASP 29 -3.098 4.066 5.691
214 H ILE 30 H ILE 30 -6.638 2.529 6.225
215 HA ILE 30 HA ILE 30 -5.523 -0.138 5.771
216 HB ILE 30 HB ILE 30 -8.359 0.846 5.944
217 HG12 ILE 30 HG12 ILE 30 -8.410 -1.139 7.581
218 HG13 ILE 30 HG13 ILE 30 -6.659 -1.111 7.464
219 HG21 ILE 30 HG21 ILE 30 -7.513 -1.908 5.066
220 HG22 ILE 30 HG22 ILE 30 -8.198 -0.671 4.012
221 HG23 ILE 30 HG23 ILE 30 -9.167 -1.346 5.323
222 HD11 ILE 30 HD11 ILE 30 -7.526 0.072 9.433
223 HD12 ILE 30 HD12 ILE 30 -8.356 1.203 8.363
224 HD13 ILE 30 HD13 ILE 30 -6.595 1.115 8.362
225 H VAL 31 H VAL 31 -5.240 -0.947 3.812
226 HA VAL 31 HA VAL 31 -6.232 0.636 1.544
227 HB VAL 31 HB VAL 31 -3.523 -0.659 1.813
228 HG11 VAL 31 HG11 VAL 31 -3.165 -0.021 -0.558
229 HG12 VAL 31 HG12 VAL 31 -4.884 0.365 -0.682
230 HG13 VAL 31 HG13 VAL 31 -4.373 -1.292 -0.359
231 HG21 VAL 31 HG21 VAL 31 -2.711 1.557 1.277
232 HG22 VAL 31 HG22 VAL 31 -3.811 1.646 2.654
233 HG23 VAL 31 HG23 VAL 31 -4.365 2.131 1.047
234 H ASP 32 H ASP 32 -7.563 -0.389 0.349
235 HA ASP 32 HA ASP 32 -7.905 -3.264 0.575
236 HB2 ASP 32 HB2 ASP 32 -9.799 -1.557 0.510
237 HB3 ASP 32 HB3 ASP 32 -9.388 -1.315 -1.189
238 H VAL 33 H VAL 33 -6.781 -4.582 -0.719
239 HA VAL 33 HA VAL 33 -5.550 -3.477 -3.113
240 HB VAL 33 HB VAL 33 -3.996 -4.711 -1.856
241 HG11 VAL 33 HG11 VAL 33 -6.191 -6.669 -1.459
242 HG12 VAL 33 HG12 VAL 33 -5.060 -5.969 -0.288
243 HG13 VAL 33 HG13 VAL 33 -4.519 -7.226 -1.402
244 HG21 VAL 33 HG21 VAL 33 -4.948 -6.627 -3.966
245 HG22 VAL 33 HG22 VAL 33 -3.316 -6.498 -3.306
246 HG23 VAL 33 HG23 VAL 33 -3.987 -5.180 -4.273
247 H MET 34 H MET 34 -6.354 -3.699 -5.038
248 HA MET 34 HA MET 34 -8.642 -5.449 -5.421
249 HB2 MET 34 HB2 MET 34 -9.050 -4.249 -7.469
250 HB3 MET 34 HB3 MET 34 -8.760 -3.094 -6.173
251 HG2 MET 34 HG2 MET 34 -6.778 -2.397 -7.043
252 HG3 MET 34 HG3 MET 34 -6.459 -3.935 -7.840
253 HE1 MET 34 HE1 MET 34 -8.616 -3.807 -11.024
254 HE2 MET 34 HE2 MET 34 -9.016 -4.570 -9.484
255 HE3 MET 34 HE3 MET 34 -7.369 -4.664 -10.113
256 H GLU 35 H GLU 35 -5.338 -4.983 -6.563
257 HA GLU 35 HA GLU 35 -5.530 -7.635 -7.795
258 HB2 GLU 35 HB2 GLU 35 -5.717 -5.904 -9.555
259 HB3 GLU 35 HB3 GLU 35 -4.126 -5.307 -9.095
260 HG2 GLU 35 HG2 GLU 35 -3.980 -6.764 -11.027
261 HG3 GLU 35 HG3 GLU 35 -3.166 -7.474 -9.631
262 H LYS 36 H LYS 36 -3.829 -8.891 -7.559
263 HA LYS 36 HA LYS 36 -1.781 -7.892 -5.713
264 HB2 LYS 36 HB2 LYS 36 -2.998 -10.609 -6.104
265 HB3 LYS 36 HB3 LYS 36 -1.496 -10.380 -5.211
266 HG2 LYS 36 HG2 LYS 36 -2.532 -9.190 -3.513
267 HG3 LYS 36 HG3 LYS 36 -3.925 -8.782 -4.515
268 HD2 LYS 36 HD2 LYS 36 -3.315 -11.615 -3.808
269 HD3 LYS 36 HD3 LYS 36 -4.199 -10.576 -2.686
270 HE2 LYS 36 HE2 LYS 36 -5.877 -10.142 -4.404
271 HE3 LYS 36 HE3 LYS 36 -4.981 -11.139 -5.546
272 HZ1 LYS 36 HZ1 LYS 36 -5.460 -13.073 -4.316
273 HZ2 LYS 36 HZ2 LYS 36 -6.924 -12.228 -4.438
274 HZ3 LYS 36 HZ3 LYS 36 -6.047 -12.198 -2.990
275 H CYS 37 H CYS 37 0.021 -7.388 -6.703
276 HA CYS 37 HA CYS 37 0.753 -8.462 -9.245
277 HB2 CYS 37 HB2 CYS 37 2.443 -6.818 -7.356
278 HB3 CYS 37 HB3 CYS 37 2.652 -6.994 -9.098
279 HG CYS 37 HG CYS 37 1.368 -4.515 -7.800
280 H ASP 38 H ASP 38 2.444 -9.770 -9.752
281 HA ASP 38 HA ASP 38 2.946 -11.935 -8.004
282 HB2 ASP 38 HB2 ASP 38 2.900 -12.194 -10.431
283 HB3 ASP 38 HB3 ASP 38 4.288 -11.125 -10.595
284 H ASP 39 H ASP 39 4.548 -8.934 -8.519
285 HA ASP 39 HA ASP 39 7.112 -9.837 -7.547
286 HB2 ASP 39 HB2 ASP 39 6.886 -8.103 -9.309
287 HB3 ASP 39 HB3 ASP 39 6.150 -7.030 -8.127
288 H GLY 40 H GLY 40 4.217 -8.813 -6.071
289 HA2 GLY 40 HA2 GLY 40 4.149 -9.329 -3.690
290 HA3 GLY 40 HA3 GLY 40 5.745 -8.616 -3.549
291 H TRP 41 H TRP 41 5.079 -6.285 -5.191
292 HA TRP 41 HA TRP 41 3.691 -4.770 -3.143
293 HB2 TRP 41 HB2 TRP 41 4.536 -3.565 -5.744
294 HB3 TRP 41 HB3 TRP 41 4.514 -2.843 -4.142
295 HD1 TRP 41 HD1 TRP 41 6.885 -3.913 -6.606
296 HE1 TRP 41 HE1 TRP 41 9.193 -4.437 -5.601
297 HE3 TRP 41 HE3 TRP 41 5.585 -4.255 -1.648
298 HZ2 TRP 41 HZ2 TRP 41 10.312 -4.930 -3.072
299 HZ3 TRP 41 HZ3 TRP 41 7.344 -4.762 -0.018
300 HH2 TRP 41 HH2 TRP 41 9.660 -5.094 -0.712
301 H PHE 42 H PHE 42 1.580 -4.535 -3.169
302 HA PHE 42 HA PHE 42 0.129 -5.655 -5.427
303 HB2 PHE 42 HB2 PHE 42 -0.849 -4.935 -2.661
304 HB3 PHE 42 HB3 PHE 42 -1.733 -5.857 -3.871
305 HD1 PHE 42 HD1 PHE 42 -0.008 -7.851 -4.855
306 HD2 PHE 42 HD2 PHE 42 -0.169 -6.244 -0.915
307 HE1 PHE 42 HE1 PHE 42 0.942 -9.936 -3.967
308 HE2 PHE 42 HE2 PHE 42 0.790 -8.327 -0.026
309 HZ PHE 42 HZ PHE 42 1.346 -10.175 -1.552
310 H VAL 43 H VAL 43 -2.084 -4.696 -5.878
311 HA VAL 43 HA VAL 43 -1.836 -1.768 -6.067
312 HB VAL 43 HB VAL 43 -2.972 -3.823 -7.914
313 HG11 VAL 43 HG11 VAL 43 -3.879 -0.940 -7.916
314 HG12 VAL 43 HG12 VAL 43 -4.881 -2.301 -7.414
315 HG13 VAL 43 HG13 VAL 43 -4.321 -2.188 -9.084
316 HG21 VAL 43 HG21 VAL 43 -1.883 -2.399 -9.561
317 HG22 VAL 43 HG22 VAL 43 -0.764 -2.823 -8.258
318 HG23 VAL 43 HG23 VAL 43 -1.532 -1.235 -8.285
319 H GLY 44 H GLY 44 -3.295 -0.515 -5.116
320 HA2 GLY 44 HA2 GLY 44 -5.826 -1.599 -4.164
321 HA3 GLY 44 HA3 GLY 44 -4.627 -1.310 -2.915
322 H THR 45 H THR 45 -6.588 0.036 -2.299
323 HA THR 45 HA THR 45 -6.161 2.772 -3.272
324 HB THR 45 HB THR 45 -8.815 1.483 -2.638
325 HG1 THR 45 HG1 THR 45 -7.450 2.055 -4.996
326 HG21 THR 45 HG21 THR 45 -9.745 3.677 -3.475
327 HG22 THR 45 HG22 THR 45 -8.113 4.334 -3.327
328 HG23 THR 45 HG23 THR 45 -8.961 3.738 -1.897
329 H SER 46 H SER 46 -6.155 4.305 -1.715
330 HA SER 46 HA SER 46 -5.672 3.471 0.977
331 HB2 SER 46 HB2 SER 46 -4.409 5.312 0.028
332 HB3 SER 46 HB3 SER 46 -5.894 6.199 -0.310
333 HG SER 46 HG SER 46 -4.958 5.484 2.299
334 H ARG 47 H ARG 47 -7.048 3.497 2.679
335 HA ARG 47 HA ARG 47 -9.836 3.980 2.339
336 HB2 ARG 47 HB2 ARG 47 -8.940 2.347 3.943
337 HB3 ARG 47 HB3 ARG 47 -8.177 3.645 4.842
338 HG2 ARG 47 HG2 ARG 47 -10.399 4.562 5.359
339 HG3 ARG 47 HG3 ARG 47 -11.133 3.193 4.513
340 HD2 ARG 47 HD2 ARG 47 -10.114 1.642 6.048
341 HD3 ARG 47 HD3 ARG 47 -9.229 2.945 6.824
342 HE ARG 47 HE ARG 47 -12.175 2.759 6.914
343 HH11 ARG 47 HH11 ARG 47 -9.081 3.274 8.460
344 HH12 ARG 47 HH12 ARG 47 -9.759 3.569 10.026
345 HH21 ARG 47 HH22 ARG 47 -13.086 3.130 8.989
346 HH22 ARG 47 HH21 ARG 47 -12.029 3.484 10.334
347 H ARG 48 H ARG 48 -7.142 5.826 3.547
348 HA ARG 48 HA ARG 48 -8.705 7.808 4.889
349 HB2 ARG 48 HB2 ARG 48 -6.401 7.208 5.543
350 HB3 ARG 48 HB3 ARG 48 -5.808 7.857 4.022
351 HG2 ARG 48 HG2 ARG 48 -6.753 10.074 4.718
352 HG3 ARG 48 HG3 ARG 48 -7.038 9.359 6.307
353 HD2 ARG 48 HD2 ARG 48 -4.659 8.776 6.452
354 HD3 ARG 48 HD3 ARG 48 -4.392 9.556 4.895
355 HE ARG 48 HE ARG 48 -5.592 11.230 6.941
356 HH11 ARG 48 HH11 ARG 48 -2.667 10.221 5.302
357 HH12 ARG 48 HH12 ARG 48 -1.706 11.536 5.905
358 HH21 ARG 48 HH22 ARG 48 -4.340 12.973 7.749
359 HH22 ARG 48 HH21 ARG 48 -2.652 13.092 7.315
360 H THR 49 H THR 49 -6.866 7.773 1.833
361 HA THR 49 HA THR 49 -8.103 10.368 1.204
362 HB THR 49 HB THR 49 -5.867 10.875 1.307
363 HG1 THR 49 HG1 THR 49 -6.531 10.194 -1.350
364 HG21 THR 49 HG21 THR 49 -4.045 9.445 0.512
365 HG22 THR 49 HG22 THR 49 -5.226 8.231 0.024
366 HG23 THR 49 HG23 THR 49 -5.038 8.642 1.729
367 H LYS 50 H LYS 50 -8.164 7.159 0.364
368 HA LYS 50 HA LYS 50 -9.209 5.977 -1.245
369 HB2 LYS 50 HB2 LYS 50 -10.527 8.584 -1.985
370 HB3 LYS 50 HB3 LYS 50 -11.083 6.977 -2.413
371 HG2 LYS 50 HG2 LYS 50 -11.099 8.301 0.278
372 HG3 LYS 50 HG3 LYS 50 -12.461 7.686 -0.650
373 HD2 LYS 50 HD2 LYS 50 -10.338 6.102 0.778
374 HD3 LYS 50 HD3 LYS 50 -12.054 6.183 1.163
375 HE2 LYS 50 HE2 LYS 50 -10.805 4.960 -1.283
376 HE3 LYS 50 HE3 LYS 50 -11.523 4.093 0.068
377 HZ1 LYS 50 HZ1 LYS 50 -13.662 5.207 -0.509
378 HZ2 LYS 50 HZ2 LYS 50 -13.093 4.127 -1.689
379 HZ3 LYS 50 HZ3 LYS 50 -12.923 5.796 -1.920
380 H GLN 51 H GLN 51 -6.638 7.056 -1.953
381 HA GLN 51 HA GLN 51 -6.974 7.615 -4.793
382 HB2 GLN 51 HB2 GLN 51 -4.296 7.566 -4.539
383 HB3 GLN 51 HB3 GLN 51 -5.271 9.004 -4.305
384 HG2 GLN 51 HG2 GLN 51 -5.159 8.774 -1.935
385 HG3 GLN 51 HG3 GLN 51 -4.390 7.191 -2.080
386 HE21 GLN 51 HE22 GLN 51 -3.490 9.764 -0.839
387 HE22 GLN 51 HE21 GLN 51 -1.942 10.082 -1.543
388 H PHE 52 H PHE 52 -5.741 6.379 -6.356
389 HA PHE 52 HA PHE 52 -5.657 3.550 -5.541
390 HB2 PHE 52 HB2 PHE 52 -7.638 3.839 -6.811
391 HB3 PHE 52 HB3 PHE 52 -6.820 4.834 -8.008
392 HD1 PHE 52 HD2 PHE 52 -6.674 1.388 -6.582
393 HD2 PHE 52 HD1 PHE 52 -6.245 3.878 -10.004
394 HE1 PHE 52 HE2 PHE 52 -6.312 -0.598 -7.979
395 HE2 PHE 52 HE1 PHE 52 -5.876 1.894 -11.407
396 HZ PHE 52 HZ PHE 52 -5.909 -0.348 -10.396
397 H GLY 53 H GLY 53 -3.895 2.439 -6.021
398 HA2 GLY 53 HA2 GLY 53 -2.361 2.714 -8.360
399 HA3 GLY 53 HA3 GLY 53 -1.547 3.587 -7.064
400 H THR 54 H THR 54 0.173 2.131 -7.192
401 HA THR 54 HA THR 54 -0.394 -0.544 -6.123
402 HB THR 54 HB THR 54 0.920 -0.695 -8.104
403 HG1 THR 54 HG1 THR 54 1.904 -1.426 -5.733
404 HG21 THR 54 HG21 THR 54 3.248 0.481 -8.040
405 HG22 THR 54 HG22 THR 54 2.441 1.562 -6.899
406 HG23 THR 54 HG23 THR 54 1.813 1.381 -8.540
407 H PHE 55 H PHE 55 0.243 -1.084 -4.147
408 HA PHE 55 HA PHE 55 1.967 0.803 -2.714
409 HB2 PHE 55 HB2 PHE 55 0.662 0.519 -0.703
410 HB3 PHE 55 HB3 PHE 55 -0.417 1.001 -1.994
411 HD1 PHE 55 HD1 PHE 55 -1.655 -0.927 -3.230
412 HD2 PHE 55 HD2 PHE 55 0.143 -1.319 0.605
413 HE1 PHE 55 HE1 PHE 55 -3.070 -2.888 -2.770
414 HE2 PHE 55 HE2 PHE 55 -1.268 -3.278 1.069
415 HZ PHE 55 HZ PHE 55 -2.875 -4.066 -0.618
416 HA PRO 56 HA PRO 56 4.547 -2.712 -2.084
417 HB2 PRO 56 HB3 PRO 56 5.385 -1.247 0.351
418 HB3 PRO 56 HB2 PRO 56 6.360 -1.827 -1.004
419 HG2 PRO 56 HG2 PRO 56 5.818 0.772 -0.695
420 HG3 PRO 56 HG3 PRO 56 5.904 0.029 -2.301
421 HD2 PRO 56 HD2 PRO 56 3.508 0.818 -0.699
422 HD3 PRO 56 HD3 PRO 56 3.778 0.919 -2.451
423 H GLY 57 H GLY 57 3.612 -4.529 -1.355
424 HA2 GLY 57 HA2 GLY 57 1.864 -4.646 0.893
425 HA3 GLY 57 HA3 GLY 57 2.479 -6.014 -0.020
426 H ASN 58 H ASN 58 4.731 -3.802 1.309
427 HA ASN 58 HA ASN 58 5.660 -5.839 3.194
428 HB2 ASN 58 HB2 ASN 58 7.105 -4.742 1.334
429 HB3 ASN 58 HB3 ASN 58 7.142 -3.341 2.399
430 HD21 ASN 58 HD22 ASN 58 7.212 -4.944 4.856
431 HD22 ASN 58 HD21 ASN 58 8.807 -5.612 4.931
432 H TYR 59 H TYR 59 4.202 -2.733 2.955
433 HA TYR 59 HA TYR 59 4.811 -2.135 5.775
434 HB2 TYR 59 HB2 TYR 59 3.742 -0.243 3.675
435 HB3 TYR 59 HB3 TYR 59 4.313 0.179 5.282
436 HD1 TYR 59 HD2 TYR 59 6.855 -0.678 5.720
437 HD2 TYR 59 HD1 TYR 59 5.134 0.201 1.931
438 HE1 TYR 59 HE2 TYR 59 9.104 -0.329 4.782
439 HE2 TYR 59 HE1 TYR 59 7.363 0.552 0.987
440 HH TYR 59 HH TYR 59 10.246 -0.306 2.706
441 H VAL 60 H VAL 60 2.729 -3.958 4.672
442 HA VAL 60 HA VAL 60 0.478 -2.832 6.121
443 HB VAL 60 HB VAL 60 -1.141 -3.524 4.356
444 HG11 VAL 60 HG11 VAL 60 0.833 -1.522 3.265
445 HG12 VAL 60 HG12 VAL 60 -0.281 -1.167 4.583
446 HG13 VAL 60 HG13 VAL 60 -0.909 -1.588 2.988
447 HG21 VAL 60 HG21 VAL 60 1.375 -4.001 2.772
448 HG22 VAL 60 HG22 VAL 60 -0.214 -3.796 2.033
449 HG23 VAL 60 HG23 VAL 60 0.077 -5.135 3.135
450 H LYS 61 H LYS 61 -1.063 -4.474 6.733
451 HA LYS 61 HA LYS 61 0.078 -7.196 6.672
452 HB2 LYS 61 HB2 LYS 61 -1.290 -7.238 9.001
453 HB3 LYS 61 HB3 LYS 61 0.422 -6.864 8.881
454 HG2 LYS 61 HG2 LYS 61 0.040 -4.557 9.081
455 HG3 LYS 61 HG3 LYS 61 -1.683 -4.736 8.765
456 HD2 LYS 61 HD2 LYS 61 -1.223 -4.270 11.111
457 HD3 LYS 61 HD3 LYS 61 -1.992 -5.839 10.902
458 HE2 LYS 61 HE2 LYS 61 0.987 -5.498 11.193
459 HE3 LYS 61 HE3 LYS 61 -0.083 -5.684 12.577
460 HZ1 LYS 61 HZ1 LYS 61 0.634 -7.824 12.168
461 HZ2 LYS 61 HZ2 LYS 61 0.587 -7.644 10.480
462 HZ3 LYS 61 HZ3 LYS 61 -0.857 -7.795 11.359
463 HA PRO 62 HA PRO 62 -3.804 -8.494 4.966
464 HB2 PRO 62 HB3 PRO 62 -3.169 -11.067 6.275
465 HB3 PRO 62 HB2 PRO 62 -3.483 -10.721 4.573
466 HG2 PRO 62 HG2 PRO 62 -1.017 -11.267 5.439
467 HG3 PRO 62 HG3 PRO 62 -1.302 -10.062 4.170
468 HD2 PRO 62 HD2 PRO 62 -0.695 -9.653 7.067
469 HD3 PRO 62 HD3 PRO 62 -0.126 -8.743 5.652
470 H LEU 63 H LEU 63 -5.729 -8.089 5.801
471 HA LEU 63 HA LEU 63 -6.086 -8.372 8.683
472 HB2 LEU 63 HB2 LEU 63 -7.707 -6.887 6.617
473 HB3 LEU 63 HB3 LEU 63 -8.074 -6.926 8.328
474 HG LEU 63 HG LEU 63 -5.593 -5.735 7.091
475 HD11 LEU 63 HD11 LEU 63 -7.929 -4.403 8.447
476 HD12 LEU 63 HD12 LEU 63 -7.689 -4.487 6.703
477 HD13 LEU 63 HD13 LEU 63 -6.535 -3.615 7.711
478 HD21 LEU 63 HD21 LEU 63 -6.520 -5.814 9.961
479 HD22 LEU 63 HD22 LEU 63 -5.130 -4.914 9.353
480 HD23 LEU 63 HD23 LEU 63 -5.136 -6.676 9.293
481 H TYR 64 H TYR 64 -8.844 -8.413 8.755
482 HA TYR 64 HA TYR 64 -9.374 -11.123 8.894
483 HB2 TYR 64 HB2 TYR 64 -11.552 -9.092 8.538
484 HB3 TYR 64 HB3 TYR 64 -11.517 -10.497 9.595
485 HD1 TYR 64 HD1 TYR 64 -9.396 -10.356 11.329
486 HD2 TYR 64 HD2 TYR 64 -11.458 -7.059 9.607
487 HE1 TYR 64 HE1 TYR 64 -8.630 -8.920 13.173
488 HE2 TYR 64 HE2 TYR 64 -10.699 -5.614 11.447
489 HH TYR 64 HH TYR 64 -9.894 -5.777 13.724
490 H LEU 65 H LEU 65 -10.505 -8.788 6.509
491 HA LEU 65 HA LEU 65 -11.392 -10.938 4.753
492 HB2 LEU 65 HB2 LEU 65 -11.737 -7.945 4.636
493 HB3 LEU 65 HB3 LEU 65 -12.178 -8.997 3.311
494 HG LEU 65 HG LEU 65 -14.177 -8.529 4.472
495 HD11 LEU 65 HD11 LEU 65 -13.964 -10.849 3.814
496 HD12 LEU 65 HD12 LEU 65 -14.883 -10.715 5.314
497 HD13 LEU 65 HD13 LEU 65 -13.198 -11.236 5.355
498 HD21 LEU 65 HD21 LEU 65 -12.775 -9.308 7.023
499 HD22 LEU 65 HD22 LEU 65 -14.472 -8.857 6.872
500 HD23 LEU 65 HD23 LEU 65 -13.211 -7.670 6.537
Start of MODEL 6
1 H1 GLN 1 H1 GLN 1 -21.331 0.030 0.031
2 H2 GLN 1 H2 GLN 1 -19.850 -0.253 0.809
3 H3 GLN 1 H3 GLN 1 -21.210 0.183 1.718
4 HA GLN 1 HA GLN 1 -20.683 -2.188 1.885
5 HB2 GLN 1 HB2 GLN 1 -23.269 -1.659 0.408
6 HB3 GLN 1 HB3 GLN 1 -22.934 -3.009 1.482
7 HG2 GLN 1 HG2 GLN 1 -22.690 -1.410 3.349
8 HG3 GLN 1 HG3 GLN 1 -23.136 -0.106 2.252
9 HE21 GLN 1 HE22 GLN 1 -24.253 -2.841 4.060
10 HE22 GLN 1 HE21 GLN 1 -25.949 -2.572 3.814
11 H THR 2 H THR 2 -18.955 -1.873 -0.069
12 HA THR 2 HA THR 2 -19.628 -4.051 -1.886
13 HB THR 2 HB THR 2 -20.248 -2.021 -3.137
14 HG1 THR 2 HG1 THR 2 -18.107 -3.646 -3.955
15 HG21 THR 2 HG21 THR 2 -18.535 -0.410 -3.820
16 HG22 THR 2 HG22 THR 2 -17.356 -1.233 -2.800
17 HG23 THR 2 HG23 THR 2 -18.744 -0.428 -2.070
18 H SER 3 H SER 3 -17.804 -3.295 0.431
19 HA SER 3 HA SER 3 -15.259 -4.076 -0.825
20 HB2 SER 3 HB2 SER 3 -15.692 -2.620 1.801
21 HB3 SER 3 HB3 SER 3 -14.133 -3.029 1.086
22 HG SER 3 HG SER 3 -14.925 -1.741 -0.785
23 H GLN 4 H GLN 4 -15.495 -6.263 -0.743
24 HA GLN 4 HA GLN 4 -16.187 -7.439 1.861
25 HB2 GLN 4 HB2 GLN 4 -17.621 -7.736 -0.363
26 HB3 GLN 4 HB3 GLN 4 -16.443 -9.005 -0.666
27 HG2 GLN 4 HG2 GLN 4 -18.336 -9.988 0.382
28 HG3 GLN 4 HG3 GLN 4 -17.012 -9.981 1.547
29 HE21 GLN 4 HE22 GLN 4 -19.886 -10.137 1.995
30 HE22 GLN 4 HE21 GLN 4 -20.293 -8.788 3.004
31 H ASP 5 H ASP 5 -15.450 -10.084 0.517
32 HA ASP 5 HA ASP 5 -12.782 -10.237 1.504
33 HB2 ASP 5 HB2 ASP 5 -14.488 -12.196 -0.039
34 HB3 ASP 5 HB3 ASP 5 -12.878 -12.577 0.563
35 H LEU 6 H LEU 6 -11.863 -8.554 0.171
36 HA LEU 6 HA LEU 6 -10.971 -9.593 -2.436
37 HB2 LEU 6 HB2 LEU 6 -12.557 -7.697 -2.626
38 HB3 LEU 6 HB3 LEU 6 -11.478 -6.722 -1.653
39 HG LEU 6 HG LEU 6 -9.747 -6.948 -3.445
40 HD11 LEU 6 HD11 LEU 6 -12.022 -8.193 -4.983
41 HD12 LEU 6 HD12 LEU 6 -10.556 -9.015 -4.446
42 HD13 LEU 6 HD13 LEU 6 -10.455 -7.727 -5.647
43 HD21 LEU 6 HD21 LEU 6 -11.194 -4.972 -3.287
44 HD22 LEU 6 HD22 LEU 6 -12.384 -5.766 -4.319
45 HD23 LEU 6 HD23 LEU 6 -10.794 -5.354 -4.962
46 H PHE 7 H PHE 7 -10.103 -9.235 0.574
47 HA PHE 7 HA PHE 7 -8.225 -9.025 1.765
48 HB2 PHE 7 HB2 PHE 7 -7.096 -9.095 -0.968
49 HB3 PHE 7 HB3 PHE 7 -6.061 -8.431 0.296
50 HD1 PHE 7 HD2 PHE 7 -5.395 -9.838 2.199
51 HD2 PHE 7 HD1 PHE 7 -7.628 -11.413 -1.062
52 HE1 PHE 7 HE2 PHE 7 -4.806 -12.119 2.903
53 HE2 PHE 7 HE1 PHE 7 -7.044 -13.698 -0.363
54 HZ PHE 7 HZ PHE 7 -5.631 -14.053 1.621
55 H SER 8 H SER 8 -8.476 -7.358 2.978
56 HA SER 8 HA SER 8 -7.567 -4.748 1.953
57 HB2 SER 8 HB2 SER 8 -9.330 -5.360 4.348
58 HB3 SER 8 HB3 SER 8 -8.834 -3.751 3.823
59 HG SER 8 HG SER 8 -10.237 -3.806 2.230
60 H TYR 9 H TYR 9 -5.734 -3.904 2.857
61 HA TYR 9 HA TYR 9 -4.672 -5.359 5.188
62 HB2 TYR 9 HB2 TYR 9 -3.066 -3.741 3.203
63 HB3 TYR 9 HB3 TYR 9 -2.441 -4.723 4.513
64 HD1 TYR 9 HD2 TYR 9 -4.077 -7.221 4.096
65 HD2 TYR 9 HD1 TYR 9 -2.085 -4.673 1.357
66 HE1 TYR 9 HE2 TYR 9 -3.805 -9.112 2.543
67 HE2 TYR 9 HE1 TYR 9 -1.794 -6.542 -0.206
68 HH TYR 9 HH TYR 9 -3.406 -9.549 0.208
69 H GLN 10 H GLN 10 -3.650 -4.158 6.823
70 HA GLN 10 HA GLN 10 -4.282 -1.280 6.788
71 HB2 GLN 10 HB2 GLN 10 -5.271 -2.650 8.664
72 HB3 GLN 10 HB3 GLN 10 -3.632 -2.956 9.218
73 HG2 GLN 10 HG2 GLN 10 -3.340 -0.445 9.312
74 HG3 GLN 10 HG3 GLN 10 -5.077 -0.331 9.081
75 HE21 GLN 10 HE22 GLN 10 -5.373 0.627 11.088
76 HE22 GLN 10 HE21 GLN 10 -5.229 -0.261 12.572
77 H ALA 11 H ALA 11 -2.641 0.137 6.955
78 HA ALA 11 HA ALA 11 -0.037 -0.762 6.289
79 HB1 ALA 11 HB1 ALA 11 0.545 1.632 6.456
80 HB2 ALA 11 HB2 ALA 11 -1.056 1.945 7.136
81 HB3 ALA 11 HB3 ALA 11 -0.898 1.346 5.482
82 H LEU 12 H LEU 12 1.712 -1.056 7.482
83 HA LEU 12 HA LEU 12 1.452 -1.268 10.334
84 HB2 LEU 12 HB2 LEU 12 3.726 -1.722 8.405
85 HB3 LEU 12 HB3 LEU 12 3.923 -1.888 10.140
86 HG LEU 12 HG LEU 12 1.682 -3.432 9.043
87 HD11 LEU 12 HD11 LEU 12 4.505 -3.982 8.182
88 HD12 LEU 12 HD12 LEU 12 3.075 -3.758 7.166
89 HD13 LEU 12 HD13 LEU 12 3.227 -5.194 8.170
90 HD21 LEU 12 HD21 LEU 12 4.051 -4.142 10.769
91 HD22 LEU 12 HD22 LEU 12 2.633 -5.152 10.493
92 HD23 LEU 12 HD23 LEU 12 2.474 -3.621 11.357
93 H TYR 13 H TYR 13 3.049 0.865 8.058
94 HA TYR 13 HA TYR 13 3.082 2.961 9.983
95 HB2 TYR 13 HB2 TYR 13 5.548 3.398 9.788
96 HB3 TYR 13 HB3 TYR 13 5.108 2.000 10.748
97 HD1 TYR 13 HD1 TYR 13 5.355 -0.296 9.704
98 HD2 TYR 13 HD2 TYR 13 7.040 3.210 7.990
99 HE1 TYR 13 HE1 TYR 13 6.954 -1.685 8.456
100 HE2 TYR 13 HE2 TYR 13 8.637 1.833 6.723
101 HH TYR 13 HH TYR 13 9.667 -0.376 6.855
102 H SER 14 H SER 14 4.274 4.933 8.973
103 HA SER 14 HA SER 14 2.805 5.416 6.565
104 HB2 SER 14 HB2 SER 14 4.800 7.197 7.990
105 HB3 SER 14 HB3 SER 14 3.624 7.707 6.774
106 HG SER 14 HG SER 14 3.286 7.402 9.420
107 H TYR 15 H TYR 15 3.532 5.755 4.493
108 HA TYR 15 HA TYR 15 6.434 5.574 4.013
109 HB2 TYR 15 HB2 TYR 15 5.577 3.318 3.619
110 HB3 TYR 15 HB3 TYR 15 4.352 3.953 2.539
111 HD1 TYR 15 HD2 TYR 15 8.049 3.685 2.927
112 HD2 TYR 15 HD1 TYR 15 4.760 4.144 0.272
113 HE1 TYR 15 HE2 TYR 15 9.566 3.414 1.008
114 HE2 TYR 15 HE1 TYR 15 6.263 3.869 -1.652
115 HH TYR 15 HH TYR 15 8.545 4.034 -2.246
116 H ILE 16 H ILE 16 7.201 6.786 2.406
117 HA ILE 16 HA ILE 16 5.301 8.566 1.050
118 HB ILE 16 HB ILE 16 8.257 8.875 1.592
119 HG12 ILE 16 HG12 ILE 16 6.890 9.216 3.575
120 HG13 ILE 16 HG13 ILE 16 7.532 10.761 3.023
121 HG21 ILE 16 HG21 ILE 16 6.377 10.784 0.204
122 HG22 ILE 16 HG22 ILE 16 7.685 9.881 -0.555
123 HG23 ILE 16 HG23 ILE 16 8.052 11.124 0.638
124 HD11 ILE 16 HD11 ILE 16 5.388 11.302 2.008
125 HD12 ILE 16 HD12 ILE 16 5.201 10.942 3.725
126 HD13 ILE 16 HD13 ILE 16 4.745 9.741 2.517
127 HA PRO 17 HA PRO 17 6.270 6.066 -2.552
128 HB2 PRO 17 HB3 PRO 17 4.486 7.998 -3.877
129 HB3 PRO 17 HB2 PRO 17 4.329 6.245 -3.739
130 HG2 PRO 17 HG2 PRO 17 2.728 7.911 -2.388
131 HG3 PRO 17 HG3 PRO 17 3.277 6.379 -1.679
132 HD2 PRO 17 HD2 PRO 17 4.292 9.161 -1.205
133 HD3 PRO 17 HD3 PRO 17 3.984 7.860 -0.034
134 H GLN 18 H GLN 18 7.804 6.293 -4.052
135 HA GLN 18 HA GLN 18 8.985 8.909 -4.477
136 HB2 GLN 18 HB2 GLN 18 9.860 6.238 -5.576
137 HB3 GLN 18 HB3 GLN 18 10.807 7.720 -5.536
138 HG2 GLN 18 HG2 GLN 18 9.834 6.301 -3.070
139 HG3 GLN 18 HG3 GLN 18 11.407 6.012 -3.810
140 HE21 GLN 18 HE22 GLN 18 12.481 6.691 -1.967
141 HE22 GLN 18 HE21 GLN 18 12.587 8.364 -1.529
142 H ASN 19 H ASN 19 6.660 7.010 -5.805
143 HA ASN 19 HA ASN 19 6.838 8.352 -8.423
144 HB2 ASN 19 HB2 ASN 19 5.632 5.680 -7.687
145 HB3 ASN 19 HB3 ASN 19 5.533 6.411 -9.289
146 HD21 ASN 19 HD22 ASN 19 7.519 4.776 -6.986
147 HD22 ASN 19 HD21 ASN 19 8.857 4.466 -8.046
148 H ASP 20 H ASP 20 4.855 9.212 -9.227
149 HA ASP 20 HA ASP 20 2.981 9.889 -7.121
150 HB2 ASP 20 HB2 ASP 20 2.012 11.457 -8.650
151 HB3 ASP 20 HB3 ASP 20 3.760 11.573 -8.812
152 H ASP 21 H ASP 21 3.335 7.406 -9.264
153 HA ASP 21 HA ASP 21 0.524 6.842 -9.701
154 HB2 ASP 21 HB2 ASP 21 2.342 6.248 -11.335
155 HB3 ASP 21 HB3 ASP 21 2.937 5.074 -10.169
156 H GLU 22 H GLU 22 2.671 6.497 -7.167
157 HA GLU 22 HA GLU 22 1.607 3.958 -6.220
158 HB2 GLU 22 HB2 GLU 22 3.847 5.731 -5.274
159 HB3 GLU 22 HB3 GLU 22 3.278 4.361 -4.332
160 HG2 GLU 22 HG2 GLU 22 3.856 2.844 -6.102
161 HG3 GLU 22 HG3 GLU 22 4.319 4.181 -7.148
162 H LEU 23 H LEU 23 1.144 3.831 -3.853
163 HA LEU 23 HA LEU 23 -0.856 5.884 -3.257
164 HB2 LEU 23 HB2 LEU 23 -1.236 3.291 -3.432
165 HB3 LEU 23 HB3 LEU 23 -0.569 3.268 -1.814
166 HG LEU 23 HG LEU 23 -3.087 3.278 -1.961
167 HD11 LEU 23 HD11 LEU 23 -1.817 5.570 -0.482
168 HD12 LEU 23 HD12 LEU 23 -1.940 3.906 0.091
169 HD13 LEU 23 HD13 LEU 23 -3.400 4.867 -0.147
170 HD21 LEU 23 HD21 LEU 23 -3.413 4.760 -3.788
171 HD22 LEU 23 HD22 LEU 23 -2.545 6.054 -2.963
172 HD23 LEU 23 HD23 LEU 23 -4.107 5.514 -2.352
173 H GLU 24 H GLU 24 -0.781 7.130 -1.461
174 HA GLU 24 HA GLU 24 1.667 7.160 0.049
175 HB2 GLU 24 HB2 GLU 24 -0.626 8.939 -0.307
176 HB3 GLU 24 HB3 GLU 24 -0.030 8.888 1.349
177 HG2 GLU 24 HG2 GLU 24 2.259 9.296 0.421
178 HG3 GLU 24 HG3 GLU 24 1.484 9.612 -1.135
179 H LEU 25 H LEU 25 2.015 5.842 1.655
180 HA LEU 25 HA LEU 25 -0.265 4.615 2.983
181 HB2 LEU 25 HB2 LEU 25 2.665 3.977 3.209
182 HB3 LEU 25 HB3 LEU 25 1.357 3.050 3.913
183 HG LEU 25 HG LEU 25 1.781 3.446 0.950
184 HD11 LEU 25 HD11 LEU 25 2.390 1.099 2.734
185 HD12 LEU 25 HD12 LEU 25 3.552 2.095 1.855
186 HD13 LEU 25 HD13 LEU 25 2.427 1.064 0.970
187 HD21 LEU 25 HD21 LEU 25 0.095 1.666 0.741
188 HD22 LEU 25 HD22 LEU 25 -0.551 3.113 1.515
189 HD23 LEU 25 HD23 LEU 25 -0.137 1.704 2.489
190 H ARG 26 H ARG 26 -0.829 5.022 5.001
191 HA ARG 26 HA ARG 26 0.925 6.725 6.630
192 HB2 ARG 26 HB2 ARG 26 -1.037 7.978 5.987
193 HB3 ARG 26 HB3 ARG 26 -2.103 6.686 6.517
194 HG2 ARG 26 HG2 ARG 26 -1.128 7.061 8.836
195 HG3 ARG 26 HG3 ARG 26 -0.441 8.550 8.180
196 HD2 ARG 26 HD2 ARG 26 -2.634 9.366 7.605
197 HD3 ARG 26 HD3 ARG 26 -3.366 7.838 8.098
198 HE ARG 26 HE ARG 26 -2.040 9.714 9.967
199 HH11 ARG 26 HH11 ARG 26 -4.601 7.457 9.191
200 HH12 ARG 26 HH12 ARG 26 -5.326 7.528 10.767
201 HH21 ARG 26 HH22 ARG 26 -2.997 9.828 12.042
202 HH22 ARG 26 HH21 ARG 26 -4.409 8.871 12.396
203 H ASP 27 H ASP 27 1.221 6.184 8.681
204 HA ASP 27 HA ASP 27 1.122 3.550 9.548
205 HB2 ASP 27 HB2 ASP 27 2.467 5.474 10.501
206 HB3 ASP 27 HB3 ASP 27 1.010 5.979 11.347
207 H GLY 28 H GLY 28 -0.759 2.415 9.577
208 HA2 GLY 28 HA2 GLY 28 -2.545 1.694 10.972
209 HA3 GLY 28 HA3 GLY 28 -2.812 3.361 11.453
210 H ASP 29 H ASP 29 -2.412 3.591 8.232
211 HA ASP 29 HA ASP 29 -5.243 3.851 7.757
212 HB2 ASP 29 HB2 ASP 29 -3.610 5.414 6.748
213 HB3 ASP 29 HB3 ASP 29 -2.940 4.090 5.804
214 H ILE 30 H ILE 30 -6.462 2.705 6.173
215 HA ILE 30 HA ILE 30 -5.462 -0.018 5.739
216 HB ILE 30 HB ILE 30 -8.266 1.065 5.902
217 HG12 ILE 30 HG12 ILE 30 -8.363 -0.949 7.526
218 HG13 ILE 30 HG13 ILE 30 -6.609 -0.883 7.456
219 HG21 ILE 30 HG21 ILE 30 -7.454 -1.693 4.997
220 HG22 ILE 30 HG22 ILE 30 -8.183 -0.439 3.992
221 HG23 ILE 30 HG23 ILE 30 -9.103 -1.152 5.318
222 HD11 ILE 30 HD11 ILE 30 -7.324 0.316 9.379
223 HD12 ILE 30 HD12 ILE 30 -8.479 1.253 8.430
224 HD13 ILE 30 HD13 ILE 30 -6.749 1.484 8.191
225 H VAL 31 H VAL 31 -5.261 -0.841 3.765
226 HA VAL 31 HA VAL 31 -6.274 0.728 1.487
227 HB VAL 31 HB VAL 31 -3.560 -0.596 1.671
228 HG11 VAL 31 HG11 VAL 31 -4.581 0.906 -0.716
229 HG12 VAL 31 HG12 VAL 31 -4.871 -0.826 -0.549
230 HG13 VAL 31 HG13 VAL 31 -3.216 -0.209 -0.606
231 HG21 VAL 31 HG21 VAL 31 -2.671 1.607 1.322
232 HG22 VAL 31 HG22 VAL 31 -3.788 1.665 2.687
233 HG23 VAL 31 HG23 VAL 31 -4.292 2.267 1.103
234 H ASP 32 H ASP 32 -7.614 -0.411 0.306
235 HA ASP 32 HA ASP 32 -7.764 -3.301 0.587
236 HB2 ASP 32 HB2 ASP 32 -9.391 -1.570 -1.280
237 HB3 ASP 32 HB3 ASP 32 -9.808 -3.159 -0.645
238 H VAL 33 H VAL 33 -6.587 -4.598 -0.684
239 HA VAL 33 HA VAL 33 -5.346 -3.472 -3.058
240 HB VAL 33 HB VAL 33 -3.860 -4.744 -1.704
241 HG11 VAL 33 HG11 VAL 33 -6.062 -6.696 -1.563
242 HG12 VAL 33 HG12 VAL 33 -4.918 -6.156 -0.323
243 HG13 VAL 33 HG13 VAL 33 -4.414 -7.320 -1.551
244 HG21 VAL 33 HG21 VAL 33 -4.604 -6.470 -4.053
245 HG22 VAL 33 HG22 VAL 33 -3.043 -6.425 -3.232
246 HG23 VAL 33 HG23 VAL 33 -3.610 -5.014 -4.130
247 H MET 34 H MET 34 -6.114 -3.708 -5.038
248 HA MET 34 HA MET 34 -8.368 -5.540 -5.403
249 HB2 MET 34 HB2 MET 34 -9.211 -4.121 -7.046
250 HB3 MET 34 HB3 MET 34 -8.551 -3.028 -5.846
251 HG2 MET 34 HG2 MET 34 -7.792 -2.048 -7.746
252 HG3 MET 34 HG3 MET 34 -6.435 -3.116 -7.392
253 HE1 MET 34 HE1 MET 34 -6.817 -1.843 -10.211
254 HE2 MET 34 HE2 MET 34 -6.614 -3.207 -11.314
255 HE3 MET 34 HE3 MET 34 -5.541 -3.027 -9.925
256 H GLU 35 H GLU 35 -5.206 -4.690 -6.708
257 HA GLU 35 HA GLU 35 -5.325 -7.198 -8.244
258 HB2 GLU 35 HB2 GLU 35 -5.293 -5.119 -9.657
259 HB3 GLU 35 HB3 GLU 35 -3.680 -4.806 -9.037
260 HG2 GLU 35 HG2 GLU 35 -2.923 -6.931 -9.945
261 HG3 GLU 35 HG3 GLU 35 -4.544 -7.260 -10.545
262 H LYS 36 H LYS 36 -3.676 -8.545 -8.028
263 HA LYS 36 HA LYS 36 -1.724 -7.824 -5.941
264 HB2 LYS 36 HB2 LYS 36 -3.141 -10.466 -6.323
265 HB3 LYS 36 HB3 LYS 36 -1.932 -10.119 -5.091
266 HG2 LYS 36 HG2 LYS 36 -3.387 -8.479 -4.072
267 HG3 LYS 36 HG3 LYS 36 -4.577 -8.701 -5.354
268 HD2 LYS 36 HD2 LYS 36 -4.934 -10.988 -4.658
269 HD3 LYS 36 HD3 LYS 36 -3.675 -10.832 -3.431
270 HE2 LYS 36 HE2 LYS 36 -5.878 -10.617 -2.421
271 HE3 LYS 36 HE3 LYS 36 -4.991 -9.098 -2.307
272 HZ1 LYS 36 HZ1 LYS 36 -7.264 -8.674 -2.942
273 HZ2 LYS 36 HZ2 LYS 36 -7.148 -9.737 -4.260
274 HZ3 LYS 36 HZ3 LYS 36 -6.254 -8.299 -4.246
275 H CYS 37 H CYS 37 0.188 -7.691 -6.864
276 HA CYS 37 HA CYS 37 0.820 -9.099 -9.284
277 HB2 CYS 37 HB2 CYS 37 2.625 -7.427 -7.525
278 HB3 CYS 37 HB3 CYS 37 2.920 -7.893 -9.198
279 HG CYS 37 HG CYS 37 1.429 -5.233 -8.071
280 H ASP 38 H ASP 38 2.691 -10.405 -9.548
281 HA ASP 38 HA ASP 38 2.757 -12.562 -7.683
282 HB2 ASP 38 HB2 ASP 38 2.920 -12.926 -10.102
283 HB3 ASP 38 HB3 ASP 38 4.413 -11.997 -10.155
284 H ASP 39 H ASP 39 4.684 -9.764 -8.284
285 HA ASP 39 HA ASP 39 7.021 -10.747 -6.934
286 HB2 ASP 39 HB2 ASP 39 7.847 -8.418 -7.318
287 HB3 ASP 39 HB3 ASP 39 7.322 -9.262 -8.772
288 H GLY 40 H GLY 40 4.108 -9.293 -5.849
289 HA2 GLY 40 HA2 GLY 40 3.756 -9.486 -3.459
290 HA3 GLY 40 HA3 GLY 40 5.426 -9.000 -3.224
291 H TRP 41 H TRP 41 5.016 -6.806 -5.336
292 HA TRP 41 HA TRP 41 3.887 -4.885 -3.465
293 HB2 TRP 41 HB2 TRP 41 4.778 -4.197 -6.252
294 HB3 TRP 41 HB3 TRP 41 4.765 -3.181 -4.821
295 HD1 TRP 41 HD1 TRP 41 7.171 -4.482 -6.983
296 HE1 TRP 41 HE1 TRP 41 9.424 -5.020 -5.865
297 HE3 TRP 41 HE3 TRP 41 5.664 -4.575 -2.062
298 HZ2 TRP 41 HZ2 TRP 41 10.426 -5.433 -3.266
299 HZ3 TRP 41 HZ3 TRP 41 7.346 -5.049 -0.344
300 HH2 TRP 41 HH2 TRP 41 9.673 -5.469 -0.928
301 H PHE 42 H PHE 42 1.840 -4.118 -3.578
302 HA PHE 42 HA PHE 42 0.179 -5.469 -5.588
303 HB2 PHE 42 HB2 PHE 42 -0.487 -4.622 -2.771
304 HB3 PHE 42 HB3 PHE 42 -1.587 -5.427 -3.876
305 HD1 PHE 42 HD1 PHE 42 -0.025 -7.568 -5.030
306 HD2 PHE 42 HD2 PHE 42 0.008 -6.037 -1.059
307 HE1 PHE 42 HE1 PHE 42 0.724 -9.755 -4.199
308 HE2 PHE 42 HE2 PHE 42 0.773 -8.219 -0.222
309 HZ PHE 42 HZ PHE 42 1.130 -10.082 -1.793
310 H VAL 43 H VAL 43 -1.954 -4.450 -6.019
311 HA VAL 43 HA VAL 43 -1.719 -1.516 -6.140
312 HB VAL 43 HB VAL 43 -2.890 -3.529 -8.010
313 HG11 VAL 43 HG11 VAL 43 -3.910 -0.693 -7.771
314 HG12 VAL 43 HG12 VAL 43 -4.841 -2.155 -7.443
315 HG13 VAL 43 HG13 VAL 43 -4.285 -1.813 -9.082
316 HG21 VAL 43 HG21 VAL 43 -1.908 -2.000 -9.645
317 HG22 VAL 43 HG22 VAL 43 -0.728 -2.476 -8.418
318 HG23 VAL 43 HG23 VAL 43 -1.505 -0.893 -8.330
319 H GLY 44 H GLY 44 -3.221 -0.309 -5.118
320 HA2 GLY 44 HA2 GLY 44 -5.652 -1.547 -4.069
321 HA3 GLY 44 HA3 GLY 44 -4.424 -1.155 -2.878
322 H THR 45 H THR 45 -6.462 0.059 -2.202
323 HA THR 45 HA THR 45 -6.245 2.804 -3.214
324 HB THR 45 HB THR 45 -8.798 1.336 -2.585
325 HG1 THR 45 HG1 THR 45 -7.432 1.991 -4.916
326 HG21 THR 45 HG21 THR 45 -9.909 3.437 -3.376
327 HG22 THR 45 HG22 THR 45 -8.329 4.220 -3.332
328 HG23 THR 45 HG23 THR 45 -9.051 3.606 -1.845
329 H SER 46 H SER 46 -6.273 4.340 -1.655
330 HA SER 46 HA SER 46 -5.825 3.519 1.050
331 HB2 SER 46 HB2 SER 46 -4.608 5.436 0.138
332 HB3 SER 46 HB3 SER 46 -6.120 6.274 -0.184
333 HG SER 46 HG SER 46 -5.049 5.578 2.371
334 H ARG 47 H ARG 47 -7.345 3.259 2.590
335 HA ARG 47 HA ARG 47 -10.085 3.924 2.156
336 HB2 ARG 47 HB2 ARG 47 -9.298 2.055 3.606
337 HB3 ARG 47 HB3 ARG 47 -8.680 3.235 4.753
338 HG2 ARG 47 HG2 ARG 47 -11.064 4.126 4.857
339 HG3 ARG 47 HG3 ARG 47 -11.528 2.636 4.031
340 HD2 ARG 47 HD2 ARG 47 -10.406 1.358 5.863
341 HD3 ARG 47 HD3 ARG 47 -10.140 2.892 6.688
342 HE ARG 47 HE ARG 47 -12.766 3.000 6.330
343 HH11 ARG 47 HH11 ARG 47 -10.764 0.385 7.512
344 HH12 ARG 47 HH12 ARG 47 -12.043 -0.351 8.433
345 HH21 ARG 47 HH22 ARG 47 -14.445 2.055 7.546
346 HH22 ARG 47 HH21 ARG 47 -14.125 0.623 8.484
347 H ARG 48 H ARG 48 -7.351 5.539 3.480
348 HA ARG 48 HA ARG 48 -8.674 7.473 5.074
349 HB2 ARG 48 HB2 ARG 48 -6.417 7.093 5.554
350 HB3 ARG 48 HB3 ARG 48 -5.942 7.198 3.870
351 HG2 ARG 48 HG2 ARG 48 -6.442 9.628 3.943
352 HG3 ARG 48 HG3 ARG 48 -6.735 9.461 5.674
353 HD2 ARG 48 HD2 ARG 48 -4.488 8.744 6.057
354 HD3 ARG 48 HD3 ARG 48 -4.179 8.635 4.329
355 HE ARG 48 HE ARG 48 -4.886 11.257 5.401
356 HH11 ARG 48 HH11 ARG 48 -2.386 9.068 4.277
357 HH12 ARG 48 HH12 ARG 48 -1.225 10.326 4.009
358 HH21 ARG 48 HH22 ARG 48 -3.363 12.925 4.995
359 HH22 ARG 48 HH21 ARG 48 -1.790 12.509 4.368
360 H THR 49 H THR 49 -7.344 7.613 1.773
361 HA THR 49 HA THR 49 -8.729 10.189 1.465
362 HB THR 49 HB THR 49 -6.521 10.841 1.641
363 HG1 THR 49 HG1 THR 49 -6.426 10.421 -1.141
364 HG21 THR 49 HG21 THR 49 -4.652 9.676 0.424
365 HG22 THR 49 HG22 THR 49 -5.799 8.381 0.091
366 HG23 THR 49 HG23 THR 49 -5.388 8.787 1.757
367 H LYS 50 H LYS 50 -8.552 7.087 0.359
368 HA LYS 50 HA LYS 50 -9.534 5.965 -1.315
369 HB2 LYS 50 HB2 LYS 50 -10.989 8.539 -1.882
370 HB3 LYS 50 HB3 LYS 50 -11.436 6.949 -2.471
371 HG2 LYS 50 HG2 LYS 50 -11.583 8.009 0.331
372 HG3 LYS 50 HG3 LYS 50 -12.883 7.392 -0.681
373 HD2 LYS 50 HD2 LYS 50 -10.685 5.822 0.659
374 HD3 LYS 50 HD3 LYS 50 -12.412 5.750 0.991
375 HE2 LYS 50 HE2 LYS 50 -11.013 4.844 -1.510
376 HE3 LYS 50 HE3 LYS 50 -11.716 3.811 -0.271
377 HZ1 LYS 50 HZ1 LYS 50 -13.900 4.747 -0.821
378 HZ2 LYS 50 HZ2 LYS 50 -13.189 3.962 -2.147
379 HZ3 LYS 50 HZ3 LYS 50 -13.195 5.651 -2.069
380 H GLN 51 H GLN 51 -7.037 6.913 -1.900
381 HA GLN 51 HA GLN 51 -7.237 7.676 -4.722
382 HB2 GLN 51 HB2 GLN 51 -4.595 7.617 -4.341
383 HB3 GLN 51 HB3 GLN 51 -5.565 9.033 -3.964
384 HG2 GLN 51 HG2 GLN 51 -5.620 8.424 -1.644
385 HG3 GLN 51 HG3 GLN 51 -4.774 6.920 -1.981
386 HE21 GLN 51 HE22 GLN 51 -4.046 9.996 -3.467
387 HE22 GLN 51 HE21 GLN 51 -2.494 10.210 -2.722
388 H PHE 52 H PHE 52 -6.153 6.436 -6.317
389 HA PHE 52 HA PHE 52 -5.902 3.603 -5.544
390 HB2 PHE 52 HB2 PHE 52 -7.930 3.830 -6.764
391 HB3 PHE 52 HB3 PHE 52 -7.182 4.876 -7.962
392 HD1 PHE 52 HD2 PHE 52 -6.785 1.415 -6.596
393 HD2 PHE 52 HD1 PHE 52 -6.705 3.976 -9.994
394 HE1 PHE 52 HE2 PHE 52 -6.410 -0.528 -8.048
395 HE2 PHE 52 HE1 PHE 52 -6.323 2.035 -11.454
396 HZ PHE 52 HZ PHE 52 -6.177 -0.223 -10.479
397 H GLY 53 H GLY 53 -4.084 2.611 -6.075
398 HA2 GLY 53 HA2 GLY 53 -2.586 3.047 -8.412
399 HA3 GLY 53 HA3 GLY 53 -1.849 3.966 -7.108
400 H THR 54 H THR 54 -0.007 2.716 -7.208
401 HA THR 54 HA THR 54 -0.293 -0.082 -6.361
402 HB THR 54 HB THR 54 0.926 0.001 -8.368
403 HG1 THR 54 HG1 THR 54 3.221 -0.023 -6.822
404 HG21 THR 54 HG21 THR 54 3.072 1.474 -8.436
405 HG22 THR 54 HG22 THR 54 2.272 2.388 -7.153
406 HG23 THR 54 HG23 THR 54 1.501 2.218 -8.731
407 H PHE 55 H PHE 55 0.821 -0.852 -4.603
408 HA PHE 55 HA PHE 55 2.491 0.966 -3.078
409 HB2 PHE 55 HB2 PHE 55 1.271 0.777 -1.026
410 HB3 PHE 55 HB3 PHE 55 0.151 1.341 -2.255
411 HD1 PHE 55 HD1 PHE 55 -1.264 -0.545 -3.418
412 HD2 PHE 55 HD2 PHE 55 0.674 -0.962 0.345
413 HE1 PHE 55 HE1 PHE 55 -2.773 -2.406 -2.848
414 HE2 PHE 55 HE2 PHE 55 -0.829 -2.822 0.918
415 HZ PHE 55 HZ PHE 55 -2.551 -3.547 -0.681
416 HA PRO 56 HA PRO 56 4.721 -2.814 -2.497
417 HB2 PRO 56 HB3 PRO 56 5.783 -1.413 -0.115
418 HB3 PRO 56 HB2 PRO 56 6.649 -2.108 -1.489
419 HG2 PRO 56 HG2 PRO 56 6.399 0.544 -1.201
420 HG3 PRO 56 HG3 PRO 56 6.365 -0.228 -2.797
421 HD2 PRO 56 HD2 PRO 56 4.099 0.829 -1.156
422 HD3 PRO 56 HD3 PRO 56 4.339 0.882 -2.914
423 H GLY 57 H GLY 57 3.674 -4.530 -1.664
424 HA2 GLY 57 HA2 GLY 57 1.924 -4.365 0.590
425 HA3 GLY 57 HA3 GLY 57 2.400 -5.831 -0.251
426 H ASN 58 H ASN 58 4.762 -3.679 1.045
427 HA ASN 58 HA ASN 58 5.651 -5.775 2.889
428 HB2 ASN 58 HB2 ASN 58 7.129 -4.816 1.012
429 HB3 ASN 58 HB3 ASN 58 7.210 -3.352 1.989
430 HD21 ASN 58 HD22 ASN 58 8.370 -3.375 3.930
431 HD22 ASN 58 HD21 ASN 58 9.480 -4.640 4.318
432 H TYR 59 H TYR 59 4.077 -2.800 2.800
433 HA TYR 59 HA TYR 59 4.947 -2.081 5.527
434 HB2 TYR 59 HB2 TYR 59 3.708 -0.279 3.439
435 HB3 TYR 59 HB3 TYR 59 4.352 0.215 4.999
436 HD1 TYR 59 HD2 TYR 59 6.908 -0.627 5.329
437 HD2 TYR 59 HD1 TYR 59 5.010 0.173 1.613
438 HE1 TYR 59 HE2 TYR 59 9.106 -0.266 4.296
439 HE2 TYR 59 HE1 TYR 59 7.199 0.537 0.566
440 HH TYR 59 HH TYR 59 9.501 1.159 1.250
441 H VAL 60 H VAL 60 2.732 -3.898 4.472
442 HA VAL 60 HA VAL 60 0.570 -2.732 6.042
443 HB VAL 60 HB VAL 60 -1.125 -3.414 4.334
444 HG11 VAL 60 HG11 VAL 60 0.845 -1.398 3.253
445 HG12 VAL 60 HG12 VAL 60 -0.281 -1.066 4.569
446 HG13 VAL 60 HG13 VAL 60 -0.894 -1.466 2.962
447 HG21 VAL 60 HG21 VAL 60 1.332 -3.862 2.650
448 HG22 VAL 60 HG22 VAL 60 -0.292 -3.680 1.988
449 HG23 VAL 60 HG23 VAL 60 0.072 -5.022 3.067
450 H LYS 61 H LYS 61 -1.031 -4.303 6.676
451 HA LYS 61 HA LYS 61 0.063 -7.028 6.703
452 HB2 LYS 61 HB2 LYS 61 -0.785 -7.230 9.041
453 HB3 LYS 61 HB3 LYS 61 0.548 -6.109 8.842
454 HG2 LYS 61 HG2 LYS 61 -1.146 -4.254 8.804
455 HG3 LYS 61 HG3 LYS 61 -2.359 -5.454 9.252
456 HD2 LYS 61 HD2 LYS 61 -1.770 -5.273 11.388
457 HD3 LYS 61 HD3 LYS 61 -0.120 -5.747 10.977
458 HE2 LYS 61 HE2 LYS 61 -0.127 -3.608 12.124
459 HE3 LYS 61 HE3 LYS 61 0.425 -3.425 10.462
460 HZ1 LYS 61 HZ1 LYS 61 -1.109 -1.672 11.138
461 HZ2 LYS 61 HZ2 LYS 61 -2.320 -2.818 11.423
462 HZ3 LYS 61 HZ3 LYS 61 -1.731 -2.578 9.854
463 HA PRO 62 HA PRO 62 -3.835 -8.139 5.098
464 HB2 PRO 62 HB3 PRO 62 -3.733 -10.819 5.675
465 HB3 PRO 62 HB2 PRO 62 -2.906 -10.055 4.314
466 HG2 PRO 62 HG2 PRO 62 -1.818 -10.994 6.900
467 HG3 PRO 62 HG3 PRO 62 -1.038 -10.895 5.321
468 HD2 PRO 62 HD2 PRO 62 -0.657 -9.148 7.428
469 HD3 PRO 62 HD3 PRO 62 -0.281 -8.816 5.737
470 H LEU 63 H LEU 63 -5.828 -8.051 5.821
471 HA LEU 63 HA LEU 63 -6.300 -8.446 8.674
472 HB2 LEU 63 HB2 LEU 63 -7.999 -7.143 6.549
473 HB3 LEU 63 HB3 LEU 63 -8.392 -7.213 8.256
474 HG LEU 63 HG LEU 63 -5.941 -5.845 7.163
475 HD11 LEU 63 HD11 LEU 63 -8.571 -4.651 8.019
476 HD12 LEU 63 HD12 LEU 63 -7.982 -4.786 6.361
477 HD13 LEU 63 HD13 LEU 63 -7.129 -3.762 7.517
478 HD21 LEU 63 HD21 LEU 63 -5.726 -6.559 9.476
479 HD22 LEU 63 HD22 LEU 63 -7.259 -5.784 9.877
480 HD23 LEU 63 HD23 LEU 63 -5.878 -4.805 9.384
481 H TYR 64 H TYR 64 -9.140 -8.788 8.369
482 HA TYR 64 HA TYR 64 -9.042 -11.678 8.211
483 HB2 TYR 64 HB2 TYR 64 -11.396 -9.945 8.984
484 HB3 TYR 64 HB3 TYR 64 -11.159 -11.652 9.346
485 HD1 TYR 64 HD2 TYR 64 -9.164 -12.267 10.860
486 HD2 TYR 64 HD1 TYR 64 -10.692 -8.312 10.488
487 HE1 TYR 64 HE2 TYR 64 -8.077 -11.651 12.979
488 HE2 TYR 64 HE1 TYR 64 -9.603 -7.688 12.600
489 HH TYR 64 HH TYR 64 -8.798 -8.780 14.646
490 H LEU 65 H LEU 65 -10.023 -9.120 6.196
491 HA LEU 65 HA LEU 65 -11.592 -10.973 4.548
492 HB2 LEU 65 HB2 LEU 65 -13.066 -9.184 3.875
493 HB3 LEU 65 HB3 LEU 65 -13.082 -9.333 5.619
494 HG LEU 65 HG LEU 65 -11.449 -7.241 4.178
495 HD11 LEU 65 HD11 LEU 65 -13.233 -5.669 4.684
496 HD12 LEU 65 HD12 LEU 65 -14.218 -6.974 5.344
497 HD13 LEU 65 HD13 LEU 65 -13.817 -6.953 3.625
498 HD21 LEU 65 HD21 LEU 65 -12.421 -7.431 7.028
499 HD22 LEU 65 HD22 LEU 65 -11.458 -6.124 6.340
500 HD23 LEU 65 HD23 LEU 65 -10.773 -7.742 6.486
Start of MODEL 7
1 H1 GLN 1 H1 GLN 1 -23.458 -9.271 -8.622
2 H2 GLN 1 H2 GLN 1 -22.650 -10.509 -7.791
3 H3 GLN 1 H3 GLN 1 -21.909 -8.991 -7.986
4 HA GLN 1 HA GLN 1 -23.533 -7.946 -6.605
5 HB2 GLN 1 HB2 GLN 1 -25.371 -9.527 -7.287
6 HB3 GLN 1 HB3 GLN 1 -24.673 -10.718 -6.198
7 HG2 GLN 1 HG2 GLN 1 -26.593 -9.553 -5.219
8 HG3 GLN 1 HG3 GLN 1 -25.113 -9.300 -4.296
9 HE21 GLN 1 HE22 GLN 1 -24.155 -7.278 -4.277
10 HE22 GLN 1 HE21 GLN 1 -24.978 -5.854 -4.820
11 H THR 2 H THR 2 -21.253 -10.345 -6.591
12 HA THR 2 HA THR 2 -20.947 -10.306 -3.665
13 HB THR 2 HB THR 2 -19.518 -12.124 -5.611
14 HG1 THR 2 HG1 THR 2 -21.308 -13.584 -4.513
15 HG21 THR 2 HG21 THR 2 -18.530 -11.959 -3.376
16 HG22 THR 2 HG22 THR 2 -19.237 -13.553 -3.636
17 HG23 THR 2 HG23 THR 2 -20.086 -12.362 -2.652
18 H SER 3 H SER 3 -18.931 -9.703 -2.770
19 HA SER 3 HA SER 3 -17.486 -7.815 -4.418
20 HB2 SER 3 HB2 SER 3 -16.258 -7.451 -2.154
21 HB3 SER 3 HB3 SER 3 -17.932 -6.922 -2.320
22 HG SER 3 HG SER 3 -18.071 -8.059 -0.522
23 H GLN 4 H GLN 4 -17.221 -10.852 -4.628
24 HA GLN 4 HA GLN 4 -15.635 -12.356 -5.197
25 HB2 GLN 4 HB2 GLN 4 -14.991 -10.587 -6.763
26 HB3 GLN 4 HB3 GLN 4 -13.968 -9.852 -5.540
27 HG2 GLN 4 HG2 GLN 4 -12.540 -11.019 -6.991
28 HG3 GLN 4 HG3 GLN 4 -12.654 -11.975 -5.511
29 HE21 GLN 4 HE22 GLN 4 -13.500 -11.767 -8.866
30 HE22 GLN 4 HE21 GLN 4 -13.989 -13.413 -9.064
31 H ASP 5 H ASP 5 -12.958 -10.509 -4.189
32 HA ASP 5 HA ASP 5 -12.966 -11.592 -1.466
33 HB2 ASP 5 HB2 ASP 5 -10.668 -11.732 -3.430
34 HB3 ASP 5 HB3 ASP 5 -10.445 -11.872 -1.693
35 H LEU 6 H LEU 6 -13.215 -9.802 -0.388
36 HA LEU 6 HA LEU 6 -12.263 -7.281 -1.404
37 HB2 LEU 6 HB2 LEU 6 -14.534 -7.602 -0.466
38 HB3 LEU 6 HB3 LEU 6 -13.818 -7.889 1.111
39 HG LEU 6 HG LEU 6 -12.865 -5.587 1.048
40 HD11 LEU 6 HD11 LEU 6 -12.810 -5.304 -1.373
41 HD12 LEU 6 HD12 LEU 6 -13.717 -4.003 -0.599
42 HD13 LEU 6 HD13 LEU 6 -14.572 -5.310 -1.421
43 HD21 LEU 6 HD21 LEU 6 -15.859 -5.779 0.736
44 HD22 LEU 6 HD22 LEU 6 -14.985 -4.438 1.477
45 HD23 LEU 6 HD23 LEU 6 -14.949 -6.035 2.225
46 H PHE 7 H PHE 7 -10.123 -8.463 -1.103
47 HA PHE 7 HA PHE 7 -8.909 -8.609 1.435
48 HB2 PHE 7 HB2 PHE 7 -8.141 -9.024 -1.302
49 HB3 PHE 7 HB3 PHE 7 -6.902 -8.069 -0.485
50 HD1 PHE 7 HD1 PHE 7 -8.666 -11.284 -0.570
51 HD2 PHE 7 HD2 PHE 7 -5.586 -9.011 1.284
52 HE1 PHE 7 HE1 PHE 7 -7.784 -13.335 0.466
53 HE2 PHE 7 HE2 PHE 7 -4.697 -11.055 2.326
54 HZ PHE 7 HZ PHE 7 -5.795 -13.221 1.917
55 H SER 8 H SER 8 -8.743 -6.924 2.733
56 HA SER 8 HA SER 8 -7.499 -4.498 1.638
57 HB2 SER 8 HB2 SER 8 -9.892 -4.243 2.492
58 HB3 SER 8 HB3 SER 8 -9.257 -4.583 4.100
59 HG SER 8 HG SER 8 -8.773 -2.391 2.412
60 H TYR 9 H TYR 9 -5.827 -3.581 2.895
61 HA TYR 9 HA TYR 9 -4.869 -5.300 5.095
62 HB2 TYR 9 HB2 TYR 9 -3.151 -3.653 3.224
63 HB3 TYR 9 HB3 TYR 9 -2.579 -4.684 4.522
64 HD1 TYR 9 HD2 TYR 9 -4.090 -7.172 4.083
65 HD2 TYR 9 HD1 TYR 9 -2.317 -4.503 1.313
66 HE1 TYR 9 HE2 TYR 9 -3.835 -9.020 2.479
67 HE2 TYR 9 HE1 TYR 9 -2.057 -6.323 -0.310
68 HH TYR 9 HH TYR 9 -3.469 -9.465 0.227
69 H GLN 10 H GLN 10 -3.734 -4.216 6.777
70 HA GLN 10 HA GLN 10 -4.316 -1.337 6.920
71 HB2 GLN 10 HB2 GLN 10 -5.282 -2.888 8.708
72 HB3 GLN 10 HB3 GLN 10 -3.625 -3.087 9.269
73 HG2 GLN 10 HG2 GLN 10 -3.451 -0.674 9.599
74 HG3 GLN 10 HG3 GLN 10 -5.111 -0.480 9.052
75 HE21 GLN 10 HE22 GLN 10 -3.978 0.256 11.603
76 HE22 GLN 10 HE21 GLN 10 -4.862 -0.610 12.805
77 H ALA 11 H ALA 11 -2.677 0.052 7.143
78 HA ALA 11 HA ALA 11 -0.130 -0.860 6.282
79 HB1 ALA 11 HB1 ALA 11 0.482 1.534 6.456
80 HB2 ALA 11 HB2 ALA 11 -1.094 1.828 7.203
81 HB3 ALA 11 HB3 ALA 11 -1.000 1.247 5.539
82 H LEU 12 H LEU 12 1.674 -1.175 7.281
83 HA LEU 12 HA LEU 12 1.771 -1.308 10.165
84 HB2 LEU 12 HB2 LEU 12 3.575 -2.095 7.902
85 HB3 LEU 12 HB3 LEU 12 4.164 -2.109 9.553
86 HG LEU 12 HG LEU 12 1.631 -3.545 8.958
87 HD11 LEU 12 HD11 LEU 12 4.367 -4.474 8.139
88 HD12 LEU 12 HD12 LEU 12 2.912 -4.334 7.145
89 HD13 LEU 12 HD13 LEU 12 3.011 -5.570 8.399
90 HD21 LEU 12 HD21 LEU 12 3.992 -4.108 10.754
91 HD22 LEU 12 HD22 LEU 12 2.499 -5.047 10.685
92 HD23 LEU 12 HD23 LEU 12 2.465 -3.377 11.247
93 H TYR 13 H TYR 13 3.056 0.680 7.595
94 HA TYR 13 HA TYR 13 4.286 2.464 9.582
95 HB2 TYR 13 HB2 TYR 13 5.685 1.757 7.002
96 HB3 TYR 13 HB3 TYR 13 6.331 2.646 8.371
97 HD1 TYR 13 HD2 TYR 13 7.096 1.442 10.380
98 HD2 TYR 13 HD1 TYR 13 5.661 -0.641 6.960
99 HE1 TYR 13 HE2 TYR 13 8.150 -0.628 11.198
100 HE2 TYR 13 HE1 TYR 13 6.717 -2.704 7.760
101 HH TYR 13 HH TYR 13 8.768 -3.218 9.308
102 H SER 14 H SER 14 4.794 4.604 8.652
103 HA SER 14 HA SER 14 2.996 5.354 6.478
104 HB2 SER 14 HB2 SER 14 4.821 7.104 8.153
105 HB3 SER 14 HB3 SER 14 3.566 7.651 7.043
106 HG SER 14 HG SER 14 3.337 6.999 9.617
107 H TYR 15 H TYR 15 3.760 5.217 4.470
108 HA TYR 15 HA TYR 15 6.681 5.389 4.095
109 HB2 TYR 15 HB2 TYR 15 5.648 3.083 3.835
110 HB3 TYR 15 HB3 TYR 15 4.803 3.707 2.431
111 HD1 TYR 15 HD2 TYR 15 8.194 3.141 3.828
112 HD2 TYR 15 HD1 TYR 15 5.852 3.750 0.331
113 HE1 TYR 15 HE2 TYR 15 10.144 2.596 2.438
114 HE2 TYR 15 HE1 TYR 15 7.794 3.194 -1.071
115 HH TYR 15 HH TYR 15 10.198 3.110 -0.966
116 H ILE 16 H ILE 16 7.387 6.801 2.708
117 HA ILE 16 HA ILE 16 5.503 8.349 1.128
118 HB ILE 16 HB ILE 16 8.465 8.680 1.613
119 HG12 ILE 16 HG12 ILE 16 7.130 9.125 3.592
120 HG13 ILE 16 HG13 ILE 16 7.754 10.639 2.950
121 HG21 ILE 16 HG21 ILE 16 6.574 10.528 0.162
122 HG22 ILE 16 HG22 ILE 16 7.853 9.567 -0.579
123 HG23 ILE 16 HG23 ILE 16 8.264 10.865 0.541
124 HD11 ILE 16 HD11 ILE 16 5.594 11.117 1.946
125 HD12 ILE 16 HD12 ILE 16 5.446 10.854 3.684
126 HD13 ILE 16 HD13 ILE 16 4.965 9.587 2.556
127 HA PRO 17 HA PRO 17 6.210 5.576 -2.331
128 HB2 PRO 17 HB3 PRO 17 4.830 7.819 -3.712
129 HB3 PRO 17 HB2 PRO 17 4.464 6.091 -3.730
130 HG2 PRO 17 HG2 PRO 17 2.949 7.768 -2.339
131 HG3 PRO 17 HG3 PRO 17 3.364 6.170 -1.688
132 HD2 PRO 17 HD2 PRO 17 4.503 8.852 -1.000
133 HD3 PRO 17 HD3 PRO 17 4.119 7.482 0.062
134 H GLN 18 H GLN 18 7.487 5.561 -4.156
135 HA GLN 18 HA GLN 18 9.431 7.734 -4.276
136 HB2 GLN 18 HB2 GLN 18 9.477 4.962 -5.481
137 HB3 GLN 18 HB3 GLN 18 10.809 6.113 -5.513
138 HG2 GLN 18 HG2 GLN 18 11.137 5.956 -3.189
139 HG3 GLN 18 HG3 GLN 18 9.595 5.139 -2.949
140 HE21 GLN 18 HE22 GLN 18 11.811 4.341 -5.534
141 HE22 GLN 18 HE21 GLN 18 12.254 2.780 -4.921
142 H ASN 19 H ASN 19 6.814 6.354 -5.928
143 HA ASN 19 HA ASN 19 7.242 8.228 -8.163
144 HB2 ASN 19 HB2 ASN 19 6.272 5.387 -8.190
145 HB3 ASN 19 HB3 ASN 19 5.759 6.510 -9.445
146 HD21 ASN 19 HD22 ASN 19 8.288 7.964 -9.427
147 HD22 ASN 19 HD21 ASN 19 9.440 6.929 -10.202
148 H ASP 20 H ASP 20 5.429 9.300 -8.917
149 HA ASP 20 HA ASP 20 3.297 9.628 -7.012
150 HB2 ASP 20 HB2 ASP 20 2.443 11.315 -8.651
151 HB3 ASP 20 HB3 ASP 20 4.097 11.604 -8.122
152 H ASP 21 H ASP 21 3.700 7.120 -8.693
153 HA ASP 21 HA ASP 21 0.951 6.900 -9.731
154 HB2 ASP 21 HB2 ASP 21 2.901 6.373 -11.272
155 HB3 ASP 21 HB3 ASP 21 3.262 5.010 -10.219
156 H GLU 22 H GLU 22 2.871 6.295 -7.134
157 HA GLU 22 HA GLU 22 1.643 3.768 -6.353
158 HB2 GLU 22 HB2 GLU 22 3.813 5.479 -5.148
159 HB3 GLU 22 HB3 GLU 22 3.140 4.087 -4.313
160 HG2 GLU 22 HG2 GLU 22 3.934 2.599 -5.977
161 HG3 GLU 22 HG3 GLU 22 4.387 3.929 -7.041
162 H LEU 23 H LEU 23 1.085 3.664 -3.944
163 HA LEU 23 HA LEU 23 -0.799 5.837 -3.344
164 HB2 LEU 23 HB2 LEU 23 -1.405 3.288 -3.534
165 HB3 LEU 23 HB3 LEU 23 -0.716 3.193 -1.930
166 HG LEU 23 HG LEU 23 -3.258 3.468 -2.100
167 HD11 LEU 23 HD11 LEU 23 -1.753 5.479 -0.446
168 HD12 LEU 23 HD12 LEU 23 -1.975 3.781 -0.030
169 HD13 LEU 23 HD13 LEU 23 -3.373 4.852 -0.136
170 HD21 LEU 23 HD21 LEU 23 -3.245 5.198 -3.821
171 HD22 LEU 23 HD22 LEU 23 -2.423 6.296 -2.711
172 HD23 LEU 23 HD23 LEU 23 -4.067 5.753 -2.358
173 H GLU 24 H GLU 24 -0.607 7.021 -1.483
174 HA GLU 24 HA GLU 24 1.886 6.848 -0.073
175 HB2 GLU 24 HB2 GLU 24 -0.377 8.738 -0.142
176 HB3 GLU 24 HB3 GLU 24 0.487 8.635 1.389
177 HG2 GLU 24 HG2 GLU 24 2.599 8.959 0.099
178 HG3 GLU 24 HG3 GLU 24 1.601 9.337 -1.306
179 H LEU 25 H LEU 25 2.268 5.544 1.514
180 HA LEU 25 HA LEU 25 0.043 4.256 2.875
181 HB2 LEU 25 HB2 LEU 25 3.012 3.752 3.049
182 HB3 LEU 25 HB3 LEU 25 1.777 2.801 3.847
183 HG LEU 25 HG LEU 25 2.061 3.085 0.855
184 HD11 LEU 25 HD11 LEU 25 2.827 0.848 2.718
185 HD12 LEU 25 HD12 LEU 25 3.901 1.814 1.710
186 HD13 LEU 25 HD13 LEU 25 2.752 0.705 0.963
187 HD21 LEU 25 HD21 LEU 25 0.397 1.304 0.753
188 HD22 LEU 25 HD22 LEU 25 -0.245 2.722 1.582
189 HD23 LEU 25 HD23 LEU 25 0.268 1.314 2.511
190 H ARG 26 H ARG 26 -0.448 4.527 4.988
191 HA ARG 26 HA ARG 26 1.230 6.378 6.535
192 HB2 ARG 26 HB2 ARG 26 -0.850 7.399 5.427
193 HB3 ARG 26 HB3 ARG 26 -1.778 6.452 6.572
194 HG2 ARG 26 HG2 ARG 26 -0.871 7.652 8.411
195 HG3 ARG 26 HG3 ARG 26 0.311 8.457 7.372
196 HD2 ARG 26 HD2 ARG 26 -1.582 9.459 6.107
197 HD3 ARG 26 HD3 ARG 26 -2.686 8.772 7.294
198 HE ARG 26 HE ARG 26 -1.568 10.197 8.969
199 HH11 ARG 26 HH11 ARG 26 -1.195 10.994 5.570
200 HH12 ARG 26 HH12 ARG 26 -0.966 12.694 5.869
201 HH21 ARG 26 HH22 ARG 26 -1.309 12.430 9.358
202 HH22 ARG 26 HH21 ARG 26 -1.060 13.515 8.018
203 H ASP 27 H ASP 27 1.374 5.915 8.658
204 HA ASP 27 HA ASP 27 1.036 3.242 9.429
205 HB2 ASP 27 HB2 ASP 27 2.749 4.457 10.510
206 HB3 ASP 27 HB3 ASP 27 1.647 5.735 10.997
207 H GLY 28 H GLY 28 -0.837 2.276 9.656
208 HA2 GLY 28 HA2 GLY 28 -2.656 1.744 11.063
209 HA3 GLY 28 HA3 GLY 28 -2.769 3.434 11.531
210 H ASP 29 H ASP 29 -2.359 3.593 8.320
211 HA ASP 29 HA ASP 29 -5.187 3.969 7.841
212 HB2 ASP 29 HB2 ASP 29 -3.298 5.443 6.899
213 HB3 ASP 29 HB3 ASP 29 -3.014 4.137 5.751
214 H ILE 30 H ILE 30 -6.388 2.851 6.251
215 HA ILE 30 HA ILE 30 -5.421 0.114 5.834
216 HB ILE 30 HB ILE 30 -8.198 1.254 6.033
217 HG12 ILE 30 HG12 ILE 30 -8.337 -0.744 7.665
218 HG13 ILE 30 HG13 ILE 30 -6.582 -0.745 7.569
219 HG21 ILE 30 HG21 ILE 30 -7.477 -1.524 5.129
220 HG22 ILE 30 HG22 ILE 30 -8.217 -0.272 4.136
221 HG23 ILE 30 HG23 ILE 30 -9.101 -0.951 5.500
222 HD11 ILE 30 HD11 ILE 30 -7.293 0.478 9.511
223 HD12 ILE 30 HD12 ILE 30 -8.336 1.503 8.523
224 HD13 ILE 30 HD13 ILE 30 -6.587 1.589 8.341
225 H VAL 31 H VAL 31 -5.357 -0.778 3.829
226 HA VAL 31 HA VAL 31 -6.244 0.904 1.586
227 HB VAL 31 HB VAL 31 -3.590 -0.490 1.860
228 HG11 VAL 31 HG11 VAL 31 -3.223 0.032 -0.546
229 HG12 VAL 31 HG12 VAL 31 -4.936 0.435 -0.684
230 HG13 VAL 31 HG13 VAL 31 -4.445 -1.212 -0.282
231 HG21 VAL 31 HG21 VAL 31 -2.719 1.674 1.186
232 HG22 VAL 31 HG22 VAL 31 -3.788 1.856 2.578
233 HG23 VAL 31 HG23 VAL 31 -4.361 2.280 0.962
234 H ASP 32 H ASP 32 -7.492 -0.039 0.212
235 HA ASP 32 HA ASP 32 -8.090 -2.876 0.420
236 HB2 ASP 32 HB2 ASP 32 -9.911 -1.233 0.166
237 HB3 ASP 32 HB3 ASP 32 -9.182 -0.680 -1.338
238 H VAL 33 H VAL 33 -6.884 -4.275 -0.724
239 HA VAL 33 HA VAL 33 -5.500 -3.331 -3.110
240 HB VAL 33 HB VAL 33 -4.072 -4.548 -1.637
241 HG11 VAL 33 HG11 VAL 33 -6.298 -6.500 -1.496
242 HG12 VAL 33 HG12 VAL 33 -5.276 -5.834 -0.212
243 HG13 VAL 33 HG13 VAL 33 -4.642 -7.074 -1.297
244 HG21 VAL 33 HG21 VAL 33 -4.809 -6.366 -3.920
245 HG22 VAL 33 HG22 VAL 33 -3.272 -6.341 -3.054
246 HG23 VAL 33 HG23 VAL 33 -3.759 -4.951 -4.027
247 H MET 34 H MET 34 -6.189 -3.695 -5.065
248 HA MET 34 HA MET 34 -8.529 -5.403 -5.373
249 HB2 MET 34 HB2 MET 34 -8.904 -4.247 -7.504
250 HB3 MET 34 HB3 MET 34 -8.788 -3.134 -6.156
251 HG2 MET 34 HG2 MET 34 -7.677 -2.117 -7.943
252 HG3 MET 34 HG3 MET 34 -6.427 -2.684 -6.842
253 HE1 MET 34 HE1 MET 34 -8.239 -3.779 -10.406
254 HE2 MET 34 HE2 MET 34 -8.515 -4.924 -9.087
255 HE3 MET 34 HE3 MET 34 -7.445 -5.361 -10.416
256 H GLU 35 H GLU 35 -5.224 -5.016 -6.631
257 HA GLU 35 HA GLU 35 -5.458 -7.829 -7.440
258 HB2 GLU 35 HB2 GLU 35 -5.673 -6.345 -9.449
259 HB3 GLU 35 HB3 GLU 35 -4.028 -5.794 -9.136
260 HG2 GLU 35 HG2 GLU 35 -3.221 -8.088 -9.358
261 HG3 GLU 35 HG3 GLU 35 -4.864 -8.631 -9.681
262 H LYS 36 H LYS 36 -3.688 -9.041 -7.152
263 HA LYS 36 HA LYS 36 -1.581 -7.789 -5.530
264 HB2 LYS 36 HB2 LYS 36 -2.726 -10.577 -5.518
265 HB3 LYS 36 HB3 LYS 36 -1.234 -10.160 -4.686
266 HG2 LYS 36 HG2 LYS 36 -2.401 -8.590 -3.278
267 HG3 LYS 36 HG3 LYS 36 -3.898 -8.856 -4.174
268 HD2 LYS 36 HD2 LYS 36 -2.543 -11.203 -2.957
269 HD3 LYS 36 HD3 LYS 36 -3.406 -10.094 -1.890
270 HE2 LYS 36 HE2 LYS 36 -4.889 -11.876 -2.543
271 HE3 LYS 36 HE3 LYS 36 -5.423 -10.374 -3.289
272 HZ1 LYS 36 HZ1 LYS 36 -5.561 -12.102 -4.894
273 HZ2 LYS 36 HZ2 LYS 36 -3.966 -12.607 -4.605
274 HZ3 LYS 36 HZ3 LYS 36 -4.263 -11.111 -5.343
275 H CYS 37 H CYS 37 0.186 -7.437 -6.680
276 HA CYS 37 HA CYS 37 0.853 -8.929 -9.016
277 HB2 CYS 37 HB2 CYS 37 2.676 -7.111 -7.443
278 HB3 CYS 37 HB3 CYS 37 2.768 -7.518 -9.156
279 HG CYS 37 HG CYS 37 1.403 -4.930 -7.851
280 H ASP 38 H ASP 38 2.669 -10.282 -9.309
281 HA ASP 38 HA ASP 38 2.953 -12.108 -7.110
282 HB2 ASP 38 HB2 ASP 38 4.172 -13.521 -8.701
283 HB3 ASP 38 HB3 ASP 38 2.658 -12.945 -9.393
284 H ASP 39 H ASP 39 4.641 -9.344 -7.965
285 HA ASP 39 HA ASP 39 7.198 -10.372 -7.014
286 HB2 ASP 39 HB2 ASP 39 7.002 -8.799 -8.992
287 HB3 ASP 39 HB3 ASP 39 6.591 -7.536 -7.836
288 H GLY 40 H GLY 40 4.408 -8.864 -5.749
289 HA2 GLY 40 HA2 GLY 40 4.320 -9.193 -3.304
290 HA3 GLY 40 HA3 GLY 40 5.929 -8.494 -3.235
291 H TRP 41 H TRP 41 4.982 -6.454 -5.316
292 HA TRP 41 HA TRP 41 3.814 -4.665 -3.319
293 HB2 TRP 41 HB2 TRP 41 4.606 -3.734 -6.046
294 HB3 TRP 41 HB3 TRP 41 4.699 -2.890 -4.506
295 HD1 TRP 41 HD1 TRP 41 6.890 -4.236 -6.983
296 HE1 TRP 41 HE1 TRP 41 9.211 -4.830 -6.059
297 HE3 TRP 41 HE3 TRP 41 5.824 -4.197 -1.956
298 HZ2 TRP 41 HZ2 TRP 41 10.434 -5.224 -3.550
299 HZ3 TRP 41 HZ3 TRP 41 7.634 -4.695 -0.380
300 HH2 TRP 41 HH2 TRP 41 9.888 -5.199 -1.158
301 H PHE 42 H PHE 42 1.706 -4.137 -3.382
302 HA PHE 42 HA PHE 42 0.153 -5.483 -5.467
303 HB2 PHE 42 HB2 PHE 42 -0.711 -4.605 -2.710
304 HB3 PHE 42 HB3 PHE 42 -1.630 -5.602 -3.828
305 HD1 PHE 42 HD1 PHE 42 0.245 -7.557 -4.773
306 HD2 PHE 42 HD2 PHE 42 -0.148 -5.879 -0.883
307 HE1 PHE 42 HE1 PHE 42 1.260 -9.577 -3.802
308 HE2 PHE 42 HE2 PHE 42 0.865 -7.896 0.095
309 HZ PHE 42 HZ PHE 42 1.572 -9.748 -1.366
310 H VAL 43 H VAL 43 -2.037 -4.515 -5.909
311 HA VAL 43 HA VAL 43 -1.779 -1.588 -6.150
312 HB VAL 43 HB VAL 43 -2.894 -3.649 -8.007
313 HG11 VAL 43 HG11 VAL 43 -3.813 -0.767 -7.970
314 HG12 VAL 43 HG12 VAL 43 -4.822 -2.150 -7.538
315 HG13 VAL 43 HG13 VAL 43 -4.216 -1.978 -9.188
316 HG21 VAL 43 HG21 VAL 43 -1.803 -2.193 -9.637
317 HG22 VAL 43 HG22 VAL 43 -0.690 -2.657 -8.341
318 HG23 VAL 43 HG23 VAL 43 -1.444 -1.061 -8.331
319 H GLY 44 H GLY 44 -3.308 -0.321 -5.264
320 HA2 GLY 44 HA2 GLY 44 -5.957 -1.221 -4.764
321 HA3 GLY 44 HA3 GLY 44 -5.011 -1.292 -3.292
322 H THR 45 H THR 45 -6.537 0.202 -2.457
323 HA THR 45 HA THR 45 -6.147 2.970 -3.331
324 HB THR 45 HB THR 45 -8.785 1.604 -2.816
325 HG1 THR 45 HG1 THR 45 -7.309 2.163 -5.057
326 HG21 THR 45 HG21 THR 45 -9.807 3.750 -3.496
327 HG22 THR 45 HG22 THR 45 -8.203 4.481 -3.486
328 HG23 THR 45 HG23 THR 45 -8.901 3.873 -1.986
329 H SER 46 H SER 46 -6.222 4.467 -1.711
330 HA SER 46 HA SER 46 -5.819 3.571 0.969
331 HB2 SER 46 HB2 SER 46 -4.674 5.565 0.165
332 HB3 SER 46 HB3 SER 46 -6.219 6.341 -0.180
333 HG SER 46 HG SER 46 -5.187 5.629 2.384
334 H ARG 47 H ARG 47 -7.272 3.413 2.600
335 HA ARG 47 HA ARG 47 -10.068 3.532 2.046
336 HB2 ARG 47 HB2 ARG 47 -9.114 1.926 3.624
337 HB3 ARG 47 HB3 ARG 47 -8.571 3.237 4.655
338 HG2 ARG 47 HG2 ARG 47 -11.058 3.872 4.799
339 HG3 ARG 47 HG3 ARG 47 -11.346 2.242 4.184
340 HD2 ARG 47 HD2 ARG 47 -10.077 1.299 6.034
341 HD3 ARG 47 HD3 ARG 47 -9.716 2.917 6.618
342 HE ARG 47 HE ARG 47 -12.536 2.313 6.403
343 HH11 ARG 47 HH11 ARG 47 -9.700 2.328 8.441
344 HH12 ARG 47 HH12 ARG 47 -10.593 2.247 9.926
345 HH21 ARG 47 HH22 ARG 47 -13.736 2.177 8.348
346 HH22 ARG 47 HH21 ARG 47 -12.895 2.206 9.877
347 H ARG 48 H ARG 48 -7.770 5.783 3.343
348 HA ARG 48 HA ARG 48 -9.768 7.355 4.739
349 HB2 ARG 48 HB2 ARG 48 -7.357 6.966 5.490
350 HB3 ARG 48 HB3 ARG 48 -6.893 8.113 4.244
351 HG2 ARG 48 HG2 ARG 48 -8.280 9.819 5.303
352 HG3 ARG 48 HG3 ARG 48 -8.693 8.668 6.581
353 HD2 ARG 48 HD2 ARG 48 -5.962 9.694 5.875
354 HD3 ARG 48 HD3 ARG 48 -6.884 10.077 7.333
355 HE ARG 48 HE ARG 48 -5.985 7.323 6.714
356 HH11 ARG 48 HH11 ARG 48 -6.289 10.024 8.949
357 HH12 ARG 48 HH12 ARG 48 -5.525 9.175 10.259
358 HH21 ARG 48 HH22 ARG 48 -4.990 6.234 8.424
359 HH22 ARG 48 HH21 ARG 48 -4.748 7.032 9.951
360 H THR 49 H THR 49 -7.568 7.816 1.995
361 HA THR 49 HA THR 49 -9.045 10.268 1.349
362 HB THR 49 HB THR 49 -6.818 10.857 1.677
363 HG1 THR 49 HG1 THR 49 -6.844 10.406 -1.135
364 HG21 THR 49 HG21 THR 49 -4.909 9.670 0.635
365 HG22 THR 49 HG22 THR 49 -6.036 8.431 0.083
366 HG23 THR 49 HG23 THR 49 -5.803 8.701 1.810
367 H LYS 50 H LYS 50 -8.599 7.095 0.353
368 HA LYS 50 HA LYS 50 -9.508 5.869 -1.300
369 HB2 LYS 50 HB2 LYS 50 -11.072 8.351 -2.007
370 HB3 LYS 50 HB3 LYS 50 -11.443 6.706 -2.500
371 HG2 LYS 50 HG2 LYS 50 -11.651 7.924 0.238
372 HG3 LYS 50 HG3 LYS 50 -12.929 7.214 -0.746
373 HD2 LYS 50 HD2 LYS 50 -10.670 5.780 0.648
374 HD3 LYS 50 HD3 LYS 50 -12.390 5.691 1.026
375 HE2 LYS 50 HE2 LYS 50 -11.077 4.727 -1.506
376 HE3 LYS 50 HE3 LYS 50 -11.607 3.707 -0.171
377 HZ1 LYS 50 HZ1 LYS 50 -13.878 4.394 -0.565
378 HZ2 LYS 50 HZ2 LYS 50 -13.222 3.732 -1.981
379 HZ3 LYS 50 HZ3 LYS 50 -13.395 5.413 -1.827
380 H GLN 51 H GLN 51 -7.027 7.125 -1.861
381 HA GLN 51 HA GLN 51 -7.245 7.725 -4.711
382 HB2 GLN 51 HB2 GLN 51 -4.621 7.901 -4.354
383 HB3 GLN 51 HB3 GLN 51 -5.701 9.234 -3.982
384 HG2 GLN 51 HG2 GLN 51 -5.658 8.621 -1.634
385 HG3 GLN 51 HG3 GLN 51 -4.609 7.254 -2.005
386 HE21 GLN 51 HE22 GLN 51 -3.141 8.828 -4.041
387 HE22 GLN 51 HE21 GLN 51 -2.103 9.882 -3.138
388 H PHE 52 H PHE 52 -6.012 6.542 -6.259
389 HA PHE 52 HA PHE 52 -5.752 3.715 -5.464
390 HB2 PHE 52 HB2 PHE 52 -7.724 3.923 -6.765
391 HB3 PHE 52 HB3 PHE 52 -6.946 4.994 -7.918
392 HD1 PHE 52 HD2 PHE 52 -6.632 1.501 -6.613
393 HD2 PHE 52 HD1 PHE 52 -6.318 4.140 -9.939
394 HE1 PHE 52 HE2 PHE 52 -6.169 -0.410 -8.083
395 HE2 PHE 52 HE1 PHE 52 -5.851 2.227 -11.415
396 HZ PHE 52 HZ PHE 52 -5.778 -0.051 -10.485
397 H GLY 53 H GLY 53 -4.037 2.560 -6.165
398 HA2 GLY 53 HA2 GLY 53 -2.525 2.968 -8.448
399 HA3 GLY 53 HA3 GLY 53 -1.720 3.874 -7.173
400 H THR 54 H THR 54 0.065 2.552 -7.244
401 HA THR 54 HA THR 54 -0.321 -0.205 -6.317
402 HB THR 54 HB THR 54 0.969 -0.222 -8.291
403 HG1 THR 54 HG1 THR 54 3.159 -0.219 -6.577
404 HG21 THR 54 HG21 THR 54 3.152 1.189 -8.336
405 HG22 THR 54 HG22 THR 54 2.337 2.172 -7.116
406 HG23 THR 54 HG23 THR 54 1.614 1.963 -8.716
407 H PHE 55 H PHE 55 0.705 -0.924 -4.475
408 HA PHE 55 HA PHE 55 2.314 0.971 -2.963
409 HB2 PHE 55 HB2 PHE 55 1.008 0.744 -0.942
410 HB3 PHE 55 HB3 PHE 55 -0.048 1.293 -2.227
411 HD1 PHE 55 HD1 PHE 55 -1.464 -0.475 -3.415
412 HD2 PHE 55 HD2 PHE 55 0.474 -1.141 0.309
413 HE1 PHE 55 HE1 PHE 55 -2.984 -2.357 -2.964
414 HE2 PHE 55 HE2 PHE 55 -1.039 -3.023 0.765
415 HZ PHE 55 HZ PHE 55 -2.767 -3.637 -0.874
416 HA PRO 56 HA PRO 56 4.684 -2.687 -2.286
417 HB2 PRO 56 HB3 PRO 56 5.617 -1.280 0.140
418 HB3 PRO 56 HB2 PRO 56 6.545 -1.902 -1.230
419 HG2 PRO 56 HG2 PRO 56 6.145 0.725 -0.884
420 HG3 PRO 56 HG3 PRO 56 6.200 -0.004 -2.498
421 HD2 PRO 56 HD2 PRO 56 3.837 0.891 -0.899
422 HD3 PRO 56 HD3 PRO 56 4.120 1.000 -2.648
423 H GLY 57 H GLY 57 3.540 -4.403 -1.593
424 HA2 GLY 57 HA2 GLY 57 1.750 -4.357 0.613
425 HA3 GLY 57 HA3 GLY 57 2.268 -5.783 -0.271
426 H ASN 58 H ASN 58 4.945 -4.177 0.745
427 HA ASN 58 HA ASN 58 5.614 -6.145 2.709
428 HB2 ASN 58 HB2 ASN 58 7.184 -5.053 1.029
429 HB3 ASN 58 HB3 ASN 58 7.096 -3.601 2.021
430 HD21 ASN 58 HD22 ASN 58 8.319 -6.830 1.776
431 HD22 ASN 58 HD21 ASN 58 9.391 -6.745 3.137
432 H TYR 59 H TYR 59 4.215 -2.992 2.725
433 HA TYR 59 HA TYR 59 4.914 -2.587 5.561
434 HB2 TYR 59 HB2 TYR 59 3.947 -0.506 3.597
435 HB3 TYR 59 HB3 TYR 59 4.606 -0.227 5.203
436 HD1 TYR 59 HD2 TYR 59 7.076 -1.170 5.543
437 HD2 TYR 59 HD1 TYR 59 5.313 -0.255 1.786
438 HE1 TYR 59 HE2 TYR 59 9.316 -0.973 4.548
439 HE2 TYR 59 HE1 TYR 59 7.538 -0.053 0.780
440 HH TYR 59 HH TYR 59 9.842 0.367 1.449
441 H VAL 60 H VAL 60 2.637 -4.190 4.463
442 HA VAL 60 HA VAL 60 0.534 -2.916 6.028
443 HB VAL 60 HB VAL 60 -1.195 -3.430 4.300
444 HG11 VAL 60 HG11 VAL 60 0.892 -1.545 3.209
445 HG12 VAL 60 HG12 VAL 60 -0.131 -1.152 4.591
446 HG13 VAL 60 HG13 VAL 60 -0.860 -1.459 3.009
447 HG21 VAL 60 HG21 VAL 60 1.230 -4.023 2.616
448 HG22 VAL 60 HG22 VAL 60 -0.362 -3.676 1.941
449 HG23 VAL 60 HG23 VAL 60 -0.134 -5.079 2.979
450 H LYS 61 H LYS 61 -1.152 -4.447 6.632
451 HA LYS 61 HA LYS 61 -0.230 -7.241 6.489
452 HB2 LYS 61 HB2 LYS 61 -1.416 -7.289 8.881
453 HB3 LYS 61 HB3 LYS 61 0.290 -6.932 8.674
454 HG2 LYS 61 HG2 LYS 61 -0.133 -4.573 8.848
455 HG3 LYS 61 HG3 LYS 61 -1.876 -4.848 8.913
456 HD2 LYS 61 HD2 LYS 61 -0.696 -4.426 11.116
457 HD3 LYS 61 HD3 LYS 61 -1.734 -5.851 11.043
458 HE2 LYS 61 HE2 LYS 61 0.238 -7.257 10.669
459 HE3 LYS 61 HE3 LYS 61 1.267 -5.828 10.724
460 HZ1 LYS 61 HZ1 LYS 61 0.595 -5.466 13.011
461 HZ2 LYS 61 HZ2 LYS 61 1.274 -7.008 12.829
462 HZ3 LYS 61 HZ3 LYS 61 -0.409 -6.828 12.964
463 HA PRO 62 HA PRO 62 -4.164 -8.238 4.901
464 HB2 PRO 62 HB3 PRO 62 -3.846 -10.844 6.242
465 HB3 PRO 62 HB2 PRO 62 -4.018 -10.477 4.526
466 HG2 PRO 62 HG2 PRO 62 -1.676 -11.263 5.547
467 HG3 PRO 62 HG3 PRO 62 -1.763 -10.048 4.257
468 HD2 PRO 62 HD2 PRO 62 -1.327 -9.666 7.193
469 HD3 PRO 62 HD3 PRO 62 -0.543 -8.853 5.822
470 H LEU 63 H LEU 63 -6.060 -7.642 5.613
471 HA LEU 63 HA LEU 63 -6.818 -8.065 8.398
472 HB2 LEU 63 HB2 LEU 63 -8.169 -6.553 6.159
473 HB3 LEU 63 HB3 LEU 63 -8.758 -6.635 7.807
474 HG LEU 63 HG LEU 63 -6.109 -5.439 7.008
475 HD11 LEU 63 HD11 LEU 63 -8.661 -4.039 7.775
476 HD12 LEU 63 HD12 LEU 63 -8.087 -4.240 6.121
477 HD13 LEU 63 HD13 LEU 63 -7.141 -3.293 7.272
478 HD21 LEU 63 HD21 LEU 63 -6.144 -6.274 9.294
479 HD22 LEU 63 HD22 LEU 63 -7.643 -5.397 9.605
480 HD23 LEU 63 HD23 LEU 63 -6.155 -4.510 9.279
481 H TYR 64 H TYR 64 -9.601 -8.200 8.012
482 HA TYR 64 HA TYR 64 -9.822 -10.900 6.866
483 HB2 TYR 64 HB2 TYR 64 -11.584 -11.262 8.708
484 HB3 TYR 64 HB3 TYR 64 -9.887 -11.327 9.155
485 HD1 TYR 64 HD2 TYR 64 -12.993 -9.374 9.405
486 HD2 TYR 64 HD1 TYR 64 -8.913 -9.637 10.588
487 HE1 TYR 64 HE2 TYR 64 -13.385 -7.658 11.123
488 HE2 TYR 64 HE1 TYR 64 -9.296 -7.927 12.308
489 HH TYR 64 HH TYR 64 -12.419 -6.891 13.220
490 H LEU 65 H LEU 65 -11.700 -11.491 5.921
491 HA LEU 65 HA LEU 65 -13.666 -9.360 5.443
492 HB2 LEU 65 HB2 LEU 65 -13.960 -10.343 3.119
493 HB3 LEU 65 HB3 LEU 65 -12.498 -9.424 3.399
494 HG LEU 65 HG LEU 65 -12.449 -12.418 3.623
495 HD11 LEU 65 HD11 LEU 65 -11.874 -12.543 1.252
496 HD12 LEU 65 HD12 LEU 65 -12.193 -10.817 1.080
497 HD13 LEU 65 HD13 LEU 65 -13.509 -11.921 1.477
498 HD21 LEU 65 HD21 LEU 65 -10.129 -12.117 2.968
499 HD22 LEU 65 HD22 LEU 65 -10.496 -11.104 4.365
500 HD23 LEU 65 HD23 LEU 65 -10.388 -10.386 2.756
Start of MODEL 8
1 H1 GLN 1 H1 GLN 1 -19.233 -1.247 -6.565
2 H2 GLN 1 H2 GLN 1 -18.507 -1.816 -7.987
3 H3 GLN 1 H3 GLN 1 -18.611 -0.146 -7.692
4 HA GLN 1 HA GLN 1 -16.379 -1.135 -7.322
5 HB2 GLN 1 HB2 GLN 1 -17.157 0.997 -6.267
6 HB3 GLN 1 HB3 GLN 1 -17.685 0.067 -4.871
7 HG2 GLN 1 HG2 GLN 1 -15.358 -0.687 -4.543
8 HG3 GLN 1 HG3 GLN 1 -14.866 0.347 -5.883
9 HE21 GLN 1 HE22 GLN 1 -17.324 1.169 -3.531
10 HE22 GLN 1 HE21 GLN 1 -16.451 2.468 -2.793
11 H THR 2 H THR 2 -18.525 -1.751 -4.541
12 HA THR 2 HA THR 2 -18.743 -3.515 -3.135
13 HB THR 2 HB THR 2 -17.428 -5.225 -5.252
14 HG1 THR 2 HG1 THR 2 -20.028 -5.407 -5.515
15 HG21 THR 2 HG21 THR 2 -18.907 -6.967 -4.345
16 HG22 THR 2 HG22 THR 2 -19.522 -5.819 -3.154
17 HG23 THR 2 HG23 THR 2 -17.832 -6.321 -3.102
18 H SER 3 H SER 3 -16.889 -2.115 -2.155
19 HA SER 3 HA SER 3 -14.396 -3.592 -1.894
20 HB2 SER 3 HB2 SER 3 -15.334 -1.065 -0.508
21 HB3 SER 3 HB3 SER 3 -13.703 -1.731 -0.439
22 HG SER 3 HG SER 3 -13.747 -0.148 -2.010
23 H GLN 4 H GLN 4 -16.387 -5.187 -1.164
24 HA GLN 4 HA GLN 4 -16.716 -5.077 1.729
25 HB2 GLN 4 HB2 GLN 4 -18.685 -5.569 0.395
26 HB3 GLN 4 HB3 GLN 4 -17.865 -6.915 -0.379
27 HG2 GLN 4 HG2 GLN 4 -19.372 -7.775 1.248
28 HG3 GLN 4 HG3 GLN 4 -17.716 -8.027 1.812
29 HE21 GLN 4 HE22 GLN 4 -19.296 -4.918 1.900
30 HE22 GLN 4 HE21 GLN 4 -19.455 -4.817 3.618
31 H ASP 5 H ASP 5 -16.556 -8.146 0.111
32 HA ASP 5 HA ASP 5 -14.223 -8.972 1.580
33 HB2 ASP 5 HB2 ASP 5 -15.701 -10.332 -0.686
34 HB3 ASP 5 HB3 ASP 5 -14.431 -11.072 0.281
35 H LEU 6 H LEU 6 -13.511 -6.754 0.200
36 HA LEU 6 HA LEU 6 -11.979 -7.729 -2.110
37 HB2 LEU 6 HB2 LEU 6 -13.572 -5.906 -2.578
38 HB3 LEU 6 HB3 LEU 6 -12.765 -4.902 -1.391
39 HG LEU 6 HG LEU 6 -10.709 -4.958 -2.776
40 HD11 LEU 6 HD11 LEU 6 -12.452 -6.388 -4.779
41 HD12 LEU 6 HD12 LEU 6 -11.102 -7.097 -3.893
42 HD13 LEU 6 HD13 LEU 6 -10.812 -5.802 -5.054
43 HD21 LEU 6 HD21 LEU 6 -12.313 -3.122 -2.987
44 HD22 LEU 6 HD22 LEU 6 -13.179 -4.020 -4.236
45 HD23 LEU 6 HD23 LEU 6 -11.526 -3.473 -4.527
46 H PHE 7 H PHE 7 -10.771 -8.619 -0.253
47 HA PHE 7 HA PHE 7 -9.180 -8.417 1.501
48 HB2 PHE 7 HB2 PHE 7 -8.414 -8.929 -1.134
49 HB3 PHE 7 HB3 PHE 7 -7.166 -7.860 -0.489
50 HD1 PHE 7 HD2 PHE 7 -6.343 -8.507 1.938
51 HD2 PHE 7 HD1 PHE 7 -8.174 -11.186 -0.817
52 HE1 PHE 7 HE2 PHE 7 -5.325 -10.411 3.118
53 HE2 PHE 7 HE1 PHE 7 -7.163 -13.093 0.362
54 HZ PHE 7 HZ PHE 7 -5.735 -12.710 2.332
55 H SER 8 H SER 8 -8.920 -6.848 2.929
56 HA SER 8 HA SER 8 -7.664 -4.362 1.975
57 HB2 SER 8 HB2 SER 8 -10.071 -4.325 2.950
58 HB3 SER 8 HB3 SER 8 -9.273 -4.543 4.505
59 HG SER 8 HG SER 8 -9.355 -2.357 2.812
60 H TYR 9 H TYR 9 -5.949 -3.540 3.103
61 HA TYR 9 HA TYR 9 -4.965 -5.139 5.380
62 HB2 TYR 9 HB2 TYR 9 -3.276 -3.632 3.373
63 HB3 TYR 9 HB3 TYR 9 -2.680 -4.554 4.743
64 HD1 TYR 9 HD2 TYR 9 -4.232 -7.073 4.479
65 HD2 TYR 9 HD1 TYR 9 -2.388 -4.627 1.543
66 HE1 TYR 9 HE2 TYR 9 -3.970 -9.032 3.016
67 HE2 TYR 9 HE1 TYR 9 -2.118 -6.572 0.068
68 HH TYR 9 HH TYR 9 -1.967 -9.066 0.329
69 H GLN 10 H GLN 10 -3.907 -3.951 7.031
70 HA GLN 10 HA GLN 10 -4.355 -1.041 6.901
71 HB2 GLN 10 HB2 GLN 10 -5.446 -2.388 8.787
72 HB3 GLN 10 HB3 GLN 10 -3.819 -2.600 9.423
73 HG2 GLN 10 HG2 GLN 10 -3.563 -0.154 9.494
74 HG3 GLN 10 HG3 GLN 10 -5.226 0.015 8.956
75 HE21 GLN 10 HE22 GLN 10 -6.904 -0.538 10.361
76 HE22 GLN 10 HE21 GLN 10 -6.656 -0.697 12.065
77 H ALA 11 H ALA 11 -2.634 0.306 7.214
78 HA ALA 11 HA ALA 11 -0.129 -0.737 6.393
79 HB1 ALA 11 HB1 ALA 11 0.610 1.610 6.583
80 HB2 ALA 11 HB2 ALA 11 -0.941 1.989 7.344
81 HB3 ALA 11 HB3 ALA 11 -0.892 1.423 5.672
82 H LEU 12 H LEU 12 1.722 -1.046 7.414
83 HA LEU 12 HA LEU 12 1.764 -1.071 10.335
84 HB2 LEU 12 HB2 LEU 12 3.651 -2.159 8.251
85 HB3 LEU 12 HB3 LEU 12 3.937 -2.265 9.977
86 HG LEU 12 HG LEU 12 1.357 -3.337 9.054
87 HD11 LEU 12 HD11 LEU 12 3.979 -4.646 8.359
88 HD12 LEU 12 HD12 LEU 12 2.736 -4.082 7.236
89 HD13 LEU 12 HD13 LEU 12 2.404 -5.446 8.308
90 HD21 LEU 12 HD21 LEU 12 3.527 -4.334 10.895
91 HD22 LEU 12 HD22 LEU 12 1.949 -5.088 10.670
92 HD23 LEU 12 HD23 LEU 12 2.065 -3.477 11.379
93 H TYR 13 H TYR 13 3.137 0.600 7.613
94 HA TYR 13 HA TYR 13 4.798 2.223 9.411
95 HB2 TYR 13 HB2 TYR 13 5.688 1.103 6.745
96 HB3 TYR 13 HB3 TYR 13 6.599 2.244 7.719
97 HD1 TYR 13 HD2 TYR 13 7.708 1.520 9.775
98 HD2 TYR 13 HD1 TYR 13 5.588 -1.247 7.333
99 HE1 TYR 13 HE2 TYR 13 8.808 -0.344 10.939
100 HE2 TYR 13 HE1 TYR 13 6.685 -3.117 8.490
101 HH TYR 13 HH TYR 13 8.353 -2.755 11.392
102 H SER 14 H SER 14 5.537 4.238 8.331
103 HA SER 14 HA SER 14 3.439 5.278 6.584
104 HB2 SER 14 HB2 SER 14 4.725 7.494 7.203
105 HB3 SER 14 HB3 SER 14 3.620 6.751 8.360
106 HG SER 14 HG SER 14 5.839 7.392 9.090
107 H TYR 15 H TYR 15 3.865 5.537 4.462
108 HA TYR 15 HA TYR 15 6.695 5.526 3.610
109 HB2 TYR 15 HB2 TYR 15 5.832 3.330 3.168
110 HB3 TYR 15 HB3 TYR 15 4.375 3.981 2.457
111 HD1 TYR 15 HD2 TYR 15 8.022 3.577 1.909
112 HD2 TYR 15 HD1 TYR 15 4.254 4.521 0.190
113 HE1 TYR 15 HE2 TYR 15 9.011 3.421 -0.340
114 HE2 TYR 15 HE1 TYR 15 5.224 4.355 -2.056
115 HH TYR 15 HH TYR 15 7.196 4.320 -3.218
116 H ILE 16 H ILE 16 7.264 6.848 2.023
117 HA ILE 16 HA ILE 16 5.225 8.696 0.987
118 HB ILE 16 HB ILE 16 8.211 9.058 1.295
119 HG12 ILE 16 HG12 ILE 16 7.048 9.205 3.424
120 HG13 ILE 16 HG13 ILE 16 7.570 10.811 2.931
121 HG21 ILE 16 HG21 ILE 16 7.839 11.367 0.548
122 HG22 ILE 16 HG22 ILE 16 6.146 10.984 0.238
123 HG23 ILE 16 HG23 ILE 16 7.414 10.196 -0.702
124 HD11 ILE 16 HD11 ILE 16 5.305 11.304 2.161
125 HD12 ILE 16 HD12 ILE 16 5.335 10.867 3.869
126 HD13 ILE 16 HD13 ILE 16 4.789 9.696 2.668
127 HA PRO 17 HA PRO 17 5.850 6.260 -2.735
128 HB2 PRO 17 HB3 PRO 17 4.074 8.379 -3.800
129 HB3 PRO 17 HB2 PRO 17 3.896 6.623 -3.864
130 HG2 PRO 17 HG2 PRO 17 2.389 8.085 -2.231
131 HG3 PRO 17 HG3 PRO 17 3.013 6.504 -1.721
132 HD2 PRO 17 HD2 PRO 17 3.976 9.246 -1.013
133 HD3 PRO 17 HD3 PRO 17 3.830 7.801 0.009
134 H GLN 18 H GLN 18 7.078 6.446 -4.486
135 HA GLN 18 HA GLN 18 8.577 8.905 -4.844
136 HB2 GLN 18 HB2 GLN 18 8.830 6.223 -6.215
137 HB3 GLN 18 HB3 GLN 18 9.960 7.562 -6.370
138 HG2 GLN 18 HG2 GLN 18 9.331 6.128 -3.798
139 HG3 GLN 18 HG3 GLN 18 10.733 5.804 -4.823
140 HE21 GLN 18 HE22 GLN 18 12.402 7.320 -4.918
141 HE22 GLN 18 HE21 GLN 18 12.552 8.596 -3.760
142 H ASN 19 H ASN 19 5.942 7.271 -6.131
143 HA ASN 19 HA ASN 19 5.808 9.105 -8.419
144 HB2 ASN 19 HB2 ASN 19 5.241 6.136 -8.409
145 HB3 ASN 19 HB3 ASN 19 4.802 7.210 -9.732
146 HD21 ASN 19 HD22 ASN 19 7.332 5.529 -8.111
147 HD22 ASN 19 HD21 ASN 19 8.578 5.840 -9.283
148 H ASP 20 H ASP 20 3.686 9.663 -9.035
149 HA ASP 20 HA ASP 20 1.759 9.665 -6.920
150 HB2 ASP 20 HB2 ASP 20 0.344 10.926 -8.412
151 HB3 ASP 20 HB3 ASP 20 1.992 11.521 -8.578
152 H ASP 21 H ASP 21 2.583 7.416 -9.252
153 HA ASP 21 HA ASP 21 0.006 6.161 -9.529
154 HB2 ASP 21 HB2 ASP 21 2.813 5.404 -10.276
155 HB3 ASP 21 HB3 ASP 21 1.548 4.183 -10.286
156 H GLU 22 H GLU 22 2.359 6.347 -7.141
157 HA GLU 22 HA GLU 22 1.665 3.780 -5.942
158 HB2 GLU 22 HB2 GLU 22 3.700 5.884 -5.239
159 HB3 GLU 22 HB3 GLU 22 3.378 4.497 -4.216
160 HG2 GLU 22 HG2 GLU 22 4.287 3.005 -5.722
161 HG3 GLU 22 HG3 GLU 22 4.101 4.104 -7.085
162 H LEU 23 H LEU 23 1.145 3.758 -3.635
163 HA LEU 23 HA LEU 23 -0.887 5.806 -3.125
164 HB2 LEU 23 HB2 LEU 23 -1.265 3.193 -3.236
165 HB3 LEU 23 HB3 LEU 23 -0.686 3.247 -1.582
166 HG LEU 23 HG LEU 23 -3.192 3.276 -1.847
167 HD11 LEU 23 HD11 LEU 23 -1.943 5.642 -0.463
168 HD12 LEU 23 HD12 LEU 23 -2.162 4.029 0.217
169 HD13 LEU 23 HD13 LEU 23 -3.568 5.019 -0.173
170 HD21 LEU 23 HD21 LEU 23 -3.415 4.630 -3.787
171 HD22 LEU 23 HD22 LEU 23 -2.572 5.970 -3.014
172 HD23 LEU 23 HD23 LEU 23 -4.166 5.490 -2.443
173 H GLU 24 H GLU 24 -0.884 7.035 -1.325
174 HA GLU 24 HA GLU 24 1.599 7.220 0.105
175 HB2 GLU 24 HB2 GLU 24 -0.709 8.907 -0.341
176 HB3 GLU 24 HB3 GLU 24 -0.220 8.917 1.351
177 HG2 GLU 24 HG2 GLU 24 2.033 9.506 0.724
178 HG3 GLU 24 HG3 GLU 24 1.594 9.437 -0.984
179 H LEU 25 H LEU 25 2.063 5.967 1.730
180 HA LEU 25 HA LEU 25 -0.153 4.766 3.223
181 HB2 LEU 25 HB2 LEU 25 2.728 3.913 3.160
182 HB3 LEU 25 HB3 LEU 25 1.396 3.040 3.877
183 HG LEU 25 HG LEU 25 1.648 3.600 0.923
184 HD11 LEU 25 HD11 LEU 25 2.268 1.091 2.471
185 HD12 LEU 25 HD12 LEU 25 3.441 2.146 1.684
186 HD13 LEU 25 HD13 LEU 25 2.270 1.249 0.714
187 HD21 LEU 25 HD21 LEU 25 -0.193 1.787 2.480
188 HD22 LEU 25 HD22 LEU 25 -0.107 1.902 0.723
189 HD23 LEU 25 HD23 LEU 25 -0.647 3.285 1.672
190 H ARG 26 H ARG 26 -0.395 5.054 5.322
191 HA ARG 26 HA ARG 26 1.782 6.202 6.902
192 HB2 ARG 26 HB2 ARG 26 0.018 7.479 8.194
193 HB3 ARG 26 HB3 ARG 26 0.360 8.086 6.583
194 HG2 ARG 26 HG2 ARG 26 -1.641 7.293 5.721
195 HG3 ARG 26 HG3 ARG 26 -1.879 6.165 7.054
196 HD2 ARG 26 HD2 ARG 26 -2.097 8.222 8.535
197 HD3 ARG 26 HD3 ARG 26 -2.218 9.151 7.037
198 HE ARG 26 HE ARG 26 -4.101 7.467 6.524
199 HH11 ARG 26 HH11 ARG 26 -3.408 8.872 9.669
200 HH12 ARG 26 HH12 ARG 26 -5.002 8.549 10.289
201 HH21 ARG 26 HH22 ARG 26 -6.166 7.045 7.333
202 HH22 ARG 26 HH21 ARG 26 -6.597 7.558 8.944
203 H ASP 27 H ASP 27 1.921 5.376 8.920
204 HA ASP 27 HA ASP 27 1.027 2.789 9.366
205 HB2 ASP 27 HB2 ASP 27 2.912 3.590 10.598
206 HB3 ASP 27 HB3 ASP 27 1.962 4.881 11.330
207 H GLY 28 H GLY 28 -0.932 2.041 9.680
208 HA2 GLY 28 HA2 GLY 28 -2.804 1.759 11.098
209 HA3 GLY 28 HA3 GLY 28 -2.717 3.460 11.528
210 H ASP 29 H ASP 29 -2.342 3.545 8.292
211 HA ASP 29 HA ASP 29 -5.172 4.068 7.845
212 HB2 ASP 29 HB2 ASP 29 -3.234 5.482 6.900
213 HB3 ASP 29 HB3 ASP 29 -3.015 4.178 5.736
214 H ILE 30 H ILE 30 -6.440 2.995 6.242
215 HA ILE 30 HA ILE 30 -5.541 0.237 5.817
216 HB ILE 30 HB ILE 30 -8.305 1.423 5.979
217 HG12 ILE 30 HG12 ILE 30 -8.413 -0.539 7.696
218 HG13 ILE 30 HG13 ILE 30 -6.662 -0.446 7.628
219 HG21 ILE 30 HG21 ILE 30 -7.574 -1.395 5.212
220 HG22 ILE 30 HG22 ILE 30 -8.333 -0.197 4.166
221 HG23 ILE 30 HG23 ILE 30 -9.199 -0.817 5.569
222 HD11 ILE 30 HD11 ILE 30 -7.422 0.829 9.491
223 HD12 ILE 30 HD12 ILE 30 -8.567 1.715 8.484
224 HD13 ILE 30 HD13 ILE 30 -6.837 1.941 8.259
225 H VAL 31 H VAL 31 -5.462 -0.668 3.861
226 HA VAL 31 HA VAL 31 -6.328 0.926 1.547
227 HB VAL 31 HB VAL 31 -3.655 -0.410 1.918
228 HG11 VAL 31 HG11 VAL 31 -3.211 0.023 -0.463
229 HG12 VAL 31 HG12 VAL 31 -4.887 0.534 -0.673
230 HG13 VAL 31 HG13 VAL 31 -4.522 -1.138 -0.246
231 HG21 VAL 31 HG21 VAL 31 -2.789 1.760 1.255
232 HG22 VAL 31 HG22 VAL 31 -3.893 1.937 2.621
233 HG23 VAL 31 HG23 VAL 31 -4.431 2.348 0.991
234 H ASP 32 H ASP 32 -7.660 -0.156 0.284
235 HA ASP 32 HA ASP 32 -7.990 -3.031 0.593
236 HB2 ASP 32 HB2 ASP 32 -9.422 -1.246 -1.379
237 HB3 ASP 32 HB3 ASP 32 -9.951 -2.803 -0.755
238 H VAL 33 H VAL 33 -6.786 -4.391 -0.589
239 HA VAL 33 HA VAL 33 -5.476 -3.412 -2.996
240 HB VAL 33 HB VAL 33 -4.019 -4.632 -1.579
241 HG11 VAL 33 HG11 VAL 33 -6.217 -6.637 -1.428
242 HG12 VAL 33 HG12 VAL 33 -5.258 -5.904 -0.133
243 HG13 VAL 33 HG13 VAL 33 -4.544 -7.134 -1.176
244 HG21 VAL 33 HG21 VAL 33 -4.814 -6.460 -3.831
245 HG22 VAL 33 HG22 VAL 33 -3.253 -6.426 -3.009
246 HG23 VAL 33 HG23 VAL 33 -3.772 -5.043 -3.977
247 H MET 34 H MET 34 -6.154 -3.802 -4.984
248 HA MET 34 HA MET 34 -8.403 -5.664 -5.301
249 HB2 MET 34 HB2 MET 34 -9.294 -4.319 -6.970
250 HB3 MET 34 HB3 MET 34 -8.664 -3.165 -5.815
251 HG2 MET 34 HG2 MET 34 -7.979 -2.244 -7.794
252 HG3 MET 34 HG3 MET 34 -6.555 -3.191 -7.356
253 HE1 MET 34 HE1 MET 34 -7.071 -2.118 -10.301
254 HE2 MET 34 HE2 MET 34 -6.687 -3.534 -11.277
255 HE3 MET 34 HE3 MET 34 -5.675 -3.118 -9.895
256 H GLU 35 H GLU 35 -5.218 -4.804 -6.479
257 HA GLU 35 HA GLU 35 -5.287 -7.234 -8.139
258 HB2 GLU 35 HB2 GLU 35 -5.228 -5.168 -9.514
259 HB3 GLU 35 HB3 GLU 35 -3.703 -4.739 -8.755
260 HG2 GLU 35 HG2 GLU 35 -2.782 -6.899 -9.600
261 HG3 GLU 35 HG3 GLU 35 -4.278 -7.107 -10.508
262 H LYS 36 H LYS 36 -3.591 -8.563 -8.032
263 HA LYS 36 HA LYS 36 -1.562 -7.934 -5.996
264 HB2 LYS 36 HB2 LYS 36 -2.790 -10.584 -6.750
265 HB3 LYS 36 HB3 LYS 36 -1.383 -10.421 -5.707
266 HG2 LYS 36 HG2 LYS 36 -2.679 -9.209 -4.076
267 HG3 LYS 36 HG3 LYS 36 -4.087 -9.220 -5.143
268 HD2 LYS 36 HD2 LYS 36 -2.740 -11.702 -4.098
269 HD3 LYS 36 HD3 LYS 36 -4.144 -10.948 -3.334
270 HE2 LYS 36 HE2 LYS 36 -5.486 -11.323 -5.276
271 HE3 LYS 36 HE3 LYS 36 -4.086 -11.858 -6.203
272 HZ1 LYS 36 HZ1 LYS 36 -3.910 -13.794 -4.833
273 HZ2 LYS 36 HZ2 LYS 36 -5.494 -13.691 -5.433
274 HZ3 LYS 36 HZ3 LYS 36 -5.163 -13.265 -3.824
275 H CYS 37 H CYS 37 0.516 -8.031 -6.591
276 HA CYS 37 HA CYS 37 1.140 -9.123 -9.248
277 HB2 CYS 37 HB2 CYS 37 2.777 -7.209 -7.567
278 HB3 CYS 37 HB3 CYS 37 3.119 -7.712 -9.221
279 HG CYS 37 HG CYS 37 1.805 -5.844 -10.377
280 H ASP 38 H ASP 38 2.696 -10.652 -9.467
281 HA ASP 38 HA ASP 38 3.349 -12.225 -7.178
282 HB2 ASP 38 HB2 ASP 38 4.562 -13.654 -8.734
283 HB3 ASP 38 HB3 ASP 38 3.000 -13.217 -9.417
284 H ASP 39 H ASP 39 4.621 -9.406 -8.379
285 HA ASP 39 HA ASP 39 7.383 -9.885 -7.699
286 HB2 ASP 39 HB2 ASP 39 6.691 -8.298 -9.499
287 HB3 ASP 39 HB3 ASP 39 5.969 -7.269 -8.269
288 H GLY 40 H GLY 40 4.524 -9.075 -5.971
289 HA2 GLY 40 HA2 GLY 40 4.777 -9.545 -3.576
290 HA3 GLY 40 HA3 GLY 40 6.278 -8.634 -3.626
291 H TRP 41 H TRP 41 5.203 -6.493 -5.256
292 HA TRP 41 HA TRP 41 3.809 -5.060 -3.148
293 HB2 TRP 41 HB2 TRP 41 4.452 -3.896 -5.842
294 HB3 TRP 41 HB3 TRP 41 4.352 -3.086 -4.283
295 HD1 TRP 41 HD1 TRP 41 6.829 -3.672 -6.655
296 HE1 TRP 41 HE1 TRP 41 9.175 -4.038 -5.681
297 HE3 TRP 41 HE3 TRP 41 5.566 -4.722 -1.783
298 HZ2 TRP 41 HZ2 TRP 41 10.344 -4.675 -3.202
299 HZ3 TRP 41 HZ3 TRP 41 7.370 -5.200 -0.196
300 HH2 TRP 41 HH2 TRP 41 9.708 -5.179 -0.886
301 H PHE 42 H PHE 42 1.752 -4.000 -3.525
302 HA PHE 42 HA PHE 42 0.142 -5.569 -5.416
303 HB2 PHE 42 HB2 PHE 42 -0.579 -4.734 -2.601
304 HB3 PHE 42 HB3 PHE 42 -1.627 -5.594 -3.713
305 HD1 PHE 42 HD1 PHE 42 0.387 -7.535 -4.850
306 HD2 PHE 42 HD2 PHE 42 -0.386 -6.264 -0.858
307 HE1 PHE 42 HE1 PHE 42 1.239 -9.677 -4.007
308 HE2 PHE 42 HE2 PHE 42 0.477 -8.405 -0.011
309 HZ PHE 42 HZ PHE 42 1.292 -10.113 -1.585
310 H VAL 43 H VAL 43 -2.027 -4.578 -5.833
311 HA VAL 43 HA VAL 43 -1.763 -1.654 -6.058
312 HB VAL 43 HB VAL 43 -2.897 -3.717 -7.891
313 HG11 VAL 43 HG11 VAL 43 -3.907 -0.870 -7.837
314 HG12 VAL 43 HG12 VAL 43 -4.854 -2.282 -7.368
315 HG13 VAL 43 HG13 VAL 43 -4.304 -2.102 -9.034
316 HG21 VAL 43 HG21 VAL 43 -1.892 -2.243 -9.548
317 HG22 VAL 43 HG22 VAL 43 -0.733 -2.653 -8.277
318 HG23 VAL 43 HG23 VAL 43 -1.537 -1.081 -8.268
319 H GLY 44 H GLY 44 -3.230 -0.397 -5.081
320 HA2 GLY 44 HA2 GLY 44 -5.717 -1.545 -4.087
321 HA3 GLY 44 HA3 GLY 44 -4.518 -1.156 -2.865
322 H THR 45 H THR 45 -6.558 0.103 -2.290
323 HA THR 45 HA THR 45 -6.232 2.835 -3.314
324 HB THR 45 HB THR 45 -8.834 1.421 -2.735
325 HG1 THR 45 HG1 THR 45 -7.400 2.015 -5.036
326 HG21 THR 45 HG21 THR 45 -9.902 3.514 -3.538
327 HG22 THR 45 HG22 THR 45 -8.319 4.283 -3.516
328 HG23 THR 45 HG23 THR 45 -9.036 3.705 -2.014
329 H SER 46 H SER 46 -6.328 4.405 -1.764
330 HA SER 46 HA SER 46 -5.924 3.612 0.957
331 HB2 SER 46 HB2 SER 46 -4.776 5.586 0.040
332 HB3 SER 46 HB3 SER 46 -6.328 6.367 -0.255
333 HG SER 46 HG SER 46 -5.197 5.679 2.272
334 H ARG 47 H ARG 47 -7.403 3.420 2.522
335 HA ARG 47 HA ARG 47 -10.185 3.648 1.964
336 HB2 ARG 47 HB2 ARG 47 -9.198 2.039 3.565
337 HB3 ARG 47 HB3 ARG 47 -8.768 3.379 4.616
338 HG2 ARG 47 HG2 ARG 47 -11.255 3.926 4.643
339 HG3 ARG 47 HG3 ARG 47 -11.487 2.314 3.959
340 HD2 ARG 47 HD2 ARG 47 -10.233 1.360 5.858
341 HD3 ARG 47 HD3 ARG 47 -10.079 2.976 6.529
342 HE ARG 47 HE ARG 47 -12.799 2.179 6.017
343 HH11 ARG 47 HH11 ARG 47 -10.174 2.169 8.320
344 HH12 ARG 47 HH12 ARG 47 -11.206 1.994 9.705
345 HH21 ARG 47 HH22 ARG 47 -14.176 1.955 7.804
346 HH22 ARG 47 HH21 ARG 47 -13.500 1.804 9.402
347 H ARG 48 H ARG 48 -7.801 5.812 3.231
348 HA ARG 48 HA ARG 48 -9.675 7.495 4.632
349 HB2 ARG 48 HB2 ARG 48 -7.306 7.180 5.344
350 HB3 ARG 48 HB3 ARG 48 -6.793 8.049 3.907
351 HG2 ARG 48 HG2 ARG 48 -8.170 9.984 4.720
352 HG3 ARG 48 HG3 ARG 48 -8.343 9.107 6.242
353 HD2 ARG 48 HD2 ARG 48 -5.921 9.030 6.479
354 HD3 ARG 48 HD3 ARG 48 -5.746 9.890 4.952
355 HE ARG 48 HE ARG 48 -7.362 11.454 6.577
356 HH11 ARG 48 HH11 ARG 48 -4.072 10.270 6.518
357 HH12 ARG 48 HH12 ARG 48 -3.438 11.574 7.475
358 HH21 ARG 48 HH22 ARG 48 -6.545 13.176 7.841
359 HH22 ARG 48 HH21 ARG 48 -4.848 13.244 8.209
360 H THR 49 H THR 49 -7.704 7.804 1.698
361 HA THR 49 HA THR 49 -9.216 10.244 1.061
362 HB THR 49 HB THR 49 -7.007 10.915 1.367
363 HG1 THR 49 HG1 THR 49 -6.782 10.440 -1.394
364 HG21 THR 49 HG21 THR 49 -5.060 9.766 0.337
365 HG22 THR 49 HG22 THR 49 -6.151 8.478 -0.173
366 HG23 THR 49 HG23 THR 49 -5.912 8.800 1.543
367 H LYS 50 H LYS 50 -8.767 7.070 0.140
368 HA LYS 50 HA LYS 50 -9.595 5.797 -1.515
369 HB2 LYS 50 HB2 LYS 50 -11.225 8.217 -2.299
370 HB3 LYS 50 HB3 LYS 50 -11.534 6.557 -2.767
371 HG2 LYS 50 HG2 LYS 50 -11.913 7.859 -0.097
372 HG3 LYS 50 HG3 LYS 50 -13.076 6.974 -1.080
373 HD2 LYS 50 HD2 LYS 50 -10.760 5.833 0.481
374 HD3 LYS 50 HD3 LYS 50 -12.476 5.628 0.824
375 HE2 LYS 50 HE2 LYS 50 -11.091 4.639 -1.661
376 HE3 LYS 50 HE3 LYS 50 -11.392 3.653 -0.237
377 HZ1 LYS 50 HZ1 LYS 50 -13.680 3.704 -0.593
378 HZ2 LYS 50 HZ2 LYS 50 -13.028 3.485 -2.138
379 HZ3 LYS 50 HZ3 LYS 50 -13.596 5.012 -1.672
380 H GLN 51 H GLN 51 -7.144 7.036 -2.049
381 HA GLN 51 HA GLN 51 -7.256 7.644 -4.897
382 HB2 GLN 51 HB2 GLN 51 -4.617 7.555 -4.436
383 HB3 GLN 51 HB3 GLN 51 -5.583 8.996 -4.158
384 HG2 GLN 51 HG2 GLN 51 -5.647 8.610 -1.834
385 HG3 GLN 51 HG3 GLN 51 -5.009 6.979 -2.015
386 HE21 GLN 51 HE22 GLN 51 -3.755 9.703 -3.808
387 HE22 GLN 51 HE21 GLN 51 -2.238 9.784 -2.988
388 H PHE 52 H PHE 52 -6.277 6.350 -6.461
389 HA PHE 52 HA PHE 52 -5.975 3.542 -5.622
390 HB2 PHE 52 HB2 PHE 52 -7.947 3.734 -6.929
391 HB3 PHE 52 HB3 PHE 52 -7.158 4.768 -8.109
392 HD1 PHE 52 HD2 PHE 52 -6.813 1.327 -6.689
393 HD2 PHE 52 HD1 PHE 52 -6.579 3.848 -10.107
394 HE1 PHE 52 HE2 PHE 52 -6.345 -0.632 -8.096
395 HE2 PHE 52 HE1 PHE 52 -6.108 1.894 -11.524
396 HZ PHE 52 HZ PHE 52 -5.990 -0.350 -10.518
397 H GLY 53 H GLY 53 -4.166 2.483 -6.117
398 HA2 GLY 53 HA2 GLY 53 -2.612 2.855 -8.412
399 HA3 GLY 53 HA3 GLY 53 -1.886 3.806 -7.123
400 H THR 54 H THR 54 -0.057 2.548 -7.163
401 HA THR 54 HA THR 54 -0.370 -0.223 -6.234
402 HB THR 54 HB THR 54 0.875 -0.138 -8.258
403 HG1 THR 54 HG1 THR 54 2.805 -0.344 -6.175
404 HG21 THR 54 HG21 THR 54 3.153 1.218 -8.108
405 HG22 THR 54 HG22 THR 54 2.207 2.202 -6.989
406 HG23 THR 54 HG23 THR 54 1.656 1.977 -8.651
407 H PHE 55 H PHE 55 0.627 -0.912 -4.394
408 HA PHE 55 HA PHE 55 2.285 0.984 -2.917
409 HB2 PHE 55 HB2 PHE 55 1.051 0.719 -0.860
410 HB3 PHE 55 HB3 PHE 55 -0.065 1.258 -2.106
411 HD1 PHE 55 HD1 PHE 55 -1.471 -0.535 -3.264
412 HD2 PHE 55 HD2 PHE 55 0.583 -1.172 0.402
413 HE1 PHE 55 HE1 PHE 55 -2.949 -2.438 -2.769
414 HE2 PHE 55 HE2 PHE 55 -0.887 -3.079 0.902
415 HZ PHE 55 HZ PHE 55 -2.659 -3.715 -0.685
416 HA PRO 56 HA PRO 56 4.643 -2.685 -2.149
417 HB2 PRO 56 HB3 PRO 56 5.570 -1.273 0.270
418 HB3 PRO 56 HB2 PRO 56 6.500 -1.885 -1.103
419 HG2 PRO 56 HG2 PRO 56 6.102 0.740 -0.745
420 HG3 PRO 56 HG3 PRO 56 6.148 0.019 -2.364
421 HD2 PRO 56 HD2 PRO 56 3.784 0.863 -0.727
422 HD3 PRO 56 HD3 PRO 56 4.070 1.051 -2.470
423 H GLY 57 H GLY 57 3.396 -4.329 -1.483
424 HA2 GLY 57 HA2 GLY 57 1.510 -4.185 0.616
425 HA3 GLY 57 HA3 GLY 57 2.023 -5.644 -0.212
426 H ASN 58 H ASN 58 4.779 -4.324 0.939
427 HA ASN 58 HA ASN 58 4.946 -6.188 3.087
428 HB2 ASN 58 HB2 ASN 58 7.214 -5.823 2.965
429 HB3 ASN 58 HB3 ASN 58 6.714 -5.475 1.324
430 HD21 ASN 58 HD22 ASN 58 6.862 -3.393 0.552
431 HD22 ASN 58 HD21 ASN 58 7.691 -2.138 1.398
432 H TYR 59 H TYR 59 4.073 -2.888 2.759
433 HA TYR 59 HA TYR 59 4.742 -2.276 5.549
434 HB2 TYR 59 HB2 TYR 59 3.598 -0.487 3.394
435 HB3 TYR 59 HB3 TYR 59 4.042 0.028 5.014
436 HD1 TYR 59 HD2 TYR 59 6.612 -0.737 5.595
437 HD2 TYR 59 HD1 TYR 59 5.019 0.113 1.750
438 HE1 TYR 59 HE2 TYR 59 8.872 -0.198 4.783
439 HE2 TYR 59 HE1 TYR 59 7.261 0.656 0.927
440 HH TYR 59 HH TYR 59 10.058 -0.173 2.548
441 H VAL 60 H VAL 60 2.454 -4.059 4.563
442 HA VAL 60 HA VAL 60 0.398 -2.758 6.165
443 HB VAL 60 HB VAL 60 -1.377 -3.418 4.519
444 HG11 VAL 60 HG11 VAL 60 0.634 -1.412 3.497
445 HG12 VAL 60 HG12 VAL 60 -0.599 -1.096 4.719
446 HG13 VAL 60 HG13 VAL 60 -1.074 -1.492 3.066
447 HG21 VAL 60 HG21 VAL 60 1.016 -3.896 2.759
448 HG22 VAL 60 HG22 VAL 60 -0.631 -3.691 2.156
449 HG23 VAL 60 HG23 VAL 60 -0.244 -5.042 3.220
450 H LYS 61 H LYS 61 -1.269 -4.228 6.862
451 HA LYS 61 HA LYS 61 -0.254 -6.983 7.028
452 HB2 LYS 61 HB2 LYS 61 -1.118 -7.039 9.364
453 HB3 LYS 61 HB3 LYS 61 0.231 -5.948 9.115
454 HG2 LYS 61 HG2 LYS 61 -1.386 -4.056 9.029
455 HG3 LYS 61 HG3 LYS 61 -2.669 -5.200 9.435
456 HD2 LYS 61 HD2 LYS 61 -2.149 -5.077 11.596
457 HD3 LYS 61 HD3 LYS 61 -0.484 -5.543 11.243
458 HE2 LYS 61 HE2 LYS 61 -0.450 -3.440 12.380
459 HE3 LYS 61 HE3 LYS 61 0.010 -3.176 10.699
460 HZ1 LYS 61 HZ1 LYS 61 -2.164 -2.326 10.234
461 HZ2 LYS 61 HZ2 LYS 61 -1.545 -1.493 11.574
462 HZ3 LYS 61 HZ3 LYS 61 -2.718 -2.704 11.790
463 HA PRO 62 HA PRO 62 -4.113 -8.248 5.335
464 HB2 PRO 62 HB3 PRO 62 -3.589 -10.708 6.897
465 HB3 PRO 62 HB2 PRO 62 -3.899 -10.519 5.172
466 HG2 PRO 62 HG2 PRO 62 -1.444 -11.046 6.058
467 HG3 PRO 62 HG3 PRO 62 -1.706 -9.930 4.707
468 HD2 PRO 62 HD2 PRO 62 -1.059 -9.329 7.561
469 HD3 PRO 62 HD3 PRO 62 -0.493 -8.533 6.078
470 H LEU 63 H LEU 63 -6.070 -7.754 6.013
471 HA LEU 63 HA LEU 63 -6.717 -8.004 8.858
472 HB2 LEU 63 HB2 LEU 63 -8.152 -6.573 6.615
473 HB3 LEU 63 HB3 LEU 63 -8.667 -6.584 8.290
474 HG LEU 63 HG LEU 63 -6.082 -5.404 7.278
475 HD11 LEU 63 HD11 LEU 63 -8.553 -4.013 8.291
476 HD12 LEU 63 HD12 LEU 63 -8.154 -4.228 6.588
477 HD13 LEU 63 HD13 LEU 63 -7.095 -3.268 7.625
478 HD21 LEU 63 HD21 LEU 63 -5.926 -4.453 9.544
479 HD22 LEU 63 HD22 LEU 63 -5.869 -6.215 9.556
480 HD23 LEU 63 HD23 LEU 63 -7.349 -5.377 10.016
481 H TYR 64 H TYR 64 -9.483 -8.172 8.656
482 HA TYR 64 HA TYR 64 -9.750 -10.975 8.107
483 HB2 TYR 64 HB2 TYR 64 -12.140 -10.615 8.852
484 HB3 TYR 64 HB3 TYR 64 -10.898 -10.247 10.025
485 HD1 TYR 64 HD1 TYR 64 -10.246 -7.770 10.326
486 HD2 TYR 64 HD2 TYR 64 -13.800 -9.051 8.370
487 HE1 TYR 64 HE1 TYR 64 -11.262 -5.571 10.745
488 HE2 TYR 64 HE2 TYR 64 -14.820 -6.854 8.774
489 HH TYR 64 HH TYR 64 -14.564 -4.995 10.412
490 H LEU 65 H LEU 65 -11.497 -8.144 6.937
491 HA LEU 65 HA LEU 65 -11.973 -9.568 4.415
492 HB2 LEU 65 HB2 LEU 65 -13.413 -7.373 5.815
493 HB3 LEU 65 HB3 LEU 65 -13.440 -7.386 4.064
494 HG LEU 65 HG LEU 65 -14.395 -9.672 4.121
495 HD11 LEU 65 HD11 LEU 65 -15.296 -10.542 6.211
496 HD12 LEU 65 HD12 LEU 65 -14.561 -9.203 7.089
497 HD13 LEU 65 HD13 LEU 65 -13.539 -10.392 6.282
498 HD21 LEU 65 HD21 LEU 65 -15.944 -7.604 5.668
499 HD22 LEU 65 HD22 LEU 65 -16.624 -9.001 4.832
500 HD23 LEU 65 HD23 LEU 65 -15.834 -7.719 3.911
Start of MODEL 9
1 H1 GLN 1 H1 GLN 1 -18.594 -0.828 -1.903
2 H2 GLN 1 H2 GLN 1 -19.845 0.299 -2.081
3 H3 GLN 1 H3 GLN 1 -18.670 0.139 -3.295
4 HA GLN 1 HA GLN 1 -20.641 -1.917 -2.498
5 HB2 GLN 1 HB2 GLN 1 -20.473 -0.089 -4.894
6 HB3 GLN 1 HB3 GLN 1 -21.486 -1.525 -4.854
7 HG2 GLN 1 HG2 GLN 1 -21.690 0.810 -2.970
8 HG3 GLN 1 HG3 GLN 1 -22.739 0.511 -4.353
9 HE21 GLN 1 HE22 GLN 1 -22.799 -2.379 -3.923
10 HE22 GLN 1 HE21 GLN 1 -23.815 -2.628 -2.540
11 H THR 2 H THR 2 -18.548 -1.048 -5.268
12 HA THR 2 HA THR 2 -18.361 -3.679 -6.228
13 HB THR 2 HB THR 2 -16.315 -1.516 -6.718
14 HG1 THR 2 HG1 THR 2 -19.004 -1.713 -7.466
15 HG21 THR 2 HG21 THR 2 -15.778 -3.715 -7.641
16 HG22 THR 2 HG22 THR 2 -16.163 -2.574 -8.930
17 HG23 THR 2 HG23 THR 2 -17.352 -3.776 -8.432
18 H SER 3 H SER 3 -15.846 -1.751 -4.567
19 HA SER 3 HA SER 3 -14.367 -4.182 -4.001
20 HB2 SER 3 HB2 SER 3 -12.731 -2.524 -2.964
21 HB3 SER 3 HB3 SER 3 -13.008 -2.358 -4.700
22 HG SER 3 HG SER 3 -13.304 -0.517 -2.843
23 H GLN 4 H GLN 4 -15.253 -5.347 -2.398
24 HA GLN 4 HA GLN 4 -15.697 -3.990 0.177
25 HB2 GLN 4 HB2 GLN 4 -17.574 -5.798 0.442
26 HB3 GLN 4 HB3 GLN 4 -17.910 -4.292 -0.408
27 HG2 GLN 4 HG2 GLN 4 -17.492 -5.460 -2.542
28 HG3 GLN 4 HG3 GLN 4 -17.269 -6.960 -1.644
29 HE21 GLN 4 HE22 GLN 4 -19.223 -6.290 -3.672
30 HE22 GLN 4 HE21 GLN 4 -20.783 -6.518 -2.950
31 H ASP 5 H ASP 5 -16.424 -7.344 -0.395
32 HA ASP 5 HA ASP 5 -14.380 -8.235 1.423
33 HB2 ASP 5 HB2 ASP 5 -16.168 -9.867 -0.402
34 HB3 ASP 5 HB3 ASP 5 -15.220 -10.486 0.943
35 H LEU 6 H LEU 6 -13.045 -6.890 -0.449
36 HA LEU 6 HA LEU 6 -12.188 -8.707 -2.550
37 HB2 LEU 6 HB2 LEU 6 -12.642 -6.302 -2.988
38 HB3 LEU 6 HB3 LEU 6 -11.292 -5.888 -1.957
39 HG LEU 6 HG LEU 6 -9.749 -6.979 -3.505
40 HD11 LEU 6 HD11 LEU 6 -12.211 -7.524 -5.154
41 HD12 LEU 6 HD12 LEU 6 -11.213 -8.730 -4.342
42 HD13 LEU 6 HD13 LEU 6 -10.547 -7.786 -5.674
43 HD21 LEU 6 HD21 LEU 6 -11.635 -5.060 -4.863
44 HD22 LEU 6 HD22 LEU 6 -9.979 -5.409 -5.356
45 HD23 LEU 6 HD23 LEU 6 -10.291 -4.618 -3.811
46 H PHE 7 H PHE 7 -10.224 -6.518 -0.541
47 HA PHE 7 HA PHE 7 -9.196 -8.392 1.225
48 HB2 PHE 7 HB2 PHE 7 -8.113 -8.892 -1.277
49 HB3 PHE 7 HB3 PHE 7 -6.895 -7.875 -0.520
50 HD1 PHE 7 HD2 PHE 7 -6.224 -8.570 1.922
51 HD2 PHE 7 HD1 PHE 7 -8.060 -11.160 -0.911
52 HE1 PHE 7 HE2 PHE 7 -5.382 -10.522 3.165
53 HE2 PHE 7 HE1 PHE 7 -7.224 -13.115 0.324
54 HZ PHE 7 HZ PHE 7 -5.882 -12.798 2.366
55 H SER 8 H SER 8 -8.888 -6.945 2.816
56 HA SER 8 HA SER 8 -7.692 -4.364 2.069
57 HB2 SER 8 HB2 SER 8 -9.535 -4.931 4.404
58 HB3 SER 8 HB3 SER 8 -8.965 -3.352 3.871
59 HG SER 8 HG SER 8 -10.065 -4.429 1.749
60 H TYR 9 H TYR 9 -5.886 -3.721 3.043
61 HA TYR 9 HA TYR 9 -4.961 -5.237 5.401
62 HB2 TYR 9 HB2 TYR 9 -3.288 -3.827 3.308
63 HB3 TYR 9 HB3 TYR 9 -2.660 -4.621 4.738
64 HD1 TYR 9 HD2 TYR 9 -4.091 -7.169 4.762
65 HD2 TYR 9 HD1 TYR 9 -2.487 -4.962 1.510
66 HE1 TYR 9 HE2 TYR 9 -3.830 -9.255 3.489
67 HE2 TYR 9 HE1 TYR 9 -2.234 -7.037 0.211
68 HH TYR 9 HH TYR 9 -2.043 -9.397 0.548
69 H GLN 10 H GLN 10 -3.800 -4.032 6.994
70 HA GLN 10 HA GLN 10 -4.288 -1.126 6.891
71 HB2 GLN 10 HB2 GLN 10 -5.303 -2.484 8.809
72 HB3 GLN 10 HB3 GLN 10 -3.652 -2.704 9.383
73 HG2 GLN 10 HG2 GLN 10 -3.397 -0.257 9.491
74 HG3 GLN 10 HG3 GLN 10 -5.071 -0.081 8.991
75 HE21 GLN 10 HE22 GLN 10 -6.709 -0.556 10.426
76 HE22 GLN 10 HE21 GLN 10 -6.434 -0.752 12.121
77 H ALA 11 H ALA 11 -2.565 0.235 7.150
78 HA ALA 11 HA ALA 11 -0.058 -0.814 6.323
79 HB1 ALA 11 HB1 ALA 11 0.684 1.545 6.488
80 HB2 ALA 11 HB2 ALA 11 -0.886 1.938 7.203
81 HB3 ALA 11 HB3 ALA 11 -0.794 1.330 5.548
82 H LEU 12 H LEU 12 1.605 -1.435 7.419
83 HA LEU 12 HA LEU 12 1.645 -1.490 10.289
84 HB2 LEU 12 HB2 LEU 12 3.543 -2.372 8.127
85 HB3 LEU 12 HB3 LEU 12 3.980 -2.455 9.822
86 HG LEU 12 HG LEU 12 1.424 -3.728 9.056
87 HD11 LEU 12 HD11 LEU 12 4.124 -4.804 8.280
88 HD12 LEU 12 HD12 LEU 12 2.754 -4.450 7.222
89 HD13 LEU 12 HD13 LEU 12 2.656 -5.780 8.376
90 HD21 LEU 12 HD21 LEU 12 3.730 -4.489 10.848
91 HD22 LEU 12 HD22 LEU 12 2.210 -5.373 10.705
92 HD23 LEU 12 HD23 LEU 12 2.220 -3.736 11.359
93 H TYR 13 H TYR 13 3.098 0.392 7.750
94 HA TYR 13 HA TYR 13 4.319 2.174 9.721
95 HB2 TYR 13 HB2 TYR 13 5.841 1.079 7.344
96 HB3 TYR 13 HB3 TYR 13 6.441 2.246 8.511
97 HD1 TYR 13 HD2 TYR 13 6.822 1.504 10.892
98 HD2 TYR 13 HD1 TYR 13 6.008 -1.246 7.747
99 HE1 TYR 13 HE2 TYR 13 7.721 -0.327 12.265
100 HE2 TYR 13 HE1 TYR 13 6.902 -3.083 9.118
101 HH TYR 13 HH TYR 13 8.540 -3.322 11.035
102 H SER 14 H SER 14 5.037 4.212 8.714
103 HA SER 14 HA SER 14 3.261 5.008 6.550
104 HB2 SER 14 HB2 SER 14 4.265 7.309 7.072
105 HB3 SER 14 HB3 SER 14 3.284 6.569 8.338
106 HG SER 14 HG SER 14 5.280 7.444 9.120
107 H TYR 15 H TYR 15 3.908 5.085 4.502
108 HA TYR 15 HA TYR 15 6.801 5.097 3.950
109 HB2 TYR 15 HB2 TYR 15 5.691 2.829 3.634
110 HB3 TYR 15 HB3 TYR 15 4.753 3.563 2.343
111 HD1 TYR 15 HD2 TYR 15 8.279 2.997 3.403
112 HD2 TYR 15 HD1 TYR 15 5.586 3.625 0.172
113 HE1 TYR 15 HE2 TYR 15 10.103 2.581 1.810
114 HE2 TYR 15 HE1 TYR 15 7.405 3.211 -1.431
115 HH TYR 15 HH TYR 15 10.365 1.850 -0.539
116 H ILE 16 H ILE 16 7.464 6.497 2.491
117 HA ILE 16 HA ILE 16 5.486 8.093 1.044
118 HB ILE 16 HB ILE 16 8.451 8.469 1.481
119 HG12 ILE 16 HG12 ILE 16 7.098 8.945 3.447
120 HG13 ILE 16 HG13 ILE 16 7.728 10.445 2.774
121 HG21 ILE 16 HG21 ILE 16 6.539 10.266 -0.009
122 HG22 ILE 16 HG22 ILE 16 7.819 9.295 -0.735
123 HG23 ILE 16 HG23 ILE 16 8.230 10.621 0.352
124 HD11 ILE 16 HD11 ILE 16 5.580 10.925 1.771
125 HD12 ILE 16 HD12 ILE 16 5.400 10.643 3.503
126 HD13 ILE 16 HD13 ILE 16 4.944 9.385 2.350
127 HA PRO 17 HA PRO 17 6.080 5.296 -2.371
128 HB2 PRO 17 HB3 PRO 17 4.728 7.497 -3.837
129 HB3 PRO 17 HB2 PRO 17 4.300 5.785 -3.739
130 HG2 PRO 17 HG2 PRO 17 2.892 7.615 -2.416
131 HG3 PRO 17 HG3 PRO 17 3.244 6.036 -1.688
132 HD2 PRO 17 HD2 PRO 17 4.517 8.692 -1.170
133 HD3 PRO 17 HD3 PRO 17 4.092 7.403 -0.024
134 H GLN 18 H GLN 18 7.607 5.065 -3.833
135 HA GLN 18 HA GLN 18 9.518 7.142 -4.292
136 HB2 GLN 18 HB2 GLN 18 9.244 4.422 -5.579
137 HB3 GLN 18 HB3 GLN 18 10.662 5.461 -5.666
138 HG2 GLN 18 HG2 GLN 18 11.061 5.235 -3.325
139 HG3 GLN 18 HG3 GLN 18 9.529 4.393 -3.096
140 HE21 GLN 18 HE22 GLN 18 9.824 2.781 -5.495
141 HE22 GLN 18 HE21 GLN 18 11.029 1.592 -5.133
142 H ASN 19 H ASN 19 6.611 6.294 -5.668
143 HA ASN 19 HA ASN 19 7.083 8.024 -7.982
144 HB2 ASN 19 HB2 ASN 19 5.779 5.297 -8.073
145 HB3 ASN 19 HB3 ASN 19 5.815 6.436 -9.417
146 HD21 ASN 19 HD22 ASN 19 7.550 4.132 -7.547
147 HD22 ASN 19 HD21 ASN 19 8.969 4.067 -8.545
148 H ASP 20 H ASP 20 5.299 9.226 -8.545
149 HA ASP 20 HA ASP 20 3.234 9.532 -6.606
150 HB2 ASP 20 HB2 ASP 20 4.007 11.446 -7.890
151 HB3 ASP 20 HB3 ASP 20 3.528 10.670 -9.395
152 H ASP 21 H ASP 21 3.658 7.498 -9.266
153 HA ASP 21 HA ASP 21 0.944 6.961 -9.940
154 HB2 ASP 21 HB2 ASP 21 2.769 6.432 -11.474
155 HB3 ASP 21 HB3 ASP 21 3.468 5.325 -10.302
156 H GLU 22 H GLU 22 2.860 6.233 -7.264
157 HA GLU 22 HA GLU 22 1.447 3.766 -6.623
158 HB2 GLU 22 HB2 GLU 22 3.887 5.109 -5.479
159 HB3 GLU 22 HB3 GLU 22 3.126 3.717 -4.711
160 HG2 GLU 22 HG2 GLU 22 3.525 2.356 -6.632
161 HG3 GLU 22 HG3 GLU 22 4.101 3.733 -7.557
162 H LEU 23 H LEU 23 1.018 3.513 -4.191
163 HA LEU 23 HA LEU 23 -0.828 5.676 -3.481
164 HB2 LEU 23 HB2 LEU 23 -1.396 3.120 -3.754
165 HB3 LEU 23 HB3 LEU 23 -0.739 2.996 -2.139
166 HG LEU 23 HG LEU 23 -3.253 3.204 -2.287
167 HD11 LEU 23 HD11 LEU 23 -2.193 3.625 -0.197
168 HD12 LEU 23 HD12 LEU 23 -3.412 4.869 -0.467
169 HD13 LEU 23 HD13 LEU 23 -1.709 5.242 -0.714
170 HD21 LEU 23 HD21 LEU 23 -3.410 4.797 -4.075
171 HD22 LEU 23 HD22 LEU 23 -2.531 5.996 -3.126
172 HD23 LEU 23 HD23 LEU 23 -4.136 5.473 -2.614
173 H GLU 24 H GLU 24 -0.707 6.770 -1.591
174 HA GLU 24 HA GLU 24 1.799 6.732 -0.196
175 HB2 GLU 24 HB2 GLU 24 -0.604 8.446 -0.239
176 HB3 GLU 24 HB3 GLU 24 0.288 8.413 1.277
177 HG2 GLU 24 HG2 GLU 24 2.302 9.088 0.143
178 HG3 GLU 24 HG3 GLU 24 1.470 9.047 -1.412
179 H LEU 25 H LEU 25 2.297 5.738 1.607
180 HA LEU 25 HA LEU 25 0.149 4.352 3.055
181 HB2 LEU 25 HB2 LEU 25 3.116 3.816 2.989
182 HB3 LEU 25 HB3 LEU 25 1.954 2.917 3.943
183 HG LEU 25 HG LEU 25 1.887 3.068 0.932
184 HD11 LEU 25 HD11 LEU 25 2.967 0.902 2.723
185 HD12 LEU 25 HD12 LEU 25 3.908 1.946 1.663
186 HD13 LEU 25 HD13 LEU 25 2.768 0.791 0.975
187 HD21 LEU 25 HD21 LEU 25 0.382 1.131 1.180
188 HD22 LEU 25 HD22 LEU 25 -0.269 2.593 1.925
189 HD23 LEU 25 HD23 LEU 25 0.451 1.337 2.930
190 H ARG 26 H ARG 26 -0.310 4.897 5.077
191 HA ARG 26 HA ARG 26 1.752 6.252 6.676
192 HB2 ARG 26 HB2 ARG 26 -0.108 7.538 7.792
193 HB3 ARG 26 HB3 ARG 26 0.235 8.019 6.139
194 HG2 ARG 26 HG2 ARG 26 -1.701 7.024 5.318
195 HG3 ARG 26 HG3 ARG 26 -1.897 6.019 6.753
196 HD2 ARG 26 HD2 ARG 26 -2.282 8.185 8.026
197 HD3 ARG 26 HD3 ARG 26 -2.425 8.962 6.446
198 HE ARG 26 HE ARG 26 -4.187 7.142 6.050
199 HH11 ARG 26 HH11 ARG 26 -3.645 8.794 9.085
200 HH12 ARG 26 HH12 ARG 26 -5.221 8.401 9.717
201 HH21 ARG 26 HH22 ARG 26 -6.217 6.613 6.855
202 HH22 ARG 26 HH21 ARG 26 -6.706 7.189 8.432
203 H ASP 27 H ASP 27 1.822 5.642 8.786
204 HA ASP 27 HA ASP 27 1.134 3.042 9.443
205 HB2 ASP 27 HB2 ASP 27 2.865 4.155 10.678
206 HB3 ASP 27 HB3 ASP 27 1.751 5.406 11.218
207 H GLY 28 H GLY 28 -0.832 2.204 9.578
208 HA2 GLY 28 HA2 GLY 28 -2.730 1.845 10.952
209 HA3 GLY 28 HA3 GLY 28 -2.759 3.557 11.331
210 H ASP 29 H ASP 29 -2.307 3.549 8.092
211 HA ASP 29 HA ASP 29 -5.127 4.007 7.591
212 HB2 ASP 29 HB2 ASP 29 -3.288 5.390 6.530
213 HB3 ASP 29 HB3 ASP 29 -2.910 3.983 5.539
214 H ILE 30 H ILE 30 -6.398 2.856 6.100
215 HA ILE 30 HA ILE 30 -5.506 0.091 5.718
216 HB ILE 30 HB ILE 30 -8.241 1.305 5.935
217 HG12 ILE 30 HG12 ILE 30 -8.389 -0.696 7.579
218 HG13 ILE 30 HG13 ILE 30 -6.639 -0.690 7.474
219 HG21 ILE 30 HG21 ILE 30 -7.608 -1.485 5.015
220 HG22 ILE 30 HG22 ILE 30 -8.320 -0.196 4.049
221 HG23 ILE 30 HG23 ILE 30 -9.215 -0.869 5.406
222 HD11 ILE 30 HD11 ILE 30 -7.263 0.565 9.390
223 HD12 ILE 30 HD12 ILE 30 -8.426 1.511 8.459
224 HD13 ILE 30 HD13 ILE 30 -6.702 1.700 8.162
225 H VAL 31 H VAL 31 -5.355 -0.767 3.762
226 HA VAL 31 HA VAL 31 -6.403 0.752 1.477
227 HB VAL 31 HB VAL 31 -3.670 -0.499 1.700
228 HG11 VAL 31 HG11 VAL 31 -3.385 0.094 -0.687
229 HG12 VAL 31 HG12 VAL 31 -5.101 0.493 -0.765
230 HG13 VAL 31 HG13 VAL 31 -4.596 -1.165 -0.440
231 HG21 VAL 31 HG21 VAL 31 -2.866 1.701 1.124
232 HG22 VAL 31 HG22 VAL 31 -3.955 1.828 2.509
233 HG23 VAL 31 HG23 VAL 31 -4.519 2.278 0.893
234 H ASP 32 H ASP 32 -7.634 -0.381 0.200
235 HA ASP 32 HA ASP 32 -7.866 -3.269 0.585
236 HB2 ASP 32 HB2 ASP 32 -9.872 -1.749 0.589
237 HB3 ASP 32 HB3 ASP 32 -9.528 -1.408 -1.106
238 H VAL 33 H VAL 33 -6.767 -4.568 -0.721
239 HA VAL 33 HA VAL 33 -5.584 -3.486 -3.145
240 HB VAL 33 HB VAL 33 -4.021 -4.607 -1.755
241 HG11 VAL 33 HG11 VAL 33 -5.979 -6.881 -1.695
242 HG12 VAL 33 HG12 VAL 33 -5.322 -5.958 -0.339
243 HG13 VAL 33 HG13 VAL 33 -4.285 -7.066 -1.241
244 HG21 VAL 33 HG21 VAL 33 -4.733 -6.468 -4.012
245 HG22 VAL 33 HG22 VAL 33 -3.162 -6.340 -3.220
246 HG23 VAL 33 HG23 VAL 33 -3.790 -4.986 -4.159
247 H MET 34 H MET 34 -6.160 -3.963 -5.125
248 HA MET 34 HA MET 34 -8.379 -5.833 -5.460
249 HB2 MET 34 HB2 MET 34 -8.888 -4.637 -7.542
250 HB3 MET 34 HB3 MET 34 -8.889 -3.586 -6.141
251 HG2 MET 34 HG2 MET 34 -7.913 -2.371 -7.882
252 HG3 MET 34 HG3 MET 34 -6.602 -2.831 -6.803
253 HE1 MET 34 HE1 MET 34 -8.316 -3.957 -10.377
254 HE2 MET 34 HE2 MET 34 -8.394 -5.247 -9.171
255 HE3 MET 34 HE3 MET 34 -7.307 -5.397 -10.552
256 H GLU 35 H GLU 35 -5.124 -5.140 -6.688
257 HA GLU 35 HA GLU 35 -5.206 -7.841 -7.837
258 HB2 GLU 35 HB2 GLU 35 -5.405 -6.131 -9.651
259 HB3 GLU 35 HB3 GLU 35 -3.811 -5.537 -9.187
260 HG2 GLU 35 HG2 GLU 35 -3.671 -7.053 -11.087
261 HG3 GLU 35 HG3 GLU 35 -2.835 -7.691 -9.672
262 H LYS 36 H LYS 36 -3.307 -8.987 -7.829
263 HA LYS 36 HA LYS 36 -1.380 -8.005 -5.822
264 HB2 LYS 36 HB2 LYS 36 -2.334 -10.829 -6.300
265 HB3 LYS 36 HB3 LYS 36 -1.168 -10.328 -5.082
266 HG2 LYS 36 HG2 LYS 36 -2.859 -9.042 -3.933
267 HG3 LYS 36 HG3 LYS 36 -4.034 -9.408 -5.196
268 HD2 LYS 36 HD2 LYS 36 -2.677 -11.475 -3.478
269 HD3 LYS 36 HD3 LYS 36 -4.276 -10.812 -3.148
270 HE2 LYS 36 HE2 LYS 36 -3.560 -12.165 -5.741
271 HE3 LYS 36 HE3 LYS 36 -4.213 -13.038 -4.356
272 HZ1 LYS 36 HZ1 LYS 36 -5.580 -10.759 -5.700
273 HZ2 LYS 36 HZ2 LYS 36 -6.204 -11.726 -4.462
274 HZ3 LYS 36 HZ3 LYS 36 -5.918 -12.390 -5.991
275 H CYS 37 H CYS 37 0.592 -7.696 -6.668
276 HA CYS 37 HA CYS 37 1.329 -8.962 -9.172
277 HB2 CYS 37 HB2 CYS 37 2.929 -7.078 -7.429
278 HB3 CYS 37 HB3 CYS 37 3.280 -7.520 -9.099
279 HG CYS 37 HG CYS 37 2.257 -4.852 -8.829
280 H ASP 38 H ASP 38 3.419 -10.009 -9.432
281 HA ASP 38 HA ASP 38 3.770 -12.091 -7.513
282 HB2 ASP 38 HB2 ASP 38 5.346 -11.328 -9.975
283 HB3 ASP 38 HB3 ASP 38 5.715 -12.738 -8.988
284 H ASP 39 H ASP 39 5.278 -9.028 -8.071
285 HA ASP 39 HA ASP 39 7.695 -9.660 -6.677
286 HB2 ASP 39 HB2 ASP 39 8.158 -7.216 -6.942
287 HB3 ASP 39 HB3 ASP 39 7.829 -8.076 -8.441
288 H GLY 40 H GLY 40 4.570 -8.796 -5.634
289 HA2 GLY 40 HA2 GLY 40 4.132 -9.136 -3.295
290 HA3 GLY 40 HA3 GLY 40 5.733 -8.503 -2.941
291 H TRP 41 H TRP 41 4.898 -6.422 -5.164
292 HA TRP 41 HA TRP 41 3.639 -4.582 -3.288
293 HB2 TRP 41 HB2 TRP 41 4.282 -3.949 -6.162
294 HB3 TRP 41 HB3 TRP 41 4.181 -2.851 -4.795
295 HD1 TRP 41 HD1 TRP 41 6.667 -3.509 -6.971
296 HE1 TRP 41 HE1 TRP 41 9.018 -3.785 -5.976
297 HE3 TRP 41 HE3 TRP 41 5.400 -4.475 -2.088
298 HZ2 TRP 41 HZ2 TRP 41 10.184 -4.338 -3.471
299 HZ3 TRP 41 HZ3 TRP 41 7.200 -4.861 -0.475
300 HH2 TRP 41 HH2 TRP 41 9.543 -4.797 -1.148
301 H PHE 42 H PHE 42 1.530 -3.757 -3.630
302 HA PHE 42 HA PHE 42 -0.037 -5.419 -5.476
303 HB2 PHE 42 HB2 PHE 42 -0.755 -4.600 -2.658
304 HB3 PHE 42 HB3 PHE 42 -1.779 -5.513 -3.749
305 HD1 PHE 42 HD1 PHE 42 0.301 -7.378 -4.892
306 HD2 PHE 42 HD2 PHE 42 -0.466 -6.092 -0.906
307 HE1 PHE 42 HE1 PHE 42 1.267 -9.468 -4.035
308 HE2 PHE 42 HE2 PHE 42 0.510 -8.179 -0.042
309 HZ PHE 42 HZ PHE 42 1.380 -9.869 -1.606
310 H VAL 43 H VAL 43 -2.219 -4.497 -5.929
311 HA VAL 43 HA VAL 43 -2.057 -1.560 -6.051
312 HB VAL 43 HB VAL 43 -3.150 -3.571 -7.985
313 HG11 VAL 43 HG11 VAL 43 -4.051 -0.689 -7.802
314 HG12 VAL 43 HG12 VAL 43 -5.069 -2.111 -7.537
315 HG13 VAL 43 HG13 VAL 43 -4.394 -1.790 -9.138
316 HG21 VAL 43 HG21 VAL 43 -2.016 -2.095 -9.568
317 HG22 VAL 43 HG22 VAL 43 -0.923 -2.604 -8.272
318 HG23 VAL 43 HG23 VAL 43 -1.650 -0.996 -8.236
319 H GLY 44 H GLY 44 -3.623 -0.346 -5.164
320 HA2 GLY 44 HA2 GLY 44 -6.269 -1.308 -4.714
321 HA3 GLY 44 HA3 GLY 44 -5.348 -1.373 -3.222
322 H THR 45 H THR 45 -6.823 0.137 -2.339
323 HA THR 45 HA THR 45 -6.476 2.895 -3.295
324 HB THR 45 HB THR 45 -9.066 1.569 -2.508
325 HG1 THR 45 HG1 THR 45 -7.823 2.127 -4.925
326 HG21 THR 45 HG21 THR 45 -10.090 3.730 -3.254
327 HG22 THR 45 HG22 THR 45 -8.465 4.417 -3.270
328 HG23 THR 45 HG23 THR 45 -9.160 3.831 -1.759
329 H SER 46 H SER 46 -6.366 4.430 -1.745
330 HA SER 46 HA SER 46 -5.814 3.635 0.950
331 HB2 SER 46 HB2 SER 46 -4.622 5.504 -0.136
332 HB3 SER 46 HB3 SER 46 -6.137 6.392 -0.270
333 HG SER 46 HG SER 46 -5.042 5.522 2.216
334 H ARG 47 H ARG 47 -7.165 3.664 2.680
335 HA ARG 47 HA ARG 47 -9.965 4.082 2.310
336 HB2 ARG 47 HB2 ARG 47 -8.833 2.478 3.923
337 HB3 ARG 47 HB3 ARG 47 -8.512 3.871 4.941
338 HG2 ARG 47 HG2 ARG 47 -10.917 4.297 5.102
339 HG3 ARG 47 HG3 ARG 47 -11.225 2.868 4.111
340 HD2 ARG 47 HD2 ARG 47 -10.130 1.470 5.792
341 HD3 ARG 47 HD3 ARG 47 -9.805 2.889 6.768
342 HE ARG 47 HE ARG 47 -12.581 2.140 6.118
343 HH11 ARG 47 HH11 ARG 47 -10.060 2.742 8.478
344 HH12 ARG 47 HH12 ARG 47 -11.124 2.624 9.848
345 HH21 ARG 47 HH22 ARG 47 -13.994 1.970 7.929
346 HH22 ARG 47 HH21 ARG 47 -13.357 2.201 9.532
347 H ARG 48 H ARG 48 -7.338 6.066 3.460
348 HA ARG 48 HA ARG 48 -8.980 7.995 4.796
349 HB2 ARG 48 HB2 ARG 48 -6.682 7.650 5.475
350 HB3 ARG 48 HB3 ARG 48 -6.108 8.077 3.872
351 HG2 ARG 48 HG2 ARG 48 -7.080 10.363 4.239
352 HG3 ARG 48 HG3 ARG 48 -7.350 9.885 5.919
353 HD2 ARG 48 HD2 ARG 48 -4.980 9.434 6.194
354 HD3 ARG 48 HD3 ARG 48 -4.695 9.832 4.504
355 HE ARG 48 HE ARG 48 -5.803 11.889 6.279
356 HH11 ARG 48 HH11 ARG 48 -3.139 10.656 4.363
357 HH12 ARG 48 HH12 ARG 48 -2.230 12.144 4.430
358 HH21 ARG 48 HH22 ARG 48 -4.615 13.836 6.388
359 HH22 ARG 48 HH21 ARG 48 -3.079 13.959 5.579
360 H THR 49 H THR 49 -7.268 7.939 1.684
361 HA THR 49 HA THR 49 -8.577 10.485 1.027
362 HB THR 49 HB THR 49 -6.398 11.086 0.936
363 HG1 THR 49 HG1 THR 49 -5.613 10.480 -1.383
364 HG21 THR 49 HG21 THR 49 -4.520 9.630 0.343
365 HG22 THR 49 HG22 THR 49 -5.656 8.314 0.039
366 HG23 THR 49 HG23 THR 49 -5.488 8.972 1.666
367 H LYS 50 H LYS 50 -8.540 7.236 0.271
368 HA LYS 50 HA LYS 50 -9.576 5.956 -1.263
369 HB2 LYS 50 HB2 LYS 50 -11.040 8.479 -2.044
370 HB3 LYS 50 HB3 LYS 50 -11.512 6.838 -2.450
371 HG2 LYS 50 HG2 LYS 50 -11.561 8.179 0.233
372 HG3 LYS 50 HG3 LYS 50 -12.906 7.499 -0.677
373 HD2 LYS 50 HD2 LYS 50 -10.705 6.026 0.756
374 HD3 LYS 50 HD3 LYS 50 -12.429 6.011 1.120
375 HE2 LYS 50 HE2 LYS 50 -11.099 4.861 -1.322
376 HE3 LYS 50 HE3 LYS 50 -11.754 3.949 0.030
377 HZ1 LYS 50 HZ1 LYS 50 -13.334 5.650 -1.831
378 HZ2 LYS 50 HZ2 LYS 50 -13.961 4.766 -0.526
379 HZ3 LYS 50 HZ3 LYS 50 -13.267 3.956 -1.845
380 H GLN 51 H GLN 51 -7.091 7.154 -1.977
381 HA GLN 51 HA GLN 51 -7.318 7.676 -4.824
382 HB2 GLN 51 HB2 GLN 51 -4.696 7.644 -4.533
383 HB3 GLN 51 HB3 GLN 51 -5.640 9.045 -4.045
384 HG2 GLN 51 HG2 GLN 51 -5.606 8.215 -1.730
385 HG3 GLN 51 HG3 GLN 51 -4.610 6.859 -2.253
386 HE21 GLN 51 HE22 GLN 51 -2.940 7.477 -0.874
387 HE22 GLN 51 HE21 GLN 51 -1.928 8.837 -1.210
388 H PHE 52 H PHE 52 -6.404 6.346 -6.403
389 HA PHE 52 HA PHE 52 -6.139 3.547 -5.522
390 HB2 PHE 52 HB2 PHE 52 -8.232 3.825 -6.642
391 HB3 PHE 52 HB3 PHE 52 -7.481 4.696 -7.970
392 HD1 PHE 52 HD2 PHE 52 -6.837 1.421 -6.277
393 HD2 PHE 52 HD1 PHE 52 -7.541 3.508 -9.915
394 HE1 PHE 52 HE2 PHE 52 -6.642 -0.684 -7.520
395 HE2 PHE 52 HE1 PHE 52 -7.342 1.402 -11.165
396 HZ PHE 52 HZ PHE 52 -6.894 -0.700 -9.969
397 H GLY 53 H GLY 53 -4.351 2.548 -6.026
398 HA2 GLY 53 HA2 GLY 53 -2.914 2.855 -8.429
399 HA3 GLY 53 HA3 GLY 53 -2.137 3.815 -7.175
400 H THR 54 H THR 54 -0.321 2.507 -7.307
401 HA THR 54 HA THR 54 -0.636 -0.243 -6.322
402 HB THR 54 HB THR 54 0.497 -0.270 -8.384
403 HG1 THR 54 HG1 THR 54 2.889 -0.326 -7.101
404 HG21 THR 54 HG21 THR 54 2.661 1.142 -8.605
405 HG22 THR 54 HG22 THR 54 1.940 2.122 -7.324
406 HG23 THR 54 HG23 THR 54 1.093 1.910 -8.861
407 H PHE 55 H PHE 55 0.426 -0.902 -4.498
408 HA PHE 55 HA PHE 55 2.173 0.993 -3.133
409 HB2 PHE 55 HB2 PHE 55 0.998 0.800 -1.020
410 HB3 PHE 55 HB3 PHE 55 -0.130 1.367 -2.235
411 HD1 PHE 55 HD1 PHE 55 -1.597 -0.441 -3.368
412 HD2 PHE 55 HD2 PHE 55 0.460 -1.017 0.308
413 HE1 PHE 55 HE1 PHE 55 -3.105 -2.307 -2.824
414 HE2 PHE 55 HE2 PHE 55 -1.042 -2.884 0.863
415 HZ PHE 55 HZ PHE 55 -2.827 -3.533 -0.706
416 HA PRO 56 HA PRO 56 4.418 -2.761 -2.339
417 HB2 PRO 56 HB3 PRO 56 5.467 -1.306 0.008
418 HB3 PRO 56 HB2 PRO 56 6.334 -2.028 -1.351
419 HG2 PRO 56 HG2 PRO 56 6.088 0.627 -1.113
420 HG3 PRO 56 HG3 PRO 56 6.048 -0.165 -2.697
421 HD2 PRO 56 HD2 PRO 56 3.777 0.888 -1.047
422 HD3 PRO 56 HD3 PRO 56 4.025 0.967 -2.805
423 H GLY 57 H GLY 57 3.069 -4.321 -1.564
424 HA2 GLY 57 HA2 GLY 57 1.565 -3.969 0.866
425 HA3 GLY 57 HA3 GLY 57 1.606 -5.423 -0.117
426 H ASN 58 H ASN 58 4.506 -3.937 0.958
427 HA ASN 58 HA ASN 58 5.126 -6.198 2.693
428 HB2 ASN 58 HB2 ASN 58 6.712 -5.305 0.903
429 HB3 ASN 58 HB3 ASN 58 6.898 -3.873 1.910
430 HD21 ASN 58 HD22 ASN 58 7.547 -7.262 1.606
431 HD22 ASN 58 HD21 ASN 58 8.750 -7.356 2.855
432 H TYR 59 H TYR 59 3.891 -3.092 2.788
433 HA TYR 59 HA TYR 59 4.751 -2.630 5.570
434 HB2 TYR 59 HB2 TYR 59 3.755 -0.610 3.550
435 HB3 TYR 59 HB3 TYR 59 4.363 -0.252 5.156
436 HD1 TYR 59 HD2 TYR 59 6.854 -1.036 5.598
437 HD2 TYR 59 HD1 TYR 59 5.148 -0.450 1.748
438 HE1 TYR 59 HE2 TYR 59 9.107 -0.783 4.640
439 HE2 TYR 59 HE1 TYR 59 7.384 -0.191 0.784
440 HH TYR 59 HH TYR 59 10.222 -1.020 2.440
441 H VAL 60 H VAL 60 2.447 -4.251 4.568
442 HA VAL 60 HA VAL 60 0.365 -2.885 6.080
443 HB VAL 60 HB VAL 60 -1.372 -3.519 4.378
444 HG11 VAL 60 HG11 VAL 60 0.672 -1.608 3.259
445 HG12 VAL 60 HG12 VAL 60 -0.360 -1.207 4.632
446 HG13 VAL 60 HG13 VAL 60 -1.081 -1.566 3.057
447 HG21 VAL 60 HG21 VAL 60 1.074 -4.063 2.709
448 HG22 VAL 60 HG22 VAL 60 -0.539 -3.804 2.039
449 HG23 VAL 60 HG23 VAL 60 -0.238 -5.168 3.113
450 H LYS 61 H LYS 61 -1.377 -4.334 6.724
451 HA LYS 61 HA LYS 61 -0.408 -7.096 7.030
452 HB2 LYS 61 HB2 LYS 61 -0.970 -7.005 9.379
453 HB3 LYS 61 HB3 LYS 61 0.135 -5.697 8.983
454 HG2 LYS 61 HG2 LYS 61 -2.134 -4.369 8.672
455 HG3 LYS 61 HG3 LYS 61 -2.716 -5.599 9.787
456 HD2 LYS 61 HD2 LYS 61 -0.579 -3.539 10.211
457 HD3 LYS 61 HD3 LYS 61 -2.048 -3.808 11.147
458 HE2 LYS 61 HE2 LYS 61 -1.076 -6.046 11.793
459 HE3 LYS 61 HE3 LYS 61 0.439 -5.497 11.061
460 HZ1 LYS 61 HZ1 LYS 61 -0.984 -4.308 13.378
461 HZ2 LYS 61 HZ2 LYS 61 0.314 -3.546 12.593
462 HZ3 LYS 61 HZ3 LYS 61 0.549 -5.032 13.374
463 HA PRO 62 HA PRO 62 -4.467 -8.282 5.787
464 HB2 PRO 62 HB3 PRO 62 -4.234 -10.595 7.592
465 HB3 PRO 62 HB2 PRO 62 -4.403 -10.554 5.836
466 HG2 PRO 62 HG2 PRO 62 -2.090 -11.235 7.015
467 HG3 PRO 62 HG3 PRO 62 -2.134 -10.329 5.492
468 HD2 PRO 62 HD2 PRO 62 -1.623 -9.343 8.271
469 HD3 PRO 62 HD3 PRO 62 -0.837 -8.882 6.746
470 H LEU 63 H LEU 63 -6.427 -7.707 6.430
471 HA LEU 63 HA LEU 63 -6.975 -7.527 9.318
472 HB2 LEU 63 HB2 LEU 63 -8.184 -5.983 7.021
473 HB3 LEU 63 HB3 LEU 63 -8.663 -5.829 8.698
474 HG LEU 63 HG LEU 63 -5.938 -5.144 7.607
475 HD11 LEU 63 HD11 LEU 63 -8.164 -3.344 8.537
476 HD12 LEU 63 HD12 LEU 63 -7.773 -3.680 6.851
477 HD13 LEU 63 HD13 LEU 63 -6.601 -2.853 7.880
478 HD21 LEU 63 HD21 LEU 63 -5.896 -5.893 9.944
479 HD22 LEU 63 HD22 LEU 63 -7.142 -4.710 10.343
480 HD23 LEU 63 HD23 LEU 63 -5.550 -4.169 9.808
481 H TYR 64 H TYR 64 -9.730 -7.169 9.144
482 HA TYR 64 HA TYR 64 -10.591 -9.886 8.545
483 HB2 TYR 64 HB2 TYR 64 -12.484 -7.785 9.509
484 HB3 TYR 64 HB3 TYR 64 -12.446 -9.500 9.877
485 HD1 TYR 64 HD2 TYR 64 -10.972 -10.365 11.643
486 HD2 TYR 64 HD1 TYR 64 -11.227 -6.198 10.812
487 HE1 TYR 64 HE2 TYR 64 -9.921 -9.869 13.813
488 HE2 TYR 64 HE1 TYR 64 -10.185 -5.696 12.979
489 HH TYR 64 HH TYR 64 -8.675 -8.079 14.901
490 H LEU 65 H LEU 65 -12.007 -10.405 6.938
491 HA LEU 65 HA LEU 65 -12.817 -8.222 5.146
492 HB2 LEU 65 HB2 LEU 65 -12.181 -11.108 4.564
493 HB3 LEU 65 HB3 LEU 65 -13.013 -10.073 3.424
494 HG LEU 65 HG LEU 65 -10.226 -9.640 4.493
495 HD11 LEU 65 HD11 LEU 65 -9.514 -10.120 2.216
496 HD12 LEU 65 HD12 LEU 65 -11.183 -10.431 1.746
497 HD13 LEU 65 HD13 LEU 65 -10.383 -11.491 2.904
498 HD21 LEU 65 HD21 LEU 65 -11.415 -7.535 4.078
499 HD22 LEU 65 HD22 LEU 65 -11.780 -8.071 2.437
500 HD23 LEU 65 HD23 LEU 65 -10.107 -7.788 2.922
Start of MODEL 10
1 H1 GLN 1 H1 GLN 1 -19.982 -4.062 -6.511
2 H2 GLN 1 H2 GLN 1 -19.727 -3.758 -8.157
3 H3 GLN 1 H3 GLN 1 -20.473 -2.583 -7.190
4 HA GLN 1 HA GLN 1 -18.227 -1.931 -7.578
5 HB2 GLN 1 HB2 GLN 1 -18.611 -3.053 -4.794
6 HB3 GLN 1 HB3 GLN 1 -17.375 -1.890 -5.242
7 HG2 GLN 1 HG2 GLN 1 -19.103 -0.270 -5.822
8 HG3 GLN 1 HG3 GLN 1 -20.345 -1.440 -5.378
9 HE21 GLN 1 HE22 GLN 1 -17.858 0.687 -4.214
10 HE22 GLN 1 HE21 GLN 1 -18.331 0.651 -2.546
11 H THR 2 H THR 2 -16.159 -2.472 -8.004
12 HA THR 2 HA THR 2 -15.421 -5.290 -7.781
13 HB THR 2 HB THR 2 -13.858 -3.069 -9.111
14 HG1 THR 2 HG1 THR 2 -14.916 -4.195 -11.047
15 HG21 THR 2 HG21 THR 2 -13.834 -6.073 -9.483
16 HG22 THR 2 HG22 THR 2 -12.594 -5.123 -8.661
17 HG23 THR 2 HG23 THR 2 -12.862 -4.915 -10.391
18 H SER 3 H SER 3 -14.736 -2.177 -6.435
19 HA SER 3 HA SER 3 -12.639 -3.359 -4.754
20 HB2 SER 3 HB2 SER 3 -11.810 -0.869 -4.696
21 HB3 SER 3 HB3 SER 3 -11.402 -1.899 -6.069
22 HG SER 3 HG SER 3 -12.350 -0.444 -7.237
23 H GLN 4 H GLN 4 -13.822 -3.769 -2.969
24 HA GLN 4 HA GLN 4 -14.819 -1.420 -1.542
25 HB2 GLN 4 HB2 GLN 4 -16.666 -2.783 -0.576
26 HB3 GLN 4 HB3 GLN 4 -16.843 -2.476 -2.294
27 HG2 GLN 4 HG2 GLN 4 -15.870 -5.059 -1.076
28 HG3 GLN 4 HG3 GLN 4 -17.524 -4.742 -1.582
29 HE21 GLN 4 HE22 GLN 4 -15.637 -6.780 -2.449
30 HE22 GLN 4 HE21 GLN 4 -15.486 -6.588 -4.169
31 H ASP 5 H ASP 5 -15.372 -4.394 -0.011
32 HA ASP 5 HA ASP 5 -12.850 -4.258 1.472
33 HB2 ASP 5 HB2 ASP 5 -13.963 -5.968 2.945
34 HB3 ASP 5 HB3 ASP 5 -14.762 -4.402 2.914
35 H LEU 6 H LEU 6 -12.522 -4.993 -1.092
36 HA LEU 6 HA LEU 6 -12.950 -7.682 -1.781
37 HB2 LEU 6 HB2 LEU 6 -12.491 -5.959 -3.441
38 HB3 LEU 6 HB3 LEU 6 -10.884 -5.718 -2.784
39 HG LEU 6 HG LEU 6 -10.276 -8.013 -3.473
40 HD11 LEU 6 HD11 LEU 6 -11.738 -9.257 -4.973
41 HD12 LEU 6 HD12 LEU 6 -12.989 -8.027 -4.793
42 HD13 LEU 6 HD13 LEU 6 -12.513 -9.008 -3.409
43 HD21 LEU 6 HD21 LEU 6 -9.775 -6.135 -4.931
44 HD22 LEU 6 HD22 LEU 6 -11.373 -6.261 -5.670
45 HD23 LEU 6 HD23 LEU 6 -10.198 -7.559 -5.880
46 H PHE 7 H PHE 7 -9.994 -6.046 -0.720
47 HA PHE 7 HA PHE 7 -9.305 -8.199 1.028
48 HB2 PHE 7 HB2 PHE 7 -8.489 -8.909 -1.357
49 HB3 PHE 7 HB3 PHE 7 -7.264 -7.669 -1.111
50 HD1 PHE 7 HD2 PHE 7 -7.750 -8.706 2.073
51 HD2 PHE 7 HD1 PHE 7 -6.224 -10.199 -1.606
52 HE1 PHE 7 HE2 PHE 7 -6.370 -10.319 3.311
53 HE2 PHE 7 HE1 PHE 7 -4.835 -11.814 -0.374
54 HZ PHE 7 HZ PHE 7 -4.906 -11.878 2.086
55 H SER 8 H SER 8 -8.695 -7.025 2.710
56 HA SER 8 HA SER 8 -7.614 -4.360 2.139
57 HB2 SER 8 HB2 SER 8 -9.834 -4.342 3.173
58 HB3 SER 8 HB3 SER 8 -9.243 -5.332 4.506
59 HG SER 8 HG SER 8 -9.341 -2.804 4.543
60 H TYR 9 H TYR 9 -5.796 -3.674 3.058
61 HA TYR 9 HA TYR 9 -4.618 -5.323 5.194
62 HB2 TYR 9 HB2 TYR 9 -3.115 -3.740 3.099
63 HB3 TYR 9 HB3 TYR 9 -2.389 -4.616 4.433
64 HD1 TYR 9 HD2 TYR 9 -3.984 -7.184 4.241
65 HD2 TYR 9 HD1 TYR 9 -2.164 -4.750 1.282
66 HE1 TYR 9 HE2 TYR 9 -3.725 -9.154 2.788
67 HE2 TYR 9 HE1 TYR 9 -1.893 -6.697 -0.181
68 HH TYR 9 HH TYR 9 -1.748 -9.147 0.030
69 H GLN 10 H GLN 10 -3.594 -4.180 6.860
70 HA GLN 10 HA GLN 10 -4.171 -1.293 6.883
71 HB2 GLN 10 HB2 GLN 10 -5.131 -2.796 8.717
72 HB3 GLN 10 HB3 GLN 10 -3.478 -2.957 9.298
73 HG2 GLN 10 HG2 GLN 10 -3.342 -0.520 9.538
74 HG3 GLN 10 HG3 GLN 10 -5.012 -0.386 9.005
75 HE21 GLN 10 HE22 GLN 10 -6.673 -1.084 10.363
76 HE22 GLN 10 HE21 GLN 10 -6.421 -1.342 12.057
77 H ALA 11 H ALA 11 -2.535 0.119 7.107
78 HA ALA 11 HA ALA 11 0.021 -0.795 6.283
79 HB1 ALA 11 HB1 ALA 11 0.620 1.619 6.481
80 HB2 ALA 11 HB2 ALA 11 -1.005 1.895 7.124
81 HB3 ALA 11 HB3 ALA 11 -0.795 1.286 5.479
82 H LEU 12 H LEU 12 1.758 -1.237 7.364
83 HA LEU 12 HA LEU 12 1.764 -1.293 10.244
84 HB2 LEU 12 HB2 LEU 12 3.725 -2.124 8.113
85 HB3 LEU 12 HB3 LEU 12 4.100 -2.230 9.823
86 HG LEU 12 HG LEU 12 1.589 -3.521 8.940
87 HD11 LEU 12 HD11 LEU 12 4.327 -4.513 8.196
88 HD12 LEU 12 HD12 LEU 12 2.941 -4.238 7.138
89 HD13 LEU 12 HD13 LEU 12 2.913 -5.561 8.302
90 HD21 LEU 12 HD21 LEU 12 3.837 -4.349 10.771
91 HD22 LEU 12 HD22 LEU 12 2.288 -5.174 10.584
92 HD23 LEU 12 HD23 LEU 12 2.345 -3.552 11.271
93 H TYR 13 H TYR 13 3.015 0.727 7.723
94 HA TYR 13 HA TYR 13 4.281 2.486 9.687
95 HB2 TYR 13 HB2 TYR 13 5.745 1.580 7.194
96 HB3 TYR 13 HB3 TYR 13 6.357 2.650 8.443
97 HD1 TYR 13 HD2 TYR 13 7.007 1.727 10.650
98 HD2 TYR 13 HD1 TYR 13 5.818 -0.789 7.433
99 HE1 TYR 13 HE2 TYR 13 8.002 -0.208 11.800
100 HE2 TYR 13 HE1 TYR 13 6.807 -2.724 8.571
101 HH TYR 13 HH TYR 13 8.444 -3.244 10.235
102 H SER 14 H SER 14 4.850 4.587 8.731
103 HA SER 14 HA SER 14 3.015 5.360 6.602
104 HB2 SER 14 HB2 SER 14 4.917 7.062 8.241
105 HB3 SER 14 HB3 SER 14 3.664 7.657 7.150
106 HG SER 14 HG SER 14 3.463 6.857 9.729
107 H TYR 15 H TYR 15 3.655 5.552 4.531
108 HA TYR 15 HA TYR 15 6.551 5.638 4.003
109 HB2 TYR 15 HB2 TYR 15 5.757 3.349 3.637
110 HB3 TYR 15 HB3 TYR 15 4.508 3.942 2.558
111 HD1 TYR 15 HD2 TYR 15 8.176 3.599 2.951
112 HD2 TYR 15 HD1 TYR 15 4.944 4.330 0.287
113 HE1 TYR 15 HE2 TYR 15 9.703 3.380 1.040
114 HE2 TYR 15 HE1 TYR 15 6.463 4.107 -1.627
115 HH TYR 15 HH TYR 15 8.882 4.339 -2.092
116 H ILE 16 H ILE 16 7.203 7.028 2.554
117 HA ILE 16 HA ILE 16 5.210 8.589 1.094
118 HB ILE 16 HB ILE 16 8.131 9.129 1.663
119 HG12 ILE 16 HG12 ILE 16 6.722 9.442 3.614
120 HG13 ILE 16 HG13 ILE 16 7.237 11.012 3.008
121 HG21 ILE 16 HG21 ILE 16 6.135 10.806 0.144
122 HG22 ILE 16 HG22 ILE 16 7.570 10.023 -0.515
123 HG23 ILE 16 HG23 ILE 16 7.739 11.342 0.642
124 HD11 ILE 16 HD11 ILE 16 5.060 11.314 1.944
125 HD12 ILE 16 HD12 ILE 16 4.907 11.049 3.680
126 HD13 ILE 16 HD13 ILE 16 4.547 9.741 2.553
127 HA PRO 17 HA PRO 17 6.208 5.945 -2.389
128 HB2 PRO 17 HB3 PRO 17 4.651 8.063 -3.776
129 HB3 PRO 17 HB2 PRO 17 4.428 6.310 -3.793
130 HG2 PRO 17 HG2 PRO 17 2.775 7.873 -2.418
131 HG3 PRO 17 HG3 PRO 17 3.295 6.306 -1.768
132 HD2 PRO 17 HD2 PRO 17 4.228 9.058 -1.065
133 HD3 PRO 17 HD3 PRO 17 3.931 7.665 -0.005
134 H GLN 18 H GLN 18 7.700 5.995 -3.959
135 HA GLN 18 HA GLN 18 9.308 8.398 -4.213
136 HB2 GLN 18 HB2 GLN 18 9.722 5.676 -5.461
137 HB3 GLN 18 HB3 GLN 18 10.902 6.975 -5.379
138 HG2 GLN 18 HG2 GLN 18 9.758 5.535 -2.997
139 HG3 GLN 18 HG3 GLN 18 11.310 5.171 -3.753
140 HE21 GLN 18 HE22 GLN 18 13.006 6.650 -3.555
141 HE22 GLN 18 HE21 GLN 18 13.008 7.868 -2.329
142 H ASN 19 H ASN 19 6.925 6.626 -5.816
143 HA ASN 19 HA ASN 19 7.309 8.128 -8.323
144 HB2 ASN 19 HB2 ASN 19 6.064 5.436 -7.772
145 HB3 ASN 19 HB3 ASN 19 5.995 6.240 -9.341
146 HD21 ASN 19 HD22 ASN 19 7.985 4.615 -7.012
147 HD22 ASN 19 HD21 ASN 19 9.349 4.353 -8.052
148 H ASP 20 H ASP 20 5.428 8.903 -9.367
149 HA ASP 20 HA ASP 20 3.391 9.842 -7.565
150 HB2 ASP 20 HB2 ASP 20 4.270 11.247 -9.397
151 HB3 ASP 20 HB3 ASP 20 3.627 10.111 -10.577
152 H ASP 21 H ASP 21 3.860 7.047 -9.300
153 HA ASP 21 HA ASP 21 1.108 6.464 -9.950
154 HB2 ASP 21 HB2 ASP 21 3.552 4.673 -9.977
155 HB3 ASP 21 HB3 ASP 21 1.991 4.296 -10.686
156 H GLU 22 H GLU 22 2.998 6.325 -7.175
157 HA GLU 22 HA GLU 22 1.826 3.837 -6.202
158 HB2 GLU 22 HB2 GLU 22 4.064 5.562 -5.159
159 HB3 GLU 22 HB3 GLU 22 3.458 4.146 -4.314
160 HG2 GLU 22 HG2 GLU 22 4.166 2.692 -6.017
161 HG3 GLU 22 HG3 GLU 22 4.456 4.014 -7.140
162 H LEU 23 H LEU 23 1.192 3.739 -3.914
163 HA LEU 23 HA LEU 23 -0.717 5.897 -3.371
164 HB2 LEU 23 HB2 LEU 23 -1.258 3.340 -3.626
165 HB3 LEU 23 HB3 LEU 23 -0.658 3.232 -1.989
166 HG LEU 23 HG LEU 23 -3.166 3.402 -2.224
167 HD11 LEU 23 HD11 LEU 23 -1.851 5.573 -0.618
168 HD12 LEU 23 HD12 LEU 23 -2.020 3.890 -0.122
169 HD13 LEU 23 HD13 LEU 23 -3.454 4.889 -0.352
170 HD21 LEU 23 HD21 LEU 23 -3.273 4.998 -4.017
171 HD22 LEU 23 HD22 LEU 23 -2.470 6.213 -3.021
172 HD23 LEU 23 HD23 LEU 23 -4.085 5.643 -2.587
173 H GLU 24 H GLU 24 -0.699 7.029 -1.462
174 HA GLU 24 HA GLU 24 1.738 6.955 0.059
175 HB2 GLU 24 HB2 GLU 24 -0.659 8.716 -0.010
176 HB3 GLU 24 HB3 GLU 24 0.332 8.716 1.445
177 HG2 GLU 24 HG2 GLU 24 2.296 9.224 0.108
178 HG3 GLU 24 HG3 GLU 24 1.294 9.269 -1.345
179 H LEU 25 H LEU 25 2.128 5.904 1.830
180 HA LEU 25 HA LEU 25 -0.125 4.495 3.090
181 HB2 LEU 25 HB2 LEU 25 2.824 3.889 3.234
182 HB3 LEU 25 HB3 LEU 25 1.544 2.930 3.946
183 HG LEU 25 HG LEU 25 1.836 3.405 0.983
184 HD11 LEU 25 HD11 LEU 25 2.694 1.057 2.664
185 HD12 LEU 25 HD12 LEU 25 3.740 2.151 1.753
186 HD13 LEU 25 HD13 LEU 25 2.633 1.073 0.900
187 HD21 LEU 25 HD21 LEU 25 0.249 1.552 0.800
188 HD22 LEU 25 HD22 LEU 25 -0.438 2.906 1.699
189 HD23 LEU 25 HD23 LEU 25 0.138 1.478 2.559
190 H ARG 26 H ARG 26 -0.512 4.673 5.232
191 HA ARG 26 HA ARG 26 1.263 6.387 6.827
192 HB2 ARG 26 HB2 ARG 26 -0.539 7.830 6.369
193 HB3 ARG 26 HB3 ARG 26 -1.724 6.539 6.515
194 HG2 ARG 26 HG2 ARG 26 -0.907 6.447 8.981
195 HG3 ARG 26 HG3 ARG 26 -0.315 8.075 8.644
196 HD2 ARG 26 HD2 ARG 26 -2.460 8.897 8.243
197 HD3 ARG 26 HD3 ARG 26 -3.137 7.282 8.018
198 HE ARG 26 HE ARG 26 -2.237 8.353 10.624
199 HH11 ARG 26 HH11 ARG 26 -4.455 6.461 8.668
200 HH12 ARG 26 HH12 ARG 26 -5.333 5.847 10.037
201 HH21 ARG 26 HH22 ARG 26 -3.389 7.527 12.421
202 HH22 ARG 26 HH21 ARG 26 -4.708 6.423 12.174
203 H ASP 27 H ASP 27 1.546 5.762 8.896
204 HA ASP 27 HA ASP 27 1.244 3.112 9.658
205 HB2 ASP 27 HB2 ASP 27 2.836 4.471 10.808
206 HB3 ASP 27 HB3 ASP 27 1.595 5.602 11.328
207 H GLY 28 H GLY 28 -0.606 2.058 9.755
208 HA2 GLY 28 HA2 GLY 28 -2.451 1.372 11.029
209 HA3 GLY 28 HA3 GLY 28 -2.627 3.009 11.643
210 H ASP 29 H ASP 29 -2.208 3.456 8.447
211 HA ASP 29 HA ASP 29 -5.055 3.831 8.040
212 HB2 ASP 29 HB2 ASP 29 -2.990 5.323 7.234
213 HB3 ASP 29 HB3 ASP 29 -3.118 4.280 5.820
214 H ILE 30 H ILE 30 -6.218 2.929 6.237
215 HA ILE 30 HA ILE 30 -5.294 0.194 5.736
216 HB ILE 30 HB ILE 30 -8.021 1.406 5.945
217 HG12 ILE 30 HG12 ILE 30 -8.257 -0.725 7.401
218 HG13 ILE 30 HG13 ILE 30 -6.502 -0.759 7.349
219 HG21 ILE 30 HG21 ILE 30 -8.914 -0.866 5.295
220 HG22 ILE 30 HG22 ILE 30 -7.327 -1.166 4.596
221 HG23 ILE 30 HG23 ILE 30 -8.311 0.158 3.994
222 HD11 ILE 30 HD11 ILE 30 -7.138 0.345 9.344
223 HD12 ILE 30 HD12 ILE 30 -8.267 1.392 8.479
224 HD13 ILE 30 HD13 ILE 30 -6.534 1.574 8.233
225 H VAL 31 H VAL 31 -5.096 -0.621 3.747
226 HA VAL 31 HA VAL 31 -6.207 0.893 1.487
227 HB VAL 31 HB VAL 31 -3.448 -0.320 1.651
228 HG11 VAL 31 HG11 VAL 31 -3.264 0.114 -0.786
229 HG12 VAL 31 HG12 VAL 31 -5.000 0.439 -0.831
230 HG13 VAL 31 HG13 VAL 31 -4.412 -1.166 -0.397
231 HG21 VAL 31 HG21 VAL 31 -2.745 1.858 0.859
232 HG22 VAL 31 HG22 VAL 31 -3.744 2.042 2.304
233 HG23 VAL 31 HG23 VAL 31 -4.429 2.364 0.706
234 H ASP 32 H ASP 32 -7.533 -0.250 0.301
235 HA ASP 32 HA ASP 32 -7.715 -3.136 0.594
236 HB2 ASP 32 HB2 ASP 32 -9.776 -1.756 0.459
237 HB3 ASP 32 HB3 ASP 32 -9.276 -1.211 -1.140
238 H VAL 33 H VAL 33 -6.603 -4.458 -0.681
239 HA VAL 33 HA VAL 33 -5.318 -3.368 -3.046
240 HB VAL 33 HB VAL 33 -3.864 -4.647 -1.663
241 HG11 VAL 33 HG11 VAL 33 -6.037 -6.676 -1.671
242 HG12 VAL 33 HG12 VAL 33 -5.090 -6.030 -0.322
243 HG13 VAL 33 HG13 VAL 33 -4.363 -7.181 -1.444
244 HG21 VAL 33 HG21 VAL 33 -4.612 -6.323 -4.050
245 HG22 VAL 33 HG22 VAL 33 -3.061 -6.336 -3.208
246 HG23 VAL 33 HG23 VAL 33 -3.580 -4.892 -4.081
247 H MET 34 H MET 34 -6.087 -3.588 -4.991
248 HA MET 34 HA MET 34 -8.347 -5.386 -5.399
249 HB2 MET 34 HB2 MET 34 -9.091 -3.991 -7.109
250 HB3 MET 34 HB3 MET 34 -8.446 -2.883 -5.920
251 HG2 MET 34 HG2 MET 34 -7.654 -1.998 -7.876
252 HG3 MET 34 HG3 MET 34 -6.285 -2.988 -7.356
253 HE1 MET 34 HE1 MET 34 -6.686 -1.898 -10.339
254 HE2 MET 34 HE2 MET 34 -6.318 -3.316 -11.319
255 HE3 MET 34 HE3 MET 34 -5.317 -2.931 -9.917
256 H GLU 35 H GLU 35 -5.114 -4.623 -6.605
257 HA GLU 35 HA GLU 35 -5.254 -7.131 -8.149
258 HB2 GLU 35 HB2 GLU 35 -5.129 -5.044 -9.527
259 HB3 GLU 35 HB3 GLU 35 -3.527 -4.775 -8.860
260 HG2 GLU 35 HG2 GLU 35 -2.781 -6.880 -9.785
261 HG3 GLU 35 HG3 GLU 35 -4.395 -7.196 -10.415
262 H LYS 36 H LYS 36 -3.807 -8.576 -7.770
263 HA LYS 36 HA LYS 36 -1.735 -7.953 -5.771
264 HB2 LYS 36 HB2 LYS 36 -3.214 -10.526 -6.303
265 HB3 LYS 36 HB3 LYS 36 -1.894 -10.355 -5.153
266 HG2 LYS 36 HG2 LYS 36 -3.174 -8.840 -3.811
267 HG3 LYS 36 HG3 LYS 36 -4.459 -8.785 -5.021
268 HD2 LYS 36 HD2 LYS 36 -3.598 -11.216 -3.470
269 HD3 LYS 36 HD3 LYS 36 -5.039 -10.249 -3.142
270 HE2 LYS 36 HE2 LYS 36 -5.761 -10.753 -5.509
271 HE3 LYS 36 HE3 LYS 36 -4.444 -11.924 -5.573
272 HZ1 LYS 36 HZ1 LYS 36 -5.460 -13.021 -3.613
273 HZ2 LYS 36 HZ2 LYS 36 -6.445 -13.048 -4.997
274 HZ3 LYS 36 HZ3 LYS 36 -6.779 -11.958 -3.744
275 H CYS 37 H CYS 37 0.185 -7.790 -6.666
276 HA CYS 37 HA CYS 37 0.862 -9.236 -9.079
277 HB2 CYS 37 HB2 CYS 37 2.639 -7.438 -7.430
278 HB3 CYS 37 HB3 CYS 37 2.815 -7.861 -9.131
279 HG CYS 37 HG CYS 37 1.575 -5.188 -8.012
280 H ASP 38 H ASP 38 2.728 -10.573 -9.246
281 HA ASP 38 HA ASP 38 2.969 -12.459 -7.121
282 HB2 ASP 38 HB2 ASP 38 4.511 -12.141 -9.702
283 HB3 ASP 38 HB3 ASP 38 4.737 -13.485 -8.588
284 H ASP 39 H ASP 39 4.636 -9.600 -7.973
285 HA ASP 39 HA ASP 39 7.109 -10.258 -6.681
286 HB2 ASP 39 HB2 ASP 39 7.610 -7.828 -7.123
287 HB3 ASP 39 HB3 ASP 39 7.184 -8.779 -8.545
288 H GLY 40 H GLY 40 4.073 -9.175 -5.547
289 HA2 GLY 40 HA2 GLY 40 3.665 -9.244 -3.197
290 HA3 GLY 40 HA3 GLY 40 5.341 -8.804 -2.925
291 H TRP 41 H TRP 41 4.778 -6.699 -5.193
292 HA TRP 41 HA TRP 41 3.757 -4.684 -3.331
293 HB2 TRP 41 HB2 TRP 41 4.714 -4.017 -6.083
294 HB3 TRP 41 HB3 TRP 41 4.829 -3.073 -4.605
295 HD1 TRP 41 HD1 TRP 41 7.000 -4.768 -6.881
296 HE1 TRP 41 HE1 TRP 41 9.210 -5.513 -5.800
297 HE3 TRP 41 HE3 TRP 41 5.711 -4.299 -1.922
298 HZ2 TRP 41 HZ2 TRP 41 10.270 -5.835 -3.220
299 HZ3 TRP 41 HZ3 TRP 41 7.397 -4.846 -0.231
300 HH2 TRP 41 HH2 TRP 41 9.627 -5.600 -0.862
301 H PHE 42 H PHE 42 1.703 -4.093 -3.444
302 HA PHE 42 HA PHE 42 0.136 -5.409 -5.533
303 HB2 PHE 42 HB2 PHE 42 -0.680 -4.535 -2.761
304 HB3 PHE 42 HB3 PHE 42 -1.679 -5.428 -3.895
305 HD1 PHE 42 HD1 PHE 42 -0.113 -7.561 -4.886
306 HD2 PHE 42 HD2 PHE 42 -0.051 -5.831 -1.002
307 HE1 PHE 42 HE1 PHE 42 0.702 -9.683 -3.958
308 HE2 PHE 42 HE2 PHE 42 0.780 -7.947 -0.068
309 HZ PHE 42 HZ PHE 42 1.158 -9.877 -1.546
310 H VAL 43 H VAL 43 -1.979 -4.408 -6.042
311 HA VAL 43 HA VAL 43 -1.770 -1.471 -6.157
312 HB VAL 43 HB VAL 43 -2.702 -3.482 -8.166
313 HG11 VAL 43 HG11 VAL 43 -3.671 -0.622 -8.161
314 HG12 VAL 43 HG12 VAL 43 -4.679 -1.996 -7.707
315 HG13 VAL 43 HG13 VAL 43 -4.041 -1.873 -9.349
316 HG21 VAL 43 HG21 VAL 43 -1.549 -1.942 -9.665
317 HG22 VAL 43 HG22 VAL 43 -0.511 -2.413 -8.312
318 HG23 VAL 43 HG23 VAL 43 -1.313 -0.843 -8.305
319 H GLY 44 H GLY 44 -3.428 -0.274 -5.374
320 HA2 GLY 44 HA2 GLY 44 -6.093 -1.185 -5.189
321 HA3 GLY 44 HA3 GLY 44 -5.326 -1.405 -3.629
322 H THR 45 H THR 45 -6.622 0.113 -2.594
323 HA THR 45 HA THR 45 -6.337 2.894 -3.487
324 HB THR 45 HB THR 45 -8.912 1.498 -2.787
325 HG1 THR 45 HG1 THR 45 -7.621 2.131 -5.148
326 HG21 THR 45 HG21 THR 45 -10.001 3.629 -3.401
327 HG22 THR 45 HG22 THR 45 -8.409 4.373 -3.526
328 HG23 THR 45 HG23 THR 45 -8.980 3.776 -1.969
329 H SER 46 H SER 46 -6.326 4.414 -1.883
330 HA SER 46 HA SER 46 -5.801 3.576 0.796
331 HB2 SER 46 HB2 SER 46 -4.732 5.582 -0.124
332 HB3 SER 46 HB3 SER 46 -6.311 6.337 -0.354
333 HG SER 46 HG SER 46 -4.922 5.804 2.042
334 H ARG 47 H ARG 47 -7.190 3.422 2.491
335 HA ARG 47 HA ARG 47 -10.004 3.500 2.028
336 HB2 ARG 47 HB2 ARG 47 -8.721 2.059 3.726
337 HB3 ARG 47 HB3 ARG 47 -8.672 3.493 4.731
338 HG2 ARG 47 HG2 ARG 47 -11.116 3.550 4.759
339 HG3 ARG 47 HG3 ARG 47 -11.148 2.085 3.768
340 HD2 ARG 47 HD2 ARG 47 -9.852 0.921 5.518
341 HD3 ARG 47 HD3 ARG 47 -9.934 2.368 6.500
342 HE ARG 47 HE ARG 47 -12.488 1.252 5.657
343 HH11 ARG 47 HH11 ARG 47 -10.075 1.548 8.183
344 HH12 ARG 47 HH12 ARG 47 -11.107 0.910 9.427
345 HH21 ARG 47 HH22 ARG 47 -13.848 0.431 7.280
346 HH22 ARG 47 HH21 ARG 47 -13.262 0.280 8.906
347 H ARG 48 H ARG 48 -7.668 5.714 3.380
348 HA ARG 48 HA ARG 48 -9.564 7.401 4.697
349 HB2 ARG 48 HB2 ARG 48 -7.355 7.298 5.577
350 HB3 ARG 48 HB3 ARG 48 -6.641 7.689 4.022
351 HG2 ARG 48 HG2 ARG 48 -7.599 9.934 4.151
352 HG3 ARG 48 HG3 ARG 48 -8.275 9.535 5.733
353 HD2 ARG 48 HD2 ARG 48 -5.352 9.394 5.062
354 HD3 ARG 48 HD3 ARG 48 -6.121 10.793 5.816
355 HE ARG 48 HE ARG 48 -6.037 8.099 7.031
356 HH11 ARG 48 HH11 ARG 48 -5.770 11.591 7.253
357 HH12 ARG 48 HH12 ARG 48 -5.666 11.597 8.989
358 HH21 ARG 48 HH22 ARG 48 -5.972 8.112 9.307
359 HH22 ARG 48 HH21 ARG 48 -5.791 9.617 10.165
360 H THR 49 H THR 49 -7.648 7.708 1.721
361 HA THR 49 HA THR 49 -9.162 10.156 1.130
362 HB THR 49 HB THR 49 -7.022 10.915 1.166
363 HG1 THR 49 HG1 THR 49 -6.157 10.543 -1.176
364 HG21 THR 49 HG21 THR 49 -5.033 9.642 0.528
365 HG22 THR 49 HG22 THR 49 -6.061 8.279 0.083
366 HG23 THR 49 HG23 THR 49 -5.983 8.812 1.762
367 H LYS 50 H LYS 50 -8.797 6.970 0.184
368 HA LYS 50 HA LYS 50 -9.653 5.704 -1.471
369 HB2 LYS 50 HB2 LYS 50 -11.288 8.134 -2.209
370 HB3 LYS 50 HB3 LYS 50 -11.609 6.474 -2.681
371 HG2 LYS 50 HG2 LYS 50 -11.892 7.735 0.025
372 HG3 LYS 50 HG3 LYS 50 -13.126 6.955 -0.957
373 HD2 LYS 50 HD2 LYS 50 -10.850 5.647 0.524
374 HD3 LYS 50 HD3 LYS 50 -12.574 5.494 0.857
375 HE2 LYS 50 HE2 LYS 50 -11.118 4.488 -1.580
376 HE3 LYS 50 HE3 LYS 50 -11.722 3.505 -0.253
377 HZ1 LYS 50 HZ1 LYS 50 -13.209 3.406 -2.138
378 HZ2 LYS 50 HZ2 LYS 50 -13.386 5.093 -2.137
379 HZ3 LYS 50 HZ3 LYS 50 -13.978 4.175 -0.837
380 H GLN 51 H GLN 51 -7.228 7.067 -1.978
381 HA GLN 51 HA GLN 51 -7.361 7.699 -4.816
382 HB2 GLN 51 HB2 GLN 51 -4.767 7.844 -4.433
383 HB3 GLN 51 HB3 GLN 51 -5.820 9.157 -3.922
384 HG2 GLN 51 HG2 GLN 51 -5.725 8.401 -1.648
385 HG3 GLN 51 HG3 GLN 51 -4.822 6.965 -2.123
386 HE21 GLN 51 HE22 GLN 51 -3.184 8.436 -4.058
387 HE22 GLN 51 HE21 GLN 51 -2.058 9.367 -3.118
388 H PHE 52 H PHE 52 -6.150 6.535 -6.361
389 HA PHE 52 HA PHE 52 -5.894 3.697 -5.625
390 HB2 PHE 52 HB2 PHE 52 -7.842 4.011 -6.980
391 HB3 PHE 52 HB3 PHE 52 -6.961 5.011 -8.123
392 HD1 PHE 52 HD2 PHE 52 -6.594 1.576 -6.678
393 HD2 PHE 52 HD1 PHE 52 -6.594 4.048 -10.141
394 HE1 PHE 52 HE2 PHE 52 -6.193 -0.399 -8.082
395 HE2 PHE 52 HE1 PHE 52 -6.188 2.075 -11.551
396 HZ PHE 52 HZ PHE 52 -5.986 -0.151 -10.523
397 H GLY 53 H GLY 53 -4.102 2.612 -6.230
398 HA2 GLY 53 HA2 GLY 53 -2.472 3.126 -8.424
399 HA3 GLY 53 HA3 GLY 53 -1.777 4.009 -7.071
400 H THR 54 H THR 54 0.063 2.708 -7.183
401 HA THR 54 HA THR 54 -0.309 -0.079 -6.336
402 HB THR 54 HB THR 54 0.966 -0.072 -8.309
403 HG1 THR 54 HG1 THR 54 3.183 -0.043 -6.622
404 HG21 THR 54 HG21 THR 54 3.131 1.370 -8.365
405 HG22 THR 54 HG22 THR 54 2.310 2.327 -7.130
406 HG23 THR 54 HG23 THR 54 1.575 2.123 -8.725
407 H PHE 55 H PHE 55 0.679 -0.827 -4.515
408 HA PHE 55 HA PHE 55 2.279 1.029 -2.940
409 HB2 PHE 55 HB2 PHE 55 0.961 0.761 -0.939
410 HB3 PHE 55 HB3 PHE 55 -0.094 1.330 -2.218
411 HD1 PHE 55 HD1 PHE 55 -1.482 -0.449 -3.460
412 HD2 PHE 55 HD2 PHE 55 0.401 -1.127 0.292
413 HE1 PHE 55 HE1 PHE 55 -2.999 -2.344 -3.045
414 HE2 PHE 55 HE2 PHE 55 -1.108 -3.022 0.713
415 HZ PHE 55 HZ PHE 55 -2.807 -3.635 -0.955
416 HA PRO 56 HA PRO 56 4.654 -2.644 -2.322
417 HB2 PRO 56 HB3 PRO 56 5.535 -1.248 0.139
418 HB3 PRO 56 HB2 PRO 56 6.498 -1.875 -1.203
419 HG2 PRO 56 HG2 PRO 56 6.107 0.751 -0.885
420 HG3 PRO 56 HG3 PRO 56 6.168 0.015 -2.496
421 HD2 PRO 56 HD2 PRO 56 3.795 0.926 -0.918
422 HD3 PRO 56 HD3 PRO 56 4.099 1.034 -2.664
423 H GLY 57 H GLY 57 3.557 -4.390 -1.637
424 HA2 GLY 57 HA2 GLY 57 1.760 -4.371 0.586
425 HA3 GLY 57 HA3 GLY 57 2.253 -5.775 -0.346
426 H ASN 58 H ASN 58 4.668 -3.791 1.044
427 HA ASN 58 HA ASN 58 5.398 -5.942 2.892
428 HB2 ASN 58 HB2 ASN 58 7.019 -5.150 1.118
429 HB3 ASN 58 HB3 ASN 58 7.061 -3.596 1.946
430 HD21 ASN 58 HD22 ASN 58 7.949 -6.949 2.126
431 HD22 ASN 58 HD21 ASN 58 9.064 -6.793 3.440
432 H TYR 59 H TYR 59 4.125 -2.780 2.743
433 HA TYR 59 HA TYR 59 4.825 -2.243 5.555
434 HB2 TYR 59 HB2 TYR 59 3.733 -0.345 3.465
435 HB3 TYR 59 HB3 TYR 59 4.172 0.086 5.111
436 HD1 TYR 59 HD2 TYR 59 6.657 -0.303 5.770
437 HD2 TYR 59 HD1 TYR 59 5.259 -0.125 1.762
438 HE1 TYR 59 HE2 TYR 59 8.933 0.228 5.008
439 HE2 TYR 59 HE1 TYR 59 7.519 0.414 0.986
440 HH TYR 59 HH TYR 59 10.273 0.077 2.989
441 H VAL 60 H VAL 60 2.653 -4.027 4.484
442 HA VAL 60 HA VAL 60 0.466 -2.824 5.990
443 HB VAL 60 HB VAL 60 -1.200 -3.515 4.252
444 HG11 VAL 60 HG11 VAL 60 0.787 -1.463 3.284
445 HG12 VAL 60 HG12 VAL 60 -0.434 -1.167 4.522
446 HG13 VAL 60 HG13 VAL 60 -0.926 -1.558 2.871
447 HG21 VAL 60 HG21 VAL 60 1.296 -3.941 2.628
448 HG22 VAL 60 HG22 VAL 60 -0.306 -3.731 1.916
449 HG23 VAL 60 HG23 VAL 60 0.010 -5.094 2.985
450 H LYS 61 H LYS 61 -1.171 -4.382 6.591
451 HA LYS 61 HA LYS 61 -0.111 -7.119 6.689
452 HB2 LYS 61 HB2 LYS 61 -0.681 -7.264 9.039
453 HB3 LYS 61 HB3 LYS 61 0.431 -5.937 8.755
454 HG2 LYS 61 HG2 LYS 61 -1.719 -4.489 8.676
455 HG3 LYS 61 HG3 LYS 61 -2.457 -5.858 9.509
456 HD2 LYS 61 HD2 LYS 61 -0.305 -4.002 10.438
457 HD3 LYS 61 HD3 LYS 61 -1.761 -4.538 11.277
458 HE2 LYS 61 HE2 LYS 61 -0.743 -6.822 11.405
459 HE3 LYS 61 HE3 LYS 61 0.741 -6.130 10.739
460 HZ1 LYS 61 HZ1 LYS 61 0.915 -4.694 12.659
461 HZ2 LYS 61 HZ2 LYS 61 0.790 -6.308 13.166
462 HZ3 LYS 61 HZ3 LYS 61 -0.551 -5.272 13.282
463 HA PRO 62 HA PRO 62 -3.975 -8.340 5.114
464 HB2 PRO 62 HB3 PRO 62 -3.710 -10.784 6.746
465 HB3 PRO 62 HB2 PRO 62 -3.845 -10.605 4.997
466 HG2 PRO 62 HG2 PRO 62 -1.523 -11.263 6.132
467 HG3 PRO 62 HG3 PRO 62 -1.588 -10.176 4.732
468 HD2 PRO 62 HD2 PRO 62 -1.205 -9.517 7.624
469 HD3 PRO 62 HD3 PRO 62 -0.411 -8.829 6.193
470 H LEU 63 H LEU 63 -5.840 -7.531 5.707
471 HA LEU 63 HA LEU 63 -6.825 -7.946 8.444
472 HB2 LEU 63 HB2 LEU 63 -7.816 -6.106 6.266
473 HB3 LEU 63 HB3 LEU 63 -8.475 -6.205 7.884
474 HG LEU 63 HG LEU 63 -5.694 -5.270 7.188
475 HD11 LEU 63 HD11 LEU 63 -8.099 -3.736 8.156
476 HD12 LEU 63 HD12 LEU 63 -7.501 -3.755 6.497
477 HD13 LEU 63 HD13 LEU 63 -6.503 -3.077 7.784
478 HD21 LEU 63 HD21 LEU 63 -5.806 -6.368 9.373
479 HD22 LEU 63 HD22 LEU 63 -7.154 -5.327 9.828
480 HD23 LEU 63 HD23 LEU 63 -5.561 -4.629 9.537
481 H TYR 64 H TYR 64 -9.546 -7.611 7.887
482 HA TYR 64 HA TYR 64 -10.155 -9.981 6.243
483 HB2 TYR 64 HB2 TYR 64 -11.591 -9.189 8.786
484 HB3 TYR 64 HB3 TYR 64 -11.847 -10.652 7.837
485 HD1 TYR 64 HD2 TYR 64 -10.099 -12.418 7.799
486 HD2 TYR 64 HD1 TYR 64 -9.805 -9.036 10.362
487 HE1 TYR 64 HE2 TYR 64 -8.378 -13.573 9.119
488 HE2 TYR 64 HE1 TYR 64 -8.081 -10.181 11.687
489 HH TYR 64 HH TYR 64 -6.610 -13.130 10.633
490 H LEU 65 H LEU 65 -11.139 -6.857 7.427
491 HA LEU 65 HA LEU 65 -12.370 -6.177 4.965
492 HB2 LEU 65 HB2 LEU 65 -14.633 -5.848 5.631
493 HB3 LEU 65 HB3 LEU 65 -14.218 -7.503 6.020
494 HG LEU 65 HG LEU 65 -14.190 -5.307 8.086
495 HD11 LEU 65 HD11 LEU 65 -16.408 -6.087 8.757
496 HD12 LEU 65 HD12 LEU 65 -16.449 -7.171 7.367
497 HD13 LEU 65 HD13 LEU 65 -16.422 -5.424 7.124
498 HD21 LEU 65 HD21 LEU 65 -14.423 -7.184 9.646
499 HD22 LEU 65 HD22 LEU 65 -12.955 -7.318 8.678
500 HD23 LEU 65 HD23 LEU 65 -14.359 -8.312 8.291
Start of MODEL 11
1 H1 GLN 1 H1 GLN 1 -16.312 0.498 -3.435
2 H2 GLN 1 H2 GLN 1 -17.800 1.066 -4.024
3 H3 GLN 1 H3 GLN 1 -17.170 -0.400 -4.592
4 HA GLN 1 HA GLN 1 -18.029 0.152 -1.814
5 HB2 GLN 1 HB2 GLN 1 -19.918 -1.302 -2.273
6 HB3 GLN 1 HB3 GLN 1 -19.905 0.034 -3.416
7 HG2 GLN 1 HG2 GLN 1 -18.875 -1.455 -5.090
8 HG3 GLN 1 HG3 GLN 1 -19.003 -2.789 -3.945
9 HE21 GLN 1 HE22 GLN 1 -20.363 -3.988 -5.229
10 HE22 GLN 1 HE21 GLN 1 -22.006 -3.531 -5.543
11 H THR 2 H THR 2 -15.932 -1.561 -3.796
12 HA THR 2 HA THR 2 -16.079 -4.032 -2.326
13 HB THR 2 HB THR 2 -15.529 -4.175 -4.671
14 HG1 THR 2 HG1 THR 2 -14.065 -5.711 -4.375
15 HG21 THR 2 HG21 THR 2 -14.421 -2.016 -4.984
16 HG22 THR 2 HG22 THR 2 -13.419 -3.336 -5.587
17 HG23 THR 2 HG23 THR 2 -13.042 -2.579 -4.040
18 H SER 3 H SER 3 -15.681 -3.511 -0.242
19 HA SER 3 HA SER 3 -12.850 -3.164 0.406
20 HB2 SER 3 HB2 SER 3 -14.146 -0.944 0.583
21 HB3 SER 3 HB3 SER 3 -15.014 -1.682 1.925
22 HG SER 3 HG SER 3 -12.174 -1.481 1.806
23 H GLN 4 H GLN 4 -13.807 -5.545 0.326
24 HA GLN 4 HA GLN 4 -14.674 -6.272 3.024
25 HB2 GLN 4 HB2 GLN 4 -16.721 -6.113 1.823
26 HB3 GLN 4 HB3 GLN 4 -16.056 -6.954 0.433
27 HG2 GLN 4 HG2 GLN 4 -15.951 -9.013 1.729
28 HG3 GLN 4 HG3 GLN 4 -16.642 -8.173 3.124
29 HE21 GLN 4 HE22 GLN 4 -18.443 -9.551 3.143
30 HE22 GLN 4 HE21 GLN 4 -19.703 -9.425 1.961
31 H ASP 5 H ASP 5 -14.737 -8.435 0.282
32 HA ASP 5 HA ASP 5 -12.696 -10.060 1.603
33 HB2 ASP 5 HB2 ASP 5 -14.930 -11.034 1.141
34 HB3 ASP 5 HB3 ASP 5 -14.664 -10.786 -0.581
35 H LEU 6 H LEU 6 -12.580 -7.729 -0.547
36 HA LEU 6 HA LEU 6 -11.102 -8.898 -2.699
37 HB2 LEU 6 HB2 LEU 6 -12.359 -6.784 -2.902
38 HB3 LEU 6 HB3 LEU 6 -11.248 -6.026 -1.781
39 HG LEU 6 HG LEU 6 -9.403 -6.453 -3.416
40 HD11 LEU 6 HD11 LEU 6 -10.014 -6.965 -5.733
41 HD12 LEU 6 HD12 LEU 6 -11.683 -7.235 -5.229
42 HD13 LEU 6 HD13 LEU 6 -10.403 -8.296 -4.640
43 HD21 LEU 6 HD21 LEU 6 -11.734 -4.783 -4.353
44 HD22 LEU 6 HD22 LEU 6 -10.078 -4.648 -4.947
45 HD23 LEU 6 HD23 LEU 6 -10.444 -4.275 -3.263
46 H PHE 7 H PHE 7 -10.425 -8.384 0.457
47 HA PHE 7 HA PHE 7 -8.583 -8.614 1.735
48 HB2 PHE 7 HB2 PHE 7 -7.327 -8.898 -0.913
49 HB3 PHE 7 HB3 PHE 7 -6.272 -8.278 0.359
50 HD1 PHE 7 HD2 PHE 7 -5.934 -9.635 2.421
51 HD2 PHE 7 HD1 PHE 7 -8.002 -11.160 -0.971
52 HE1 PHE 7 HE2 PHE 7 -5.647 -11.922 3.278
53 HE2 PHE 7 HE1 PHE 7 -7.720 -13.449 -0.116
54 HZ PHE 7 HZ PHE 7 -6.540 -13.830 2.010
55 H SER 8 H SER 8 -8.515 -6.977 2.989
56 HA SER 8 HA SER 8 -7.434 -4.441 1.971
57 HB2 SER 8 HB2 SER 8 -9.302 -4.746 4.328
58 HB3 SER 8 HB3 SER 8 -8.850 -3.260 3.491
59 HG SER 8 HG SER 8 -10.319 -3.629 2.025
60 H TYR 9 H TYR 9 -5.696 -3.645 3.059
61 HA TYR 9 HA TYR 9 -4.866 -5.135 5.463
62 HB2 TYR 9 HB2 TYR 9 -3.040 -3.839 3.429
63 HB3 TYR 9 HB3 TYR 9 -2.550 -4.784 4.828
64 HD1 TYR 9 HD2 TYR 9 -4.434 -7.092 4.589
65 HD2 TYR 9 HD1 TYR 9 -2.171 -5.017 1.658
66 HE1 TYR 9 HE2 TYR 9 -4.405 -9.115 3.195
67 HE2 TYR 9 HE1 TYR 9 -2.133 -7.028 0.244
68 HH TYR 9 HH TYR 9 -2.327 -9.584 0.680
69 H GLN 10 H GLN 10 -3.698 -3.935 7.052
70 HA GLN 10 HA GLN 10 -4.198 -1.037 6.896
71 HB2 GLN 10 HB2 GLN 10 -5.211 -2.380 8.814
72 HB3 GLN 10 HB3 GLN 10 -3.566 -2.593 9.403
73 HG2 GLN 10 HG2 GLN 10 -3.317 -0.146 9.483
74 HG3 GLN 10 HG3 GLN 10 -4.994 0.019 8.987
75 HE21 GLN 10 HE22 GLN 10 -5.839 -2.285 10.570
76 HE22 GLN 10 HE21 GLN 10 -5.865 -1.743 12.207
77 H ALA 11 H ALA 11 -2.516 0.347 7.082
78 HA ALA 11 HA ALA 11 0.056 -0.656 6.415
79 HB1 ALA 11 HB1 ALA 11 0.715 1.717 6.482
80 HB2 ALA 11 HB2 ALA 11 -0.874 2.100 7.160
81 HB3 ALA 11 HB3 ALA 11 -0.745 1.435 5.530
82 H LEU 12 H LEU 12 1.742 -1.061 7.594
83 HA LEU 12 HA LEU 12 1.641 -0.951 10.474
84 HB2 LEU 12 HB2 LEU 12 3.701 -1.897 8.488
85 HB3 LEU 12 HB3 LEU 12 3.981 -1.917 10.218
86 HG LEU 12 HG LEU 12 1.494 -3.236 9.428
87 HD11 LEU 12 HD11 LEU 12 4.133 -4.268 8.427
88 HD12 LEU 12 HD12 LEU 12 2.693 -3.874 7.484
89 HD13 LEU 12 HD13 LEU 12 2.679 -5.254 8.585
90 HD21 LEU 12 HD21 LEU 12 3.894 -4.110 11.034
91 HD22 LEU 12 HD22 LEU 12 2.337 -4.939 10.958
92 HD23 LEU 12 HD23 LEU 12 2.449 -3.333 11.679
93 H TYR 13 H TYR 13 3.114 0.830 7.872
94 HA TYR 13 HA TYR 13 4.271 2.715 9.791
95 HB2 TYR 13 HB2 TYR 13 5.824 1.501 7.484
96 HB3 TYR 13 HB3 TYR 13 6.397 2.793 8.530
97 HD1 TYR 13 HD2 TYR 13 6.733 2.262 11.006
98 HD2 TYR 13 HD1 TYR 13 6.156 -0.744 8.053
99 HE1 TYR 13 HE2 TYR 13 7.719 0.592 12.520
100 HE2 TYR 13 HE1 TYR 13 7.141 -2.420 9.553
101 HH TYR 13 HH TYR 13 8.739 -2.431 11.498
102 H SER 14 H SER 14 5.143 4.665 8.573
103 HA SER 14 HA SER 14 3.206 5.404 6.521
104 HB2 SER 14 HB2 SER 14 5.158 7.126 8.067
105 HB3 SER 14 HB3 SER 14 3.915 7.711 6.960
106 HG SER 14 HG SER 14 2.803 7.799 8.768
107 H TYR 15 H TYR 15 3.791 5.245 4.456
108 HA TYR 15 HA TYR 15 6.660 5.445 3.782
109 HB2 TYR 15 HB2 TYR 15 5.838 3.158 3.451
110 HB3 TYR 15 HB3 TYR 15 4.537 3.759 2.446
111 HD1 TYR 15 HD2 TYR 15 8.213 3.359 2.616
112 HD2 TYR 15 HD1 TYR 15 4.845 4.152 0.151
113 HE1 TYR 15 HE2 TYR 15 9.624 3.098 0.618
114 HE2 TYR 15 HE1 TYR 15 6.239 3.886 -1.852
115 HH TYR 15 HH TYR 15 9.370 2.555 -1.755
116 H ILE 16 H ILE 16 7.244 6.818 2.273
117 HA ILE 16 HA ILE 16 5.165 8.366 0.904
118 HB ILE 16 HB ILE 16 8.093 8.958 1.342
119 HG12 ILE 16 HG12 ILE 16 6.787 9.214 3.374
120 HG13 ILE 16 HG13 ILE 16 7.242 10.800 2.764
121 HG21 ILE 16 HG21 ILE 16 5.968 10.591 -0.044
122 HG22 ILE 16 HG22 ILE 16 7.396 9.865 -0.787
123 HG23 ILE 16 HG23 ILE 16 7.578 11.178 0.376
124 HD11 ILE 16 HD11 ILE 16 5.018 11.124 1.870
125 HD12 ILE 16 HD12 ILE 16 4.942 10.735 3.588
126 HD13 ILE 16 HD13 ILE 16 4.553 9.504 2.385
127 HA PRO 17 HA PRO 17 6.077 5.681 -2.524
128 HB2 PRO 17 HB3 PRO 17 4.459 7.683 -3.988
129 HB3 PRO 17 HB2 PRO 17 4.227 5.939 -3.839
130 HG2 PRO 17 HG2 PRO 17 2.643 7.645 -2.543
131 HG3 PRO 17 HG3 PRO 17 3.162 6.125 -1.786
132 HD2 PRO 17 HD2 PRO 17 4.181 8.906 -1.353
133 HD3 PRO 17 HD3 PRO 17 3.874 7.620 -0.169
134 H GLN 18 H GLN 18 7.416 5.662 -4.244
135 HA GLN 18 HA GLN 18 9.060 8.006 -4.684
136 HB2 GLN 18 HB2 GLN 18 9.229 5.241 -5.901
137 HB3 GLN 18 HB3 GLN 18 10.450 6.500 -6.027
138 HG2 GLN 18 HG2 GLN 18 9.561 5.252 -3.439
139 HG3 GLN 18 HG3 GLN 18 10.973 4.739 -4.362
140 HE21 GLN 18 HE22 GLN 18 11.683 7.433 -5.172
141 HE22 GLN 18 HE21 GLN 18 12.346 8.206 -3.769
142 H ASN 19 H ASN 19 6.273 6.726 -5.870
143 HA ASN 19 HA ASN 19 6.483 8.247 -8.373
144 HB2 ASN 19 HB2 ASN 19 5.326 5.482 -8.006
145 HB3 ASN 19 HB3 ASN 19 5.121 6.449 -9.463
146 HD21 ASN 19 HD22 ASN 19 7.293 4.566 -7.532
147 HD22 ASN 19 HD21 ASN 19 8.554 4.434 -8.716
148 H ASP 20 H ASP 20 4.652 9.351 -8.918
149 HA ASP 20 HA ASP 20 2.687 9.828 -6.909
150 HB2 ASP 20 HB2 ASP 20 3.382 11.568 -8.494
151 HB3 ASP 20 HB3 ASP 20 2.751 10.617 -9.834
152 H ASP 21 H ASP 21 3.063 7.489 -9.301
153 HA ASP 21 HA ASP 21 0.282 6.808 -9.642
154 HB2 ASP 21 HB2 ASP 21 1.826 6.335 -11.444
155 HB3 ASP 21 HB3 ASP 21 2.854 5.390 -10.375
156 H GLU 22 H GLU 22 2.551 6.367 -7.213
157 HA GLU 22 HA GLU 22 1.449 3.816 -6.317
158 HB2 GLU 22 HB2 GLU 22 3.793 5.461 -5.384
159 HB3 GLU 22 HB3 GLU 22 3.231 4.033 -4.525
160 HG2 GLU 22 HG2 GLU 22 3.639 2.673 -6.496
161 HG3 GLU 22 HG3 GLU 22 4.175 4.091 -7.383
162 H LEU 23 H LEU 23 1.030 3.621 -3.944
163 HA LEU 23 HA LEU 23 -0.876 5.742 -3.276
164 HB2 LEU 23 HB2 LEU 23 -1.401 3.187 -3.538
165 HB3 LEU 23 HB3 LEU 23 -0.741 3.066 -1.921
166 HG LEU 23 HG LEU 23 -3.272 3.248 -2.106
167 HD11 LEU 23 HD11 LEU 23 -3.489 4.694 -0.174
168 HD12 LEU 23 HD12 LEU 23 -1.858 5.315 -0.443
169 HD13 LEU 23 HD13 LEU 23 -2.097 3.622 -0.009
170 HD21 LEU 23 HD21 LEU 23 -3.347 4.936 -3.844
171 HD22 LEU 23 HD22 LEU 23 -2.562 6.095 -2.772
172 HD23 LEU 23 HD23 LEU 23 -4.180 5.501 -2.393
173 H GLU 24 H GLU 24 -0.809 6.861 -1.397
174 HA GLU 24 HA GLU 24 1.659 6.858 0.059
175 HB2 GLU 24 HB2 GLU 24 -0.700 8.570 -0.137
176 HB3 GLU 24 HB3 GLU 24 -0.079 8.438 1.505
177 HG2 GLU 24 HG2 GLU 24 2.158 9.050 0.649
178 HG3 GLU 24 HG3 GLU 24 1.428 9.321 -0.938
179 H LEU 25 H LEU 25 2.112 5.528 1.622
180 HA LEU 25 HA LEU 25 -0.062 4.224 3.084
181 HB2 LEU 25 HB2 LEU 25 2.892 3.651 3.197
182 HB3 LEU 25 HB3 LEU 25 1.611 2.672 3.877
183 HG LEU 25 HG LEU 25 1.964 3.174 0.923
184 HD11 LEU 25 HD11 LEU 25 2.740 0.796 2.600
185 HD12 LEU 25 HD12 LEU 25 3.833 1.889 1.749
186 HD13 LEU 25 HD13 LEU 25 2.744 0.843 0.836
187 HD21 LEU 25 HD21 LEU 25 0.203 1.243 2.434
188 HD22 LEU 25 HD22 LEU 25 0.365 1.340 0.678
189 HD23 LEU 25 HD23 LEU 25 -0.335 2.689 1.575
190 H ARG 26 H ARG 26 -0.497 4.732 5.144
191 HA ARG 26 HA ARG 26 1.477 6.319 6.628
192 HB2 ARG 26 HB2 ARG 26 -1.493 6.855 6.672
193 HB3 ARG 26 HB3 ARG 26 -0.241 7.801 7.459
194 HG2 ARG 26 HG2 ARG 26 0.669 8.373 5.235
195 HG3 ARG 26 HG3 ARG 26 -0.693 7.528 4.501
196 HD2 ARG 26 HD2 ARG 26 -2.250 9.050 5.520
197 HD3 ARG 26 HD3 ARG 26 -0.944 9.835 6.414
198 HE ARG 26 HE ARG 26 -0.178 10.104 3.830
199 HH11 ARG 26 HH11 ARG 26 -3.117 10.925 5.558
200 HH12 ARG 26 HH12 ARG 26 -3.548 12.203 4.459
201 HH21 ARG 26 HH22 ARG 26 -0.738 11.779 2.396
202 HH22 ARG 26 HH21 ARG 26 -2.181 12.711 2.683
203 H ASP 27 H ASP 27 1.616 5.866 8.749
204 HA ASP 27 HA ASP 27 1.124 3.326 9.649
205 HB2 ASP 27 HB2 ASP 27 2.707 4.673 10.796
206 HB3 ASP 27 HB3 ASP 27 1.506 5.892 11.186
207 H GLY 28 H GLY 28 -0.794 2.358 9.649
208 HA2 GLY 28 HA2 GLY 28 -2.662 1.792 10.968
209 HA3 GLY 28 HA3 GLY 28 -2.836 3.475 11.431
210 H ASP 29 H ASP 29 -2.379 3.621 8.185
211 HA ASP 29 HA ASP 29 -5.231 3.920 7.738
212 HB2 ASP 29 HB2 ASP 29 -3.438 5.492 6.812
213 HB3 ASP 29 HB3 ASP 29 -3.082 4.221 5.642
214 H ILE 30 H ILE 30 -6.487 2.745 6.268
215 HA ILE 30 HA ILE 30 -5.429 0.064 5.741
216 HB ILE 30 HB ILE 30 -8.243 1.117 5.947
217 HG12 ILE 30 HG12 ILE 30 -8.286 -0.941 7.545
218 HG13 ILE 30 HG13 ILE 30 -6.538 -0.791 7.483
219 HG21 ILE 30 HG21 ILE 30 -7.397 -1.592 4.950
220 HG22 ILE 30 HG22 ILE 30 -8.265 -0.353 4.049
221 HG23 ILE 30 HG23 ILE 30 -9.042 -1.155 5.411
222 HD11 ILE 30 HD11 ILE 30 -7.323 0.361 9.408
223 HD12 ILE 30 HD12 ILE 30 -8.511 1.252 8.455
224 HD13 ILE 30 HD13 ILE 30 -6.794 1.558 8.229
225 H VAL 31 H VAL 31 -5.343 -0.817 3.757
226 HA VAL 31 HA VAL 31 -6.325 0.770 1.481
227 HB VAL 31 HB VAL 31 -3.637 -0.576 1.736
228 HG11 VAL 31 HG11 VAL 31 -3.284 -0.098 -0.650
229 HG12 VAL 31 HG12 VAL 31 -4.968 0.410 -0.790
230 HG13 VAL 31 HG13 VAL 31 -4.580 -1.266 -0.398
231 HG21 VAL 31 HG21 VAL 31 -2.779 1.592 1.083
232 HG22 VAL 31 HG22 VAL 31 -3.841 1.765 2.480
233 HG23 VAL 31 HG23 VAL 31 -4.421 2.199 0.870
234 H ASP 32 H ASP 32 -7.673 -0.324 0.229
235 HA ASP 32 HA ASP 32 -7.940 -3.209 0.491
236 HB2 ASP 32 HB2 ASP 32 -9.397 -1.409 -1.452
237 HB3 ASP 32 HB3 ASP 32 -9.888 -3.004 -0.902
238 H VAL 33 H VAL 33 -6.684 -4.527 -0.703
239 HA VAL 33 HA VAL 33 -5.382 -3.450 -3.075
240 HB VAL 33 HB VAL 33 -3.915 -4.686 -1.658
241 HG11 VAL 33 HG11 VAL 33 -6.102 -6.662 -1.528
242 HG12 VAL 33 HG12 VAL 33 -4.998 -6.084 -0.269
243 HG13 VAL 33 HG13 VAL 33 -4.445 -7.261 -1.461
244 HG21 VAL 33 HG21 VAL 33 -4.618 -6.446 -3.989
245 HG22 VAL 33 HG22 VAL 33 -3.070 -6.398 -3.142
246 HG23 VAL 33 HG23 VAL 33 -3.616 -4.996 -4.069
247 H MET 34 H MET 34 -6.152 -3.703 -5.051
248 HA MET 34 HA MET 34 -8.337 -5.607 -5.457
249 HB2 MET 34 HB2 MET 34 -9.061 -4.325 -7.283
250 HB3 MET 34 HB3 MET 34 -8.566 -3.145 -6.080
251 HG2 MET 34 HG2 MET 34 -6.641 -2.572 -7.250
252 HG3 MET 34 HG3 MET 34 -6.672 -4.053 -8.200
253 HE1 MET 34 HE1 MET 34 -6.073 -1.651 -9.978
254 HE2 MET 34 HE2 MET 34 -7.243 -1.990 -11.252
255 HE3 MET 34 HE3 MET 34 -6.405 -3.321 -10.444
256 H GLU 35 H GLU 35 -5.186 -4.682 -6.752
257 HA GLU 35 HA GLU 35 -5.225 -7.133 -8.379
258 HB2 GLU 35 HB2 GLU 35 -5.260 -5.005 -9.681
259 HB3 GLU 35 HB3 GLU 35 -3.689 -4.616 -9.000
260 HG2 GLU 35 HG2 GLU 35 -2.770 -6.638 -10.006
261 HG3 GLU 35 HG3 GLU 35 -4.345 -7.014 -10.693
262 H LYS 36 H LYS 36 -3.636 -8.493 -8.137
263 HA LYS 36 HA LYS 36 -1.635 -7.799 -6.091
264 HB2 LYS 36 HB2 LYS 36 -3.061 -10.436 -6.476
265 HB3 LYS 36 HB3 LYS 36 -1.835 -10.099 -5.256
266 HG2 LYS 36 HG2 LYS 36 -3.268 -8.436 -4.227
267 HG3 LYS 36 HG3 LYS 36 -4.477 -8.667 -5.487
268 HD2 LYS 36 HD2 LYS 36 -4.832 -10.953 -4.758
269 HD3 LYS 36 HD3 LYS 36 -3.568 -10.774 -3.539
270 HE2 LYS 36 HE2 LYS 36 -5.767 -10.539 -2.527
271 HE3 LYS 36 HE3 LYS 36 -4.883 -9.018 -2.443
272 HZ1 LYS 36 HZ1 LYS 36 -7.012 -9.690 -4.411
273 HZ2 LYS 36 HZ2 LYS 36 -6.159 -8.231 -4.354
274 HZ3 LYS 36 HZ3 LYS 36 -7.182 -8.654 -3.077
275 H CYS 37 H CYS 37 0.264 -7.648 -6.992
276 HA CYS 37 HA CYS 37 0.883 -8.919 -9.488
277 HB2 CYS 37 HB2 CYS 37 2.741 -7.362 -7.686
278 HB3 CYS 37 HB3 CYS 37 2.916 -7.651 -9.419
279 HG CYS 37 HG CYS 37 1.724 -5.038 -8.067
280 H ASP 38 H ASP 38 2.801 -10.158 -9.841
281 HA ASP 38 HA ASP 38 2.887 -12.411 -8.095
282 HB2 ASP 38 HB2 ASP 38 4.308 -13.412 -9.769
283 HB3 ASP 38 HB3 ASP 38 3.024 -12.530 -10.592
284 H ASP 39 H ASP 39 4.658 -9.508 -8.241
285 HA ASP 39 HA ASP 39 7.067 -10.723 -7.140
286 HB2 ASP 39 HB2 ASP 39 7.121 -8.954 -8.962
287 HB3 ASP 39 HB3 ASP 39 6.664 -7.793 -7.719
288 H GLY 40 H GLY 40 4.202 -9.302 -5.968
289 HA2 GLY 40 HA2 GLY 40 3.853 -9.767 -3.603
290 HA3 GLY 40 HA3 GLY 40 5.512 -9.270 -3.314
291 H TRP 41 H TRP 41 4.933 -6.972 -5.278
292 HA TRP 41 HA TRP 41 3.777 -5.185 -3.286
293 HB2 TRP 41 HB2 TRP 41 4.641 -4.276 -6.011
294 HB3 TRP 41 HB3 TRP 41 4.725 -3.420 -4.473
295 HD1 TRP 41 HD1 TRP 41 6.866 -5.118 -6.875
296 HE1 TRP 41 HE1 TRP 41 9.158 -5.707 -5.873
297 HE3 TRP 41 HE3 TRP 41 5.815 -4.383 -1.902
298 HZ2 TRP 41 HZ2 TRP 41 10.361 -5.841 -3.335
299 HZ3 TRP 41 HZ3 TRP 41 7.603 -4.770 -0.266
300 HH2 TRP 41 HH2 TRP 41 9.827 -5.485 -0.967
301 H PHE 42 H PHE 42 1.775 -4.154 -3.571
302 HA PHE 42 HA PHE 42 0.142 -5.543 -5.582
303 HB2 PHE 42 HB2 PHE 42 -0.559 -4.797 -2.745
304 HB3 PHE 42 HB3 PHE 42 -1.657 -5.538 -3.897
305 HD1 PHE 42 HD1 PHE 42 0.095 -7.576 -5.147
306 HD2 PHE 42 HD2 PHE 42 -0.301 -6.374 -1.079
307 HE1 PHE 42 HE1 PHE 42 0.826 -9.806 -4.418
308 HE2 PHE 42 HE2 PHE 42 0.445 -8.601 -0.350
309 HZ PHE 42 HZ PHE 42 1.010 -10.319 -2.018
310 H VAL 43 H VAL 43 -1.979 -4.506 -6.016
311 HA VAL 43 HA VAL 43 -1.724 -1.575 -6.090
312 HB VAL 43 HB VAL 43 -2.866 -3.545 -8.024
313 HG11 VAL 43 HG11 VAL 43 -3.806 -0.676 -7.873
314 HG12 VAL 43 HG12 VAL 43 -4.789 -2.070 -7.430
315 HG13 VAL 43 HG13 VAL 43 -4.245 -1.869 -9.097
316 HG21 VAL 43 HG21 VAL 43 -1.789 -2.048 -9.601
317 HG22 VAL 43 HG22 VAL 43 -0.666 -2.503 -8.312
318 HG23 VAL 43 HG23 VAL 43 -1.453 -0.923 -8.286
319 H GLY 44 H GLY 44 -3.233 -0.354 -5.134
320 HA2 GLY 44 HA2 GLY 44 -5.711 -1.559 -4.197
321 HA3 GLY 44 HA3 GLY 44 -4.540 -1.176 -2.948
322 H THR 45 H THR 45 -6.639 0.053 -2.424
323 HA THR 45 HA THR 45 -6.253 2.813 -3.344
324 HB THR 45 HB THR 45 -8.886 1.422 -2.847
325 HG1 THR 45 HG1 THR 45 -7.410 2.027 -5.097
326 HG21 THR 45 HG21 THR 45 -9.855 3.619 -3.642
327 HG22 THR 45 HG22 THR 45 -8.255 4.315 -3.384
328 HG23 THR 45 HG23 THR 45 -9.148 3.631 -2.026
329 H SER 46 H SER 46 -6.369 4.335 -1.752
330 HA SER 46 HA SER 46 -5.978 3.419 0.930
331 HB2 SER 46 HB2 SER 46 -4.749 5.363 0.138
332 HB3 SER 46 HB3 SER 46 -6.259 6.206 -0.210
333 HG SER 46 HG SER 46 -5.302 5.415 2.365
334 H ARG 47 H ARG 47 -7.420 3.275 2.520
335 HA ARG 47 HA ARG 47 -10.198 3.415 1.932
336 HB2 ARG 47 HB2 ARG 47 -9.111 1.820 3.515
337 HB3 ARG 47 HB3 ARG 47 -8.835 3.160 4.615
338 HG2 ARG 47 HG2 ARG 47 -11.362 3.503 4.550
339 HG3 ARG 47 HG3 ARG 47 -11.427 1.897 3.815
340 HD2 ARG 47 HD2 ARG 47 -10.151 1.015 5.760
341 HD3 ARG 47 HD3 ARG 47 -10.234 2.614 6.482
342 HE ARG 47 HE ARG 47 -12.763 1.344 5.760
343 HH11 ARG 47 HH11 ARG 47 -10.454 2.173 8.261
344 HH12 ARG 47 HH12 ARG 47 -11.592 2.003 9.563
345 HH21 ARG 47 HH22 ARG 47 -14.267 1.110 7.461
346 HH22 ARG 47 HH21 ARG 47 -13.769 1.384 9.107
347 H ARG 48 H ARG 48 -7.921 5.624 3.370
348 HA ARG 48 HA ARG 48 -10.008 7.235 4.591
349 HB2 ARG 48 HB2 ARG 48 -7.624 6.746 5.493
350 HB3 ARG 48 HB3 ARG 48 -7.126 8.028 4.399
351 HG2 ARG 48 HG2 ARG 48 -8.768 9.524 5.522
352 HG3 ARG 48 HG3 ARG 48 -9.023 8.241 6.710
353 HD2 ARG 48 HD2 ARG 48 -6.462 9.665 6.079
354 HD3 ARG 48 HD3 ARG 48 -7.390 9.762 7.579
355 HE ARG 48 HE ARG 48 -6.261 7.178 6.723
356 HH11 ARG 48 HH11 ARG 48 -6.380 9.827 9.024
357 HH12 ARG 48 HH12 ARG 48 -5.337 9.041 10.172
358 HH21 ARG 48 HH22 ARG 48 -4.911 6.148 8.227
359 HH22 ARG 48 HH21 ARG 48 -4.504 6.933 9.725
360 H THR 49 H THR 49 -7.502 7.687 2.091
361 HA THR 49 HA THR 49 -8.806 10.203 1.359
362 HB THR 49 HB THR 49 -6.597 10.748 1.673
363 HG1 THR 49 HG1 THR 49 -7.055 10.169 -1.032
364 HG21 THR 49 HG21 THR 49 -4.680 9.382 1.038
365 HG22 THR 49 HG22 THR 49 -5.771 8.170 0.365
366 HG23 THR 49 HG23 THR 49 -5.779 8.498 2.098
367 H LYS 50 H LYS 50 -8.666 7.023 0.360
368 HA LYS 50 HA LYS 50 -9.626 5.918 -1.357
369 HB2 LYS 50 HB2 LYS 50 -10.963 8.545 -1.969
370 HB3 LYS 50 HB3 LYS 50 -11.465 6.967 -2.544
371 HG2 LYS 50 HG2 LYS 50 -11.612 8.066 0.242
372 HG3 LYS 50 HG3 LYS 50 -12.927 7.526 -0.794
373 HD2 LYS 50 HD2 LYS 50 -10.859 5.835 0.592
374 HD3 LYS 50 HD3 LYS 50 -12.595 5.874 0.890
375 HE2 LYS 50 HE2 LYS 50 -11.190 4.857 -1.562
376 HE3 LYS 50 HE3 LYS 50 -12.024 3.891 -0.350
377 HZ1 LYS 50 HZ1 LYS 50 -13.267 5.812 -2.251
378 HZ2 LYS 50 HZ2 LYS 50 -14.103 5.039 -0.994
379 HZ3 LYS 50 HZ3 LYS 50 -13.425 4.127 -2.252
380 H GLN 51 H GLN 51 -7.066 7.033 -1.844
381 HA GLN 51 HA GLN 51 -7.193 7.776 -4.661
382 HB2 GLN 51 HB2 GLN 51 -4.563 7.774 -4.217
383 HB3 GLN 51 HB3 GLN 51 -5.576 9.157 -3.845
384 HG2 GLN 51 HG2 GLN 51 -5.655 8.505 -1.516
385 HG3 GLN 51 HG3 GLN 51 -4.717 7.057 -1.872
386 HE21 GLN 51 HE22 GLN 51 -4.632 10.496 -1.460
387 HE22 GLN 51 HE21 GLN 51 -2.910 10.661 -1.460
388 H PHE 52 H PHE 52 -6.062 6.588 -6.250
389 HA PHE 52 HA PHE 52 -5.856 3.737 -5.531
390 HB2 PHE 52 HB2 PHE 52 -7.786 4.014 -6.883
391 HB3 PHE 52 HB3 PHE 52 -6.948 5.090 -7.992
392 HD1 PHE 52 HD2 PHE 52 -6.697 1.586 -6.714
393 HD2 PHE 52 HD1 PHE 52 -6.298 4.251 -10.008
394 HE1 PHE 52 HE2 PHE 52 -6.191 -0.309 -8.183
395 HE2 PHE 52 HE1 PHE 52 -5.787 2.354 -11.483
396 HZ PHE 52 HZ PHE 52 -5.733 0.070 -10.571
397 H GLY 53 H GLY 53 -4.142 2.578 -6.213
398 HA2 GLY 53 HA2 GLY 53 -2.528 3.044 -8.397
399 HA3 GLY 53 HA3 GLY 53 -1.785 3.929 -7.070
400 H THR 54 H THR 54 0.008 2.592 -7.226
401 HA THR 54 HA THR 54 -0.378 -0.183 -6.342
402 HB THR 54 HB THR 54 0.844 -0.161 -8.359
403 HG1 THR 54 HG1 THR 54 3.154 -0.258 -6.892
404 HG21 THR 54 HG21 THR 54 3.045 1.229 -8.424
405 HG22 THR 54 HG22 THR 54 2.248 2.197 -7.181
406 HG23 THR 54 HG23 THR 54 1.501 2.006 -8.770
407 H PHE 55 H PHE 55 0.755 -0.960 -4.551
408 HA PHE 55 HA PHE 55 2.374 0.930 -3.048
409 HB2 PHE 55 HB2 PHE 55 1.115 0.747 -1.015
410 HB3 PHE 55 HB3 PHE 55 0.001 1.228 -2.278
411 HD1 PHE 55 HD1 PHE 55 -1.386 -0.649 -3.384
412 HD2 PHE 55 HD2 PHE 55 0.650 -1.082 0.328
413 HE1 PHE 55 HE1 PHE 55 -2.843 -2.549 -2.808
414 HE2 PHE 55 HE2 PHE 55 -0.802 -2.981 0.910
415 HZ PHE 55 HZ PHE 55 -2.552 -3.717 -0.660
416 HA PRO 56 HA PRO 56 4.592 -2.811 -2.124
417 HB2 PRO 56 HB3 PRO 56 5.685 -1.305 0.146
418 HB3 PRO 56 HB2 PRO 56 6.522 -1.993 -1.249
419 HG2 PRO 56 HG2 PRO 56 6.195 0.660 -0.941
420 HG3 PRO 56 HG3 PRO 56 6.207 -0.111 -2.535
421 HD2 PRO 56 HD2 PRO 56 3.881 0.849 -0.907
422 HD3 PRO 56 HD3 PRO 56 4.152 0.951 -2.660
423 H GLY 57 H GLY 57 3.325 -4.357 -1.231
424 HA2 GLY 57 HA2 GLY 57 1.704 -3.923 1.081
425 HA3 GLY 57 HA3 GLY 57 1.996 -5.478 0.310
426 H ASN 58 H ASN 58 4.848 -3.915 0.998
427 HA ASN 58 HA ASN 58 5.609 -5.761 3.039
428 HB2 ASN 58 HB2 ASN 58 7.089 -4.811 1.202
429 HB3 ASN 58 HB3 ASN 58 7.084 -3.294 2.097
430 HD21 ASN 58 HD22 ASN 58 8.289 -3.098 3.948
431 HD22 ASN 58 HD21 ASN 58 9.425 -4.293 4.468
432 H TYR 59 H TYR 59 4.065 -2.730 3.003
433 HA TYR 59 HA TYR 59 4.798 -2.225 5.819
434 HB2 TYR 59 HB2 TYR 59 3.801 -0.268 3.741
435 HB3 TYR 59 HB3 TYR 59 4.121 0.122 5.424
436 HD1 TYR 59 HD2 TYR 59 6.513 -0.105 6.263
437 HD2 TYR 59 HD1 TYR 59 5.486 -0.172 2.139
438 HE1 TYR 59 HE2 TYR 59 8.834 0.457 5.682
439 HE2 TYR 59 HE1 TYR 59 7.794 0.398 1.545
440 HH TYR 59 HH TYR 59 10.353 0.237 3.795
441 H VAL 60 H VAL 60 2.639 -4.008 4.783
442 HA VAL 60 HA VAL 60 0.458 -2.751 6.250
443 HB VAL 60 HB VAL 60 -1.230 -3.504 4.566
444 HG11 VAL 60 HG11 VAL 60 0.756 -1.507 3.481
445 HG12 VAL 60 HG12 VAL 60 -0.462 -1.149 4.708
446 HG13 VAL 60 HG13 VAL 60 -0.958 -1.620 3.079
447 HG21 VAL 60 HG21 VAL 60 1.221 -3.993 2.893
448 HG22 VAL 60 HG22 VAL 60 -0.415 -3.863 2.243
449 HG23 VAL 60 HG23 VAL 60 -0.018 -5.155 3.370
450 H LYS 61 H LYS 61 -1.167 -4.249 6.939
451 HA LYS 61 HA LYS 61 -0.200 -7.026 7.097
452 HB2 LYS 61 HB2 LYS 61 -1.439 -6.800 9.464
453 HB3 LYS 61 HB3 LYS 61 0.273 -6.462 9.249
454 HG2 LYS 61 HG2 LYS 61 -0.070 -4.148 9.260
455 HG3 LYS 61 HG3 LYS 61 -1.805 -4.318 9.012
456 HD2 LYS 61 HD2 LYS 61 -1.128 -3.649 11.310
457 HD3 LYS 61 HD3 LYS 61 -2.127 -5.097 11.242
458 HE2 LYS 61 HE2 LYS 61 0.872 -5.233 11.365
459 HE3 LYS 61 HE3 LYS 61 -0.097 -5.067 12.825
460 HZ1 LYS 61 HZ1 LYS 61 0.243 -7.359 11.063
461 HZ2 LYS 61 HZ2 LYS 61 -1.316 -7.128 11.698
462 HZ3 LYS 61 HZ3 LYS 61 0.010 -7.302 12.741
463 HA PRO 62 HA PRO 62 -4.126 -8.208 5.579
464 HB2 PRO 62 HB3 PRO 62 -3.895 -10.590 7.303
465 HB3 PRO 62 HB2 PRO 62 -4.044 -10.484 5.549
466 HG2 PRO 62 HG2 PRO 62 -1.731 -11.154 6.714
467 HG3 PRO 62 HG3 PRO 62 -1.774 -10.157 5.248
468 HD2 PRO 62 HD2 PRO 62 -1.336 -9.342 8.085
469 HD3 PRO 62 HD3 PRO 62 -0.549 -8.750 6.607
470 H LEU 63 H LEU 63 -6.116 -7.683 6.124
471 HA LEU 63 HA LEU 63 -6.931 -7.897 8.945
472 HB2 LEU 63 HB2 LEU 63 -7.986 -5.975 6.870
473 HB3 LEU 63 HB3 LEU 63 -8.462 -6.050 8.555
474 HG LEU 63 HG LEU 63 -5.741 -5.253 7.532
475 HD11 LEU 63 HD11 LEU 63 -7.855 -3.578 8.859
476 HD12 LEU 63 HD12 LEU 63 -7.653 -3.711 7.114
477 HD13 LEU 63 HD13 LEU 63 -6.356 -3.036 8.098
478 HD21 LEU 63 HD21 LEU 63 -6.858 -5.263 10.334
479 HD22 LEU 63 HD22 LEU 63 -5.289 -4.623 9.846
480 HD23 LEU 63 HD23 LEU 63 -5.616 -6.350 9.711
481 H TYR 64 H TYR 64 -9.556 -7.597 8.786
482 HA TYR 64 HA TYR 64 -11.383 -8.912 8.712
483 HB2 TYR 64 HB2 TYR 64 -10.795 -8.820 5.764
484 HB3 TYR 64 HB3 TYR 64 -12.354 -9.089 6.524
485 HD1 TYR 64 HD1 TYR 64 -12.813 -7.138 8.430
486 HD2 TYR 64 HD2 TYR 64 -10.584 -6.730 4.833
487 HE1 TYR 64 HE1 TYR 64 -13.256 -4.719 8.439
488 HE2 TYR 64 HE2 TYR 64 -11.013 -4.309 4.836
489 HH TYR 64 HH TYR 64 -12.304 -2.654 5.750
490 H LEU 65 H LEU 65 -10.105 -10.467 5.854
491 HA LEU 65 HA LEU 65 -10.759 -13.042 6.936
492 HB2 LEU 65 HB2 LEU 65 -11.165 -12.476 4.580
493 HB3 LEU 65 HB3 LEU 65 -9.440 -12.283 4.327
494 HG LEU 65 HG LEU 65 -9.131 -14.689 4.875
495 HD11 LEU 65 HD11 LEU 65 -11.124 -15.005 6.248
496 HD12 LEU 65 HD12 LEU 65 -11.073 -16.161 4.918
497 HD13 LEU 65 HD13 LEU 65 -12.143 -14.763 4.830
498 HD21 LEU 65 HD21 LEU 65 -10.044 -15.538 2.766
499 HD22 LEU 65 HD22 LEU 65 -9.275 -13.964 2.564
500 HD23 LEU 65 HD23 LEU 65 -11.033 -14.086 2.616
Start of MODEL 12
1 H1 GLN 1 H1 GLN 1 -23.006 -3.250 -3.911
2 H2 GLN 1 H2 GLN 1 -24.570 -3.365 -3.269
3 H3 GLN 1 H3 GLN 1 -23.855 -4.711 -4.006
4 HA GLN 1 HA GLN 1 -22.859 -3.382 -1.561
5 HB2 GLN 1 HB2 GLN 1 -24.622 -5.774 -1.942
6 HB3 GLN 1 HB3 GLN 1 -23.588 -5.635 -0.525
7 HG2 GLN 1 HG2 GLN 1 -25.825 -3.808 -1.361
8 HG3 GLN 1 HG3 GLN 1 -25.736 -4.830 0.074
9 HE21 GLN 1 HE22 GLN 1 -24.283 -4.246 1.749
10 HE22 GLN 1 HE21 GLN 1 -23.755 -2.602 1.924
11 H THR 2 H THR 2 -22.442 -5.868 -4.023
12 HA THR 2 HA THR 2 -20.267 -7.110 -2.588
13 HB THR 2 HB THR 2 -19.982 -8.388 -4.781
14 HG1 THR 2 HG1 THR 2 -21.032 -7.398 -6.360
15 HG21 THR 2 HG21 THR 2 -22.633 -8.511 -3.339
16 HG22 THR 2 HG22 THR 2 -21.145 -9.321 -2.849
17 HG23 THR 2 HG23 THR 2 -21.954 -9.791 -4.345
18 H SER 3 H SER 3 -19.738 -4.436 -2.891
19 HA SER 3 HA SER 3 -17.626 -4.341 -4.919
20 HB2 SER 3 HB2 SER 3 -17.584 -1.861 -4.108
21 HB3 SER 3 HB3 SER 3 -18.914 -2.400 -5.134
22 HG SER 3 HG SER 3 -20.240 -1.991 -3.566
23 H GLN 4 H GLN 4 -18.195 -4.794 -1.612
24 HA GLN 4 HA GLN 4 -15.464 -4.080 -0.841
25 HB2 GLN 4 HB2 GLN 4 -17.824 -3.841 0.532
26 HB3 GLN 4 HB3 GLN 4 -17.205 -5.368 1.154
27 HG2 GLN 4 HG2 GLN 4 -16.465 -3.650 2.606
28 HG3 GLN 4 HG3 GLN 4 -15.071 -4.218 1.687
29 HE21 GLN 4 HE22 GLN 4 -17.554 -2.110 0.396
30 HE22 GLN 4 HE21 GLN 4 -16.545 -0.713 0.233
31 H ASP 5 H ASP 5 -15.211 -6.031 1.207
32 HA ASP 5 HA ASP 5 -14.257 -8.075 1.534
33 HB2 ASP 5 HB2 ASP 5 -16.592 -8.814 1.109
34 HB3 ASP 5 HB3 ASP 5 -16.217 -8.968 -0.600
35 H LEU 6 H LEU 6 -13.221 -6.237 -0.516
36 HA LEU 6 HA LEU 6 -12.044 -8.099 -2.441
37 HB2 LEU 6 HB2 LEU 6 -13.315 -6.115 -3.270
38 HB3 LEU 6 HB3 LEU 6 -12.106 -5.085 -2.531
39 HG LEU 6 HG LEU 6 -10.389 -6.064 -4.022
40 HD11 LEU 6 HD11 LEU 6 -11.106 -7.433 -5.925
41 HD12 LEU 6 HD12 LEU 6 -12.732 -7.512 -5.247
42 HD13 LEU 6 HD13 LEU 6 -11.380 -8.244 -4.385
43 HD21 LEU 6 HD21 LEU 6 -11.159 -4.984 -6.075
44 HD22 LEU 6 HD22 LEU 6 -11.530 -4.010 -4.654
45 HD23 LEU 6 HD23 LEU 6 -12.803 -4.943 -5.440
46 H PHE 7 H PHE 7 -11.110 -8.167 0.147
47 HA PHE 7 HA PHE 7 -9.181 -8.341 1.301
48 HB2 PHE 7 HB2 PHE 7 -8.323 -8.203 -1.484
49 HB3 PHE 7 HB3 PHE 7 -7.091 -7.655 -0.352
50 HD1 PHE 7 HD2 PHE 7 -6.243 -9.163 1.377
51 HD2 PHE 7 HD1 PHE 7 -8.948 -10.501 -1.620
52 HE1 PHE 7 HE2 PHE 7 -5.655 -11.490 1.896
53 HE2 PHE 7 HE1 PHE 7 -8.363 -12.836 -1.108
54 HZ PHE 7 HZ PHE 7 -6.715 -13.331 0.651
55 H SER 8 H SER 8 -8.951 -6.899 2.857
56 HA SER 8 HA SER 8 -7.910 -4.237 2.120
57 HB2 SER 8 HB2 SER 8 -9.514 -4.932 4.595
58 HB3 SER 8 HB3 SER 8 -9.031 -3.323 4.064
59 HG SER 8 HG SER 8 -10.427 -3.494 2.309
60 H TYR 9 H TYR 9 -6.011 -3.617 3.043
61 HA TYR 9 HA TYR 9 -5.038 -5.213 5.331
62 HB2 TYR 9 HB2 TYR 9 -3.340 -3.742 3.302
63 HB3 TYR 9 HB3 TYR 9 -2.755 -4.695 4.655
64 HD1 TYR 9 HD2 TYR 9 -4.546 -7.109 4.360
65 HD2 TYR 9 HD1 TYR 9 -2.399 -4.809 1.514
66 HE1 TYR 9 HE2 TYR 9 -4.397 -9.079 2.891
67 HE2 TYR 9 HE1 TYR 9 -2.242 -6.754 0.033
68 HH TYR 9 HH TYR 9 -4.068 -9.584 0.519
69 H GLN 10 H GLN 10 -3.878 -4.039 6.950
70 HA GLN 10 HA GLN 10 -4.385 -1.136 6.892
71 HB2 GLN 10 HB2 GLN 10 -5.373 -2.430 8.810
72 HB3 GLN 10 HB3 GLN 10 -3.734 -2.814 9.322
73 HG2 GLN 10 HG2 GLN 10 -3.288 -0.362 9.433
74 HG3 GLN 10 HG3 GLN 10 -5.001 -0.096 9.140
75 HE21 GLN 10 HE22 GLN 10 -5.274 0.927 11.104
76 HE22 GLN 10 HE21 GLN 10 -5.280 0.061 12.602
77 H ALA 11 H ALA 11 -2.685 0.243 7.051
78 HA ALA 11 HA ALA 11 -0.147 -0.774 6.258
79 HB1 ALA 11 HB1 ALA 11 0.528 1.598 6.300
80 HB2 ALA 11 HB2 ALA 11 -1.032 1.993 7.032
81 HB3 ALA 11 HB3 ALA 11 -0.966 1.319 5.399
82 H LEU 12 H LEU 12 1.647 -1.090 7.343
83 HA LEU 12 HA LEU 12 1.596 -1.024 10.242
84 HB2 LEU 12 HB2 LEU 12 3.565 -2.061 8.214
85 HB3 LEU 12 HB3 LEU 12 3.873 -2.096 9.940
86 HG LEU 12 HG LEU 12 1.337 -3.308 9.022
87 HD11 LEU 12 HD11 LEU 12 4.040 -4.482 8.447
88 HD12 LEU 12 HD12 LEU 12 2.718 -4.181 7.315
89 HD13 LEU 12 HD13 LEU 12 2.565 -5.443 8.540
90 HD21 LEU 12 HD21 LEU 12 3.453 -4.123 11.009
91 HD22 LEU 12 HD22 LEU 12 1.900 -4.925 10.769
92 HD23 LEU 12 HD23 LEU 12 1.953 -3.271 11.382
93 H TYR 13 H TYR 13 2.954 0.784 7.617
94 HA TYR 13 HA TYR 13 4.261 2.598 9.516
95 HB2 TYR 13 HB2 TYR 13 5.634 1.468 7.057
96 HB3 TYR 13 HB3 TYR 13 6.281 2.733 8.088
97 HD1 TYR 13 HD2 TYR 13 7.106 2.192 10.346
98 HD2 TYR 13 HD1 TYR 13 5.755 -0.841 7.689
99 HE1 TYR 13 HE2 TYR 13 8.233 0.493 11.721
100 HE2 TYR 13 HE1 TYR 13 6.878 -2.549 9.055
101 HH TYR 13 HH TYR 13 8.127 -1.885 12.179
102 H SER 14 H SER 14 4.942 4.627 8.410
103 HA SER 14 HA SER 14 2.998 5.400 6.374
104 HB2 SER 14 HB2 SER 14 4.942 7.146 7.913
105 HB3 SER 14 HB3 SER 14 3.570 7.688 6.943
106 HG SER 14 HG SER 14 3.597 6.389 9.444
107 H TYR 15 H TYR 15 3.585 5.521 4.303
108 HA TYR 15 HA TYR 15 6.458 5.684 3.659
109 HB2 TYR 15 HB2 TYR 15 5.878 3.388 3.340
110 HB3 TYR 15 HB3 TYR 15 4.391 3.807 2.526
111 HD1 TYR 15 HD2 TYR 15 8.077 3.741 2.143
112 HD2 TYR 15 HD1 TYR 15 4.316 4.199 0.224
113 HE1 TYR 15 HE2 TYR 15 9.175 3.536 -0.054
114 HE2 TYR 15 HE1 TYR 15 5.391 3.985 -1.967
115 HH TYR 15 HH TYR 15 7.305 3.867 -3.075
116 H ILE 16 H ILE 16 7.010 6.930 2.013
117 HA ILE 16 HA ILE 16 4.886 8.488 0.725
118 HB ILE 16 HB ILE 16 7.803 9.160 1.141
119 HG12 ILE 16 HG12 ILE 16 6.521 9.321 3.202
120 HG13 ILE 16 HG13 ILE 16 6.931 10.934 2.628
121 HG21 ILE 16 HG21 ILE 16 5.609 10.782 -0.151
122 HG22 ILE 16 HG22 ILE 16 7.023 10.099 -0.953
123 HG23 ILE 16 HG23 ILE 16 7.221 11.383 0.240
124 HD11 ILE 16 HD11 ILE 16 4.682 11.206 1.751
125 HD12 ILE 16 HD12 ILE 16 4.651 10.824 3.471
126 HD13 ILE 16 HD13 ILE 16 4.268 9.577 2.285
127 HA PRO 17 HA PRO 17 5.884 5.928 -2.832
128 HB2 PRO 17 HB3 PRO 17 4.113 7.982 -4.063
129 HB3 PRO 17 HB2 PRO 17 4.035 6.219 -4.164
130 HG2 PRO 17 HG2 PRO 17 2.319 7.536 -2.637
131 HG3 PRO 17 HG3 PRO 17 3.038 6.015 -2.070
132 HD2 PRO 17 HD2 PRO 17 3.723 8.833 -1.325
133 HD3 PRO 17 HD3 PRO 17 3.615 7.388 -0.297
134 H GLN 18 H GLN 18 7.460 6.113 -4.273
135 HA GLN 18 HA GLN 18 8.799 8.648 -4.591
136 HB2 GLN 18 HB2 GLN 18 9.476 6.027 -5.934
137 HB3 GLN 18 HB3 GLN 18 10.545 7.400 -5.660
138 HG2 GLN 18 HG2 GLN 18 10.305 7.019 -3.216
139 HG3 GLN 18 HG3 GLN 18 9.390 5.558 -3.578
140 HE21 GLN 18 HE22 GLN 18 11.854 5.822 -2.120
141 HE22 GLN 18 HE21 GLN 18 13.037 4.863 -2.956
142 H ASN 19 H ASN 19 6.765 6.502 -6.344
143 HA ASN 19 HA ASN 19 6.536 8.485 -8.513
144 HB2 ASN 19 HB2 ASN 19 6.061 5.514 -8.401
145 HB3 ASN 19 HB3 ASN 19 5.398 6.506 -9.697
146 HD21 ASN 19 HD22 ASN 19 7.341 4.307 -9.715
147 HD22 ASN 19 HD21 ASN 19 8.751 4.935 -10.501
148 H ASP 20 H ASP 20 4.463 9.265 -8.960
149 HA ASP 20 HA ASP 20 2.554 9.064 -6.817
150 HB2 ASP 20 HB2 ASP 20 1.225 10.656 -8.068
151 HB3 ASP 20 HB3 ASP 20 2.908 11.169 -8.087
152 H ASP 21 H ASP 21 3.294 7.111 -9.333
153 HA ASP 21 HA ASP 21 0.720 6.077 -10.009
154 HB2 ASP 21 HB2 ASP 21 2.991 5.788 -11.237
155 HB3 ASP 21 HB3 ASP 21 3.295 4.505 -10.073
156 H GLU 22 H GLU 22 2.689 5.970 -7.280
157 HA GLU 22 HA GLU 22 1.693 3.420 -6.280
158 HB2 GLU 22 HB2 GLU 22 3.689 5.423 -5.234
159 HB3 GLU 22 HB3 GLU 22 3.159 4.035 -4.298
160 HG2 GLU 22 HG2 GLU 22 4.212 2.528 -5.703
161 HG3 GLU 22 HG3 GLU 22 4.330 3.687 -7.026
162 H LEU 23 H LEU 23 1.007 3.397 -3.978
163 HA LEU 23 HA LEU 23 -0.935 5.544 -3.520
164 HB2 LEU 23 HB2 LEU 23 -1.561 3.027 -3.730
165 HB3 LEU 23 HB3 LEU 23 -0.912 2.889 -2.110
166 HG LEU 23 HG LEU 23 -3.454 3.204 -2.364
167 HD11 LEU 23 HD11 LEU 23 -3.582 4.597 -0.362
168 HD12 LEU 23 HD12 LEU 23 -1.886 5.035 -0.563
169 HD13 LEU 23 HD13 LEU 23 -2.331 3.363 -0.224
170 HD21 LEU 23 HD21 LEU 23 -3.345 4.996 -4.013
171 HD22 LEU 23 HD22 LEU 23 -2.539 6.032 -2.836
172 HD23 LEU 23 HD23 LEU 23 -4.206 5.518 -2.561
173 H GLU 24 H GLU 24 -0.907 6.723 -1.666
174 HA GLU 24 HA GLU 24 1.510 6.744 -0.145
175 HB2 GLU 24 HB2 GLU 24 -0.972 8.369 -0.216
176 HB3 GLU 24 HB3 GLU 24 -0.018 8.410 1.262
177 HG2 GLU 24 HG2 GLU 24 1.944 9.042 -0.048
178 HG3 GLU 24 HG3 GLU 24 0.942 9.085 -1.504
179 H LEU 25 H LEU 25 1.971 5.635 1.578
180 HA LEU 25 HA LEU 25 -0.230 4.261 2.961
181 HB2 LEU 25 HB2 LEU 25 2.720 3.668 3.062
182 HB3 LEU 25 HB3 LEU 25 1.456 2.729 3.818
183 HG LEU 25 HG LEU 25 1.691 3.105 0.836
184 HD11 LEU 25 HD11 LEU 25 2.608 0.811 2.562
185 HD12 LEU 25 HD12 LEU 25 3.642 1.924 1.664
186 HD13 LEU 25 HD13 LEU 25 2.574 0.821 0.797
187 HD21 LEU 25 HD21 LEU 25 0.077 1.185 2.513
188 HD22 LEU 25 HD22 LEU 25 0.134 1.226 0.752
189 HD23 LEU 25 HD23 LEU 25 -0.557 2.582 1.643
190 H ARG 26 H ARG 26 -0.535 4.503 5.124
191 HA ARG 26 HA ARG 26 1.295 6.261 6.584
192 HB2 ARG 26 HB2 ARG 26 -0.413 7.732 5.840
193 HB3 ARG 26 HB3 ARG 26 -1.690 6.608 6.267
194 HG2 ARG 26 HG2 ARG 26 -1.105 6.934 8.644
195 HG3 ARG 26 HG3 ARG 26 0.069 8.161 8.145
196 HD2 ARG 26 HD2 ARG 26 -1.719 9.428 7.060
197 HD3 ARG 26 HD3 ARG 26 -2.884 8.201 7.556
198 HE ARG 26 HE ARG 26 -2.468 8.879 9.861
199 HH11 ARG 26 HH11 ARG 26 -1.330 11.010 7.333
200 HH12 ARG 26 HH12 ARG 26 -1.440 12.447 8.313
201 HH21 ARG 26 HH22 ARG 26 -2.576 10.754 11.179
202 HH22 ARG 26 HH21 ARG 26 -2.138 12.293 10.501
203 H ASP 27 H ASP 27 1.494 5.791 8.688
204 HA ASP 27 HA ASP 27 1.110 3.178 9.532
205 HB2 ASP 27 HB2 ASP 27 2.740 4.615 10.598
206 HB3 ASP 27 HB3 ASP 27 1.475 5.669 11.203
207 H GLY 28 H GLY 28 -0.808 2.231 9.552
208 HA2 GLY 28 HA2 GLY 28 -2.654 1.618 10.894
209 HA3 GLY 28 HA3 GLY 28 -2.812 3.287 11.419
210 H ASP 29 H ASP 29 -2.370 3.614 8.221
211 HA ASP 29 HA ASP 29 -5.175 3.994 7.695
212 HB2 ASP 29 HB2 ASP 29 -3.479 5.498 6.699
213 HB3 ASP 29 HB3 ASP 29 -2.825 4.143 5.785
214 H ILE 30 H ILE 30 -6.451 2.850 6.197
215 HA ILE 30 HA ILE 30 -5.522 0.107 5.754
216 HB ILE 30 HB ILE 30 -8.276 1.305 5.908
217 HG12 ILE 30 HG12 ILE 30 -8.496 -0.719 7.495
218 HG13 ILE 30 HG13 ILE 30 -6.744 -0.783 7.423
219 HG21 ILE 30 HG21 ILE 30 -7.618 -1.468 4.932
220 HG22 ILE 30 HG22 ILE 30 -8.280 -0.153 3.962
221 HG23 ILE 30 HG23 ILE 30 -9.232 -0.848 5.275
222 HD11 ILE 30 HD11 ILE 30 -7.448 0.416 9.387
223 HD12 ILE 30 HD12 ILE 30 -8.414 1.520 8.403
224 HD13 ILE 30 HD13 ILE 30 -6.658 1.521 8.263
225 H VAL 31 H VAL 31 -5.401 -0.769 3.760
226 HA VAL 31 HA VAL 31 -6.307 0.862 1.488
227 HB VAL 31 HB VAL 31 -3.675 -0.617 1.681
228 HG11 VAL 31 HG11 VAL 31 -4.658 0.868 -0.736
229 HG12 VAL 31 HG12 VAL 31 -4.976 -0.852 -0.526
230 HG13 VAL 31 HG13 VAL 31 -3.312 -0.267 -0.610
231 HG21 VAL 31 HG21 VAL 31 -2.670 1.524 1.312
232 HG22 VAL 31 HG22 VAL 31 -3.813 1.684 2.645
233 HG23 VAL 31 HG23 VAL 31 -4.246 2.265 1.033
234 H ASP 32 H ASP 32 -7.705 -0.189 0.283
235 HA ASP 32 HA ASP 32 -8.059 -3.058 0.573
236 HB2 ASP 32 HB2 ASP 32 -9.507 -1.176 -1.300
237 HB3 ASP 32 HB3 ASP 32 -10.037 -2.768 -0.773
238 H VAL 33 H VAL 33 -6.937 -4.433 -0.656
239 HA VAL 33 HA VAL 33 -5.577 -3.397 -3.023
240 HB VAL 33 HB VAL 33 -4.106 -4.492 -1.526
241 HG11 VAL 33 HG11 VAL 33 -6.168 -6.656 -1.437
242 HG12 VAL 33 HG12 VAL 33 -5.399 -5.779 -0.107
243 HG13 VAL 33 HG13 VAL 33 -4.486 -6.981 -1.017
244 HG21 VAL 33 HG21 VAL 33 -4.707 -6.440 -3.742
245 HG22 VAL 33 HG22 VAL 33 -3.178 -6.266 -2.880
246 HG23 VAL 33 HG23 VAL 33 -3.766 -4.959 -3.911
247 H MET 34 H MET 34 -6.244 -3.817 -5.009
248 HA MET 34 HA MET 34 -8.392 -5.785 -5.331
249 HB2 MET 34 HB2 MET 34 -9.256 -4.518 -7.085
250 HB3 MET 34 HB3 MET 34 -8.706 -3.318 -5.935
251 HG2 MET 34 HG2 MET 34 -7.934 -2.413 -7.873
252 HG3 MET 34 HG3 MET 34 -6.529 -3.363 -7.391
253 HE1 MET 34 HE1 MET 34 -6.831 -2.290 -10.262
254 HE2 MET 34 HE2 MET 34 -6.533 -3.682 -11.303
255 HE3 MET 34 HE3 MET 34 -5.516 -3.408 -9.889
256 H GLU 35 H GLU 35 -5.184 -4.944 -6.390
257 HA GLU 35 HA GLU 35 -5.125 -7.437 -7.948
258 HB2 GLU 35 HB2 GLU 35 -5.188 -5.507 -9.488
259 HB3 GLU 35 HB3 GLU 35 -3.722 -4.890 -8.735
260 HG2 GLU 35 HG2 GLU 35 -3.205 -6.045 -10.803
261 HG3 GLU 35 HG3 GLU 35 -2.530 -6.894 -9.410
262 H LYS 36 H LYS 36 -3.253 -8.597 -7.870
263 HA LYS 36 HA LYS 36 -1.288 -7.694 -5.873
264 HB2 LYS 36 HB2 LYS 36 -2.437 -10.467 -6.217
265 HB3 LYS 36 HB3 LYS 36 -1.058 -10.085 -5.195
266 HG2 LYS 36 HG2 LYS 36 -2.457 -8.637 -3.823
267 HG3 LYS 36 HG3 LYS 36 -3.841 -8.979 -4.861
268 HD2 LYS 36 HD2 LYS 36 -2.342 -11.194 -3.510
269 HD3 LYS 36 HD3 LYS 36 -3.584 -10.290 -2.648
270 HE2 LYS 36 HE2 LYS 36 -4.534 -12.302 -3.592
271 HE3 LYS 36 HE3 LYS 36 -5.206 -10.891 -4.400
272 HZ1 LYS 36 HZ1 LYS 36 -2.986 -12.547 -5.482
273 HZ2 LYS 36 HZ2 LYS 36 -3.783 -11.275 -6.274
274 HZ3 LYS 36 HZ3 LYS 36 -4.615 -12.706 -5.931
275 H CYS 37 H CYS 37 0.564 -7.365 -6.862
276 HA CYS 37 HA CYS 37 1.245 -8.667 -9.328
277 HB2 CYS 37 HB2 CYS 37 3.078 -7.041 -7.561
278 HB3 CYS 37 HB3 CYS 37 3.212 -7.314 -9.296
279 HG CYS 37 HG CYS 37 1.600 -4.930 -7.664
280 H ASP 38 H ASP 38 2.857 -10.183 -9.639
281 HA ASP 38 HA ASP 38 3.255 -12.070 -7.553
282 HB2 ASP 38 HB2 ASP 38 4.539 -11.816 -10.283
283 HB3 ASP 38 HB3 ASP 38 4.759 -13.193 -9.210
284 H ASP 39 H ASP 39 4.819 -9.204 -8.402
285 HA ASP 39 HA ASP 39 7.448 -9.935 -7.478
286 HB2 ASP 39 HB2 ASP 39 7.047 -8.228 -9.243
287 HB3 ASP 39 HB3 ASP 39 6.299 -7.191 -8.034
288 H GLY 40 H GLY 40 4.538 -9.013 -5.921
289 HA2 GLY 40 HA2 GLY 40 4.589 -9.506 -3.521
290 HA3 GLY 40 HA3 GLY 40 6.141 -8.690 -3.452
291 H TRP 41 H TRP 41 5.139 -6.515 -5.228
292 HA TRP 41 HA TRP 41 3.797 -4.964 -3.175
293 HB2 TRP 41 HB2 TRP 41 4.359 -3.997 -5.971
294 HB3 TRP 41 HB3 TRP 41 4.222 -3.055 -4.493
295 HD1 TRP 41 HD1 TRP 41 6.730 -3.617 -6.787
296 HE1 TRP 41 HE1 TRP 41 9.087 -3.814 -5.787
297 HE3 TRP 41 HE3 TRP 41 5.494 -4.580 -1.887
298 HZ2 TRP 41 HZ2 TRP 41 10.272 -4.315 -3.290
299 HZ3 TRP 41 HZ3 TRP 41 7.316 -4.910 -0.279
300 HH2 TRP 41 HH2 TRP 41 9.651 -4.781 -0.963
301 H PHE 42 H PHE 42 1.700 -3.953 -3.529
302 HA PHE 42 HA PHE 42 0.062 -5.590 -5.339
303 HB2 PHE 42 HB2 PHE 42 -0.601 -4.662 -2.540
304 HB3 PHE 42 HB3 PHE 42 -1.686 -5.540 -3.605
305 HD1 PHE 42 HD1 PHE 42 0.436 -7.464 -4.720
306 HD2 PHE 42 HD2 PHE 42 -0.552 -6.217 -0.769
307 HE1 PHE 42 HE1 PHE 42 1.286 -9.596 -3.836
308 HE2 PHE 42 HE2 PHE 42 0.306 -8.344 0.119
309 HZ PHE 42 HZ PHE 42 1.225 -10.037 -1.414
310 H VAL 43 H VAL 43 -2.086 -4.602 -5.795
311 HA VAL 43 HA VAL 43 -1.847 -1.674 -6.048
312 HB VAL 43 HB VAL 43 -2.978 -3.765 -7.856
313 HG11 VAL 43 HG11 VAL 43 -3.969 -0.913 -7.852
314 HG12 VAL 43 HG12 VAL 43 -4.919 -2.303 -7.327
315 HG13 VAL 43 HG13 VAL 43 -4.393 -2.178 -9.005
316 HG21 VAL 43 HG21 VAL 43 -1.983 -2.286 -9.531
317 HG22 VAL 43 HG22 VAL 43 -0.818 -2.738 -8.281
318 HG23 VAL 43 HG23 VAL 43 -1.584 -1.149 -8.242
319 H GLY 44 H GLY 44 -3.316 -0.418 -5.062
320 HA2 GLY 44 HA2 GLY 44 -5.821 -1.552 -4.100
321 HA3 GLY 44 HA3 GLY 44 -4.628 -1.237 -2.853
322 H THR 45 H THR 45 -6.538 0.064 -2.165
323 HA THR 45 HA THR 45 -6.311 2.790 -3.228
324 HB THR 45 HB THR 45 -8.856 1.371 -2.469
325 HG1 THR 45 HG1 THR 45 -7.583 1.915 -4.881
326 HG21 THR 45 HG21 THR 45 -9.957 3.455 -3.335
327 HG22 THR 45 HG22 THR 45 -8.367 4.217 -3.317
328 HG23 THR 45 HG23 THR 45 -9.090 3.650 -1.813
329 H SER 46 H SER 46 -6.276 4.355 -1.715
330 HA SER 46 HA SER 46 -5.740 3.599 0.995
331 HB2 SER 46 HB2 SER 46 -4.571 5.490 -0.086
332 HB3 SER 46 HB3 SER 46 -6.102 6.345 -0.247
333 HG SER 46 HG SER 46 -4.907 5.553 2.225
334 H ARG 47 H ARG 47 -7.208 3.420 2.612
335 HA ARG 47 HA ARG 47 -9.969 4.035 2.201
336 HB2 ARG 47 HB2 ARG 47 -9.054 2.229 3.711
337 HB3 ARG 47 HB3 ARG 47 -8.580 3.496 4.831
338 HG2 ARG 47 HG2 ARG 47 -10.991 4.203 4.883
339 HG3 ARG 47 HG3 ARG 47 -11.356 2.722 3.991
340 HD2 ARG 47 HD2 ARG 47 -10.191 1.457 5.820
341 HD3 ARG 47 HD3 ARG 47 -10.117 2.971 6.716
342 HE ARG 47 HE ARG 47 -12.718 1.956 5.812
343 HH11 ARG 47 HH11 ARG 47 -10.521 2.803 8.405
344 HH12 ARG 47 HH12 ARG 47 -11.729 2.663 9.646
345 HH21 ARG 47 HH22 ARG 47 -14.311 1.760 7.449
346 HH22 ARG 47 HH21 ARG 47 -13.876 2.086 9.108
347 H ARG 48 H ARG 48 -7.236 5.680 3.505
348 HA ARG 48 HA ARG 48 -8.536 7.688 5.003
349 HB2 ARG 48 HB2 ARG 48 -6.286 7.329 5.492
350 HB3 ARG 48 HB3 ARG 48 -5.819 7.299 3.804
351 HG2 ARG 48 HG2 ARG 48 -6.216 9.742 3.702
352 HG3 ARG 48 HG3 ARG 48 -6.532 9.717 5.441
353 HD2 ARG 48 HD2 ARG 48 -4.337 9.053 5.940
354 HD3 ARG 48 HD3 ARG 48 -4.014 8.583 4.275
355 HE ARG 48 HE ARG 48 -4.444 11.408 4.977
356 HH11 ARG 48 HH11 ARG 48 -2.438 8.843 3.666
357 HH12 ARG 48 HH12 ARG 48 -1.227 9.936 3.060
358 HH21 ARG 48 HH22 ARG 48 -2.845 12.847 4.148
359 HH22 ARG 48 HH21 ARG 48 -1.473 12.197 3.299
360 H THR 49 H THR 49 -7.272 7.668 1.670
361 HA THR 49 HA THR 49 -8.645 10.241 1.259
362 HB THR 49 HB THR 49 -6.518 10.983 1.143
363 HG1 THR 49 HG1 THR 49 -5.732 10.504 -1.213
364 HG21 THR 49 HG21 THR 49 -4.567 9.678 0.459
365 HG22 THR 49 HG22 THR 49 -5.619 8.309 0.099
366 HG23 THR 49 HG23 THR 49 -5.468 8.895 1.757
367 H LYS 50 H LYS 50 -8.559 7.072 0.328
368 HA LYS 50 HA LYS 50 -9.557 5.848 -1.263
369 HB2 LYS 50 HB2 LYS 50 -11.097 8.363 -1.881
370 HB3 LYS 50 HB3 LYS 50 -11.515 6.748 -2.424
371 HG2 LYS 50 HG2 LYS 50 -11.680 7.914 0.327
372 HG3 LYS 50 HG3 LYS 50 -12.934 7.129 -0.626
373 HD2 LYS 50 HD2 LYS 50 -10.581 5.820 0.735
374 HD3 LYS 50 HD3 LYS 50 -12.283 5.661 1.162
375 HE2 LYS 50 HE2 LYS 50 -11.072 4.748 -1.444
376 HE3 LYS 50 HE3 LYS 50 -11.349 3.703 -0.056
377 HZ1 LYS 50 HZ1 LYS 50 -13.651 3.884 -0.278
378 HZ2 LYS 50 HZ2 LYS 50 -13.093 3.689 -1.868
379 HZ3 LYS 50 HZ3 LYS 50 -13.560 5.227 -1.313
380 H GLN 51 H GLN 51 -7.096 6.965 -1.946
381 HA GLN 51 HA GLN 51 -7.382 7.527 -4.799
382 HB2 GLN 51 HB2 GLN 51 -4.765 7.700 -4.527
383 HB3 GLN 51 HB3 GLN 51 -5.814 9.039 -4.086
384 HG2 GLN 51 HG2 GLN 51 -5.724 8.215 -1.733
385 HG3 GLN 51 HG3 GLN 51 -4.510 7.046 -2.256
386 HE21 GLN 51 HE22 GLN 51 -2.916 7.934 -0.948
387 HE22 GLN 51 HE21 GLN 51 -2.174 9.457 -1.296
388 H PHE 52 H PHE 52 -6.070 6.329 -6.318
389 HA PHE 52 HA PHE 52 -5.846 3.511 -5.484
390 HB2 PHE 52 HB2 PHE 52 -7.856 3.757 -6.746
391 HB3 PHE 52 HB3 PHE 52 -7.054 4.734 -7.964
392 HD1 PHE 52 HD2 PHE 52 -6.791 1.314 -6.469
393 HD2 PHE 52 HD1 PHE 52 -6.556 3.742 -9.957
394 HE1 PHE 52 HE2 PHE 52 -6.448 -0.694 -7.839
395 HE2 PHE 52 HE1 PHE 52 -6.209 1.734 -11.331
396 HZ PHE 52 HZ PHE 52 -6.155 -0.488 -10.274
397 H GLY 53 H GLY 53 -4.093 2.400 -6.121
398 HA2 GLY 53 HA2 GLY 53 -2.561 2.825 -8.413
399 HA3 GLY 53 HA3 GLY 53 -1.793 3.722 -7.107
400 H THR 54 H THR 54 0.011 2.367 -7.276
401 HA THR 54 HA THR 54 -0.406 -0.365 -6.288
402 HB THR 54 HB THR 54 0.848 -0.431 -8.291
403 HG1 THR 54 HG1 THR 54 3.124 -0.542 -6.814
404 HG21 THR 54 HG21 THR 54 3.088 0.917 -8.326
405 HG22 THR 54 HG22 THR 54 2.262 1.931 -7.137
406 HG23 THR 54 HG23 THR 54 1.569 1.712 -8.748
407 H PHE 55 H PHE 55 0.373 -0.971 -4.376
408 HA PHE 55 HA PHE 55 2.085 0.901 -2.924
409 HB2 PHE 55 HB2 PHE 55 0.793 0.741 -0.915
410 HB3 PHE 55 HB3 PHE 55 -0.312 1.182 -2.205
411 HD1 PHE 55 HD1 PHE 55 -1.596 -0.787 -3.319
412 HD2 PHE 55 HD2 PHE 55 0.280 -1.020 0.489
413 HE1 PHE 55 HE1 PHE 55 -3.027 -2.704 -2.736
414 HE2 PHE 55 HE2 PHE 55 -1.143 -2.939 1.079
415 HZ PHE 55 HZ PHE 55 -2.798 -3.785 -0.536
416 HA PRO 56 HA PRO 56 4.458 -2.737 -2.154
417 HB2 PRO 56 HB3 PRO 56 5.290 -1.295 0.292
418 HB3 PRO 56 HB2 PRO 56 6.275 -1.947 -1.021
419 HG2 PRO 56 HG2 PRO 56 5.873 0.687 -0.750
420 HG3 PRO 56 HG3 PRO 56 5.985 -0.075 -2.346
421 HD2 PRO 56 HD2 PRO 56 3.569 0.867 -0.857
422 HD3 PRO 56 HD3 PRO 56 3.920 0.926 -2.597
423 H GLY 57 H GLY 57 3.231 -4.416 -1.518
424 HA2 GLY 57 HA2 GLY 57 1.443 -4.425 0.684
425 HA3 GLY 57 HA3 GLY 57 2.007 -5.837 -0.193
426 H ASN 58 H ASN 58 4.616 -4.148 0.826
427 HA ASN 58 HA ASN 58 5.324 -6.079 2.826
428 HB2 ASN 58 HB2 ASN 58 6.913 -5.203 1.123
429 HB3 ASN 58 HB3 ASN 58 6.764 -3.604 1.841
430 HD21 ASN 58 HD22 ASN 58 8.951 -3.498 2.278
431 HD22 ASN 58 HD21 ASN 58 9.683 -4.397 3.564
432 H TYR 59 H TYR 59 3.986 -2.880 2.749
433 HA TYR 59 HA TYR 59 4.692 -2.443 5.579
434 HB2 TYR 59 HB2 TYR 59 3.687 -0.413 3.576
435 HB3 TYR 59 HB3 TYR 59 4.267 -0.080 5.202
436 HD1 TYR 59 HD2 TYR 59 6.766 -0.767 5.675
437 HD2 TYR 59 HD1 TYR 59 5.105 -0.238 1.796
438 HE1 TYR 59 HE2 TYR 59 9.027 -0.460 4.752
439 HE2 TYR 59 HE1 TYR 59 7.347 0.080 0.867
440 HH TYR 59 HH TYR 59 9.528 0.403 1.351
441 H VAL 60 H VAL 60 2.473 -4.136 4.616
442 HA VAL 60 HA VAL 60 0.347 -2.815 6.094
443 HB VAL 60 HB VAL 60 -1.379 -3.478 4.413
444 HG11 VAL 60 HG11 VAL 60 0.659 -1.599 3.226
445 HG12 VAL 60 HG12 VAL 60 -0.404 -1.161 4.563
446 HG13 VAL 60 HG13 VAL 60 -1.088 -1.583 2.988
447 HG21 VAL 60 HG21 VAL 60 1.046 -4.080 2.728
448 HG22 VAL 60 HG22 VAL 60 -0.585 -3.880 2.082
449 HG23 VAL 60 HG23 VAL 60 -0.244 -5.187 3.211
450 H LYS 61 H LYS 61 -1.315 -4.304 6.783
451 HA LYS 61 HA LYS 61 -0.208 -7.013 7.097
452 HB2 LYS 61 HB2 LYS 61 -1.160 -7.019 9.330
453 HB3 LYS 61 HB3 LYS 61 -0.089 -5.642 9.116
454 HG2 LYS 61 HG2 LYS 61 -2.520 -4.610 8.399
455 HG3 LYS 61 HG3 LYS 61 -2.946 -5.731 9.684
456 HD2 LYS 61 HD2 LYS 61 -1.091 -3.370 9.806
457 HD3 LYS 61 HD3 LYS 61 -2.566 -3.649 10.732
458 HE2 LYS 61 HE2 LYS 61 -1.380 -5.626 11.768
459 HE3 LYS 61 HE3 LYS 61 0.098 -5.021 11.001
460 HZ1 LYS 61 HZ1 LYS 61 -0.291 -2.889 12.185
461 HZ2 LYS 61 HZ2 LYS 61 -0.005 -4.198 13.233
462 HZ3 LYS 61 HZ3 LYS 61 -1.580 -3.615 13.017
463 HA PRO 62 HA PRO 62 -3.944 -8.505 5.190
464 HB2 PRO 62 HB3 PRO 62 -3.403 -10.959 6.733
465 HB3 PRO 62 HB2 PRO 62 -3.542 -10.738 4.990
466 HG2 PRO 62 HG2 PRO 62 -1.173 -11.190 6.154
467 HG3 PRO 62 HG3 PRO 62 -1.329 -10.102 4.763
468 HD2 PRO 62 HD2 PRO 62 -1.038 -9.440 7.662
469 HD3 PRO 62 HD3 PRO 62 -0.314 -8.652 6.245
470 H LEU 63 H LEU 63 -5.999 -8.257 5.817
471 HA LEU 63 HA LEU 63 -6.595 -8.424 8.688
472 HB2 LEU 63 HB2 LEU 63 -8.094 -7.015 6.475
473 HB3 LEU 63 HB3 LEU 63 -8.580 -7.045 8.158
474 HG LEU 63 HG LEU 63 -6.083 -5.759 7.056
475 HD11 LEU 63 HD11 LEU 63 -8.512 -4.506 8.318
476 HD12 LEU 63 HD12 LEU 63 -8.237 -4.621 6.580
477 HD13 LEU 63 HD13 LEU 63 -7.134 -3.679 7.585
478 HD21 LEU 63 HD21 LEU 63 -5.762 -4.912 9.330
479 HD22 LEU 63 HD22 LEU 63 -5.687 -6.673 9.280
480 HD23 LEU 63 HD23 LEU 63 -7.138 -5.868 9.879
481 H TYR 64 H TYR 64 -9.336 -8.620 8.552
482 HA TYR 64 HA TYR 64 -9.668 -11.409 8.449
483 HB2 TYR 64 HB2 TYR 64 -12.045 -9.606 8.274
484 HB3 TYR 64 HB3 TYR 64 -11.796 -11.032 9.277
485 HD1 TYR 64 HD2 TYR 64 -10.490 -10.849 11.382
486 HD2 TYR 64 HD1 TYR 64 -11.435 -7.431 9.034
487 HE1 TYR 64 HE2 TYR 64 -9.941 -9.391 13.289
488 HE2 TYR 64 HE1 TYR 64 -10.893 -5.969 10.929
489 HH TYR 64 HH TYR 64 -9.351 -7.139 13.792
490 H LEU 65 H LEU 65 -10.742 -8.831 6.315
491 HA LEU 65 HA LEU 65 -10.865 -10.744 4.126
492 HB2 LEU 65 HB2 LEU 65 -12.942 -9.687 3.261
493 HB3 LEU 65 HB3 LEU 65 -13.170 -10.589 4.742
494 HG LEU 65 HG LEU 65 -12.823 -7.601 4.811
495 HD11 LEU 65 HD11 LEU 65 -14.623 -8.044 3.227
496 HD12 LEU 65 HD12 LEU 65 -15.261 -7.388 4.735
497 HD13 LEU 65 HD13 LEU 65 -15.401 -9.113 4.396
498 HD21 LEU 65 HD21 LEU 65 -12.683 -8.789 6.934
499 HD22 LEU 65 HD22 LEU 65 -14.229 -9.576 6.612
500 HD23 LEU 65 HD23 LEU 65 -14.162 -7.830 6.858
Start of MODEL 13
1 H1 GLN 1 H1 GLN 1 -12.146 -6.961 -11.516
2 H2 GLN 1 H2 GLN 1 -13.139 -7.645 -10.320
3 H3 GLN 1 H3 GLN 1 -11.776 -6.746 -9.877
4 HA GLN 1 HA GLN 1 -12.772 -4.766 -10.900
5 HB2 GLN 1 HB2 GLN 1 -14.244 -6.135 -12.420
6 HB3 GLN 1 HB3 GLN 1 -15.250 -6.496 -11.026
7 HG2 GLN 1 HG2 GLN 1 -15.603 -4.038 -10.747
8 HG3 GLN 1 HG3 GLN 1 -14.768 -3.810 -12.282
9 HE21 GLN 1 HE22 GLN 1 -16.911 -6.481 -11.538
10 HE22 GLN 1 HE21 GLN 1 -18.150 -6.043 -12.674
11 H THR 2 H THR 2 -14.058 -3.350 -9.576
12 HA THR 2 HA THR 2 -15.155 -2.610 -7.735
13 HB THR 2 HB THR 2 -15.553 -5.505 -6.965
14 HG1 THR 2 HG1 THR 2 -17.712 -4.178 -8.004
15 HG21 THR 2 HG21 THR 2 -17.021 -2.992 -6.142
16 HG22 THR 2 HG22 THR 2 -15.928 -3.931 -5.125
17 HG23 THR 2 HG23 THR 2 -17.451 -4.636 -5.667
18 H SER 3 H SER 3 -13.158 -1.734 -7.010
19 HA SER 3 HA SER 3 -11.834 -3.160 -4.843
20 HB2 SER 3 HB2 SER 3 -10.541 -0.909 -4.727
21 HB3 SER 3 HB3 SER 3 -10.277 -1.944 -6.130
22 HG SER 3 HG SER 3 -11.317 0.571 -5.994
23 H GLN 4 H GLN 4 -12.222 -2.777 -2.718
24 HA GLN 4 HA GLN 4 -13.691 -0.627 -1.650
25 HB2 GLN 4 HB2 GLN 4 -15.592 -1.335 -2.882
26 HB3 GLN 4 HB3 GLN 4 -15.275 -3.030 -2.549
27 HG2 GLN 4 HG2 GLN 4 -17.175 -2.330 -1.295
28 HG3 GLN 4 HG3 GLN 4 -15.833 -2.658 -0.197
29 HE21 GLN 4 HE22 GLN 4 -18.265 -1.032 0.108
30 HE22 GLN 4 HE21 GLN 4 -17.716 0.549 0.557
31 H ASP 5 H ASP 5 -14.478 -3.984 -0.940
32 HA ASP 5 HA ASP 5 -12.391 -4.062 1.126
33 HB2 ASP 5 HB2 ASP 5 -13.883 -4.951 2.784
34 HB3 ASP 5 HB3 ASP 5 -14.576 -3.466 2.157
35 H LEU 6 H LEU 6 -12.373 -5.114 -1.425
36 HA LEU 6 HA LEU 6 -13.059 -7.839 -1.628
37 HB2 LEU 6 HB2 LEU 6 -12.459 -6.514 -3.573
38 HB3 LEU 6 HB3 LEU 6 -10.841 -6.267 -2.947
39 HG LEU 6 HG LEU 6 -10.350 -8.649 -3.229
40 HD11 LEU 6 HD11 LEU 6 -13.139 -8.825 -4.368
41 HD12 LEU 6 HD12 LEU 6 -12.580 -9.558 -2.864
42 HD13 LEU 6 HD13 LEU 6 -11.929 -10.108 -4.408
43 HD21 LEU 6 HD21 LEU 6 -10.323 -8.693 -5.665
44 HD22 LEU 6 HD22 LEU 6 -9.896 -7.092 -5.060
45 HD23 LEU 6 HD23 LEU 6 -11.508 -7.386 -5.713
46 H PHE 7 H PHE 7 -10.123 -6.205 -0.548
47 HA PHE 7 HA PHE 7 -9.677 -8.151 1.471
48 HB2 PHE 7 HB2 PHE 7 -8.606 -9.013 -0.872
49 HB3 PHE 7 HB3 PHE 7 -7.269 -8.029 -0.263
50 HD1 PHE 7 HD2 PHE 7 -6.544 -8.483 2.179
51 HD2 PHE 7 HD1 PHE 7 -8.864 -11.190 -0.141
52 HE1 PHE 7 HE2 PHE 7 -5.897 -10.319 3.683
53 HE2 PHE 7 HE1 PHE 7 -8.224 -13.031 1.360
54 HZ PHE 7 HZ PHE 7 -6.739 -12.597 3.275
55 H SER 8 H SER 8 -9.174 -6.817 3.067
56 HA SER 8 HA SER 8 -7.871 -4.291 2.312
57 HB2 SER 8 HB2 SER 8 -10.157 -4.089 3.167
58 HB3 SER 8 HB3 SER 8 -9.693 -4.925 4.647
59 HG SER 8 HG SER 8 -8.454 -2.542 3.775
60 H TYR 9 H TYR 9 -6.035 -3.642 3.215
61 HA TYR 9 HA TYR 9 -5.059 -5.101 5.582
62 HB2 TYR 9 HB2 TYR 9 -3.341 -3.733 3.494
63 HB3 TYR 9 HB3 TYR 9 -2.773 -4.629 4.891
64 HD1 TYR 9 HD2 TYR 9 -4.517 -7.039 4.747
65 HD2 TYR 9 HD1 TYR 9 -2.468 -4.903 1.707
66 HE1 TYR 9 HE2 TYR 9 -4.417 -9.083 3.391
67 HE2 TYR 9 HE1 TYR 9 -2.369 -6.936 0.327
68 HH TYR 9 HH TYR 9 -2.423 -9.445 0.730
69 H GLN 10 H GLN 10 -3.880 -3.883 7.096
70 HA GLN 10 HA GLN 10 -4.356 -0.977 6.966
71 HB2 GLN 10 HB2 GLN 10 -5.583 -1.780 8.812
72 HB3 GLN 10 HB3 GLN 10 -4.314 -2.898 9.285
73 HG2 GLN 10 HG2 GLN 10 -3.042 -1.244 10.271
74 HG3 GLN 10 HG3 GLN 10 -3.826 0.043 9.364
75 HE21 GLN 10 HE22 GLN 10 -5.745 0.903 10.120
76 HE22 GLN 10 HE21 GLN 10 -6.388 0.532 11.682
77 H ALA 11 H ALA 11 -2.598 0.345 7.230
78 HA ALA 11 HA ALA 11 -0.127 -0.811 6.465
79 HB1 ALA 11 HB1 ALA 11 0.705 1.528 6.615
80 HB2 ALA 11 HB2 ALA 11 -0.874 1.988 7.267
81 HB3 ALA 11 HB3 ALA 11 -0.746 1.334 5.632
82 H LEU 12 H LEU 12 1.693 -1.170 7.513
83 HA LEU 12 HA LEU 12 1.662 -1.338 10.403
84 HB2 LEU 12 HB2 LEU 12 3.622 -2.159 8.267
85 HB3 LEU 12 HB3 LEU 12 4.002 -2.280 9.972
86 HG LEU 12 HG LEU 12 1.488 -3.573 9.118
87 HD11 LEU 12 HD11 LEU 12 4.205 -4.532 8.256
88 HD12 LEU 12 HD12 LEU 12 2.777 -4.250 7.256
89 HD13 LEU 12 HD13 LEU 12 2.804 -5.594 8.398
90 HD21 LEU 12 HD21 LEU 12 3.796 -4.381 10.885
91 HD22 LEU 12 HD22 LEU 12 2.290 -5.280 10.693
92 HD23 LEU 12 HD23 LEU 12 2.273 -3.674 11.422
93 H TYR 13 H TYR 13 3.146 0.553 7.879
94 HA TYR 13 HA TYR 13 4.237 2.424 9.840
95 HB2 TYR 13 HB2 TYR 13 5.900 1.312 7.564
96 HB3 TYR 13 HB3 TYR 13 6.417 2.500 8.749
97 HD1 TYR 13 HD2 TYR 13 6.643 1.747 11.173
98 HD2 TYR 13 HD1 TYR 13 6.197 -0.981 7.938
99 HE1 TYR 13 HE2 TYR 13 7.563 -0.059 12.571
100 HE2 TYR 13 HE1 TYR 13 7.114 -2.789 9.324
101 HH TYR 13 HH TYR 13 8.562 -3.049 11.293
102 H SER 14 H SER 14 4.943 4.456 8.727
103 HA SER 14 HA SER 14 3.221 5.046 6.466
104 HB2 SER 14 HB2 SER 14 5.131 6.820 8.013
105 HB3 SER 14 HB3 SER 14 4.010 7.368 6.766
106 HG SER 14 HG SER 14 3.552 6.958 9.367
107 H TYR 15 H TYR 15 3.919 5.371 4.394
108 HA TYR 15 HA TYR 15 6.807 5.286 3.869
109 HB2 TYR 15 HB2 TYR 15 5.707 2.967 3.706
110 HB3 TYR 15 HB3 TYR 15 4.890 3.591 2.283
111 HD1 TYR 15 HD2 TYR 15 8.313 3.216 3.709
112 HD2 TYR 15 HD1 TYR 15 5.906 3.385 0.208
113 HE1 TYR 15 HE2 TYR 15 10.276 2.643 2.344
114 HE2 TYR 15 HE1 TYR 15 7.859 2.804 -1.171
115 HH TYR 15 HH TYR 15 10.742 1.612 0.146
116 H ILE 16 H ILE 16 7.425 6.597 2.308
117 HA ILE 16 HA ILE 16 5.374 8.186 0.971
118 HB ILE 16 HB ILE 16 8.370 8.535 1.148
119 HG12 ILE 16 HG12 ILE 16 7.266 8.923 3.279
120 HG13 ILE 16 HG13 ILE 16 7.813 10.453 2.603
121 HG21 ILE 16 HG21 ILE 16 7.969 10.783 0.202
122 HG22 ILE 16 HG22 ILE 16 6.284 10.341 -0.075
123 HG23 ILE 16 HG23 ILE 16 7.571 9.489 -0.927
124 HD11 ILE 16 HD11 ILE 16 5.549 10.950 1.867
125 HD12 ILE 16 HD12 ILE 16 5.602 10.641 3.603
126 HD13 ILE 16 HD13 ILE 16 4.995 9.402 2.505
127 HA PRO 17 HA PRO 17 5.795 5.483 -2.564
128 HB2 PRO 17 HB3 PRO 17 4.279 7.682 -3.858
129 HB3 PRO 17 HB2 PRO 17 3.900 5.959 -3.759
130 HG2 PRO 17 HG2 PRO 17 2.555 7.733 -2.302
131 HG3 PRO 17 HG3 PRO 17 2.991 6.146 -1.635
132 HD2 PRO 17 HD2 PRO 17 4.265 8.815 -1.172
133 HD3 PRO 17 HD3 PRO 17 3.924 7.512 -0.015
134 H GLN 18 H GLN 18 7.256 5.369 -4.122
135 HA GLN 18 HA GLN 18 9.078 7.548 -4.511
136 HB2 GLN 18 HB2 GLN 18 8.965 4.901 -5.960
137 HB3 GLN 18 HB3 GLN 18 10.338 5.993 -5.888
138 HG2 GLN 18 HG2 GLN 18 9.148 4.577 -3.516
139 HG3 GLN 18 HG3 GLN 18 10.557 4.025 -4.417
140 HE21 GLN 18 HE22 GLN 18 11.879 4.137 -2.613
141 HE22 GLN 18 HE21 GLN 18 12.421 5.646 -1.949
142 H ASN 19 H ASN 19 6.504 6.024 -6.218
143 HA ASN 19 HA ASN 19 6.640 8.127 -8.283
144 HB2 ASN 19 HB2 ASN 19 5.544 5.323 -8.316
145 HB3 ASN 19 HB3 ASN 19 5.105 6.509 -9.543
146 HD21 ASN 19 HD22 ASN 19 6.517 3.961 -9.782
147 HD22 ASN 19 HD21 ASN 19 8.041 4.326 -10.520
148 H ASP 20 H ASP 20 4.809 9.362 -8.606
149 HA ASP 20 HA ASP 20 2.968 9.523 -6.415
150 HB2 ASP 20 HB2 ASP 20 1.971 11.396 -7.593
151 HB3 ASP 20 HB3 ASP 20 3.725 11.532 -7.664
152 H ASP 21 H ASP 21 3.135 7.586 -9.077
153 HA ASP 21 HA ASP 21 0.316 7.240 -9.578
154 HB2 ASP 21 HB2 ASP 21 2.592 5.396 -10.322
155 HB3 ASP 21 HB3 ASP 21 1.011 5.501 -11.088
156 H GLU 22 H GLU 22 2.363 6.445 -7.134
157 HA GLU 22 HA GLU 22 1.182 3.857 -6.502
158 HB2 GLU 22 HB2 GLU 22 3.448 5.444 -5.311
159 HB3 GLU 22 HB3 GLU 22 2.805 4.004 -4.537
160 HG2 GLU 22 HG2 GLU 22 3.411 2.658 -6.432
161 HG3 GLU 22 HG3 GLU 22 3.940 4.082 -7.320
162 H LEU 23 H LEU 23 0.851 3.608 -4.016
163 HA LEU 23 HA LEU 23 -1.094 5.671 -3.257
164 HB2 LEU 23 HB2 LEU 23 -1.580 3.083 -3.552
165 HB3 LEU 23 HB3 LEU 23 -0.929 2.995 -1.929
166 HG LEU 23 HG LEU 23 -3.441 3.142 -2.083
167 HD11 LEU 23 HD11 LEU 23 -2.293 3.691 -0.019
168 HD12 LEU 23 HD12 LEU 23 -3.671 4.759 -0.278
169 HD13 LEU 23 HD13 LEU 23 -2.038 5.341 -0.586
170 HD21 LEU 23 HD21 LEU 23 -3.675 4.651 -3.903
171 HD22 LEU 23 HD22 LEU 23 -2.747 5.893 -3.061
172 HD23 LEU 23 HD23 LEU 23 -4.340 5.431 -2.467
173 H GLU 24 H GLU 24 -0.948 6.719 -1.356
174 HA GLU 24 HA GLU 24 1.600 6.740 -0.052
175 HB2 GLU 24 HB2 GLU 24 -0.784 8.411 -0.111
176 HB3 GLU 24 HB3 GLU 24 -0.124 8.251 1.512
177 HG2 GLU 24 HG2 GLU 24 2.082 8.929 0.620
178 HG3 GLU 24 HG3 GLU 24 1.306 9.224 -0.940
179 H LEU 25 H LEU 25 2.181 5.414 1.505
180 HA LEU 25 HA LEU 25 0.119 4.044 3.052
181 HB2 LEU 25 HB2 LEU 25 3.101 3.618 2.890
182 HB3 LEU 25 HB3 LEU 25 1.999 2.640 3.840
183 HG LEU 25 HG LEU 25 1.917 2.904 0.831
184 HD11 LEU 25 HD11 LEU 25 2.900 0.642 2.556
185 HD12 LEU 25 HD12 LEU 25 3.906 1.714 1.585
186 HD13 LEU 25 HD13 LEU 25 2.766 0.622 0.799
187 HD21 LEU 25 HD21 LEU 25 0.335 1.044 0.946
188 HD22 LEU 25 HD22 LEU 25 -0.271 2.458 1.808
189 HD23 LEU 25 HD23 LEU 25 0.398 1.096 2.707
190 H ARG 26 H ARG 26 -0.252 4.492 5.139
191 HA ARG 26 HA ARG 26 1.719 6.074 6.605
192 HB2 ARG 26 HB2 ARG 26 -0.265 7.406 5.505
193 HB3 ARG 26 HB3 ARG 26 -1.171 6.786 6.874
194 HG2 ARG 26 HG2 ARG 26 0.279 7.883 8.415
195 HG3 ARG 26 HG3 ARG 26 1.402 8.323 7.124
196 HD2 ARG 26 HD2 ARG 26 -0.632 9.526 6.091
197 HD3 ARG 26 HD3 ARG 26 -1.330 9.401 7.704
198 HE ARG 26 HE ARG 26 0.612 10.689 8.502
199 HH11 ARG 26 HH11 ARG 26 -0.161 10.730 5.093
200 HH12 ARG 26 HH12 ARG 26 0.578 12.279 4.805
201 HH21 ARG 26 HH22 ARG 26 1.590 12.732 8.145
202 HH22 ARG 26 HH21 ARG 26 1.565 13.426 6.546
203 H ASP 27 H ASP 27 1.773 5.661 8.734
204 HA ASP 27 HA ASP 27 1.149 3.136 9.642
205 HB2 ASP 27 HB2 ASP 27 2.802 4.459 10.761
206 HB3 ASP 27 HB3 ASP 27 1.612 5.679 11.197
207 H GLY 28 H GLY 28 -0.808 2.274 9.665
208 HA2 GLY 28 HA2 GLY 28 -2.744 1.856 10.965
209 HA3 GLY 28 HA3 GLY 28 -2.836 3.568 11.344
210 H ASP 29 H ASP 29 -2.269 3.759 8.181
211 HA ASP 29 HA ASP 29 -5.035 4.215 7.579
212 HB2 ASP 29 HB2 ASP 29 -3.169 5.553 6.577
213 HB3 ASP 29 HB3 ASP 29 -2.726 4.141 5.624
214 H ILE 30 H ILE 30 -6.309 3.150 6.001
215 HA ILE 30 HA ILE 30 -5.598 0.312 5.756
216 HB ILE 30 HB ILE 30 -8.280 1.667 5.902
217 HG12 ILE 30 HG12 ILE 30 -8.413 -0.260 7.694
218 HG13 ILE 30 HG13 ILE 30 -6.665 -0.136 7.621
219 HG21 ILE 30 HG21 ILE 30 -7.751 -1.232 5.294
220 HG22 ILE 30 HG22 ILE 30 -8.372 -0.040 4.159
221 HG23 ILE 30 HG23 ILE 30 -9.329 -0.493 5.568
222 HD11 ILE 30 HD11 ILE 30 -7.431 1.230 9.412
223 HD12 ILE 30 HD12 ILE 30 -8.624 2.012 8.375
224 HD13 ILE 30 HD13 ILE 30 -6.908 2.290 8.105
225 H VAL 31 H VAL 31 -5.518 -0.651 3.855
226 HA VAL 31 HA VAL 31 -6.456 0.816 1.482
227 HB VAL 31 HB VAL 31 -3.790 -0.562 1.804
228 HG11 VAL 31 HG11 VAL 31 -3.418 -0.135 -0.586
229 HG12 VAL 31 HG12 VAL 31 -5.085 0.420 -0.742
230 HG13 VAL 31 HG13 VAL 31 -4.750 -1.261 -0.324
231 HG21 VAL 31 HG21 VAL 31 -2.862 1.563 1.168
232 HG22 VAL 31 HG22 VAL 31 -3.982 1.807 2.510
233 HG23 VAL 31 HG23 VAL 31 -4.474 2.212 0.863
234 H ASP 32 H ASP 32 -7.754 -0.336 0.230
235 HA ASP 32 HA ASP 32 -8.013 -3.218 0.618
236 HB2 ASP 32 HB2 ASP 32 -10.069 -1.880 0.378
237 HB3 ASP 32 HB3 ASP 32 -9.514 -1.332 -1.204
238 H VAL 33 H VAL 33 -6.918 -4.613 -0.597
239 HA VAL 33 HA VAL 33 -5.568 -3.589 -2.975
240 HB VAL 33 HB VAL 33 -4.137 -4.765 -1.437
241 HG11 VAL 33 HG11 VAL 33 -6.253 -6.826 -1.464
242 HG12 VAL 33 HG12 VAL 33 -5.268 -6.207 -0.128
243 HG13 VAL 33 HG13 VAL 33 -4.579 -7.351 -1.281
244 HG21 VAL 33 HG21 VAL 33 -4.641 -6.546 -3.811
245 HG22 VAL 33 HG22 VAL 33 -3.143 -6.416 -2.890
246 HG23 VAL 33 HG23 VAL 33 -3.711 -5.047 -3.851
247 H MET 34 H MET 34 -6.245 -3.955 -4.918
248 HA MET 34 HA MET 34 -8.452 -5.834 -5.323
249 HB2 MET 34 HB2 MET 34 -8.903 -4.612 -7.383
250 HB3 MET 34 HB3 MET 34 -8.829 -3.516 -6.008
251 HG2 MET 34 HG2 MET 34 -6.929 -2.506 -6.731
252 HG3 MET 34 HG3 MET 34 -6.341 -3.950 -7.542
253 HE1 MET 34 HE1 MET 34 -7.949 -3.958 -10.954
254 HE2 MET 34 HE2 MET 34 -8.379 -4.925 -9.542
255 HE3 MET 34 HE3 MET 34 -6.681 -4.578 -9.885
256 H GLU 35 H GLU 35 -5.223 -5.053 -6.451
257 HA GLU 35 HA GLU 35 -5.178 -7.601 -7.899
258 HB2 GLU 35 HB2 GLU 35 -5.272 -6.332 -9.772
259 HB3 GLU 35 HB3 GLU 35 -4.713 -4.890 -8.950
260 HG2 GLU 35 HG2 GLU 35 -2.443 -5.587 -9.116
261 HG3 GLU 35 HG3 GLU 35 -2.927 -7.173 -9.712
262 H LYS 36 H LYS 36 -3.124 -8.538 -8.117
263 HA LYS 36 HA LYS 36 -1.165 -7.574 -6.143
264 HB2 LYS 36 HB2 LYS 36 -2.087 -10.409 -6.606
265 HB3 LYS 36 HB3 LYS 36 -0.690 -9.976 -5.635
266 HG2 LYS 36 HG2 LYS 36 -2.115 -8.764 -4.089
267 HG3 LYS 36 HG3 LYS 36 -3.529 -9.140 -5.080
268 HD2 LYS 36 HD2 LYS 36 -3.182 -11.516 -4.697
269 HD3 LYS 36 HD3 LYS 36 -1.733 -11.167 -3.755
270 HE2 LYS 36 HE2 LYS 36 -3.061 -10.006 -2.093
271 HE3 LYS 36 HE3 LYS 36 -4.518 -10.253 -3.059
272 HZ1 LYS 36 HZ1 LYS 36 -2.862 -12.422 -1.883
273 HZ2 LYS 36 HZ2 LYS 36 -4.306 -12.626 -2.751
274 HZ3 LYS 36 HZ3 LYS 36 -4.321 -11.855 -1.239
275 H CYS 37 H CYS 37 0.795 -7.275 -6.988
276 HA CYS 37 HA CYS 37 1.550 -8.633 -9.441
277 HB2 CYS 37 HB2 CYS 37 3.264 -6.879 -7.669
278 HB3 CYS 37 HB3 CYS 37 3.580 -7.339 -9.340
279 HG CYS 37 HG CYS 37 1.312 -5.904 -10.326
280 H ASP 38 H ASP 38 2.728 -10.446 -9.509
281 HA ASP 38 HA ASP 38 3.138 -11.994 -7.193
282 HB2 ASP 38 HB2 ASP 38 4.234 -13.592 -8.657
283 HB3 ASP 38 HB3 ASP 38 2.805 -12.941 -9.453
284 H ASP 39 H ASP 39 4.855 -9.354 -8.190
285 HA ASP 39 HA ASP 39 7.449 -10.309 -7.307
286 HB2 ASP 39 HB2 ASP 39 7.162 -8.713 -9.238
287 HB3 ASP 39 HB3 ASP 39 6.673 -7.491 -8.070
288 H GLY 40 H GLY 40 4.649 -8.895 -5.895
289 HA2 GLY 40 HA2 GLY 40 4.762 -9.310 -3.431
290 HA3 GLY 40 HA3 GLY 40 6.282 -8.436 -3.462
291 H TRP 41 H TRP 41 5.098 -6.503 -5.441
292 HA TRP 41 HA TRP 41 3.841 -4.792 -3.457
293 HB2 TRP 41 HB2 TRP 41 4.319 -4.047 -6.335
294 HB3 TRP 41 HB3 TRP 41 4.235 -2.993 -4.930
295 HD1 TRP 41 HD1 TRP 41 6.657 -3.645 -7.237
296 HE1 TRP 41 HE1 TRP 41 9.053 -3.830 -6.325
297 HE3 TRP 41 HE3 TRP 41 5.596 -4.477 -2.273
298 HZ2 TRP 41 HZ2 TRP 41 10.321 -4.266 -3.854
299 HZ3 TRP 41 HZ3 TRP 41 7.471 -4.766 -0.722
300 HH2 TRP 41 HH2 TRP 41 9.786 -4.664 -1.491
301 H PHE 42 H PHE 42 1.740 -3.803 -3.827
302 HA PHE 42 HA PHE 42 0.035 -5.532 -5.481
303 HB2 PHE 42 HB2 PHE 42 -0.514 -4.536 -2.679
304 HB3 PHE 42 HB3 PHE 42 -1.625 -5.462 -3.668
305 HD1 PHE 42 HD1 PHE 42 0.457 -7.408 -4.815
306 HD2 PHE 42 HD2 PHE 42 -0.335 -6.015 -0.865
307 HE1 PHE 42 HE1 PHE 42 1.381 -9.492 -3.895
308 HE2 PHE 42 HE2 PHE 42 0.599 -8.096 0.057
309 HZ PHE 42 HZ PHE 42 1.458 -9.836 -1.458
310 H VAL 43 H VAL 43 -2.140 -4.586 -5.872
311 HA VAL 43 HA VAL 43 -1.971 -1.660 -6.142
312 HB VAL 43 HB VAL 43 -3.150 -3.756 -7.920
313 HG11 VAL 43 HG11 VAL 43 -4.073 -0.883 -7.931
314 HG12 VAL 43 HG12 VAL 43 -5.040 -2.225 -7.325
315 HG13 VAL 43 HG13 VAL 43 -4.583 -2.167 -9.028
316 HG21 VAL 43 HG21 VAL 43 -2.135 -2.358 -9.620
317 HG22 VAL 43 HG22 VAL 43 -0.962 -2.712 -8.345
318 HG23 VAL 43 HG23 VAL 43 -1.777 -1.146 -8.389
319 H GLY 44 H GLY 44 -3.465 -0.426 -5.194
320 HA2 GLY 44 HA2 GLY 44 -5.871 -1.624 -4.055
321 HA3 GLY 44 HA3 GLY 44 -4.633 -1.168 -2.896
322 H THR 45 H THR 45 -6.779 0.033 -2.351
323 HA THR 45 HA THR 45 -6.414 2.780 -3.329
324 HB THR 45 HB THR 45 -9.035 1.402 -2.758
325 HG1 THR 45 HG1 THR 45 -7.602 1.953 -5.024
326 HG21 THR 45 HG21 THR 45 -10.058 3.573 -3.463
327 HG22 THR 45 HG22 THR 45 -8.450 4.294 -3.373
328 HG23 THR 45 HG23 THR 45 -9.209 3.645 -1.918
329 H SER 46 H SER 46 -6.517 4.339 -1.765
330 HA SER 46 HA SER 46 -6.106 3.476 0.941
331 HB2 SER 46 HB2 SER 46 -4.817 5.351 0.090
332 HB3 SER 46 HB3 SER 46 -6.293 6.240 -0.282
333 HG SER 46 HG SER 46 -5.166 5.641 2.250
334 H ARG 47 H ARG 47 -7.528 3.417 2.534
335 HA ARG 47 HA ARG 47 -10.315 3.807 2.076
336 HB2 ARG 47 HB2 ARG 47 -9.219 2.158 3.655
337 HB3 ARG 47 HB3 ARG 47 -8.873 3.514 4.715
338 HG2 ARG 47 HG2 ARG 47 -11.346 3.955 4.782
339 HG3 ARG 47 HG3 ARG 47 -11.559 2.408 3.955
340 HD2 ARG 47 HD2 ARG 47 -10.224 1.348 5.798
341 HD3 ARG 47 HD3 ARG 47 -10.275 2.897 6.625
342 HE ARG 47 HE ARG 47 -12.861 2.502 6.286
343 HH11 ARG 47 HH11 ARG 47 -10.393 0.227 7.280
344 HH12 ARG 47 HH12 ARG 47 -11.465 -0.724 8.262
345 HH21 ARG 47 HH22 ARG 47 -14.290 1.259 7.567
346 HH22 ARG 47 HH21 ARG 47 -13.685 -0.127 8.434
347 H ARG 48 H ARG 48 -7.729 5.778 3.291
348 HA ARG 48 HA ARG 48 -9.475 7.610 4.699
349 HB2 ARG 48 HB2 ARG 48 -7.224 7.002 5.537
350 HB3 ARG 48 HB3 ARG 48 -6.511 7.775 4.133
351 HG2 ARG 48 HG2 ARG 48 -7.489 9.912 4.847
352 HG3 ARG 48 HG3 ARG 48 -8.102 9.115 6.298
353 HD2 ARG 48 HD2 ARG 48 -5.214 9.238 5.483
354 HD3 ARG 48 HD3 ARG 48 -5.967 10.302 6.673
355 HE ARG 48 HE ARG 48 -6.477 7.705 7.491
356 HH11 ARG 48 HH11 ARG 48 -3.657 9.681 6.897
357 HH12 ARG 48 HH12 ARG 48 -2.712 8.915 8.139
358 HH21 ARG 48 HH22 ARG 48 -5.215 6.682 9.116
359 HH22 ARG 48 HH21 ARG 48 -3.576 7.217 9.380
360 H THR 49 H THR 49 -7.299 7.758 1.885
361 HA THR 49 HA THR 49 -8.538 10.340 1.228
362 HB THR 49 HB THR 49 -6.310 10.827 1.573
363 HG1 THR 49 HG1 THR 49 -6.683 10.330 -1.195
364 HG21 THR 49 HG21 THR 49 -4.418 9.485 0.831
365 HG22 THR 49 HG22 THR 49 -5.521 8.330 0.083
366 HG23 THR 49 HG23 THR 49 -5.519 8.536 1.835
367 H LYS 50 H LYS 50 -8.597 7.177 0.317
368 HA LYS 50 HA LYS 50 -9.653 6.087 -1.354
369 HB2 LYS 50 HB2 LYS 50 -10.857 8.777 -1.972
370 HB3 LYS 50 HB3 LYS 50 -11.483 7.214 -2.467
371 HG2 LYS 50 HG2 LYS 50 -11.378 8.362 0.308
372 HG3 LYS 50 HG3 LYS 50 -12.798 7.950 -0.646
373 HD2 LYS 50 HD2 LYS 50 -10.815 6.060 0.607
374 HD3 LYS 50 HD3 LYS 50 -12.519 6.262 1.019
375 HE2 LYS 50 HE2 LYS 50 -13.046 5.521 -1.334
376 HE3 LYS 50 HE3 LYS 50 -11.338 5.111 -1.484
377 HZ1 LYS 50 HZ1 LYS 50 -13.043 4.010 0.670
378 HZ2 LYS 50 HZ2 LYS 50 -11.529 3.455 0.151
379 HZ3 LYS 50 HZ3 LYS 50 -12.890 3.245 -0.836
380 H GLN 51 H GLN 51 -7.056 7.025 -1.978
381 HA GLN 51 HA GLN 51 -7.277 7.723 -4.802
382 HB2 GLN 51 HB2 GLN 51 -4.629 7.593 -4.470
383 HB3 GLN 51 HB3 GLN 51 -5.557 9.040 -4.109
384 HG2 GLN 51 HG2 GLN 51 -5.545 8.519 -1.769
385 HG3 GLN 51 HG3 GLN 51 -4.785 6.961 -2.081
386 HE21 GLN 51 HE22 GLN 51 -3.043 8.154 -4.165
387 HE22 GLN 51 HE21 GLN 51 -1.823 9.022 -3.303
388 H PHE 52 H PHE 52 -6.017 6.469 -6.365
389 HA PHE 52 HA PHE 52 -5.951 3.623 -5.587
390 HB2 PHE 52 HB2 PHE 52 -7.977 3.876 -6.796
391 HB3 PHE 52 HB3 PHE 52 -7.219 4.905 -8.004
392 HD1 PHE 52 HD2 PHE 52 -6.917 1.438 -6.630
393 HD2 PHE 52 HD1 PHE 52 -6.700 3.997 -10.025
394 HE1 PHE 52 HE2 PHE 52 -6.529 -0.510 -8.073
395 HE2 PHE 52 HE1 PHE 52 -6.308 2.050 -11.473
396 HZ PHE 52 HZ PHE 52 -6.222 -0.209 -10.496
397 H GLY 53 H GLY 53 -4.239 2.489 -6.226
398 HA2 GLY 53 HA2 GLY 53 -2.777 2.813 -8.562
399 HA3 GLY 53 HA3 GLY 53 -1.964 3.770 -7.331
400 H THR 54 H THR 54 -0.165 2.488 -7.347
401 HA THR 54 HA THR 54 -0.512 -0.265 -6.393
402 HB THR 54 HB THR 54 0.716 -0.350 -8.384
403 HG1 THR 54 HG1 THR 54 2.955 -0.176 -6.709
404 HG21 THR 54 HG21 THR 54 2.801 1.133 -8.664
405 HG22 THR 54 HG22 THR 54 2.096 2.116 -7.378
406 HG23 THR 54 HG23 THR 54 1.216 1.873 -8.890
407 H PHE 55 H PHE 55 0.671 -0.982 -4.620
408 HA PHE 55 HA PHE 55 2.313 0.919 -3.166
409 HB2 PHE 55 HB2 PHE 55 1.090 0.801 -1.104
410 HB3 PHE 55 HB3 PHE 55 -0.036 1.302 -2.354
411 HD1 PHE 55 HD1 PHE 55 -1.451 -0.604 -3.431
412 HD2 PHE 55 HD2 PHE 55 0.552 -0.933 0.305
413 HE1 PHE 55 HE1 PHE 55 -2.937 -2.464 -2.804
414 HE2 PHE 55 HE2 PHE 55 -0.925 -2.795 0.940
415 HZ PHE 55 HZ PHE 55 -2.671 -3.564 -0.616
416 HA PRO 56 HA PRO 56 4.459 -2.861 -2.248
417 HB2 PRO 56 HB3 PRO 56 5.538 -1.355 0.042
418 HB3 PRO 56 HB2 PRO 56 6.386 -2.122 -1.304
419 HG2 PRO 56 HG2 PRO 56 6.172 0.548 -1.102
420 HG3 PRO 56 HG3 PRO 56 6.163 -0.275 -2.670
421 HD2 PRO 56 HD2 PRO 56 3.874 0.848 -1.101
422 HD3 PRO 56 HD3 PRO 56 4.156 0.863 -2.856
423 H GLY 57 H GLY 57 3.040 -4.330 -1.429
424 HA2 GLY 57 HA2 GLY 57 1.531 -3.869 0.969
425 HA3 GLY 57 HA3 GLY 57 1.606 -5.378 0.075
426 H ASN 58 H ASN 58 4.580 -4.008 0.895
427 HA ASN 58 HA ASN 58 5.183 -6.119 2.779
428 HB2 ASN 58 HB2 ASN 58 6.689 -5.271 0.870
429 HB3 ASN 58 HB3 ASN 58 6.989 -3.867 1.891
430 HD21 ASN 58 HD22 ASN 58 8.262 -4.081 3.723
431 HD22 ASN 58 HD21 ASN 58 9.207 -5.491 4.035
432 H TYR 59 H TYR 59 3.835 -3.095 2.889
433 HA TYR 59 HA TYR 59 4.824 -2.571 5.620
434 HB2 TYR 59 HB2 TYR 59 3.859 -0.554 3.592
435 HB3 TYR 59 HB3 TYR 59 4.458 -0.190 5.201
436 HD1 TYR 59 HD2 TYR 59 6.928 -1.032 5.675
437 HD2 TYR 59 HD1 TYR 59 5.279 -0.429 1.803
438 HE1 TYR 59 HE2 TYR 59 9.197 -0.850 4.742
439 HE2 TYR 59 HE1 TYR 59 7.533 -0.245 0.861
440 HH TYR 59 HH TYR 59 10.326 -1.144 2.565
441 H VAL 60 H VAL 60 2.442 -4.104 4.571
442 HA VAL 60 HA VAL 60 0.438 -2.696 6.158
443 HB VAL 60 HB VAL 60 -1.360 -3.403 4.546
444 HG11 VAL 60 HG11 VAL 60 0.637 -1.545 3.260
445 HG12 VAL 60 HG12 VAL 60 -0.312 -1.089 4.674
446 HG13 VAL 60 HG13 VAL 60 -1.124 -1.496 3.159
447 HG21 VAL 60 HG21 VAL 60 1.020 -3.990 2.789
448 HG22 VAL 60 HG22 VAL 60 -0.634 -3.815 2.202
449 HG23 VAL 60 HG23 VAL 60 -0.232 -5.113 3.321
450 H LYS 61 H LYS 61 -1.264 -4.098 6.931
451 HA LYS 61 HA LYS 61 -0.312 -6.858 7.206
452 HB2 LYS 61 HB2 LYS 61 -0.881 -6.822 9.569
453 HB3 LYS 61 HB3 LYS 61 0.315 -5.600 9.184
454 HG2 LYS 61 HG2 LYS 61 -1.528 -3.896 9.197
455 HG3 LYS 61 HG3 LYS 61 -2.611 -5.176 9.761
456 HD2 LYS 61 HD2 LYS 61 -1.978 -4.617 11.829
457 HD3 LYS 61 HD3 LYS 61 -0.439 -5.391 11.437
458 HE2 LYS 61 HE2 LYS 61 0.064 -3.235 12.300
459 HE3 LYS 61 HE3 LYS 61 0.349 -3.185 10.562
460 HZ1 LYS 61 HZ1 LYS 61 -2.062 -2.160 11.958
461 HZ2 LYS 61 HZ2 LYS 61 -1.798 -2.114 10.285
462 HZ3 LYS 61 HZ3 LYS 61 -0.809 -1.213 11.318
463 HA PRO 62 HA PRO 62 -4.280 -8.028 5.783
464 HB2 PRO 62 HB3 PRO 62 -3.902 -10.398 7.513
465 HB3 PRO 62 HB2 PRO 62 -4.213 -10.313 5.779
466 HG2 PRO 62 HG2 PRO 62 -1.796 -10.946 6.700
467 HG3 PRO 62 HG3 PRO 62 -1.989 -9.920 5.267
468 HD2 PRO 62 HD2 PRO 62 -1.295 -9.152 8.068
469 HD3 PRO 62 HD3 PRO 62 -0.668 -8.515 6.535
470 H LEU 63 H LEU 63 -6.116 -7.213 6.485
471 HA LEU 63 HA LEU 63 -6.764 -7.291 9.331
472 HB2 LEU 63 HB2 LEU 63 -8.038 -5.867 6.998
473 HB3 LEU 63 HB3 LEU 63 -8.675 -5.824 8.628
474 HG LEU 63 HG LEU 63 -5.967 -4.790 7.803
475 HD11 LEU 63 HD11 LEU 63 -8.448 -3.283 8.603
476 HD12 LEU 63 HD12 LEU 63 -7.921 -3.531 6.942
477 HD13 LEU 63 HD13 LEU 63 -6.913 -2.603 8.054
478 HD21 LEU 63 HD21 LEU 63 -7.453 -4.604 10.427
479 HD22 LEU 63 HD22 LEU 63 -5.901 -3.850 10.060
480 HD23 LEU 63 HD23 LEU 63 -6.037 -5.610 10.119
481 H TYR 64 H TYR 64 -9.527 -7.276 9.169
482 HA TYR 64 HA TYR 64 -9.910 -10.124 8.590
483 HB2 TYR 64 HB2 TYR 64 -11.475 -8.233 10.341
484 HB3 TYR 64 HB3 TYR 64 -11.846 -9.944 10.129
485 HD1 TYR 64 HD2 TYR 64 -9.814 -11.571 10.613
486 HD2 TYR 64 HD1 TYR 64 -10.148 -7.616 12.144
487 HE1 TYR 64 HE2 TYR 64 -8.227 -12.137 12.402
488 HE2 TYR 64 HE1 TYR 64 -8.559 -8.171 13.935
489 HH TYR 64 HH TYR 64 -6.631 -10.925 13.891
490 H LEU 65 H LEU 65 -10.289 -7.475 6.915
491 HA LEU 65 HA LEU 65 -12.908 -8.122 5.802
492 HB2 LEU 65 HB2 LEU 65 -10.954 -5.906 5.169
493 HB3 LEU 65 HB3 LEU 65 -12.457 -6.152 4.313
494 HG LEU 65 HG LEU 65 -12.871 -4.403 5.820
495 HD11 LEU 65 HD11 LEU 65 -13.902 -6.938 7.077
496 HD12 LEU 65 HD12 LEU 65 -14.662 -6.021 5.775
497 HD13 LEU 65 HD13 LEU 65 -14.521 -5.315 7.385
498 HD21 LEU 65 HD21 LEU 65 -10.888 -4.697 7.223
499 HD22 LEU 65 HD22 LEU 65 -11.653 -6.074 8.015
500 HD23 LEU 65 HD23 LEU 65 -12.345 -4.461 8.190
Start of MODEL 14
1 H1 GLN 1 H1 GLN 1 -19.401 -13.561 -5.625
2 H2 GLN 1 H2 GLN 1 -20.327 -12.151 -5.431
3 H3 GLN 1 H3 GLN 1 -19.190 -12.593 -4.251
4 HA GLN 1 HA GLN 1 -17.398 -12.288 -5.816
5 HB2 GLN 1 HB2 GLN 1 -17.831 -11.217 -7.965
6 HB3 GLN 1 HB3 GLN 1 -18.678 -12.752 -7.862
7 HG2 GLN 1 HG2 GLN 1 -20.761 -11.615 -7.416
8 HG3 GLN 1 HG3 GLN 1 -19.936 -10.058 -7.394
9 HE21 GLN 1 HE22 GLN 1 -19.140 -12.597 -9.667
10 HE22 GLN 1 HE21 GLN 1 -19.772 -11.796 -11.066
11 H THR 2 H THR 2 -16.377 -10.227 -6.006
12 HA THR 2 HA THR 2 -17.850 -7.868 -5.233
13 HB THR 2 HB THR 2 -17.495 -8.708 -3.028
14 HG1 THR 2 HG1 THR 2 -15.733 -7.136 -2.315
15 HG21 THR 2 HG21 THR 2 -15.282 -9.322 -2.158
16 HG22 THR 2 HG22 THR 2 -14.589 -9.078 -3.762
17 HG23 THR 2 HG23 THR 2 -15.766 -10.364 -3.497
18 H SER 3 H SER 3 -16.957 -6.096 -6.090
19 HA SER 3 HA SER 3 -14.197 -6.308 -7.103
20 HB2 SER 3 HB2 SER 3 -15.889 -6.288 -8.920
21 HB3 SER 3 HB3 SER 3 -16.499 -4.748 -8.318
22 HG SER 3 HG SER 3 -14.280 -3.966 -8.658
23 H GLN 4 H GLN 4 -15.249 -5.324 -4.526
24 HA GLN 4 HA GLN 4 -13.856 -2.767 -4.545
25 HB2 GLN 4 HB2 GLN 4 -16.070 -1.950 -4.745
26 HB3 GLN 4 HB3 GLN 4 -16.701 -3.150 -3.629
27 HG2 GLN 4 HG2 GLN 4 -16.678 -0.966 -2.605
28 HG3 GLN 4 HG3 GLN 4 -15.561 -2.059 -1.785
29 HE21 GLN 4 HE22 GLN 4 -13.353 -1.663 -1.906
30 HE22 GLN 4 HE21 GLN 4 -12.710 -0.170 -2.492
31 H ASP 5 H ASP 5 -15.904 -4.029 -1.998
32 HA ASP 5 HA ASP 5 -13.796 -4.253 -0.114
33 HB2 ASP 5 HB2 ASP 5 -16.555 -5.501 -0.054
34 HB3 ASP 5 HB3 ASP 5 -15.475 -5.317 1.324
35 H LEU 6 H LEU 6 -12.218 -5.541 -1.040
36 HA LEU 6 HA LEU 6 -12.990 -8.327 -1.624
37 HB2 LEU 6 HB2 LEU 6 -12.320 -7.048 -3.597
38 HB3 LEU 6 HB3 LEU 6 -10.799 -6.637 -2.828
39 HG LEU 6 HG LEU 6 -10.183 -9.043 -2.826
40 HD11 LEU 6 HD11 LEU 6 -12.691 -9.359 -4.467
41 HD12 LEU 6 HD12 LEU 6 -12.421 -9.999 -2.845
42 HD13 LEU 6 HD13 LEU 6 -11.466 -10.599 -4.201
43 HD21 LEU 6 HD21 LEU 6 -10.876 -7.867 -5.515
44 HD22 LEU 6 HD22 LEU 6 -9.736 -9.184 -5.234
45 HD23 LEU 6 HD23 LEU 6 -9.399 -7.574 -4.597
46 H PHE 7 H PHE 7 -10.015 -6.496 -0.915
47 HA PHE 7 HA PHE 7 -9.491 -8.212 1.373
48 HB2 PHE 7 HB2 PHE 7 -8.457 -9.021 -1.013
49 HB3 PHE 7 HB3 PHE 7 -7.170 -7.952 -0.449
50 HD1 PHE 7 HD2 PHE 7 -5.979 -8.451 1.640
51 HD2 PHE 7 HD1 PHE 7 -8.874 -11.121 0.032
52 HE1 PHE 7 HE2 PHE 7 -5.121 -10.249 3.086
53 HE2 PHE 7 HE1 PHE 7 -8.023 -12.921 1.474
54 HZ PHE 7 HZ PHE 7 -6.143 -12.486 3.003
55 H SER 8 H SER 8 -9.098 -6.721 2.898
56 HA SER 8 HA SER 8 -7.717 -4.266 2.079
57 HB2 SER 8 HB2 SER 8 -9.419 -4.758 4.535
58 HB3 SER 8 HB3 SER 8 -8.745 -3.212 4.022
59 HG SER 8 HG SER 8 -10.119 -4.226 1.972
60 H TYR 9 H TYR 9 -5.830 -3.680 2.969
61 HA TYR 9 HA TYR 9 -4.844 -5.230 5.279
62 HB2 TYR 9 HB2 TYR 9 -3.202 -3.713 3.239
63 HB3 TYR 9 HB3 TYR 9 -2.573 -4.614 4.604
64 HD1 TYR 9 HD2 TYR 9 -4.080 -7.162 4.395
65 HD2 TYR 9 HD1 TYR 9 -2.339 -4.714 1.401
66 HE1 TYR 9 HE2 TYR 9 -3.794 -9.137 2.954
67 HE2 TYR 9 HE1 TYR 9 -2.039 -6.668 -0.051
68 HH TYR 9 HH TYR 9 -3.526 -9.663 0.574
69 H GLN 10 H GLN 10 -3.711 -4.016 6.897
70 HA GLN 10 HA GLN 10 -4.231 -1.113 6.806
71 HB2 GLN 10 HB2 GLN 10 -5.159 -2.467 8.749
72 HB3 GLN 10 HB3 GLN 10 -3.491 -2.722 9.249
73 HG2 GLN 10 HG2 GLN 10 -3.198 -0.274 9.371
74 HG3 GLN 10 HG3 GLN 10 -4.902 -0.079 8.979
75 HE21 GLN 10 HE22 GLN 10 -6.459 -0.624 10.499
76 HE22 GLN 10 HE21 GLN 10 -6.078 -0.844 12.169
77 H ALA 11 H ALA 11 -2.531 0.276 6.918
78 HA ALA 11 HA ALA 11 0.028 -0.732 6.197
79 HB1 ALA 11 HB1 ALA 11 0.709 1.636 6.301
80 HB2 ALA 11 HB2 ALA 11 -0.856 2.026 7.020
81 HB3 ALA 11 HB3 ALA 11 -0.773 1.396 5.374
82 H LEU 12 H LEU 12 1.600 -1.390 7.429
83 HA LEU 12 HA LEU 12 1.493 -1.463 10.254
84 HB2 LEU 12 HB2 LEU 12 3.732 -1.961 8.293
85 HB3 LEU 12 HB3 LEU 12 3.896 -2.211 10.022
86 HG LEU 12 HG LEU 12 1.592 -3.591 8.863
87 HD11 LEU 12 HD11 LEU 12 4.377 -4.245 7.943
88 HD12 LEU 12 HD12 LEU 12 2.965 -3.846 6.956
89 HD13 LEU 12 HD13 LEU 12 3.016 -5.365 7.851
90 HD21 LEU 12 HD21 LEU 12 3.942 -4.462 10.542
91 HD22 LEU 12 HD22 LEU 12 2.520 -5.443 10.185
92 HD23 LEU 12 HD23 LEU 12 2.358 -3.969 11.139
93 H TYR 13 H TYR 13 3.148 0.592 7.930
94 HA TYR 13 HA TYR 13 3.213 2.720 9.813
95 HB2 TYR 13 HB2 TYR 13 5.680 3.123 9.679
96 HB3 TYR 13 HB3 TYR 13 5.213 1.724 10.625
97 HD1 TYR 13 HD1 TYR 13 5.393 -0.564 9.502
98 HD2 TYR 13 HD2 TYR 13 7.286 2.932 8.005
99 HE1 TYR 13 HE1 TYR 13 7.009 -1.971 8.290
100 HE2 TYR 13 HE2 TYR 13 8.901 1.541 6.779
101 HH TYR 13 HH TYR 13 8.519 -1.861 6.413
102 H SER 14 H SER 14 4.649 4.589 8.725
103 HA SER 14 HA SER 14 3.083 5.113 6.375
104 HB2 SER 14 HB2 SER 14 5.124 6.863 7.769
105 HB3 SER 14 HB3 SER 14 3.922 7.392 6.589
106 HG SER 14 HG SER 14 3.648 7.132 9.231
107 H TYR 15 H TYR 15 3.779 5.525 4.327
108 HA TYR 15 HA TYR 15 6.642 5.433 3.726
109 HB2 TYR 15 HB2 TYR 15 5.804 3.129 3.380
110 HB3 TYR 15 HB3 TYR 15 4.598 3.752 2.268
111 HD1 TYR 15 HD2 TYR 15 8.306 3.819 2.760
112 HD2 TYR 15 HD1 TYR 15 5.065 3.721 0.018
113 HE1 TYR 15 HE2 TYR 15 9.899 3.623 0.897
114 HE2 TYR 15 HE1 TYR 15 6.644 3.522 -1.860
115 HH TYR 15 HH TYR 15 8.856 3.793 -2.446
116 H ILE 16 H ILE 16 7.222 6.677 2.036
117 HA ILE 16 HA ILE 16 5.093 8.278 0.804
118 HB ILE 16 HB ILE 16 8.000 8.944 1.275
119 HG12 ILE 16 HG12 ILE 16 6.670 9.134 3.284
120 HG13 ILE 16 HG13 ILE 16 7.045 10.750 2.696
121 HG21 ILE 16 HG21 ILE 16 5.876 10.618 -0.067
122 HG22 ILE 16 HG22 ILE 16 7.253 9.861 -0.867
123 HG23 ILE 16 HG23 ILE 16 7.517 11.141 0.318
124 HD11 ILE 16 HD11 ILE 16 4.808 10.926 1.742
125 HD12 ILE 16 HD12 ILE 16 4.749 10.594 3.474
126 HD13 ILE 16 HD13 ILE 16 4.435 9.300 2.316
127 HA PRO 17 HA PRO 17 6.083 5.838 -2.813
128 HB2 PRO 17 HB3 PRO 17 4.274 7.810 -4.073
129 HB3 PRO 17 HB2 PRO 17 4.170 6.048 -4.046
130 HG2 PRO 17 HG2 PRO 17 2.514 7.546 -2.593
131 HG3 PRO 17 HG3 PRO 17 3.152 6.014 -1.969
132 HD2 PRO 17 HD2 PRO 17 3.991 8.812 -1.335
133 HD3 PRO 17 HD3 PRO 17 3.809 7.414 -0.253
134 H GLN 18 H GLN 18 7.408 6.075 -4.518
135 HA GLN 18 HA GLN 18 8.830 8.593 -4.733
136 HB2 GLN 18 HB2 GLN 18 9.333 6.001 -6.204
137 HB3 GLN 18 HB3 GLN 18 10.432 7.369 -6.076
138 HG2 GLN 18 HG2 GLN 18 10.554 7.013 -3.645
139 HG3 GLN 18 HG3 GLN 18 9.522 5.596 -3.819
140 HE21 GLN 18 HE22 GLN 18 12.035 6.515 -6.087
141 HE22 GLN 18 HE21 GLN 18 13.080 5.175 -5.749
142 H ASN 19 H ASN 19 6.383 6.840 -6.267
143 HA ASN 19 HA ASN 19 6.211 8.922 -8.347
144 HB2 ASN 19 HB2 ASN 19 5.744 5.953 -8.565
145 HB3 ASN 19 HB3 ASN 19 5.005 7.082 -9.695
146 HD21 ASN 19 HD22 ASN 19 7.300 8.878 -9.703
147 HD22 ASN 19 HD21 ASN 19 8.525 8.082 -10.631
148 H ASP 20 H ASP 20 4.147 9.768 -8.652
149 HA ASP 20 HA ASP 20 2.292 9.379 -6.486
150 HB2 ASP 20 HB2 ASP 20 0.869 11.011 -7.850
151 HB3 ASP 20 HB3 ASP 20 2.418 11.605 -7.254
152 H ASP 21 H ASP 21 2.898 7.718 -9.251
153 HA ASP 21 HA ASP 21 0.249 6.806 -9.848
154 HB2 ASP 21 HB2 ASP 21 2.075 6.658 -11.493
155 HB3 ASP 21 HB3 ASP 21 2.955 5.568 -10.429
156 H GLU 22 H GLU 22 2.445 6.333 -7.350
157 HA GLU 22 HA GLU 22 1.413 3.719 -6.567
158 HB2 GLU 22 HB2 GLU 22 3.590 5.486 -5.437
159 HB3 GLU 22 HB3 GLU 22 3.112 3.947 -4.732
160 HG2 GLU 22 HG2 GLU 22 3.934 2.726 -6.515
161 HG3 GLU 22 HG3 GLU 22 3.956 4.114 -7.594
162 H LEU 23 H LEU 23 0.993 3.543 -4.119
163 HA LEU 23 HA LEU 23 -0.968 5.627 -3.469
164 HB2 LEU 23 HB2 LEU 23 -1.448 3.043 -3.687
165 HB3 LEU 23 HB3 LEU 23 -0.805 2.989 -2.062
166 HG LEU 23 HG LEU 23 -3.335 3.134 -2.277
167 HD11 LEU 23 HD11 LEU 23 -1.975 5.292 -0.688
168 HD12 LEU 23 HD12 LEU 23 -2.138 3.607 -0.195
169 HD13 LEU 23 HD13 LEU 23 -3.575 4.613 -0.388
170 HD21 LEU 23 HD21 LEU 23 -3.467 4.741 -4.060
171 HD22 LEU 23 HD22 LEU 23 -2.630 5.945 -3.076
172 HD23 LEU 23 HD23 LEU 23 -4.245 5.396 -2.613
173 H GLU 24 H GLU 24 -0.902 6.753 -1.609
174 HA GLU 24 HA GLU 24 1.576 6.863 -0.179
175 HB2 GLU 24 HB2 GLU 24 -0.863 8.459 -0.373
176 HB3 GLU 24 HB3 GLU 24 -0.211 8.382 1.257
177 HG2 GLU 24 HG2 GLU 24 1.989 9.068 0.321
178 HG3 GLU 24 HG3 GLU 24 1.171 9.354 -1.220
179 H LEU 25 H LEU 25 2.089 5.593 1.466
180 HA LEU 25 HA LEU 25 -0.096 4.301 2.931
181 HB2 LEU 25 HB2 LEU 25 2.845 3.633 2.900
182 HB3 LEU 25 HB3 LEU 25 1.587 2.715 3.704
183 HG LEU 25 HG LEU 25 1.738 3.131 0.720
184 HD11 LEU 25 HD11 LEU 25 2.502 0.733 2.370
185 HD12 LEU 25 HD12 LEU 25 3.616 1.807 1.522
186 HD13 LEU 25 HD13 LEU 25 2.475 0.815 0.609
187 HD21 LEU 25 HD21 LEU 25 0.078 1.290 0.690
188 HD22 LEU 25 HD22 LEU 25 -0.520 2.759 1.464
189 HD23 LEU 25 HD23 LEU 25 -0.011 1.389 2.450
190 H ARG 26 H ARG 26 -0.444 4.735 5.010
191 HA ARG 26 HA ARG 26 1.591 6.218 6.497
192 HB2 ARG 26 HB2 ARG 26 -1.334 6.963 6.280
193 HB3 ARG 26 HB3 ARG 26 -0.226 7.642 7.469
194 HG2 ARG 26 HG2 ARG 26 1.130 8.587 5.714
195 HG3 ARG 26 HG3 ARG 26 0.120 7.824 4.485
196 HD2 ARG 26 HD2 ARG 26 -1.809 9.110 5.393
197 HD3 ARG 26 HD3 ARG 26 -0.675 9.981 6.425
198 HE ARG 26 HE ARG 26 -0.084 10.002 3.582
199 HH11 ARG 26 HH11 ARG 26 -1.436 11.695 6.330
200 HH12 ARG 26 HH12 ARG 26 -1.474 13.233 5.518
201 HH21 ARG 26 HH22 ARG 26 -0.074 11.998 2.535
202 HH22 ARG 26 HH21 ARG 26 -0.696 13.411 3.351
203 H ASP 27 H ASP 27 1.674 5.791 8.641
204 HA ASP 27 HA ASP 27 1.195 3.203 9.437
205 HB2 ASP 27 HB2 ASP 27 2.717 4.974 10.486
206 HB3 ASP 27 HB3 ASP 27 1.300 5.494 11.390
207 H GLY 28 H GLY 28 -0.755 2.277 9.406
208 HA2 GLY 28 HA2 GLY 28 -2.625 1.695 10.752
209 HA3 GLY 28 HA3 GLY 28 -2.767 3.375 11.239
210 H ASP 29 H ASP 29 -2.281 3.645 8.030
211 HA ASP 29 HA ASP 29 -5.082 4.004 7.476
212 HB2 ASP 29 HB2 ASP 29 -3.380 5.474 6.450
213 HB3 ASP 29 HB3 ASP 29 -2.733 4.097 5.567
214 H ILE 30 H ILE 30 -6.415 2.777 6.190
215 HA ILE 30 HA ILE 30 -5.466 0.052 5.684
216 HB ILE 30 HB ILE 30 -8.235 1.199 5.959
217 HG12 ILE 30 HG12 ILE 30 -8.302 -0.819 7.596
218 HG13 ILE 30 HG13 ILE 30 -6.553 -0.783 7.446
219 HG21 ILE 30 HG21 ILE 30 -7.558 -1.590 5.042
220 HG22 ILE 30 HG22 ILE 30 -8.250 -0.316 4.041
221 HG23 ILE 30 HG23 ILE 30 -9.171 -0.969 5.396
222 HD11 ILE 30 HD11 ILE 30 -7.226 0.421 9.409
223 HD12 ILE 30 HD12 ILE 30 -8.319 1.430 8.460
224 HD13 ILE 30 HD13 ILE 30 -6.578 1.552 8.222
225 H VAL 31 H VAL 31 -5.333 -0.789 3.716
226 HA VAL 31 HA VAL 31 -6.448 0.725 1.457
227 HB VAL 31 HB VAL 31 -3.688 -0.494 1.609
228 HG11 VAL 31 HG11 VAL 31 -3.464 0.088 -0.783
229 HG12 VAL 31 HG12 VAL 31 -5.184 0.486 -0.827
230 HG13 VAL 31 HG13 VAL 31 -4.668 -1.170 -0.505
231 HG21 VAL 31 HG21 VAL 31 -2.931 1.717 1.023
232 HG22 VAL 31 HG22 VAL 31 -3.995 1.830 2.427
233 HG23 VAL 31 HG23 VAL 31 -4.597 2.267 0.823
234 H ASP 32 H ASP 32 -7.776 -0.452 0.282
235 HA ASP 32 HA ASP 32 -7.873 -3.339 0.616
236 HB2 ASP 32 HB2 ASP 32 -9.955 -1.924 0.493
237 HB3 ASP 32 HB3 ASP 32 -9.547 -1.594 -1.193
238 H VAL 33 H VAL 33 -6.748 -4.646 -0.648
239 HA VAL 33 HA VAL 33 -5.538 -3.591 -3.063
240 HB VAL 33 HB VAL 33 -4.019 -4.770 -1.660
241 HG11 VAL 33 HG11 VAL 33 -6.124 -6.870 -1.553
242 HG12 VAL 33 HG12 VAL 33 -5.173 -6.145 -0.247
243 HG13 VAL 33 HG13 VAL 33 -4.432 -7.314 -1.341
244 HG21 VAL 33 HG21 VAL 33 -4.729 -6.585 -3.956
245 HG22 VAL 33 HG22 VAL 33 -3.164 -6.472 -3.149
246 HG23 VAL 33 HG23 VAL 33 -3.779 -5.103 -4.079
247 H MET 34 H MET 34 -6.278 -3.913 -4.991
248 HA MET 34 HA MET 34 -8.489 -5.786 -5.386
249 HB2 MET 34 HB2 MET 34 -9.029 -4.501 -7.368
250 HB3 MET 34 HB3 MET 34 -8.864 -3.426 -5.986
251 HG2 MET 34 HG2 MET 34 -6.920 -2.488 -6.771
252 HG3 MET 34 HG3 MET 34 -6.523 -3.890 -7.758
253 HE1 MET 34 HE1 MET 34 -8.671 -3.559 -10.883
254 HE2 MET 34 HE2 MET 34 -8.993 -4.555 -9.462
255 HE3 MET 34 HE3 MET 34 -7.341 -4.382 -10.061
256 H GLU 35 H GLU 35 -5.269 -4.976 -6.540
257 HA GLU 35 HA GLU 35 -5.260 -7.487 -8.066
258 HB2 GLU 35 HB2 GLU 35 -5.550 -5.526 -9.569
259 HB3 GLU 35 HB3 GLU 35 -3.994 -4.922 -9.014
260 HG2 GLU 35 HG2 GLU 35 -2.927 -6.953 -9.858
261 HG3 GLU 35 HG3 GLU 35 -4.491 -7.524 -10.435
262 H LYS 36 H LYS 36 -3.424 -8.636 -7.970
263 HA LYS 36 HA LYS 36 -1.435 -7.655 -6.022
264 HB2 LYS 36 HB2 LYS 36 -2.466 -10.469 -6.385
265 HB3 LYS 36 HB3 LYS 36 -1.241 -9.967 -5.227
266 HG2 LYS 36 HG2 LYS 36 -2.831 -8.628 -4.035
267 HG3 LYS 36 HG3 LYS 36 -4.065 -8.927 -5.261
268 HD2 LYS 36 HD2 LYS 36 -2.777 -11.042 -3.549
269 HD3 LYS 36 HD3 LYS 36 -4.350 -10.311 -3.226
270 HE2 LYS 36 HE2 LYS 36 -3.564 -11.968 -5.622
271 HE3 LYS 36 HE3 LYS 36 -4.670 -12.434 -4.329
272 HZ1 LYS 36 HZ1 LYS 36 -6.062 -10.474 -5.050
273 HZ2 LYS 36 HZ2 LYS 36 -6.000 -11.774 -6.143
274 HZ3 LYS 36 HZ3 LYS 36 -5.079 -10.384 -6.428
275 H CYS 37 H CYS 37 0.530 -7.450 -6.825
276 HA CYS 37 HA CYS 37 1.347 -8.934 -9.190
277 HB2 CYS 37 HB2 CYS 37 3.050 -7.081 -7.521
278 HB3 CYS 37 HB3 CYS 37 3.261 -7.519 -9.216
279 HG CYS 37 HG CYS 37 1.817 -4.901 -8.016
280 H ASP 38 H ASP 38 2.880 -10.552 -9.177
281 HA ASP 38 HA ASP 38 3.217 -12.012 -6.756
282 HB2 ASP 38 HB2 ASP 38 4.491 -13.587 -8.050
283 HB3 ASP 38 HB3 ASP 38 3.136 -13.053 -9.036
284 H ASP 39 H ASP 39 4.780 -9.335 -8.004
285 HA ASP 39 HA ASP 39 7.426 -9.922 -7.045
286 HB2 ASP 39 HB2 ASP 39 6.902 -8.409 -8.992
287 HB3 ASP 39 HB3 ASP 39 6.300 -7.231 -7.832
288 H GLY 40 H GLY 40 4.529 -8.855 -5.602
289 HA2 GLY 40 HA2 GLY 40 4.610 -9.158 -3.161
290 HA3 GLY 40 HA3 GLY 40 6.118 -8.257 -3.177
291 H TRP 41 H TRP 41 5.053 -6.307 -5.129
292 HA TRP 41 HA TRP 41 3.624 -4.672 -3.202
293 HB2 TRP 41 HB2 TRP 41 4.221 -3.717 -5.970
294 HB3 TRP 41 HB3 TRP 41 4.213 -2.819 -4.459
295 HD1 TRP 41 HD1 TRP 41 6.535 -3.280 -6.876
296 HE1 TRP 41 HE1 TRP 41 8.941 -3.669 -6.076
297 HE3 TRP 41 HE3 TRP 41 5.597 -4.697 -2.004
298 HZ2 TRP 41 HZ2 TRP 41 10.269 -4.465 -3.737
299 HZ3 TRP 41 HZ3 TRP 41 7.514 -5.253 -0.586
300 HH2 TRP 41 HH2 TRP 41 9.795 -5.142 -1.432
301 H PHE 42 H PHE 42 1.530 -3.820 -3.583
302 HA PHE 42 HA PHE 42 0.006 -5.444 -5.500
303 HB2 PHE 42 HB2 PHE 42 -0.786 -4.658 -2.694
304 HB3 PHE 42 HB3 PHE 42 -1.760 -5.590 -3.815
305 HD1 PHE 42 HD1 PHE 42 0.281 -7.447 -4.917
306 HD2 PHE 42 HD2 PHE 42 -0.414 -6.108 -0.936
307 HE1 PHE 42 HE1 PHE 42 1.273 -9.524 -4.049
308 HE2 PHE 42 HE2 PHE 42 0.578 -8.181 -0.062
309 HZ PHE 42 HZ PHE 42 1.428 -9.890 -1.620
310 H VAL 43 H VAL 43 -2.178 -4.532 -5.953
311 HA VAL 43 HA VAL 43 -2.059 -1.590 -6.107
312 HB VAL 43 HB VAL 43 -3.092 -3.675 -7.984
313 HG11 VAL 43 HG11 VAL 43 -4.106 -0.835 -8.035
314 HG12 VAL 43 HG12 VAL 43 -5.053 -2.184 -7.414
315 HG13 VAL 43 HG13 VAL 43 -4.559 -2.159 -9.110
316 HG21 VAL 43 HG21 VAL 43 -2.054 -2.204 -9.608
317 HG22 VAL 43 HG22 VAL 43 -0.928 -2.552 -8.288
318 HG23 VAL 43 HG23 VAL 43 -1.790 -1.013 -8.333
319 H GLY 44 H GLY 44 -3.647 -0.411 -5.198
320 HA2 GLY 44 HA2 GLY 44 -6.274 -1.425 -4.738
321 HA3 GLY 44 HA3 GLY 44 -5.345 -1.440 -3.250
322 H THR 45 H THR 45 -6.905 0.050 -2.420
323 HA THR 45 HA THR 45 -6.493 2.808 -3.338
324 HB THR 45 HB THR 45 -9.145 1.530 -2.697
325 HG1 THR 45 HG1 THR 45 -7.755 2.046 -5.017
326 HG21 THR 45 HG21 THR 45 -10.093 3.737 -3.387
327 HG22 THR 45 HG22 THR 45 -8.450 4.385 -3.366
328 HG23 THR 45 HG23 THR 45 -9.183 3.788 -1.875
329 H SER 46 H SER 46 -6.428 4.317 -1.757
330 HA SER 46 HA SER 46 -5.939 3.428 0.916
331 HB2 SER 46 HB2 SER 46 -4.659 5.288 0.009
332 HB3 SER 46 HB3 SER 46 -6.139 6.205 -0.272
333 HG SER 46 HG SER 46 -4.991 5.467 2.238
334 H ARG 47 H ARG 47 -7.356 3.340 2.571
335 HA ARG 47 HA ARG 47 -10.125 3.917 2.179
336 HB2 ARG 47 HB2 ARG 47 -9.222 2.124 3.659
337 HB3 ARG 47 HB3 ARG 47 -8.637 3.367 4.752
338 HG2 ARG 47 HG2 ARG 47 -11.042 4.139 4.932
339 HG3 ARG 47 HG3 ARG 47 -11.471 2.631 4.116
340 HD2 ARG 47 HD2 ARG 47 -10.146 1.432 5.892
341 HD3 ARG 47 HD3 ARG 47 -10.057 2.971 6.741
342 HE ARG 47 HE ARG 47 -12.742 2.216 6.069
343 HH11 ARG 47 HH11 ARG 47 -10.187 1.838 8.437
344 HH12 ARG 47 HH12 ARG 47 -11.268 1.369 9.716
345 HH21 ARG 47 HH22 ARG 47 -14.161 1.601 7.736
346 HH22 ARG 47 HH21 ARG 47 -13.524 1.233 9.314
347 H ARG 48 H ARG 48 -7.414 5.670 3.455
348 HA ARG 48 HA ARG 48 -8.985 7.550 4.963
349 HB2 ARG 48 HB2 ARG 48 -6.654 6.867 5.544
350 HB3 ARG 48 HB3 ARG 48 -6.091 7.734 4.123
351 HG2 ARG 48 HG2 ARG 48 -7.163 9.792 5.120
352 HG3 ARG 48 HG3 ARG 48 -7.317 8.857 6.612
353 HD2 ARG 48 HD2 ARG 48 -4.884 8.399 6.506
354 HD3 ARG 48 HD3 ARG 48 -4.787 9.475 5.115
355 HE ARG 48 HE ARG 48 -5.479 10.282 7.864
356 HH11 ARG 48 HH11 ARG 48 -4.331 11.085 4.647
357 HH12 ARG 48 HH12 ARG 48 -3.851 12.691 5.091
358 HH21 ARG 48 HH22 ARG 48 -4.857 12.391 8.435
359 HH22 ARG 48 HH21 ARG 48 -4.168 13.440 7.233
360 H THR 49 H THR 49 -7.115 7.696 1.932
361 HA THR 49 HA THR 49 -8.335 10.323 1.441
362 HB THR 49 HB THR 49 -6.095 10.801 1.563
363 HG1 THR 49 HG1 THR 49 -5.487 10.340 -0.992
364 HG21 THR 49 HG21 THR 49 -4.280 9.402 0.700
365 HG22 THR 49 HG22 THR 49 -5.467 8.215 0.159
366 HG23 THR 49 HG23 THR 49 -5.277 8.553 1.880
367 H LYS 50 H LYS 50 -8.411 7.150 0.443
368 HA LYS 50 HA LYS 50 -9.585 6.072 -1.149
369 HB2 LYS 50 HB2 LYS 50 -10.830 8.764 -1.675
370 HB3 LYS 50 HB3 LYS 50 -11.451 7.219 -2.228
371 HG2 LYS 50 HG2 LYS 50 -11.323 8.279 0.576
372 HG3 LYS 50 HG3 LYS 50 -12.745 7.808 -0.352
373 HD2 LYS 50 HD2 LYS 50 -10.625 6.009 0.816
374 HD3 LYS 50 HD3 LYS 50 -12.320 6.109 1.283
375 HE2 LYS 50 HE2 LYS 50 -11.252 5.139 -1.358
376 HE3 LYS 50 HE3 LYS 50 -11.862 4.122 -0.059
377 HZ1 LYS 50 HZ1 LYS 50 -13.491 4.499 -1.848
378 HZ2 LYS 50 HZ2 LYS 50 -13.495 6.157 -1.482
379 HZ3 LYS 50 HZ3 LYS 50 -14.040 5.034 -0.335
380 H GLN 51 H GLN 51 -7.023 7.027 -1.841
381 HA GLN 51 HA GLN 51 -7.315 7.696 -4.669
382 HB2 GLN 51 HB2 GLN 51 -4.697 7.705 -4.461
383 HB3 GLN 51 HB3 GLN 51 -5.640 9.091 -3.925
384 HG2 GLN 51 HG2 GLN 51 -5.522 8.128 -1.616
385 HG3 GLN 51 HG3 GLN 51 -4.392 6.932 -2.253
386 HE21 GLN 51 HE22 GLN 51 -2.372 7.655 -3.060
387 HE22 GLN 51 HE21 GLN 51 -1.694 9.164 -2.546
388 H PHE 52 H PHE 52 -6.081 6.492 -6.236
389 HA PHE 52 HA PHE 52 -5.915 3.648 -5.477
390 HB2 PHE 52 HB2 PHE 52 -7.837 3.927 -6.855
391 HB3 PHE 52 HB3 PHE 52 -6.966 4.955 -7.984
392 HD1 PHE 52 HD2 PHE 52 -7.017 1.469 -6.654
393 HD2 PHE 52 HD1 PHE 52 -6.071 4.052 -9.905
394 HE1 PHE 52 HE2 PHE 52 -6.535 -0.480 -8.063
395 HE2 PHE 52 HE1 PHE 52 -5.580 2.098 -11.314
396 HZ PHE 52 HZ PHE 52 -5.813 -0.171 -10.392
397 H GLY 53 H GLY 53 -4.251 2.436 -6.276
398 HA2 GLY 53 HA2 GLY 53 -2.609 2.893 -8.405
399 HA3 GLY 53 HA3 GLY 53 -1.862 3.808 -7.100
400 H THR 54 H THR 54 -0.082 2.442 -7.296
401 HA THR 54 HA THR 54 -0.466 -0.273 -6.286
402 HB THR 54 HB THR 54 0.677 -0.351 -8.327
403 HG1 THR 54 HG1 THR 54 2.981 -0.684 -7.574
404 HG21 THR 54 HG21 THR 54 2.794 1.080 -8.650
405 HG22 THR 54 HG22 THR 54 2.154 2.068 -7.332
406 HG23 THR 54 HG23 THR 54 1.224 1.863 -8.820
407 H PHE 55 H PHE 55 0.664 -0.978 -4.522
408 HA PHE 55 HA PHE 55 2.354 0.908 -3.088
409 HB2 PHE 55 HB2 PHE 55 1.091 0.755 -1.029
410 HB3 PHE 55 HB3 PHE 55 0.019 1.310 -2.303
411 HD1 PHE 55 HD1 PHE 55 -1.481 -0.425 -3.419
412 HD2 PHE 55 HD2 PHE 55 0.531 -1.112 0.264
413 HE1 PHE 55 HE1 PHE 55 -3.057 -2.246 -2.901
414 HE2 PHE 55 HE2 PHE 55 -1.036 -2.938 0.787
415 HZ PHE 55 HZ PHE 55 -2.832 -3.507 -0.798
416 HA PRO 56 HA PRO 56 4.624 -2.813 -2.288
417 HB2 PRO 56 HB3 PRO 56 5.579 -1.332 0.094
418 HB3 PRO 56 HB2 PRO 56 6.503 -2.053 -1.228
419 HG2 PRO 56 HG2 PRO 56 6.215 0.593 -1.038
420 HG3 PRO 56 HG3 PRO 56 6.207 -0.219 -2.615
421 HD2 PRO 56 HD2 PRO 56 3.901 0.827 -1.009
422 HD3 PRO 56 HD3 PRO 56 4.173 0.889 -2.764
423 H GLY 57 H GLY 57 3.445 -4.470 -1.527
424 HA2 GLY 57 HA2 GLY 57 1.577 -4.263 0.593
425 HA3 GLY 57 HA3 GLY 57 2.092 -5.746 -0.193
426 H ASN 58 H ASN 58 4.866 -4.381 0.788
427 HA ASN 58 HA ASN 58 5.129 -6.161 2.988
428 HB2 ASN 58 HB2 ASN 58 7.399 -5.803 2.752
429 HB3 ASN 58 HB3 ASN 58 6.807 -5.569 1.124
430 HD21 ASN 58 HD22 ASN 58 8.551 -4.422 0.496
431 HD22 ASN 58 HD21 ASN 58 8.885 -2.812 1.029
432 H TYR 59 H TYR 59 4.117 -2.952 2.620
433 HA TYR 59 HA TYR 59 4.885 -2.204 5.352
434 HB2 TYR 59 HB2 TYR 59 3.652 -0.558 3.138
435 HB3 TYR 59 HB3 TYR 59 4.043 0.050 4.738
436 HD1 TYR 59 HD2 TYR 59 6.571 -0.272 5.446
437 HD2 TYR 59 HD1 TYR 59 5.165 -0.253 1.437
438 HE1 TYR 59 HE2 TYR 59 8.822 0.335 4.669
439 HE2 TYR 59 HE1 TYR 59 7.410 0.357 0.647
440 HH TYR 59 HH TYR 59 10.170 0.145 2.579
441 H VAL 60 H VAL 60 2.561 -4.035 4.301
442 HA VAL 60 HA VAL 60 0.511 -2.798 5.980
443 HB VAL 60 HB VAL 60 -1.268 -3.495 4.355
444 HG11 VAL 60 HG11 VAL 60 0.707 -1.460 3.325
445 HG12 VAL 60 HG12 VAL 60 -0.533 -1.163 4.544
446 HG13 VAL 60 HG13 VAL 60 -0.998 -1.568 2.889
447 HG21 VAL 60 HG21 VAL 60 1.121 -3.958 2.587
448 HG22 VAL 60 HG22 VAL 60 -0.522 -3.751 1.979
449 HG23 VAL 60 HG23 VAL 60 -0.140 -5.105 3.040
450 H LYS 61 H LYS 61 -1.145 -4.299 6.671
451 HA LYS 61 HA LYS 61 -0.104 -7.044 6.926
452 HB2 LYS 61 HB2 LYS 61 -1.116 -6.916 9.287
453 HB3 LYS 61 HB3 LYS 61 0.391 -6.054 8.999
454 HG2 LYS 61 HG2 LYS 61 -1.117 -4.027 8.521
455 HG3 LYS 61 HG3 LYS 61 -2.372 -4.958 9.333
456 HD2 LYS 61 HD2 LYS 61 -1.358 -4.797 11.380
457 HD3 LYS 61 HD3 LYS 61 0.262 -4.669 10.686
458 HE2 LYS 61 HE2 LYS 61 -0.157 -2.409 9.979
459 HE3 LYS 61 HE3 LYS 61 -1.841 -2.516 10.500
460 HZ1 LYS 61 HZ1 LYS 61 0.525 -2.673 12.301
461 HZ2 LYS 61 HZ2 LYS 61 -1.102 -2.720 12.783
462 HZ3 LYS 61 HZ3 LYS 61 -0.462 -1.307 12.092
463 HA PRO 62 HA PRO 62 -3.939 -8.341 5.290
464 HB2 PRO 62 HB3 PRO 62 -3.622 -10.778 6.923
465 HB3 PRO 62 HB2 PRO 62 -3.725 -10.602 5.172
466 HG2 PRO 62 HG2 PRO 62 -1.411 -11.197 6.365
467 HG3 PRO 62 HG3 PRO 62 -1.472 -10.125 4.954
468 HD2 PRO 62 HD2 PRO 62 -1.181 -9.430 7.850
469 HD3 PRO 62 HD3 PRO 62 -0.359 -8.741 6.434
470 H LEU 63 H LEU 63 -5.899 -7.746 5.831
471 HA LEU 63 HA LEU 63 -6.892 -8.324 8.550
472 HB2 LEU 63 HB2 LEU 63 -7.804 -6.129 6.689
473 HB3 LEU 63 HB3 LEU 63 -8.374 -6.414 8.320
474 HG LEU 63 HG LEU 63 -5.591 -5.524 7.566
475 HD11 LEU 63 HD11 LEU 63 -7.790 -4.010 8.954
476 HD12 LEU 63 HD12 LEU 63 -7.438 -3.887 7.232
477 HD13 LEU 63 HD13 LEU 63 -6.228 -3.390 8.416
478 HD21 LEU 63 HD21 LEU 63 -5.276 -5.207 9.963
479 HD22 LEU 63 HD22 LEU 63 -5.621 -6.896 9.593
480 HD23 LEU 63 HD23 LEU 63 -6.882 -5.867 10.271
481 H TYR 64 H TYR 64 -9.528 -7.894 8.184
482 HA TYR 64 HA TYR 64 -10.337 -9.616 5.934
483 HB2 TYR 64 HB2 TYR 64 -11.465 -9.706 8.741
484 HB3 TYR 64 HB3 TYR 64 -12.069 -10.624 7.372
485 HD1 TYR 64 HD1 TYR 64 -9.161 -10.216 9.633
486 HD2 TYR 64 HD2 TYR 64 -11.090 -12.679 6.750
487 HE1 TYR 64 HE1 TYR 64 -7.616 -12.048 10.174
488 HE2 TYR 64 HE2 TYR 64 -9.550 -14.519 7.283
489 HH TYR 64 HH TYR 64 -7.494 -14.468 10.021
490 H LEU 65 H LEU 65 -12.551 -9.246 5.240
491 HA LEU 65 HA LEU 65 -13.498 -6.552 5.962
492 HB2 LEU 65 HB2 LEU 65 -12.459 -6.970 3.589
493 HB3 LEU 65 HB3 LEU 65 -13.996 -7.734 3.245
494 HG LEU 65 HG LEU 65 -13.970 -5.429 2.460
495 HD11 LEU 65 HD11 LEU 65 -16.107 -6.336 3.204
496 HD12 LEU 65 HD12 LEU 65 -15.999 -4.606 3.532
497 HD13 LEU 65 HD13 LEU 65 -15.786 -5.767 4.843
498 HD21 LEU 65 HD21 LEU 65 -12.355 -4.505 4.004
499 HD22 LEU 65 HD22 LEU 65 -13.482 -4.708 5.344
500 HD23 LEU 65 HD23 LEU 65 -13.846 -3.565 4.051
Start of MODEL 15
1 H1 GLN 1 H1 GLN 1 -13.447 -5.884 -8.669
2 H2 GLN 1 H2 GLN 1 -12.518 -4.609 -9.294
3 H3 GLN 1 H3 GLN 1 -13.278 -5.696 -10.347
4 HA GLN 1 HA GLN 1 -14.436 -3.560 -10.213
5 HB2 GLN 1 HB2 GLN 1 -15.664 -5.578 -10.809
6 HB3 GLN 1 HB3 GLN 1 -15.891 -5.973 -9.112
7 HG2 GLN 1 HG2 GLN 1 -17.245 -3.935 -8.844
8 HG3 GLN 1 HG3 GLN 1 -17.054 -3.608 -10.565
9 HE21 GLN 1 HE22 GLN 1 -19.466 -4.107 -8.977
10 HE22 GLN 1 HE21 GLN 1 -20.250 -5.467 -9.721
11 H THR 2 H THR 2 -14.060 -1.933 -8.825
12 HA THR 2 HA THR 2 -14.306 -0.576 -7.024
13 HB THR 2 HB THR 2 -16.213 -2.645 -5.913
14 HG1 THR 2 HG1 THR 2 -17.675 -1.899 -7.268
15 HG21 THR 2 HG21 THR 2 -15.471 -0.928 -4.304
16 HG22 THR 2 HG22 THR 2 -17.183 -0.768 -4.697
17 HG23 THR 2 HG23 THR 2 -16.007 0.329 -5.418
18 H SER 3 H SER 3 -12.500 -0.440 -5.846
19 HA SER 3 HA SER 3 -11.338 -2.718 -4.556
20 HB2 SER 3 HB2 SER 3 -10.628 0.202 -4.206
21 HB3 SER 3 HB3 SER 3 -9.605 -1.185 -3.842
22 HG SER 3 HG SER 3 -9.206 -0.088 -5.893
23 H GLN 4 H GLN 4 -12.759 -3.492 -2.987
24 HA GLN 4 HA GLN 4 -12.773 -1.908 -0.549
25 HB2 GLN 4 HB2 GLN 4 -14.928 -1.422 -1.684
26 HB3 GLN 4 HB3 GLN 4 -15.308 -3.139 -1.642
27 HG2 GLN 4 HG2 GLN 4 -15.347 -3.131 0.752
28 HG3 GLN 4 HG3 GLN 4 -14.815 -1.446 0.800
29 HE21 GLN 4 HE22 GLN 4 -17.465 -3.600 0.402
30 HE22 GLN 4 HE21 GLN 4 -18.708 -2.393 0.260
31 H ASP 5 H ASP 5 -14.964 -4.538 -0.621
32 HA ASP 5 HA ASP 5 -13.345 -5.978 1.272
33 HB2 ASP 5 HB2 ASP 5 -16.006 -6.733 0.059
34 HB3 ASP 5 HB3 ASP 5 -15.246 -7.514 1.439
35 H LEU 6 H LEU 6 -12.241 -5.868 -1.391
36 HA LEU 6 HA LEU 6 -12.463 -8.582 -2.398
37 HB2 LEU 6 HB2 LEU 6 -12.181 -6.598 -3.896
38 HB3 LEU 6 HB3 LEU 6 -10.571 -6.379 -3.238
39 HG LEU 6 HG LEU 6 -9.903 -8.564 -4.140
40 HD11 LEU 6 HD11 LEU 6 -12.076 -9.677 -4.047
41 HD12 LEU 6 HD12 LEU 6 -11.383 -9.767 -5.666
42 HD13 LEU 6 HD13 LEU 6 -12.677 -8.619 -5.324
43 HD21 LEU 6 HD21 LEU 6 -9.934 -7.942 -6.500
44 HD22 LEU 6 HD22 LEU 6 -9.583 -6.547 -5.477
45 HD23 LEU 6 HD23 LEU 6 -11.192 -6.749 -6.173
46 H PHE 7 H PHE 7 -10.226 -6.495 -0.721
47 HA PHE 7 HA PHE 7 -9.307 -8.326 1.106
48 HB2 PHE 7 HB2 PHE 7 -8.161 -9.017 -1.298
49 HB3 PHE 7 HB3 PHE 7 -6.944 -7.934 -0.618
50 HD1 PHE 7 HD2 PHE 7 -6.182 -8.422 1.801
51 HD2 PHE 7 HD1 PHE 7 -8.245 -11.235 -0.636
52 HE1 PHE 7 HE2 PHE 7 -5.356 -10.257 3.222
53 HE2 PHE 7 HE1 PHE 7 -7.432 -13.069 0.784
54 HZ PHE 7 HZ PHE 7 -5.982 -12.584 2.713
55 H SER 8 H SER 8 -8.714 -6.951 2.714
56 HA SER 8 HA SER 8 -7.491 -4.405 1.858
57 HB2 SER 8 HB2 SER 8 -9.840 -4.188 2.663
58 HB3 SER 8 HB3 SER 8 -9.323 -4.801 4.231
59 HG SER 8 HG SER 8 -9.108 -2.320 3.159
60 H TYR 9 H TYR 9 -5.782 -3.595 2.994
61 HA TYR 9 HA TYR 9 -4.846 -5.164 5.307
62 HB2 TYR 9 HB2 TYR 9 -3.084 -3.721 3.310
63 HB3 TYR 9 HB3 TYR 9 -2.540 -4.628 4.709
64 HD1 TYR 9 HD2 TYR 9 -4.183 -7.088 4.485
65 HD2 TYR 9 HD1 TYR 9 -2.164 -4.816 1.521
66 HE1 TYR 9 HE2 TYR 9 -3.977 -9.102 3.090
67 HE2 TYR 9 HE1 TYR 9 -1.962 -6.815 0.109
68 HH TYR 9 HH TYR 9 -1.920 -9.344 0.499
69 H GLN 10 H GLN 10 -3.707 -3.981 6.906
70 HA GLN 10 HA GLN 10 -4.242 -1.084 6.873
71 HB2 GLN 10 HB2 GLN 10 -5.266 -2.092 8.787
72 HB3 GLN 10 HB3 GLN 10 -3.814 -3.015 9.147
73 HG2 GLN 10 HG2 GLN 10 -2.650 -1.101 9.861
74 HG3 GLN 10 HG3 GLN 10 -3.880 -0.023 9.212
75 HE21 GLN 10 HE22 GLN 10 -5.833 0.200 10.318
76 HE22 GLN 10 HE21 GLN 10 -6.003 -0.261 11.979
77 H ALA 11 H ALA 11 -2.567 0.295 6.994
78 HA ALA 11 HA ALA 11 0.033 -0.666 6.350
79 HB1 ALA 11 HB1 ALA 11 0.660 1.706 6.449
80 HB2 ALA 11 HB2 ALA 11 -0.920 2.066 7.146
81 HB3 ALA 11 HB3 ALA 11 -0.805 1.445 5.498
82 H LEU 12 H LEU 12 1.551 -1.319 7.660
83 HA LEU 12 HA LEU 12 1.339 -1.342 10.478
84 HB2 LEU 12 HB2 LEU 12 3.591 -1.889 8.557
85 HB3 LEU 12 HB3 LEU 12 3.827 -1.974 10.292
86 HG LEU 12 HG LEU 12 1.546 -3.541 9.323
87 HD11 LEU 12 HD11 LEU 12 4.350 -4.151 8.433
88 HD12 LEU 12 HD12 LEU 12 2.901 -3.966 7.439
89 HD13 LEU 12 HD13 LEU 12 3.063 -5.358 8.509
90 HD21 LEU 12 HD21 LEU 12 3.948 -4.192 11.028
91 HD22 LEU 12 HD22 LEU 12 2.509 -5.192 10.836
92 HD23 LEU 12 HD23 LEU 12 2.390 -3.619 11.624
93 H TYR 13 H TYR 13 3.065 0.686 8.193
94 HA TYR 13 HA TYR 13 3.153 2.837 10.061
95 HB2 TYR 13 HB2 TYR 13 5.641 3.133 9.948
96 HB3 TYR 13 HB3 TYR 13 5.099 1.774 10.914
97 HD1 TYR 13 HD1 TYR 13 5.259 -0.542 9.917
98 HD2 TYR 13 HD2 TYR 13 7.174 2.838 8.188
99 HE1 TYR 13 HE1 TYR 13 6.808 -2.037 8.737
100 HE2 TYR 13 HE2 TYR 13 8.727 1.350 6.990
101 HH TYR 13 HH TYR 13 9.619 -0.878 7.130
102 H SER 14 H SER 14 4.638 4.655 8.993
103 HA SER 14 HA SER 14 3.196 5.182 6.574
104 HB2 SER 14 HB2 SER 14 5.271 6.861 7.999
105 HB3 SER 14 HB3 SER 14 4.172 7.417 6.733
106 HG SER 14 HG SER 14 3.715 7.431 9.293
107 H TYR 15 H TYR 15 3.931 5.402 4.535
108 HA TYR 15 HA TYR 15 6.799 5.105 3.989
109 HB2 TYR 15 HB2 TYR 15 5.770 2.859 3.724
110 HB3 TYR 15 HB3 TYR 15 4.643 3.534 2.566
111 HD1 TYR 15 HD2 TYR 15 8.265 2.918 3.135
112 HD2 TYR 15 HD1 TYR 15 5.187 3.707 0.313
113 HE1 TYR 15 HE2 TYR 15 9.837 2.462 1.298
114 HE2 TYR 15 HE1 TYR 15 6.742 3.247 -1.528
115 HH TYR 15 HH TYR 15 9.798 1.800 -1.028
116 H ILE 16 H ILE 16 7.494 6.431 2.471
117 HA ILE 16 HA ILE 16 5.524 8.039 1.021
118 HB ILE 16 HB ILE 16 8.479 8.455 1.485
119 HG12 ILE 16 HG12 ILE 16 7.134 8.900 3.461
120 HG13 ILE 16 HG13 ILE 16 7.726 10.418 2.794
121 HG21 ILE 16 HG21 ILE 16 8.215 10.615 0.372
122 HG22 ILE 16 HG22 ILE 16 6.533 10.227 0.006
123 HG23 ILE 16 HG23 ILE 16 7.834 9.284 -0.721
124 HD11 ILE 16 HD11 ILE 16 5.547 10.831 1.787
125 HD12 ILE 16 HD12 ILE 16 5.413 10.594 3.529
126 HD13 ILE 16 HD13 ILE 16 4.956 9.296 2.426
127 HA PRO 17 HA PRO 17 6.195 5.199 -2.341
128 HB2 PRO 17 HB3 PRO 17 4.895 7.429 -3.823
129 HB3 PRO 17 HB2 PRO 17 4.483 5.712 -3.787
130 HG2 PRO 17 HG2 PRO 17 3.003 7.469 -2.465
131 HG3 PRO 17 HG3 PRO 17 3.378 5.889 -1.749
132 HD2 PRO 17 HD2 PRO 17 4.564 8.569 -1.157
133 HD3 PRO 17 HD3 PRO 17 4.157 7.243 -0.047
134 H GLN 18 H GLN 18 7.585 4.987 -4.039
135 HA GLN 18 HA GLN 18 9.492 7.163 -4.400
136 HB2 GLN 18 HB2 GLN 18 9.633 4.329 -5.431
137 HB3 GLN 18 HB3 GLN 18 10.939 5.506 -5.423
138 HG2 GLN 18 HG2 GLN 18 9.627 4.488 -2.916
139 HG3 GLN 18 HG3 GLN 18 11.028 3.718 -3.650
140 HE21 GLN 18 HE22 GLN 18 10.609 7.190 -3.657
141 HE22 GLN 18 HE21 GLN 18 11.865 7.539 -2.523
142 H ASN 19 H ASN 19 6.747 6.036 -5.718
143 HA ASN 19 HA ASN 19 7.278 7.311 -8.319
144 HB2 ASN 19 HB2 ASN 19 5.699 4.789 -7.767
145 HB3 ASN 19 HB3 ASN 19 5.731 5.617 -9.321
146 HD21 ASN 19 HD22 ASN 19 7.458 3.645 -7.065
147 HD22 ASN 19 HD21 ASN 19 8.753 3.201 -8.133
148 H ASP 20 H ASP 20 5.373 8.278 -9.273
149 HA ASP 20 HA ASP 20 3.506 9.295 -7.317
150 HB2 ASP 20 HB2 ASP 20 4.370 10.784 -9.057
151 HB3 ASP 20 HB3 ASP 20 3.701 9.743 -10.308
152 H ASP 21 H ASP 21 3.721 6.607 -9.264
153 HA ASP 21 HA ASP 21 0.917 6.216 -9.803
154 HB2 ASP 21 HB2 ASP 21 3.202 4.241 -9.951
155 HB3 ASP 21 HB3 ASP 21 1.617 4.063 -10.689
156 H GLU 22 H GLU 22 2.836 5.938 -7.101
157 HA GLU 22 HA GLU 22 1.601 3.503 -6.089
158 HB2 GLU 22 HB2 GLU 22 3.883 5.199 -5.110
159 HB3 GLU 22 HB3 GLU 22 3.189 3.913 -4.137
160 HG2 GLU 22 HG2 GLU 22 3.779 2.276 -5.802
161 HG3 GLU 22 HG3 GLU 22 4.377 3.536 -6.877
162 H LEU 23 H LEU 23 0.984 3.471 -3.799
163 HA LEU 23 HA LEU 23 -0.819 5.712 -3.240
164 HB2 LEU 23 HB2 LEU 23 -1.469 3.159 -3.406
165 HB3 LEU 23 HB3 LEU 23 -0.832 3.088 -1.779
166 HG LEU 23 HG LEU 23 -3.339 3.358 -1.968
167 HD11 LEU 23 HD11 LEU 23 -1.876 5.520 -0.469
168 HD12 LEU 23 HD12 LEU 23 -2.130 3.868 0.095
169 HD13 LEU 23 HD13 LEU 23 -3.509 4.940 -0.146
170 HD21 LEU 23 HD21 LEU 23 -3.412 4.906 -3.815
171 HD22 LEU 23 HD22 LEU 23 -2.540 6.116 -2.872
172 HD23 LEU 23 HD23 LEU 23 -4.169 5.631 -2.393
173 H GLU 24 H GLU 24 -0.720 6.839 -1.342
174 HA GLU 24 HA GLU 24 1.799 6.789 0.033
175 HB2 GLU 24 HB2 GLU 24 -0.466 8.601 -0.196
176 HB3 GLU 24 HB3 GLU 24 0.142 8.488 1.452
177 HG2 GLU 24 HG2 GLU 24 2.394 8.983 0.640
178 HG3 GLU 24 HG3 GLU 24 1.747 9.166 -0.994
179 H LEU 25 H LEU 25 2.231 5.421 1.601
180 HA LEU 25 HA LEU 25 0.020 4.264 3.122
181 HB2 LEU 25 HB2 LEU 25 2.941 3.540 3.186
182 HB3 LEU 25 HB3 LEU 25 1.631 2.646 3.924
183 HG LEU 25 HG LEU 25 1.948 3.048 0.949
184 HD11 LEU 25 HD11 LEU 25 2.568 0.641 2.655
185 HD12 LEU 25 HD12 LEU 25 3.739 1.663 1.819
186 HD13 LEU 25 HD13 LEU 25 2.596 0.691 0.891
187 HD21 LEU 25 HD21 LEU 25 0.085 1.308 2.559
188 HD22 LEU 25 HD22 LEU 25 0.238 1.291 0.802
189 HD23 LEU 25 HD23 LEU 25 -0.363 2.734 1.620
190 H ARG 26 H ARG 26 -0.295 4.668 5.233
191 HA ARG 26 HA ARG 26 1.691 6.279 6.654
192 HB2 ARG 26 HB2 ARG 26 -1.265 6.907 6.615
193 HB3 ARG 26 HB3 ARG 26 -0.022 7.804 7.473
194 HG2 ARG 26 HG2 ARG 26 1.032 8.310 5.269
195 HG3 ARG 26 HG3 ARG 26 -0.378 7.586 4.497
196 HD2 ARG 26 HD2 ARG 26 -1.822 9.236 5.426
197 HD3 ARG 26 HD3 ARG 26 -0.530 9.860 6.457
198 HE ARG 26 HE ARG 26 0.010 9.959 3.615
199 HH11 ARG 26 HH11 ARG 26 -1.292 11.669 6.369
200 HH12 ARG 26 HH12 ARG 26 -1.064 13.241 5.670
201 HH21 ARG 26 HH22 ARG 26 0.362 12.007 2.697
202 HH22 ARG 26 HH21 ARG 26 -0.087 13.438 3.590
203 H ASP 27 H ASP 27 1.754 5.958 8.818
204 HA ASP 27 HA ASP 27 1.299 3.425 9.781
205 HB2 ASP 27 HB2 ASP 27 2.820 5.101 10.804
206 HB3 ASP 27 HB3 ASP 27 1.419 5.950 11.444
207 H GLY 28 H GLY 28 -0.661 2.489 9.669
208 HA2 GLY 28 HA2 GLY 28 -2.547 1.901 10.975
209 HA3 GLY 28 HA3 GLY 28 -2.702 3.574 11.476
210 H ASP 29 H ASP 29 -2.187 3.830 8.275
211 HA ASP 29 HA ASP 29 -4.983 4.266 7.717
212 HB2 ASP 29 HB2 ASP 29 -2.987 5.623 6.799
213 HB3 ASP 29 HB3 ASP 29 -2.780 4.297 5.657
214 H ILE 30 H ILE 30 -6.251 3.157 6.148
215 HA ILE 30 HA ILE 30 -5.356 0.381 5.804
216 HB ILE 30 HB ILE 30 -8.133 1.553 5.930
217 HG12 ILE 30 HG12 ILE 30 -8.217 -0.333 7.730
218 HG13 ILE 30 HG13 ILE 30 -6.464 -0.219 7.664
219 HG21 ILE 30 HG21 ILE 30 -7.396 -1.312 5.351
220 HG22 ILE 30 HG22 ILE 30 -8.064 -0.181 4.177
221 HG23 ILE 30 HG23 ILE 30 -9.023 -0.673 5.573
222 HD11 ILE 30 HD11 ILE 30 -7.268 1.129 9.466
223 HD12 ILE 30 HD12 ILE 30 -8.407 1.955 8.400
224 HD13 ILE 30 HD13 ILE 30 -6.673 2.194 8.193
225 H VAL 31 H VAL 31 -5.238 -0.547 3.867
226 HA VAL 31 HA VAL 31 -6.189 0.979 1.540
227 HB VAL 31 HB VAL 31 -3.472 -0.294 1.853
228 HG11 VAL 31 HG11 VAL 31 -3.120 0.211 -0.546
229 HG12 VAL 31 HG12 VAL 31 -4.836 0.599 -0.692
230 HG13 VAL 31 HG13 VAL 31 -4.334 -1.042 -0.285
231 HG21 VAL 31 HG21 VAL 31 -2.667 1.888 1.188
232 HG22 VAL 31 HG22 VAL 31 -3.756 2.052 2.568
233 HG23 VAL 31 HG23 VAL 31 -4.324 2.445 0.940
234 H ASP 32 H ASP 32 -7.532 -0.146 0.360
235 HA ASP 32 HA ASP 32 -7.761 -3.021 0.709
236 HB2 ASP 32 HB2 ASP 32 -9.343 -1.301 -1.199
237 HB3 ASP 32 HB3 ASP 32 -9.800 -2.857 -0.515
238 H VAL 33 H VAL 33 -6.556 -4.341 -0.495
239 HA VAL 33 HA VAL 33 -5.352 -3.388 -2.955
240 HB VAL 33 HB VAL 33 -3.858 -4.629 -1.604
241 HG11 VAL 33 HG11 VAL 33 -6.041 -6.666 -1.405
242 HG12 VAL 33 HG12 VAL 33 -5.156 -5.842 -0.113
243 HG13 VAL 33 HG13 VAL 33 -4.355 -7.076 -1.085
244 HG21 VAL 33 HG21 VAL 33 -4.769 -6.494 -3.780
245 HG22 VAL 33 HG22 VAL 33 -3.165 -6.425 -3.050
246 HG23 VAL 33 HG23 VAL 33 -3.753 -5.074 -4.023
247 H MET 34 H MET 34 -6.104 -3.733 -4.907
248 HA MET 34 HA MET 34 -8.383 -5.558 -5.192
249 HB2 MET 34 HB2 MET 34 -9.293 -4.166 -6.807
250 HB3 MET 34 HB3 MET 34 -8.580 -3.038 -5.674
251 HG2 MET 34 HG2 MET 34 -7.896 -2.119 -7.635
252 HG3 MET 34 HG3 MET 34 -6.530 -3.184 -7.305
253 HE1 MET 34 HE1 MET 34 -7.065 -1.993 -10.153
254 HE2 MET 34 HE2 MET 34 -6.913 -3.391 -11.220
255 HE3 MET 34 HE3 MET 34 -5.768 -3.163 -9.898
256 H GLU 35 H GLU 35 -5.200 -4.796 -6.396
257 HA GLU 35 HA GLU 35 -5.295 -7.260 -7.991
258 HB2 GLU 35 HB2 GLU 35 -5.517 -5.236 -9.468
259 HB3 GLU 35 HB3 GLU 35 -3.926 -4.734 -8.918
260 HG2 GLU 35 HG2 GLU 35 -2.999 -6.839 -9.803
261 HG3 GLU 35 HG3 GLU 35 -4.592 -7.244 -10.433
262 H LYS 36 H LYS 36 -3.265 -8.302 -8.235
263 HA LYS 36 HA LYS 36 -1.272 -7.414 -6.272
264 HB2 LYS 36 HB2 LYS 36 -2.284 -10.250 -6.526
265 HB3 LYS 36 HB3 LYS 36 -1.074 -9.668 -5.393
266 HG2 LYS 36 HG2 LYS 36 -2.942 -8.091 -4.563
267 HG3 LYS 36 HG3 LYS 36 -4.022 -9.196 -5.406
268 HD2 LYS 36 HD2 LYS 36 -3.271 -11.052 -4.089
269 HD3 LYS 36 HD3 LYS 36 -2.003 -10.071 -3.350
270 HE2 LYS 36 HE2 LYS 36 -3.710 -8.655 -2.314
271 HE3 LYS 36 HE3 LYS 36 -4.973 -9.649 -3.043
272 HZ1 LYS 36 HZ1 LYS 36 -4.453 -10.194 -0.689
273 HZ2 LYS 36 HZ2 LYS 36 -2.914 -10.700 -1.177
274 HZ3 LYS 36 HZ3 LYS 36 -4.294 -11.509 -1.741
275 H CYS 37 H CYS 37 0.585 -7.164 -7.273
276 HA CYS 37 HA CYS 37 1.286 -8.581 -9.665
277 HB2 CYS 37 HB2 CYS 37 3.175 -7.090 -7.841
278 HB3 CYS 37 HB3 CYS 37 3.348 -7.394 -9.568
279 HG CYS 37 HG CYS 37 1.726 -4.929 -7.993
280 H ASP 38 H ASP 38 2.650 -10.330 -9.849
281 HA ASP 38 HA ASP 38 2.740 -12.071 -7.593
282 HB2 ASP 38 HB2 ASP 38 3.880 -13.641 -9.114
283 HB3 ASP 38 HB3 ASP 38 2.429 -12.963 -9.843
284 H ASP 39 H ASP 39 4.683 -9.530 -8.493
285 HA ASP 39 HA ASP 39 7.158 -10.636 -7.489
286 HB2 ASP 39 HB2 ASP 39 6.985 -8.881 -9.317
287 HB3 ASP 39 HB3 ASP 39 6.577 -7.730 -8.050
288 H GLY 40 H GLY 40 4.355 -9.238 -6.110
289 HA2 GLY 40 HA2 GLY 40 4.228 -9.766 -3.715
290 HA3 GLY 40 HA3 GLY 40 5.861 -9.143 -3.559
291 H TRP 41 H TRP 41 4.869 -6.936 -5.522
292 HA TRP 41 HA TRP 41 3.800 -5.234 -3.398
293 HB2 TRP 41 HB2 TRP 41 4.527 -4.240 -6.135
294 HB3 TRP 41 HB3 TRP 41 4.595 -3.397 -4.591
295 HD1 TRP 41 HD1 TRP 41 6.788 -4.893 -7.053
296 HE1 TRP 41 HE1 TRP 41 9.120 -5.394 -6.100
297 HE3 TRP 41 HE3 TRP 41 5.766 -4.424 -2.036
298 HZ2 TRP 41 HZ2 TRP 41 10.365 -5.566 -3.587
299 HZ3 TRP 41 HZ3 TRP 41 7.594 -4.778 -0.441
300 HH2 TRP 41 HH2 TRP 41 9.847 -5.338 -1.198
301 H PHE 42 H PHE 42 1.783 -4.197 -3.596
302 HA PHE 42 HA PHE 42 0.056 -5.627 -5.493
303 HB2 PHE 42 HB2 PHE 42 -0.588 -4.726 -2.686
304 HB3 PHE 42 HB3 PHE 42 -1.644 -5.634 -3.755
305 HD1 PHE 42 HD1 PHE 42 0.292 -7.609 -4.871
306 HD2 PHE 42 HD2 PHE 42 -0.268 -6.168 -0.900
307 HE1 PHE 42 HE1 PHE 42 1.199 -9.713 -3.980
308 HE2 PHE 42 HE2 PHE 42 0.649 -8.270 -0.008
309 HZ PHE 42 HZ PHE 42 1.383 -10.044 -1.548
310 H VAL 43 H VAL 43 -2.065 -4.570 -5.878
311 HA VAL 43 HA VAL 43 -1.765 -1.647 -6.060
312 HB VAL 43 HB VAL 43 -2.970 -3.666 -7.896
313 HG11 VAL 43 HG11 VAL 43 -3.960 -0.814 -7.771
314 HG12 VAL 43 HG12 VAL 43 -4.897 -2.226 -7.283
315 HG13 VAL 43 HG13 VAL 43 -4.406 -2.032 -8.967
316 HG21 VAL 43 HG21 VAL 43 -2.005 -2.154 -9.559
317 HG22 VAL 43 HG22 VAL 43 -0.812 -2.637 -8.346
318 HG23 VAL 43 HG23 VAL 43 -1.571 -1.046 -8.257
319 H GLY 44 H GLY 44 -3.201 -0.383 -5.051
320 HA2 GLY 44 HA2 GLY 44 -5.677 -1.521 -4.018
321 HA3 GLY 44 HA3 GLY 44 -4.465 -1.112 -2.816
322 H THR 45 H THR 45 -6.554 0.116 -2.288
323 HA THR 45 HA THR 45 -6.262 2.843 -3.315
324 HB THR 45 HB THR 45 -8.846 1.380 -2.784
325 HG1 THR 45 HG1 THR 45 -7.556 2.291 -5.139
326 HG21 THR 45 HG21 THR 45 -9.896 3.479 -3.693
327 HG22 THR 45 HG22 THR 45 -8.323 4.255 -3.503
328 HG23 THR 45 HG23 THR 45 -9.176 3.632 -2.091
329 H SER 46 H SER 46 -6.385 4.402 -1.745
330 HA SER 46 HA SER 46 -5.975 3.582 0.954
331 HB2 SER 46 HB2 SER 46 -4.870 5.576 0.079
332 HB3 SER 46 HB3 SER 46 -6.433 6.325 -0.233
333 HG SER 46 HG SER 46 -5.297 5.679 2.300
334 H ARG 47 H ARG 47 -7.436 3.345 2.547
335 HA ARG 47 HA ARG 47 -10.230 3.505 2.029
336 HB2 ARG 47 HB2 ARG 47 -9.085 1.939 3.634
337 HB3 ARG 47 HB3 ARG 47 -8.851 3.308 4.709
338 HG2 ARG 47 HG2 ARG 47 -11.380 3.588 4.639
339 HG3 ARG 47 HG3 ARG 47 -11.415 1.981 3.904
340 HD2 ARG 47 HD2 ARG 47 -10.064 1.173 5.859
341 HD3 ARG 47 HD3 ARG 47 -10.329 2.747 6.602
342 HE ARG 47 HE ARG 47 -12.665 1.176 5.779
343 HH11 ARG 47 HH11 ARG 47 -10.671 2.494 8.346
344 HH12 ARG 47 HH12 ARG 47 -11.824 2.139 9.594
345 HH21 ARG 47 HH22 ARG 47 -14.185 0.720 7.431
346 HH22 ARG 47 HH21 ARG 47 -13.806 1.124 9.081
347 H ARG 48 H ARG 48 -7.887 5.718 3.212
348 HA ARG 48 HA ARG 48 -9.768 7.407 4.620
349 HB2 ARG 48 HB2 ARG 48 -7.502 7.076 5.463
350 HB3 ARG 48 HB3 ARG 48 -6.833 7.729 3.979
351 HG2 ARG 48 HG2 ARG 48 -7.867 9.894 4.489
352 HG3 ARG 48 HG3 ARG 48 -8.454 9.222 6.015
353 HD2 ARG 48 HD2 ARG 48 -6.201 8.804 6.751
354 HD3 ARG 48 HD3 ARG 48 -5.565 9.314 5.189
355 HE ARG 48 HE ARG 48 -6.958 11.484 6.082
356 HH11 ARG 48 HH11 ARG 48 -4.401 9.491 7.381
357 HH12 ARG 48 HH12 ARG 48 -3.669 10.772 8.297
358 HH21 ARG 48 HH22 ARG 48 -6.012 13.194 7.284
359 HH22 ARG 48 HH21 ARG 48 -4.598 12.883 8.255
360 H THR 49 H THR 49 -7.693 7.703 1.737
361 HA THR 49 HA THR 49 -9.208 10.128 1.040
362 HB THR 49 HB THR 49 -7.062 10.903 1.288
363 HG1 THR 49 HG1 THR 49 -7.468 10.169 -1.401
364 HG21 THR 49 HG21 THR 49 -5.025 9.727 0.664
365 HG22 THR 49 HG22 THR 49 -5.983 8.393 0.020
366 HG23 THR 49 HG23 THR 49 -6.016 8.748 1.749
367 H LYS 50 H LYS 50 -8.907 6.958 0.215
368 HA LYS 50 HA LYS 50 -9.709 5.677 -1.454
369 HB2 LYS 50 HB2 LYS 50 -11.275 8.134 -2.244
370 HB3 LYS 50 HB3 LYS 50 -11.641 6.475 -2.686
371 HG2 LYS 50 HG2 LYS 50 -11.908 7.811 -0.018
372 HG3 LYS 50 HG3 LYS 50 -13.138 6.990 -0.972
373 HD2 LYS 50 HD2 LYS 50 -10.846 5.731 0.534
374 HD3 LYS 50 HD3 LYS 50 -12.563 5.613 0.912
375 HE2 LYS 50 HE2 LYS 50 -11.235 4.533 -1.568
376 HE3 LYS 50 HE3 LYS 50 -11.672 3.579 -0.155
377 HZ1 LYS 50 HZ1 LYS 50 -13.563 5.021 -1.943
378 HZ2 LYS 50 HZ2 LYS 50 -14.002 4.181 -0.536
379 HZ3 LYS 50 HZ3 LYS 50 -13.341 3.345 -1.849
380 H GLN 51 H GLN 51 -7.244 7.024 -2.008
381 HA GLN 51 HA GLN 51 -7.395 7.612 -4.855
382 HB2 GLN 51 HB2 GLN 51 -4.756 7.685 -4.385
383 HB3 GLN 51 HB3 GLN 51 -5.812 9.060 -4.105
384 HG2 GLN 51 HG2 GLN 51 -5.902 8.591 -1.767
385 HG3 GLN 51 HG3 GLN 51 -5.038 7.075 -1.989
386 HE21 GLN 51 HE22 GLN 51 -4.205 10.004 -3.691
387 HE22 GLN 51 HE21 GLN 51 -2.702 10.277 -2.883
388 H PHE 52 H PHE 52 -6.294 6.400 -6.419
389 HA PHE 52 HA PHE 52 -6.002 3.579 -5.618
390 HB2 PHE 52 HB2 PHE 52 -7.949 3.831 -6.966
391 HB3 PHE 52 HB3 PHE 52 -7.103 4.846 -8.123
392 HD1 PHE 52 HD2 PHE 52 -6.852 1.394 -6.694
393 HD2 PHE 52 HD1 PHE 52 -6.518 3.907 -10.112
394 HE1 PHE 52 HE2 PHE 52 -6.413 -0.574 -8.096
395 HE2 PHE 52 HE1 PHE 52 -6.075 1.943 -11.521
396 HZ PHE 52 HZ PHE 52 -6.022 -0.305 -10.514
397 H GLY 53 H GLY 53 -4.188 2.523 -6.093
398 HA2 GLY 53 HA2 GLY 53 -2.600 2.964 -8.368
399 HA3 GLY 53 HA3 GLY 53 -1.869 3.817 -7.016
400 H THR 54 H THR 54 -0.077 2.462 -7.203
401 HA THR 54 HA THR 54 -0.491 -0.312 -6.326
402 HB THR 54 HB THR 54 0.749 -0.289 -8.349
403 HG1 THR 54 HG1 THR 54 2.550 -0.529 -6.156
404 HG21 THR 54 HG21 THR 54 2.984 1.064 -8.357
405 HG22 THR 54 HG22 THR 54 2.170 2.036 -7.125
406 HG23 THR 54 HG23 THR 54 1.460 1.868 -8.733
407 H PHE 55 H PHE 55 0.629 -1.085 -4.521
408 HA PHE 55 HA PHE 55 2.319 0.777 -3.063
409 HB2 PHE 55 HB2 PHE 55 1.096 0.654 -1.005
410 HB3 PHE 55 HB3 PHE 55 -0.034 1.151 -2.254
411 HD1 PHE 55 HD1 PHE 55 -1.482 -0.704 -3.307
412 HD2 PHE 55 HD2 PHE 55 0.607 -1.135 0.373
413 HE1 PHE 55 HE1 PHE 55 -2.970 -2.568 -2.683
414 HE2 PHE 55 HE2 PHE 55 -0.870 -2.997 1.004
415 HZ PHE 55 HZ PHE 55 -2.663 -3.717 -0.526
416 HA PRO 56 HA PRO 56 4.514 -2.995 -2.297
417 HB2 PRO 56 HB3 PRO 56 5.648 -1.539 -0.002
418 HB3 PRO 56 HB2 PRO 56 6.464 -2.236 -1.403
419 HG2 PRO 56 HG2 PRO 56 6.192 0.419 -1.091
420 HG3 PRO 56 HG3 PRO 56 6.163 -0.349 -2.687
421 HD2 PRO 56 HD2 PRO 56 3.890 0.677 -1.033
422 HD3 PRO 56 HD3 PRO 56 4.129 0.741 -2.792
423 H GLY 57 H GLY 57 3.259 -4.569 -1.422
424 HA2 GLY 57 HA2 GLY 57 1.789 -4.200 1.023
425 HA3 GLY 57 HA3 GLY 57 1.924 -5.699 0.118
426 H ASN 58 H ASN 58 4.572 -3.770 1.260
427 HA ASN 58 HA ASN 58 5.549 -5.989 2.906
428 HB2 ASN 58 HB2 ASN 58 6.987 -5.016 1.078
429 HB3 ASN 58 HB3 ASN 58 6.969 -3.487 1.947
430 HD21 ASN 58 HD22 ASN 58 7.201 -6.690 3.411
431 HD22 ASN 58 HD21 ASN 58 8.804 -6.468 4.031
432 H TYR 59 H TYR 59 4.031 -2.989 3.029
433 HA TYR 59 HA TYR 59 4.945 -2.442 5.782
434 HB2 TYR 59 HB2 TYR 59 3.858 -0.437 3.801
435 HB3 TYR 59 HB3 TYR 59 4.627 -0.101 5.346
436 HD1 TYR 59 HD2 TYR 59 7.103 -0.912 5.574
437 HD2 TYR 59 HD1 TYR 59 5.111 -0.375 1.859
438 HE1 TYR 59 HE2 TYR 59 9.278 -0.771 4.437
439 HE2 TYR 59 HE1 TYR 59 7.276 -0.236 0.707
440 HH TYR 59 HH TYR 59 10.197 -1.134 2.173
441 H VAL 60 H VAL 60 2.649 -4.077 4.726
442 HA VAL 60 HA VAL 60 0.511 -2.713 6.165
443 HB VAL 60 HB VAL 60 -1.161 -3.381 4.422
444 HG11 VAL 60 HG11 VAL 60 0.924 -1.524 3.293
445 HG12 VAL 60 HG12 VAL 60 -0.114 -1.078 4.647
446 HG13 VAL 60 HG13 VAL 60 -0.826 -1.465 3.075
447 HG21 VAL 60 HG21 VAL 60 1.337 -3.998 2.854
448 HG22 VAL 60 HG22 VAL 60 -0.247 -3.747 2.116
449 HG23 VAL 60 HG23 VAL 60 0.000 -5.082 3.239
450 H LYS 61 H LYS 61 -1.235 -4.156 6.772
451 HA LYS 61 HA LYS 61 -0.258 -6.900 7.147
452 HB2 LYS 61 HB2 LYS 61 -0.972 -6.775 9.471
453 HB3 LYS 61 HB3 LYS 61 0.218 -5.540 9.103
454 HG2 LYS 61 HG2 LYS 61 -2.028 -4.125 8.680
455 HG3 LYS 61 HG3 LYS 61 -2.613 -5.273 9.883
456 HD2 LYS 61 HD2 LYS 61 -0.375 -3.284 10.123
457 HD3 LYS 61 HD3 LYS 61 -1.843 -3.401 11.091
458 HE2 LYS 61 HE2 LYS 61 0.455 -5.349 11.071
459 HE3 LYS 61 HE3 LYS 61 0.089 -4.179 12.339
460 HZ1 LYS 61 HZ1 LYS 61 -1.484 -6.581 11.589
461 HZ2 LYS 61 HZ2 LYS 61 -2.099 -5.351 12.586
462 HZ3 LYS 61 HZ3 LYS 61 -0.740 -6.237 13.071
463 HA PRO 62 HA PRO 62 -4.170 -8.130 5.557
464 HB2 PRO 62 HB3 PRO 62 -3.903 -10.465 7.348
465 HB3 PRO 62 HB2 PRO 62 -4.086 -10.407 5.595
466 HG2 PRO 62 HG2 PRO 62 -1.744 -11.028 6.725
467 HG3 PRO 62 HG3 PRO 62 -1.827 -10.064 5.238
468 HD2 PRO 62 HD2 PRO 62 -1.319 -9.181 8.048
469 HD3 PRO 62 HD3 PRO 62 -0.594 -8.608 6.532
470 H LEU 63 H LEU 63 -6.145 -7.553 6.104
471 HA LEU 63 HA LEU 63 -6.894 -7.480 8.944
472 HB2 LEU 63 HB2 LEU 63 -8.162 -6.171 6.534
473 HB3 LEU 63 HB3 LEU 63 -8.743 -6.022 8.181
474 HG LEU 63 HG LEU 63 -6.053 -5.057 7.219
475 HD11 LEU 63 HD11 LEU 63 -8.520 -3.467 7.889
476 HD12 LEU 63 HD12 LEU 63 -8.000 -3.868 6.254
477 HD13 LEU 63 HD13 LEU 63 -6.982 -2.852 7.276
478 HD21 LEU 63 HD21 LEU 63 -6.096 -5.662 9.591
479 HD22 LEU 63 HD22 LEU 63 -7.515 -4.641 9.828
480 HD23 LEU 63 HD23 LEU 63 -5.971 -3.915 9.379
481 H TYR 64 H TYR 64 -9.660 -7.495 8.588
482 HA TYR 64 HA TYR 64 -10.073 -10.324 7.964
483 HB2 TYR 64 HB2 TYR 64 -11.757 -8.345 9.507
484 HB3 TYR 64 HB3 TYR 64 -12.243 -10.005 9.183
485 HD1 TYR 64 HD2 TYR 64 -10.986 -11.878 10.209
486 HD2 TYR 64 HD1 TYR 64 -10.182 -7.828 11.227
487 HE1 TYR 64 HE2 TYR 64 -9.809 -12.629 12.230
488 HE2 TYR 64 HE1 TYR 64 -9.001 -8.564 13.256
489 HH TYR 64 HH TYR 64 -9.070 -10.633 14.778
490 H LEU 65 H LEU 65 -10.212 -7.557 6.333
491 HA LEU 65 HA LEU 65 -12.753 -8.011 4.989
492 HB2 LEU 65 HB2 LEU 65 -10.649 -5.893 4.535
493 HB3 LEU 65 HB3 LEU 65 -12.222 -5.947 3.771
494 HG LEU 65 HG LEU 65 -11.708 -5.544 6.719
495 HD11 LEU 65 HD11 LEU 65 -12.580 -3.285 6.308
496 HD12 LEU 65 HD12 LEU 65 -12.638 -3.635 4.580
497 HD13 LEU 65 HD13 LEU 65 -11.088 -3.599 5.421
498 HD21 LEU 65 HD21 LEU 65 -14.098 -5.137 6.896
499 HD22 LEU 65 HD22 LEU 65 -13.787 -6.763 6.289
500 HD23 LEU 65 HD23 LEU 65 -14.301 -5.493 5.180