Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
480667 | 2l2n RC | 17143 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H PHE 16 H PHE 16 1.956 0.240 -1.356
2 HA PHE 16 HA PHE 16 -0.913 0.560 -0.210
3 HB2 PHE 16 1HB PHE 16 -1.179 -1.742 0.501
4 HB3 PHE 16 2HB PHE 16 -0.502 -1.764 -1.143
5 HD1 PHE 16 HD1 PHE 16 0.163 -2.381 2.409
6 HD2 PHE 16 HD2 PHE 16 1.698 -2.567 -1.574
7 HE1 PHE 16 HE1 PHE 16 2.004 -3.835 3.188
8 HE2 PHE 16 HE2 PHE 16 3.539 -4.024 -0.799
9 HZ PHE 16 HZ PHE 16 3.692 -4.657 1.584
10 H LYS 17 H LYS 17 2.320 0.626 0.829
11 HA LYS 17 HA LYS 17 1.968 0.040 3.621
12 HB2 LYS 17 1HB LYS 17 3.992 1.737 2.155
13 HB3 LYS 17 2HB LYS 17 4.081 1.329 3.885
14 HG2 LYS 17 1HG LYS 17 4.212 -1.067 3.308
15 HG3 LYS 17 2HG LYS 17 4.144 -0.648 1.579
16 HD2 LYS 17 1HD LYS 17 6.230 0.655 1.825
17 HD3 LYS 17 2HD LYS 17 6.303 0.195 3.542
18 HE2 LYS 17 1HE LYS 17 6.444 -2.173 2.907
19 HE3 LYS 17 2HE LYS 17 6.362 -1.719 1.189
20 HZ1 LYS 17 3HZ LYS 17 8.503 -0.948 3.066
21 HZ2 LYS 17 1HZ LYS 17 8.622 -2.108 1.899
22 HZ3 LYS 17 2HZ LYS 17 8.428 -0.526 1.472
23 H SER 18 H SER 18 1.407 1.181 5.337
24 HA SER 18 HA SER 18 1.070 3.465 6.410
25 HB2 SER 18 1HB SER 18 1.688 4.571 4.387
26 HB3 SER 18 2HB SER 18 0.065 4.238 3.740
27 HG SER 18 HG SER 18 0.657 5.666 6.120
28 H ARG 19 H ARG 19 -1.504 4.425 4.770
29 HA ARG 19 HA ARG 19 -3.359 3.391 6.719
30 HB2 ARG 19 1HB ARG 19 -3.770 4.934 4.203
31 HB3 ARG 19 2HB ARG 19 -5.083 4.418 5.288
32 HG2 ARG 19 1HG ARG 19 -4.109 5.711 7.117
33 HG3 ARG 19 2HG ARG 19 -2.747 6.189 6.074
34 HD2 ARG 19 1HD ARG 19 -4.287 7.379 4.629
35 HD3 ARG 19 2HD ARG 19 -5.634 6.918 5.696
36 HE ARG 19 HE ARG 19 -3.768 8.445 7.286
37 HH11 ARG 19 1HH1 ARG 19 -5.846 8.966 4.535
38 HH12 ARG 19 2HH1 ARG 19 -6.049 10.644 4.997
39 HH21 ARG 19 1HH2 ARG 19 -3.984 10.367 7.824
40 HH22 ARG 19 2HH2 ARG 19 -4.986 11.445 6.873
41 H LEU 20 H LEU 20 -2.823 2.637 3.281
42 HA LEU 20 HA LEU 20 -5.048 0.816 3.097
43 HB2 LEU 20 1HB LEU 20 -2.522 1.173 1.634
44 HB3 LEU 20 2HB LEU 20 -3.705 -0.001 1.013
45 HG LEU 20 HG LEU 20 -4.136 2.997 1.319
46 HD11 LEU 20 1HD1 LEU 20 -4.199 2.987 -1.189
47 HD12 LEU 20 2HD1 LEU 20 -2.631 2.407 -0.579
48 HD13 LEU 20 3HD1 LEU 20 -3.839 1.245 -1.176
49 HD21 LEU 20 3HD2 LEU 20 -6.179 1.751 1.706
50 HD22 LEU 20 1HD2 LEU 20 -6.272 2.599 0.144
51 HD23 LEU 20 2HD2 LEU 20 -5.951 0.848 0.190
52 H GLN 21 H GLN 21 -1.644 0.384 3.946
53 HA GLN 21 HA GLN 21 -1.707 -2.478 4.119
54 HB2 GLN 21 1HB GLN 21 0.338 -1.090 4.153
55 HB3 GLN 21 2HB GLN 21 -0.132 -0.480 5.757
56 HG2 GLN 21 1HG GLN 21 0.118 -3.068 6.583
57 HG3 GLN 21 2HG GLN 21 0.518 -3.143 4.851
58 HE21 GLN 21 2HE2 GLN 21 2.303 -4.131 6.647
59 HE22 GLN 21 1HE2 GLN 21 3.682 -3.089 6.769
60 H GLU 22 H GLU 22 -2.302 0.024 6.593
61 HA GLU 22 HA GLU 22 -2.936 -1.835 8.690
62 HB2 GLU 22 1HB GLU 22 -3.725 1.036 8.194
63 HB3 GLU 22 2HB GLU 22 -4.149 0.132 9.668
64 HG2 GLU 22 1HG GLU 22 -1.693 -0.118 10.201
65 HG3 GLU 22 2HG GLU 22 -1.396 0.670 8.634
66 H TYR 23 H TYR 23 -4.880 -0.364 6.138
67 HA TYR 23 HA TYR 23 -7.434 -1.272 7.085
68 HB2 TYR 23 1HB TYR 23 -6.384 -0.748 4.299
69 HB3 TYR 23 2HB TYR 23 -8.085 -1.108 4.685
70 HD1 TYR 23 HD1 TYR 23 -7.468 0.574 7.454
71 HD2 TYR 23 HD2 TYR 23 -7.411 1.377 3.267
72 HE1 TYR 23 HE1 TYR 23 -7.871 2.974 7.917
73 HE2 TYR 23 HE2 TYR 23 -7.814 3.775 3.710
74 HH TYR 23 HH TYR 23 -8.137 5.378 5.296
75 H ALA 24 H ALA 24 -5.137 -2.758 4.787
76 HA ALA 24 HA ALA 24 -6.636 -5.109 4.309
77 HB1 ALA 24 3HB ALA 24 -3.620 -4.759 4.405
78 HB2 ALA 24 1HB ALA 24 -4.485 -6.122 3.658
79 HB3 ALA 24 2HB ALA 24 -4.663 -4.482 2.990
80 H GLN 25 H GLN 25 -4.349 -4.339 6.910
81 HA GLN 25 HA GLN 25 -4.368 -6.943 8.123
82 HB2 GLN 25 1HB GLN 25 -3.916 -4.168 9.233
83 HB3 GLN 25 2HB GLN 25 -3.729 -5.657 10.189
84 HG2 GLN 25 1HG GLN 25 -1.756 -6.331 8.485
85 HG3 GLN 25 2HG GLN 25 -2.397 -4.839 7.757
86 HE21 GLN 25 2HE2 GLN 25 0.327 -5.305 8.468
87 HE22 GLN 25 1HE2 GLN 25 0.748 -4.178 9.713
88 H LYS 26 H LYS 26 -6.356 -4.046 8.711
89 HA LYS 26 HA LYS 26 -7.955 -5.281 10.776
90 HB2 LYS 26 1HB LYS 26 -8.453 -2.959 8.912
91 HB3 LYS 26 2HB LYS 26 -9.565 -3.451 10.211
92 HG2 LYS 26 1HG LYS 26 -7.819 -3.017 11.883
93 HG3 LYS 26 2HG LYS 26 -6.690 -2.546 10.590
94 HD2 LYS 26 1HD LYS 26 -8.170 -0.691 9.959
95 HD3 LYS 26 2HD LYS 26 -9.320 -1.168 11.231
96 HE2 LYS 26 1HE LYS 26 -7.607 -0.758 12.941
97 HE3 LYS 26 2HE LYS 26 -6.449 -0.291 11.674
98 HZ1 LYS 26 3HZ LYS 26 -8.977 1.102 12.283
99 HZ2 LYS 26 1HZ LYS 26 -7.469 1.627 12.697
100 HZ3 LYS 26 2HZ LYS 26 -7.904 1.535 11.108
101 H TYR 27 H TYR 27 -8.025 -5.398 7.297
102 HA TYR 27 HA TYR 27 -10.742 -6.578 7.272
103 HB2 TYR 27 1HB TYR 27 -8.712 -6.151 5.069
104 HB3 TYR 27 2HB TYR 27 -10.382 -6.732 4.858
105 HD1 TYR 27 HD1 TYR 27 -11.105 -4.630 7.280
106 HD2 TYR 27 HD2 TYR 27 -9.433 -4.371 3.366
107 HE1 TYR 27 HE1 TYR 27 -11.899 -2.290 7.104
108 HE2 TYR 27 HE2 TYR 27 -10.218 -2.035 3.173
109 HH TYR 27 HH TYR 27 -11.316 -0.318 4.189
110 H LYS 28 H LYS 28 -7.879 -7.719 8.233
111 HA LYS 28 HA LYS 28 -6.879 -9.821 8.297
112 HB2 LYS 28 1HB LYS 28 -9.719 -10.700 7.755
113 HB3 LYS 28 2HB LYS 28 -8.397 -11.727 8.360
114 HG2 LYS 28 1HG LYS 28 -8.267 -10.323 10.398
115 HG3 LYS 28 2HG LYS 28 -9.634 -9.354 9.798
116 HD2 LYS 28 1HD LYS 28 -11.034 -11.409 9.766
117 HD3 LYS 28 2HD LYS 28 -9.670 -12.319 10.459
118 HE2 LYS 28 1HE LYS 28 -9.698 -10.897 12.443
119 HE3 LYS 28 2HE LYS 28 -11.015 -9.924 11.748
120 HZ1 LYS 28 3HZ LYS 28 -11.183 -12.785 12.450
121 HZ2 LYS 28 1HZ LYS 28 -11.839 -11.545 13.317
122 HZ3 LYS 28 2HZ LYS 28 -12.404 -11.883 11.804
123 H LEU 29 H LEU 29 -6.831 -8.457 5.785
124 HA LEU 29 HA LEU 29 -7.037 -10.693 3.829
125 HB2 LEU 29 1HB LEU 29 -6.311 -7.844 3.612
126 HB3 LEU 29 2HB LEU 29 -6.454 -8.857 2.156
127 HG LEU 29 HG LEU 29 -8.691 -8.065 4.062
128 HD11 LEU 29 1HD1 LEU 29 -9.609 -6.883 2.048
129 HD12 LEU 29 2HD1 LEU 29 -7.998 -6.265 2.482
130 HD13 LEU 29 3HD1 LEU 29 -8.181 -7.393 1.117
131 HD21 LEU 29 3HD2 LEU 29 -9.001 -10.340 3.281
132 HD22 LEU 29 1HD2 LEU 29 -10.193 -9.265 2.510
133 HD23 LEU 29 2HD2 LEU 29 -8.772 -9.823 1.593
134 HA PRO 30 HA PRO 30 -2.887 -11.752 3.792
135 HB2 PRO 30 1HB PRO 30 -3.229 -11.724 1.083
136 HB3 PRO 30 2HB PRO 30 -2.698 -12.906 2.071
137 HG2 PRO 30 1HG PRO 30 -5.177 -12.341 1.498
138 HG3 PRO 30 2HG PRO 30 -4.534 -13.831 1.661
139 HD2 PRO 30 1HD PRO 30 -6.076 -10.869 1.857
140 HD3 PRO 30 2HD PRO 30 -5.908 -12.305 2.614
141 H THR 31 H THR 31 -0.910 -10.810 3.840
142 HA THR 31 HA THR 31 -0.725 -8.018 3.531
143 HB THR 31 HB THR 31 1.529 -10.042 3.200
144 HG1 THR 31 HG1 THR 31 0.375 -10.234 5.199
145 HG21 THR 31 1HG2 THR 31 2.962 -8.180 3.961
146 HG22 THR 31 2HG2 THR 31 2.115 -7.760 2.453
147 HG23 THR 31 3HG2 THR 31 1.544 -7.106 4.006
148 HA PRO 32 HA PRO 32 -1.072 -7.454 -0.721
149 HB2 PRO 32 1HB PRO 32 0.026 -5.071 0.044
150 HB3 PRO 32 2HB PRO 32 -1.315 -5.388 -0.825
151 HG2 PRO 32 1HG PRO 32 -1.116 -5.308 1.772
152 HG3 PRO 32 2HG PRO 32 -2.356 -4.743 0.876
153 HD2 PRO 32 1HD PRO 32 -0.134 -6.341 2.826
154 HD3 PRO 32 2HD PRO 32 -1.686 -6.366 2.324
155 H VAL 33 H VAL 33 0.148 -7.873 -2.474
156 HA VAL 33 HA VAL 33 3.108 -7.957 -1.979
157 HB VAL 33 HB VAL 33 1.419 -9.176 -4.204
158 HG11 VAL 33 1HG1 VAL 33 3.503 -10.372 -4.786
159 HG12 VAL 33 2HG1 VAL 33 3.719 -8.610 -4.913
160 HG13 VAL 33 3HG1 VAL 33 4.368 -9.487 -3.507
161 HG21 VAL 33 3HG2 VAL 33 0.984 -10.253 -2.078
162 HG22 VAL 33 1HG2 VAL 33 1.922 -11.321 -3.148
163 HG23 VAL 33 2HG2 VAL 33 2.730 -10.471 -1.810
164 H TYR 34 H TYR 34 4.351 -6.442 -2.612
165 HA TYR 34 HA TYR 34 3.415 -4.624 -4.784
166 HB2 TYR 34 1HB TYR 34 4.148 -3.602 -2.695
167 HB3 TYR 34 2HB TYR 34 5.719 -4.430 -2.835
168 HD1 TYR 34 HD1 TYR 34 3.524 -1.927 -4.530
169 HD2 TYR 34 HD2 TYR 34 7.484 -3.430 -4.037
170 HE1 TYR 34 HE1 TYR 34 4.402 -0.024 -5.850
171 HE2 TYR 34 HE2 TYR 34 8.377 -1.538 -5.352
172 HH TYR 34 HH TYR 34 6.243 0.978 -6.724
173 H GLU 35 H GLU 35 3.993 -4.962 -6.768
174 HA GLU 35 HA GLU 35 6.751 -6.047 -7.255
175 HB2 GLU 35 1HB GLU 35 4.250 -6.284 -8.937
176 HB3 GLU 35 2HB GLU 35 5.880 -6.799 -9.436
177 HG2 GLU 35 1HG GLU 35 5.857 -8.469 -7.481
178 HG3 GLU 35 2HG GLU 35 4.215 -7.851 -7.189
179 H ILE 36 H ILE 36 8.068 -5.073 -8.677
180 HA ILE 36 HA ILE 36 7.102 -2.449 -9.790
181 HB ILE 36 HB ILE 36 8.656 -2.057 -7.895
182 HG12 ILE 36 1HG1 ILE 36 10.465 -0.883 -9.191
183 HG13 ILE 36 2HG1 ILE 36 9.695 -1.531 -10.658
184 HG21 ILE 36 1HG2 ILE 36 10.990 -2.855 -8.043
185 HG22 ILE 36 2HG2 ILE 36 9.851 -4.219 -7.978
186 HG23 ILE 36 3HG2 ILE 36 10.590 -3.751 -9.527
187 HD11 ILE 36 3HD1 ILE 36 8.370 0.272 -8.602
188 HD12 ILE 36 1HD1 ILE 36 8.951 0.774 -10.206
189 HD13 ILE 36 2HD1 ILE 36 7.599 -0.376 -10.069
190 H VAL 37 H VAL 37 7.206 -2.158 -11.829
191 HA VAL 37 HA VAL 37 9.053 -3.931 -13.428
192 HB VAL 37 HB VAL 37 6.365 -2.745 -14.239
193 HG11 VAL 37 1HG1 VAL 37 6.690 -4.075 -16.298
194 HG12 VAL 37 2HG1 VAL 37 7.990 -2.877 -16.097
195 HG13 VAL 37 3HG1 VAL 37 8.290 -4.589 -15.714
196 HG21 VAL 37 3HG2 VAL 37 6.077 -4.581 -12.684
197 HG22 VAL 37 1HG2 VAL 37 5.584 -5.059 -14.325
198 HG23 VAL 37 2HG2 VAL 37 7.145 -5.609 -13.669
199 H LYS 38 H LYS 38 10.637 -3.027 -14.384
200 HA LYS 38 HA LYS 38 10.354 -0.137 -15.151
201 HB2 LYS 38 1HB LYS 38 11.947 -0.518 -13.312
202 HB3 LYS 38 2HB LYS 38 12.846 -1.649 -14.351
203 HG2 LYS 38 1HG LYS 38 13.346 0.179 -15.918
204 HG3 LYS 38 2HG LYS 38 12.438 1.312 -14.890
205 HD2 LYS 38 1HD LYS 38 14.006 0.868 -13.033
206 HD3 LYS 38 2HD LYS 38 14.924 -0.236 -14.085
207 HE2 LYS 38 1HE LYS 38 15.450 1.592 -15.603
208 HE3 LYS 38 2HE LYS 38 14.453 2.709 -14.642
209 HZ1 LYS 38 3HZ LYS 38 16.895 1.346 -13.700
210 HZ2 LYS 38 1HZ LYS 38 16.788 2.935 -14.130
211 HZ3 LYS 38 2HZ LYS 38 15.971 2.382 -12.808
212 H GLU 39 H GLU 39 10.406 0.307 -17.196
213 HA GLU 39 HA GLU 39 11.830 -1.562 -19.046
214 HB2 GLU 39 1HB GLU 39 9.017 -0.504 -19.368
215 HB3 GLU 39 2HB GLU 39 9.950 -1.356 -20.622
216 HG2 GLU 39 1HG GLU 39 9.991 -3.412 -19.096
217 HG3 GLU 39 2HG GLU 39 9.052 -2.405 -17.971
218 H GLY 40 H GLY 40 12.047 -0.658 -21.251
219 HA2 GLY 40 1HA GLY 40 12.165 1.197 -22.735
220 HA3 GLY 40 2HA GLY 40 11.926 2.302 -21.361
221 HA PRO 41 HA PRO 41 16.372 2.098 -22.718
222 HB2 PRO 41 1HB PRO 41 15.871 4.776 -22.769
223 HB3 PRO 41 2HB PRO 41 16.661 3.826 -23.831
224 HG2 PRO 41 1HG PRO 41 14.097 4.283 -23.747
225 HG3 PRO 41 2HG PRO 41 15.018 4.167 -25.087
226 HD2 PRO 41 1HD PRO 41 12.928 3.776 -22.591
227 HD3 PRO 41 2HD PRO 41 13.475 3.055 -23.949
228 H SER 42 H SER 42 18.280 2.861 -21.588
229 HA SER 42 HA SER 42 17.882 2.906 -18.693
230 HB2 SER 42 1HB SER 42 20.150 3.066 -18.503
231 HB3 SER 42 2HB SER 42 19.741 1.876 -19.760
232 HG SER 42 HG SER 42 21.459 3.261 -20.373
233 H HIS 43 H HIS 43 17.955 5.323 -21.208
234 HA HIS 43 HA HIS 43 18.425 7.476 -19.180
235 HB2 HIS 43 1HB HIS 43 18.653 7.532 -22.224
236 HB3 HIS 43 2HB HIS 43 18.899 8.929 -21.149
237 HD2 HIS 43 HD2 HIS 43 21.066 6.243 -22.837
238 HE1 HIS 43 HE1 HIS 43 23.177 7.648 -19.429
239 HE2 HIS 43 HE2 HIS 43 23.277 6.276 -21.669
240 H LYS 44 H LYS 44 16.024 5.959 -21.049
241 HA LYS 44 HA LYS 44 14.126 8.097 -20.173
242 HB2 LYS 44 1HB LYS 44 14.162 6.715 -22.861
243 HB3 LYS 44 2HB LYS 44 12.845 7.742 -22.248
244 HG2 LYS 44 1HG LYS 44 14.410 9.659 -22.151
245 HG3 LYS 44 2HG LYS 44 15.693 8.625 -22.824
246 HD2 LYS 44 1HD LYS 44 14.296 8.250 -24.841
247 HD3 LYS 44 2HD LYS 44 13.070 9.353 -24.172
248 HE2 LYS 44 1HE LYS 44 14.735 11.171 -24.145
249 HE3 LYS 44 2HE LYS 44 15.941 10.068 -24.846
250 HZ1 LYS 44 3HZ LYS 44 13.414 10.886 -26.130
251 HZ2 LYS 44 1HZ LYS 44 14.915 11.446 -26.523
252 HZ3 LYS 44 2HZ LYS 44 14.532 9.862 -26.781
253 H SER 45 H SER 45 14.320 6.242 -18.466
254 HA SER 45 HA SER 45 12.909 3.720 -19.150
255 HB2 SER 45 1HB SER 45 13.399 3.018 -17.034
256 HB3 SER 45 2HB SER 45 14.848 3.735 -17.776
257 HG SER 45 HG SER 45 14.412 5.624 -16.548
258 H LEU 46 H LEU 46 10.963 3.050 -18.261
259 HA LEU 46 HA LEU 46 9.363 5.132 -16.811
260 HB2 LEU 46 1HB LEU 46 8.585 3.040 -18.734
261 HB3 LEU 46 2HB LEU 46 7.328 3.961 -17.876
262 HG LEU 46 HG LEU 46 9.365 5.082 -19.840
263 HD11 LEU 46 1HD1 LEU 46 7.354 5.516 -21.276
264 HD12 LEU 46 2HD1 LEU 46 7.541 3.780 -20.933
265 HD13 LEU 46 3HD1 LEU 46 6.329 4.737 -20.048
266 HD21 LEU 46 3HD2 LEU 46 8.863 6.670 -18.079
267 HD22 LEU 46 1HD2 LEU 46 8.121 7.204 -19.606
268 HD23 LEU 46 2HD2 LEU 46 7.116 6.455 -18.342
269 H PHE 47 H PHE 47 8.294 4.589 -15.025
270 HA PHE 47 HA PHE 47 8.824 1.824 -13.993
271 HB2 PHE 47 1HB PHE 47 8.354 4.473 -12.564
272 HB3 PHE 47 2HB PHE 47 8.392 2.898 -11.740
273 HD1 PHE 47 HD1 PHE 47 10.393 5.277 -13.748
274 HD2 PHE 47 HD2 PHE 47 10.402 1.876 -11.162
275 HE1 PHE 47 HE1 PHE 47 12.849 5.454 -13.526
276 HE2 PHE 47 HE2 PHE 47 12.857 2.051 -10.935
277 HZ PHE 47 HZ PHE 47 14.081 3.841 -12.119
278 H GLN 48 H GLN 48 7.264 0.517 -13.320
279 HA GLN 48 HA GLN 48 4.511 1.640 -13.046
280 HB2 GLN 48 1HB GLN 48 4.735 0.578 -15.267
281 HB3 GLN 48 2HB GLN 48 5.242 -0.929 -14.468
282 HG2 GLN 48 1HG GLN 48 2.771 -0.987 -13.373
283 HG3 GLN 48 2HG GLN 48 2.771 0.555 -14.259
284 HE21 GLN 48 2HE2 GLN 48 0.839 -1.466 -14.617
285 HE22 GLN 48 1HE2 GLN 48 1.000 -2.100 -16.221
286 H SER 49 H SER 49 3.484 1.068 -11.294
287 HA SER 49 HA SER 49 4.764 -1.019 -9.511
288 HB2 SER 49 1HB SER 49 3.217 1.416 -8.874
289 HB3 SER 49 2HB SER 49 3.639 0.123 -7.728
290 HG SER 49 HG SER 49 5.599 1.370 -9.324
291 H THR 50 H THR 50 3.636 -2.800 -9.063
292 HA THR 50 HA THR 50 0.660 -2.744 -9.460
293 HB THR 50 HB THR 50 2.562 -5.091 -9.868
294 HG1 THR 50 HG1 THR 50 0.985 -3.583 -11.720
295 HG21 THR 50 1HG2 THR 50 0.537 -6.281 -10.634
296 HG22 THR 50 2HG2 THR 50 0.372 -5.762 -8.939
297 HG23 THR 50 3HG2 THR 50 -0.452 -4.857 -10.231
298 H VAL 51 H VAL 51 -0.424 -2.851 -7.677
299 HA VAL 51 HA VAL 51 0.724 -4.414 -5.370
300 HB VAL 51 HB VAL 51 -1.439 -2.267 -5.414
301 HG11 VAL 51 1HG1 VAL 51 -1.337 -2.464 -2.952
302 HG12 VAL 51 2HG1 VAL 51 -1.826 -4.004 -3.697
303 HG13 VAL 51 3HG1 VAL 51 -0.160 -3.789 -3.106
304 HG21 VAL 51 3HG2 VAL 51 0.762 -1.322 -5.778
305 HG22 VAL 51 1HG2 VAL 51 0.158 -0.914 -4.155
306 HG23 VAL 51 2HG2 VAL 51 1.389 -2.185 -4.352
307 H ILE 52 H ILE 52 0.054 -6.345 -5.112
308 HA ILE 52 HA ILE 52 -2.714 -7.036 -6.056
309 HB ILE 52 HB ILE 52 -0.298 -8.827 -5.526
310 HG12 ILE 52 1HG1 ILE 52 -1.630 -8.170 -8.138
311 HG13 ILE 52 2HG1 ILE 52 -0.161 -7.376 -7.525
312 HG21 ILE 52 1HG2 ILE 52 -1.712 -10.614 -6.482
313 HG22 ILE 52 2HG2 ILE 52 -2.451 -9.930 -5.017
314 HG23 ILE 52 3HG2 ILE 52 -3.066 -9.469 -6.621
315 HD11 ILE 52 3HD1 ILE 52 -0.462 -10.339 -8.129
316 HD12 ILE 52 1HD1 ILE 52 0.394 -9.152 -9.140
317 HD13 ILE 52 2HD1 ILE 52 1.008 -9.545 -7.516
318 H LEU 53 H LEU 53 -4.229 -7.237 -4.682
319 HA LEU 53 HA LEU 53 -3.542 -8.261 -1.956
320 HB2 LEU 53 1HB LEU 53 -3.692 -6.020 -1.742
321 HB3 LEU 53 2HB LEU 53 -5.202 -5.786 -2.654
322 HG LEU 53 HG LEU 53 -6.384 -7.132 -0.887
323 HD11 LEU 53 1HD1 LEU 53 -5.221 -7.390 1.320
324 HD12 LEU 53 2HD1 LEU 53 -4.377 -8.287 0.036
325 HD13 LEU 53 3HD1 LEU 53 -3.737 -6.724 0.598
326 HD21 LEU 53 3HD2 LEU 53 -6.512 -4.711 -0.914
327 HD22 LEU 53 1HD2 LEU 53 -6.463 -5.298 0.766
328 HD23 LEU 53 2HD2 LEU 53 -5.005 -4.592 0.026
329 H ASP 54 H ASP 54 -4.500 -10.091 -1.632
330 HA ASP 54 HA ASP 54 -6.124 -11.757 -1.664
331 HB2 ASP 54 1HB ASP 54 -7.341 -9.681 -0.448
332 HB3 ASP 54 2HB ASP 54 -8.104 -9.641 -2.057
333 H GLY 55 H GLY 55 -4.969 -11.141 -4.152
334 HA2 GLY 55 1HA GLY 55 -5.328 -12.215 -6.210
335 HA3 GLY 55 2HA GLY 55 -7.048 -12.409 -5.800
336 H VAL 56 H VAL 56 -6.765 -9.364 -5.023
337 HA VAL 56 HA VAL 56 -7.659 -8.405 -7.708
338 HB VAL 56 HB VAL 56 -7.706 -7.029 -4.989
339 HG11 VAL 56 1HG1 VAL 56 -9.266 -5.469 -6.105
340 HG12 VAL 56 2HG1 VAL 56 -7.679 -5.474 -6.910
341 HG13 VAL 56 3HG1 VAL 56 -9.048 -6.348 -7.637
342 HG21 VAL 56 3HG2 VAL 56 -9.128 -8.990 -4.974
343 HG22 VAL 56 1HG2 VAL 56 -10.103 -7.502 -4.986
344 HG23 VAL 56 2HG2 VAL 56 -9.916 -8.454 -6.478
345 H ARG 57 H ARG 57 -6.529 -7.295 -9.038
346 HA ARG 57 HA ARG 57 -3.803 -6.482 -8.123
347 HB2 ARG 57 1HB ARG 57 -3.820 -8.071 -9.875
348 HB3 ARG 57 2HB ARG 57 -4.856 -7.018 -10.865
349 HG2 ARG 57 1HG ARG 57 -3.099 -5.380 -11.071
350 HG3 ARG 57 2HG ARG 57 -2.074 -6.271 -9.920
351 HD2 ARG 57 1HD ARG 57 -2.947 -7.267 -12.613
352 HD3 ARG 57 2HD ARG 57 -1.377 -6.519 -12.239
353 HE ARG 57 HE ARG 57 -1.486 -8.810 -10.566
354 HH11 ARG 57 1HH1 ARG 57 -1.827 -8.300 -13.998
355 HH12 ARG 57 2HH1 ARG 57 -1.155 -9.889 -14.307
356 HH21 ARG 57 1HH2 ARG 57 -0.723 -10.635 -10.903
357 HH22 ARG 57 2HH2 ARG 57 -0.526 -11.222 -12.542
358 H TYR 58 H TYR 58 -3.182 -4.479 -7.964
359 HA TYR 58 HA TYR 58 -4.855 -2.378 -9.309
360 HB2 TYR 58 1HB TYR 58 -3.184 -2.126 -6.802
361 HB3 TYR 58 2HB TYR 58 -4.192 -0.864 -7.552
362 HD1 TYR 58 HD2 TYR 58 -6.731 -1.379 -7.740
363 HD2 TYR 58 HD1 TYR 58 -4.100 -3.487 -5.129
364 HE1 TYR 58 HE2 TYR 58 -8.671 -2.114 -6.396
365 HE2 TYR 58 HE1 TYR 58 -6.033 -4.232 -3.770
366 HH TYR 58 HH TYR 58 -9.379 -3.303 -4.587
367 H ASN 59 H ASN 59 -3.878 -1.877 -11.124
368 HA ASN 59 HA ASN 59 -0.909 -1.644 -11.159
369 HB2 ASN 59 1HB ASN 59 -2.792 -1.491 -13.629
370 HB3 ASN 59 2HB ASN 59 -1.050 -1.336 -13.296
371 HD21 ASN 59 2HD2 ASN 59 -3.624 -3.432 -13.957
372 HD22 ASN 59 1HD2 ASN 59 -2.783 -4.934 -13.758
373 H SER 60 H SER 60 0.196 0.163 -11.293
374 HA SER 60 HA SER 60 -1.066 2.753 -10.774
375 HB2 SER 60 1HB SER 60 1.008 3.644 -10.754
376 HB3 SER 60 2HB SER 60 1.080 2.068 -9.932
377 HG SER 60 HG SER 60 1.743 2.337 -12.658
378 H LEU 61 H LEU 61 -0.463 4.650 -12.164
379 HA LEU 61 HA LEU 61 -1.243 4.173 -14.956
380 HB2 LEU 61 1HB LEU 61 -0.364 6.534 -13.427
381 HB3 LEU 61 2HB LEU 61 -0.968 6.723 -15.090
382 HG LEU 61 HG LEU 61 -2.551 5.757 -12.677
383 HD11 LEU 61 1HD1 LEU 61 -3.870 7.860 -13.043
384 HD12 LEU 61 2HD1 LEU 61 -2.158 8.219 -12.716
385 HD13 LEU 61 3HD1 LEU 61 -2.781 8.291 -14.382
386 HD21 LEU 61 3HD2 LEU 61 -3.234 4.585 -14.686
387 HD22 LEU 61 1HD2 LEU 61 -4.497 5.739 -14.198
388 HD23 LEU 61 2HD2 LEU 61 -3.415 6.125 -15.559
389 HA PRO 62 HA PRO 62 2.729 4.112 -16.603
390 HB2 PRO 62 1HB PRO 62 2.150 4.546 -18.988
391 HB3 PRO 62 2HB PRO 62 1.664 3.195 -18.217
392 HG2 PRO 62 1HG PRO 62 0.191 5.249 -18.855
393 HG3 PRO 62 2HG PRO 62 -0.242 3.679 -18.943
394 HD2 PRO 62 1HD PRO 62 -1.032 4.791 -16.907
395 HD3 PRO 62 2HD PRO 62 -0.449 3.274 -16.760
396 H GLY 63 H GLY 63 4.423 5.345 -17.634
397 HA2 GLY 63 1HA GLY 63 5.195 7.307 -18.728
398 HA3 GLY 63 2HA GLY 63 3.671 8.128 -18.316
399 H PHE 64 H PHE 64 5.373 6.287 -15.890
400 HA PHE 64 HA PHE 64 6.151 8.832 -14.525
401 HB2 PHE 64 1HB PHE 64 5.707 5.993 -13.527
402 HB3 PHE 64 2HB PHE 64 6.475 7.256 -12.539
403 HD1 PHE 64 HD2 PHE 64 5.011 9.598 -12.799
404 HD2 PHE 64 HD1 PHE 64 3.569 5.579 -12.930
405 HE1 PHE 64 HE2 PHE 64 2.785 10.375 -12.056
406 HE2 PHE 64 HE1 PHE 64 1.341 6.353 -12.190
407 HZ PHE 64 HZ PHE 64 0.949 8.751 -11.753
408 H PHE 65 H PHE 65 8.164 9.346 -13.989
409 HA PHE 65 HA PHE 65 10.310 7.524 -15.030
410 HB2 PHE 65 1HB PHE 65 10.260 10.557 -14.720
411 HB3 PHE 65 2HB PHE 65 11.687 9.609 -15.196
412 HD1 PHE 65 HD2 PHE 65 11.776 8.495 -17.355
413 HD2 PHE 65 HD1 PHE 65 8.496 10.995 -16.241
414 HE1 PHE 65 HE2 PHE 65 11.092 8.650 -19.726
415 HE2 PHE 65 HE1 PHE 65 7.807 11.150 -18.611
416 HZ PHE 65 HZ PHE 65 9.106 9.977 -20.353
417 H ASN 66 H ASN 66 8.968 7.460 -12.377
418 HA ASN 66 HA ASN 66 11.438 7.331 -10.784
419 HB2 ASN 66 1HB ASN 66 10.377 9.864 -10.484
420 HB3 ASN 66 2HB ASN 66 9.196 8.735 -9.777
421 HD21 ASN 66 2HD2 ASN 66 9.706 10.207 -7.927
422 HD22 ASN 66 1HD2 ASN 66 10.989 9.722 -6.870
423 H ARG 67 H ARG 67 11.391 5.829 -9.269
424 HA ARG 67 HA ARG 67 9.288 3.879 -9.352
425 HB2 ARG 67 1HB ARG 67 11.573 3.336 -8.844
426 HB3 ARG 67 2HB ARG 67 11.433 4.212 -7.302
427 HG2 ARG 67 1HG ARG 67 9.678 2.643 -6.577
428 HG3 ARG 67 2HG ARG 67 9.842 1.759 -8.114
429 HD2 ARG 67 1HD ARG 67 10.964 0.582 -6.391
430 HD3 ARG 67 2HD ARG 67 12.160 1.251 -7.525
431 HE ARG 67 HE ARG 67 13.049 2.538 -5.628
432 HH11 ARG 67 1HH1 ARG 67 9.869 1.360 -4.815
433 HH12 ARG 67 2HH1 ARG 67 10.102 1.862 -3.152
434 HH21 ARG 67 1HH2 ARG 67 13.327 3.126 -3.730
435 HH22 ARG 67 2HH2 ARG 67 12.073 2.870 -2.532
436 H LYS 68 H LYS 68 10.002 6.499 -7.076
437 HA LYS 68 HA LYS 68 7.969 5.778 -5.164
438 HB2 LYS 68 1HB LYS 68 9.293 8.405 -5.844
439 HB3 LYS 68 2HB LYS 68 8.152 8.183 -4.496
440 HG2 LYS 68 1HG LYS 68 9.674 6.536 -3.478
441 HG3 LYS 68 2HG LYS 68 10.816 6.761 -4.825
442 HD2 LYS 68 1HD LYS 68 11.047 9.145 -4.218
443 HD3 LYS 68 2HD LYS 68 9.928 8.898 -2.856
444 HE2 LYS 68 1HE LYS 68 11.474 7.277 -1.863
445 HE3 LYS 68 2HE LYS 68 12.587 7.485 -3.235
446 HZ1 LYS 68 3HZ LYS 68 11.817 9.591 -1.317
447 HZ2 LYS 68 1HZ LYS 68 13.260 8.793 -1.337
448 HZ3 LYS 68 2HZ LYS 68 12.849 9.785 -2.590
449 H ALA 69 H ALA 69 7.945 7.906 -8.008
450 HA ALA 69 HA ALA 69 5.311 8.917 -7.622
451 HB1 ALA 69 3HB ALA 69 6.830 8.432 -10.207
452 HB2 ALA 69 1HB ALA 69 5.383 9.451 -10.027
453 HB3 ALA 69 2HB ALA 69 6.898 9.905 -9.211
454 H ALA 70 H ALA 70 6.467 6.066 -9.421
455 HA ALA 70 HA ALA 70 3.874 5.263 -10.335
456 HB1 ALA 70 3HB ALA 70 6.361 3.597 -9.824
457 HB2 ALA 70 1HB ALA 70 4.938 3.081 -10.757
458 HB3 ALA 70 2HB ALA 70 5.947 4.424 -11.344
459 H GLU 71 H GLU 71 5.731 4.487 -7.413
460 HA GLU 71 HA GLU 71 3.954 2.467 -6.420
461 HB2 GLU 71 1HB GLU 71 6.240 2.853 -5.603
462 HB3 GLU 71 2HB GLU 71 5.713 4.405 -4.908
463 HG2 GLU 71 1HG GLU 71 4.153 3.133 -3.355
464 HG3 GLU 71 2HG GLU 71 4.731 1.674 -4.192
465 H GLN 72 H GLN 72 4.064 5.982 -5.851
466 HA GLN 72 HA GLN 72 1.843 6.052 -4.045
467 HB2 GLN 72 1HB GLN 72 2.987 8.075 -5.975
468 HB3 GLN 72 2HB GLN 72 1.640 8.434 -4.869
469 HG2 GLN 72 1HG GLN 72 3.351 7.943 -2.852
470 HG3 GLN 72 2HG GLN 72 4.315 7.508 -4.282
471 HE21 GLN 72 2HE2 GLN 72 5.093 9.365 -2.266
472 HE22 GLN 72 1HE2 GLN 72 5.218 10.928 -3.003
473 H SER 73 H SER 73 1.998 6.352 -7.587
474 HA SER 73 HA SER 73 -0.759 6.826 -8.161
475 HB2 SER 73 1HB SER 73 0.923 7.035 -9.763
476 HB3 SER 73 2HB SER 73 1.233 5.284 -9.711
477 HG SER 73 HG SER 73 -1.217 6.530 -10.417
478 H ALA 74 H ALA 74 1.040 3.743 -7.768
479 HA ALA 74 HA ALA 74 -1.159 2.005 -8.197
480 HB1 ALA 74 3HB ALA 74 1.273 1.609 -6.420
481 HB2 ALA 74 1HB ALA 74 0.180 0.326 -6.988
482 HB3 ALA 74 2HB ALA 74 1.169 1.233 -8.157
483 H ALA 75 H ALA 75 0.066 3.450 -5.178
484 HA ALA 75 HA ALA 75 -1.836 2.199 -3.457
485 HB1 ALA 75 3HB ALA 75 -0.440 4.881 -3.170
486 HB2 ALA 75 1HB ALA 75 -1.275 3.999 -1.871
487 HB3 ALA 75 2HB ALA 75 0.185 3.309 -2.618
488 H GLU 76 H GLU 76 -1.948 5.241 -5.284
489 HA GLU 76 HA GLU 76 -4.443 6.179 -4.237
490 HB2 GLU 76 1HB GLU 76 -2.880 7.545 -5.541
491 HB3 GLU 76 2HB GLU 76 -3.231 6.557 -6.980
492 HG2 GLU 76 1HG GLU 76 -4.583 8.613 -7.185
493 HG3 GLU 76 2HG GLU 76 -5.580 7.201 -6.766
494 H VAL 77 H VAL 77 -3.707 4.053 -6.989
495 HA VAL 77 HA VAL 77 -6.433 3.733 -7.885
496 HB VAL 77 HB VAL 77 -4.019 1.883 -8.059
497 HG11 VAL 77 1HG1 VAL 77 -5.316 0.673 -9.781
498 HG12 VAL 77 2HG1 VAL 77 -6.129 0.603 -8.200
499 HG13 VAL 77 3HG1 VAL 77 -6.720 1.717 -9.457
500 HG21 VAL 77 3HG2 VAL 77 -3.731 3.974 -9.249
501 HG22 VAL 77 1HG2 VAL 77 -3.930 2.621 -10.387
502 HG23 VAL 77 2HG2 VAL 77 -5.285 3.735 -10.084
503 H ALA 78 H ALA 78 -4.506 1.853 -5.558
504 HA ALA 78 HA ALA 78 -6.566 -0.035 -4.989
505 HB1 ALA 78 3HB ALA 78 -4.328 0.980 -3.204
506 HB2 ALA 78 1HB ALA 78 -5.298 -0.484 -2.925
507 HB3 ALA 78 2HB ALA 78 -4.226 -0.385 -4.342
508 H LEU 79 H LEU 79 -5.838 3.149 -3.611
509 HA LEU 79 HA LEU 79 -7.777 2.927 -1.469
510 HB2 LEU 79 1HB LEU 79 -5.931 4.307 -1.370
511 HB3 LEU 79 2HB LEU 79 -6.395 5.360 -2.727
512 HG LEU 79 HG LEU 79 -8.441 6.015 -1.423
513 HD11 LEU 79 1HD1 LEU 79 -8.419 5.566 1.045
514 HD12 LEU 79 2HD1 LEU 79 -8.488 4.052 0.113
515 HD13 LEU 79 3HD1 LEU 79 -6.951 4.582 0.837
516 HD21 LEU 79 3HD2 LEU 79 -6.500 7.465 -1.513
517 HD22 LEU 79 1HD2 LEU 79 -7.253 7.558 0.097
518 HD23 LEU 79 2HD2 LEU 79 -5.762 6.612 -0.136
519 H ARG 80 H ARG 80 -7.859 4.342 -4.723
520 HA ARG 80 HA ARG 80 -10.506 5.445 -4.483
521 HB2 ARG 80 1HB ARG 80 -8.896 4.650 -6.860
522 HB3 ARG 80 2HB ARG 80 -10.523 5.363 -6.946
523 HG2 ARG 80 1HG ARG 80 -9.729 7.376 -5.819
524 HG3 ARG 80 2HG ARG 80 -8.107 6.660 -5.646
525 HD2 ARG 80 1HD ARG 80 -7.875 6.633 -8.059
526 HD3 ARG 80 2HD ARG 80 -9.485 7.374 -8.216
527 HE ARG 80 HE ARG 80 -7.859 9.205 -6.691
528 HH11 ARG 80 1HH1 ARG 80 -7.885 7.855 -9.906
529 HH12 ARG 80 2HH1 ARG 80 -7.138 9.312 -10.530
530 HH21 ARG 80 1HH2 ARG 80 -6.996 10.877 -7.390
531 HH22 ARG 80 2HH2 ARG 80 -6.630 11.036 -9.096
532 H GLU 81 H GLU 81 -9.325 2.296 -5.637
533 HA GLU 81 HA GLU 81 -11.956 1.313 -6.342
534 HB2 GLU 81 1HB GLU 81 -9.359 -0.074 -5.670
535 HB3 GLU 81 2HB GLU 81 -10.832 -0.915 -6.209
536 HG2 GLU 81 1HG GLU 81 -9.200 1.098 -7.871
537 HG3 GLU 81 2HG GLU 81 -9.325 -0.672 -8.002
538 H LEU 82 H LEU 82 -10.108 1.415 -3.360
539 HA LEU 82 HA LEU 82 -11.864 -0.331 -1.867
540 HB2 LEU 82 1HB LEU 82 -9.709 0.163 -1.213
541 HB3 LEU 82 2HB LEU 82 -9.968 1.906 -0.967
542 HG LEU 82 HG LEU 82 -11.648 1.329 0.812
543 HD11 LEU 82 1HD1 LEU 82 -11.556 -0.990 1.764
544 HD12 LEU 82 2HD1 LEU 82 -12.111 -1.007 0.074
545 HD13 LEU 82 3HD1 LEU 82 -10.436 -1.462 0.465
546 HD21 LEU 82 3HD2 LEU 82 -9.396 2.015 1.394
547 HD22 LEU 82 1HD2 LEU 82 -9.965 0.773 2.533
548 HD23 LEU 82 2HD2 LEU 82 -8.816 0.340 1.244
549 H ALA 83 H ALA 83 -11.790 3.185 -2.386
550 HA ALA 83 HA ALA 83 -14.058 3.748 -0.730
551 HB1 ALA 83 3HB ALA 83 -13.006 5.235 -3.160
552 HB2 ALA 83 1HB ALA 83 -14.166 5.872 -1.972
553 HB3 ALA 83 2HB ALA 83 -12.501 5.491 -1.473
554 H LYS 84 H LYS 84 -13.742 2.739 -4.097
555 HA LYS 84 HA LYS 84 -16.525 3.095 -4.786
556 HB2 LYS 84 1HB LYS 84 -14.351 1.300 -5.866
557 HB3 LYS 84 2HB LYS 84 -15.987 1.404 -6.559
558 HG2 LYS 84 1HG LYS 84 -15.646 3.779 -7.055
559 HG3 LYS 84 2HG LYS 84 -14.025 3.710 -6.323
560 HD2 LYS 84 1HD LYS 84 -13.362 2.020 -8.015
561 HD3 LYS 84 2HD LYS 84 -14.967 2.175 -8.769
562 HE2 LYS 84 1HE LYS 84 -14.545 4.541 -9.225
563 HE3 LYS 84 2HE LYS 84 -12.958 4.423 -8.431
564 HZ1 LYS 84 3HZ LYS 84 -13.770 2.964 -10.863
565 HZ2 LYS 84 1HZ LYS 84 -12.770 4.274 -10.820
566 HZ3 LYS 84 2HZ LYS 84 -12.298 2.854 -10.126
567 H SER 85 H SER 85 -14.688 0.393 -3.407
568 HA SER 85 HA SER 85 -16.971 -1.479 -3.441
569 HB2 SER 85 1HB SER 85 -15.612 -2.962 -2.371
570 HB3 SER 85 2HB SER 85 -14.713 -2.190 -3.696
571 HG SER 85 HG SER 85 -14.521 -1.537 -0.941
572 H SER 86 H SER 86 -15.724 1.027 -1.338
573 HA SER 86 HA SER 86 -16.676 0.176 1.237
574 HB2 SER 86 1HB SER 86 -15.138 1.901 0.995
575 HB3 SER 86 2HB SER 86 -16.335 2.901 0.141
576 HG SER 86 HG SER 86 -16.209 3.382 2.376
Start of MODEL 2
1 H PHE 16 H PHE 16 1.278 3.783 -0.755
2 HA PHE 16 HA PHE 16 -1.048 2.331 0.689
3 HB2 PHE 16 1HB PHE 16 -0.659 0.172 -0.550
4 HB3 PHE 16 2HB PHE 16 -1.001 1.550 -1.620
5 HD1 PHE 16 HD1 PHE 16 1.522 -0.838 -0.476
6 HD2 PHE 16 HD2 PHE 16 0.676 2.447 -3.074
7 HE1 PHE 16 HE1 PHE 16 3.583 -1.320 -1.754
8 HE2 PHE 16 HE2 PHE 16 2.735 1.966 -4.355
9 HZ PHE 16 HZ PHE 16 4.189 0.082 -3.694
10 H LYS 17 H LYS 17 2.409 2.341 0.716
11 HA LYS 17 HA LYS 17 2.823 0.053 2.412
12 HB2 LYS 17 1HB LYS 17 4.395 2.608 2.056
13 HB3 LYS 17 2HB LYS 17 4.945 1.205 3.004
14 HG2 LYS 17 1HG LYS 17 4.877 -0.187 0.966
15 HG3 LYS 17 2HG LYS 17 4.354 1.229 0.024
16 HD2 LYS 17 1HD LYS 17 6.450 2.393 0.641
17 HD3 LYS 17 2HD LYS 17 6.975 0.945 1.533
18 HE2 LYS 17 1HE LYS 17 6.895 -0.368 -0.543
19 HE3 LYS 17 2HE LYS 17 6.367 1.077 -1.437
20 HZ1 LYS 17 3HZ LYS 17 8.944 0.776 -0.034
21 HZ2 LYS 17 1HZ LYS 17 8.728 0.702 -1.668
22 HZ3 LYS 17 2HZ LYS 17 8.456 2.116 -0.863
23 H SER 18 H SER 18 2.713 -0.291 4.507
24 HA SER 18 HA SER 18 2.461 0.214 6.847
25 HB2 SER 18 1HB SER 18 3.936 2.069 6.349
26 HB3 SER 18 2HB SER 18 2.485 3.069 6.101
27 HG SER 18 HG SER 18 3.131 1.607 8.447
28 H ARG 19 H ARG 19 0.740 2.864 5.159
29 HA ARG 19 HA ARG 19 -1.481 2.772 6.970
30 HB2 ARG 19 1HB ARG 19 -0.834 4.750 5.770
31 HB3 ARG 19 2HB ARG 19 -1.357 3.992 4.249
32 HG2 ARG 19 1HG ARG 19 -3.657 3.887 5.068
33 HG3 ARG 19 2HG ARG 19 -3.149 4.587 6.624
34 HD2 ARG 19 1HD ARG 19 -2.488 6.624 5.457
35 HD3 ARG 19 2HD ARG 19 -3.086 5.920 3.936
36 HE ARG 19 HE ARG 19 -5.277 6.061 5.865
37 HH11 ARG 19 1HH1 ARG 19 -3.328 8.134 3.847
38 HH12 ARG 19 2HH1 ARG 19 -4.655 9.273 3.725
39 HH21 ARG 19 1HH2 ARG 19 -6.804 7.360 5.740
40 HH22 ARG 19 2HH2 ARG 19 -6.638 8.832 4.805
41 H LEU 20 H LEU 20 -1.578 2.031 3.470
42 HA LEU 20 HA LEU 20 -4.191 0.808 3.766
43 HB2 LEU 20 1HB LEU 20 -2.144 0.881 1.653
44 HB3 LEU 20 2HB LEU 20 -3.715 0.128 1.298
45 HG LEU 20 HG LEU 20 -3.136 3.047 1.913
46 HD11 LEU 20 1HD1 LEU 20 -4.196 3.405 -0.332
47 HD12 LEU 20 2HD1 LEU 20 -2.782 2.331 -0.447
48 HD13 LEU 20 3HD1 LEU 20 -4.425 1.646 -0.486
49 HD21 LEU 20 3HD2 LEU 20 -5.131 2.381 3.120
50 HD22 LEU 20 1HD2 LEU 20 -5.571 3.429 1.750
51 HD23 LEU 20 2HD2 LEU 20 -5.823 1.671 1.641
52 H GLN 21 H GLN 21 -0.899 -0.407 3.711
53 HA GLN 21 HA GLN 21 -1.535 -3.197 3.560
54 HB2 GLN 21 1HB GLN 21 0.677 -1.629 4.880
55 HB3 GLN 21 2HB GLN 21 0.580 -3.403 4.976
56 HG2 GLN 21 1HG GLN 21 0.829 -3.437 2.308
57 HG3 GLN 21 2HG GLN 21 0.656 -1.699 2.642
58 HE21 GLN 21 2HE2 GLN 21 2.785 -2.991 1.187
59 HE22 GLN 21 1HE2 GLN 21 4.253 -2.691 2.057
60 H GLU 22 H GLU 22 -1.323 -0.986 6.341
61 HA GLU 22 HA GLU 22 -2.005 -2.986 8.305
62 HB2 GLU 22 1HB GLU 22 -0.949 -0.839 8.839
63 HB3 GLU 22 2HB GLU 22 -2.428 0.008 8.324
64 HG2 GLU 22 1HG GLU 22 -3.689 -1.101 10.222
65 HG3 GLU 22 2HG GLU 22 -2.168 -1.957 10.562
66 H TYR 23 H TYR 23 -3.949 -0.779 6.331
67 HA TYR 23 HA TYR 23 -6.485 -1.431 7.500
68 HB2 TYR 23 1HB TYR 23 -5.738 -0.617 4.685
69 HB3 TYR 23 2HB TYR 23 -7.402 -0.719 5.310
70 HD1 TYR 23 HD1 TYR 23 -5.549 0.325 8.020
71 HD2 TYR 23 HD2 TYR 23 -6.942 1.802 4.271
72 HE1 TYR 23 HE1 TYR 23 -5.370 2.642 8.877
73 HE2 TYR 23 HE2 TYR 23 -6.770 4.121 5.108
74 HH TYR 23 HH TYR 23 -5.645 4.850 8.420
75 H ALA 24 H ALA 24 -4.688 -2.909 4.804
76 HA ALA 24 HA ALA 24 -6.601 -4.865 4.107
77 HB1 ALA 24 3HB ALA 24 -3.573 -5.091 4.114
78 HB2 ALA 24 1HB ALA 24 -4.693 -6.160 3.240
79 HB3 ALA 24 2HB ALA 24 -4.575 -4.441 2.794
80 H GLN 25 H GLN 25 -4.133 -4.907 6.663
81 HA GLN 25 HA GLN 25 -4.708 -7.579 7.571
82 HB2 GLN 25 1HB GLN 25 -3.590 -5.144 8.973
83 HB3 GLN 25 2HB GLN 25 -3.693 -6.761 9.709
84 HG2 GLN 25 1HG GLN 25 -2.000 -7.581 7.776
85 HG3 GLN 25 2HG GLN 25 -2.319 -5.892 7.319
86 HE21 GLN 25 2HE2 GLN 25 0.258 -7.027 7.741
87 HE22 GLN 25 1HE2 GLN 25 0.974 -6.231 9.104
88 H LYS 26 H LYS 26 -5.995 -4.398 8.501
89 HA LYS 26 HA LYS 26 -7.783 -5.408 10.522
90 HB2 LYS 26 1HB LYS 26 -7.884 -2.956 8.761
91 HB3 LYS 26 2HB LYS 26 -9.024 -3.289 10.086
92 HG2 LYS 26 1HG LYS 26 -7.200 -3.226 11.710
93 HG3 LYS 26 2HG LYS 26 -6.020 -2.974 10.401
94 HD2 LYS 26 1HD LYS 26 -7.073 -0.839 9.833
95 HD3 LYS 26 2HD LYS 26 -8.303 -1.095 11.094
96 HE2 LYS 26 1HE LYS 26 -6.549 -1.089 12.813
97 HE3 LYS 26 2HE LYS 26 -5.314 -0.843 11.556
98 HZ1 LYS 26 3HZ LYS 26 -7.502 1.029 12.200
99 HZ2 LYS 26 1HZ LYS 26 -5.920 1.221 12.625
100 HZ3 LYS 26 2HZ LYS 26 -6.358 1.258 11.034
101 H TYR 27 H TYR 27 -7.901 -5.398 7.049
102 HA TYR 27 HA TYR 27 -10.796 -6.064 7.046
103 HB2 TYR 27 1HB TYR 27 -8.795 -5.864 4.787
104 HB3 TYR 27 2HB TYR 27 -10.554 -6.090 4.627
105 HD1 TYR 27 HD1 TYR 27 -10.815 -4.066 7.176
106 HD2 TYR 27 HD2 TYR 27 -9.146 -3.857 3.257
107 HE1 TYR 27 HE1 TYR 27 -11.133 -1.609 7.180
108 HE2 TYR 27 HE2 TYR 27 -9.457 -1.405 3.244
109 HH TYR 27 HH TYR 27 -10.189 0.416 4.398
110 H LYS 28 H LYS 28 -8.253 -7.743 7.951
111 HA LYS 28 HA LYS 28 -7.672 -9.994 7.940
112 HB2 LYS 28 1HB LYS 28 -10.547 -10.320 7.071
113 HB3 LYS 28 2HB LYS 28 -9.489 -11.594 7.720
114 HG2 LYS 28 1HG LYS 28 -9.347 -10.351 9.861
115 HG3 LYS 28 2HG LYS 28 -10.469 -9.133 9.208
116 HD2 LYS 28 1HD LYS 28 -12.170 -10.916 8.893
117 HD3 LYS 28 2HD LYS 28 -11.052 -12.084 9.633
118 HE2 LYS 28 1HE LYS 28 -11.046 -10.780 11.708
119 HE3 LYS 28 2HE LYS 28 -12.140 -9.587 10.971
120 HZ1 LYS 28 3HZ LYS 28 -12.775 -12.426 11.455
121 HZ2 LYS 28 1HZ LYS 28 -13.331 -11.155 12.347
122 HZ3 LYS 28 2HZ LYS 28 -13.791 -11.321 10.771
123 H LEU 29 H LEU 29 -7.061 -8.524 5.607
124 HA LEU 29 HA LEU 29 -7.467 -10.538 3.444
125 HB2 LEU 29 1HB LEU 29 -6.218 -7.868 3.510
126 HB3 LEU 29 2HB LEU 29 -6.447 -8.739 1.977
127 HG LEU 29 HG LEU 29 -8.619 -7.631 3.798
128 HD11 LEU 29 1HD1 LEU 29 -9.140 -6.176 1.820
129 HD12 LEU 29 2HD1 LEU 29 -7.475 -5.919 2.391
130 HD13 LEU 29 3HD1 LEU 29 -7.777 -6.908 0.942
131 HD21 LEU 29 3HD2 LEU 29 -9.312 -9.748 2.841
132 HD22 LEU 29 1HD2 LEU 29 -10.211 -8.415 2.079
133 HD23 LEU 29 2HD2 LEU 29 -8.865 -9.193 1.211
134 HA PRO 30 HA PRO 30 -3.489 -12.118 3.626
135 HB2 PRO 30 1HB PRO 30 -2.937 -12.336 1.184
136 HB3 PRO 30 2HB PRO 30 -4.079 -13.239 1.917
137 HG2 PRO 30 1HG PRO 30 -4.469 -11.226 0.307
138 HG3 PRO 30 2HG PRO 30 -5.326 -12.613 0.353
139 HD2 PRO 30 1HD PRO 30 -6.298 -10.645 1.471
140 HD3 PRO 30 2HD PRO 30 -6.434 -12.119 2.157
141 H THR 31 H THR 31 -1.223 -11.757 3.384
142 HA THR 31 HA THR 31 -0.515 -9.021 3.616
143 HB THR 31 HB THR 31 1.261 -11.330 2.719
144 HG1 THR 31 HG1 THR 31 0.216 -11.679 4.756
145 HG21 THR 31 1HG2 THR 31 3.084 -9.948 3.652
146 HG22 THR 31 2HG2 THR 31 2.249 -9.097 2.330
147 HG23 THR 31 3HG2 THR 31 1.916 -8.657 4.021
148 HA PRO 32 HA PRO 32 -0.856 -7.620 -0.448
149 HB2 PRO 32 1HB PRO 32 0.599 -5.600 0.664
150 HB3 PRO 32 2HB PRO 32 -0.826 -5.569 -0.128
151 HG2 PRO 32 1HG PRO 32 -0.459 -6.002 2.416
152 HG3 PRO 32 2HG PRO 32 -1.656 -5.120 1.744
153 HD2 PRO 32 1HD PRO 32 0.275 -7.353 3.205
154 HD3 PRO 32 2HD PRO 32 -1.269 -7.060 2.768
155 H VAL 33 H VAL 33 0.305 -7.637 -2.330
156 HA VAL 33 HA VAL 33 3.260 -8.125 -1.961
157 HB VAL 33 HB VAL 33 1.399 -9.123 -4.159
158 HG11 VAL 33 1HG1 VAL 33 3.389 -10.377 -4.922
159 HG12 VAL 33 2HG1 VAL 33 3.686 -8.622 -4.953
160 HG13 VAL 33 3HG1 VAL 33 4.360 -9.616 -3.640
161 HG21 VAL 33 3HG2 VAL 33 1.019 -10.310 -2.081
162 HG22 VAL 33 1HG2 VAL 33 1.847 -11.351 -3.261
163 HG23 VAL 33 2HG2 VAL 33 2.763 -10.625 -1.920
164 H TYR 34 H TYR 34 4.566 -6.677 -2.620
165 HA TYR 34 HA TYR 34 3.583 -4.727 -4.678
166 HB2 TYR 34 1HB TYR 34 4.061 -3.709 -2.531
167 HB3 TYR 34 2HB TYR 34 5.677 -4.457 -2.514
168 HD1 TYR 34 HD1 TYR 34 4.351 -3.153 -5.657
169 HD2 TYR 34 HD2 TYR 34 6.714 -2.217 -2.234
170 HE1 TYR 34 HE1 TYR 34 5.273 -1.183 -6.842
171 HE2 TYR 34 HE2 TYR 34 7.644 -0.247 -3.401
172 HH TYR 34 HH TYR 34 7.509 1.087 -5.264
173 H GLU 35 H GLU 35 4.229 -5.256 -6.614
174 HA GLU 35 HA GLU 35 7.078 -6.130 -6.952
175 HB2 GLU 35 1HB GLU 35 4.693 -6.378 -8.792
176 HB3 GLU 35 2HB GLU 35 6.358 -6.871 -9.184
177 HG2 GLU 35 1HG GLU 35 6.216 -8.562 -7.251
178 HG3 GLU 35 2HG GLU 35 4.551 -7.965 -7.070
179 H ILE 36 H ILE 36 8.440 -5.136 -8.339
180 HA ILE 36 HA ILE 36 7.534 -2.430 -9.297
181 HB ILE 36 HB ILE 36 10.320 -3.410 -8.519
182 HG12 ILE 36 1HG1 ILE 36 8.581 -1.342 -7.201
183 HG13 ILE 36 2HG1 ILE 36 8.756 -3.027 -6.654
184 HG21 ILE 36 1HG2 ILE 36 11.000 -1.064 -8.905
185 HG22 ILE 36 2HG2 ILE 36 10.361 -1.799 -10.393
186 HG23 ILE 36 3HG2 ILE 36 9.351 -0.676 -9.452
187 HD11 ILE 36 3HD1 ILE 36 10.991 -0.976 -6.838
188 HD12 ILE 36 1HD1 ILE 36 10.191 -1.514 -5.343
189 HD13 ILE 36 2HD1 ILE 36 11.165 -2.661 -6.293
190 H VAL 37 H VAL 37 7.337 -2.087 -11.316
191 HA VAL 37 HA VAL 37 8.616 -4.043 -13.216
192 HB VAL 37 HB VAL 37 6.218 -2.201 -13.594
193 HG11 VAL 37 1HG1 VAL 37 5.939 -3.420 -15.727
194 HG12 VAL 37 2HG1 VAL 37 7.506 -2.579 -15.670
195 HG13 VAL 37 3HG1 VAL 37 7.427 -4.336 -15.398
196 HG21 VAL 37 3HG2 VAL 37 5.699 -4.022 -12.084
197 HG22 VAL 37 1HG2 VAL 37 4.894 -4.254 -13.653
198 HG23 VAL 37 2HG2 VAL 37 6.347 -5.200 -13.250
199 H LYS 38 H LYS 38 10.314 -3.468 -14.230
200 HA LYS 38 HA LYS 38 10.559 -0.585 -15.031
201 HB2 LYS 38 1HB LYS 38 12.209 -1.279 -13.341
202 HB3 LYS 38 2HB LYS 38 12.752 -2.576 -14.431
203 HG2 LYS 38 1HG LYS 38 13.454 -0.890 -16.086
204 HG3 LYS 38 2HG LYS 38 12.920 0.405 -14.988
205 HD2 LYS 38 1HD LYS 38 14.546 -0.363 -13.299
206 HD3 LYS 38 2HD LYS 38 15.088 -1.642 -14.412
207 HE2 LYS 38 1HE LYS 38 15.837 0.020 -16.019
208 HE3 LYS 38 2HE LYS 38 15.204 1.332 -14.996
209 HZ1 LYS 38 3HZ LYS 38 17.382 -0.518 -14.260
210 HZ2 LYS 38 1HZ LYS 38 17.574 1.054 -14.722
211 HZ3 LYS 38 2HZ LYS 38 16.795 0.698 -13.311
212 H GLU 39 H GLU 39 10.507 -0.166 -17.082
213 HA GLU 39 HA GLU 39 11.565 -2.112 -19.043
214 HB2 GLU 39 1HB GLU 39 9.539 -2.185 -20.335
215 HB3 GLU 39 2HB GLU 39 9.264 -2.847 -18.705
216 HG2 GLU 39 1HG GLU 39 8.178 -0.604 -18.071
217 HG3 GLU 39 2HG GLU 39 8.494 -0.161 -19.765
218 H GLY 40 H GLY 40 11.500 -1.271 -21.260
219 HA2 GLY 40 1HA GLY 40 11.283 0.640 -22.739
220 HA3 GLY 40 2HA GLY 40 11.464 1.713 -21.332
221 HA PRO 41 HA PRO 41 15.472 1.252 -23.540
222 HB2 PRO 41 1HB PRO 41 15.847 3.730 -23.780
223 HB3 PRO 41 2HB PRO 41 14.960 2.856 -24.832
224 HG2 PRO 41 1HG PRO 41 14.064 4.490 -23.011
225 HG3 PRO 41 2HG PRO 41 13.484 4.310 -24.524
226 HD2 PRO 41 1HD PRO 41 12.293 3.207 -22.661
227 HD3 PRO 41 2HD PRO 41 12.462 2.456 -24.101
228 H SER 42 H SER 42 17.605 1.637 -22.801
229 HA SER 42 HA SER 42 17.873 1.803 -19.916
230 HB2 SER 42 1HB SER 42 20.130 1.712 -20.229
231 HB3 SER 42 2HB SER 42 19.330 0.568 -21.331
232 HG SER 42 HG SER 42 21.009 1.751 -22.344
233 H HIS 43 H HIS 43 17.665 4.183 -22.461
234 HA HIS 43 HA HIS 43 19.038 6.282 -20.917
235 HB2 HIS 43 1HB HIS 43 17.468 6.368 -23.533
236 HB3 HIS 43 2HB HIS 43 18.334 7.749 -22.816
237 HD2 HIS 43 HD2 HIS 43 19.045 4.982 -25.391
238 HE1 HIS 43 HE1 HIS 43 22.776 6.311 -23.853
239 HE2 HIS 43 HE2 HIS 43 21.526 4.932 -25.710
240 H LYS 44 H LYS 44 15.698 5.539 -21.904
241 HA LYS 44 HA LYS 44 14.779 7.217 -19.606
242 HB2 LYS 44 1HB LYS 44 13.698 7.259 -22.428
243 HB3 LYS 44 2HB LYS 44 12.905 8.000 -21.017
244 HG2 LYS 44 1HG LYS 44 14.884 9.472 -20.717
245 HG3 LYS 44 2HG LYS 44 15.599 8.771 -22.188
246 HD2 LYS 44 1HD LYS 44 13.680 9.566 -23.506
247 HD3 LYS 44 2HD LYS 44 12.957 10.261 -22.036
248 HE2 LYS 44 1HE LYS 44 14.900 11.742 -21.777
249 HE3 LYS 44 2HE LYS 44 15.626 11.048 -23.245
250 HZ1 LYS 44 3HZ LYS 44 13.079 12.530 -23.128
251 HZ2 LYS 44 1HZ LYS 44 14.508 13.123 -23.702
252 HZ3 LYS 44 2HZ LYS 44 13.751 11.887 -24.490
253 H SER 45 H SER 45 14.745 5.032 -18.676
254 HA SER 45 HA SER 45 12.695 3.112 -19.590
255 HB2 SER 45 1HB SER 45 13.245 1.850 -17.773
256 HB3 SER 45 2HB SER 45 14.730 2.432 -18.559
257 HG SER 45 HG SER 45 14.853 4.023 -16.910
258 H LEU 46 H LEU 46 10.785 2.609 -18.503
259 HA LEU 46 HA LEU 46 9.688 4.802 -16.785
260 HB2 LEU 46 1HB LEU 46 8.424 2.629 -18.325
261 HB3 LEU 46 2HB LEU 46 7.437 3.814 -17.440
262 HG LEU 46 HG LEU 46 9.213 4.336 -19.854
263 HD11 LEU 46 1HD1 LEU 46 7.048 4.984 -20.945
264 HD12 LEU 46 2HD1 LEU 46 7.009 3.297 -20.382
265 HD13 LEU 46 3HD1 LEU 46 6.186 4.568 -19.445
266 HD21 LEU 46 3HD2 LEU 46 9.363 6.184 -18.292
267 HD22 LEU 46 1HD2 LEU 46 8.420 6.671 -19.721
268 HD23 LEU 46 2HD2 LEU 46 7.589 6.284 -18.194
269 H PHE 47 H PHE 47 8.785 4.438 -14.845
270 HA PHE 47 HA PHE 47 9.249 1.693 -13.716
271 HB2 PHE 47 1HB PHE 47 9.477 4.422 -12.373
272 HB3 PHE 47 2HB PHE 47 9.578 2.861 -11.526
273 HD1 PHE 47 HD1 PHE 47 11.261 5.190 -13.786
274 HD2 PHE 47 HD2 PHE 47 11.503 1.449 -11.737
275 HE1 PHE 47 HE1 PHE 47 13.694 5.115 -14.214
276 HE2 PHE 47 HE2 PHE 47 13.938 1.373 -12.160
277 HZ PHE 47 HZ PHE 47 15.032 3.207 -13.401
278 H GLN 48 H GLN 48 7.522 0.612 -13.259
279 HA GLN 48 HA GLN 48 5.073 2.141 -12.440
280 HB2 GLN 48 1HB GLN 48 5.286 -0.474 -13.949
281 HB3 GLN 48 2HB GLN 48 3.777 0.287 -13.394
282 HG2 GLN 48 1HG GLN 48 4.397 2.310 -15.105
283 HG3 GLN 48 2HG GLN 48 5.767 1.189 -15.282
284 HE21 GLN 48 2HE2 GLN 48 4.201 2.058 -17.442
285 HE22 GLN 48 1HE2 GLN 48 3.320 0.705 -18.069
286 H SER 49 H SER 49 3.734 1.283 -10.881
287 HA SER 49 HA SER 49 5.078 -0.712 -9.036
288 HB2 SER 49 1HB SER 49 3.264 1.548 -8.461
289 HB3 SER 49 2HB SER 49 3.731 0.268 -7.318
290 HG SER 49 HG SER 49 5.795 0.958 -7.380
291 H THR 50 H THR 50 4.078 -2.591 -8.686
292 HA THR 50 HA THR 50 1.165 -2.808 -9.385
293 HB THR 50 HB THR 50 3.321 -4.957 -9.557
294 HG1 THR 50 HG1 THR 50 1.781 -3.636 -11.576
295 HG21 THR 50 1HG2 THR 50 1.514 -6.357 -10.493
296 HG22 THR 50 2HG2 THR 50 1.133 -5.847 -8.830
297 HG23 THR 50 3HG2 THR 50 0.348 -5.043 -10.210
298 H VAL 51 H VAL 51 -0.117 -3.068 -7.759
299 HA VAL 51 HA VAL 51 0.942 -4.440 -5.289
300 HB VAL 51 HB VAL 51 -1.173 -2.254 -5.497
301 HG11 VAL 51 1HG1 VAL 51 -1.119 -2.328 -3.026
302 HG12 VAL 51 2HG1 VAL 51 -1.613 -3.897 -3.703
303 HG13 VAL 51 3HG1 VAL 51 0.044 -3.673 -3.091
304 HG21 VAL 51 3HG2 VAL 51 1.046 -1.354 -5.865
305 HG22 VAL 51 1HG2 VAL 51 0.418 -0.858 -4.276
306 HG23 VAL 51 2HG2 VAL 51 1.636 -2.151 -4.387
307 H ILE 52 H ILE 52 0.230 -6.361 -5.057
308 HA ILE 52 HA ILE 52 -2.550 -6.983 -6.018
309 HB ILE 52 HB ILE 52 -0.185 -8.839 -5.478
310 HG12 ILE 52 1HG1 ILE 52 -1.493 -8.153 -8.095
311 HG13 ILE 52 2HG1 ILE 52 -0.006 -7.394 -7.479
312 HG21 ILE 52 1HG2 ILE 52 -1.645 -10.588 -6.436
313 HG22 ILE 52 2HG2 ILE 52 -2.370 -9.881 -4.973
314 HG23 ILE 52 3HG2 ILE 52 -2.968 -9.406 -6.580
315 HD11 ILE 52 3HD1 ILE 52 -0.376 -10.350 -8.077
316 HD12 ILE 52 1HD1 ILE 52 0.512 -9.188 -9.087
317 HD13 ILE 52 2HD1 ILE 52 1.110 -9.591 -7.460
318 H LEU 53 H LEU 53 -4.078 -7.171 -4.655
319 HA LEU 53 HA LEU 53 -3.452 -8.250 -1.945
320 HB2 LEU 53 1HB LEU 53 -3.395 -5.978 -1.738
321 HB3 LEU 53 2HB LEU 53 -4.945 -5.641 -2.542
322 HG LEU 53 HG LEU 53 -6.080 -6.944 -0.707
323 HD11 LEU 53 1HD1 LEU 53 -4.785 -7.272 1.417
324 HD12 LEU 53 2HD1 LEU 53 -4.077 -8.205 0.077
325 HD13 LEU 53 3HD1 LEU 53 -3.321 -6.679 0.597
326 HD21 LEU 53 3HD2 LEU 53 -6.086 -4.520 -0.720
327 HD22 LEU 53 1HD2 LEU 53 -5.955 -5.118 0.952
328 HD23 LEU 53 2HD2 LEU 53 -4.515 -4.483 0.116
329 H ASP 54 H ASP 54 -4.572 -9.992 -1.656
330 HA ASP 54 HA ASP 54 -6.321 -11.523 -1.761
331 HB2 ASP 54 1HB ASP 54 -7.373 -9.477 -0.413
332 HB3 ASP 54 2HB ASP 54 -8.071 -9.181 -2.025
333 H GLY 55 H GLY 55 -5.123 -10.818 -4.239
334 HA2 GLY 55 1HA GLY 55 -5.519 -11.758 -6.344
335 HA3 GLY 55 2HA GLY 55 -7.222 -12.013 -5.897
336 H VAL 56 H VAL 56 -6.344 -8.877 -5.131
337 HA VAL 56 HA VAL 56 -7.446 -7.822 -7.732
338 HB VAL 56 HB VAL 56 -7.412 -6.537 -4.969
339 HG11 VAL 56 1HG1 VAL 56 -8.871 -4.846 -6.031
340 HG12 VAL 56 2HG1 VAL 56 -7.285 -4.920 -6.834
341 HG13 VAL 56 3HG1 VAL 56 -8.703 -5.682 -7.592
342 HG21 VAL 56 3HG2 VAL 56 -8.953 -8.406 -5.023
343 HG22 VAL 56 1HG2 VAL 56 -9.834 -6.861 -4.984
344 HG23 VAL 56 2HG2 VAL 56 -9.701 -7.769 -6.508
345 H ARG 57 H ARG 57 -6.068 -7.066 -9.069
346 HA ARG 57 HA ARG 57 -3.423 -6.171 -8.035
347 HB2 ARG 57 1HB ARG 57 -3.377 -7.836 -9.725
348 HB3 ARG 57 2HB ARG 57 -4.325 -6.795 -10.812
349 HG2 ARG 57 1HG ARG 57 -2.513 -5.197 -10.943
350 HG3 ARG 57 2HG ARG 57 -1.580 -6.100 -9.726
351 HD2 ARG 57 1HD ARG 57 -2.327 -7.075 -12.464
352 HD3 ARG 57 2HD ARG 57 -0.745 -6.430 -11.970
353 HE ARG 57 HE ARG 57 -1.155 -8.719 -10.323
354 HH11 ARG 57 1HH1 ARG 57 -1.084 -8.147 -13.762
355 HH12 ARG 57 2HH1 ARG 57 -0.466 -9.767 -14.024
356 HH21 ARG 57 1HH2 ARG 57 -0.457 -10.579 -10.607
357 HH22 ARG 57 2HH2 ARG 57 -0.110 -11.155 -12.227
358 H TYR 58 H TYR 58 -2.934 -4.158 -7.751
359 HA TYR 58 HA TYR 58 -4.522 -2.077 -9.203
360 HB2 TYR 58 1HB TYR 58 -2.628 -1.752 -6.870
361 HB3 TYR 58 2HB TYR 58 -3.729 -0.532 -7.554
362 HD1 TYR 58 HD2 TYR 58 -6.276 -1.154 -7.502
363 HD2 TYR 58 HD1 TYR 58 -3.336 -2.997 -5.023
364 HE1 TYR 58 HE2 TYR 58 -8.054 -1.866 -5.941
365 HE2 TYR 58 HE1 TYR 58 -5.105 -3.718 -3.447
366 HH TYR 58 HH TYR 58 -8.546 -2.959 -4.004
367 H ASN 59 H ASN 59 -3.690 -0.788 -10.667
368 HA ASN 59 HA ASN 59 -0.775 -1.178 -11.281
369 HB2 ASN 59 1HB ASN 59 -2.931 -0.690 -13.464
370 HB3 ASN 59 2HB ASN 59 -1.159 -0.829 -13.357
371 HD21 ASN 59 2HD2 ASN 59 -4.150 -2.475 -13.539
372 HD22 ASN 59 1HD2 ASN 59 -3.531 -4.093 -13.526
373 H SER 60 H SER 60 0.444 0.499 -11.029
374 HA SER 60 HA SER 60 -0.460 3.199 -10.524
375 HB2 SER 60 1HB SER 60 1.670 3.822 -10.467
376 HB3 SER 60 2HB SER 60 1.649 2.157 -9.842
377 HG SER 60 HG SER 60 2.590 3.119 -12.317
378 H LEU 61 H LEU 61 0.271 5.055 -11.882
379 HA LEU 61 HA LEU 61 -0.776 4.762 -14.607
380 HB2 LEU 61 1HB LEU 61 0.457 6.958 -13.078
381 HB3 LEU 61 2HB LEU 61 -0.232 7.280 -14.686
382 HG LEU 61 HG LEU 61 -1.745 6.377 -12.205
383 HD11 LEU 61 1HD1 LEU 61 -2.856 8.618 -12.400
384 HD12 LEU 61 2HD1 LEU 61 -1.098 8.784 -12.181
385 HD13 LEU 61 3HD1 LEU 61 -1.818 8.994 -13.795
386 HD21 LEU 61 3HD2 LEU 61 -2.679 5.371 -14.204
387 HD22 LEU 61 1HD2 LEU 61 -3.778 6.626 -13.587
388 HD23 LEU 61 2HD2 LEU 61 -2.753 6.958 -15.004
389 HA PRO 62 HA PRO 62 3.025 4.203 -16.526
390 HB2 PRO 62 1HB PRO 62 2.240 4.450 -18.879
391 HB3 PRO 62 2HB PRO 62 1.763 3.209 -17.937
392 HG2 PRO 62 1HG PRO 62 0.343 5.280 -18.633
393 HG3 PRO 62 2HG PRO 62 -0.177 3.738 -18.526
394 HD2 PRO 62 1HD PRO 62 -0.703 5.094 -16.552
395 HD3 PRO 62 2HD PRO 62 -0.194 3.563 -16.307
396 H GLY 63 H GLY 63 4.652 5.209 -17.893
397 HA2 GLY 63 1HA GLY 63 5.479 7.067 -19.113
398 HA3 GLY 63 2HA GLY 63 4.068 8.023 -18.600
399 H PHE 64 H PHE 64 5.072 6.464 -15.892
400 HA PHE 64 HA PHE 64 6.352 8.894 -14.831
401 HB2 PHE 64 1HB PHE 64 5.474 6.250 -13.620
402 HB3 PHE 64 2HB PHE 64 6.413 7.450 -12.702
403 HD1 PHE 64 HD1 PHE 64 4.703 9.555 -14.645
404 HD2 PHE 64 HD2 PHE 64 3.932 6.641 -11.617
405 HE1 PHE 64 HE1 PHE 64 2.614 10.733 -14.045
406 HE2 PHE 64 HE2 PHE 64 1.841 7.815 -11.017
407 HZ PHE 64 HZ PHE 64 1.184 9.863 -12.230
408 H PHE 65 H PHE 65 8.393 9.230 -14.298
409 HA PHE 65 HA PHE 65 10.341 7.077 -15.040
410 HB2 PHE 65 1HB PHE 65 10.687 10.099 -14.818
411 HB3 PHE 65 2HB PHE 65 11.988 8.946 -15.191
412 HD1 PHE 65 HD2 PHE 65 11.883 7.627 -17.294
413 HD2 PHE 65 HD1 PHE 65 9.232 10.873 -16.467
414 HE1 PHE 65 HE2 PHE 65 11.353 7.803 -19.702
415 HE2 PHE 65 HE1 PHE 65 8.695 11.051 -18.873
416 HZ PHE 65 HZ PHE 65 9.756 9.516 -20.491
417 H ASN 66 H ASN 66 8.761 7.857 -12.414
418 HA ASN 66 HA ASN 66 11.143 7.371 -10.664
419 HB2 ASN 66 1HB ASN 66 8.943 9.382 -9.789
420 HB3 ASN 66 2HB ASN 66 10.375 8.589 -9.089
421 HD21 ASN 66 2HD2 ASN 66 9.191 11.023 -11.255
422 HD22 ASN 66 1HD2 ASN 66 10.704 11.823 -11.527
423 H ARG 67 H ARG 67 10.942 5.874 -9.166
424 HA ARG 67 HA ARG 67 8.666 4.105 -9.172
425 HB2 ARG 67 1HB ARG 67 10.972 4.373 -7.305
426 HB3 ARG 67 2HB ARG 67 9.675 3.167 -7.129
427 HG2 ARG 67 1HG ARG 67 10.243 2.199 -9.293
428 HG3 ARG 67 2HG ARG 67 11.490 3.445 -9.544
429 HD2 ARG 67 1HD ARG 67 12.725 2.578 -7.650
430 HD3 ARG 67 2HD ARG 67 11.482 1.326 -7.417
431 HE ARG 67 HE ARG 67 12.568 0.946 -10.060
432 HH11 ARG 67 1HH1 ARG 67 13.723 0.819 -6.772
433 HH12 ARG 67 2HH1 ARG 67 14.897 -0.401 -7.226
434 HH21 ARG 67 1HH2 ARG 67 13.912 -0.444 -10.597
435 HH22 ARG 67 2HH2 ARG 67 15.007 -1.120 -9.408
436 H LYS 68 H LYS 68 9.636 6.773 -7.051
437 HA LYS 68 HA LYS 68 7.628 6.408 -5.059
438 HB2 LYS 68 1HB LYS 68 9.549 7.921 -4.855
439 HB3 LYS 68 2HB LYS 68 8.845 8.968 -6.108
440 HG2 LYS 68 1HG LYS 68 6.935 9.457 -4.667
441 HG3 LYS 68 2HG LYS 68 7.567 8.351 -3.424
442 HD2 LYS 68 1HD LYS 68 9.556 9.761 -3.161
443 HD3 LYS 68 2HD LYS 68 8.960 10.855 -4.432
444 HE2 LYS 68 1HE LYS 68 6.977 11.358 -3.061
445 HE3 LYS 68 2HE LYS 68 7.588 10.278 -1.788
446 HZ1 LYS 68 3HZ LYS 68 8.926 12.724 -2.749
447 HZ2 LYS 68 1HZ LYS 68 8.104 12.577 -1.327
448 HZ3 LYS 68 2HZ LYS 68 9.495 11.724 -1.568
449 H ALA 69 H ALA 69 7.554 8.344 -8.057
450 HA ALA 69 HA ALA 69 4.908 9.323 -7.710
451 HB1 ALA 69 3HB ALA 69 6.410 8.712 -10.280
452 HB2 ALA 69 1HB ALA 69 4.949 9.718 -10.142
453 HB3 ALA 69 2HB ALA 69 6.466 10.240 -9.370
454 H ALA 70 H ALA 70 6.102 6.350 -9.252
455 HA ALA 70 HA ALA 70 3.570 5.394 -10.138
456 HB1 ALA 70 3HB ALA 70 6.008 3.831 -9.220
457 HB2 ALA 70 1HB ALA 70 4.642 3.174 -10.150
458 HB3 ALA 70 2HB ALA 70 5.697 4.413 -10.872
459 H GLU 71 H GLU 71 5.254 5.034 -7.030
460 HA GLU 71 HA GLU 71 3.318 3.246 -5.864
461 HB2 GLU 71 1HB GLU 71 5.300 5.187 -4.675
462 HB3 GLU 71 2HB GLU 71 4.279 4.097 -3.706
463 HG2 GLU 71 1HG GLU 71 5.401 2.111 -4.777
464 HG3 GLU 71 2HG GLU 71 6.244 3.288 -5.809
465 H GLN 72 H GLN 72 3.530 6.760 -6.076
466 HA GLN 72 HA GLN 72 1.420 7.312 -4.197
467 HB2 GLN 72 1HB GLN 72 2.524 8.825 -6.567
468 HB3 GLN 72 2HB GLN 72 1.248 9.466 -5.504
469 HG2 GLN 72 1HG GLN 72 3.051 9.349 -3.509
470 HG3 GLN 72 2HG GLN 72 3.924 8.583 -4.856
471 HE21 GLN 72 2HE2 GLN 72 4.843 10.805 -3.314
472 HE22 GLN 72 1HE2 GLN 72 4.979 12.165 -4.377
473 H SER 73 H SER 73 1.413 6.871 -7.729
474 HA SER 73 HA SER 73 -1.465 7.331 -8.047
475 HB2 SER 73 1HB SER 73 -1.203 6.665 -10.219
476 HB3 SER 73 2HB SER 73 0.115 7.766 -9.760
477 HG SER 73 HG SER 73 1.518 6.095 -9.763
478 H ALA 74 H ALA 74 0.655 4.527 -7.499
479 HA ALA 74 HA ALA 74 -1.317 2.502 -7.936
480 HB1 ALA 74 3HB ALA 74 1.089 2.502 -6.082
481 HB2 ALA 74 1HB ALA 74 0.165 1.069 -6.586
482 HB3 ALA 74 2HB ALA 74 1.081 2.004 -7.790
483 H ALA 75 H ALA 75 -0.384 4.313 -5.016
484 HA ALA 75 HA ALA 75 -2.310 3.053 -3.299
485 HB1 ALA 75 3HB ALA 75 -1.071 5.821 -3.145
486 HB2 ALA 75 1HB ALA 75 -1.952 5.002 -1.836
487 HB3 ALA 75 2HB ALA 75 -0.411 4.335 -2.424
488 H GLU 76 H GLU 76 -2.452 5.899 -5.411
489 HA GLU 76 HA GLU 76 -5.045 6.816 -4.693
490 HB2 GLU 76 1HB GLU 76 -3.519 8.043 -6.144
491 HB3 GLU 76 2HB GLU 76 -3.681 6.782 -7.391
492 HG2 GLU 76 1HG GLU 76 -6.164 7.387 -7.578
493 HG3 GLU 76 2HG GLU 76 -5.800 8.606 -6.336
494 H VAL 77 H VAL 77 -4.111 4.434 -7.185
495 HA VAL 77 HA VAL 77 -6.807 3.822 -8.011
496 HB VAL 77 HB VAL 77 -4.255 2.161 -8.082
497 HG11 VAL 77 1HG1 VAL 77 -5.464 0.741 -9.705
498 HG12 VAL 77 2HG1 VAL 77 -6.263 0.720 -8.115
499 HG13 VAL 77 3HG1 VAL 77 -6.942 1.696 -9.440
500 HG21 VAL 77 3HG2 VAL 77 -4.131 4.181 -9.415
501 HG22 VAL 77 1HG2 VAL 77 -4.231 2.741 -10.456
502 HG23 VAL 77 2HG2 VAL 77 -5.666 3.768 -10.218
503 H ALA 78 H ALA 78 -4.737 2.381 -5.514
504 HA ALA 78 HA ALA 78 -6.567 0.356 -4.727
505 HB1 ALA 78 3HB ALA 78 -4.574 1.903 -3.038
506 HB2 ALA 78 1HB ALA 78 -5.358 0.374 -2.581
507 HB3 ALA 78 2HB ALA 78 -4.237 0.421 -3.962
508 H LEU 79 H LEU 79 -6.253 3.736 -3.660
509 HA LEU 79 HA LEU 79 -8.357 3.581 -1.694
510 HB2 LEU 79 1HB LEU 79 -7.121 5.721 -3.286
511 HB3 LEU 79 2HB LEU 79 -8.335 6.178 -2.070
512 HG LEU 79 HG LEU 79 -5.707 4.753 -1.505
513 HD11 LEU 79 1HD1 LEU 79 -5.041 6.915 -0.420
514 HD12 LEU 79 2HD1 LEU 79 -5.380 7.138 -2.151
515 HD13 LEU 79 3HD1 LEU 79 -6.585 7.632 -0.937
516 HD21 LEU 79 3HD2 LEU 79 -7.455 4.125 0.052
517 HD22 LEU 79 1HD2 LEU 79 -6.258 5.157 0.868
518 HD23 LEU 79 2HD2 LEU 79 -7.827 5.836 0.371
519 H ARG 80 H ARG 80 -8.322 4.418 -5.136
520 HA ARG 80 HA ARG 80 -11.059 5.281 -5.270
521 HB2 ARG 80 1HB ARG 80 -9.234 4.190 -7.359
522 HB3 ARG 80 2HB ARG 80 -10.892 4.757 -7.662
523 HG2 ARG 80 1HG ARG 80 -10.274 6.993 -6.837
524 HG3 ARG 80 2HG ARG 80 -8.612 6.422 -6.550
525 HD2 ARG 80 1HD ARG 80 -8.394 5.981 -8.945
526 HD3 ARG 80 2HD ARG 80 -10.019 6.664 -9.189
527 HE ARG 80 HE ARG 80 -7.580 8.297 -8.769
528 HH11 ARG 80 1HH1 ARG 80 -11.062 8.264 -8.613
529 HH12 ARG 80 2HH1 ARG 80 -11.089 10.015 -8.696
530 HH21 ARG 80 1HH2 ARG 80 -7.593 10.301 -8.875
531 HH22 ARG 80 2HH2 ARG 80 -9.111 11.178 -8.847
532 H GLU 81 H GLU 81 -9.547 2.093 -5.663
533 HA GLU 81 HA GLU 81 -12.070 0.785 -6.317
534 HB2 GLU 81 1HB GLU 81 -9.380 -0.246 -5.412
535 HB3 GLU 81 2HB GLU 81 -10.761 -1.287 -5.832
536 HG2 GLU 81 1HG GLU 81 -9.264 0.584 -7.764
537 HG3 GLU 81 2HG GLU 81 -9.241 -1.189 -7.627
538 H LEU 82 H LEU 82 -10.274 1.445 -3.365
539 HA LEU 82 HA LEU 82 -11.847 -0.198 -1.618
540 HB2 LEU 82 1HB LEU 82 -9.814 0.711 -1.037
541 HB3 LEU 82 2HB LEU 82 -10.325 2.414 -1.104
542 HG LEU 82 HG LEU 82 -11.969 1.913 0.733
543 HD11 LEU 82 1HD1 LEU 82 -11.577 -0.167 2.080
544 HD12 LEU 82 2HD1 LEU 82 -12.065 -0.557 0.415
545 HD13 LEU 82 3HD1 LEU 82 -10.356 -0.686 0.895
546 HD21 LEU 82 3HD2 LEU 82 -9.860 3.015 1.205
547 HD22 LEU 82 1HD2 LEU 82 -10.285 1.918 2.541
548 HD23 LEU 82 2HD2 LEU 82 -9.040 1.443 1.359
549 H ALA 83 H ALA 83 -12.246 3.187 -2.654
550 HA ALA 83 HA ALA 83 -14.614 3.693 -1.166
551 HB1 ALA 83 3HB ALA 83 -13.764 4.806 -3.862
552 HB2 ALA 83 1HB ALA 83 -15.021 5.489 -2.805
553 HB3 ALA 83 2HB ALA 83 -13.324 5.466 -2.269
554 H LYS 84 H LYS 84 -14.101 2.063 -4.246
555 HA LYS 84 HA LYS 84 -16.916 1.925 -4.950
556 HB2 LYS 84 1HB LYS 84 -14.496 0.330 -5.796
557 HB3 LYS 84 2HB LYS 84 -16.128 0.093 -6.465
558 HG2 LYS 84 1HG LYS 84 -16.137 2.366 -7.341
559 HG3 LYS 84 2HG LYS 84 -14.553 2.687 -6.594
560 HD2 LYS 84 1HD LYS 84 -13.554 0.905 -7.994
561 HD3 LYS 84 2HD LYS 84 -15.136 0.647 -8.768
562 HE2 LYS 84 1HE LYS 84 -15.124 2.949 -9.598
563 HE3 LYS 84 2HE LYS 84 -13.565 3.242 -8.795
564 HZ1 LYS 84 3HZ LYS 84 -14.039 1.294 -10.960
565 HZ2 LYS 84 1HZ LYS 84 -13.286 2.752 -11.129
566 HZ3 LYS 84 2HZ LYS 84 -12.592 1.566 -10.215
567 H SER 85 H SER 85 -14.768 -0.023 -2.977
568 HA SER 85 HA SER 85 -16.747 -2.244 -2.699
569 HB2 SER 85 1HB SER 85 -15.177 -3.347 -1.485
570 HB3 SER 85 2HB SER 85 -14.411 -2.686 -2.948
571 HG SER 85 HG SER 85 -13.135 -2.398 -1.069
572 H SER 86 H SER 86 -16.011 0.800 -1.252
573 HA SER 86 HA SER 86 -16.779 0.217 1.521
574 HB2 SER 86 1HB SER 86 -15.321 1.956 1.065
575 HB3 SER 86 2HB SER 86 -16.529 2.765 0.041
576 HG SER 86 HG SER 86 -17.866 2.892 1.901
Start of MODEL 3
1 H PHE 16 H PHE 16 0.824 2.414 -0.498
2 HA PHE 16 HA PHE 16 -1.682 1.074 0.757
3 HB2 PHE 16 1HB PHE 16 -1.169 -1.172 0.107
4 HB3 PHE 16 2HB PHE 16 -0.739 -0.165 -1.294
5 HD1 PHE 16 HD2 PHE 16 1.569 0.202 -1.904
6 HD2 PHE 16 HD1 PHE 16 0.494 -2.315 1.377
7 HE1 PHE 16 HE2 PHE 16 3.839 -0.778 -1.916
8 HE2 PHE 16 HE1 PHE 16 2.763 -3.296 1.369
9 HZ PHE 16 HZ PHE 16 4.435 -2.526 -0.277
10 H LYS 17 H LYS 17 1.725 1.428 1.395
11 HA LYS 17 HA LYS 17 1.932 -0.278 3.676
12 HB2 LYS 17 1HB LYS 17 3.341 2.309 2.999
13 HB3 LYS 17 2HB LYS 17 3.798 1.218 4.330
14 HG2 LYS 17 1HG LYS 17 4.255 -0.575 2.702
15 HG3 LYS 17 2HG LYS 17 3.807 0.521 1.373
16 HD2 LYS 17 1HD LYS 17 5.635 2.053 2.048
17 HD3 LYS 17 2HD LYS 17 6.100 0.906 3.327
18 HE2 LYS 17 1HE LYS 17 6.551 -0.812 1.641
19 HE3 LYS 17 2HE LYS 17 6.054 0.309 0.352
20 HZ1 LYS 17 3HZ LYS 17 8.344 0.693 2.173
21 HZ2 LYS 17 1HZ LYS 17 8.443 0.230 0.593
22 HZ3 LYS 17 2HZ LYS 17 7.885 1.735 0.978
23 H SER 18 H SER 18 1.450 -0.128 5.747
24 HA SER 18 HA SER 18 0.537 0.823 7.761
25 HB2 SER 18 1HB SER 18 1.871 2.756 7.134
26 HB3 SER 18 2HB SER 18 0.414 3.410 6.351
27 HG SER 18 HG SER 18 -0.644 3.187 8.375
28 H ARG 19 H ARG 19 -0.970 2.720 5.126
29 HA ARG 19 HA ARG 19 -3.573 2.651 6.275
30 HB2 ARG 19 1HB ARG 19 -2.901 4.319 4.712
31 HB3 ARG 19 2HB ARG 19 -2.808 3.095 3.425
32 HG2 ARG 19 1HG ARG 19 -4.872 4.287 3.157
33 HG3 ARG 19 2HG ARG 19 -5.250 2.655 3.762
34 HD2 ARG 19 1HD ARG 19 -6.640 4.218 4.850
35 HD3 ARG 19 2HD ARG 19 -5.449 3.604 6.020
36 HE ARG 19 HE ARG 19 -4.548 6.192 5.017
37 HH11 ARG 19 1HH1 ARG 19 -7.003 4.828 7.084
38 HH12 ARG 19 2HH1 ARG 19 -7.037 6.304 8.028
39 HH21 ARG 19 1HH2 ARG 19 -4.582 7.891 6.082
40 HH22 ARG 19 2HH2 ARG 19 -5.657 8.053 7.457
41 H LEU 20 H LEU 20 -2.630 0.975 3.257
42 HA LEU 20 HA LEU 20 -5.066 -0.630 3.413
43 HB2 LEU 20 1HB LEU 20 -2.675 -0.572 1.702
44 HB3 LEU 20 2HB LEU 20 -3.965 -1.735 1.317
45 HG LEU 20 HG LEU 20 -4.133 1.301 1.261
46 HD11 LEU 20 1HD1 LEU 20 -4.651 0.930 -1.165
47 HD12 LEU 20 2HD1 LEU 20 -3.062 0.257 -0.733
48 HD13 LEU 20 3HD1 LEU 20 -4.465 -0.822 -0.921
49 HD21 LEU 20 3HD2 LEU 20 -6.182 0.389 2.181
50 HD22 LEU 20 1HD2 LEU 20 -6.475 1.002 0.536
51 HD23 LEU 20 2HD2 LEU 20 -6.322 -0.748 0.820
52 H GLN 21 H GLN 21 -1.665 -1.114 4.157
53 HA GLN 21 HA GLN 21 -1.719 -3.919 4.616
54 HB2 GLN 21 1HB GLN 21 -0.245 -1.625 5.895
55 HB3 GLN 21 2HB GLN 21 -0.048 -3.297 6.472
56 HG2 GLN 21 1HG GLN 21 0.825 -3.867 3.968
57 HG3 GLN 21 2HG GLN 21 0.392 -2.145 3.858
58 HE21 GLN 21 2HE2 GLN 21 2.961 -3.476 3.336
59 HE22 GLN 21 1HE2 GLN 21 4.109 -2.741 4.406
60 H GLU 22 H GLU 22 -2.570 -1.245 6.814
61 HA GLU 22 HA GLU 22 -3.266 -2.949 9.026
62 HB2 GLU 22 1HB GLU 22 -2.791 -0.557 9.234
63 HB3 GLU 22 2HB GLU 22 -4.257 -0.189 8.293
64 HG2 GLU 22 1HG GLU 22 -5.659 -1.202 10.150
65 HG3 GLU 22 2HG GLU 22 -4.109 -1.581 10.934
66 H TYR 23 H TYR 23 -5.204 -1.559 6.387
67 HA TYR 23 HA TYR 23 -7.728 -2.572 7.278
68 HB2 TYR 23 1HB TYR 23 -6.657 -1.990 4.512
69 HB3 TYR 23 2HB TYR 23 -8.351 -2.408 4.869
70 HD1 TYR 23 HD1 TYR 23 -7.727 -0.714 7.667
71 HD2 TYR 23 HD2 TYR 23 -7.842 0.091 3.481
72 HE1 TYR 23 HE1 TYR 23 -8.216 1.667 8.146
73 HE2 TYR 23 HE2 TYR 23 -8.331 2.470 3.940
74 HH TYR 23 HH TYR 23 -8.669 4.058 5.537
75 H ALA 24 H ALA 24 -5.255 -4.003 5.152
76 HA ALA 24 HA ALA 24 -6.617 -6.399 4.547
77 HB1 ALA 24 3HB ALA 24 -3.649 -5.978 5.030
78 HB2 ALA 24 1HB ALA 24 -4.381 -7.373 4.205
79 HB3 ALA 24 2HB ALA 24 -4.503 -5.750 3.486
80 H GLN 25 H GLN 25 -4.490 -5.673 7.322
81 HA GLN 25 HA GLN 25 -4.722 -8.233 8.566
82 HB2 GLN 25 1HB GLN 25 -4.273 -5.463 9.689
83 HB3 GLN 25 2HB GLN 25 -4.201 -6.949 10.665
84 HG2 GLN 25 1HG GLN 25 -2.130 -7.691 9.103
85 HG3 GLN 25 2HG GLN 25 -2.663 -6.174 8.343
86 HE21 GLN 25 2HE2 GLN 25 -0.020 -6.739 9.257
87 HE22 GLN 25 1HE2 GLN 25 0.342 -5.635 10.543
88 H LYS 26 H LYS 26 -6.736 -5.326 8.812
89 HA LYS 26 HA LYS 26 -8.491 -6.351 10.849
90 HB2 LYS 26 1HB LYS 26 -8.859 -4.313 8.654
91 HB3 LYS 26 2HB LYS 26 -10.106 -4.689 9.867
92 HG2 LYS 26 1HG LYS 26 -8.605 -3.966 11.662
93 HG3 LYS 26 2HG LYS 26 -7.322 -3.635 10.473
94 HD2 LYS 26 1HD LYS 26 -8.689 -1.909 9.427
95 HD3 LYS 26 2HD LYS 26 -10.040 -2.280 10.526
96 HE2 LYS 26 1HE LYS 26 -8.675 -1.609 12.448
97 HE3 LYS 26 2HE LYS 26 -7.307 -1.263 11.367
98 HZ1 LYS 26 3HZ LYS 26 -9.914 0.118 11.328
99 HZ2 LYS 26 1HZ LYS 26 -8.512 0.733 11.942
100 HZ3 LYS 26 2HZ LYS 26 -8.645 0.438 10.323
101 H TYR 27 H TYR 27 -8.265 -6.920 7.417
102 HA TYR 27 HA TYR 27 -10.934 -8.228 7.376
103 HB2 TYR 27 1HB TYR 27 -8.876 -7.927 5.183
104 HB3 TYR 27 2HB TYR 27 -10.561 -8.474 5.011
105 HD1 TYR 27 HD1 TYR 27 -11.368 -6.232 7.201
106 HD2 TYR 27 HD2 TYR 27 -9.399 -6.202 3.419
107 HE1 TYR 27 HE1 TYR 27 -12.095 -3.890 6.850
108 HE2 TYR 27 HE2 TYR 27 -10.116 -3.866 3.052
109 HH TYR 27 HH TYR 27 -11.250 -2.079 3.895
110 H LYS 28 H LYS 28 -8.132 -9.128 8.606
111 HA LYS 28 HA LYS 28 -7.018 -11.145 8.907
112 HB2 LYS 28 1HB LYS 28 -9.579 -12.315 7.809
113 HB3 LYS 28 2HB LYS 28 -8.305 -13.190 8.691
114 HG2 LYS 28 1HG LYS 28 -8.764 -11.781 10.687
115 HG3 LYS 28 2HG LYS 28 -10.096 -11.002 9.799
116 HD2 LYS 28 1HD LYS 28 -11.163 -13.238 9.523
117 HD3 LYS 28 2HD LYS 28 -9.871 -13.943 10.523
118 HE2 LYS 28 1HE LYS 28 -10.523 -12.490 12.393
119 HE3 LYS 28 2HE LYS 28 -11.812 -11.781 11.395
120 HZ1 LYS 28 3HZ LYS 28 -11.631 -14.612 12.202
121 HZ2 LYS 28 1HZ LYS 28 -12.655 -13.494 12.850
122 HZ3 LYS 28 2HZ LYS 28 -12.827 -13.955 11.276
123 H LEU 29 H LEU 29 -6.898 -9.693 6.325
124 HA LEU 29 HA LEU 29 -6.115 -11.997 4.576
125 HB2 LEU 29 1HB LEU 29 -6.548 -9.134 4.024
126 HB3 LEU 29 2HB LEU 29 -6.165 -10.277 2.716
127 HG LEU 29 HG LEU 29 -8.695 -10.215 4.406
128 HD11 LEU 29 1HD1 LEU 29 -9.811 -9.700 2.219
129 HD12 LEU 29 2HD1 LEU 29 -8.602 -8.463 2.634
130 HD13 LEU 29 3HD1 LEU 29 -8.220 -9.709 1.422
131 HD21 LEU 29 3HD2 LEU 29 -8.047 -12.500 3.918
132 HD22 LEU 29 1HD2 LEU 29 -9.484 -12.059 2.964
133 HD23 LEU 29 2HD2 LEU 29 -7.882 -12.114 2.188
134 HA PRO 30 HA PRO 30 -1.936 -10.942 4.805
135 HB2 PRO 30 1HB PRO 30 -1.232 -11.404 2.434
136 HB3 PRO 30 2HB PRO 30 -1.659 -12.579 3.479
137 HG2 PRO 30 1HG PRO 30 -3.077 -11.658 1.496
138 HG3 PRO 30 2HG PRO 30 -2.953 -13.216 1.958
139 HD2 PRO 30 1HD PRO 30 -4.952 -11.958 2.667
140 HD3 PRO 30 2HD PRO 30 -4.240 -13.010 3.691
141 H THR 31 H THR 31 -0.309 -9.403 4.276
142 HA THR 31 HA THR 31 -1.468 -6.851 3.533
143 HB THR 31 HB THR 31 0.866 -6.013 3.655
144 HG1 THR 31 HG1 THR 31 1.888 -7.923 2.833
145 HG21 THR 31 1HG2 THR 31 1.277 -6.558 6.028
146 HG22 THR 31 2HG2 THR 31 -0.450 -6.246 5.733
147 HG23 THR 31 3HG2 THR 31 0.133 -7.918 5.914
148 HA PRO 32 HA PRO 32 -1.205 -6.683 -0.698
149 HB2 PRO 32 1HB PRO 32 -0.091 -4.229 -0.373
150 HB3 PRO 32 2HB PRO 32 -1.497 -4.669 -1.069
151 HG2 PRO 32 1HG PRO 32 -1.104 -4.110 1.446
152 HG3 PRO 32 2HG PRO 32 -2.401 -3.692 0.550
153 HD2 PRO 32 1HD PRO 32 -0.435 -5.031 2.675
154 HD3 PRO 32 2HD PRO 32 -1.959 -5.125 2.101
155 H VAL 33 H VAL 33 0.111 -7.148 -2.419
156 HA VAL 33 HA VAL 33 3.017 -7.367 -1.683
157 HB VAL 33 HB VAL 33 1.432 -8.676 -3.934
158 HG11 VAL 33 1HG1 VAL 33 3.483 -10.020 -4.250
159 HG12 VAL 33 2HG1 VAL 33 3.809 -8.289 -4.494
160 HG13 VAL 33 3HG1 VAL 33 4.295 -9.081 -2.976
161 HG21 VAL 33 3HG2 VAL 33 0.773 -9.554 -1.774
162 HG22 VAL 33 1HG2 VAL 33 1.728 -10.751 -2.679
163 HG23 VAL 33 2HG2 VAL 33 2.478 -9.837 -1.347
164 H TYR 34 H TYR 34 4.410 -6.014 -2.368
165 HA TYR 34 HA TYR 34 3.631 -4.193 -4.599
166 HB2 TYR 34 1HB TYR 34 4.329 -3.186 -2.482
167 HB3 TYR 34 2HB TYR 34 5.879 -4.058 -2.581
168 HD1 TYR 34 HD1 TYR 34 3.793 -1.512 -4.352
169 HD2 TYR 34 HD2 TYR 34 7.701 -3.103 -3.731
170 HE1 TYR 34 HE1 TYR 34 4.755 0.360 -5.658
171 HE2 TYR 34 HE2 TYR 34 8.677 -1.243 -5.031
172 HH TYR 34 HH TYR 34 6.646 1.320 -6.472
173 H GLU 35 H GLU 35 4.382 -4.386 -6.546
174 HA GLU 35 HA GLU 35 7.054 -5.702 -6.904
175 HB2 GLU 35 1HB GLU 35 4.609 -5.905 -8.669
176 HB3 GLU 35 2HB GLU 35 6.230 -6.520 -9.073
177 HG2 GLU 35 1HG GLU 35 6.050 -8.104 -7.068
178 HG3 GLU 35 2HG GLU 35 4.443 -7.378 -6.838
179 H ILE 36 H ILE 36 8.360 -4.971 -8.560
180 HA ILE 36 HA ILE 36 7.676 -2.186 -9.477
181 HB ILE 36 HB ILE 36 10.400 -3.444 -8.907
182 HG12 ILE 36 1HG1 ILE 36 9.001 -1.192 -7.492
183 HG13 ILE 36 2HG1 ILE 36 9.044 -2.879 -6.930
184 HG21 ILE 36 1HG2 ILE 36 11.284 -1.187 -9.394
185 HG22 ILE 36 2HG2 ILE 36 10.451 -1.867 -10.810
186 HG23 ILE 36 3HG2 ILE 36 9.645 -0.635 -9.811
187 HD11 ILE 36 3HD1 ILE 36 11.457 -1.078 -7.334
188 HD12 ILE 36 1HD1 ILE 36 10.733 -1.512 -5.769
189 HD13 ILE 36 2HD1 ILE 36 11.500 -2.765 -6.772
190 H VAL 37 H VAL 37 7.338 -1.858 -11.479
191 HA VAL 37 HA VAL 37 8.523 -3.786 -13.472
192 HB VAL 37 HB VAL 37 6.102 -1.952 -13.729
193 HG11 VAL 37 1HG1 VAL 37 5.770 -3.117 -15.884
194 HG12 VAL 37 2HG1 VAL 37 7.333 -2.268 -15.851
195 HG13 VAL 37 3HG1 VAL 37 7.273 -4.032 -15.623
196 HG21 VAL 37 3HG2 VAL 37 5.637 -3.816 -12.253
197 HG22 VAL 37 1HG2 VAL 37 4.789 -4.012 -13.806
198 HG23 VAL 37 2HG2 VAL 37 6.258 -4.959 -13.468
199 H LYS 38 H LYS 38 10.164 -3.171 -14.550
200 HA LYS 38 HA LYS 38 10.362 -0.264 -15.272
201 HB2 LYS 38 1HB LYS 38 11.994 -0.894 -13.545
202 HB3 LYS 38 2HB LYS 38 12.607 -2.177 -14.615
203 HG2 LYS 38 1HG LYS 38 13.303 -0.482 -16.257
204 HG3 LYS 38 2HG LYS 38 12.685 0.804 -15.193
205 HD2 LYS 38 1HD LYS 38 14.284 0.119 -13.444
206 HD3 LYS 38 2HD LYS 38 14.907 -1.154 -14.520
207 HE2 LYS 38 1HE LYS 38 15.622 0.532 -16.138
208 HE3 LYS 38 2HE LYS 38 14.949 1.821 -15.113
209 HZ1 LYS 38 3HZ LYS 38 17.160 0.016 -14.366
210 HZ2 LYS 38 1HZ LYS 38 17.321 1.595 -14.815
211 HZ3 LYS 38 2HZ LYS 38 16.535 1.211 -13.415
212 H GLU 39 H GLU 39 10.178 0.093 -17.325
213 HA GLU 39 HA GLU 39 11.106 -2.034 -19.227
214 HB2 GLU 39 1HB GLU 39 8.618 -0.325 -19.378
215 HB3 GLU 39 2HB GLU 39 9.227 -1.377 -20.681
216 HG2 GLU 39 1HG GLU 39 8.884 -3.381 -19.119
217 HG3 GLU 39 2HG GLU 39 8.284 -2.175 -17.958
218 H GLY 40 H GLY 40 11.883 -1.391 -21.211
219 HA2 GLY 40 1HA GLY 40 12.421 0.232 -22.873
220 HA3 GLY 40 2HA GLY 40 12.156 1.526 -21.682
221 HA PRO 41 HA PRO 41 16.666 0.542 -22.102
222 HB2 PRO 41 1HB PRO 41 17.330 2.692 -23.218
223 HB3 PRO 41 2HB PRO 41 16.799 1.393 -24.046
224 HG2 PRO 41 1HG PRO 41 15.473 3.582 -23.552
225 HG3 PRO 41 2HG PRO 41 15.461 2.733 -24.945
226 HD2 PRO 41 1HD PRO 41 13.570 2.393 -23.402
227 HD3 PRO 41 2HD PRO 41 14.201 1.120 -24.204
228 H SER 42 H SER 42 18.401 1.412 -20.874
229 HA SER 42 HA SER 42 17.596 2.663 -18.409
230 HB2 SER 42 1HB SER 42 19.809 2.799 -17.868
231 HB3 SER 42 2HB SER 42 19.482 1.238 -18.656
232 HG SER 42 HG SER 42 21.413 2.221 -19.398
233 H HIS 43 H HIS 43 18.312 3.955 -21.565
234 HA HIS 43 HA HIS 43 19.096 6.612 -20.614
235 HB2 HIS 43 1HB HIS 43 18.328 5.571 -23.377
236 HB3 HIS 43 2HB HIS 43 18.903 7.222 -23.041
237 HD2 HIS 43 HD2 HIS 43 20.416 3.819 -24.056
238 HE1 HIS 43 HE1 HIS 43 23.507 6.170 -22.332
239 HE2 HIS 43 HE2 HIS 43 22.886 4.025 -23.720
240 H LYS 44 H LYS 44 16.131 4.970 -21.315
241 HA LYS 44 HA LYS 44 14.610 7.326 -20.424
242 HB2 LYS 44 1HB LYS 44 14.929 7.736 -22.833
243 HB3 LYS 44 2HB LYS 44 14.187 6.157 -23.180
244 HG2 LYS 44 1HG LYS 44 12.073 6.908 -22.209
245 HG3 LYS 44 2HG LYS 44 12.806 8.471 -21.781
246 HD2 LYS 44 1HD LYS 44 13.198 8.948 -24.160
247 HD3 LYS 44 2HD LYS 44 12.480 7.378 -24.596
248 HE2 LYS 44 1HE LYS 44 10.346 8.075 -23.595
249 HE3 LYS 44 2HE LYS 44 11.062 9.644 -23.158
250 HZ1 LYS 44 3HZ LYS 44 10.718 8.621 -25.904
251 HZ2 LYS 44 1HZ LYS 44 9.789 9.781 -25.190
252 HZ3 LYS 44 2HZ LYS 44 11.383 10.076 -25.500
253 H SER 45 H SER 45 14.790 5.202 -18.954
254 HA SER 45 HA SER 45 12.874 3.053 -19.597
255 HB2 SER 45 1HB SER 45 13.378 2.164 -17.559
256 HB3 SER 45 2HB SER 45 14.877 2.674 -18.370
257 HG SER 45 HG SER 45 14.842 4.537 -17.029
258 H LEU 46 H LEU 46 10.872 2.718 -18.692
259 HA LEU 46 HA LEU 46 9.717 4.982 -17.102
260 HB2 LEU 46 1HB LEU 46 8.486 2.876 -18.756
261 HB3 LEU 46 2HB LEU 46 7.478 4.076 -17.916
262 HG LEU 46 HG LEU 46 9.439 4.601 -20.182
263 HD11 LEU 46 1HD1 LEU 46 7.377 5.296 -21.431
264 HD12 LEU 46 2HD1 LEU 46 7.274 3.599 -20.906
265 HD13 LEU 46 3HD1 LEU 46 6.392 4.863 -20.015
266 HD21 LEU 46 3HD2 LEU 46 9.482 6.419 -18.579
267 HD22 LEU 46 1HD2 LEU 46 8.664 6.944 -20.069
268 HD23 LEU 46 2HD2 LEU 46 7.708 6.539 -18.623
269 H PHE 47 H PHE 47 8.581 4.614 -15.264
270 HA PHE 47 HA PHE 47 9.004 1.885 -14.084
271 HB2 PHE 47 1HB PHE 47 9.017 4.634 -12.767
272 HB3 PHE 47 2HB PHE 47 9.030 3.096 -11.877
273 HD1 PHE 47 HD2 PHE 47 10.979 1.691 -11.842
274 HD2 PHE 47 HD1 PHE 47 10.950 5.404 -13.956
275 HE1 PHE 47 HE2 PHE 47 13.447 1.635 -11.971
276 HE2 PHE 47 HE1 PHE 47 13.417 5.349 -14.090
277 HZ PHE 47 HZ PHE 47 14.666 3.464 -13.096
278 H GLN 48 H GLN 48 7.372 0.790 -13.286
279 HA GLN 48 HA GLN 48 4.828 2.235 -12.709
280 HB2 GLN 48 1HB GLN 48 4.654 1.287 -14.967
281 HB3 GLN 48 2HB GLN 48 5.098 -0.311 -14.322
282 HG2 GLN 48 1HG GLN 48 2.784 -0.242 -12.950
283 HG3 GLN 48 2HG GLN 48 2.838 1.377 -13.685
284 HE21 GLN 48 2HE2 GLN 48 1.144 1.398 -15.042
285 HE22 GLN 48 1HE2 GLN 48 0.855 0.233 -16.292
286 H SER 49 H SER 49 3.939 1.732 -10.866
287 HA SER 49 HA SER 49 5.154 -0.450 -9.207
288 HB2 SER 49 1HB SER 49 3.400 1.833 -8.551
289 HB3 SER 49 2HB SER 49 3.885 0.540 -7.432
290 HG SER 49 HG SER 49 5.790 1.994 -8.916
291 H THR 50 H THR 50 4.064 -2.224 -8.557
292 HA THR 50 HA THR 50 1.166 -2.446 -9.301
293 HB THR 50 HB THR 50 3.286 -4.635 -9.398
294 HG1 THR 50 HG1 THR 50 1.688 -3.669 -11.544
295 HG21 THR 50 1HG2 THR 50 1.450 -6.047 -10.257
296 HG22 THR 50 2HG2 THR 50 1.092 -5.462 -8.615
297 HG23 THR 50 3HG2 THR 50 0.306 -4.705 -10.020
298 H VAL 51 H VAL 51 -0.092 -2.563 -7.636
299 HA VAL 51 HA VAL 51 0.896 -4.019 -5.185
300 HB VAL 51 HB VAL 51 -1.194 -1.812 -5.407
301 HG11 VAL 51 1HG1 VAL 51 -1.236 -1.949 -2.939
302 HG12 VAL 51 2HG1 VAL 51 -1.724 -3.494 -3.675
303 HG13 VAL 51 3HG1 VAL 51 -0.090 -3.309 -2.995
304 HG21 VAL 51 3HG2 VAL 51 1.049 -0.934 -5.667
305 HG22 VAL 51 1HG2 VAL 51 0.367 -0.469 -4.090
306 HG23 VAL 51 2HG2 VAL 51 1.571 -1.777 -4.189
307 H ILE 52 H ILE 52 0.160 -5.931 -4.964
308 HA ILE 52 HA ILE 52 -2.584 -6.540 -6.031
309 HB ILE 52 HB ILE 52 -0.257 -8.404 -5.370
310 HG12 ILE 52 1HG1 ILE 52 -1.445 -7.730 -8.047
311 HG13 ILE 52 2HG1 ILE 52 0.025 -6.986 -7.375
312 HG21 ILE 52 1HG2 ILE 52 -1.686 -10.155 -6.372
313 HG22 ILE 52 2HG2 ILE 52 -2.469 -9.427 -4.949
314 HG23 ILE 52 3HG2 ILE 52 -2.994 -8.966 -6.586
315 HD11 ILE 52 3HD1 ILE 52 -0.361 -9.942 -7.965
316 HD12 ILE 52 1HD1 ILE 52 0.585 -8.799 -8.945
317 HD13 ILE 52 2HD1 ILE 52 1.108 -9.197 -7.292
318 H LEU 53 H LEU 53 -4.166 -6.672 -4.727
319 HA LEU 53 HA LEU 53 -3.731 -7.836 -2.029
320 HB2 LEU 53 1HB LEU 53 -3.389 -5.599 -1.724
321 HB3 LEU 53 2HB LEU 53 -4.866 -5.035 -2.537
322 HG LEU 53 HG LEU 53 -6.179 -6.303 -0.771
323 HD11 LEU 53 1HD1 LEU 53 -4.964 -6.783 1.370
324 HD12 LEU 53 2HD1 LEU 53 -4.309 -7.747 0.025
325 HD13 LEU 53 3HD1 LEU 53 -3.437 -6.302 0.594
326 HD21 LEU 53 3HD2 LEU 53 -5.976 -3.888 -0.734
327 HD22 LEU 53 1HD2 LEU 53 -5.933 -4.527 0.927
328 HD23 LEU 53 2HD2 LEU 53 -4.428 -4.003 0.136
329 H ASP 54 H ASP 54 -5.173 -9.288 -1.590
330 HA ASP 54 HA ASP 54 -7.163 -10.486 -1.620
331 HB2 ASP 54 1HB ASP 54 -8.018 -7.984 -1.004
332 HB3 ASP 54 2HB ASP 54 -8.527 -8.145 -2.704
333 H GLY 55 H GLY 55 -5.479 -10.381 -3.966
334 HA2 GLY 55 1HA GLY 55 -5.591 -11.467 -6.017
335 HA3 GLY 55 2HA GLY 55 -7.332 -11.721 -5.754
336 H VAL 56 H VAL 56 -6.429 -8.483 -5.318
337 HA VAL 56 HA VAL 56 -7.295 -7.785 -8.123
338 HB VAL 56 HB VAL 56 -7.617 -6.163 -5.563
339 HG11 VAL 56 1HG1 VAL 56 -8.984 -4.684 -6.997
340 HG12 VAL 56 2HG1 VAL 56 -7.315 -4.799 -7.603
341 HG13 VAL 56 3HG1 VAL 56 -8.618 -5.709 -8.404
342 HG21 VAL 56 3HG2 VAL 56 -9.095 -8.082 -5.537
343 HG22 VAL 56 1HG2 VAL 56 -10.013 -6.581 -5.801
344 HG23 VAL 56 2HG2 VAL 56 -9.683 -7.675 -7.167
345 H ARG 57 H ARG 57 -5.982 -6.813 -9.390
346 HA ARG 57 HA ARG 57 -3.360 -5.970 -8.246
347 HB2 ARG 57 1HB ARG 57 -3.281 -7.613 -9.969
348 HB3 ARG 57 2HB ARG 57 -4.151 -6.522 -11.072
349 HG2 ARG 57 1HG ARG 57 -2.305 -4.973 -11.097
350 HG3 ARG 57 2HG ARG 57 -1.458 -5.896 -9.832
351 HD2 ARG 57 1HD ARG 57 -2.055 -6.841 -12.619
352 HD3 ARG 57 2HD ARG 57 -0.494 -6.231 -12.020
353 HE ARG 57 HE ARG 57 -1.040 -8.522 -10.422
354 HH11 ARG 57 1HH1 ARG 57 -0.790 -7.938 -13.851
355 HH12 ARG 57 2HH1 ARG 57 -0.200 -9.570 -14.092
356 HH21 ARG 57 1HH2 ARG 57 -0.374 -10.397 -10.683
357 HH22 ARG 57 2HH2 ARG 57 0.036 -10.975 -12.287
358 H TYR 58 H TYR 58 -2.800 -3.969 -7.991
359 HA TYR 58 HA TYR 58 -4.355 -1.869 -9.469
360 HB2 TYR 58 1HB TYR 58 -2.856 -1.603 -6.859
361 HB3 TYR 58 2HB TYR 58 -3.875 -0.378 -7.652
362 HD1 TYR 58 HD2 TYR 58 -6.376 -1.090 -8.047
363 HD2 TYR 58 HD1 TYR 58 -3.803 -2.931 -5.188
364 HE1 TYR 58 HE2 TYR 58 -8.353 -1.923 -6.820
365 HE2 TYR 58 HE1 TYR 58 -5.773 -3.773 -3.945
366 HH TYR 58 HH TYR 58 -8.040 -3.872 -3.842
367 H ASN 59 H ASN 59 -3.231 -1.415 -11.224
368 HA ASN 59 HA ASN 59 -0.278 -1.085 -11.001
369 HB2 ASN 59 1HB ASN 59 -1.934 -1.062 -13.634
370 HB3 ASN 59 2HB ASN 59 -0.235 -0.839 -13.150
371 HD21 ASN 59 2HD2 ASN 59 -2.658 -3.035 -14.000
372 HD22 ASN 59 1HD2 ASN 59 -1.797 -4.502 -13.676
373 H SER 60 H SER 60 0.803 0.755 -11.241
374 HA SER 60 HA SER 60 -0.566 3.327 -10.891
375 HB2 SER 60 1HB SER 60 1.493 4.287 -10.867
376 HB3 SER 60 2HB SER 60 1.542 2.793 -9.905
377 HG SER 60 HG SER 60 2.681 3.324 -12.425
378 H LEU 61 H LEU 61 -0.038 5.163 -12.347
379 HA LEU 61 HA LEU 61 -0.736 4.555 -15.115
380 HB2 LEU 61 1HB LEU 61 0.155 6.963 -13.674
381 HB3 LEU 61 2HB LEU 61 -0.369 7.103 -15.368
382 HG LEU 61 HG LEU 61 -2.084 6.253 -13.001
383 HD11 LEU 61 1HD1 LEU 61 -3.328 8.378 -13.483
384 HD12 LEU 61 2HD1 LEU 61 -1.623 8.702 -13.086
385 HD13 LEU 61 3HD1 LEU 61 -2.167 8.745 -14.780
386 HD21 LEU 61 3HD2 LEU 61 -2.705 5.044 -15.008
387 HD22 LEU 61 1HD2 LEU 61 -3.958 6.243 -14.611
388 HD23 LEU 61 2HD2 LEU 61 -2.804 6.564 -15.929
389 HA PRO 62 HA PRO 62 3.284 4.080 -16.598
390 HB2 PRO 62 1HB PRO 62 2.669 3.973 -19.021
391 HB3 PRO 62 2HB PRO 62 2.290 2.786 -17.971
392 HG2 PRO 62 1HG PRO 62 0.667 4.554 -18.987
393 HG3 PRO 62 2HG PRO 62 0.346 2.975 -18.732
394 HD2 PRO 62 1HD PRO 62 -0.502 4.510 -17.012
395 HD3 PRO 62 2HD PRO 62 0.147 3.090 -16.542
396 H GLY 63 H GLY 63 4.891 5.096 -18.004
397 HA2 GLY 63 1HA GLY 63 5.547 6.908 -19.415
398 HA3 GLY 63 2HA GLY 63 4.064 7.781 -18.966
399 H PHE 64 H PHE 64 5.353 6.406 -16.215
400 HA PHE 64 HA PHE 64 6.448 9.008 -15.317
401 HB2 PHE 64 1HB PHE 64 5.899 6.378 -13.878
402 HB3 PHE 64 2HB PHE 64 6.600 7.815 -13.099
403 HD1 PHE 64 HD1 PHE 64 4.629 9.444 -15.190
404 HD2 PHE 64 HD2 PHE 64 4.238 6.636 -11.994
405 HE1 PHE 64 HE1 PHE 64 2.358 10.299 -14.718
406 HE2 PHE 64 HE2 PHE 64 1.965 7.487 -11.521
407 HZ PHE 64 HZ PHE 64 1.027 9.322 -12.884
408 H PHE 65 H PHE 65 8.481 9.446 -14.713
409 HA PHE 65 HA PHE 65 10.515 7.499 -15.738
410 HB2 PHE 65 1HB PHE 65 10.619 10.528 -15.407
411 HB3 PHE 65 2HB PHE 65 11.990 9.517 -15.918
412 HD1 PHE 65 HD2 PHE 65 11.911 8.328 -18.070
413 HD2 PHE 65 HD1 PHE 65 8.920 11.147 -16.904
414 HE1 PHE 65 HE2 PHE 65 11.188 8.532 -20.425
415 HE2 PHE 65 HE1 PHE 65 8.192 11.352 -19.258
416 HZ PHE 65 HZ PHE 65 9.326 10.043 -21.019
417 H ASN 66 H ASN 66 9.149 7.867 -12.967
418 HA ASN 66 HA ASN 66 11.598 7.101 -11.531
419 HB2 ASN 66 1HB ASN 66 11.534 8.925 -9.795
420 HB3 ASN 66 2HB ASN 66 11.501 9.370 -11.519
421 HD21 ASN 66 2HD2 ASN 66 10.283 11.026 -11.918
422 HD22 ASN 66 1HD2 ASN 66 8.790 11.426 -11.134
423 H ARG 67 H ARG 67 11.152 6.366 -9.325
424 HA ARG 67 HA ARG 67 8.838 4.570 -9.506
425 HB2 ARG 67 1HB ARG 67 11.033 4.825 -7.504
426 HB3 ARG 67 2HB ARG 67 9.675 3.683 -7.373
427 HG2 ARG 67 1HG ARG 67 10.347 2.610 -9.462
428 HG3 ARG 67 2HG ARG 67 11.678 3.778 -9.651
429 HD2 ARG 67 1HD ARG 67 12.727 2.917 -7.660
430 HD3 ARG 67 2HD ARG 67 11.387 1.767 -7.440
431 HE ARG 67 HE ARG 67 12.562 1.126 -9.974
432 HH11 ARG 67 1HH1 ARG 67 13.659 1.264 -6.667
433 HH12 ARG 67 2HH1 ARG 67 14.806 -0.023 -6.987
434 HH21 ARG 67 1HH2 ARG 67 13.875 -0.342 -10.359
435 HH22 ARG 67 2HH2 ARG 67 14.931 -0.938 -9.093
436 H LYS 68 H LYS 68 9.709 7.460 -7.720
437 HA LYS 68 HA LYS 68 7.932 7.139 -5.517
438 HB2 LYS 68 1HB LYS 68 9.738 8.796 -5.635
439 HB3 LYS 68 2HB LYS 68 8.837 9.675 -6.893
440 HG2 LYS 68 1HG LYS 68 7.040 10.154 -5.309
441 HG3 LYS 68 2HG LYS 68 7.876 9.214 -4.049
442 HD2 LYS 68 1HD LYS 68 9.760 10.782 -4.108
443 HD3 LYS 68 2HD LYS 68 8.964 11.707 -5.403
444 HE2 LYS 68 1HE LYS 68 7.084 12.198 -3.892
445 HE3 LYS 68 2HE LYS 68 7.891 11.285 -2.596
446 HZ1 LYS 68 3HZ LYS 68 8.944 13.718 -3.891
447 HZ2 LYS 68 1HZ LYS 68 8.268 13.648 -2.387
448 HZ3 LYS 68 2HZ LYS 68 9.692 12.871 -2.689
449 H ALA 69 H ALA 69 7.416 8.782 -8.641
450 HA ALA 69 HA ALA 69 4.724 9.561 -8.069
451 HB1 ALA 69 3HB ALA 69 6.059 9.007 -10.740
452 HB2 ALA 69 1HB ALA 69 4.521 9.870 -10.505
453 HB3 ALA 69 2HB ALA 69 6.036 10.566 -9.882
454 H ALA 70 H ALA 70 6.081 6.664 -9.618
455 HA ALA 70 HA ALA 70 3.603 5.475 -10.349
456 HB1 ALA 70 3HB ALA 70 6.209 4.144 -9.535
457 HB2 ALA 70 1HB ALA 70 4.861 3.357 -10.386
458 HB3 ALA 70 2HB ALA 70 5.766 4.669 -11.176
459 H GLU 71 H GLU 71 5.465 5.308 -7.325
460 HA GLU 71 HA GLU 71 3.794 3.361 -6.038
461 HB2 GLU 71 1HB GLU 71 5.573 5.558 -4.980
462 HB3 GLU 71 2HB GLU 71 4.721 4.392 -3.938
463 HG2 GLU 71 1HG GLU 71 6.024 2.511 -5.002
464 HG3 GLU 71 2HG GLU 71 6.692 3.747 -6.091
465 H GLN 72 H GLN 72 3.675 6.915 -6.098
466 HA GLN 72 HA GLN 72 1.462 7.113 -4.260
467 HB2 GLN 72 1HB GLN 72 2.510 8.949 -6.419
468 HB3 GLN 72 2HB GLN 72 1.182 9.374 -5.315
469 HG2 GLN 72 1HG GLN 72 2.978 9.145 -3.315
470 HG3 GLN 72 2HG GLN 72 3.915 8.630 -4.737
471 HE21 GLN 72 2HE2 GLN 72 4.633 10.713 -2.912
472 HE22 GLN 72 1HE2 GLN 72 4.658 12.202 -3.798
473 H SER 73 H SER 73 1.663 6.887 -7.792
474 HA SER 73 HA SER 73 -1.131 7.307 -8.396
475 HB2 SER 73 1HB SER 73 0.428 7.536 -10.052
476 HB3 SER 73 2HB SER 73 1.005 5.868 -9.842
477 HG SER 73 HG SER 73 -1.603 6.649 -10.641
478 H ALA 74 H ALA 74 0.806 4.358 -7.748
479 HA ALA 74 HA ALA 74 -1.335 2.507 -8.132
480 HB1 ALA 74 3HB ALA 74 1.144 2.267 -6.395
481 HB2 ALA 74 1HB ALA 74 0.089 0.924 -6.894
482 HB3 ALA 74 2HB ALA 74 1.020 1.824 -8.114
483 H ALA 75 H ALA 75 -0.170 4.210 -5.241
484 HA ALA 75 HA ALA 75 -1.952 2.939 -3.401
485 HB1 ALA 75 3HB ALA 75 -0.735 5.719 -3.317
486 HB2 ALA 75 1HB ALA 75 -1.495 4.875 -1.948
487 HB3 ALA 75 2HB ALA 75 -0.002 4.232 -2.672
488 H GLU 76 H GLU 76 -2.293 5.833 -5.430
489 HA GLU 76 HA GLU 76 -4.827 6.659 -4.343
490 HB2 GLU 76 1HB GLU 76 -3.450 7.121 -6.984
491 HB3 GLU 76 2HB GLU 76 -5.040 7.815 -6.586
492 HG2 GLU 76 1HG GLU 76 -4.021 9.129 -4.722
493 HG3 GLU 76 2HG GLU 76 -2.534 8.196 -5.006
494 H VAL 77 H VAL 77 -3.971 4.566 -7.085
495 HA VAL 77 HA VAL 77 -6.687 4.117 -7.978
496 HB VAL 77 HB VAL 77 -4.154 2.447 -8.234
497 HG11 VAL 77 1HG1 VAL 77 -5.394 1.163 -9.945
498 HG12 VAL 77 2HG1 VAL 77 -6.160 1.006 -8.346
499 HG13 VAL 77 3HG1 VAL 77 -6.868 2.088 -9.570
500 HG21 VAL 77 3HG2 VAL 77 -4.061 4.571 -9.396
501 HG22 VAL 77 1HG2 VAL 77 -4.181 3.223 -10.551
502 HG23 VAL 77 2HG2 VAL 77 -5.611 4.222 -10.198
503 H ALA 78 H ALA 78 -4.628 2.337 -5.691
504 HA ALA 78 HA ALA 78 -6.539 0.265 -5.215
505 HB1 ALA 78 3HB ALA 78 -4.361 1.350 -3.398
506 HB2 ALA 78 1HB ALA 78 -5.223 -0.191 -3.183
507 HB3 ALA 78 2HB ALA 78 -4.174 0.051 -4.599
508 H LEU 79 H LEU 79 -5.952 3.369 -3.579
509 HA LEU 79 HA LEU 79 -7.902 2.930 -1.499
510 HB2 LEU 79 1HB LEU 79 -6.641 5.271 -2.748
511 HB3 LEU 79 2HB LEU 79 -7.739 5.552 -1.376
512 HG LEU 79 HG LEU 79 -5.176 3.910 -1.302
513 HD11 LEU 79 1HD1 LEU 79 -4.310 5.774 0.135
514 HD12 LEU 79 2HD1 LEU 79 -4.746 6.358 -1.489
515 HD13 LEU 79 3HD1 LEU 79 -5.836 6.654 -0.112
516 HD21 LEU 79 3HD2 LEU 79 -6.856 3.066 0.230
517 HD22 LEU 79 1HD2 LEU 79 -5.546 3.855 1.140
518 HD23 LEU 79 2HD2 LEU 79 -7.099 4.694 0.907
519 H ARG 80 H ARG 80 -8.075 4.455 -4.695
520 HA ARG 80 HA ARG 80 -10.774 5.427 -4.376
521 HB2 ARG 80 1HB ARG 80 -9.099 4.896 -6.779
522 HB3 ARG 80 2HB ARG 80 -10.780 5.472 -6.856
523 HG2 ARG 80 1HG ARG 80 -10.179 7.476 -5.604
524 HG3 ARG 80 2HG ARG 80 -8.506 6.891 -5.436
525 HD2 ARG 80 1HD ARG 80 -8.212 7.036 -7.829
526 HD3 ARG 80 2HD ARG 80 -9.888 7.610 -8.002
527 HE ARG 80 HE ARG 80 -8.503 9.520 -6.337
528 HH11 ARG 80 1HH1 ARG 80 -8.315 8.347 -9.616
529 HH12 ARG 80 2HH1 ARG 80 -7.715 9.907 -10.145
530 HH21 ARG 80 1HH2 ARG 80 -7.809 11.307 -6.926
531 HH22 ARG 80 2HH2 ARG 80 -7.425 11.596 -8.612
532 H GLU 81 H GLU 81 -9.430 2.424 -5.719
533 HA GLU 81 HA GLU 81 -11.968 1.334 -6.537
534 HB2 GLU 81 1HB GLU 81 -9.310 0.107 -5.816
535 HB3 GLU 81 2HB GLU 81 -10.718 -0.861 -6.321
536 HG2 GLU 81 1HG GLU 81 -9.285 1.248 -8.049
537 HG3 GLU 81 2HG GLU 81 -9.224 -0.528 -8.126
538 H LEU 82 H LEU 82 -10.148 1.179 -3.499
539 HA LEU 82 HA LEU 82 -11.959 -0.602 -2.153
540 HB2 LEU 82 1HB LEU 82 -9.818 -0.161 -1.426
541 HB3 LEU 82 2HB LEU 82 -10.075 1.564 -1.073
542 HG LEU 82 HG LEU 82 -11.794 0.879 0.632
543 HD11 LEU 82 1HD1 LEU 82 -11.716 -1.496 1.438
544 HD12 LEU 82 2HD1 LEU 82 -12.238 -1.407 -0.259
545 HD13 LEU 82 3HD1 LEU 82 -10.571 -1.886 0.134
546 HD21 LEU 82 3HD2 LEU 82 -9.555 1.528 1.299
547 HD22 LEU 82 1HD2 LEU 82 -10.144 0.216 2.347
548 HD23 LEU 82 2HD2 LEU 82 -8.968 -0.135 1.056
549 H ALA 83 H ALA 83 -11.881 2.938 -2.450
550 HA ALA 83 HA ALA 83 -14.009 3.476 -0.655
551 HB1 ALA 83 3HB ALA 83 -13.205 4.976 -3.171
552 HB2 ALA 83 1HB ALA 83 -14.241 5.608 -1.870
553 HB3 ALA 83 2HB ALA 83 -12.534 5.224 -1.543
554 H LYS 84 H LYS 84 -14.030 2.355 -3.982
555 HA LYS 84 HA LYS 84 -16.762 3.058 -4.568
556 HB2 LYS 84 1HB LYS 84 -14.881 0.983 -5.692
557 HB3 LYS 84 2HB LYS 84 -16.521 1.268 -6.320
558 HG2 LYS 84 1HG LYS 84 -15.932 3.558 -6.915
559 HG3 LYS 84 2HG LYS 84 -14.313 3.349 -6.205
560 HD2 LYS 84 1HD LYS 84 -13.793 1.613 -7.852
561 HD3 LYS 84 2HD LYS 84 -15.424 1.765 -8.545
562 HE2 LYS 84 1HE LYS 84 -14.962 4.088 -9.164
563 HE3 LYS 84 2HE LYS 84 -13.343 3.970 -8.437
564 HZ1 LYS 84 3HZ LYS 84 -14.311 2.392 -10.735
565 HZ2 LYS 84 1HZ LYS 84 -13.273 3.672 -10.819
566 HZ3 LYS 84 2HZ LYS 84 -12.809 2.282 -10.061
567 H SER 85 H SER 85 -15.357 0.538 -2.677
568 HA SER 85 HA SER 85 -17.491 -1.447 -2.904
569 HB2 SER 85 1HB SER 85 -16.497 -2.549 -1.186
570 HB3 SER 85 2HB SER 85 -15.238 -1.951 -2.291
571 HG SER 85 HG SER 85 -15.991 -0.776 0.179
572 H SER 86 H SER 86 -17.104 1.574 -1.206
573 HA SER 86 HA SER 86 -18.664 1.223 1.158
574 HB2 SER 86 1HB SER 86 -17.342 3.099 0.810
575 HB3 SER 86 2HB SER 86 -18.358 3.614 -0.556
576 HG SER 86 HG SER 86 -18.928 4.639 1.410
Start of MODEL 4
1 H PHE 16 H PHE 16 0.528 4.639 -0.001
2 HA PHE 16 HA PHE 16 -1.452 2.409 0.865
3 HB2 PHE 16 1HB PHE 16 -0.753 0.762 -0.720
4 HB3 PHE 16 2HB PHE 16 -0.748 2.299 -1.613
5 HD1 PHE 16 HD2 PHE 16 1.362 3.405 -2.167
6 HD2 PHE 16 HD1 PHE 16 1.231 -0.458 -0.348
7 HE1 PHE 16 HE2 PHE 16 3.706 3.009 -2.846
8 HE2 PHE 16 HE1 PHE 16 3.576 -0.857 -1.021
9 HZ PHE 16 HZ PHE 16 4.814 0.877 -2.270
10 H LYS 17 H LYS 17 1.948 3.173 1.137
11 HA LYS 17 HA LYS 17 2.725 0.820 2.609
12 HB2 LYS 17 1HB LYS 17 3.829 3.632 2.585
13 HB3 LYS 17 2HB LYS 17 4.600 2.241 3.385
14 HG2 LYS 17 1HG LYS 17 4.791 1.108 1.192
15 HG3 LYS 17 2HG LYS 17 4.072 2.536 0.409
16 HD2 LYS 17 1HD LYS 17 5.943 3.920 1.246
17 HD3 LYS 17 2HD LYS 17 6.668 2.473 1.985
18 HE2 LYS 17 1HE LYS 17 6.852 1.428 -0.229
19 HE3 LYS 17 2HE LYS 17 6.120 2.867 -0.973
20 HZ1 LYS 17 3HZ LYS 17 8.678 2.810 0.496
21 HZ2 LYS 17 1HZ LYS 17 8.515 2.900 -1.143
22 HZ3 LYS 17 2HZ LYS 17 7.999 4.146 -0.194
23 H SER 18 H SER 18 2.282 0.163 4.546
24 HA SER 18 HA SER 18 1.736 0.287 6.888
25 HB2 SER 18 1HB SER 18 3.199 2.240 6.835
26 HB3 SER 18 2HB SER 18 1.730 3.223 6.639
27 HG SER 18 HG SER 18 2.326 2.945 8.832
28 H ARG 19 H ARG 19 0.132 2.936 5.059
29 HA ARG 19 HA ARG 19 -2.320 2.878 6.480
30 HB2 ARG 19 1HB ARG 19 -1.683 4.694 5.073
31 HB3 ARG 19 2HB ARG 19 -1.850 3.656 3.637
32 HG2 ARG 19 1HG ARG 19 -4.239 3.419 4.047
33 HG3 ARG 19 2HG ARG 19 -4.098 4.374 5.543
34 HD2 ARG 19 1HD ARG 19 -3.474 6.314 4.259
35 HD3 ARG 19 2HD ARG 19 -3.575 5.363 2.758
36 HE ARG 19 HE ARG 19 -6.026 5.631 2.889
37 HH11 ARG 19 1HH1 ARG 19 -4.568 6.639 5.893
38 HH12 ARG 19 2HH1 ARG 19 -6.084 7.361 6.394
39 HH21 ARG 19 1HH2 ARG 19 -7.771 6.446 3.453
40 HH22 ARG 19 2HH2 ARG 19 -7.912 7.251 5.004
41 H LEU 20 H LEU 20 -1.789 1.500 3.219
42 HA LEU 20 HA LEU 20 -4.313 0.131 3.230
43 HB2 LEU 20 1HB LEU 20 -3.201 0.765 1.313
44 HB3 LEU 20 2HB LEU 20 -1.791 -0.297 1.537
45 HG LEU 20 HG LEU 20 -3.403 -2.258 1.451
46 HD11 LEU 20 1HD1 LEU 20 -5.599 -1.827 0.317
47 HD12 LEU 20 2HD1 LEU 20 -5.491 -0.959 1.865
48 HD13 LEU 20 3HD1 LEU 20 -5.249 -0.083 0.335
49 HD21 LEU 20 3HD2 LEU 20 -1.954 -1.701 -0.412
50 HD22 LEU 20 1HD2 LEU 20 -3.533 -2.256 -1.017
51 HD23 LEU 20 2HD2 LEU 20 -3.138 -0.519 -1.018
52 H GLN 21 H GLN 21 -1.029 -0.930 4.045
53 HA GLN 21 HA GLN 21 -1.594 -3.689 4.412
54 HB2 GLN 21 1HB GLN 21 0.318 -1.820 5.821
55 HB3 GLN 21 2HB GLN 21 0.277 -3.578 6.094
56 HG2 GLN 21 1HG GLN 21 0.931 -3.836 3.485
57 HG3 GLN 21 2HG GLN 21 0.728 -2.077 3.665
58 HE21 GLN 21 2HE2 GLN 21 3.056 -3.331 2.650
59 HE22 GLN 21 1HE2 GLN 21 4.357 -3.029 3.754
60 H GLU 22 H GLU 22 -1.843 -1.000 6.738
61 HA GLU 22 HA GLU 22 -2.702 -2.625 8.942
62 HB2 GLU 22 1HB GLU 22 -1.849 -0.335 9.153
63 HB3 GLU 22 2HB GLU 22 -3.297 0.271 8.315
64 HG2 GLU 22 1HG GLU 22 -4.722 -0.568 10.240
65 HG3 GLU 22 2HG GLU 22 -3.201 -1.196 10.917
66 H TYR 23 H TYR 23 -4.547 -0.824 6.483
67 HA TYR 23 HA TYR 23 -7.141 -1.494 7.483
68 HB2 TYR 23 1HB TYR 23 -6.025 -0.730 4.805
69 HB3 TYR 23 2HB TYR 23 -7.716 -1.267 4.956
70 HD1 TYR 23 HD2 TYR 23 -8.970 -0.061 7.045
71 HD2 TYR 23 HD1 TYR 23 -5.694 1.565 4.852
72 HE1 TYR 23 HE2 TYR 23 -9.638 2.211 7.752
73 HE2 TYR 23 HE1 TYR 23 -6.349 3.850 5.553
74 HH TYR 23 HH TYR 23 -9.179 4.439 7.643
75 H ALA 24 H ALA 24 -5.022 -3.184 5.180
76 HA ALA 24 HA ALA 24 -6.815 -5.271 4.514
77 HB1 ALA 24 3HB ALA 24 -3.791 -5.369 4.788
78 HB2 ALA 24 1HB ALA 24 -4.797 -6.565 3.938
79 HB3 ALA 24 2HB ALA 24 -4.696 -4.894 3.332
80 H GLN 25 H GLN 25 -4.448 -5.071 7.176
81 HA GLN 25 HA GLN 25 -5.008 -7.631 8.304
82 HB2 GLN 25 1HB GLN 25 -4.112 -5.022 9.538
83 HB3 GLN 25 2HB GLN 25 -4.222 -6.552 10.437
84 HG2 GLN 25 1HG GLN 25 -2.347 -7.504 8.748
85 HG3 GLN 25 2HG GLN 25 -2.680 -5.887 8.085
86 HE21 GLN 25 2HE2 GLN 25 -0.113 -6.871 8.841
87 HE22 GLN 25 1HE2 GLN 25 0.458 -5.904 10.161
88 H LYS 26 H LYS 26 -6.521 -4.464 8.865
89 HA LYS 26 HA LYS 26 -8.362 -5.419 10.874
90 HB2 LYS 26 1HB LYS 26 -8.443 -3.074 8.975
91 HB3 LYS 26 2HB LYS 26 -9.657 -3.376 10.241
92 HG2 LYS 26 1HG LYS 26 -7.917 -3.186 11.965
93 HG3 LYS 26 2HG LYS 26 -6.692 -2.906 10.706
94 HD2 LYS 26 1HD LYS 26 -7.823 -0.851 10.022
95 HD3 LYS 26 2HD LYS 26 -9.113 -1.145 11.212
96 HE2 LYS 26 1HE LYS 26 -7.475 -0.988 13.035
97 HE3 LYS 26 2HE LYS 26 -6.180 -0.704 11.850
98 HZ1 LYS 26 3HZ LYS 26 -8.507 1.053 12.298
99 HZ2 LYS 26 1HZ LYS 26 -6.968 1.349 12.813
100 HZ3 LYS 26 2HZ LYS 26 -7.306 1.316 11.199
101 H TYR 27 H TYR 27 -8.305 -5.611 7.405
102 HA TYR 27 HA TYR 27 -11.190 -6.359 7.331
103 HB2 TYR 27 1HB TYR 27 -9.151 -5.974 5.130
104 HB3 TYR 27 2HB TYR 27 -10.872 -6.365 4.900
105 HD1 TYR 27 HD1 TYR 27 -11.396 -4.414 7.478
106 HD2 TYR 27 HD2 TYR 27 -9.662 -3.988 3.605
107 HE1 TYR 27 HE1 TYR 27 -11.951 -2.000 7.505
108 HE2 TYR 27 HE2 TYR 27 -10.208 -1.577 3.614
109 HH TYR 27 HH TYR 27 -11.141 0.148 4.773
110 H LYS 28 H LYS 28 -8.481 -7.901 8.148
111 HA LYS 28 HA LYS 28 -7.794 -10.121 8.106
112 HB2 LYS 28 1HB LYS 28 -10.658 -10.595 7.265
113 HB3 LYS 28 2HB LYS 28 -9.518 -11.820 7.870
114 HG2 LYS 28 1HG LYS 28 -9.416 -10.614 10.037
115 HG3 LYS 28 2HG LYS 28 -10.623 -9.458 9.426
116 HD2 LYS 28 1HD LYS 28 -12.213 -11.337 9.097
117 HD3 LYS 28 2HD LYS 28 -11.011 -12.447 9.795
118 HE2 LYS 28 1HE LYS 28 -11.052 -11.183 11.897
119 HE3 LYS 28 2HE LYS 28 -12.242 -10.057 11.201
120 HZ1 LYS 28 3HZ LYS 28 -12.666 -12.943 11.639
121 HZ2 LYS 28 1HZ LYS 28 -13.294 -11.730 12.564
122 HZ3 LYS 28 2HZ LYS 28 -13.769 -11.900 10.993
123 H LEU 29 H LEU 29 -7.354 -8.542 5.777
124 HA LEU 29 HA LEU 29 -7.598 -10.606 3.623
125 HB2 LEU 29 1HB LEU 29 -6.901 -7.741 3.583
126 HB3 LEU 29 2HB LEU 29 -7.057 -8.671 2.074
127 HG LEU 29 HG LEU 29 -9.277 -7.977 4.036
128 HD11 LEU 29 1HD1 LEU 29 -10.209 -6.695 2.092
129 HD12 LEU 29 2HD1 LEU 29 -8.593 -6.102 2.541
130 HD13 LEU 29 3HD1 LEU 29 -8.791 -7.161 1.124
131 HD21 LEU 29 3HD2 LEU 29 -9.600 -10.209 3.148
132 HD22 LEU 29 1HD2 LEU 29 -10.795 -9.095 2.442
133 HD23 LEU 29 2HD2 LEU 29 -9.383 -9.611 1.487
134 HA PRO 30 HA PRO 30 -3.410 -11.563 3.570
135 HB2 PRO 30 1HB PRO 30 -3.716 -11.247 0.873
136 HB3 PRO 30 2HB PRO 30 -3.141 -12.506 1.733
137 HG2 PRO 30 1HG PRO 30 -5.637 -11.993 1.189
138 HG3 PRO 30 2HG PRO 30 -4.928 -13.462 1.198
139 HD2 PRO 30 1HD PRO 30 -6.594 -10.579 1.674
140 HD3 PRO 30 2HD PRO 30 -6.389 -12.083 2.272
141 H THR 31 H THR 31 -1.471 -10.564 3.767
142 HA THR 31 HA THR 31 -1.375 -7.754 3.777
143 HB THR 31 HB THR 31 0.954 -9.647 3.243
144 HG1 THR 31 HG1 THR 31 -0.216 -10.123 5.185
145 HG21 THR 31 1HG2 THR 31 2.307 -7.842 4.249
146 HG22 THR 31 2HG2 THR 31 1.462 -7.271 2.789
147 HG23 THR 31 3HG2 THR 31 0.849 -6.833 4.401
148 HA PRO 32 HA PRO 32 -1.619 -6.675 -0.384
149 HB2 PRO 32 1HB PRO 32 -0.594 -4.381 0.686
150 HB3 PRO 32 2HB PRO 32 -1.922 -4.623 -0.230
151 HG2 PRO 32 1HG PRO 32 -1.744 -4.848 2.361
152 HG3 PRO 32 2HG PRO 32 -2.991 -4.210 1.524
153 HD2 PRO 32 1HD PRO 32 -0.809 -5.995 3.301
154 HD3 PRO 32 2HD PRO 32 -2.344 -5.987 2.751
155 H VAL 33 H VAL 33 -0.338 -6.600 -2.190
156 HA VAL 33 HA VAL 33 2.624 -6.534 -1.613
157 HB VAL 33 HB VAL 33 1.132 -8.147 -3.725
158 HG11 VAL 33 1HG1 VAL 33 3.366 -9.081 -4.224
159 HG12 VAL 33 2HG1 VAL 33 3.334 -7.322 -4.490
160 HG13 VAL 33 3HG1 VAL 33 4.093 -7.987 -3.024
161 HG21 VAL 33 3HG2 VAL 33 0.842 -9.104 -1.519
162 HG22 VAL 33 1HG2 VAL 33 1.926 -10.111 -2.508
163 HG23 VAL 33 2HG2 VAL 33 2.600 -9.054 -1.245
164 H TYR 34 H TYR 34 3.783 -5.088 -2.531
165 HA TYR 34 HA TYR 34 2.585 -3.589 -4.836
166 HB2 TYR 34 1HB TYR 34 3.000 -2.143 -2.995
167 HB3 TYR 34 2HB TYR 34 4.619 -2.838 -2.738
168 HD1 TYR 34 HD1 TYR 34 2.596 -0.860 -5.177
169 HD2 TYR 34 HD2 TYR 34 6.498 -1.891 -3.799
170 HE1 TYR 34 HE1 TYR 34 3.568 0.872 -6.658
171 HE2 TYR 34 HE2 TYR 34 7.484 -0.168 -5.271
172 HH TYR 34 HH TYR 34 7.082 1.464 -6.809
173 H GLU 35 H GLU 35 3.382 -3.806 -6.763
174 HA GLU 35 HA GLU 35 6.244 -4.668 -7.020
175 HB2 GLU 35 1HB GLU 35 3.875 -5.445 -8.728
176 HB3 GLU 35 2HB GLU 35 5.577 -5.799 -9.108
177 HG2 GLU 35 1HG GLU 35 5.684 -7.207 -6.967
178 HG3 GLU 35 2HG GLU 35 3.974 -6.761 -6.776
179 H ILE 36 H ILE 36 7.432 -3.862 -8.720
180 HA ILE 36 HA ILE 36 6.178 -1.647 -10.298
181 HB ILE 36 HB ILE 36 7.414 -0.635 -8.352
182 HG12 ILE 36 1HG1 ILE 36 8.858 -0.187 -10.945
183 HG13 ILE 36 2HG1 ILE 36 7.206 0.389 -10.620
184 HG21 ILE 36 1HG2 ILE 36 9.877 -0.841 -8.299
185 HG22 ILE 36 2HG2 ILE 36 9.097 -2.423 -8.062
186 HG23 ILE 36 3HG2 ILE 36 9.808 -2.010 -9.639
187 HD11 ILE 36 3HD1 ILE 36 9.693 1.144 -9.047
188 HD12 ILE 36 1HD1 ILE 36 8.861 2.173 -10.236
189 HD13 ILE 36 2HD1 ILE 36 8.042 1.718 -8.722
190 H VAL 37 H VAL 37 6.788 -1.396 -12.314
191 HA VAL 37 HA VAL 37 8.740 -3.449 -13.353
192 HB VAL 37 HB VAL 37 6.281 -2.273 -14.717
193 HG11 VAL 37 1HG1 VAL 37 6.804 -3.909 -16.495
194 HG12 VAL 37 2HG1 VAL 37 8.142 -2.758 -16.270
195 HG13 VAL 37 3HG1 VAL 37 8.265 -4.406 -15.609
196 HG21 VAL 37 3HG2 VAL 37 5.649 -3.840 -12.980
197 HG22 VAL 37 1HG2 VAL 37 5.364 -4.534 -14.592
198 HG23 VAL 37 2HG2 VAL 37 6.773 -5.053 -13.638
199 H LYS 38 H LYS 38 10.499 -2.771 -14.183
200 HA LYS 38 HA LYS 38 10.610 0.063 -15.144
201 HB2 LYS 38 1HB LYS 38 12.163 -0.579 -13.346
202 HB3 LYS 38 2HB LYS 38 12.828 -1.850 -14.398
203 HG2 LYS 38 1HG LYS 38 13.551 -0.106 -16.007
204 HG3 LYS 38 2HG LYS 38 12.944 1.144 -14.895
205 HD2 LYS 38 1HD LYS 38 14.513 0.382 -13.166
206 HD3 LYS 38 2HD LYS 38 15.110 -0.887 -14.261
207 HE2 LYS 38 1HE LYS 38 15.849 0.844 -15.851
208 HE3 LYS 38 2HE LYS 38 15.273 2.105 -14.737
209 HZ1 LYS 38 3HZ LYS 38 17.400 0.145 -14.156
210 HZ2 LYS 38 1HZ LYS 38 17.635 1.737 -14.519
211 HZ3 LYS 38 2HZ LYS 38 16.865 1.314 -13.122
212 H GLU 39 H GLU 39 10.521 0.430 -17.199
213 HA GLU 39 HA GLU 39 11.733 -1.581 -19.061
214 HB2 GLU 39 1HB GLU 39 9.104 -0.122 -19.360
215 HB3 GLU 39 2HB GLU 39 9.916 -1.039 -20.652
216 HG2 GLU 39 1HG GLU 39 9.677 -3.142 -19.200
217 HG3 GLU 39 2HG GLU 39 8.858 -2.061 -18.050
218 H GLY 40 H GLY 40 12.447 -0.787 -21.067
219 HA2 GLY 40 1HA GLY 40 12.937 0.963 -22.608
220 HA3 GLY 40 2HA GLY 40 12.581 2.163 -21.344
221 HA PRO 41 HA PRO 41 17.129 1.452 -21.676
222 HB2 PRO 41 1HB PRO 41 17.745 3.633 -22.738
223 HB3 PRO 41 2HB PRO 41 17.243 2.350 -23.607
224 HG2 PRO 41 1HG PRO 41 15.878 4.501 -23.061
225 HG3 PRO 41 2HG PRO 41 15.890 3.692 -24.477
226 HD2 PRO 41 1HD PRO 41 13.988 3.208 -22.999
227 HD3 PRO 41 2HD PRO 41 14.683 1.977 -23.814
228 H SER 42 H SER 42 18.891 2.575 -20.559
229 HA SER 42 HA SER 42 18.075 3.793 -18.064
230 HB2 SER 42 1HB SER 42 20.286 4.178 -17.652
231 HB3 SER 42 2HB SER 42 20.086 2.563 -18.370
232 HG SER 42 HG SER 42 20.776 3.479 -20.358
233 H HIS 43 H HIS 43 18.478 5.031 -21.295
234 HA HIS 43 HA HIS 43 18.930 7.808 -20.480
235 HB2 HIS 43 1HB HIS 43 18.172 6.531 -23.144
236 HB3 HIS 43 2HB HIS 43 18.451 8.273 -22.917
237 HD2 HIS 43 HD2 HIS 43 20.491 5.232 -24.023
238 HE1 HIS 43 HE1 HIS 43 23.212 8.056 -22.387
239 HE2 HIS 43 HE2 HIS 43 22.902 5.859 -23.798
240 H LYS 44 H LYS 44 16.150 5.873 -21.550
241 HA LYS 44 HA LYS 44 14.399 7.964 -20.323
242 HB2 LYS 44 1HB LYS 44 13.988 6.598 -22.988
243 HB3 LYS 44 2HB LYS 44 12.771 7.579 -22.137
244 HG2 LYS 44 1HG LYS 44 14.276 9.542 -22.295
245 HG3 LYS 44 2HG LYS 44 15.443 8.553 -23.204
246 HD2 LYS 44 1HD LYS 44 13.735 8.163 -24.949
247 HD3 LYS 44 2HD LYS 44 12.595 9.190 -24.047
248 HE2 LYS 44 1HE LYS 44 14.150 11.092 -24.268
249 HE3 LYS 44 2HE LYS 44 15.264 10.063 -25.197
250 HZ1 LYS 44 3HZ LYS 44 12.515 10.771 -25.996
251 HZ2 LYS 44 1HZ LYS 44 13.894 11.414 -26.634
252 HZ3 LYS 44 2HZ LYS 44 13.547 9.816 -26.859
253 H SER 45 H SER 45 14.818 6.227 -18.628
254 HA SER 45 HA SER 45 13.393 3.663 -18.892
255 HB2 SER 45 1HB SER 45 15.284 3.752 -17.583
256 HB3 SER 45 2HB SER 45 14.597 5.043 -16.572
257 HG SER 45 HG SER 45 13.547 2.426 -16.887
258 H LEU 46 H LEU 46 11.286 3.322 -18.593
259 HA LEU 46 HA LEU 46 9.732 5.331 -16.996
260 HB2 LEU 46 1HB LEU 46 8.935 3.446 -19.118
261 HB3 LEU 46 2HB LEU 46 7.726 4.478 -18.321
262 HG LEU 46 HG LEU 46 10.027 5.395 -20.088
263 HD11 LEU 46 1HD1 LEU 46 8.188 6.182 -21.602
264 HD12 LEU 46 2HD1 LEU 46 8.101 4.425 -21.339
265 HD13 LEU 46 3HD1 LEU 46 6.991 5.511 -20.470
266 HD21 LEU 46 3HD2 LEU 46 9.657 6.963 -18.276
267 HD22 LEU 46 1HD2 LEU 46 9.092 7.665 -19.810
268 HD23 LEU 46 2HD2 LEU 46 7.916 7.018 -18.640
269 H PHE 47 H PHE 47 8.284 4.667 -15.482
270 HA PHE 47 HA PHE 47 8.599 1.801 -14.640
271 HB2 PHE 47 1HB PHE 47 8.132 4.305 -12.965
272 HB3 PHE 47 2HB PHE 47 8.105 2.642 -12.335
273 HD1 PHE 47 HD2 PHE 47 10.149 1.322 -12.231
274 HD2 PHE 47 HD1 PHE 47 10.163 5.412 -13.462
275 HE1 PHE 47 HE2 PHE 47 12.587 1.427 -11.842
276 HE2 PHE 47 HE1 PHE 47 12.603 5.521 -13.077
277 HZ PHE 47 HZ PHE 47 13.816 3.528 -12.268
278 H GLN 48 H GLN 48 6.847 0.687 -13.810
279 HA GLN 48 HA GLN 48 4.196 2.051 -14.029
280 HB2 GLN 48 1HB GLN 48 4.597 0.585 -15.997
281 HB3 GLN 48 2HB GLN 48 4.815 -0.785 -14.882
282 HG2 GLN 48 1HG GLN 48 2.228 -0.357 -14.157
283 HG3 GLN 48 2HG GLN 48 2.534 0.925 -15.352
284 HE21 GLN 48 2HE2 GLN 48 0.412 -0.699 -15.759
285 HE22 GLN 48 1HE2 GLN 48 0.720 -1.802 -17.059
286 H SER 49 H SER 49 2.687 1.550 -12.539
287 HA SER 49 HA SER 49 3.745 0.219 -10.058
288 HB2 SER 49 1HB SER 49 3.078 2.406 -9.770
289 HB3 SER 49 2HB SER 49 1.488 2.078 -10.498
290 HG SER 49 HG SER 49 1.130 0.590 -8.788
291 H THR 50 H THR 50 3.024 -1.718 -9.444
292 HA THR 50 HA THR 50 0.297 -2.573 -10.350
293 HB THR 50 HB THR 50 2.743 -4.359 -10.018
294 HG1 THR 50 HG1 THR 50 1.250 -3.915 -12.396
295 HG21 THR 50 1HG2 THR 50 1.246 -6.140 -10.848
296 HG22 THR 50 2HG2 THR 50 0.634 -5.445 -9.327
297 HG23 THR 50 3HG2 THR 50 -0.109 -4.986 -10.879
298 H VAL 51 H VAL 51 -1.071 -2.995 -8.821
299 HA VAL 51 HA VAL 51 -0.000 -3.585 -6.062
300 HB VAL 51 HB VAL 51 -2.516 -2.043 -6.829
301 HG11 VAL 51 1HG1 VAL 51 -2.712 -1.665 -4.394
302 HG12 VAL 51 2HG1 VAL 51 -2.769 -3.401 -4.778
303 HG13 VAL 51 3HG1 VAL 51 -1.279 -2.682 -4.118
304 HG21 VAL 51 3HG2 VAL 51 -0.527 -0.718 -7.226
305 HG22 VAL 51 1HG2 VAL 51 -1.417 -0.114 -5.810
306 HG23 VAL 51 2HG2 VAL 51 0.064 -1.077 -5.585
307 H ILE 52 H ILE 52 -0.418 -5.448 -5.292
308 HA ILE 52 HA ILE 52 -2.854 -6.895 -6.306
309 HB ILE 52 HB ILE 52 -0.229 -8.026 -5.232
310 HG12 ILE 52 1HG1 ILE 52 -1.388 -8.190 -8.000
311 HG13 ILE 52 2HG1 ILE 52 -0.118 -7.054 -7.490
312 HG21 ILE 52 1HG2 ILE 52 -1.202 -10.217 -5.831
313 HG22 ILE 52 2HG2 ILE 52 -2.195 -9.388 -4.609
314 HG23 ILE 52 3HG2 ILE 52 -2.716 -9.415 -6.310
315 HD11 ILE 52 3HD1 ILE 52 0.084 -10.085 -7.442
316 HD12 ILE 52 1HD1 ILE 52 0.846 -9.010 -8.635
317 HD13 ILE 52 2HD1 ILE 52 1.354 -8.949 -6.931
318 H LEU 53 H LEU 53 -4.451 -6.842 -5.002
319 HA LEU 53 HA LEU 53 -3.872 -7.241 -2.088
320 HB2 LEU 53 1HB LEU 53 -4.460 -5.064 -2.457
321 HB3 LEU 53 2HB LEU 53 -5.940 -5.390 -3.390
322 HG LEU 53 HG LEU 53 -6.857 -6.540 -1.327
323 HD11 LEU 53 1HD1 LEU 53 -5.794 -5.912 0.858
324 HD12 LEU 53 2HD1 LEU 53 -4.680 -6.861 -0.154
325 HD13 LEU 53 3HD1 LEU 53 -4.487 -5.095 -0.030
326 HD21 LEU 53 3HD2 LEU 53 -7.588 -4.325 -1.988
327 HD22 LEU 53 1HD2 LEU 53 -7.489 -4.427 -0.214
328 HD23 LEU 53 2HD2 LEU 53 -6.216 -3.584 -1.129
329 H ASP 54 H ASP 54 -4.568 -9.068 -1.350
330 HA ASP 54 HA ASP 54 -5.806 -11.024 -1.144
331 HB2 ASP 54 1HB ASP 54 -7.640 -9.078 -0.755
332 HB3 ASP 54 2HB ASP 54 -8.046 -9.629 -2.399
333 H GLY 55 H GLY 55 -4.325 -10.658 -3.547
334 HA2 GLY 55 1HA GLY 55 -3.981 -12.183 -5.286
335 HA3 GLY 55 2HA GLY 55 -5.600 -12.860 -4.995
336 H VAL 56 H VAL 56 -5.852 -9.537 -5.142
337 HA VAL 56 HA VAL 56 -6.788 -9.661 -7.997
338 HB VAL 56 HB VAL 56 -7.408 -7.643 -5.798
339 HG11 VAL 56 1HG1 VAL 56 -9.112 -6.826 -7.391
340 HG12 VAL 56 2HG1 VAL 56 -7.476 -6.689 -8.078
341 HG13 VAL 56 3HG1 VAL 56 -8.553 -8.009 -8.597
342 HG21 VAL 56 3HG2 VAL 56 -8.403 -9.796 -5.303
343 HG22 VAL 56 1HG2 VAL 56 -9.648 -8.621 -5.787
344 HG23 VAL 56 2HG2 VAL 56 -9.107 -9.869 -6.935
345 H ARG 57 H ARG 57 -5.319 -9.157 -9.384
346 HA ARG 57 HA ARG 57 -3.235 -7.181 -8.680
347 HB2 ARG 57 1HB ARG 57 -2.586 -9.194 -9.784
348 HB3 ARG 57 2HB ARG 57 -3.630 -8.787 -11.167
349 HG2 ARG 57 1HG ARG 57 -2.272 -6.819 -11.646
350 HG3 ARG 57 2HG ARG 57 -1.259 -7.147 -10.219
351 HD2 ARG 57 1HD ARG 57 -1.516 -8.879 -12.657
352 HD3 ARG 57 2HD ARG 57 -0.171 -7.779 -12.273
353 HE ARG 57 HE ARG 57 -0.288 -9.724 -10.152
354 HH11 ARG 57 1HH1 ARG 57 0.293 -9.719 -13.590
355 HH12 ARG 57 2HH1 ARG 57 1.348 -11.109 -13.420
356 HH21 ARG 57 1HH2 ARG 57 0.911 -11.320 -9.941
357 HH22 ARG 57 2HH2 ARG 57 1.701 -12.023 -11.340
358 H TYR 58 H TYR 58 -3.394 -5.118 -8.983
359 HA TYR 58 HA TYR 58 -5.095 -4.151 -11.262
360 HB2 TYR 58 1HB TYR 58 -5.964 -3.630 -8.974
361 HB3 TYR 58 2HB TYR 58 -4.470 -2.707 -8.684
362 HD1 TYR 58 HD2 TYR 58 -4.045 -0.614 -9.929
363 HD2 TYR 58 HD1 TYR 58 -7.715 -2.737 -10.375
364 HE1 TYR 58 HE2 TYR 58 -5.060 1.381 -10.977
365 HE2 TYR 58 HE1 TYR 58 -8.749 -0.746 -11.428
366 HH TYR 58 HH TYR 58 -8.451 1.403 -12.100
367 H ASN 59 H ASN 59 -3.987 -3.401 -12.867
368 HA ASN 59 HA ASN 59 -1.226 -2.386 -12.370
369 HB2 ASN 59 1HB ASN 59 -2.455 -3.056 -15.147
370 HB3 ASN 59 2HB ASN 59 -0.930 -2.395 -14.511
371 HD21 ASN 59 2HD2 ASN 59 -2.716 -5.179 -15.256
372 HD22 ASN 59 1HD2 ASN 59 -1.605 -6.359 -14.641
373 H SER 60 H SER 60 -0.615 -0.370 -12.559
374 HA SER 60 HA SER 60 -2.679 1.726 -13.172
375 HB2 SER 60 1HB SER 60 0.009 1.912 -11.955
376 HB3 SER 60 2HB SER 60 -1.112 3.251 -12.293
377 HG SER 60 HG SER 60 -1.634 1.012 -10.629
378 H LEU 61 H LEU 61 -1.948 3.595 -14.437
379 HA LEU 61 HA LEU 61 -0.967 2.813 -17.028
380 HB2 LEU 61 1HB LEU 61 -2.496 4.533 -16.609
381 HB3 LEU 61 2HB LEU 61 -1.327 5.606 -15.806
382 HG LEU 61 HG LEU 61 0.024 5.490 -17.984
383 HD11 LEU 61 1HD1 LEU 61 -1.328 4.990 -20.037
384 HD12 LEU 61 2HD1 LEU 61 -1.202 3.562 -18.982
385 HD13 LEU 61 3HD1 LEU 61 -2.699 4.525 -19.002
386 HD21 LEU 61 3HD2 LEU 61 -1.169 7.479 -17.278
387 HD22 LEU 61 1HD2 LEU 61 -1.315 7.278 -19.041
388 HD23 LEU 61 2HD2 LEU 61 -2.681 6.857 -17.980
389 HA PRO 62 HA PRO 62 3.274 3.041 -16.192
390 HB2 PRO 62 1HB PRO 62 3.990 2.407 -18.509
391 HB3 PRO 62 2HB PRO 62 3.323 1.341 -17.474
392 HG2 PRO 62 1HG PRO 62 2.177 2.440 -19.540
393 HG3 PRO 62 2HG PRO 62 2.018 0.892 -19.051
394 HD2 PRO 62 1HD PRO 62 0.208 2.430 -18.411
395 HD3 PRO 62 2HD PRO 62 0.721 1.311 -17.339
396 H GLY 63 H GLY 63 5.171 4.254 -16.794
397 HA2 GLY 63 1HA GLY 63 6.016 5.819 -18.580
398 HA3 GLY 63 2HA GLY 63 4.436 6.628 -18.464
399 H PHE 64 H PHE 64 5.650 5.410 -15.502
400 HA PHE 64 HA PHE 64 5.949 8.101 -14.407
401 HB2 PHE 64 1HB PHE 64 6.517 5.351 -13.217
402 HB3 PHE 64 2HB PHE 64 6.554 6.883 -12.316
403 HD1 PHE 64 HD2 PHE 64 4.311 8.336 -12.739
404 HD2 PHE 64 HD1 PHE 64 4.668 4.084 -12.939
405 HE1 PHE 64 HE2 PHE 64 1.897 8.112 -12.252
406 HE2 PHE 64 HE1 PHE 64 2.254 3.856 -12.455
407 HZ PHE 64 HZ PHE 64 0.869 5.871 -12.112
408 H PHE 65 H PHE 65 7.715 9.179 -13.744
409 HA PHE 65 HA PHE 65 10.253 8.262 -15.032
410 HB2 PHE 65 1HB PHE 65 9.368 11.031 -14.108
411 HB3 PHE 65 2HB PHE 65 10.923 10.646 -14.880
412 HD1 PHE 65 HD2 PHE 65 10.900 9.723 -17.224
413 HD2 PHE 65 HD1 PHE 65 7.490 11.507 -15.369
414 HE1 PHE 65 HE2 PHE 65 9.892 10.105 -19.448
415 HE2 PHE 65 HE1 PHE 65 6.477 11.888 -17.593
416 HZ PHE 65 HZ PHE 65 7.680 11.188 -19.632
417 H ASN 66 H ASN 66 8.917 7.790 -12.193
418 HA ASN 66 HA ASN 66 11.512 7.536 -10.869
419 HB2 ASN 66 1HB ASN 66 10.557 10.090 -10.318
420 HB3 ASN 66 2HB ASN 66 9.479 8.934 -9.498
421 HD21 ASN 66 2HD2 ASN 66 10.304 10.312 -7.682
422 HD22 ASN 66 1HD2 ASN 66 11.722 9.750 -6.860
423 H ARG 67 H ARG 67 11.511 6.197 -9.103
424 HA ARG 67 HA ARG 67 9.477 4.182 -9.035
425 HB2 ARG 67 1HB ARG 67 11.657 4.851 -7.116
426 HB3 ARG 67 2HB ARG 67 10.526 3.492 -6.914
427 HG2 ARG 67 1HG ARG 67 11.296 2.505 -9.006
428 HG3 ARG 67 2HG ARG 67 12.381 3.890 -9.282
429 HD2 ARG 67 1HD ARG 67 13.636 3.286 -7.297
430 HD3 ARG 67 2HD ARG 67 12.564 1.888 -7.054
431 HE ARG 67 HE ARG 67 13.808 1.553 -9.633
432 HH11 ARG 67 1HH1 ARG 67 14.815 1.707 -6.298
433 HH12 ARG 67 2HH1 ARG 67 16.159 0.638 -6.648
434 HH21 ARG 67 1HH2 ARG 67 15.348 0.334 -10.051
435 HH22 ARG 67 2HH2 ARG 67 16.465 -0.145 -8.789
436 H LYS 68 H LYS 68 10.024 7.045 -7.011
437 HA LYS 68 HA LYS 68 7.940 6.463 -5.116
438 HB2 LYS 68 1HB LYS 68 9.206 9.046 -6.031
439 HB3 LYS 68 2HB LYS 68 8.012 8.936 -4.716
440 HG2 LYS 68 1HG LYS 68 9.533 7.468 -3.454
441 HG3 LYS 68 2HG LYS 68 10.728 7.576 -4.768
442 HD2 LYS 68 1HD LYS 68 10.873 10.017 -4.430
443 HD3 LYS 68 2HD LYS 68 9.693 9.896 -3.103
444 HE2 LYS 68 1HE LYS 68 11.225 8.448 -1.856
445 HE3 LYS 68 2HE LYS 68 12.401 8.530 -3.187
446 HZ1 LYS 68 3HZ LYS 68 11.483 10.818 -1.567
447 HZ2 LYS 68 1HZ LYS 68 12.944 10.068 -1.425
448 HZ3 LYS 68 2HZ LYS 68 12.573 10.895 -2.803
449 H ALA 69 H ALA 69 7.936 8.052 -8.265
450 HA ALA 69 HA ALA 69 5.275 9.080 -8.119
451 HB1 ALA 69 3HB ALA 69 6.863 8.149 -10.534
452 HB2 ALA 69 1HB ALA 69 5.391 9.145 -10.580
453 HB3 ALA 69 2HB ALA 69 6.876 9.787 -9.838
454 H ALA 70 H ALA 70 6.547 5.928 -9.140
455 HA ALA 70 HA ALA 70 3.959 4.863 -9.860
456 HB1 ALA 70 3HB ALA 70 6.516 3.443 -9.044
457 HB2 ALA 70 1HB ALA 70 5.096 2.679 -9.794
458 HB3 ALA 70 2HB ALA 70 6.043 3.881 -10.703
459 H GLU 71 H GLU 71 5.784 5.092 -6.863
460 HA GLU 71 HA GLU 71 4.040 3.374 -5.316
461 HB2 GLU 71 1HB GLU 71 5.917 5.622 -4.592
462 HB3 GLU 71 2HB GLU 71 4.989 4.692 -3.390
463 HG2 GLU 71 1HG GLU 71 6.206 2.603 -4.065
464 HG3 GLU 71 2HG GLU 71 6.925 3.571 -5.373
465 H GLN 72 H GLN 72 4.041 6.839 -6.059
466 HA GLN 72 HA GLN 72 1.822 7.524 -4.377
467 HB2 GLN 72 1HB GLN 72 2.908 8.669 -6.950
468 HB3 GLN 72 2HB GLN 72 1.511 9.368 -6.097
469 HG2 GLN 72 1HG GLN 72 3.180 9.811 -4.030
470 HG3 GLN 72 2HG GLN 72 4.207 8.901 -5.163
471 HE21 GLN 72 2HE2 GLN 72 4.849 11.436 -4.049
472 HE22 GLN 72 1HE2 GLN 72 4.913 12.587 -5.343
473 H SER 73 H SER 73 1.998 6.222 -7.660
474 HA SER 73 HA SER 73 -0.823 6.310 -8.302
475 HB2 SER 73 1HB SER 73 0.847 6.012 -9.923
476 HB3 SER 73 2HB SER 73 1.267 4.432 -9.225
477 HG SER 73 HG SER 73 -0.667 3.641 -9.838
478 H ALA 74 H ALA 74 1.264 3.810 -6.789
479 HA ALA 74 HA ALA 74 -0.792 1.893 -6.348
480 HB1 ALA 74 3HB ALA 74 1.730 2.415 -4.740
481 HB2 ALA 74 1HB ALA 74 0.731 0.946 -4.659
482 HB3 ALA 74 2HB ALA 74 1.593 1.353 -6.161
483 H ALA 75 H ALA 75 0.232 4.704 -4.472
484 HA ALA 75 HA ALA 75 -1.413 4.172 -2.183
485 HB1 ALA 75 3HB ALA 75 -0.453 6.819 -3.323
486 HB2 ALA 75 1HB ALA 75 -1.135 6.571 -1.699
487 HB3 ALA 75 2HB ALA 75 0.412 5.810 -2.139
488 H GLU 76 H GLU 76 -2.013 5.912 -5.222
489 HA GLU 76 HA GLU 76 -4.704 6.714 -4.568
490 HB2 GLU 76 1HB GLU 76 -3.290 6.209 -7.187
491 HB3 GLU 76 2HB GLU 76 -4.957 6.822 -7.062
492 HG2 GLU 76 1HG GLU 76 -4.107 8.885 -5.901
493 HG3 GLU 76 2HG GLU 76 -2.512 8.099 -5.912
494 H VAL 77 H VAL 77 -3.334 3.777 -5.984
495 HA VAL 77 HA VAL 77 -5.892 2.521 -6.570
496 HB VAL 77 HB VAL 77 -3.135 1.350 -6.013
497 HG11 VAL 77 1HG1 VAL 77 -4.051 -0.732 -6.981
498 HG12 VAL 77 2HG1 VAL 77 -4.927 -0.274 -5.502
499 HG13 VAL 77 3HG1 VAL 77 -5.656 0.027 -7.098
500 HG21 VAL 77 3HG2 VAL 77 -3.207 2.721 -8.010
501 HG22 VAL 77 1HG2 VAL 77 -3.056 0.999 -8.430
502 HG23 VAL 77 2HG2 VAL 77 -4.626 1.821 -8.599
503 H ALA 78 H ALA 78 -3.779 2.497 -3.722
504 HA ALA 78 HA ALA 78 -5.329 0.699 -2.171
505 HB1 ALA 78 3HB ALA 78 -3.741 3.126 -1.267
506 HB2 ALA 78 1HB ALA 78 -4.306 1.804 -0.220
507 HB3 ALA 78 2HB ALA 78 -3.104 1.480 -1.491
508 H LEU 79 H LEU 79 -5.646 4.214 -2.619
509 HA LEU 79 HA LEU 79 -7.861 4.519 -0.802
510 HB2 LEU 79 1HB LEU 79 -6.911 5.967 -3.181
511 HB3 LEU 79 2HB LEU 79 -8.237 6.669 -2.224
512 HG LEU 79 HG LEU 79 -5.411 6.119 -1.236
513 HD11 LEU 79 1HD1 LEU 79 -5.225 8.620 -1.142
514 HD12 LEU 79 2HD1 LEU 79 -5.537 8.057 -2.800
515 HD13 LEU 79 3HD1 LEU 79 -6.859 8.753 -1.833
516 HD21 LEU 79 3HD2 LEU 79 -7.058 5.844 0.521
517 HD22 LEU 79 1HD2 LEU 79 -6.118 7.330 0.798
518 HD23 LEU 79 2HD2 LEU 79 -7.770 7.430 0.143
519 H ARG 80 H ARG 80 -7.664 3.774 -4.258
520 HA ARG 80 HA ARG 80 -10.492 3.834 -4.756
521 HB2 ARG 80 1HB ARG 80 -8.267 2.384 -6.103
522 HB3 ARG 80 2HB ARG 80 -9.969 2.290 -6.612
523 HG2 ARG 80 1HG ARG 80 -10.011 4.686 -7.034
524 HG3 ARG 80 2HG ARG 80 -8.344 4.845 -6.430
525 HD2 ARG 80 1HD ARG 80 -7.554 3.481 -8.268
526 HD3 ARG 80 2HD ARG 80 -9.221 3.336 -8.872
527 HE ARG 80 HE ARG 80 -8.573 6.145 -8.867
528 HH11 ARG 80 1HH1 ARG 80 -7.445 3.256 -10.460
529 HH12 ARG 80 2HH1 ARG 80 -6.996 4.200 -11.866
530 HH21 ARG 80 1HH2 ARG 80 -8.057 7.241 -10.467
531 HH22 ARG 80 2HH2 ARG 80 -7.344 6.474 -11.872
532 H GLU 81 H GLU 81 -8.333 1.280 -3.577
533 HA GLU 81 HA GLU 81 -10.346 -0.788 -3.552
534 HB2 GLU 81 1HB GLU 81 -7.772 -0.375 -2.035
535 HB3 GLU 81 2HB GLU 81 -8.804 -1.812 -1.832
536 HG2 GLU 81 1HG GLU 81 -7.395 -0.983 -4.442
537 HG3 GLU 81 2HG GLU 81 -6.981 -2.261 -3.277
538 H LEU 82 H LEU 82 -9.310 1.609 -1.153
539 HA LEU 82 HA LEU 82 -11.030 0.653 0.951
540 HB2 LEU 82 1HB LEU 82 -9.860 3.253 0.233
541 HB3 LEU 82 2HB LEU 82 -10.733 3.114 1.777
542 HG LEU 82 HG LEU 82 -8.229 1.576 0.985
543 HD11 LEU 82 1HD1 LEU 82 -7.129 2.937 2.784
544 HD12 LEU 82 2HD1 LEU 82 -7.785 3.975 1.497
545 HD13 LEU 82 3HD1 LEU 82 -8.660 3.808 3.038
546 HD21 LEU 82 3HD2 LEU 82 -9.684 0.260 2.409
547 HD22 LEU 82 1HD2 LEU 82 -8.242 0.768 3.320
548 HD23 LEU 82 2HD2 LEU 82 -9.798 1.596 3.578
549 H ALA 83 H ALA 83 -11.508 2.974 -1.683
550 HA ALA 83 HA ALA 83 -14.050 3.932 -0.884
551 HB1 ALA 83 3HB ALA 83 -12.983 3.463 -3.690
552 HB2 ALA 83 1HB ALA 83 -14.382 4.475 -3.265
553 HB3 ALA 83 2HB ALA 83 -12.753 4.932 -2.713
554 H LYS 84 H LYS 84 -13.109 0.907 -2.391
555 HA LYS 84 HA LYS 84 -15.740 0.190 -3.350
556 HB2 LYS 84 1HB LYS 84 -13.295 -1.443 -2.667
557 HB3 LYS 84 2HB LYS 84 -14.778 -2.116 -3.384
558 HG2 LYS 84 1HG LYS 84 -14.484 -0.737 -5.372
559 HG3 LYS 84 2HG LYS 84 -13.056 0.041 -4.649
560 HD2 LYS 84 1HD LYS 84 -11.878 -2.106 -4.615
561 HD3 LYS 84 2HD LYS 84 -13.313 -2.917 -5.287
562 HE2 LYS 84 1HE LYS 84 -13.143 -1.578 -7.324
563 HE3 LYS 84 2HE LYS 84 -11.747 -0.706 -6.652
564 HZ1 LYS 84 3HZ LYS 84 -11.841 -3.594 -7.245
565 HZ2 LYS 84 1HZ LYS 84 -11.067 -2.455 -8.151
566 HZ3 LYS 84 2HZ LYS 84 -10.545 -2.787 -6.622
567 H SER 85 H SER 85 -14.269 0.143 -0.229
568 HA SER 85 HA SER 85 -15.964 -1.969 0.945
569 HB2 SER 85 1HB SER 85 -14.979 -1.513 2.923
570 HB3 SER 85 2HB SER 85 -13.721 -1.474 1.667
571 HG SER 85 HG SER 85 -14.983 0.779 2.843
572 H SER 86 H SER 86 -16.369 1.346 0.089
573 HA SER 86 HA SER 86 -18.114 2.285 2.213
574 HB2 SER 86 1HB SER 86 -16.974 3.771 0.840
575 HB3 SER 86 2HB SER 86 -17.833 3.168 -0.596
576 HG SER 86 HG SER 86 -18.793 5.050 0.288
Start of MODEL 5
1 H PHE 16 H PHE 16 2.617 -2.409 -0.703
2 HA PHE 16 HA PHE 16 0.071 -2.623 1.051
3 HB2 PHE 16 1HB PHE 16 1.118 -3.541 2.956
4 HB3 PHE 16 2HB PHE 16 2.064 -4.226 1.614
5 HD1 PHE 16 HD1 PHE 16 2.036 -1.737 4.324
6 HD2 PHE 16 HD2 PHE 16 4.341 -3.689 1.302
7 HE1 PHE 16 HE1 PHE 16 4.111 -0.853 5.337
8 HE2 PHE 16 HE2 PHE 16 6.417 -2.809 2.314
9 HZ PHE 16 HZ PHE 16 6.302 -1.389 4.331
10 H LYS 17 H LYS 17 2.521 -0.364 0.387
11 HA LYS 17 HA LYS 17 2.454 1.242 2.749
12 HB2 LYS 17 1HB LYS 17 2.932 1.976 -0.142
13 HB3 LYS 17 2HB LYS 17 3.193 3.069 1.238
14 HG2 LYS 17 1HG LYS 17 4.888 1.516 2.138
15 HG3 LYS 17 2HG LYS 17 4.637 0.443 0.741
16 HD2 LYS 17 1HD LYS 17 5.390 2.197 -0.782
17 HD3 LYS 17 2HD LYS 17 5.567 3.329 0.580
18 HE2 LYS 17 1HE LYS 17 7.253 1.806 1.583
19 HE3 LYS 17 2HE LYS 17 7.120 0.759 0.151
20 HZ1 LYS 17 3HZ LYS 17 8.005 3.572 0.140
21 HZ2 LYS 17 1HZ LYS 17 8.989 2.257 -0.015
22 HZ3 LYS 17 2HZ LYS 17 7.882 2.602 -1.188
23 H SER 18 H SER 18 1.645 3.513 2.811
24 HA SER 18 HA SER 18 -0.245 4.975 2.903
25 HB2 SER 18 1HB SER 18 -0.048 4.687 0.471
26 HB3 SER 18 2HB SER 18 -1.369 3.504 0.614
27 HG SER 18 HG SER 18 -1.429 6.195 1.511
28 H ARG 19 H ARG 19 -2.915 4.424 2.379
29 HA ARG 19 HA ARG 19 -3.677 3.355 4.899
30 HB2 ARG 19 1HB ARG 19 -5.280 3.843 2.435
31 HB3 ARG 19 2HB ARG 19 -5.957 3.286 3.983
32 HG2 ARG 19 1HG ARG 19 -5.163 5.321 5.083
33 HG3 ARG 19 2HG ARG 19 -4.428 5.874 3.558
34 HD2 ARG 19 1HD ARG 19 -6.639 5.974 2.552
35 HD3 ARG 19 2HD ARG 19 -7.352 5.473 4.103
36 HE ARG 19 HE ARG 19 -5.962 7.917 4.642
37 HH11 ARG 19 1HH1 ARG 19 -8.549 6.928 2.523
38 HH12 ARG 19 2HH1 ARG 19 -9.255 8.529 2.627
39 HH21 ARG 19 1HH2 ARG 19 -6.753 9.758 4.765
40 HH22 ARG 19 2HH2 ARG 19 -8.232 10.144 3.904
41 H LEU 20 H LEU 20 -3.037 1.767 1.884
42 HA LEU 20 HA LEU 20 -4.582 -0.559 2.071
43 HB2 LEU 20 1HB LEU 20 -1.788 -0.082 1.288
44 HB3 LEU 20 2HB LEU 20 -2.501 -1.677 0.949
45 HG LEU 20 HG LEU 20 -3.478 0.984 -0.160
46 HD11 LEU 20 1HD1 LEU 20 -2.635 0.105 -2.352
47 HD12 LEU 20 2HD1 LEU 20 -1.316 0.256 -1.166
48 HD13 LEU 20 3HD1 LEU 20 -2.019 -1.341 -1.518
49 HD21 LEU 20 3HD2 LEU 20 -5.286 -0.598 0.159
50 HD22 LEU 20 1HD2 LEU 20 -4.952 -0.399 -1.578
51 HD23 LEU 20 2HD2 LEU 20 -4.382 -1.853 -0.723
52 H GLN 21 H GLN 21 -1.622 0.236 3.838
53 HA GLN 21 HA GLN 21 -1.275 -2.347 5.042
54 HB2 GLN 21 1HB GLN 21 0.423 -0.538 4.972
55 HB3 GLN 21 2HB GLN 21 -0.565 0.384 6.130
56 HG2 GLN 21 1HG GLN 21 -0.109 -1.653 7.864
57 HG3 GLN 21 2HG GLN 21 0.707 -2.198 6.380
58 HE21 GLN 21 2HE2 GLN 21 2.130 -2.129 8.691
59 HE22 GLN 21 1HE2 GLN 21 3.269 -0.824 8.667
60 H GLU 22 H GLU 22 -3.090 0.526 6.067
61 HA GLU 22 HA GLU 22 -3.855 -0.575 8.630
62 HB2 GLU 22 1HB GLU 22 -5.048 1.588 6.893
63 HB3 GLU 22 2HB GLU 22 -5.631 1.181 8.525
64 HG2 GLU 22 1HG GLU 22 -3.388 1.853 9.473
65 HG3 GLU 22 2HG GLU 22 -2.881 2.091 7.785
66 H TYR 23 H TYR 23 -5.350 -0.608 5.419
67 HA TYR 23 HA TYR 23 -7.825 -1.813 6.183
68 HB2 TYR 23 1HB TYR 23 -7.547 -0.879 4.002
69 HB3 TYR 23 2HB TYR 23 -6.185 -1.972 3.654
70 HD1 TYR 23 HD1 TYR 23 -9.857 -1.927 4.335
71 HD2 TYR 23 HD2 TYR 23 -6.576 -4.080 2.667
72 HE1 TYR 23 HE1 TYR 23 -11.437 -3.578 3.378
73 HE2 TYR 23 HE2 TYR 23 -8.137 -5.737 1.706
74 HH TYR 23 HH TYR 23 -10.316 -6.340 1.421
75 H ALA 24 H ALA 24 -4.777 -3.333 5.106
76 HA ALA 24 HA ALA 24 -5.684 -6.010 5.330
77 HB1 ALA 24 3HB ALA 24 -2.889 -4.897 5.742
78 HB2 ALA 24 1HB ALA 24 -3.297 -6.604 5.458
79 HB3 ALA 24 2HB ALA 24 -3.602 -5.394 4.191
80 H GLN 25 H GLN 25 -3.987 -3.976 7.727
81 HA GLN 25 HA GLN 25 -3.856 -6.058 9.714
82 HB2 GLN 25 1HB GLN 25 -3.705 -3.045 9.878
83 HB3 GLN 25 2HB GLN 25 -3.469 -4.121 11.275
84 HG2 GLN 25 1HG GLN 25 -1.348 -5.125 9.915
85 HG3 GLN 25 2HG GLN 25 -2.028 -3.939 8.777
86 HE21 GLN 25 2HE2 GLN 25 0.660 -3.973 9.722
87 HE22 GLN 25 1HE2 GLN 25 0.919 -2.526 10.639
88 H LYS 26 H LYS 26 -6.254 -3.592 8.963
89 HA LYS 26 HA LYS 26 -7.778 -3.647 11.334
90 HB2 LYS 26 1HB LYS 26 -8.175 -2.127 9.464
91 HB3 LYS 26 2HB LYS 26 -8.738 -3.493 8.471
92 HG2 LYS 26 1HG LYS 26 -10.635 -3.836 9.969
93 HG3 LYS 26 2HG LYS 26 -10.057 -2.532 11.033
94 HD2 LYS 26 1HD LYS 26 -10.337 -0.909 9.210
95 HD3 LYS 26 2HD LYS 26 -10.895 -2.209 8.131
96 HE2 LYS 26 1HE LYS 26 -12.797 -2.634 9.637
97 HE3 LYS 26 2HE LYS 26 -12.243 -1.321 10.701
98 HZ1 LYS 26 3HZ LYS 26 -13.094 -1.011 7.893
99 HZ2 LYS 26 1HZ LYS 26 -13.984 -0.590 9.217
100 HZ3 LYS 26 2HZ LYS 26 -12.581 0.209 8.879
101 H TYR 27 H TYR 27 -7.636 -6.008 8.722
102 HA TYR 27 HA TYR 27 -9.750 -7.599 10.145
103 HB2 TYR 27 1HB TYR 27 -8.936 -7.647 7.231
104 HB3 TYR 27 2HB TYR 27 -10.199 -8.644 7.995
105 HD1 TYR 27 HD2 TYR 27 -12.184 -7.394 9.071
106 HD2 TYR 27 HD1 TYR 27 -9.492 -5.550 6.325
107 HE1 TYR 27 HE2 TYR 27 -13.858 -5.630 8.631
108 HE2 TYR 27 HE1 TYR 27 -11.158 -3.774 5.872
109 HH TYR 27 HH TYR 27 -14.344 -3.728 7.476
110 H LYS 28 H LYS 28 -6.699 -7.444 10.420
111 HA LYS 28 HA LYS 28 -4.957 -8.950 10.762
112 HB2 LYS 28 1HB LYS 28 -7.251 -10.895 11.066
113 HB3 LYS 28 2HB LYS 28 -5.576 -11.140 11.613
114 HG2 LYS 28 1HG LYS 28 -5.834 -9.213 13.163
115 HG3 LYS 28 2HG LYS 28 -7.534 -9.066 12.657
116 HD2 LYS 28 1HD LYS 28 -7.925 -11.402 13.430
117 HD3 LYS 28 2HD LYS 28 -6.248 -11.455 14.024
118 HE2 LYS 28 1HE LYS 28 -6.710 -9.587 15.538
119 HE3 LYS 28 2HE LYS 28 -8.378 -9.492 14.928
120 HZ1 LYS 28 3HZ LYS 28 -7.200 -11.794 16.348
121 HZ2 LYS 28 1HZ LYS 28 -8.255 -10.705 16.997
122 HZ3 LYS 28 2HZ LYS 28 -8.747 -11.707 15.782
123 H LEU 29 H LEU 29 -5.782 -8.480 8.047
124 HA LEU 29 HA LEU 29 -5.280 -11.134 6.781
125 HB2 LEU 29 1HB LEU 29 -5.943 -8.462 5.726
126 HB3 LEU 29 2HB LEU 29 -5.828 -9.864 4.638
127 HG LEU 29 HG LEU 29 -7.881 -9.421 6.839
128 HD11 LEU 29 1HD1 LEU 29 -9.511 -9.406 4.931
129 HD12 LEU 29 2HD1 LEU 29 -8.301 -8.113 4.759
130 HD13 LEU 29 3HD1 LEU 29 -8.156 -9.600 3.794
131 HD21 LEU 29 3HD2 LEU 29 -7.254 -11.759 6.720
132 HD22 LEU 29 1HD2 LEU 29 -8.896 -11.539 6.072
133 HD23 LEU 29 2HD2 LEU 29 -7.525 -11.773 4.961
134 HA PRO 30 HA PRO 30 -1.169 -10.377 5.745
135 HB2 PRO 30 1HB PRO 30 -1.922 -11.328 3.300
136 HB3 PRO 30 2HB PRO 30 -0.756 -11.834 4.320
137 HG2 PRO 30 1HG PRO 30 -3.271 -12.513 4.360
138 HG3 PRO 30 2HG PRO 30 -1.996 -13.493 4.636
139 HD2 PRO 30 1HD PRO 30 -4.671 -11.520 4.688
140 HD3 PRO 30 2HD PRO 30 -3.721 -12.450 5.633
141 H THR 31 H THR 31 0.175 -8.833 4.883
142 HA THR 31 HA THR 31 -1.196 -6.464 3.960
143 HB THR 31 HB THR 31 1.095 -5.553 3.609
144 HG1 THR 31 HG1 THR 31 2.080 -7.542 2.946
145 HG21 THR 31 1HG2 THR 31 1.846 -5.716 5.956
146 HG22 THR 31 2HG2 THR 31 0.083 -5.494 5.862
147 HG23 THR 31 3HG2 THR 31 0.760 -7.102 6.207
148 HA PRO 32 HA PRO 32 -1.464 -6.888 -0.291
149 HB2 PRO 32 1HB PRO 32 -0.599 -4.299 -0.270
150 HB3 PRO 32 2HB PRO 32 -1.934 -4.963 -0.924
151 HG2 PRO 32 1HG PRO 32 -1.639 -4.142 1.531
152 HG3 PRO 32 2HG PRO 32 -2.966 -3.963 0.600
153 HD2 PRO 32 1HD PRO 32 -0.571 -4.766 2.774
154 HD3 PRO 32 2HD PRO 32 -2.122 -5.072 2.373
155 H VAL 33 H VAL 33 -0.275 -7.306 -2.148
156 HA VAL 33 HA VAL 33 2.697 -7.190 -1.666
157 HB VAL 33 HB VAL 33 1.071 -9.033 -3.467
158 HG11 VAL 33 1HG1 VAL 33 3.230 -10.189 -3.806
159 HG12 VAL 33 2HG1 VAL 33 3.311 -8.503 -4.369
160 HG13 VAL 33 3HG1 VAL 33 4.045 -8.960 -2.813
161 HG21 VAL 33 3HG2 VAL 33 0.750 -9.579 -1.128
162 HG22 VAL 33 1HG2 VAL 33 1.749 -10.811 -1.934
163 HG23 VAL 33 2HG2 VAL 33 2.512 -9.603 -0.872
164 H TYR 34 H TYR 34 3.790 -5.760 -2.669
165 HA TYR 34 HA TYR 34 2.670 -4.685 -5.237
166 HB2 TYR 34 1HB TYR 34 3.733 -2.632 -4.761
167 HB3 TYR 34 2HB TYR 34 2.838 -3.120 -3.301
168 HD1 TYR 34 HD2 TYR 34 4.043 -3.824 -1.283
169 HD2 TYR 34 HD1 TYR 34 6.163 -2.554 -4.759
170 HE1 TYR 34 HE2 TYR 34 6.103 -3.609 0.065
171 HE2 TYR 34 HE1 TYR 34 8.237 -2.334 -3.423
172 HH TYR 34 HH TYR 34 9.195 -2.541 -1.374
173 H GLU 35 H GLU 35 3.918 -4.416 -7.006
174 HA GLU 35 HA GLU 35 6.726 -5.443 -6.848
175 HB2 GLU 35 1HB GLU 35 4.640 -6.137 -8.922
176 HB3 GLU 35 2HB GLU 35 6.373 -6.534 -9.026
177 HG2 GLU 35 1HG GLU 35 6.100 -7.976 -6.932
178 HG3 GLU 35 2HG GLU 35 4.396 -7.471 -6.990
179 H ILE 36 H ILE 36 8.196 -4.579 -8.234
180 HA ILE 36 HA ILE 36 7.275 -2.075 -9.629
181 HB ILE 36 HB ILE 36 9.987 -2.744 -8.393
182 HG12 ILE 36 1HG1 ILE 36 7.978 -0.663 -7.574
183 HG13 ILE 36 2HG1 ILE 36 8.167 -2.255 -6.802
184 HG21 ILE 36 1HG2 ILE 36 10.573 -0.417 -8.991
185 HG22 ILE 36 2HG2 ILE 36 10.178 -1.371 -10.440
186 HG23 ILE 36 3HG2 ILE 36 8.991 -0.222 -9.781
187 HD11 ILE 36 3HD1 ILE 36 10.296 -0.093 -6.962
188 HD12 ILE 36 1HD1 ILE 36 9.334 -0.502 -5.523
189 HD13 ILE 36 2HD1 ILE 36 10.485 -1.685 -6.191
190 H VAL 37 H VAL 37 7.439 -1.892 -11.678
191 HA VAL 37 HA VAL 37 9.316 -3.749 -13.136
192 HB VAL 37 HB VAL 37 6.522 -2.879 -13.990
193 HG11 VAL 37 1HG1 VAL 37 6.917 -4.386 -15.910
194 HG12 VAL 37 2HG1 VAL 37 8.117 -3.071 -15.870
195 HG13 VAL 37 3HG1 VAL 37 8.566 -4.704 -15.320
196 HG21 VAL 37 3HG2 VAL 37 6.420 -4.558 -12.246
197 HG22 VAL 37 1HG2 VAL 37 5.937 -5.245 -13.814
198 HG23 VAL 37 2HG2 VAL 37 7.551 -5.593 -13.150
199 H LYS 38 H LYS 38 10.824 -2.800 -14.167
200 HA LYS 38 HA LYS 38 10.409 0.030 -15.032
201 HB2 LYS 38 1HB LYS 38 12.373 -0.511 -13.638
202 HB3 LYS 38 2HB LYS 38 12.922 -1.642 -14.897
203 HG2 LYS 38 1HG LYS 38 13.066 0.261 -16.494
204 HG3 LYS 38 2HG LYS 38 12.618 1.367 -15.172
205 HD2 LYS 38 1HD LYS 38 14.616 0.673 -13.912
206 HD3 LYS 38 2HD LYS 38 15.061 -0.438 -15.228
207 HE2 LYS 38 1HE LYS 38 15.249 1.462 -16.774
208 HE3 LYS 38 2HE LYS 38 14.797 2.576 -15.462
209 HZ1 LYS 38 3HZ LYS 38 17.203 0.867 -15.510
210 HZ2 LYS 38 1HZ LYS 38 17.177 2.494 -15.780
211 HZ3 LYS 38 2HZ LYS 38 16.785 1.899 -14.292
212 H GLU 39 H GLU 39 10.120 0.589 -17.038
213 HA GLU 39 HA GLU 39 10.781 -1.402 -19.177
214 HB2 GLU 39 1HB GLU 39 8.243 0.209 -18.869
215 HB3 GLU 39 2HB GLU 39 8.700 -0.721 -20.317
216 HG2 GLU 39 1HG GLU 39 8.643 -2.843 -18.880
217 HG3 GLU 39 2HG GLU 39 8.167 -1.749 -17.562
218 H GLY 40 H GLY 40 10.962 -0.526 -21.311
219 HA2 GLY 40 1HA GLY 40 11.139 1.307 -22.830
220 HA3 GLY 40 2HA GLY 40 11.278 2.424 -21.453
221 HA PRO 41 HA PRO 41 15.454 1.398 -23.186
222 HB2 PRO 41 1HB PRO 41 15.928 3.667 -24.151
223 HB3 PRO 41 2HB PRO 41 15.128 2.508 -24.971
224 HG2 PRO 41 1HG PRO 41 14.103 4.635 -23.867
225 HG3 PRO 41 2HG PRO 41 13.683 3.989 -25.304
226 HD2 PRO 41 1HD PRO 41 12.238 3.475 -23.376
227 HD3 PRO 41 2HD PRO 41 12.567 2.313 -24.473
228 H SER 42 H SER 42 17.498 2.066 -22.366
229 HA SER 42 HA SER 42 17.407 2.874 -19.609
230 HB2 SER 42 1HB SER 42 19.690 2.923 -19.646
231 HB3 SER 42 2HB SER 42 19.104 1.521 -20.570
232 HG SER 42 HG SER 42 20.821 2.620 -21.614
233 H HIS 43 H HIS 43 17.532 4.694 -22.614
234 HA HIS 43 HA HIS 43 18.461 7.162 -21.290
235 HB2 HIS 43 1HB HIS 43 17.555 6.562 -24.141
236 HB3 HIS 43 2HB HIS 43 18.101 8.160 -23.577
237 HD2 HIS 43 HD2 HIS 43 19.647 4.998 -25.175
238 HE1 HIS 43 HE1 HIS 43 22.765 7.189 -23.294
239 HE2 HIS 43 HE2 HIS 43 22.126 5.246 -24.946
240 H LYS 44 H LYS 44 15.450 5.684 -22.275
241 HA LYS 44 HA LYS 44 14.015 8.007 -21.053
242 HB2 LYS 44 1HB LYS 44 13.333 6.620 -23.649
243 HB3 LYS 44 2HB LYS 44 12.276 7.764 -22.789
244 HG2 LYS 44 1HG LYS 44 14.004 9.525 -23.067
245 HG3 LYS 44 2HG LYS 44 14.994 8.376 -23.998
246 HD2 LYS 44 1HD LYS 44 13.137 8.149 -25.634
247 HD3 LYS 44 2HD LYS 44 12.219 9.373 -24.725
248 HE2 LYS 44 1HE LYS 44 14.006 11.013 -25.124
249 HE3 LYS 44 2HE LYS 44 14.924 9.791 -26.034
250 HZ1 LYS 44 3HZ LYS 44 12.267 10.841 -26.773
251 HZ2 LYS 44 1HZ LYS 44 13.695 11.249 -27.493
252 HZ3 LYS 44 2HZ LYS 44 13.118 9.708 -27.618
253 H SER 45 H SER 45 14.469 6.044 -19.442
254 HA SER 45 HA SER 45 12.599 3.763 -19.689
255 HB2 SER 45 1HB SER 45 13.477 2.991 -17.732
256 HB3 SER 45 2HB SER 45 14.793 3.520 -18.805
257 HG SER 45 HG SER 45 13.738 4.973 -16.608
258 H LEU 46 H LEU 46 10.792 3.394 -18.448
259 HA LEU 46 HA LEU 46 9.948 5.578 -16.574
260 HB2 LEU 46 1HB LEU 46 8.390 3.831 -18.364
261 HB3 LEU 46 2HB LEU 46 7.549 4.866 -17.186
262 HG LEU 46 HG LEU 46 9.251 5.798 -19.530
263 HD11 LEU 46 1HD1 LEU 46 7.082 6.718 -20.394
264 HD12 LEU 46 2HD1 LEU 46 7.002 4.952 -20.192
265 HD13 LEU 46 3HD1 LEU 46 6.245 6.021 -18.986
266 HD21 LEU 46 3HD2 LEU 46 9.502 7.276 -17.624
267 HD22 LEU 46 1HD2 LEU 46 8.540 8.076 -18.889
268 HD23 LEU 46 2HD2 LEU 46 7.736 7.401 -17.452
269 H PHE 47 H PHE 47 9.015 5.031 -14.667
270 HA PHE 47 HA PHE 47 9.376 2.156 -13.895
271 HB2 PHE 47 1HB PHE 47 9.398 4.707 -12.225
272 HB3 PHE 47 2HB PHE 47 9.457 3.062 -11.552
273 HD1 PHE 47 HD1 PHE 47 11.284 5.647 -13.386
274 HD2 PHE 47 HD2 PHE 47 11.427 1.713 -11.725
275 HE1 PHE 47 HE1 PHE 47 13.748 5.653 -13.589
276 HE2 PHE 47 HE2 PHE 47 13.891 1.717 -11.925
277 HZ PHE 47 HZ PHE 47 15.051 3.687 -12.859
278 H GLN 48 H GLN 48 7.689 0.955 -13.619
279 HA GLN 48 HA GLN 48 5.140 2.280 -12.752
280 HB2 GLN 48 1HB GLN 48 5.506 -0.177 -14.480
281 HB3 GLN 48 2HB GLN 48 3.954 0.492 -13.924
282 HG2 GLN 48 1HG GLN 48 4.589 2.673 -15.432
283 HG3 GLN 48 2HG GLN 48 5.982 1.591 -15.661
284 HE21 GLN 48 2HE2 GLN 48 4.408 2.636 -17.766
285 HE22 GLN 48 1HE2 GLN 48 3.587 1.319 -18.536
286 H SER 49 H SER 49 3.660 0.928 -11.555
287 HA SER 49 HA SER 49 4.969 -1.269 -9.953
288 HB2 SER 49 1HB SER 49 5.565 0.683 -8.817
289 HB3 SER 49 2HB SER 49 3.862 1.192 -8.743
290 HG SER 49 HG SER 49 4.948 -1.186 -7.637
291 H THR 50 H THR 50 3.534 -2.746 -9.177
292 HA THR 50 HA THR 50 0.611 -2.149 -9.488
293 HB THR 50 HB THR 50 0.229 -4.499 -10.093
294 HG1 THR 50 HG1 THR 50 2.321 -5.140 -9.004
295 HG21 THR 50 1HG2 THR 50 1.233 -4.484 -12.349
296 HG22 THR 50 2HG2 THR 50 0.606 -2.875 -11.917
297 HG23 THR 50 3HG2 THR 50 2.354 -3.199 -11.843
298 H VAL 51 H VAL 51 -0.802 -3.153 -8.057
299 HA VAL 51 HA VAL 51 0.463 -4.391 -5.625
300 HB VAL 51 HB VAL 51 -1.608 -2.157 -5.679
301 HG11 VAL 51 1HG1 VAL 51 -1.635 -2.407 -3.220
302 HG12 VAL 51 2HG1 VAL 51 -2.188 -3.897 -4.020
303 HG13 VAL 51 3HG1 VAL 51 -0.542 -3.805 -3.350
304 HG21 VAL 51 3HG2 VAL 51 0.666 -1.354 -5.921
305 HG22 VAL 51 1HG2 VAL 51 0.015 -0.938 -4.318
306 HG23 VAL 51 2HG2 VAL 51 1.167 -2.285 -4.488
307 H ILE 52 H ILE 52 -0.324 -6.221 -5.092
308 HA ILE 52 HA ILE 52 -3.037 -6.975 -6.121
309 HB ILE 52 HB ILE 52 -0.821 -8.677 -4.888
310 HG12 ILE 52 1HG1 ILE 52 -1.766 -8.578 -7.739
311 HG13 ILE 52 2HG1 ILE 52 -0.336 -7.723 -7.117
312 HG21 ILE 52 1HG2 ILE 52 -2.213 -10.585 -5.614
313 HG22 ILE 52 2HG2 ILE 52 -3.086 -9.562 -4.451
314 HG23 ILE 52 3HG2 ILE 52 -3.463 -9.456 -6.186
315 HD11 ILE 52 3HD1 ILE 52 -0.757 -10.732 -7.098
316 HD12 ILE 52 1HD1 ILE 52 0.297 -9.836 -8.213
317 HD13 ILE 52 2HD1 ILE 52 0.674 -9.877 -6.474
318 H LEU 53 H LEU 53 -4.677 -6.608 -4.932
319 HA LEU 53 HA LEU 53 -4.403 -7.122 -1.990
320 HB2 LEU 53 1HB LEU 53 -4.491 -4.873 -2.345
321 HB3 LEU 53 2HB LEU 53 -5.920 -4.866 -3.405
322 HG LEU 53 HG LEU 53 -7.217 -5.836 -1.436
323 HD11 LEU 53 1HD1 LEU 53 -6.240 -5.385 0.831
324 HD12 LEU 53 2HD1 LEU 53 -5.238 -6.534 -0.087
325 HD13 LEU 53 3HD1 LEU 53 -4.737 -4.832 0.056
326 HD21 LEU 53 3HD2 LEU 53 -7.472 -3.534 -2.151
327 HD22 LEU 53 1HD2 LEU 53 -7.541 -3.629 -0.374
328 HD23 LEU 53 2HD2 LEU 53 -6.063 -3.045 -1.179
329 H ASP 54 H ASP 54 -5.564 -8.706 -1.281
330 HA ASP 54 HA ASP 54 -7.196 -10.363 -1.196
331 HB2 ASP 54 1HB ASP 54 -8.949 -8.085 -2.302
332 HB3 ASP 54 2HB ASP 54 -9.405 -9.721 -1.767
333 H GLY 55 H GLY 55 -5.533 -10.091 -3.622
334 HA2 GLY 55 1HA GLY 55 -5.371 -11.740 -5.309
335 HA3 GLY 55 2HA GLY 55 -7.117 -12.047 -5.168
336 H VAL 56 H VAL 56 -6.785 -8.771 -5.205
337 HA VAL 56 HA VAL 56 -7.268 -8.641 -8.176
338 HB VAL 56 HB VAL 56 -8.083 -6.692 -5.979
339 HG11 VAL 56 1HG1 VAL 56 -9.415 -5.641 -7.777
340 HG12 VAL 56 2HG1 VAL 56 -7.680 -5.632 -8.176
341 HG13 VAL 56 3HG1 VAL 56 -8.765 -6.815 -8.945
342 HG21 VAL 56 3HG2 VAL 56 -9.330 -8.760 -5.787
343 HG22 VAL 56 1HG2 VAL 56 -10.368 -7.449 -6.396
344 HG23 VAL 56 2HG2 VAL 56 -9.752 -8.688 -7.514
345 H ARG 57 H ARG 57 -5.832 -7.848 -9.424
346 HA ARG 57 HA ARG 57 -3.550 -6.401 -8.158
347 HB2 ARG 57 1HB ARG 57 -3.143 -8.441 -9.462
348 HB3 ARG 57 2HB ARG 57 -3.689 -7.553 -10.904
349 HG2 ARG 57 1HG ARG 57 -1.877 -5.956 -10.655
350 HG3 ARG 57 2HG ARG 57 -1.366 -6.731 -9.136
351 HD2 ARG 57 1HD ARG 57 -0.866 -8.769 -10.401
352 HD3 ARG 57 2HD ARG 57 -1.263 -7.895 -11.899
353 HE ARG 57 HE ARG 57 0.926 -6.541 -10.487
354 HH11 ARG 57 1HH1 ARG 57 0.265 -9.341 -12.458
355 HH12 ARG 57 2HH1 ARG 57 1.914 -9.320 -13.050
356 HH21 ARG 57 1HH2 ARG 57 2.818 -6.509 -11.150
357 HH22 ARG 57 2HH2 ARG 57 3.372 -7.706 -12.305
358 H TYR 58 H TYR 58 -3.310 -4.328 -8.300
359 HA TYR 58 HA TYR 58 -4.864 -2.869 -10.412
360 HB2 TYR 58 1HB TYR 58 -3.749 -1.866 -7.785
361 HB3 TYR 58 2HB TYR 58 -4.720 -0.938 -8.955
362 HD1 TYR 58 HD2 TYR 58 -7.127 -1.486 -9.270
363 HD2 TYR 58 HD1 TYR 58 -4.800 -3.360 -6.227
364 HE1 TYR 58 HE2 TYR 58 -9.204 -2.223 -8.150
365 HE2 TYR 58 HE1 TYR 58 -6.872 -4.106 -5.092
366 HH TYR 58 HH TYR 58 -10.107 -3.343 -6.385
367 H ASN 59 H ASN 59 -3.953 -1.320 -11.657
368 HA ASN 59 HA ASN 59 -0.959 -1.448 -11.767
369 HB2 ASN 59 1HB ASN 59 -2.786 -0.705 -14.169
370 HB3 ASN 59 2HB ASN 59 -1.045 -0.810 -13.810
371 HD21 ASN 59 2HD2 ASN 59 -3.879 -2.484 -14.707
372 HD22 ASN 59 1HD2 ASN 59 -3.196 -4.073 -14.811
373 H SER 60 H SER 60 0.271 0.282 -11.617
374 HA SER 60 HA SER 60 -0.813 2.884 -10.796
375 HB2 SER 60 1HB SER 60 1.336 3.617 -10.695
376 HB3 SER 60 2HB SER 60 1.248 1.987 -9.991
377 HG SER 60 HG SER 60 2.175 2.640 -12.593
378 H LEU 61 H LEU 61 -0.217 4.879 -11.948
379 HA LEU 61 HA LEU 61 -0.786 4.748 -14.825
380 HB2 LEU 61 1HB LEU 61 0.050 6.900 -12.992
381 HB3 LEU 61 2HB LEU 61 -0.464 7.281 -14.651
382 HG LEU 61 HG LEU 61 -2.186 6.111 -12.432
383 HD11 LEU 61 1HD1 LEU 61 -3.443 8.273 -12.642
384 HD12 LEU 61 2HD1 LEU 61 -1.742 8.554 -12.199
385 HD13 LEU 61 3HD1 LEU 61 -2.279 8.810 -13.876
386 HD21 LEU 61 3HD2 LEU 61 -2.792 5.166 -14.581
387 HD22 LEU 61 1HD2 LEU 61 -4.054 6.296 -14.037
388 HD23 LEU 61 2HD2 LEU 61 -2.898 6.791 -15.298
389 HA PRO 62 HA PRO 62 3.320 4.930 -16.147
390 HB2 PRO 62 1HB PRO 62 2.940 5.544 -18.518
391 HB3 PRO 62 2HB PRO 62 2.367 4.148 -17.908
392 HG2 PRO 62 1HG PRO 62 0.987 6.276 -18.504
393 HG3 PRO 62 2HG PRO 62 0.543 4.728 -18.759
394 HD2 PRO 62 1HD PRO 62 -0.420 5.577 -16.679
395 HD3 PRO 62 2HD PRO 62 0.182 4.062 -16.622
396 H GLY 63 H GLY 63 5.059 6.276 -16.942
397 HA2 GLY 63 1HA GLY 63 5.714 8.390 -17.931
398 HA3 GLY 63 2HA GLY 63 4.269 9.141 -17.214
399 H PHE 64 H PHE 64 5.677 6.975 -15.053
400 HA PHE 64 HA PHE 64 6.776 9.218 -13.449
401 HB2 PHE 64 1HB PHE 64 6.180 6.298 -12.826
402 HB3 PHE 64 2HB PHE 64 6.971 7.406 -11.682
403 HD1 PHE 64 HD2 PHE 64 5.660 9.710 -11.384
404 HD2 PHE 64 HD1 PHE 64 3.948 5.993 -12.609
405 HE1 PHE 64 HE2 PHE 64 3.448 10.469 -10.584
406 HE2 PHE 64 HE1 PHE 64 1.733 6.749 -11.813
407 HZ PHE 64 HZ PHE 64 1.483 8.988 -10.801
408 H PHE 65 H PHE 65 8.822 9.529 -12.894
409 HA PHE 65 HA PHE 65 10.837 7.632 -14.057
410 HB2 PHE 65 1HB PHE 65 11.067 10.605 -13.416
411 HB3 PHE 65 2HB PHE 65 12.401 9.575 -13.980
412 HD1 PHE 65 HD2 PHE 65 12.350 8.624 -16.249
413 HD2 PHE 65 HD1 PHE 65 9.471 11.477 -14.901
414 HE1 PHE 65 HE2 PHE 65 11.743 9.115 -18.595
415 HE2 PHE 65 HE1 PHE 65 8.859 11.969 -17.245
416 HZ PHE 65 HZ PHE 65 9.994 10.787 -19.091
417 H ASN 66 H ASN 66 9.432 7.287 -11.522
418 HA ASN 66 HA ASN 66 11.799 6.894 -9.828
419 HB2 ASN 66 1HB ASN 66 10.844 9.418 -9.288
420 HB3 ASN 66 2HB ASN 66 9.553 8.291 -8.807
421 HD21 ASN 66 2HD2 ASN 66 9.979 9.500 -6.761
422 HD22 ASN 66 1HD2 ASN 66 11.151 8.826 -5.678
423 H ARG 67 H ARG 67 11.636 5.154 -8.643
424 HA ARG 67 HA ARG 67 9.421 3.379 -8.972
425 HB2 ARG 67 1HB ARG 67 11.652 3.368 -6.995
426 HB3 ARG 67 2HB ARG 67 10.414 2.098 -7.130
427 HG2 ARG 67 1HG ARG 67 11.119 1.615 -9.413
428 HG3 ARG 67 2HG ARG 67 12.307 2.938 -9.347
429 HD2 ARG 67 1HD ARG 67 13.500 1.759 -7.592
430 HD3 ARG 67 2HD ARG 67 12.325 0.426 -7.704
431 HE ARG 67 HE ARG 67 13.556 0.668 -10.297
432 HH11 ARG 67 1HH1 ARG 67 14.570 -0.080 -7.046
433 HH12 ARG 67 2HH1 ARG 67 15.842 -1.111 -7.674
434 HH21 ARG 67 1HH2 ARG 67 15.012 -0.501 -11.032
435 HH22 ARG 67 2HH2 ARG 67 16.095 -1.351 -9.946
436 H LYS 68 H LYS 68 10.255 5.607 -6.340
437 HA LYS 68 HA LYS 68 8.156 4.729 -4.570
438 HB2 LYS 68 1HB LYS 68 9.676 7.326 -4.815
439 HB3 LYS 68 2HB LYS 68 8.495 6.985 -3.528
440 HG2 LYS 68 1HG LYS 68 9.869 5.086 -2.769
441 HG3 LYS 68 2HG LYS 68 11.051 5.430 -4.055
442 HD2 LYS 68 1HD LYS 68 11.450 7.664 -3.079
443 HD3 LYS 68 2HD LYS 68 10.287 7.296 -1.782
444 HE2 LYS 68 1HE LYS 68 11.685 5.423 -1.043
445 HE3 LYS 68 2HE LYS 68 12.839 5.757 -2.355
446 HZ1 LYS 68 3HZ LYS 68 12.188 7.590 -0.137
447 HZ2 LYS 68 1HZ LYS 68 13.568 6.696 -0.268
448 HZ3 LYS 68 2HZ LYS 68 13.260 7.900 -1.353
449 H ALA 69 H ALA 69 8.295 7.209 -7.096
450 HA ALA 69 HA ALA 69 5.694 8.290 -6.593
451 HB1 ALA 69 3HB ALA 69 7.265 8.129 -9.187
452 HB2 ALA 69 1HB ALA 69 5.850 9.163 -8.893
453 HB3 ALA 69 2HB ALA 69 7.355 9.437 -7.986
454 H ALA 70 H ALA 70 6.807 5.622 -8.661
455 HA ALA 70 HA ALA 70 4.231 5.008 -9.752
456 HB1 ALA 70 3HB ALA 70 6.619 3.196 -9.261
457 HB2 ALA 70 1HB ALA 70 5.222 2.818 -10.295
458 HB3 ALA 70 2HB ALA 70 6.314 4.155 -10.728
459 H GLU 71 H GLU 71 5.899 3.960 -6.807
460 HA GLU 71 HA GLU 71 3.973 1.990 -6.005
461 HB2 GLU 71 1HB GLU 71 5.903 3.737 -4.484
462 HB3 GLU 71 2HB GLU 71 4.846 2.546 -3.690
463 HG2 GLU 71 1HG GLU 71 5.978 0.694 -4.937
464 HG3 GLU 71 2HG GLU 71 6.819 1.962 -5.857
465 H GLN 72 H GLN 72 4.178 5.483 -5.375
466 HA GLN 72 HA GLN 72 1.890 5.580 -3.639
467 HB2 GLN 72 1HB GLN 72 3.228 7.619 -5.421
468 HB3 GLN 72 2HB GLN 72 1.834 8.001 -4.383
469 HG2 GLN 72 1HG GLN 72 3.404 7.344 -2.292
470 HG3 GLN 72 2HG GLN 72 4.433 6.943 -3.687
471 HE21 GLN 72 2HE2 GLN 72 5.149 8.677 -1.540
472 HE22 GLN 72 1HE2 GLN 72 5.369 10.266 -2.193
473 H SER 73 H SER 73 2.236 5.973 -7.152
474 HA SER 73 HA SER 73 -0.504 6.614 -7.780
475 HB2 SER 73 1HB SER 73 1.212 6.982 -9.296
476 HB3 SER 73 2HB SER 73 1.562 5.241 -9.390
477 HG SER 73 HG SER 73 -1.013 6.254 -9.925
478 H ALA 74 H ALA 74 1.257 3.495 -7.553
479 HA ALA 74 HA ALA 74 -0.939 1.852 -8.333
480 HB1 ALA 74 3HB ALA 74 1.426 1.198 -6.540
481 HB2 ALA 74 1HB ALA 74 0.345 0.012 -7.309
482 HB3 ALA 74 2HB ALA 74 1.383 1.053 -8.313
483 H ALA 75 H ALA 75 0.182 2.892 -5.116
484 HA ALA 75 HA ALA 75 -1.834 1.460 -3.662
485 HB1 ALA 75 3HB ALA 75 -0.316 3.983 -2.920
486 HB2 ALA 75 1HB ALA 75 -1.252 2.965 -1.802
487 HB3 ALA 75 2HB ALA 75 0.202 2.313 -2.594
488 H GLU 76 H GLU 76 -1.750 4.670 -5.138
489 HA GLU 76 HA GLU 76 -4.197 5.637 -3.983
490 HB2 GLU 76 1HB GLU 76 -2.517 7.052 -5.085
491 HB3 GLU 76 2HB GLU 76 -2.916 6.287 -6.642
492 HG2 GLU 76 1HG GLU 76 -4.130 8.432 -6.590
493 HG3 GLU 76 2HG GLU 76 -5.225 7.054 -6.339
494 H VAL 77 H VAL 77 -3.531 3.896 -7.016
495 HA VAL 77 HA VAL 77 -6.286 3.857 -7.918
496 HB VAL 77 HB VAL 77 -3.931 2.017 -8.507
497 HG11 VAL 77 1HG1 VAL 77 -5.293 1.209 -10.406
498 HG12 VAL 77 2HG1 VAL 77 -6.083 0.849 -8.852
499 HG13 VAL 77 3HG1 VAL 77 -6.659 2.205 -9.851
500 HG21 VAL 77 3HG2 VAL 77 -3.596 4.293 -9.266
501 HG22 VAL 77 1HG2 VAL 77 -3.855 3.199 -10.644
502 HG23 VAL 77 2HG2 VAL 77 -5.169 4.267 -10.098
503 H ALA 78 H ALA 78 -4.368 1.512 -6.053
504 HA ALA 78 HA ALA 78 -6.416 -0.434 -5.821
505 HB1 ALA 78 3HB ALA 78 -4.226 0.280 -3.841
506 HB2 ALA 78 1HB ALA 78 -5.181 -1.222 -3.840
507 HB3 ALA 78 2HB ALA 78 -4.084 -0.865 -5.197
508 H LEU 79 H LEU 79 -5.741 2.449 -3.863
509 HA LEU 79 HA LEU 79 -7.767 1.782 -1.875
510 HB2 LEU 79 1HB LEU 79 -6.200 4.160 -2.602
511 HB3 LEU 79 2HB LEU 79 -7.313 4.283 -1.219
512 HG LEU 79 HG LEU 79 -4.947 2.381 -1.443
513 HD11 LEU 79 1HD1 LEU 79 -3.946 3.804 0.366
514 HD12 LEU 79 2HD1 LEU 79 -4.254 4.752 -1.108
515 HD13 LEU 79 3HD1 LEU 79 -5.360 4.879 0.281
516 HD21 LEU 79 3HD2 LEU 79 -6.766 1.434 -0.149
517 HD22 LEU 79 1HD2 LEU 79 -5.418 1.868 0.928
518 HD23 LEU 79 2HD2 LEU 79 -6.863 2.905 0.848
519 H ARG 80 H ARG 80 -7.645 3.765 -4.787
520 HA ARG 80 HA ARG 80 -10.189 5.057 -4.398
521 HB2 ARG 80 1HB ARG 80 -8.538 4.527 -6.814
522 HB3 ARG 80 2HB ARG 80 -10.144 5.291 -6.884
523 HG2 ARG 80 1HG ARG 80 -9.349 7.086 -5.397
524 HG3 ARG 80 2HG ARG 80 -7.738 6.327 -5.353
525 HD2 ARG 80 1HD ARG 80 -7.542 6.672 -7.758
526 HD3 ARG 80 2HD ARG 80 -9.118 7.499 -7.745
527 HE ARG 80 HE ARG 80 -7.315 8.934 -5.972
528 HH11 ARG 80 1HH1 ARG 80 -7.729 8.300 -9.375
529 HH12 ARG 80 2HH1 ARG 80 -6.986 9.841 -9.758
530 HH21 ARG 80 1HH2 ARG 80 -6.456 10.698 -6.394
531 HH22 ARG 80 2HH2 ARG 80 -6.259 11.208 -8.059
532 H GLU 81 H GLU 81 -9.262 2.030 -6.017
533 HA GLU 81 HA GLU 81 -12.026 1.396 -6.732
534 HB2 GLU 81 1HB GLU 81 -9.486 -0.235 -6.632
535 HB3 GLU 81 2HB GLU 81 -11.059 -0.864 -7.177
536 HG2 GLU 81 1HG GLU 81 -9.461 1.385 -8.546
537 HG3 GLU 81 2HG GLU 81 -9.677 -0.317 -9.019
538 H LEU 82 H LEU 82 -9.878 0.700 -4.031
539 HA LEU 82 HA LEU 82 -11.496 -1.300 -2.778
540 HB2 LEU 82 1HB LEU 82 -9.305 -0.882 -2.215
541 HB3 LEU 82 2HB LEU 82 -9.562 0.763 -1.591
542 HG LEU 82 HG LEU 82 -11.072 -0.227 0.165
543 HD11 LEU 82 1HD1 LEU 82 -10.843 -2.686 0.606
544 HD12 LEU 82 2HD1 LEU 82 -11.548 -2.380 -0.998
545 HD13 LEU 82 3HD1 LEU 82 -9.835 -2.839 -0.850
546 HD21 LEU 82 3HD2 LEU 82 -8.793 0.416 0.686
547 HD22 LEU 82 1HD2 LEU 82 -9.231 -1.054 1.588
548 HD23 LEU 82 2HD2 LEU 82 -8.191 -1.170 0.147
549 H ALA 83 H ALA 83 -11.506 2.247 -2.464
550 HA ALA 83 HA ALA 83 -13.537 2.409 -0.497
551 HB1 ALA 83 3HB ALA 83 -12.937 4.319 -2.779
552 HB2 ALA 83 1HB ALA 83 -13.904 4.696 -1.336
553 HB3 ALA 83 2HB ALA 83 -12.170 4.330 -1.173
554 H LYS 84 H LYS 84 -13.735 1.861 -3.962
555 HA LYS 84 HA LYS 84 -16.541 2.529 -4.210
556 HB2 LYS 84 1HB LYS 84 -14.679 0.853 -5.897
557 HB3 LYS 84 2HB LYS 84 -16.359 1.241 -6.341
558 HG2 LYS 84 1HG LYS 84 -15.816 3.628 -6.383
559 HG3 LYS 84 2HG LYS 84 -14.145 3.271 -5.885
560 HD2 LYS 84 1HD LYS 84 -13.780 2.001 -7.946
561 HD3 LYS 84 2HD LYS 84 -15.465 2.292 -8.440
562 HE2 LYS 84 1HE LYS 84 -15.043 4.705 -8.502
563 HE3 LYS 84 2HE LYS 84 -13.365 4.433 -7.979
564 HZ1 LYS 84 3HZ LYS 84 -14.558 3.457 -10.495
565 HZ2 LYS 84 1HZ LYS 84 -13.520 4.732 -10.357
566 HZ3 LYS 84 2HZ LYS 84 -13.001 3.204 -10.012
567 H SER 85 H SER 85 -14.878 -0.201 -2.961
568 HA SER 85 HA SER 85 -16.942 -2.231 -3.471
569 HB2 SER 85 1HB SER 85 -15.731 -3.636 -2.195
570 HB3 SER 85 2HB SER 85 -14.592 -2.692 -3.182
571 HG SER 85 HG SER 85 -13.913 -2.908 -1.006
572 H SER 86 H SER 86 -16.549 0.402 -1.250
573 HA SER 86 HA SER 86 -17.964 -0.665 1.069
574 HB2 SER 86 1HB SER 86 -16.469 1.090 1.301
575 HB3 SER 86 2HB SER 86 -17.431 2.115 0.211
576 HG SER 86 HG SER 86 -17.885 2.498 2.422
Start of MODEL 6
1 H PHE 16 H PHE 16 -0.827 2.528 -1.354
2 HA PHE 16 HA PHE 16 -2.260 0.270 0.229
3 HB2 PHE 16 1HB PHE 16 0.071 -0.346 -1.635
4 HB3 PHE 16 2HB PHE 16 -0.711 -1.546 -0.581
5 HD1 PHE 16 HD2 PHE 16 -3.093 -2.125 -0.945
6 HD2 PHE 16 HD1 PHE 16 -0.859 0.273 -3.684
7 HE1 PHE 16 HE2 PHE 16 -4.760 -2.592 -2.710
8 HE2 PHE 16 HE1 PHE 16 -2.525 -0.189 -5.451
9 HZ PHE 16 HZ PHE 16 -4.477 -1.622 -4.963
10 H LYS 17 H LYS 17 0.791 1.956 0.126
11 HA LYS 17 HA LYS 17 2.093 0.481 2.234
12 HB2 LYS 17 1HB LYS 17 2.432 3.330 1.286
13 HB3 LYS 17 2HB LYS 17 3.511 2.495 2.428
14 HG2 LYS 17 1HG LYS 17 2.983 1.554 -0.409
15 HG3 LYS 17 2HG LYS 17 4.352 2.594 0.054
16 HD2 LYS 17 1HD LYS 17 5.084 0.845 1.669
17 HD3 LYS 17 2HD LYS 17 3.768 -0.202 1.086
18 HE2 LYS 17 1HE LYS 17 4.729 -0.067 -1.204
19 HE3 LYS 17 2HE LYS 17 6.088 0.875 -0.545
20 HZ1 LYS 17 3HZ LYS 17 5.381 -1.885 0.224
21 HZ2 LYS 17 1HZ LYS 17 6.637 -1.454 -0.754
22 HZ3 LYS 17 2HZ LYS 17 6.641 -1.012 0.836
23 H SER 18 H SER 18 2.334 0.848 4.388
24 HA SER 18 HA SER 18 1.907 1.806 6.535
25 HB2 SER 18 1HB SER 18 2.575 3.808 5.399
26 HB3 SER 18 2HB SER 18 0.863 4.128 5.037
27 HG SER 18 HG SER 18 1.567 5.139 6.968
28 H ARG 19 H ARG 19 -0.557 3.863 6.168
29 HA ARG 19 HA ARG 19 -2.244 2.246 7.811
30 HB2 ARG 19 1HB ARG 19 -2.768 4.801 6.370
31 HB3 ARG 19 2HB ARG 19 -3.947 3.985 7.423
32 HG2 ARG 19 1HG ARG 19 -2.433 4.195 9.324
33 HG3 ARG 19 2HG ARG 19 -1.198 4.939 8.280
34 HD2 ARG 19 1HD ARG 19 -2.673 6.822 7.892
35 HD3 ARG 19 2HD ARG 19 -3.891 6.080 8.955
36 HE ARG 19 HE ARG 19 -1.540 6.479 10.562
37 HH11 ARG 19 1HH1 ARG 19 -3.773 8.480 8.784
38 HH12 ARG 19 2HH1 ARG 19 -3.519 9.787 9.924
39 HH21 ARG 19 1HH2 ARG 19 -1.231 7.969 11.871
40 HH22 ARG 19 2HH2 ARG 19 -2.068 9.497 11.684
41 H LEU 20 H LEU 20 -2.110 2.676 4.346
42 HA LEU 20 HA LEU 20 -4.754 1.613 3.815
43 HB2 LEU 20 1HB LEU 20 -2.257 1.876 2.282
44 HB3 LEU 20 2HB LEU 20 -3.715 1.293 1.447
45 HG LEU 20 HG LEU 20 -3.490 3.991 2.829
46 HD11 LEU 20 1HD1 LEU 20 -3.342 4.949 0.516
47 HD12 LEU 20 2HD1 LEU 20 -1.964 3.877 0.861
48 HD13 LEU 20 3HD1 LEU 20 -3.311 3.299 -0.149
49 HD21 LEU 20 3HD2 LEU 20 -5.753 3.133 2.687
50 HD22 LEU 20 1HD2 LEU 20 -5.556 4.511 1.578
51 HD23 LEU 20 2HD2 LEU 20 -5.567 2.848 0.939
52 H GLN 21 H GLN 21 -1.561 0.186 4.227
53 HA GLN 21 HA GLN 21 -2.422 -2.507 3.552
54 HB2 GLN 21 1HB GLN 21 -0.066 -1.781 3.565
55 HB3 GLN 21 2HB GLN 21 -0.172 -1.530 5.324
56 HG2 GLN 21 1HG GLN 21 -0.600 -4.207 5.491
57 HG3 GLN 21 2HG GLN 21 -0.472 -3.926 3.738
58 HE21 GLN 21 2HE2 GLN 21 1.132 -5.789 4.974
59 HE22 GLN 21 1HE2 GLN 21 2.771 -5.229 4.999
60 H GLU 22 H GLU 22 -2.213 -0.650 6.571
61 HA GLU 22 HA GLU 22 -3.091 -2.768 8.297
62 HB2 GLU 22 1HB GLU 22 -3.362 0.235 8.467
63 HB3 GLU 22 2HB GLU 22 -3.838 -0.886 9.766
64 HG2 GLU 22 1HG GLU 22 -1.437 -1.636 9.978
65 HG3 GLU 22 2HG GLU 22 -1.112 -0.595 8.573
66 H TYR 23 H TYR 23 -4.840 -0.502 6.240
67 HA TYR 23 HA TYR 23 -7.475 -1.189 7.190
68 HB2 TYR 23 1HB TYR 23 -6.516 -0.221 4.490
69 HB3 TYR 23 2HB TYR 23 -8.218 -0.330 5.001
70 HD1 TYR 23 HD1 TYR 23 -7.056 0.538 7.958
71 HD2 TYR 23 HD2 TYR 23 -7.136 2.237 4.048
72 HE1 TYR 23 HE1 TYR 23 -6.904 2.804 8.948
73 HE2 TYR 23 HE2 TYR 23 -6.985 4.505 5.019
74 HH TYR 23 HH TYR 23 -6.844 5.741 6.926
75 H ALA 24 H ALA 24 -5.426 -2.515 4.601
76 HA ALA 24 HA ALA 24 -7.284 -4.473 3.696
77 HB1 ALA 24 3HB ALA 24 -4.250 -4.589 3.777
78 HB2 ALA 24 1HB ALA 24 -5.307 -5.650 2.817
79 HB3 ALA 24 2HB ALA 24 -5.239 -3.907 2.464
80 H GLN 25 H GLN 25 -4.953 -4.510 6.364
81 HA GLN 25 HA GLN 25 -5.406 -7.264 7.096
82 HB2 GLN 25 1HB GLN 25 -4.462 -4.847 8.647
83 HB3 GLN 25 2HB GLN 25 -4.543 -6.490 9.328
84 HG2 GLN 25 1HG GLN 25 -2.728 -7.189 7.460
85 HG3 GLN 25 2HG GLN 25 -3.086 -5.499 7.036
86 HE21 GLN 25 2HE2 GLN 25 -0.490 -6.517 7.532
87 HE22 GLN 25 1HE2 GLN 25 0.127 -5.752 8.959
88 H LYS 26 H LYS 26 -6.911 -4.211 8.106
89 HA LYS 26 HA LYS 26 -8.726 -5.407 9.997
90 HB2 LYS 26 1HB LYS 26 -8.871 -2.888 8.339
91 HB3 LYS 26 2HB LYS 26 -10.076 -3.345 9.566
92 HG2 LYS 26 1HG LYS 26 -8.392 -3.242 11.319
93 HG3 LYS 26 2HG LYS 26 -7.123 -2.907 10.117
94 HD2 LYS 26 1HD LYS 26 -8.243 -0.800 9.515
95 HD3 LYS 26 2HD LYS 26 -9.516 -1.134 10.713
96 HE2 LYS 26 1HE LYS 26 -7.834 -1.108 12.507
97 HE3 LYS 26 2HE LYS 26 -6.564 -0.769 11.310
98 HZ1 LYS 26 3HZ LYS 26 -8.860 0.981 11.915
99 HZ2 LYS 26 1HZ LYS 26 -7.307 1.232 12.409
100 HZ3 LYS 26 2HZ LYS 26 -7.682 1.296 10.804
101 H TYR 27 H TYR 27 -8.583 -5.505 6.580
102 HA TYR 27 HA TYR 27 -11.449 -6.358 6.435
103 HB2 TYR 27 1HB TYR 27 -9.446 -5.660 4.278
104 HB3 TYR 27 2HB TYR 27 -11.113 -6.217 3.997
105 HD1 TYR 27 HD1 TYR 27 -11.802 -4.467 6.708
106 HD2 TYR 27 HD2 TYR 27 -10.220 -3.674 2.829
107 HE1 TYR 27 HE1 TYR 27 -12.610 -2.131 6.864
108 HE2 TYR 27 HE2 TYR 27 -11.021 -1.340 2.967
109 HH TYR 27 HH TYR 27 -12.760 -0.112 5.836
110 H LYS 28 H LYS 28 -8.817 -7.806 7.344
111 HA LYS 28 HA LYS 28 -8.076 -10.009 7.290
112 HB2 LYS 28 1HB LYS 28 -10.821 -10.500 6.129
113 HB3 LYS 28 2HB LYS 28 -9.733 -11.721 6.830
114 HG2 LYS 28 1HG LYS 28 -9.894 -10.553 9.021
115 HG3 LYS 28 2HG LYS 28 -11.064 -9.422 8.302
116 HD2 LYS 28 1HD LYS 28 -12.535 -11.358 7.755
117 HD3 LYS 28 2HD LYS 28 -11.388 -12.427 8.596
118 HE2 LYS 28 1HE LYS 28 -11.738 -11.182 10.678
119 HE3 LYS 28 2HE LYS 28 -12.864 -10.088 9.844
120 HZ1 LYS 28 3HZ LYS 28 -13.251 -12.989 10.214
121 HZ2 LYS 28 1HZ LYS 28 -14.026 -11.803 11.058
122 HZ3 LYS 28 2HZ LYS 28 -14.295 -11.974 9.440
123 H LEU 29 H LEU 29 -7.497 -8.314 5.029
124 HA LEU 29 HA LEU 29 -7.461 -10.256 2.780
125 HB2 LEU 29 1HB LEU 29 -6.416 -7.519 3.111
126 HB3 LEU 29 2HB LEU 29 -6.419 -8.316 1.521
127 HG LEU 29 HG LEU 29 -8.843 -7.445 3.142
128 HD11 LEU 29 1HD1 LEU 29 -9.253 -5.934 1.182
129 HD12 LEU 29 2HD1 LEU 29 -7.678 -5.598 1.937
130 HD13 LEU 29 3HD1 LEU 29 -7.759 -6.534 0.426
131 HD21 LEU 29 3HD2 LEU 29 -9.286 -9.554 2.032
132 HD22 LEU 29 1HD2 LEU 29 -10.190 -8.247 1.232
133 HD23 LEU 29 2HD2 LEU 29 -8.711 -8.894 0.483
134 HA PRO 30 HA PRO 30 -3.476 -11.623 3.438
135 HB2 PRO 30 1HB PRO 30 -2.714 -11.978 1.074
136 HB3 PRO 30 2HB PRO 30 -3.898 -12.863 1.760
137 HG2 PRO 30 1HG PRO 30 -4.184 -10.964 -0.002
138 HG3 PRO 30 2HG PRO 30 -5.013 -12.368 0.056
139 HD2 PRO 30 1HD PRO 30 -6.135 -10.378 0.973
140 HD3 PRO 30 2HD PRO 30 -6.287 -11.810 1.739
141 H THR 31 H THR 31 -1.214 -11.196 3.377
142 HA THR 31 HA THR 31 -0.617 -8.408 3.407
143 HB THR 31 HB THR 31 1.307 -10.738 3.011
144 HG1 THR 31 HG1 THR 31 0.027 -10.887 4.935
145 HG21 THR 31 1HG2 THR 31 2.970 -9.192 3.982
146 HG22 THR 31 2HG2 THR 31 2.285 -8.532 2.478
147 HG23 THR 31 3HG2 THR 31 1.738 -7.910 4.051
148 HA PRO 32 HA PRO 32 -0.583 -7.520 -0.816
149 HB2 PRO 32 1HB PRO 32 0.677 -5.328 0.218
150 HB3 PRO 32 2HB PRO 32 -0.614 -5.440 -0.770
151 HG2 PRO 32 1HG PRO 32 -0.621 -5.566 1.833
152 HG3 PRO 32 2HG PRO 32 -1.721 -4.812 0.895
153 HD2 PRO 32 1HD PRO 32 0.144 -6.771 2.872
154 HD3 PRO 32 2HD PRO 32 -1.352 -6.596 2.247
155 H VAL 33 H VAL 33 0.731 -8.013 -2.471
156 HA VAL 33 HA VAL 33 3.662 -8.186 -1.803
157 HB VAL 33 HB VAL 33 2.073 -9.453 -4.074
158 HG11 VAL 33 1HG1 VAL 33 4.170 -10.685 -4.513
159 HG12 VAL 33 2HG1 VAL 33 4.413 -8.930 -4.677
160 HG13 VAL 33 3HG1 VAL 33 4.979 -9.774 -3.215
161 HG21 VAL 33 3HG2 VAL 33 1.516 -10.464 -1.944
162 HG22 VAL 33 1HG2 VAL 33 2.496 -11.572 -2.934
163 HG23 VAL 33 2HG2 VAL 33 3.243 -10.691 -1.579
164 H TYR 34 H TYR 34 4.947 -6.698 -2.421
165 HA TYR 34 HA TYR 34 3.992 -4.817 -4.537
166 HB2 TYR 34 1HB TYR 34 6.210 -4.560 -2.495
167 HB3 TYR 34 2HB TYR 34 5.706 -3.314 -3.663
168 HD1 TYR 34 HD1 TYR 34 4.727 -5.152 -0.603
169 HD2 TYR 34 HD2 TYR 34 3.736 -1.980 -3.275
170 HE1 TYR 34 HE1 TYR 34 3.055 -4.316 1.023
171 HE2 TYR 34 HE2 TYR 34 2.063 -1.132 -1.665
172 HH TYR 34 HH TYR 34 1.485 -2.737 1.474
173 H GLU 35 H GLU 35 4.758 -4.868 -6.483
174 HA GLU 35 HA GLU 35 7.519 -5.971 -6.893
175 HB2 GLU 35 1HB GLU 35 5.070 -6.300 -8.633
176 HB3 GLU 35 2HB GLU 35 6.724 -6.775 -9.085
177 HG2 GLU 35 1HG GLU 35 6.701 -8.425 -7.118
178 HG3 GLU 35 2HG GLU 35 5.042 -7.840 -6.856
179 H ILE 36 H ILE 36 8.833 -5.003 -8.337
180 HA ILE 36 HA ILE 36 7.913 -2.295 -9.261
181 HB ILE 36 HB ILE 36 10.719 -3.382 -8.742
182 HG12 ILE 36 1HG1 ILE 36 9.212 -1.224 -7.292
183 HG13 ILE 36 2HG1 ILE 36 9.324 -2.916 -6.753
184 HG21 ILE 36 1HG2 ILE 36 11.458 -1.069 -9.206
185 HG22 ILE 36 2HG2 ILE 36 10.657 -1.782 -10.626
186 HG23 ILE 36 3HG2 ILE 36 9.784 -0.615 -9.606
187 HD11 ILE 36 3HD1 ILE 36 11.662 -1.011 -7.132
188 HD12 ILE 36 1HD1 ILE 36 10.956 -1.497 -5.573
189 HD13 ILE 36 2HD1 ILE 36 11.774 -2.704 -6.595
190 H VAL 37 H VAL 37 7.833 -1.725 -11.265
191 HA VAL 37 HA VAL 37 8.835 -3.708 -13.307
192 HB VAL 37 HB VAL 37 6.365 -1.929 -13.435
193 HG11 VAL 37 1HG1 VAL 37 5.938 -3.110 -15.564
194 HG12 VAL 37 2HG1 VAL 37 7.482 -2.228 -15.619
195 HG13 VAL 37 3HG1 VAL 37 7.474 -3.991 -15.382
196 HG21 VAL 37 3HG2 VAL 37 6.021 -3.794 -11.929
197 HG22 VAL 37 1HG2 VAL 37 5.094 -4.015 -13.431
198 HG23 VAL 37 2HG2 VAL 37 6.599 -4.930 -13.172
199 H LYS 38 H LYS 38 10.429 -3.053 -14.432
200 HA LYS 38 HA LYS 38 10.492 -0.158 -15.221
201 HB2 LYS 38 1HB LYS 38 12.203 -0.686 -13.532
202 HB3 LYS 38 2HB LYS 38 12.834 -1.964 -14.597
203 HG2 LYS 38 1HG LYS 38 13.442 -0.298 -16.279
204 HG3 LYS 38 2HG LYS 38 12.748 0.996 -15.274
205 HD2 LYS 38 1HD LYS 38 14.387 0.476 -13.496
206 HD3 LYS 38 2HD LYS 38 15.096 -0.783 -14.534
207 HE2 LYS 38 1HE LYS 38 15.685 0.896 -16.208
208 HE3 LYS 38 2HE LYS 38 14.928 2.166 -15.220
209 HZ1 LYS 38 3HZ LYS 38 17.261 0.544 -14.429
210 HZ2 LYS 38 1HZ LYS 38 17.311 2.115 -14.928
211 HZ3 LYS 38 2HZ LYS 38 16.558 1.722 -13.513
212 H GLU 39 H GLU 39 10.154 0.100 -17.268
213 HA GLU 39 HA GLU 39 11.323 -1.882 -19.178
214 HB2 GLU 39 1HB GLU 39 8.505 -0.791 -19.204
215 HB3 GLU 39 2HB GLU 39 9.264 -1.723 -20.518
216 HG2 GLU 39 1HG GLU 39 9.469 -3.700 -18.908
217 HG3 GLU 39 2HG GLU 39 8.698 -2.620 -17.724
218 H GLY 40 H GLY 40 11.531 -1.129 -21.349
219 HA2 GLY 40 1HA GLY 40 11.480 0.653 -22.971
220 HA3 GLY 40 2HA GLY 40 11.422 1.834 -21.642
221 HA PRO 41 HA PRO 41 15.705 1.352 -23.426
222 HB2 PRO 41 1HB PRO 41 15.289 4.049 -23.497
223 HB3 PRO 41 2HB PRO 41 15.978 3.055 -24.588
224 HG2 PRO 41 1HG PRO 41 13.438 3.578 -24.334
225 HG3 PRO 41 2HG PRO 41 14.259 3.406 -25.732
226 HD2 PRO 41 1HD PRO 41 12.365 3.188 -23.013
227 HD3 PRO 41 2HD PRO 41 12.747 2.415 -24.398
228 H SER 42 H SER 42 17.709 1.845 -22.428
229 HA SER 42 HA SER 42 17.537 1.831 -19.542
230 HB2 SER 42 1HB SER 42 19.819 1.848 -19.511
231 HB3 SER 42 2HB SER 42 19.249 0.762 -20.798
232 HG SER 42 HG SER 42 20.224 3.403 -21.147
233 H HIS 43 H HIS 43 17.487 4.393 -21.881
234 HA HIS 43 HA HIS 43 18.163 6.385 -19.743
235 HB2 HIS 43 1HB HIS 43 18.375 6.646 -22.777
236 HB3 HIS 43 2HB HIS 43 18.719 7.938 -21.601
237 HD2 HIS 43 HD2 HIS 43 20.686 5.234 -23.510
238 HE1 HIS 43 HE1 HIS 43 22.933 6.287 -20.062
239 HE2 HIS 43 HE2 HIS 43 22.912 5.055 -22.384
240 H LYS 44 H LYS 44 15.669 5.071 -21.598
241 HA LYS 44 HA LYS 44 13.944 7.424 -20.903
242 HB2 LYS 44 1HB LYS 44 13.890 5.695 -23.378
243 HB3 LYS 44 2HB LYS 44 12.582 6.802 -22.898
244 HG2 LYS 44 1HG LYS 44 14.142 8.706 -23.059
245 HG3 LYS 44 2HG LYS 44 15.439 7.595 -23.559
246 HD2 LYS 44 1HD LYS 44 14.023 6.922 -25.514
247 HD3 LYS 44 2HD LYS 44 12.857 8.182 -25.044
248 HE2 LYS 44 1HE LYS 44 14.583 9.898 -25.305
249 HE3 LYS 44 2HE LYS 44 15.775 8.650 -25.734
250 HZ1 LYS 44 3HZ LYS 44 13.339 9.296 -27.270
251 HZ2 LYS 44 1HZ LYS 44 14.876 9.730 -27.683
252 HZ3 LYS 44 2HZ LYS 44 14.444 8.138 -27.669
253 H SER 45 H SER 45 14.451 5.197 -19.239
254 HA SER 45 HA SER 45 12.440 3.090 -19.574
255 HB2 SER 45 1HB SER 45 13.121 2.286 -17.552
256 HB3 SER 45 2HB SER 45 14.542 2.747 -18.515
257 HG SER 45 HG SER 45 14.637 4.667 -17.262
258 H LEU 46 H LEU 46 10.501 2.839 -18.540
259 HA LEU 46 HA LEU 46 9.520 5.148 -16.899
260 HB2 LEU 46 1HB LEU 46 8.135 2.989 -18.353
261 HB3 LEU 46 2HB LEU 46 7.211 4.214 -17.453
262 HG LEU 46 HG LEU 46 8.937 4.671 -19.918
263 HD11 LEU 46 1HD1 LEU 46 6.759 5.320 -20.980
264 HD12 LEU 46 2HD1 LEU 46 6.717 3.641 -20.394
265 HD13 LEU 46 3HD1 LEU 46 5.920 4.929 -19.461
266 HD21 LEU 46 3HD2 LEU 46 9.126 6.538 -18.383
267 HD22 LEU 46 1HD2 LEU 46 8.162 7.014 -19.801
268 HD23 LEU 46 2HD2 LEU 46 7.354 6.652 -18.256
269 H PHE 47 H PHE 47 8.702 4.877 -14.913
270 HA PHE 47 HA PHE 47 9.292 2.209 -13.680
271 HB2 PHE 47 1HB PHE 47 9.221 5.013 -12.487
272 HB3 PHE 47 2HB PHE 47 9.417 3.522 -11.538
273 HD1 PHE 47 HD2 PHE 47 11.455 2.250 -11.617
274 HD2 PHE 47 HD1 PHE 47 10.992 5.856 -13.861
275 HE1 PHE 47 HE2 PHE 47 13.903 2.353 -11.953
276 HE2 PHE 47 HE1 PHE 47 13.438 5.961 -14.201
277 HZ PHE 47 HZ PHE 47 14.893 4.209 -13.247
278 H GLN 48 H GLN 48 7.649 0.970 -13.310
279 HA GLN 48 HA GLN 48 5.123 2.252 -12.325
280 HB2 GLN 48 1HB GLN 48 5.545 -0.061 -14.215
281 HB3 GLN 48 2HB GLN 48 4.027 0.173 -13.316
282 HG2 GLN 48 1HG GLN 48 3.891 2.578 -14.615
283 HG3 GLN 48 2HG GLN 48 5.384 1.840 -15.241
284 HE21 GLN 48 2HE2 GLN 48 1.854 1.648 -15.146
285 HE22 GLN 48 1HE2 GLN 48 1.679 0.653 -16.553
286 H SER 49 H SER 49 3.803 0.959 -10.943
287 HA SER 49 HA SER 49 5.383 -1.083 -9.343
288 HB2 SER 49 1HB SER 49 5.382 0.911 -8.169
289 HB3 SER 49 2HB SER 49 3.617 1.059 -8.327
290 HG SER 49 HG SER 49 4.561 0.067 -6.333
291 H THR 50 H THR 50 4.340 -2.932 -8.873
292 HA THR 50 HA THR 50 1.403 -3.088 -9.472
293 HB THR 50 HB THR 50 3.502 -5.249 -9.927
294 HG1 THR 50 HG1 THR 50 2.881 -4.910 -12.142
295 HG21 THR 50 1HG2 THR 50 1.622 -6.523 -10.895
296 HG22 THR 50 2HG2 THR 50 1.323 -6.144 -9.182
297 HG23 THR 50 3HG2 THR 50 0.506 -5.210 -10.458
298 H VAL 51 H VAL 51 0.245 -3.396 -7.761
299 HA VAL 51 HA VAL 51 1.438 -4.935 -5.460
300 HB VAL 51 HB VAL 51 -0.851 -2.923 -5.492
301 HG11 VAL 51 1HG1 VAL 51 -0.752 -3.156 -3.032
302 HG12 VAL 51 2HG1 VAL 51 -1.132 -4.712 -3.809
303 HG13 VAL 51 3HG1 VAL 51 0.511 -4.398 -3.201
304 HG21 VAL 51 3HG2 VAL 51 1.284 -1.827 -5.821
305 HG22 VAL 51 1HG2 VAL 51 0.645 -1.490 -4.197
306 HG23 VAL 51 2HG2 VAL 51 1.958 -2.672 -4.407
307 H ILE 52 H ILE 52 0.810 -6.863 -5.107
308 HA ILE 52 HA ILE 52 -1.807 -7.763 -6.254
309 HB ILE 52 HB ILE 52 0.503 -9.363 -5.057
310 HG12 ILE 52 1HG1 ILE 52 -0.331 -9.130 -7.934
311 HG13 ILE 52 2HG1 ILE 52 0.989 -8.200 -7.188
312 HG21 ILE 52 1HG2 ILE 52 -0.695 -11.315 -5.986
313 HG22 ILE 52 2HG2 ILE 52 -1.697 -10.458 -4.794
314 HG23 ILE 52 3HG2 ILE 52 -2.011 -10.250 -6.532
315 HD11 ILE 52 3HD1 ILE 52 0.845 -11.228 -7.396
316 HD12 ILE 52 1HD1 ILE 52 1.858 -10.162 -8.398
317 HD13 ILE 52 2HD1 ILE 52 2.165 -10.297 -6.649
318 H LEU 53 H LEU 53 -3.482 -7.490 -5.070
319 HA LEU 53 HA LEU 53 -3.284 -8.305 -2.195
320 HB2 LEU 53 1HB LEU 53 -3.253 -6.024 -2.285
321 HB3 LEU 53 2HB LEU 53 -4.668 -5.823 -3.345
322 HG LEU 53 HG LEU 53 -6.033 -6.952 -1.515
323 HD11 LEU 53 1HD1 LEU 53 -5.061 -6.834 0.795
324 HD12 LEU 53 2HD1 LEU 53 -4.109 -7.912 -0.251
325 HD13 LEU 53 3HD1 LEU 53 -3.523 -6.269 0.103
326 HD21 LEU 53 3HD2 LEU 53 -6.162 -4.570 -1.943
327 HD22 LEU 53 1HD2 LEU 53 -6.257 -4.878 -0.193
328 HD23 LEU 53 2HD2 LEU 53 -4.741 -4.277 -0.911
329 H ASP 54 H ASP 54 -4.634 -9.787 -1.586
330 HA ASP 54 HA ASP 54 -6.318 -11.387 -1.746
331 HB2 ASP 54 1HB ASP 54 -7.636 -9.031 -1.465
332 HB3 ASP 54 2HB ASP 54 -7.932 -9.423 -3.178
333 H GLY 55 H GLY 55 -4.444 -11.133 -3.961
334 HA2 GLY 55 1HA GLY 55 -4.165 -12.494 -5.835
335 HA3 GLY 55 2HA GLY 55 -5.879 -12.960 -5.726
336 H VAL 56 H VAL 56 -5.521 -9.608 -5.585
337 HA VAL 56 HA VAL 56 -6.152 -9.343 -8.522
338 HB VAL 56 HB VAL 56 -6.921 -7.522 -6.203
339 HG11 VAL 56 1HG1 VAL 56 -8.296 -6.375 -7.908
340 HG12 VAL 56 2HG1 VAL 56 -6.571 -6.334 -8.344
341 HG13 VAL 56 3HG1 VAL 56 -7.667 -7.477 -9.157
342 HG21 VAL 56 3HG2 VAL 56 -8.157 -9.603 -6.105
343 HG22 VAL 56 1HG2 VAL 56 -9.212 -8.265 -6.615
344 HG23 VAL 56 2HG2 VAL 56 -8.616 -9.434 -7.817
345 H ARG 57 H ARG 57 -4.988 -8.183 -9.804
346 HA ARG 57 HA ARG 57 -2.507 -7.021 -8.655
347 HB2 ARG 57 1HB ARG 57 -3.286 -7.590 -11.480
348 HB3 ARG 57 2HB ARG 57 -1.763 -6.838 -10.951
349 HG2 ARG 57 1HG ARG 57 -1.143 -8.851 -9.742
350 HG3 ARG 57 2HG ARG 57 -2.705 -9.606 -10.143
351 HD2 ARG 57 1HD ARG 57 -2.106 -9.579 -12.490
352 HD3 ARG 57 2HD ARG 57 -0.540 -8.842 -12.077
353 HE ARG 57 HE ARG 57 -0.651 -11.377 -10.712
354 HH11 ARG 57 1HH1 ARG 57 -0.659 -10.244 -14.010
355 HH12 ARG 57 2HH1 ARG 57 0.142 -11.715 -14.524
356 HH21 ARG 57 1HH2 ARG 57 0.259 -13.071 -11.286
357 HH22 ARG 57 2HH2 ARG 57 0.666 -13.329 -12.972
358 H TYR 58 H TYR 58 -2.182 -4.977 -8.322
359 HA TYR 58 HA TYR 58 -3.883 -3.013 -9.829
360 HB2 TYR 58 1HB TYR 58 -2.640 -2.741 -7.084
361 HB3 TYR 58 2HB TYR 58 -3.593 -1.505 -7.942
362 HD1 TYR 58 HD2 TYR 58 -6.031 -1.843 -8.282
363 HD2 TYR 58 HD1 TYR 58 -3.723 -4.551 -5.933
364 HE1 TYR 58 HE2 TYR 58 -8.112 -2.756 -7.310
365 HE2 TYR 58 HE1 TYR 58 -5.799 -5.478 -4.948
366 HH TYR 58 HH TYR 58 -9.024 -4.257 -5.861
367 H ASN 59 H ASN 59 -2.769 -2.208 -11.427
368 HA ASN 59 HA ASN 59 0.161 -1.733 -11.015
369 HB2 ASN 59 1HB ASN 59 -0.577 -3.259 -13.099
370 HB3 ASN 59 2HB ASN 59 -1.429 -1.722 -13.385
371 HD21 ASN 59 2HD2 ASN 59 1.878 -2.630 -12.444
372 HD22 ASN 59 1HD2 ASN 59 2.671 -1.707 -13.676
373 H SER 60 H SER 60 1.054 0.190 -11.151
374 HA SER 60 HA SER 60 -0.605 2.587 -10.938
375 HB2 SER 60 1HB SER 60 1.324 3.765 -10.693
376 HB3 SER 60 2HB SER 60 1.441 2.259 -9.753
377 HG SER 60 HG SER 60 2.614 2.742 -12.292
378 H LEU 61 H LEU 61 -0.202 4.498 -12.307
379 HA LEU 61 HA LEU 61 -0.763 3.871 -15.083
380 HB2 LEU 61 1HB LEU 61 -0.103 6.339 -13.617
381 HB3 LEU 61 2HB LEU 61 -0.645 6.440 -15.309
382 HG LEU 61 HG LEU 61 -2.262 5.410 -12.945
383 HD11 LEU 61 1HD1 LEU 61 -3.701 7.415 -13.397
384 HD12 LEU 61 2HD1 LEU 61 -2.033 7.892 -13.002
385 HD13 LEU 61 3HD1 LEU 61 -2.585 7.904 -14.694
386 HD21 LEU 61 3HD2 LEU 61 -2.776 4.172 -14.966
387 HD22 LEU 61 1HD2 LEU 61 -4.134 5.244 -14.550
388 HD23 LEU 61 2HD2 LEU 61 -3.021 5.687 -15.867
389 HA PRO 62 HA PRO 62 3.225 4.031 -16.697
390 HB2 PRO 62 1HB PRO 62 2.626 4.304 -19.103
391 HB3 PRO 62 2HB PRO 62 2.265 2.950 -18.273
392 HG2 PRO 62 1HG PRO 62 0.610 4.824 -19.006
393 HG3 PRO 62 2HG PRO 62 0.327 3.218 -19.023
394 HD2 PRO 62 1HD PRO 62 -0.578 4.360 -17.051
395 HD3 PRO 62 2HD PRO 62 0.135 2.909 -16.829
396 H GLY 63 H GLY 63 4.785 5.344 -17.890
397 HA2 GLY 63 1HA GLY 63 5.384 7.389 -18.950
398 HA3 GLY 63 2HA GLY 63 3.839 8.103 -18.429
399 H PHE 64 H PHE 64 5.169 6.370 -15.892
400 HA PHE 64 HA PHE 64 5.969 8.847 -14.502
401 HB2 PHE 64 1HB PHE 64 5.737 5.937 -13.633
402 HB3 PHE 64 2HB PHE 64 6.318 7.238 -12.570
403 HD1 PHE 64 HD1 PHE 64 4.261 9.226 -14.020
404 HD2 PHE 64 HD2 PHE 64 3.998 5.481 -11.981
405 HE1 PHE 64 HE1 PHE 64 1.931 9.742 -13.374
406 HE2 PHE 64 HE2 PHE 64 1.667 5.993 -11.336
407 HZ PHE 64 HZ PHE 64 0.634 8.126 -12.033
408 H PHE 65 H PHE 65 7.927 9.456 -13.851
409 HA PHE 65 HA PHE 65 10.213 7.898 -15.013
410 HB2 PHE 65 1HB PHE 65 9.970 10.882 -14.425
411 HB3 PHE 65 2HB PHE 65 11.415 10.066 -15.067
412 HD1 PHE 65 HD2 PHE 65 11.247 8.916 -17.303
413 HD2 PHE 65 HD1 PHE 65 8.300 11.637 -15.832
414 HE1 PHE 65 HE2 PHE 65 10.426 9.269 -19.608
415 HE2 PHE 65 HE1 PHE 65 7.474 11.991 -18.136
416 HZ PHE 65 HZ PHE 65 8.538 10.807 -20.024
417 H ASN 66 H ASN 66 8.776 7.794 -12.292
418 HA ASN 66 HA ASN 66 11.236 7.272 -10.809
419 HB2 ASN 66 1HB ASN 66 10.627 9.953 -10.411
420 HB3 ASN 66 2HB ASN 66 9.346 9.003 -9.620
421 HD21 ASN 66 2HD2 ASN 66 10.254 10.335 -7.808
422 HD22 ASN 66 1HD2 ASN 66 11.525 9.618 -6.874
423 H ARG 67 H ARG 67 10.957 6.052 -8.971
424 HA ARG 67 HA ARG 67 8.646 4.317 -9.071
425 HB2 ARG 67 1HB ARG 67 10.864 4.546 -7.092
426 HB3 ARG 67 2HB ARG 67 9.551 3.348 -7.013
427 HG2 ARG 67 1HG ARG 67 10.244 2.381 -9.124
428 HG3 ARG 67 2HG ARG 67 11.481 3.645 -9.332
429 HD2 ARG 67 1HD ARG 67 12.638 2.804 -7.365
430 HD3 ARG 67 2HD ARG 67 11.421 1.513 -7.221
431 HE ARG 67 HE ARG 67 12.638 1.180 -9.799
432 HH11 ARG 67 1HH1 ARG 67 13.706 1.143 -6.480
433 HH12 ARG 67 2HH1 ARG 67 14.959 -0.011 -6.890
434 HH21 ARG 67 1HH2 ARG 67 14.075 -0.134 -10.287
435 HH22 ARG 67 2HH2 ARG 67 15.172 -0.739 -9.061
436 H LYS 68 H LYS 68 9.548 7.065 -7.051
437 HA LYS 68 HA LYS 68 7.568 6.774 -5.033
438 HB2 LYS 68 1HB LYS 68 9.415 8.388 -4.971
439 HB3 LYS 68 2HB LYS 68 8.648 9.301 -6.292
440 HG2 LYS 68 1HG LYS 68 6.732 9.811 -4.866
441 HG3 LYS 68 2HG LYS 68 7.427 8.832 -3.551
442 HD2 LYS 68 1HD LYS 68 9.353 10.349 -3.424
443 HD3 LYS 68 2HD LYS 68 8.688 11.317 -4.762
444 HE2 LYS 68 1HE LYS 68 6.704 11.829 -3.401
445 HE3 LYS 68 2HE LYS 68 7.374 10.868 -2.063
446 HZ1 LYS 68 3HZ LYS 68 8.594 13.298 -3.209
447 HZ2 LYS 68 1HZ LYS 68 7.792 13.215 -1.770
448 HZ3 LYS 68 2HZ LYS 68 9.217 12.406 -1.967
449 H ALA 69 H ALA 69 7.351 8.224 -8.264
450 HA ALA 69 HA ALA 69 4.679 9.212 -7.933
451 HB1 ALA 69 3HB ALA 69 6.156 8.390 -10.455
452 HB2 ALA 69 1HB ALA 69 4.658 9.347 -10.393
453 HB3 ALA 69 2HB ALA 69 6.165 10.008 -9.715
454 H ALA 70 H ALA 70 5.972 6.130 -9.134
455 HA ALA 70 HA ALA 70 3.452 5.003 -9.874
456 HB1 ALA 70 3HB ALA 70 5.979 3.630 -8.894
457 HB2 ALA 70 1HB ALA 70 4.614 2.836 -9.713
458 HB3 ALA 70 2HB ALA 70 5.595 4.040 -10.583
459 H GLU 71 H GLU 71 5.173 5.162 -6.790
460 HA GLU 71 HA GLU 71 3.368 3.374 -5.390
461 HB2 GLU 71 1HB GLU 71 5.288 5.512 -4.465
462 HB3 GLU 71 2HB GLU 71 4.347 4.477 -3.364
463 HG2 GLU 71 1HG GLU 71 6.512 3.513 -5.329
464 HG3 GLU 71 2HG GLU 71 6.551 3.672 -3.557
465 H GLN 72 H GLN 72 3.471 6.874 -5.901
466 HA GLN 72 HA GLN 72 1.265 7.478 -4.144
467 HB2 GLN 72 1HB GLN 72 2.423 8.862 -6.568
468 HB3 GLN 72 2HB GLN 72 1.075 9.524 -5.614
469 HG2 GLN 72 1HG GLN 72 2.791 9.607 -3.534
470 HG3 GLN 72 2HG GLN 72 3.756 8.814 -4.800
471 HE21 GLN 72 2HE2 GLN 72 4.483 11.174 -3.352
472 HE22 GLN 72 1HE2 GLN 72 4.596 12.474 -4.492
473 H SER 73 H SER 73 1.451 6.664 -7.595
474 HA SER 73 HA SER 73 -1.328 6.964 -8.279
475 HB2 SER 73 1HB SER 73 0.345 6.766 -9.890
476 HB3 SER 73 2HB SER 73 0.702 5.106 -9.364
477 HG SER 73 HG SER 73 -1.781 6.048 -10.365
478 H ALA 74 H ALA 74 0.539 4.108 -7.146
479 HA ALA 74 HA ALA 74 -1.678 2.323 -7.071
480 HB1 ALA 74 3HB ALA 74 0.868 2.306 -5.415
481 HB2 ALA 74 1HB ALA 74 -0.252 0.939 -5.613
482 HB3 ALA 74 2HB ALA 74 0.653 1.558 -7.015
483 H ALA 75 H ALA 75 -0.403 4.583 -4.668
484 HA ALA 75 HA ALA 75 -2.067 3.743 -2.502
485 HB1 ALA 75 3HB ALA 75 -0.934 6.491 -3.124
486 HB2 ALA 75 1HB ALA 75 -1.605 5.974 -1.561
487 HB3 ALA 75 2HB ALA 75 -0.126 5.211 -2.190
488 H GLU 76 H GLU 76 -2.572 6.128 -5.090
489 HA GLU 76 HA GLU 76 -5.168 6.991 -4.190
490 HB2 GLU 76 1HB GLU 76 -3.849 6.928 -6.904
491 HB3 GLU 76 2HB GLU 76 -5.457 7.630 -6.605
492 HG2 GLU 76 1HG GLU 76 -4.411 9.324 -5.052
493 HG3 GLU 76 2HG GLU 76 -2.887 8.449 -5.318
494 H VAL 77 H VAL 77 -4.117 4.336 -6.287
495 HA VAL 77 HA VAL 77 -6.775 3.417 -6.986
496 HB VAL 77 HB VAL 77 -4.121 1.940 -6.741
497 HG11 VAL 77 1HG1 VAL 77 -5.229 0.149 -8.034
498 HG12 VAL 77 2HG1 VAL 77 -6.034 0.398 -6.467
499 HG13 VAL 77 3HG1 VAL 77 -6.766 1.043 -7.957
500 HG21 VAL 77 3HG2 VAL 77 -4.118 3.653 -8.454
501 HG22 VAL 77 1HG2 VAL 77 -4.122 2.031 -9.182
502 HG23 VAL 77 2HG2 VAL 77 -5.619 2.992 -9.145
503 H ALA 78 H ALA 78 -4.631 2.658 -4.263
504 HA ALA 78 HA ALA 78 -6.367 0.717 -3.088
505 HB1 ALA 78 3HB ALA 78 -4.387 2.600 -1.763
506 HB2 ALA 78 1HB ALA 78 -5.112 1.158 -1.015
507 HB3 ALA 78 2HB ALA 78 -4.024 0.984 -2.412
508 H LEU 79 H LEU 79 -6.204 4.247 -2.779
509 HA LEU 79 HA LEU 79 -8.288 4.470 -0.804
510 HB2 LEU 79 1HB LEU 79 -7.259 6.196 -2.950
511 HB3 LEU 79 2HB LEU 79 -8.469 6.864 -1.832
512 HG LEU 79 HG LEU 79 -5.696 5.854 -1.085
513 HD11 LEU 79 1HD1 LEU 79 -5.233 8.265 -0.567
514 HD12 LEU 79 2HD1 LEU 79 -5.654 8.041 -2.281
515 HD13 LEU 79 3HD1 LEU 79 -6.863 8.686 -1.144
516 HD21 LEU 79 3HD2 LEU 79 -7.311 5.441 0.677
517 HD22 LEU 79 1HD2 LEU 79 -6.205 6.750 1.161
518 HD23 LEU 79 2HD2 LEU 79 -7.856 7.135 0.614
519 H ARG 80 H ARG 80 -8.333 4.339 -4.342
520 HA ARG 80 HA ARG 80 -11.167 4.794 -4.609
521 HB2 ARG 80 1HB ARG 80 -9.171 3.482 -6.388
522 HB3 ARG 80 2HB ARG 80 -10.901 3.626 -6.778
523 HG2 ARG 80 1HG ARG 80 -10.751 6.055 -6.693
524 HG3 ARG 80 2HG ARG 80 -9.043 5.953 -6.202
525 HD2 ARG 80 1HD ARG 80 -8.489 4.959 -8.333
526 HD3 ARG 80 2HD ARG 80 -10.197 5.055 -8.823
527 HE ARG 80 HE ARG 80 -9.340 7.753 -8.308
528 HH11 ARG 80 1HH1 ARG 80 -8.483 5.185 -10.506
529 HH12 ARG 80 2HH1 ARG 80 -8.031 6.367 -11.720
530 HH21 ARG 80 1HH2 ARG 80 -8.819 9.118 -9.684
531 HH22 ARG 80 2HH2 ARG 80 -8.221 8.610 -11.251
532 H GLU 81 H GLU 81 -9.230 1.889 -4.049
533 HA GLU 81 HA GLU 81 -11.560 0.118 -4.143
534 HB2 GLU 81 1HB GLU 81 -8.758 -0.216 -3.063
535 HB3 GLU 81 2HB GLU 81 -9.992 -1.499 -3.086
536 HG2 GLU 81 1HG GLU 81 -8.772 -0.160 -5.576
537 HG3 GLU 81 2HG GLU 81 -8.443 -1.756 -4.864
538 H LEU 82 H LEU 82 -9.939 2.047 -1.718
539 HA LEU 82 HA LEU 82 -11.151 0.774 0.573
540 HB2 LEU 82 1HB LEU 82 -9.246 2.081 0.680
541 HB3 LEU 82 2HB LEU 82 -10.026 3.602 0.187
542 HG LEU 82 HG LEU 82 -11.485 3.423 2.230
543 HD11 LEU 82 1HD1 LEU 82 -10.694 1.906 4.065
544 HD12 LEU 82 2HD1 LEU 82 -11.186 0.980 2.626
545 HD13 LEU 82 3HD1 LEU 82 -9.459 1.247 2.967
546 HD21 LEU 82 3HD2 LEU 82 -9.570 4.909 2.182
547 HD22 LEU 82 1HD2 LEU 82 -9.745 4.199 3.804
548 HD23 LEU 82 2HD2 LEU 82 -8.494 3.587 2.695
549 H ALA 83 H ALA 83 -12.145 3.431 -1.543
550 HA ALA 83 HA ALA 83 -14.410 4.208 0.035
551 HB1 ALA 83 3HB ALA 83 -13.922 4.493 -2.949
552 HB2 ALA 83 1HB ALA 83 -15.171 5.345 -2.014
553 HB3 ALA 83 2HB ALA 83 -13.449 5.660 -1.692
554 H LYS 84 H LYS 84 -13.815 1.449 -1.879
555 HA LYS 84 HA LYS 84 -16.648 0.980 -2.556
556 HB2 LYS 84 1HB LYS 84 -14.149 -0.690 -2.860
557 HB3 LYS 84 2HB LYS 84 -15.773 -1.191 -3.391
558 HG2 LYS 84 1HG LYS 84 -15.860 0.675 -4.969
559 HG3 LYS 84 2HG LYS 84 -14.268 1.242 -4.410
560 HD2 LYS 84 1HD LYS 84 -13.233 -0.837 -5.191
561 HD3 LYS 84 2HD LYS 84 -14.823 -1.447 -5.709
562 HE2 LYS 84 1HE LYS 84 -15.020 0.409 -7.304
563 HE3 LYS 84 2HE LYS 84 -13.438 1.032 -6.782
564 HZ1 LYS 84 3HZ LYS 84 -13.914 -1.583 -8.062
565 HZ2 LYS 84 1HZ LYS 84 -13.265 -0.258 -8.800
566 HZ3 LYS 84 2HZ LYS 84 -12.446 -1.007 -7.577
567 H SER 85 H SER 85 -14.567 0.398 0.090
568 HA SER 85 HA SER 85 -15.815 -2.035 1.145
569 HB2 SER 85 1HB SER 85 -14.624 -1.672 3.056
570 HB3 SER 85 2HB SER 85 -13.584 -1.380 1.643
571 HG SER 85 HG SER 85 -13.329 0.204 3.277
572 H SER 86 H SER 86 -16.646 1.351 1.053
573 HA SER 86 HA SER 86 -18.199 1.643 3.464
574 HB2 SER 86 1HB SER 86 -17.460 3.482 2.256
575 HB3 SER 86 2HB SER 86 -18.440 3.006 0.850
576 HG SER 86 HG SER 86 -19.420 3.636 3.438
Start of MODEL 7
1 H PHE 16 H PHE 16 -0.091 9.244 0.918
2 HA PHE 16 HA PHE 16 -2.199 6.961 0.905
3 HB2 PHE 16 1HB PHE 16 -0.692 7.765 -1.618
4 HB3 PHE 16 2HB PHE 16 -1.825 6.399 -1.523
5 HD1 PHE 16 HD2 PHE 16 -4.216 6.825 -1.022
6 HD2 PHE 16 HD1 PHE 16 -1.442 9.961 -1.874
7 HE1 PHE 16 HE2 PHE 16 -6.096 8.345 -1.538
8 HE2 PHE 16 HE1 PHE 16 -3.320 11.484 -2.388
9 HZ PHE 16 HZ PHE 16 -5.647 10.676 -2.219
10 H LYS 17 H LYS 17 1.248 7.395 0.654
11 HA LYS 17 HA LYS 17 2.045 4.703 0.206
12 HB2 LYS 17 1HB LYS 17 3.541 6.663 0.199
13 HB3 LYS 17 2HB LYS 17 3.346 6.789 1.964
14 HG2 LYS 17 1HG LYS 17 4.407 4.613 2.269
15 HG3 LYS 17 2HG LYS 17 4.535 4.405 0.506
16 HD2 LYS 17 1HD LYS 17 6.017 6.351 0.365
17 HD3 LYS 17 2HD LYS 17 5.863 6.610 2.118
18 HE2 LYS 17 1HE LYS 17 6.895 4.434 2.549
19 HE3 LYS 17 2HE LYS 17 7.011 4.130 0.800
20 HZ1 LYS 17 3HZ LYS 17 8.378 6.300 2.256
21 HZ2 LYS 17 1HZ LYS 17 9.091 4.919 1.705
22 HZ3 LYS 17 2HZ LYS 17 8.486 6.019 0.635
23 H SER 18 H SER 18 1.731 2.917 1.247
24 HA SER 18 HA SER 18 1.624 1.410 3.107
25 HB2 SER 18 1HB SER 18 2.303 3.781 4.739
26 HB3 SER 18 2HB SER 18 2.294 2.069 5.221
27 HG SER 18 HG SER 18 3.897 1.717 3.618
28 H ARG 19 H ARG 19 -0.431 3.941 2.399
29 HA ARG 19 HA ARG 19 -2.293 3.737 4.620
30 HB2 ARG 19 1HB ARG 19 -2.214 5.664 3.191
31 HB3 ARG 19 2HB ARG 19 -2.769 4.669 1.824
32 HG2 ARG 19 1HG ARG 19 -4.887 4.254 2.923
33 HG3 ARG 19 2HG ARG 19 -4.333 5.108 4.384
34 HD2 ARG 19 1HD ARG 19 -4.234 7.175 3.139
35 HD3 ARG 19 2HD ARG 19 -4.781 6.322 1.676
36 HE ARG 19 HE ARG 19 -6.827 6.061 3.733
37 HH11 ARG 19 1HH1 ARG 19 -5.442 8.487 1.648
38 HH12 ARG 19 2HH1 ARG 19 -6.968 9.349 1.627
39 HH21 ARG 19 1HH2 ARG 19 -8.579 7.040 3.726
40 HH22 ARG 19 2HH2 ARG 19 -8.757 8.525 2.812
41 H LEU 20 H LEU 20 -2.090 2.192 1.419
42 HA LEU 20 HA LEU 20 -4.415 0.571 1.651
43 HB2 LEU 20 1HB LEU 20 -3.038 0.959 -0.259
44 HB3 LEU 20 2HB LEU 20 -1.768 -0.160 0.287
45 HG LEU 20 HG LEU 20 -3.624 -1.937 0.387
46 HD11 LEU 20 1HD1 LEU 20 -5.550 -1.524 -1.165
47 HD12 LEU 20 2HD1 LEU 20 -5.541 -0.358 0.179
48 HD13 LEU 20 3HD1 LEU 20 -4.961 0.134 -1.431
49 HD21 LEU 20 3HD2 LEU 20 -1.857 -1.961 -1.275
50 HD22 LEU 20 1HD2 LEU 20 -3.397 -2.456 -2.018
51 HD23 LEU 20 2HD2 LEU 20 -2.762 -0.816 -2.294
52 H GLN 21 H GLN 21 -1.176 0.154 2.987
53 HA GLN 21 HA GLN 21 -1.638 -2.554 3.910
54 HB2 GLN 21 1HB GLN 21 0.309 -0.400 4.752
55 HB3 GLN 21 2HB GLN 21 0.317 -2.061 5.391
56 HG2 GLN 21 1HG GLN 21 0.852 -2.860 2.870
57 HG3 GLN 21 2HG GLN 21 0.609 -1.109 2.676
58 HE21 GLN 21 2HE2 GLN 21 2.921 -2.572 1.860
59 HE22 GLN 21 1HE2 GLN 21 4.265 -1.995 2.788
60 H GLU 22 H GLU 22 -1.916 0.644 5.435
61 HA GLU 22 HA GLU 22 -2.658 -0.224 8.035
62 HB2 GLU 22 1HB GLU 22 -2.165 2.094 7.444
63 HB3 GLU 22 2HB GLU 22 -3.641 2.155 6.451
64 HG2 GLU 22 1HG GLU 22 -5.018 1.812 8.566
65 HG3 GLU 22 2HG GLU 22 -3.452 1.733 9.404
66 H TYR 23 H TYR 23 -4.772 0.487 5.242
67 HA TYR 23 HA TYR 23 -7.184 -0.308 6.614
68 HB2 TYR 23 1HB TYR 23 -6.473 -0.056 3.688
69 HB3 TYR 23 2HB TYR 23 -8.102 -0.455 4.287
70 HD1 TYR 23 HD1 TYR 23 -6.680 1.679 6.642
71 HD2 TYR 23 HD2 TYR 23 -8.350 1.752 2.719
72 HE1 TYR 23 HE1 TYR 23 -7.173 4.093 6.906
73 HE2 TYR 23 HE2 TYR 23 -8.850 4.160 2.965
74 HH TYR 23 HH TYR 23 -8.043 5.958 5.946
75 H ALA 24 H ALA 24 -4.874 -2.040 4.569
76 HA ALA 24 HA ALA 24 -6.309 -4.453 4.276
77 HB1 ALA 24 3HB ALA 24 -3.320 -4.056 4.647
78 HB2 ALA 24 1HB ALA 24 -4.103 -5.519 4.005
79 HB3 ALA 24 2HB ALA 24 -4.203 -3.988 3.104
80 H GLN 25 H GLN 25 -4.188 -3.396 6.935
81 HA GLN 25 HA GLN 25 -4.517 -5.799 8.495
82 HB2 GLN 25 1HB GLN 25 -3.818 -2.951 9.226
83 HB3 GLN 25 2HB GLN 25 -3.832 -4.297 10.390
84 HG2 GLN 25 1HG GLN 25 -1.872 -5.402 8.907
85 HG3 GLN 25 2HG GLN 25 -2.314 -3.968 7.953
86 HE21 GLN 25 2HE2 GLN 25 0.308 -4.599 8.870
87 HE22 GLN 25 1HE2 GLN 25 0.794 -3.362 9.982
88 H LYS 26 H LYS 26 -6.304 -2.744 8.351
89 HA LYS 26 HA LYS 26 -8.000 -3.346 10.618
90 HB2 LYS 26 1HB LYS 26 -8.304 -1.484 8.261
91 HB3 LYS 26 2HB LYS 26 -9.462 -1.584 9.609
92 HG2 LYS 26 1HG LYS 26 -7.719 -0.891 11.185
93 HG3 LYS 26 2HG LYS 26 -6.528 -0.839 9.863
94 HD2 LYS 26 1HD LYS 26 -7.817 0.928 8.752
95 HD3 LYS 26 2HD LYS 26 -9.039 0.862 10.044
96 HE2 LYS 26 1HE LYS 26 -7.341 1.526 11.689
97 HE3 LYS 26 2HE LYS 26 -6.115 1.588 10.402
98 HZ1 LYS 26 3HZ LYS 26 -8.527 3.279 10.554
99 HZ2 LYS 26 1HZ LYS 26 -6.990 3.767 10.901
100 HZ3 LYS 26 2HZ LYS 26 -7.391 3.336 9.359
101 H TYR 27 H TYR 27 -8.065 -4.235 7.245
102 HA TYR 27 HA TYR 27 -10.914 -5.109 7.513
103 HB2 TYR 27 1HB TYR 27 -9.159 -4.720 5.080
104 HB3 TYR 27 2HB TYR 27 -10.852 -5.269 5.064
105 HD1 TYR 27 HD1 TYR 27 -11.226 -3.173 7.576
106 HD2 TYR 27 HD2 TYR 27 -10.059 -2.915 3.483
107 HE1 TYR 27 HE1 TYR 27 -11.990 -0.816 7.515
108 HE2 TYR 27 HE2 TYR 27 -10.816 -0.564 3.403
109 HH TYR 27 HH TYR 27 -11.742 1.166 4.560
110 H LYS 28 H LYS 28 -8.156 -6.421 8.290
111 HA LYS 28 HA LYS 28 -7.316 -8.590 8.344
112 HB2 LYS 28 1HB LYS 28 -10.203 -9.262 7.755
113 HB3 LYS 28 2HB LYS 28 -8.963 -10.385 8.362
114 HG2 LYS 28 1HG LYS 28 -8.771 -9.044 10.426
115 HG3 LYS 28 2HG LYS 28 -10.030 -7.942 9.820
116 HD2 LYS 28 1HD LYS 28 -11.616 -9.849 9.726
117 HD3 LYS 28 2HD LYS 28 -10.357 -10.903 10.412
118 HE2 LYS 28 1HE LYS 28 -10.284 -9.553 12.437
119 HE3 LYS 28 2HE LYS 28 -11.465 -8.416 11.749
120 HZ1 LYS 28 3HZ LYS 28 -11.974 -11.257 12.357
121 HZ2 LYS 28 1HZ LYS 28 -12.502 -9.975 13.251
122 HZ3 LYS 28 2HZ LYS 28 -13.070 -10.202 11.719
123 H LEU 29 H LEU 29 -7.035 -7.235 5.892
124 HA LEU 29 HA LEU 29 -7.430 -9.406 3.883
125 HB2 LEU 29 1HB LEU 29 -6.484 -6.619 3.706
126 HB3 LEU 29 2HB LEU 29 -6.714 -7.599 2.239
127 HG LEU 29 HG LEU 29 -8.872 -6.648 4.161
128 HD11 LEU 29 1HD1 LEU 29 -9.695 -5.373 2.163
129 HD12 LEU 29 2HD1 LEU 29 -8.038 -4.894 2.598
130 HD13 LEU 29 3HD1 LEU 29 -8.317 -5.987 1.222
131 HD21 LEU 29 3HD2 LEU 29 -9.371 -8.881 3.357
132 HD22 LEU 29 1HD2 LEU 29 -10.472 -7.703 2.602
133 HD23 LEU 29 2HD2 LEU 29 -9.105 -8.366 1.675
134 HA PRO 30 HA PRO 30 -3.346 -10.733 3.832
135 HB2 PRO 30 1HB PRO 30 -3.663 -10.625 1.125
136 HB3 PRO 30 2HB PRO 30 -3.241 -11.865 2.093
137 HG2 PRO 30 1HG PRO 30 -5.660 -11.096 1.498
138 HG3 PRO 30 2HG PRO 30 -5.136 -12.636 1.636
139 HD2 PRO 30 1HD PRO 30 -6.476 -9.618 1.921
140 HD3 PRO 30 2HD PRO 30 -6.394 -11.078 2.644
141 H THR 31 H THR 31 -1.197 -10.080 3.555
142 HA THR 31 HA THR 31 -0.840 -7.240 3.356
143 HB THR 31 HB THR 31 1.230 -9.450 3.006
144 HG1 THR 31 HG1 THR 31 0.399 -7.997 5.327
145 HG21 THR 31 1HG2 THR 31 2.832 -7.703 3.700
146 HG22 THR 31 2HG2 THR 31 1.987 -7.238 2.205
147 HG23 THR 31 3HG2 THR 31 1.511 -6.513 3.757
148 HA PRO 32 HA PRO 32 -1.065 -6.749 -0.900
149 HB2 PRO 32 1HB PRO 32 -0.235 -4.362 -0.905
150 HB3 PRO 32 2HB PRO 32 -1.720 -4.800 -0.394
151 HG2 PRO 32 1HG PRO 32 0.313 -4.130 1.093
152 HG3 PRO 32 2HG PRO 32 -1.247 -3.723 1.340
153 HD2 PRO 32 1HD PRO 32 -0.213 -5.562 2.643
154 HD3 PRO 32 2HD PRO 32 -1.757 -5.647 2.122
155 H VAL 33 H VAL 33 0.188 -6.959 -2.703
156 HA VAL 33 HA VAL 33 3.156 -6.854 -2.168
157 HB VAL 33 HB VAL 33 1.601 -8.547 -4.169
158 HG11 VAL 33 1HG1 VAL 33 3.802 -9.578 -4.624
159 HG12 VAL 33 2HG1 VAL 33 3.820 -7.839 -4.998
160 HG13 VAL 33 3HG1 VAL 33 4.570 -8.435 -3.498
161 HG21 VAL 33 3HG2 VAL 33 1.300 -9.357 -1.906
162 HG22 VAL 33 1HG2 VAL 33 2.345 -10.455 -2.837
163 HG23 VAL 33 2HG2 VAL 33 3.061 -9.343 -1.647
164 H TYR 34 H TYR 34 4.389 -5.561 -3.226
165 HA TYR 34 HA TYR 34 3.138 -4.030 -5.482
166 HB2 TYR 34 1HB TYR 34 5.300 -3.276 -3.507
167 HB3 TYR 34 2HB TYR 34 4.832 -2.302 -4.922
168 HD1 TYR 34 HD1 TYR 34 3.561 -3.699 -1.707
169 HD2 TYR 34 HD2 TYR 34 2.979 -0.829 -4.808
170 HE1 TYR 34 HE1 TYR 34 1.780 -2.621 -0.364
171 HE2 TYR 34 HE2 TYR 34 1.200 0.258 -3.481
172 HH TYR 34 HH TYR 34 0.248 -0.948 -0.256
173 H GLU 35 H GLU 35 3.824 -4.433 -7.415
174 HA GLU 35 HA GLU 35 6.659 -5.364 -7.747
175 HB2 GLU 35 1HB GLU 35 4.202 -5.912 -9.419
176 HB3 GLU 35 2HB GLU 35 5.867 -6.357 -9.871
177 HG2 GLU 35 1HG GLU 35 5.943 -7.839 -7.767
178 HG3 GLU 35 2HG GLU 35 4.258 -7.317 -7.543
179 H ILE 36 H ILE 36 7.994 -4.336 -9.055
180 HA ILE 36 HA ILE 36 6.902 -1.902 -10.448
181 HB ILE 36 HB ILE 36 9.680 -2.347 -9.259
182 HG12 ILE 36 1HG1 ILE 36 8.009 -2.123 -7.538
183 HG13 ILE 36 2HG1 ILE 36 9.110 -0.728 -7.601
184 HG21 ILE 36 1HG2 ILE 36 10.004 0.046 -9.783
185 HG22 ILE 36 2HG2 ILE 36 9.661 -0.890 -11.256
186 HG23 ILE 36 3HG2 ILE 36 8.385 0.106 -10.519
187 HD11 ILE 36 3HD1 ILE 36 6.282 -0.812 -8.710
188 HD12 ILE 36 1HD1 ILE 36 6.786 -0.011 -7.205
189 HD13 ILE 36 2HD1 ILE 36 7.383 0.583 -8.774
190 H VAL 37 H VAL 37 7.040 -1.746 -12.501
191 HA VAL 37 HA VAL 37 8.978 -3.557 -13.938
192 HB VAL 37 HB VAL 37 6.312 -2.434 -14.900
193 HG11 VAL 37 1HG1 VAL 37 6.709 -3.878 -16.867
194 HG12 VAL 37 2HG1 VAL 37 7.998 -2.665 -16.693
195 HG13 VAL 37 3HG1 VAL 37 8.290 -4.350 -16.202
196 HG21 VAL 37 3HG2 VAL 37 5.979 -4.179 -13.251
197 HG22 VAL 37 1HG2 VAL 37 5.542 -4.753 -14.878
198 HG23 VAL 37 2HG2 VAL 37 7.081 -5.256 -14.141
199 H LYS 38 H LYS 38 10.540 -2.730 -15.004
200 HA LYS 38 HA LYS 38 10.402 0.197 -15.645
201 HB2 LYS 38 1HB LYS 38 12.194 -0.515 -14.112
202 HB3 LYS 38 2HB LYS 38 12.793 -1.631 -15.364
203 HG2 LYS 38 1HG LYS 38 13.218 0.305 -16.854
204 HG3 LYS 38 2HG LYS 38 12.681 1.398 -15.557
205 HD2 LYS 38 1HD LYS 38 14.488 0.569 -14.104
206 HD3 LYS 38 2HD LYS 38 15.025 -0.528 -15.399
207 HE2 LYS 38 1HE LYS 38 15.479 1.398 -16.852
208 HE3 LYS 38 2HE LYS 38 14.932 2.500 -15.566
209 HZ1 LYS 38 3HZ LYS 38 17.244 0.676 -15.393
210 HZ2 LYS 38 1HZ LYS 38 17.325 2.308 -15.616
211 HZ3 LYS 38 2HZ LYS 38 16.738 1.698 -14.200
212 H GLU 39 H GLU 39 10.054 0.751 -17.629
213 HA GLU 39 HA GLU 39 11.090 -1.020 -19.813
214 HB2 GLU 39 1HB GLU 39 8.376 0.299 -19.632
215 HB3 GLU 39 2HB GLU 39 9.046 -0.471 -21.091
216 HG2 GLU 39 1HG GLU 39 9.106 -2.687 -19.801
217 HG3 GLU 39 2HG GLU 39 8.405 -1.746 -18.465
218 H GLY 40 H GLY 40 11.249 0.036 -21.902
219 HA2 GLY 40 1HA GLY 40 11.285 2.032 -23.238
220 HA3 GLY 40 2HA GLY 40 11.396 3.005 -21.752
221 HA PRO 41 HA PRO 41 15.552 2.530 -23.671
222 HB2 PRO 41 1HB PRO 41 15.368 5.240 -23.478
223 HB3 PRO 41 2HB PRO 41 15.863 4.296 -24.712
224 HG2 PRO 41 1HG PRO 41 13.419 5.032 -24.187
225 HG3 PRO 41 2HG PRO 41 14.103 4.921 -25.663
226 HD2 PRO 41 1HD PRO 41 12.368 4.536 -22.935
227 HD3 PRO 41 2HD PRO 41 12.637 3.872 -24.401
228 H SER 42 H SER 42 17.627 2.804 -22.735
229 HA SER 42 HA SER 42 17.646 2.623 -19.856
230 HB2 SER 42 1HB SER 42 19.924 2.581 -19.974
231 HB3 SER 42 2HB SER 42 19.241 1.596 -21.287
232 HG SER 42 HG SER 42 20.986 2.908 -21.978
233 H HIS 43 H HIS 43 17.699 5.332 -22.073
234 HA HIS 43 HA HIS 43 18.563 7.158 -19.862
235 HB2 HIS 43 1HB HIS 43 18.509 7.585 -22.885
236 HB3 HIS 43 2HB HIS 43 18.987 8.808 -21.683
237 HD2 HIS 43 HD2 HIS 43 20.708 6.156 -23.882
238 HE1 HIS 43 HE1 HIS 43 23.272 6.987 -20.597
239 HE2 HIS 43 HE2 HIS 43 23.017 5.871 -22.963
240 H LYS 44 H LYS 44 15.876 6.150 -21.724
241 HA LYS 44 HA LYS 44 14.304 8.445 -20.604
242 HB2 LYS 44 1HB LYS 44 14.031 7.088 -23.288
243 HB3 LYS 44 2HB LYS 44 12.824 8.191 -22.586
244 HG2 LYS 44 1HG LYS 44 14.516 9.999 -22.564
245 HG3 LYS 44 2HG LYS 44 15.685 8.892 -23.323
246 HD2 LYS 44 1HD LYS 44 14.093 8.622 -25.238
247 HD3 LYS 44 2HD LYS 44 13.062 9.870 -24.497
248 HE2 LYS 44 1HE LYS 44 14.888 11.491 -24.639
249 HE3 LYS 44 2HE LYS 44 15.953 10.247 -25.333
250 HZ1 LYS 44 3HZ LYS 44 13.479 11.270 -26.572
251 HZ2 LYS 44 1HZ LYS 44 15.014 11.661 -27.032
252 HZ3 LYS 44 2HZ LYS 44 14.467 10.116 -27.216
253 H SER 45 H SER 45 14.710 6.112 -19.188
254 HA SER 45 HA SER 45 12.685 4.060 -19.736
255 HB2 SER 45 1HB SER 45 13.365 3.048 -17.809
256 HB3 SER 45 2HB SER 45 14.788 3.589 -18.730
257 HG SER 45 HG SER 45 14.909 5.372 -17.289
258 H LEU 46 H LEU 46 10.738 3.739 -18.747
259 HA LEU 46 HA LEU 46 9.921 5.681 -16.618
260 HB2 LEU 46 1HB LEU 46 8.366 4.495 -18.822
261 HB3 LEU 46 2HB LEU 46 7.550 5.454 -17.566
262 HG LEU 46 HG LEU 46 9.626 6.474 -19.543
263 HD11 LEU 46 1HD1 LEU 46 7.711 7.796 -20.481
264 HD12 LEU 46 2HD1 LEU 46 7.401 6.048 -20.583
265 HD13 LEU 46 3HD1 LEU 46 6.621 7.018 -19.311
266 HD21 LEU 46 3HD2 LEU 46 9.792 7.604 -17.405
267 HD22 LEU 46 1HD2 LEU 46 9.105 8.706 -18.621
268 HD23 LEU 46 2HD2 LEU 46 8.045 7.939 -17.412
269 H PHE 47 H PHE 47 8.671 4.938 -14.963
270 HA PHE 47 HA PHE 47 8.753 1.960 -14.651
271 HB2 PHE 47 1HB PHE 47 8.604 4.217 -12.606
272 HB3 PHE 47 2HB PHE 47 8.487 2.489 -12.205
273 HD1 PHE 47 HD2 PHE 47 10.416 1.015 -12.500
274 HD2 PHE 47 HD1 PHE 47 10.675 5.238 -13.090
275 HE1 PHE 47 HE2 PHE 47 12.877 0.886 -12.320
276 HE2 PHE 47 HE1 PHE 47 13.138 5.113 -12.914
277 HZ PHE 47 HZ PHE 47 14.239 2.936 -12.529
278 H GLN 48 H GLN 48 7.021 0.778 -13.989
279 HA GLN 48 HA GLN 48 4.487 2.223 -13.418
280 HB2 GLN 48 1HB GLN 48 4.513 1.593 -15.832
281 HB3 GLN 48 2HB GLN 48 4.696 -0.106 -15.336
282 HG2 GLN 48 1HG GLN 48 2.269 0.275 -14.085
283 HG3 GLN 48 2HG GLN 48 2.577 1.805 -14.939
284 HE21 GLN 48 2HE2 GLN 48 0.276 0.329 -15.396
285 HE22 GLN 48 1HE2 GLN 48 0.328 -0.339 -16.994
286 H SER 49 H SER 49 3.234 1.334 -11.905
287 HA SER 49 HA SER 49 4.504 -0.976 -10.413
288 HB2 SER 49 1HB SER 49 4.728 1.001 -9.259
289 HB3 SER 49 2HB SER 49 2.998 1.371 -9.434
290 HG SER 49 HG SER 49 4.102 -0.867 -8.085
291 H THR 50 H THR 50 3.324 -2.768 -10.100
292 HA THR 50 HA THR 50 0.334 -2.510 -10.183
293 HB THR 50 HB THR 50 2.035 -4.943 -10.878
294 HG1 THR 50 HG1 THR 50 0.199 -3.670 -12.611
295 HG21 THR 50 1HG2 THR 50 -0.128 -5.998 -11.437
296 HG22 THR 50 2HG2 THR 50 -0.065 -5.538 -9.718
297 HG23 THR 50 3HG2 THR 50 -0.984 -4.544 -10.872
298 H VAL 51 H VAL 51 -0.691 -2.828 -8.388
299 HA VAL 51 HA VAL 51 0.736 -4.288 -6.164
300 HB VAL 51 HB VAL 51 0.364 -1.876 -5.674
301 HG11 VAL 51 1HG1 VAL 51 -1.951 -1.048 -5.417
302 HG12 VAL 51 2HG1 VAL 51 -1.627 -1.533 -7.098
303 HG13 VAL 51 3HG1 VAL 51 -2.573 -2.598 -6.031
304 HG21 VAL 51 3HG2 VAL 51 0.358 -3.488 -3.866
305 HG22 VAL 51 1HG2 VAL 51 -0.804 -2.179 -3.549
306 HG23 VAL 51 2HG2 VAL 51 -1.384 -3.769 -4.097
307 H ILE 52 H ILE 52 -0.148 -5.906 -5.159
308 HA ILE 52 HA ILE 52 -2.889 -6.735 -6.089
309 HB ILE 52 HB ILE 52 -0.522 -8.501 -5.309
310 HG12 ILE 52 1HG1 ILE 52 -1.789 -8.078 -8.004
311 HG13 ILE 52 2HG1 ILE 52 -0.248 -7.372 -7.460
312 HG21 ILE 52 1HG2 ILE 52 -1.984 -10.352 -6.049
313 HG22 ILE 52 2HG2 ILE 52 -2.719 -9.456 -4.700
314 HG23 ILE 52 3HG2 ILE 52 -3.297 -9.192 -6.361
315 HD11 ILE 52 3HD1 ILE 52 -0.843 -10.339 -7.741
316 HD12 ILE 52 1HD1 ILE 52 0.130 -9.362 -8.863
317 HD13 ILE 52 2HD1 ILE 52 0.696 -9.632 -7.197
318 H LEU 53 H LEU 53 -4.394 -6.784 -4.688
319 HA LEU 53 HA LEU 53 -3.682 -7.455 -1.864
320 HB2 LEU 53 1HB LEU 53 -3.845 -5.181 -1.984
321 HB3 LEU 53 2HB LEU 53 -5.419 -5.114 -2.810
322 HG LEU 53 HG LEU 53 -6.385 -6.303 -0.773
323 HD11 LEU 53 1HD1 LEU 53 -5.077 -6.047 1.353
324 HD12 LEU 53 2HD1 LEU 53 -4.216 -7.074 0.184
325 HD13 LEU 53 3HD1 LEU 53 -3.718 -5.382 0.419
326 HD21 LEU 53 3HD2 LEU 53 -6.775 -3.950 -1.207
327 HD22 LEU 53 1HD2 LEU 53 -6.569 -4.219 0.540
328 HD23 LEU 53 2HD2 LEU 53 -5.240 -3.519 -0.416
329 H ASP 54 H ASP 54 -4.813 -9.006 -1.016
330 HA ASP 54 HA ASP 54 -6.402 -10.695 -0.840
331 HB2 ASP 54 1HB ASP 54 -7.845 -8.415 -0.540
332 HB3 ASP 54 2HB ASP 54 -8.317 -8.943 -2.174
333 H GLY 55 H GLY 55 -4.835 -10.472 -3.288
334 HA2 GLY 55 1HA GLY 55 -4.692 -12.002 -5.051
335 HA3 GLY 55 2HA GLY 55 -6.374 -12.495 -4.742
336 H VAL 56 H VAL 56 -6.279 -9.171 -4.833
337 HA VAL 56 HA VAL 56 -7.264 -9.156 -7.677
338 HB VAL 56 HB VAL 56 -7.706 -7.139 -5.436
339 HG11 VAL 56 1HG1 VAL 56 -9.383 -6.191 -6.986
340 HG12 VAL 56 2HG1 VAL 56 -7.756 -6.161 -7.706
341 HG13 VAL 56 3HG1 VAL 56 -8.931 -7.398 -8.213
342 HG21 VAL 56 3HG2 VAL 56 -8.835 -9.224 -4.937
343 HG22 VAL 56 1HG2 VAL 56 -10.006 -7.961 -5.385
344 HG23 VAL 56 2HG2 VAL 56 -9.576 -9.232 -6.556
345 H ARG 57 H ARG 57 -6.234 -8.244 -9.219
346 HA ARG 57 HA ARG 57 -3.709 -6.837 -8.567
347 HB2 ARG 57 1HB ARG 57 -4.825 -7.700 -11.198
348 HB3 ARG 57 2HB ARG 57 -3.251 -6.920 -10.918
349 HG2 ARG 57 1HG ARG 57 -2.480 -8.822 -9.638
350 HG3 ARG 57 2HG ARG 57 -4.085 -9.586 -9.736
351 HD2 ARG 57 1HD ARG 57 -3.828 -9.822 -12.125
352 HD3 ARG 57 2HD ARG 57 -2.229 -9.048 -12.032
353 HE ARG 57 HE ARG 57 -2.089 -11.416 -10.403
354 HH11 ARG 57 1HH1 ARG 57 -2.646 -10.665 -13.762
355 HH12 ARG 57 2HH1 ARG 57 -1.919 -12.189 -14.231
356 HH21 ARG 57 1HH2 ARG 57 -1.262 -13.169 -10.923
357 HH22 ARG 57 2HH2 ARG 57 -1.130 -13.619 -12.612
358 H TYR 58 H TYR 58 -3.441 -4.758 -8.510
359 HA TYR 58 HA TYR 58 -5.358 -3.047 -10.065
360 HB2 TYR 58 1HB TYR 58 -3.820 -2.309 -7.569
361 HB3 TYR 58 2HB TYR 58 -4.996 -1.303 -8.450
362 HD1 TYR 58 HD2 TYR 58 -7.415 -1.906 -8.395
363 HD2 TYR 58 HD1 TYR 58 -4.553 -3.961 -5.994
364 HE1 TYR 58 HE2 TYR 58 -9.247 -2.807 -7.003
365 HE2 TYR 58 HE1 TYR 58 -6.377 -4.874 -4.588
366 HH TYR 58 HH TYR 58 -9.803 -4.109 -5.218
367 H ASN 59 H ASN 59 -4.503 -2.261 -11.806
368 HA ASN 59 HA ASN 59 -1.546 -1.890 -11.925
369 HB2 ASN 59 1HB ASN 59 -3.479 -1.815 -14.359
370 HB3 ASN 59 2HB ASN 59 -1.736 -1.621 -14.048
371 HD21 ASN 59 2HD2 ASN 59 -4.323 -3.791 -14.545
372 HD22 ASN 59 1HD2 ASN 59 -3.426 -5.266 -14.403
373 H SER 60 H SER 60 -0.656 -0.025 -11.609
374 HA SER 60 HA SER 60 -2.218 2.511 -11.706
375 HB2 SER 60 1HB SER 60 -0.371 3.543 -10.857
376 HB3 SER 60 2HB SER 60 -0.703 2.063 -9.927
377 HG SER 60 HG SER 60 1.522 2.338 -10.394
378 H LEU 61 H LEU 61 -1.283 4.359 -12.870
379 HA LEU 61 HA LEU 61 -0.872 3.647 -15.679
380 HB2 LEU 61 1HB LEU 61 -0.886 6.167 -14.154
381 HB3 LEU 61 2HB LEU 61 -0.800 6.213 -15.930
382 HG LEU 61 HG LEU 61 -3.103 5.156 -14.243
383 HD11 LEU 61 1HD1 LEU 61 -4.372 7.055 -15.281
384 HD12 LEU 61 2HD1 LEU 61 -2.974 7.644 -14.352
385 HD13 LEU 61 3HD1 LEU 61 -2.892 7.562 -16.127
386 HD21 LEU 61 3HD2 LEU 61 -2.815 3.818 -16.244
387 HD22 LEU 61 1HD2 LEU 61 -4.277 4.822 -16.391
388 HD23 LEU 61 2HD2 LEU 61 -2.790 5.282 -17.256
389 HA PRO 62 HA PRO 62 3.412 3.704 -15.665
390 HB2 PRO 62 1HB PRO 62 3.730 3.850 -18.150
391 HB3 PRO 62 2HB PRO 62 3.134 2.524 -17.415
392 HG2 PRO 62 1HG PRO 62 1.796 4.278 -18.801
393 HG3 PRO 62 2HG PRO 62 1.580 2.661 -18.814
394 HD2 PRO 62 1HD PRO 62 0.021 3.975 -17.434
395 HD3 PRO 62 2HD PRO 62 0.579 2.547 -16.877
396 H GLY 63 H GLY 63 5.247 5.021 -15.897
397 HA2 GLY 63 1HA GLY 63 6.086 6.990 -17.244
398 HA3 GLY 63 2HA GLY 63 4.564 7.794 -16.798
399 H PHE 64 H PHE 64 5.916 5.726 -14.410
400 HA PHE 64 HA PHE 64 6.399 7.988 -12.617
401 HB2 PHE 64 1HB PHE 64 6.832 4.988 -12.294
402 HB3 PHE 64 2HB PHE 64 7.062 6.188 -11.003
403 HD1 PHE 64 HD2 PHE 64 4.963 7.797 -10.683
404 HD2 PHE 64 HD1 PHE 64 4.869 3.862 -12.342
405 HE1 PHE 64 HE2 PHE 64 2.576 7.599 -10.072
406 HE2 PHE 64 HE1 PHE 64 2.481 3.660 -11.734
407 HZ PHE 64 HZ PHE 64 1.335 5.530 -10.598
408 H PHE 65 H PHE 65 8.265 8.708 -11.736
409 HA PHE 65 HA PHE 65 10.736 7.947 -13.260
410 HB2 PHE 65 1HB PHE 65 10.039 10.549 -11.828
411 HB3 PHE 65 2HB PHE 65 11.567 10.204 -12.670
412 HD1 PHE 65 HD2 PHE 65 11.490 9.738 -15.146
413 HD2 PHE 65 HD1 PHE 65 8.214 11.399 -12.963
414 HE1 PHE 65 HE2 PHE 65 10.529 10.607 -17.252
415 HE2 PHE 65 HE1 PHE 65 7.249 12.265 -15.067
416 HZ PHE 65 HZ PHE 65 8.407 11.870 -17.212
417 H ASN 66 H ASN 66 9.259 7.257 -10.453
418 HA ASN 66 HA ASN 66 11.797 6.506 -9.177
419 HB2 ASN 66 1HB ASN 66 11.131 9.055 -8.308
420 HB3 ASN 66 2HB ASN 66 9.890 7.948 -7.670
421 HD21 ASN 66 2HD2 ASN 66 10.791 8.961 -5.666
422 HD22 ASN 66 1HD2 ASN 66 12.104 8.135 -4.893
423 H ARG 67 H ARG 67 11.622 4.936 -7.643
424 HA ARG 67 HA ARG 67 9.333 3.203 -7.933
425 HB2 ARG 67 1HB ARG 67 11.492 2.308 -7.566
426 HB3 ARG 67 2HB ARG 67 11.590 3.113 -5.981
427 HG2 ARG 67 1HG ARG 67 9.824 1.735 -5.099
428 HG3 ARG 67 2HG ARG 67 9.505 1.035 -6.705
429 HD2 ARG 67 1HD ARG 67 11.606 -0.087 -6.682
430 HD3 ARG 67 2HD ARG 67 12.048 0.699 -5.148
431 HE ARG 67 HE ARG 67 9.694 -0.914 -4.658
432 HH11 ARG 67 1HH1 ARG 67 13.038 -1.385 -5.528
433 HH12 ARG 67 2HH1 ARG 67 13.037 -2.937 -4.715
434 HH21 ARG 67 1HH2 ARG 67 9.675 -2.694 -3.730
435 HH22 ARG 67 2HH2 ARG 67 11.119 -3.686 -3.689
436 H LYS 68 H LYS 68 10.364 5.443 -5.383
437 HA LYS 68 HA LYS 68 8.388 4.774 -3.454
438 HB2 LYS 68 1HB LYS 68 10.306 6.249 -3.050
439 HB3 LYS 68 2HB LYS 68 9.572 7.476 -4.109
440 HG2 LYS 68 1HG LYS 68 7.688 7.714 -2.569
441 HG3 LYS 68 2HG LYS 68 8.356 6.435 -1.528
442 HD2 LYS 68 1HD LYS 68 10.338 7.806 -1.085
443 HD3 LYS 68 2HD LYS 68 9.714 9.076 -2.164
444 HE2 LYS 68 1HE LYS 68 7.756 9.356 -0.701
445 HE3 LYS 68 2HE LYS 68 8.386 8.093 0.380
446 HZ1 LYS 68 3HZ LYS 68 9.711 10.662 -0.208
447 HZ2 LYS 68 1HZ LYS 68 8.909 10.294 1.185
448 HZ3 LYS 68 2HZ LYS 68 10.296 9.491 0.795
449 H ALA 69 H ALA 69 8.244 7.222 -6.052
450 HA ALA 69 HA ALA 69 5.542 7.987 -5.484
451 HB1 ALA 69 3HB ALA 69 7.108 8.155 -8.080
452 HB2 ALA 69 1HB ALA 69 5.589 9.007 -7.724
453 HB3 ALA 69 2HB ALA 69 7.060 9.391 -6.801
454 H ALA 70 H ALA 70 6.945 5.467 -7.521
455 HA ALA 70 HA ALA 70 4.546 4.787 -8.918
456 HB1 ALA 70 3HB ALA 70 6.923 3.045 -8.184
457 HB2 ALA 70 1HB ALA 70 5.680 2.652 -9.393
458 HB3 ALA 70 2HB ALA 70 6.765 4.038 -9.652
459 H GLU 71 H GLU 71 5.938 3.567 -5.877
460 HA GLU 71 HA GLU 71 3.880 1.541 -5.533
461 HB2 GLU 71 1HB GLU 71 5.900 2.776 -3.659
462 HB3 GLU 71 2HB GLU 71 4.787 1.464 -3.201
463 HG2 GLU 71 1HG GLU 71 5.869 -0.032 -4.923
464 HG3 GLU 71 2HG GLU 71 6.826 1.394 -5.387
465 H GLN 72 H GLN 72 4.367 4.832 -4.305
466 HA GLN 72 HA GLN 72 2.130 4.837 -2.514
467 HB2 GLN 72 1HB GLN 72 3.917 6.530 -2.531
468 HB3 GLN 72 2HB GLN 72 3.345 7.099 -4.117
469 HG2 GLN 72 1HG GLN 72 1.061 7.807 -2.839
470 HG3 GLN 72 2HG GLN 72 2.021 7.044 -1.549
471 HE21 GLN 72 2HE2 GLN 72 1.028 9.570 -1.190
472 HE22 GLN 72 1HE2 GLN 72 2.315 10.728 -1.233
473 H SER 73 H SER 73 2.391 5.753 -5.944
474 HA SER 73 HA SER 73 -0.358 6.607 -6.296
475 HB2 SER 73 1HB SER 73 1.667 5.648 -8.223
476 HB3 SER 73 2HB SER 73 0.055 6.283 -8.622
477 HG SER 73 HG SER 73 1.842 7.726 -6.988
478 H ALA 74 H ALA 74 1.338 3.479 -6.702
479 HA ALA 74 HA ALA 74 -0.856 1.997 -7.727
480 HB1 ALA 74 3HB ALA 74 1.413 1.069 -5.934
481 HB2 ALA 74 1HB ALA 74 0.343 0.015 -6.886
482 HB3 ALA 74 2HB ALA 74 1.444 1.144 -7.712
483 H ALA 75 H ALA 75 0.155 2.577 -4.358
484 HA ALA 75 HA ALA 75 -1.952 1.086 -3.146
485 HB1 ALA 75 3HB ALA 75 -0.492 3.546 -2.125
486 HB2 ALA 75 1HB ALA 75 -1.481 2.442 -1.142
487 HB3 ALA 75 2HB ALA 75 0.017 1.856 -1.902
488 H GLU 76 H GLU 76 -1.783 4.449 -4.260
489 HA GLU 76 HA GLU 76 -4.335 5.289 -3.279
490 HB2 GLU 76 1HB GLU 76 -2.606 6.791 -4.168
491 HB3 GLU 76 2HB GLU 76 -2.874 6.114 -5.793
492 HG2 GLU 76 1HG GLU 76 -5.249 7.028 -5.732
493 HG3 GLU 76 2HG GLU 76 -4.843 7.590 -4.094
494 H VAL 77 H VAL 77 -3.422 3.794 -6.382
495 HA VAL 77 HA VAL 77 -6.075 3.822 -7.518
496 HB VAL 77 HB VAL 77 -3.708 1.962 -7.990
497 HG11 VAL 77 1HG1 VAL 77 -4.890 1.316 -10.063
498 HG12 VAL 77 2HG1 VAL 77 -5.841 0.882 -8.623
499 HG13 VAL 77 3HG1 VAL 77 -6.282 2.315 -9.582
500 HG21 VAL 77 3HG2 VAL 77 -3.247 4.271 -8.560
501 HG22 VAL 77 1HG2 VAL 77 -3.391 3.274 -10.026
502 HG23 VAL 77 2HG2 VAL 77 -4.729 4.345 -9.544
503 H ALA 78 H ALA 78 -4.401 1.391 -5.544
504 HA ALA 78 HA ALA 78 -6.560 -0.498 -5.644
505 HB1 ALA 78 3HB ALA 78 -4.403 -0.109 -3.542
506 HB2 ALA 78 1HB ALA 78 -5.450 -1.537 -3.706
507 HB3 ALA 78 2HB ALA 78 -4.285 -1.137 -4.990
508 H LEU 79 H LEU 79 -5.799 2.184 -3.458
509 HA LEU 79 HA LEU 79 -7.910 1.617 -1.574
510 HB2 LEU 79 1HB LEU 79 -6.420 4.018 -2.387
511 HB3 LEU 79 2HB LEU 79 -7.548 4.144 -1.017
512 HG LEU 79 HG LEU 79 -5.175 2.247 -1.112
513 HD11 LEU 79 1HD1 LEU 79 -4.065 3.852 0.465
514 HD12 LEU 79 2HD1 LEU 79 -4.400 4.617 -1.107
515 HD13 LEU 79 3HD1 LEU 79 -5.450 4.956 0.290
516 HD21 LEU 79 3HD2 LEU 79 -6.971 1.534 0.353
517 HD22 LEU 79 1HD2 LEU 79 -5.570 2.055 1.319
518 HD23 LEU 79 2HD2 LEU 79 -6.986 3.122 1.156
519 H ARG 80 H ARG 80 -7.741 3.626 -4.493
520 HA ARG 80 HA ARG 80 -10.353 4.788 -4.202
521 HB2 ARG 80 1HB ARG 80 -8.640 4.352 -6.602
522 HB3 ARG 80 2HB ARG 80 -10.223 5.165 -6.629
523 HG2 ARG 80 1HG ARG 80 -9.376 6.862 -5.062
524 HG3 ARG 80 2HG ARG 80 -7.792 6.050 -5.043
525 HD2 ARG 80 1HD ARG 80 -7.585 6.493 -7.441
526 HD3 ARG 80 2HD ARG 80 -9.117 7.396 -7.374
527 HE ARG 80 HE ARG 80 -6.514 8.475 -6.454
528 HH11 ARG 80 1HH1 ARG 80 -9.979 8.775 -6.208
529 HH12 ARG 80 2HH1 ARG 80 -9.802 10.424 -5.639
530 HH21 ARG 80 1HH2 ARG 80 -6.295 10.364 -5.811
531 HH22 ARG 80 2HH2 ARG 80 -7.701 11.331 -5.413
532 H GLU 81 H GLU 81 -9.232 1.796 -5.736
533 HA GLU 81 HA GLU 81 -11.912 1.043 -6.621
534 HB2 GLU 81 1HB GLU 81 -9.341 -0.496 -6.251
535 HB3 GLU 81 2HB GLU 81 -10.849 -1.208 -6.873
536 HG2 GLU 81 1HG GLU 81 -9.235 1.029 -8.243
537 HG3 GLU 81 2HG GLU 81 -9.350 -0.702 -8.637
538 H LEU 82 H LEU 82 -9.946 0.489 -3.747
539 HA LEU 82 HA LEU 82 -11.600 -1.532 -2.573
540 HB2 LEU 82 1HB LEU 82 -9.421 -1.009 -1.928
541 HB3 LEU 82 2HB LEU 82 -9.821 0.581 -1.237
542 HG LEU 82 HG LEU 82 -11.346 -0.591 0.382
543 HD11 LEU 82 1HD1 LEU 82 -10.993 -3.053 0.709
544 HD12 LEU 82 2HD1 LEU 82 -11.633 -2.701 -0.914
545 HD13 LEU 82 3HD1 LEU 82 -9.905 -3.068 -0.699
546 HD21 LEU 82 3HD2 LEU 82 -9.139 0.153 1.056
547 HD22 LEU 82 1HD2 LEU 82 -9.532 -1.388 1.857
548 HD23 LEU 82 2HD2 LEU 82 -8.416 -1.364 0.469
549 H ALA 83 H ALA 83 -11.797 1.997 -2.540
550 HA ALA 83 HA ALA 83 -13.837 2.163 -0.537
551 HB1 ALA 83 3HB ALA 83 -13.212 4.046 -2.837
552 HB2 ALA 83 1HB ALA 83 -14.224 4.428 -1.426
553 HB3 ALA 83 2HB ALA 83 -12.488 4.098 -1.212
554 H LYS 84 H LYS 84 -13.918 1.114 -3.804
555 HA LYS 84 HA LYS 84 -16.735 1.829 -4.254
556 HB2 LYS 84 1HB LYS 84 -14.787 0.101 -5.788
557 HB3 LYS 84 2HB LYS 84 -16.445 0.483 -6.312
558 HG2 LYS 84 1HG LYS 84 -15.867 2.875 -6.403
559 HG3 LYS 84 2HG LYS 84 -14.210 2.494 -5.877
560 HD2 LYS 84 1HD LYS 84 -13.887 1.117 -7.896
561 HD3 LYS 84 2HD LYS 84 -15.540 1.512 -8.425
562 HE2 LYS 84 1HE LYS 84 -14.954 3.888 -8.525
563 HE3 LYS 84 2HE LYS 84 -13.308 3.515 -7.965
564 HZ1 LYS 84 3HZ LYS 84 -14.518 2.570 -10.485
565 HZ2 LYS 84 1HZ LYS 84 -13.399 3.774 -10.351
566 HZ3 LYS 84 2HZ LYS 84 -12.990 2.223 -9.965
567 H SER 85 H SER 85 -15.197 -0.532 -2.472
568 HA SER 85 HA SER 85 -16.976 -2.816 -2.914
569 HB2 SER 85 1HB SER 85 -16.038 -3.766 -1.095
570 HB3 SER 85 2HB SER 85 -14.750 -2.955 -2.015
571 HG SER 85 HG SER 85 -14.587 -2.602 0.242
572 H SER 86 H SER 86 -17.274 0.256 -1.327
573 HA SER 86 HA SER 86 -19.072 -0.309 0.841
574 HB2 SER 86 1HB SER 86 -17.966 1.724 0.654
575 HB3 SER 86 2HB SER 86 -18.833 2.104 -0.851
576 HG SER 86 HG SER 86 -20.778 1.986 0.362
Start of MODEL 8
1 H PHE 16 H PHE 16 2.458 3.910 -0.341
2 HA PHE 16 HA PHE 16 -0.141 2.455 0.542
3 HB2 PHE 16 1HB PHE 16 0.314 0.364 -0.649
4 HB3 PHE 16 2HB PHE 16 0.514 1.731 -1.769
5 HD1 PHE 16 HD2 PHE 16 2.691 2.366 -2.585
6 HD2 PHE 16 HD1 PHE 16 2.173 -0.972 0.032
7 HE1 PHE 16 HE2 PHE 16 4.949 1.553 -3.178
8 HE2 PHE 16 HE1 PHE 16 4.431 -1.786 -0.557
9 HZ PHE 16 HZ PHE 16 5.820 -0.523 -2.163
10 H LYS 17 H LYS 17 3.306 2.310 1.097
11 HA LYS 17 HA LYS 17 3.380 0.069 2.859
12 HB2 LYS 17 1HB LYS 17 5.012 2.611 2.820
13 HB3 LYS 17 2HB LYS 17 5.381 1.183 3.816
14 HG2 LYS 17 1HG LYS 17 5.644 -0.167 1.763
15 HG3 LYS 17 2HG LYS 17 5.306 1.277 0.780
16 HD2 LYS 17 1HD LYS 17 7.279 2.394 1.781
17 HD3 LYS 17 2HD LYS 17 7.629 0.912 2.702
18 HE2 LYS 17 1HE LYS 17 7.889 -0.336 0.604
19 HE3 LYS 17 2HE LYS 17 7.528 1.139 -0.322
20 HZ1 LYS 17 3HZ LYS 17 9.835 0.768 1.480
21 HZ2 LYS 17 1HZ LYS 17 9.891 0.741 -0.168
22 HZ3 LYS 17 2HZ LYS 17 9.500 2.136 0.622
23 H SER 18 H SER 18 2.918 -0.294 4.903
24 HA SER 18 HA SER 18 2.282 0.192 7.174
25 HB2 SER 18 1HB SER 18 3.827 1.977 7.078
26 HB3 SER 18 2HB SER 18 2.569 3.030 6.391
27 HG SER 18 HG SER 18 1.340 2.618 8.284
28 H ARG 19 H ARG 19 0.885 2.874 5.249
29 HA ARG 19 HA ARG 19 -1.573 2.854 6.696
30 HB2 ARG 19 1HB ARG 19 -0.761 4.782 5.543
31 HB3 ARG 19 2HB ARG 19 -1.019 3.969 3.982
32 HG2 ARG 19 1HG ARG 19 -3.431 3.866 4.429
33 HG3 ARG 19 2HG ARG 19 -3.177 4.671 5.997
34 HD2 ARG 19 1HD ARG 19 -2.372 6.642 4.847
35 HD3 ARG 19 2HD ARG 19 -2.638 5.836 3.283
36 HE ARG 19 HE ARG 19 -5.173 6.033 4.733
37 HH11 ARG 19 1HH1 ARG 19 -2.903 8.007 2.970
38 HH12 ARG 19 2HH1 ARG 19 -4.200 9.090 2.502
39 HH21 ARG 19 1HH2 ARG 19 -6.667 7.269 4.212
40 HH22 ARG 19 2HH2 ARG 19 -6.346 8.670 3.209
41 H LEU 20 H LEU 20 -0.990 1.750 3.339
42 HA LEU 20 HA LEU 20 -3.651 0.658 3.093
43 HB2 LEU 20 1HB LEU 20 -2.312 1.425 1.328
44 HB3 LEU 20 2HB LEU 20 -1.125 0.105 1.440
45 HG LEU 20 HG LEU 20 -3.000 -1.513 0.996
46 HD11 LEU 20 1HD1 LEU 20 -5.091 -0.580 -0.030
47 HD12 LEU 20 2HD1 LEU 20 -4.883 -0.010 1.642
48 HD13 LEU 20 3HD1 LEU 20 -4.490 1.066 0.279
49 HD21 LEU 20 3HD2 LEU 20 -1.455 -0.871 -0.758
50 HD22 LEU 20 1HD2 LEU 20 -3.088 -1.077 -1.434
51 HD23 LEU 20 2HD2 LEU 20 -2.444 0.557 -1.147
52 H GLN 21 H GLN 21 -0.519 -0.741 3.961
53 HA GLN 21 HA GLN 21 -1.341 -3.475 3.997
54 HB2 GLN 21 1HB GLN 21 0.683 -1.950 5.645
55 HB3 GLN 21 2HB GLN 21 0.478 -3.717 5.712
56 HG2 GLN 21 1HG GLN 21 1.191 -3.731 3.103
57 HG3 GLN 21 2HG GLN 21 1.152 -1.995 3.490
58 HE21 GLN 21 2HE2 GLN 21 3.378 -3.405 2.397
59 HE22 GLN 21 1HE2 GLN 21 4.663 -3.346 3.557
60 H GLU 22 H GLU 22 -1.538 -0.955 6.492
61 HA GLU 22 HA GLU 22 -2.649 -2.697 8.515
62 HB2 GLU 22 1HB GLU 22 -1.585 -0.526 8.976
63 HB3 GLU 22 2HB GLU 22 -2.929 0.290 8.141
64 HG2 GLU 22 1HG GLU 22 -4.518 -0.592 9.916
65 HG3 GLU 22 2HG GLU 22 -3.093 -1.411 10.593
66 H TYR 23 H TYR 23 -4.112 -0.594 6.051
67 HA TYR 23 HA TYR 23 -6.836 -1.025 6.736
68 HB2 TYR 23 1HB TYR 23 -5.462 -0.636 4.074
69 HB3 TYR 23 2HB TYR 23 -7.230 -0.712 4.271
70 HD1 TYR 23 HD1 TYR 23 -6.534 0.745 7.182
71 HD2 TYR 23 HD2 TYR 23 -6.112 1.666 3.040
72 HE1 TYR 23 HE1 TYR 23 -6.579 3.163 7.723
73 HE2 TYR 23 HE2 TYR 23 -6.155 4.082 3.562
74 HH TYR 23 HH TYR 23 -6.487 5.281 6.911
75 H ALA 24 H ALA 24 -4.705 -2.951 4.618
76 HA ALA 24 HA ALA 24 -6.586 -4.942 3.933
77 HB1 ALA 24 3HB ALA 24 -3.605 -5.239 4.426
78 HB2 ALA 24 1HB ALA 24 -4.636 -6.400 3.557
79 HB3 ALA 24 2HB ALA 24 -4.373 -4.771 2.891
80 H GLN 25 H GLN 25 -4.462 -4.716 6.780
81 HA GLN 25 HA GLN 25 -5.194 -7.256 7.894
82 HB2 GLN 25 1HB GLN 25 -4.205 -4.685 9.136
83 HB3 GLN 25 2HB GLN 25 -4.453 -6.190 10.052
84 HG2 GLN 25 1HG GLN 25 -2.560 -7.280 8.463
85 HG3 GLN 25 2HG GLN 25 -2.753 -5.649 7.779
86 HE21 GLN 25 2HE2 GLN 25 -0.291 -6.751 8.644
87 HE22 GLN 25 1HE2 GLN 25 0.266 -5.829 10.000
88 H LYS 26 H LYS 26 -6.672 -4.064 8.093
89 HA LYS 26 HA LYS 26 -8.481 -4.641 10.241
90 HB2 LYS 26 1HB LYS 26 -8.613 -2.746 7.897
91 HB3 LYS 26 2HB LYS 26 -9.862 -2.827 9.162
92 HG2 LYS 26 1HG LYS 26 -8.189 -2.234 10.864
93 HG3 LYS 26 2HG LYS 26 -6.931 -2.167 9.607
94 HD2 LYS 26 1HD LYS 26 -8.164 -0.354 8.476
95 HD3 LYS 26 2HD LYS 26 -9.408 -0.414 9.747
96 HE2 LYS 26 1HE LYS 26 -7.711 0.161 11.433
97 HE3 LYS 26 2HE LYS 26 -6.474 0.237 10.157
98 HZ1 LYS 26 3HZ LYS 26 -8.856 1.968 10.339
99 HZ2 LYS 26 1HZ LYS 26 -7.313 2.417 10.711
100 HZ3 LYS 26 2HZ LYS 26 -7.709 2.038 9.156
101 H TYR 27 H TYR 27 -8.530 -5.472 6.848
102 HA TYR 27 HA TYR 27 -11.314 -6.534 7.181
103 HB2 TYR 27 1HB TYR 27 -9.733 -5.904 4.681
104 HB3 TYR 27 2HB TYR 27 -11.385 -6.564 4.737
105 HD1 TYR 27 HD2 TYR 27 -13.155 -5.120 5.987
106 HD2 TYR 27 HD1 TYR 27 -9.428 -3.584 4.594
107 HE1 TYR 27 HE2 TYR 27 -14.077 -2.829 6.075
108 HE2 TYR 27 HE1 TYR 27 -10.338 -1.281 4.676
109 HH TYR 27 HH TYR 27 -13.680 -0.614 5.727
110 H LYS 28 H LYS 28 -8.635 -7.725 7.997
111 HA LYS 28 HA LYS 28 -7.681 -9.847 7.998
112 HB2 LYS 28 1HB LYS 28 -10.467 -10.612 7.112
113 HB3 LYS 28 2HB LYS 28 -9.233 -11.712 7.771
114 HG2 LYS 28 1HG LYS 28 -9.286 -10.454 9.906
115 HG3 LYS 28 2HG LYS 28 -10.571 -9.417 9.244
116 HD2 LYS 28 1HD LYS 28 -11.988 -11.436 8.925
117 HD3 LYS 28 2HD LYS 28 -10.716 -12.418 9.689
118 HE2 LYS 28 1HE LYS 28 -10.930 -11.131 11.753
119 HE3 LYS 28 2HE LYS 28 -12.155 -10.089 10.995
120 HZ1 LYS 28 3HZ LYS 28 -12.432 -12.985 11.479
121 HZ2 LYS 28 1HZ LYS 28 -13.158 -11.793 12.357
122 HZ3 LYS 28 2HZ LYS 28 -13.569 -12.018 10.775
123 H LEU 29 H LEU 29 -7.369 -8.304 5.603
124 HA LEU 29 HA LEU 29 -7.526 -10.313 3.428
125 HB2 LEU 29 1HB LEU 29 -6.487 -7.560 3.614
126 HB3 LEU 29 2HB LEU 29 -6.569 -8.393 2.043
127 HG LEU 29 HG LEU 29 -8.913 -7.557 3.794
128 HD11 LEU 29 1HD1 LEU 29 -9.475 -6.074 1.850
129 HD12 LEU 29 2HD1 LEU 29 -7.868 -5.691 2.512
130 HD13 LEU 29 3HD1 LEU 29 -8.010 -6.641 1.014
131 HD21 LEU 29 3HD2 LEU 29 -9.364 -9.686 2.727
132 HD22 LEU 29 1HD2 LEU 29 -10.346 -8.409 1.971
133 HD23 LEU 29 2HD2 LEU 29 -8.895 -9.026 1.143
134 HA PRO 30 HA PRO 30 -3.525 -11.774 3.662
135 HB2 PRO 30 1HB PRO 30 -2.949 -11.917 1.211
136 HB3 PRO 30 2HB PRO 30 -4.031 -12.897 1.936
137 HG2 PRO 30 1HG PRO 30 -4.550 -10.889 0.359
138 HG3 PRO 30 2HG PRO 30 -5.322 -12.325 0.389
139 HD2 PRO 30 1HD PRO 30 -6.360 -10.373 1.497
140 HD3 PRO 30 2HD PRO 30 -6.450 -11.860 2.159
141 H THR 31 H THR 31 -1.282 -11.313 3.501
142 HA THR 31 HA THR 31 -0.684 -8.548 3.730
143 HB THR 31 HB THR 31 1.204 -10.797 2.913
144 HG1 THR 31 HG1 THR 31 0.513 -9.765 5.491
145 HG21 THR 31 1HG2 THR 31 2.943 -9.340 3.889
146 HG22 THR 31 2HG2 THR 31 2.120 -8.534 2.532
147 HG23 THR 31 3HG2 THR 31 1.718 -8.090 4.208
148 HA PRO 32 HA PRO 32 -0.974 -7.158 -0.353
149 HB2 PRO 32 1HB PRO 32 0.482 -5.168 0.823
150 HB3 PRO 32 2HB PRO 32 -0.883 -5.098 -0.063
151 HG2 PRO 32 1HG PRO 32 -0.701 -5.540 2.499
152 HG3 PRO 32 2HG PRO 32 -1.825 -4.627 1.749
153 HD2 PRO 32 1HD PRO 32 0.087 -6.895 3.321
154 HD3 PRO 32 2HD PRO 32 -1.443 -6.579 2.852
155 H VAL 33 H VAL 33 0.192 -7.376 -2.186
156 HA VAL 33 HA VAL 33 3.150 -7.802 -1.770
157 HB VAL 33 HB VAL 33 1.295 -9.065 -3.832
158 HG11 VAL 33 1HG1 VAL 33 3.300 -10.362 -4.472
159 HG12 VAL 33 2HG1 VAL 33 3.566 -8.618 -4.699
160 HG13 VAL 33 3HG1 VAL 33 4.268 -9.449 -3.290
161 HG21 VAL 33 3HG2 VAL 33 0.951 -10.020 -1.633
162 HG22 VAL 33 1HG2 VAL 33 1.788 -11.172 -2.699
163 HG23 VAL 33 2HG2 VAL 33 2.701 -10.287 -1.454
164 H TYR 34 H TYR 34 4.513 -6.575 -2.732
165 HA TYR 34 HA TYR 34 3.409 -4.638 -4.739
166 HB2 TYR 34 1HB TYR 34 4.186 -3.555 -2.748
167 HB3 TYR 34 2HB TYR 34 5.716 -4.463 -2.798
168 HD1 TYR 34 HD1 TYR 34 3.717 -1.905 -4.640
169 HD2 TYR 34 HD2 TYR 34 7.570 -3.610 -3.985
170 HE1 TYR 34 HE1 TYR 34 4.738 -0.096 -5.991
171 HE2 TYR 34 HE2 TYR 34 8.605 -1.813 -5.329
172 HH TYR 34 HH TYR 34 8.257 0.075 -6.555
173 H GLU 35 H GLU 35 3.976 -4.806 -6.745
174 HA GLU 35 HA GLU 35 6.628 -6.074 -7.365
175 HB2 GLU 35 1HB GLU 35 4.040 -6.116 -8.924
176 HB3 GLU 35 2HB GLU 35 5.611 -6.687 -9.540
177 HG2 GLU 35 1HG GLU 35 5.620 -8.425 -7.644
178 HG3 GLU 35 2HG GLU 35 4.029 -7.745 -7.236
179 H ILE 36 H ILE 36 8.013 -5.066 -8.636
180 HA ILE 36 HA ILE 36 7.171 -2.372 -9.681
181 HB ILE 36 HB ILE 36 8.820 -2.199 -7.819
182 HG12 ILE 36 1HG1 ILE 36 10.139 -1.626 -10.456
183 HG13 ILE 36 2HG1 ILE 36 8.787 -0.678 -9.794
184 HG21 ILE 36 1HG2 ILE 36 11.094 -3.116 -8.131
185 HG22 ILE 36 2HG2 ILE 36 9.879 -4.415 -8.098
186 HG23 ILE 36 3HG2 ILE 36 10.575 -3.888 -9.648
187 HD11 ILE 36 3HD1 ILE 36 11.498 -1.065 -8.478
188 HD12 ILE 36 1HD1 ILE 36 10.948 0.404 -9.318
189 HD13 ILE 36 2HD1 ILE 36 10.146 -0.117 -7.817
190 H VAL 37 H VAL 37 7.391 -1.875 -11.690
191 HA VAL 37 HA VAL 37 8.917 -3.795 -13.447
192 HB VAL 37 HB VAL 37 6.367 -2.255 -14.088
193 HG11 VAL 37 1HG1 VAL 37 6.463 -3.487 -16.230
194 HG12 VAL 37 2HG1 VAL 37 7.902 -2.462 -16.015
195 HG13 VAL 37 3HG1 VAL 37 8.009 -4.217 -15.739
196 HG21 VAL 37 3HG2 VAL 37 5.915 -4.135 -12.628
197 HG22 VAL 37 1HG2 VAL 37 5.315 -4.452 -14.272
198 HG23 VAL 37 2HG2 VAL 37 6.821 -5.218 -13.712
199 H LYS 38 H LYS 38 10.536 -3.049 -14.484
200 HA LYS 38 HA LYS 38 10.521 -0.139 -15.213
201 HB2 LYS 38 1HB LYS 38 12.083 -0.611 -13.367
202 HB3 LYS 38 2HB LYS 38 12.891 -1.824 -14.390
203 HG2 LYS 38 1HG LYS 38 13.524 -0.063 -15.985
204 HG3 LYS 38 2HG LYS 38 12.708 1.152 -14.973
205 HD2 LYS 38 1HD LYS 38 14.244 0.620 -13.113
206 HD3 LYS 38 2HD LYS 38 15.069 -0.571 -14.145
207 HE2 LYS 38 1HE LYS 38 15.719 1.189 -15.705
208 HE3 LYS 38 2HE LYS 38 14.836 2.395 -14.739
209 HZ1 LYS 38 3HZ LYS 38 17.166 0.836 -13.821
210 HZ2 LYS 38 1HZ LYS 38 17.191 2.425 -14.264
211 HZ3 LYS 38 2HZ LYS 38 16.349 1.953 -12.925
212 H GLU 39 H GLU 39 10.484 0.205 -17.274
213 HA GLU 39 HA GLU 39 11.841 -1.752 -19.086
214 HB2 GLU 39 1HB GLU 39 9.066 -0.598 -19.410
215 HB3 GLU 39 2HB GLU 39 9.955 -1.515 -20.652
216 HG2 GLU 39 1HG GLU 39 9.936 -3.534 -19.080
217 HG3 GLU 39 2HG GLU 39 9.048 -2.467 -17.968
218 H GLY 40 H GLY 40 12.509 -0.967 -21.085
219 HA2 GLY 40 1HA GLY 40 12.542 0.824 -22.734
220 HA3 GLY 40 2HA GLY 40 12.334 1.997 -21.413
221 HA PRO 41 HA PRO 41 16.777 1.667 -22.448
222 HB2 PRO 41 1HB PRO 41 17.091 4.106 -22.954
223 HB3 PRO 41 2HB PRO 41 16.521 3.043 -24.050
224 HG2 PRO 41 1HG PRO 41 15.148 4.833 -22.747
225 HG3 PRO 41 2HG PRO 41 14.963 4.419 -24.314
226 HD2 PRO 41 1HD PRO 41 13.384 3.433 -22.700
227 HD3 PRO 41 2HD PRO 41 13.962 2.522 -23.923
228 H SER 42 H SER 42 18.601 2.269 -21.229
229 HA SER 42 HA SER 42 18.096 2.821 -18.436
230 HB2 SER 42 1HB SER 42 20.357 2.897 -18.149
231 HB3 SER 42 2HB SER 42 19.943 1.566 -19.253
232 HG SER 42 HG SER 42 20.949 4.112 -20.003
233 H HIS 43 H HIS 43 18.437 4.865 -21.245
234 HA HIS 43 HA HIS 43 19.156 7.246 -19.638
235 HB2 HIS 43 1HB HIS 43 18.624 6.857 -22.617
236 HB3 HIS 43 2HB HIS 43 19.057 8.410 -21.865
237 HD2 HIS 43 HD2 HIS 43 20.874 5.479 -23.568
238 HE1 HIS 43 HE1 HIS 43 23.670 7.446 -21.045
239 HE2 HIS 43 HE2 HIS 43 23.296 5.714 -22.986
240 H LYS 44 H LYS 44 16.361 5.863 -21.284
241 HA LYS 44 HA LYS 44 14.691 7.838 -19.777
242 HB2 LYS 44 1HB LYS 44 14.304 6.919 -22.629
243 HB3 LYS 44 2HB LYS 44 13.113 7.834 -21.676
244 HG2 LYS 44 1HG LYS 44 14.745 9.696 -21.480
245 HG3 LYS 44 2HG LYS 44 15.873 8.786 -22.514
246 HD2 LYS 44 1HD LYS 44 14.219 8.803 -24.338
247 HD3 LYS 44 2HD LYS 44 13.088 9.707 -23.305
248 HE2 LYS 44 1HE LYS 44 14.692 11.561 -23.160
249 HE3 LYS 44 2HE LYS 44 15.833 10.657 -24.182
250 HZ1 LYS 44 3HZ LYS 44 13.152 11.575 -25.003
251 HZ2 LYS 44 1HZ LYS 44 14.581 12.264 -25.453
252 HZ3 LYS 44 2HZ LYS 44 14.210 10.736 -25.951
253 H SER 45 H SER 45 14.708 6.049 -18.245
254 HA SER 45 HA SER 45 13.340 3.520 -18.981
255 HB2 SER 45 1HB SER 45 14.392 4.549 -16.418
256 HB3 SER 45 2HB SER 45 13.602 2.978 -16.682
257 HG SER 45 HG SER 45 15.936 3.918 -17.994
258 H LEU 46 H LEU 46 11.239 3.070 -18.694
259 HA LEU 46 HA LEU 46 9.525 5.069 -17.285
260 HB2 LEU 46 1HB LEU 46 8.986 2.728 -18.993
261 HB3 LEU 46 2HB LEU 46 7.634 3.681 -18.338
262 HG LEU 46 HG LEU 46 9.737 4.602 -20.335
263 HD11 LEU 46 1HD1 LEU 46 7.759 4.872 -21.855
264 HD12 LEU 46 2HD1 LEU 46 7.926 3.189 -21.303
265 HD13 LEU 46 3HD1 LEU 46 6.703 4.252 -20.566
266 HD21 LEU 46 3HD2 LEU 46 9.211 6.394 -18.787
267 HD22 LEU 46 1HD2 LEU 46 8.505 6.744 -20.384
268 HD23 LEU 46 2HD2 LEU 46 7.468 6.158 -19.061
269 H PHE 47 H PHE 47 8.514 4.705 -15.451
270 HA PHE 47 HA PHE 47 8.982 2.028 -14.174
271 HB2 PHE 47 1HB PHE 47 8.747 4.805 -12.937
272 HB3 PHE 47 2HB PHE 47 8.802 3.290 -12.008
273 HD1 PHE 47 HD2 PHE 47 10.832 2.005 -11.840
274 HD2 PHE 47 HD1 PHE 47 10.696 5.683 -14.007
275 HE1 PHE 47 HE2 PHE 47 13.301 2.106 -11.817
276 HE2 PHE 47 HE1 PHE 47 13.165 5.787 -13.989
277 HZ PHE 47 HZ PHE 47 14.469 3.999 -12.894
278 H GLN 48 H GLN 48 7.345 0.820 -13.640
279 HA GLN 48 HA GLN 48 4.790 2.124 -12.874
280 HB2 GLN 48 1HB GLN 48 4.735 1.477 -15.322
281 HB3 GLN 48 2HB GLN 48 4.896 -0.211 -14.783
282 HG2 GLN 48 1HG GLN 48 2.543 0.141 -13.504
283 HG3 GLN 48 2HG GLN 48 2.877 1.762 -14.158
284 HE21 GLN 48 2HE2 GLN 48 0.480 0.514 -14.678
285 HE22 GLN 48 1HE2 GLN 48 0.406 0.054 -16.346
286 H SER 49 H SER 49 3.581 1.051 -11.401
287 HA SER 49 HA SER 49 4.900 -1.380 -10.148
288 HB2 SER 49 1HB SER 49 3.936 1.048 -8.762
289 HB3 SER 49 2HB SER 49 4.454 -0.483 -8.020
290 HG SER 49 HG SER 49 6.231 0.776 -8.039
291 H THR 50 H THR 50 3.516 -2.771 -9.051
292 HA THR 50 HA THR 50 0.581 -2.225 -9.268
293 HB THR 50 HB THR 50 1.928 -4.881 -9.915
294 HG1 THR 50 HG1 THR 50 0.397 -3.299 -11.704
295 HG21 THR 50 1HG2 THR 50 -0.355 -5.589 -10.535
296 HG22 THR 50 2HG2 THR 50 -0.275 -5.113 -8.821
297 HG23 THR 50 3HG2 THR 50 -0.985 -4.006 -10.020
298 H VAL 51 H VAL 51 -0.517 -2.514 -7.494
299 HA VAL 51 HA VAL 51 0.734 -4.117 -5.272
300 HB VAL 51 HB VAL 51 -1.538 -2.086 -5.211
301 HG11 VAL 51 1HG1 VAL 51 -1.348 -2.326 -2.757
302 HG12 VAL 51 2HG1 VAL 51 -1.775 -3.876 -3.522
303 HG13 VAL 51 3HG1 VAL 51 -0.106 -3.581 -2.976
304 HG21 VAL 51 3HG2 VAL 51 0.595 -1.011 -5.619
305 HG22 VAL 51 1HG2 VAL 51 0.021 -0.670 -3.970
306 HG23 VAL 51 2HG2 VAL 51 1.313 -1.867 -4.232
307 H ILE 52 H ILE 52 0.046 -5.991 -4.748
308 HA ILE 52 HA ILE 52 -2.601 -6.878 -5.870
309 HB ILE 52 HB ILE 52 -0.130 -8.510 -5.124
310 HG12 ILE 52 1HG1 ILE 52 -1.364 -8.038 -7.824
311 HG13 ILE 52 2HG1 ILE 52 0.046 -7.163 -7.182
312 HG21 ILE 52 1HG2 ILE 52 -1.396 -10.419 -6.054
313 HG22 ILE 52 2HG2 ILE 52 -2.243 -9.706 -4.661
314 HG23 ILE 52 3HG2 ILE 52 -2.802 -9.360 -6.314
315 HD11 ILE 52 3HD1 ILE 52 -0.119 -10.159 -7.665
316 HD12 ILE 52 1HD1 ILE 52 0.739 -8.985 -8.689
317 HD13 ILE 52 2HD1 ILE 52 1.291 -9.284 -7.023
318 H LEU 53 H LEU 53 -4.189 -7.164 -4.595
319 HA LEU 53 HA LEU 53 -3.682 -8.109 -1.823
320 HB2 LEU 53 1HB LEU 53 -3.599 -5.824 -1.673
321 HB3 LEU 53 2HB LEU 53 -5.131 -5.497 -2.516
322 HG LEU 53 HG LEU 53 -6.302 -6.776 -0.674
323 HD11 LEU 53 1HD1 LEU 53 -5.050 -7.023 1.486
324 HD12 LEU 53 2HD1 LEU 53 -4.300 -7.984 0.191
325 HD13 LEU 53 3HD1 LEU 53 -3.577 -6.434 0.682
326 HD21 LEU 53 3HD2 LEU 53 -6.338 -4.353 -0.761
327 HD22 LEU 53 1HD2 LEU 53 -6.236 -4.899 0.930
328 HD23 LEU 53 2HD2 LEU 53 -4.788 -4.270 0.108
329 H ASP 54 H ASP 54 -4.854 -9.811 -1.518
330 HA ASP 54 HA ASP 54 -6.625 -11.311 -1.636
331 HB2 ASP 54 1HB ASP 54 -7.804 -9.053 -0.707
332 HB3 ASP 54 2HB ASP 54 -8.373 -9.099 -2.394
333 H GLY 55 H GLY 55 -5.112 -10.749 -4.016
334 HA2 GLY 55 1HA GLY 55 -5.207 -11.752 -6.121
335 HA3 GLY 55 2HA GLY 55 -6.927 -12.118 -5.850
336 H VAL 56 H VAL 56 -6.385 -8.904 -5.123
337 HA VAL 56 HA VAL 56 -7.391 -8.039 -7.825
338 HB VAL 56 HB VAL 56 -7.503 -6.607 -5.137
339 HG11 VAL 56 1HG1 VAL 56 -9.026 -5.064 -6.325
340 HG12 VAL 56 2HG1 VAL 56 -7.417 -5.091 -7.087
341 HG13 VAL 56 3HG1 VAL 56 -8.771 -5.974 -7.833
342 HG21 VAL 56 3HG2 VAL 56 -8.935 -8.562 -5.122
343 HG22 VAL 56 1HG2 VAL 56 -9.902 -7.071 -5.190
344 HG23 VAL 56 2HG2 VAL 56 -9.678 -8.053 -6.657
345 H ARG 57 H ARG 57 -6.213 -6.982 -9.151
346 HA ARG 57 HA ARG 57 -3.539 -6.073 -8.197
347 HB2 ARG 57 1HB ARG 57 -4.569 -6.551 -10.958
348 HB3 ARG 57 2HB ARG 57 -2.957 -5.925 -10.539
349 HG2 ARG 57 1HG ARG 57 -2.410 -7.997 -9.392
350 HG3 ARG 57 2HG ARG 57 -4.051 -8.622 -9.682
351 HD2 ARG 57 1HD ARG 57 -3.625 -8.610 -12.067
352 HD3 ARG 57 2HD ARG 57 -1.979 -8.007 -11.765
353 HE ARG 57 HE ARG 57 -2.225 -10.553 -10.418
354 HH11 ARG 57 1HH1 ARG 57 -2.267 -9.337 -13.686
355 HH12 ARG 57 2HH1 ARG 57 -1.601 -10.852 -14.264
356 HH21 ARG 57 1HH2 ARG 57 -1.471 -12.297 -11.067
357 HH22 ARG 57 2HH2 ARG 57 -1.148 -12.541 -12.772
358 H TYR 58 H TYR 58 -3.016 -4.060 -7.920
359 HA TYR 58 HA TYR 58 -4.769 -1.963 -9.160
360 HB2 TYR 58 1HB TYR 58 -2.954 -1.710 -6.759
361 HB3 TYR 58 2HB TYR 58 -4.100 -0.500 -7.387
362 HD1 TYR 58 HD2 TYR 58 -6.613 -1.449 -7.576
363 HD2 TYR 58 HD1 TYR 58 -3.638 -2.921 -4.900
364 HE1 TYR 58 HE2 TYR 58 -8.389 -2.360 -6.120
365 HE2 TYR 58 HE1 TYR 58 -5.406 -3.841 -3.428
366 HH TYR 58 HH TYR 58 -8.870 -3.496 -4.206
367 H ASN 59 H ASN 59 -3.822 -1.659 -11.088
368 HA ASN 59 HA ASN 59 -0.893 -1.372 -11.273
369 HB2 ASN 59 1HB ASN 59 -2.914 -1.016 -13.607
370 HB3 ASN 59 2HB ASN 59 -1.150 -0.987 -13.374
371 HD21 ASN 59 2HD2 ASN 59 -3.871 -2.877 -14.007
372 HD22 ASN 59 1HD2 ASN 59 -3.129 -4.439 -13.901
373 H SER 60 H SER 60 0.251 0.397 -11.196
374 HA SER 60 HA SER 60 -0.885 3.072 -10.848
375 HB2 SER 60 1HB SER 60 1.247 3.856 -10.861
376 HB3 SER 60 2HB SER 60 1.186 2.360 -9.900
377 HG SER 60 HG SER 60 2.119 2.597 -12.569
378 H LEU 61 H LEU 61 -0.451 4.857 -12.298
379 HA LEU 61 HA LEU 61 -1.119 4.278 -15.073
380 HB2 LEU 61 1HB LEU 61 -0.228 6.672 -13.607
381 HB3 LEU 61 2HB LEU 61 -0.748 6.827 -15.302
382 HG LEU 61 HG LEU 61 -2.469 5.961 -12.946
383 HD11 LEU 61 1HD1 LEU 61 -3.709 8.090 -13.417
384 HD12 LEU 61 2HD1 LEU 61 -2.006 8.411 -13.015
385 HD13 LEU 61 3HD1 LEU 61 -2.546 8.464 -14.710
386 HD21 LEU 61 3HD2 LEU 61 -3.086 4.765 -14.961
387 HD22 LEU 61 1HD2 LEU 61 -4.339 5.963 -14.559
388 HD23 LEU 61 2HD2 LEU 61 -3.182 6.290 -15.872
389 HA PRO 62 HA PRO 62 2.904 3.831 -16.541
390 HB2 PRO 62 1HB PRO 62 2.304 3.698 -18.965
391 HB3 PRO 62 2HB PRO 62 1.912 2.523 -17.906
392 HG2 PRO 62 1HG PRO 62 0.303 4.285 -18.953
393 HG3 PRO 62 2HG PRO 62 -0.025 2.710 -18.683
394 HD2 PRO 62 1HD PRO 62 -0.880 4.260 -16.981
395 HD3 PRO 62 2HD PRO 62 -0.235 2.844 -16.492
396 H GLY 63 H GLY 63 4.580 4.908 -17.666
397 HA2 GLY 63 1HA GLY 63 5.256 6.654 -19.197
398 HA3 GLY 63 2HA GLY 63 3.757 7.533 -18.818
399 H PHE 64 H PHE 64 5.353 6.073 -16.145
400 HA PHE 64 HA PHE 64 6.104 8.764 -15.127
401 HB2 PHE 64 1HB PHE 64 5.882 6.027 -13.808
402 HB3 PHE 64 2HB PHE 64 6.470 7.484 -12.975
403 HD1 PHE 64 HD1 PHE 64 4.335 9.127 -14.795
404 HD2 PHE 64 HD2 PHE 64 4.215 5.917 -11.978
405 HE1 PHE 64 HE1 PHE 64 2.011 9.732 -14.208
406 HE2 PHE 64 HE2 PHE 64 1.890 6.517 -11.390
407 HZ PHE 64 HZ PHE 64 0.789 8.427 -12.504
408 H PHE 65 H PHE 65 8.095 9.344 -14.397
409 HA PHE 65 HA PHE 65 10.334 7.660 -15.474
410 HB2 PHE 65 1HB PHE 65 10.153 10.682 -15.105
411 HB3 PHE 65 2HB PHE 65 11.597 9.798 -15.648
412 HD1 PHE 65 HD2 PHE 65 11.496 8.526 -17.802
413 HD2 PHE 65 HD1 PHE 65 8.491 11.312 -16.595
414 HE1 PHE 65 HE2 PHE 65 10.732 8.714 -20.146
415 HE2 PHE 65 HE1 PHE 65 7.722 11.502 -18.937
416 HZ PHE 65 HZ PHE 65 8.844 10.202 -20.713
417 H ASN 66 H ASN 66 8.897 7.774 -12.753
418 HA ASN 66 HA ASN 66 11.387 7.541 -11.189
419 HB2 ASN 66 1HB ASN 66 10.420 10.131 -10.958
420 HB3 ASN 66 2HB ASN 66 9.231 9.062 -10.176
421 HD21 ASN 66 2HD2 ASN 66 9.857 10.580 -8.396
422 HD22 ASN 66 1HD2 ASN 66 11.160 10.084 -7.368
423 H ARG 67 H ARG 67 11.200 6.378 -9.307
424 HA ARG 67 HA ARG 67 9.141 4.349 -9.400
425 HB2 ARG 67 1HB ARG 67 11.270 4.946 -7.403
426 HB3 ARG 67 2HB ARG 67 10.099 3.615 -7.250
427 HG2 ARG 67 1HG ARG 67 10.914 2.621 -9.319
428 HG3 ARG 67 2HG ARG 67 12.037 3.982 -9.554
429 HD2 ARG 67 1HD ARG 67 13.226 3.340 -7.547
430 HD3 ARG 67 2HD ARG 67 12.106 1.975 -7.323
431 HE ARG 67 HE ARG 67 13.398 1.585 -9.869
432 HH11 ARG 67 1HH1 ARG 67 14.346 1.749 -6.517
433 HH12 ARG 67 2HH1 ARG 67 15.669 0.645 -6.831
434 HH21 ARG 67 1HH2 ARG 67 14.914 0.326 -10.246
435 HH22 ARG 67 2HH2 ARG 67 15.996 -0.168 -8.958
436 H LYS 68 H LYS 68 9.648 7.229 -7.408
437 HA LYS 68 HA LYS 68 7.681 6.659 -5.425
438 HB2 LYS 68 1HB LYS 68 8.694 9.262 -6.568
439 HB3 LYS 68 2HB LYS 68 7.585 9.151 -5.181
440 HG2 LYS 68 1HG LYS 68 9.283 7.879 -3.928
441 HG3 LYS 68 2HG LYS 68 10.392 7.998 -5.314
442 HD2 LYS 68 1HD LYS 68 10.359 10.458 -5.122
443 HD3 LYS 68 2HD LYS 68 9.266 10.328 -3.724
444 HE2 LYS 68 1HE LYS 68 10.974 9.085 -2.485
445 HE3 LYS 68 2HE LYS 68 12.064 9.166 -3.889
446 HZ1 LYS 68 3HZ LYS 68 11.065 11.482 -2.360
447 HZ2 LYS 68 1HZ LYS 68 12.586 10.851 -2.259
448 HZ3 LYS 68 2HZ LYS 68 12.076 11.557 -3.660
449 H ALA 69 H ALA 69 7.387 8.314 -8.560
450 HA ALA 69 HA ALA 69 4.685 9.121 -8.256
451 HB1 ALA 69 3HB ALA 69 6.172 8.335 -10.784
452 HB2 ALA 69 1HB ALA 69 4.645 9.246 -10.715
453 HB3 ALA 69 2HB ALA 69 6.136 9.955 -10.048
454 H ALA 70 H ALA 70 6.057 6.087 -9.506
455 HA ALA 70 HA ALA 70 3.505 4.969 -10.241
456 HB1 ALA 70 3HB ALA 70 6.138 3.598 -9.598
457 HB2 ALA 70 1HB ALA 70 4.735 2.840 -10.388
458 HB3 ALA 70 2HB ALA 70 5.611 4.157 -11.204
459 H GLU 71 H GLU 71 5.434 4.931 -7.286
460 HA GLU 71 HA GLU 71 3.829 2.914 -5.950
461 HB2 GLU 71 1HB GLU 71 5.716 5.050 -4.954
462 HB3 GLU 71 2HB GLU 71 4.910 3.866 -3.898
463 HG2 GLU 71 1HG GLU 71 6.113 2.000 -5.112
464 HG3 GLU 71 2HG GLU 71 6.756 3.273 -6.173
465 H GLN 72 H GLN 72 3.607 6.397 -6.312
466 HA GLN 72 HA GLN 72 1.548 6.673 -4.252
467 HB2 GLN 72 1HB GLN 72 2.542 8.463 -6.473
468 HB3 GLN 72 2HB GLN 72 1.241 8.920 -5.350
469 HG2 GLN 72 1HG GLN 72 3.073 8.726 -3.384
470 HG3 GLN 72 2HG GLN 72 3.978 8.165 -4.808
471 HE21 GLN 72 2HE2 GLN 72 4.756 10.284 -3.054
472 HE22 GLN 72 1HE2 GLN 72 4.778 11.750 -3.978
473 H SER 73 H SER 73 1.593 6.501 -7.801
474 HA SER 73 HA SER 73 -1.230 6.902 -8.256
475 HB2 SER 73 1HB SER 73 0.352 7.169 -9.947
476 HB3 SER 73 2HB SER 73 0.772 5.442 -9.872
477 HG SER 73 HG SER 73 -1.626 6.657 -10.717
478 H ALA 74 H ALA 74 0.764 3.961 -7.769
479 HA ALA 74 HA ALA 74 -1.372 2.093 -8.100
480 HB1 ALA 74 3HB ALA 74 1.185 1.846 -6.481
481 HB2 ALA 74 1HB ALA 74 0.125 0.502 -6.960
482 HB3 ALA 74 2HB ALA 74 0.990 1.438 -8.201
483 H ALA 75 H ALA 75 -0.039 3.659 -5.191
484 HA ALA 75 HA ALA 75 -1.784 2.390 -3.327
485 HB1 ALA 75 3HB ALA 75 -0.523 5.151 -3.221
486 HB2 ALA 75 1HB ALA 75 -1.243 4.283 -1.846
487 HB3 ALA 75 2HB ALA 75 0.213 3.639 -2.641
488 H GLU 76 H GLU 76 -2.168 5.309 -5.303
489 HA GLU 76 HA GLU 76 -4.621 6.184 -4.079
490 HB2 GLU 76 1HB GLU 76 -3.174 7.596 -5.477
491 HB3 GLU 76 2HB GLU 76 -3.596 6.602 -6.892
492 HG2 GLU 76 1HG GLU 76 -5.014 8.622 -6.992
493 HG3 GLU 76 2HG GLU 76 -5.941 7.181 -6.518
494 H VAL 77 H VAL 77 -3.960 4.083 -6.869
495 HA VAL 77 HA VAL 77 -6.744 3.638 -7.553
496 HB VAL 77 HB VAL 77 -4.251 1.947 -8.010
497 HG11 VAL 77 1HG1 VAL 77 -5.627 0.730 -9.664
498 HG12 VAL 77 2HG1 VAL 77 -6.295 0.558 -8.024
499 HG13 VAL 77 3HG1 VAL 77 -7.051 1.681 -9.180
500 HG21 VAL 77 3HG2 VAL 77 -4.179 4.093 -9.133
501 HG22 VAL 77 1HG2 VAL 77 -4.404 2.774 -10.304
502 HG23 VAL 77 2HG2 VAL 77 -5.784 3.798 -9.843
503 H ALA 78 H ALA 78 -4.531 2.007 -5.325
504 HA ALA 78 HA ALA 78 -6.357 -0.108 -4.672
505 HB1 ALA 78 3HB ALA 78 -4.112 1.112 -3.029
506 HB2 ALA 78 1HB ALA 78 -4.925 -0.434 -2.693
507 HB3 ALA 78 2HB ALA 78 -3.958 -0.240 -4.175
508 H LEU 79 H LEU 79 -5.839 3.132 -3.336
509 HA LEU 79 HA LEU 79 -7.648 2.757 -1.102
510 HB2 LEU 79 1HB LEU 79 -6.544 5.067 -2.548
511 HB3 LEU 79 2HB LEU 79 -7.539 5.367 -1.104
512 HG LEU 79 HG LEU 79 -4.907 3.843 -1.185
513 HD11 LEU 79 1HD1 LEU 79 -4.031 5.786 0.140
514 HD12 LEU 79 2HD1 LEU 79 -4.622 6.304 -1.456
515 HD13 LEU 79 3HD1 LEU 79 -5.617 6.579 -0.006
516 HD21 LEU 79 3HD2 LEU 79 -6.415 2.953 0.492
517 HD22 LEU 79 1HD2 LEU 79 -5.083 3.830 1.280
518 HD23 LEU 79 2HD2 LEU 79 -6.691 4.582 1.151
519 H ARG 80 H ARG 80 -8.005 4.071 -4.373
520 HA ARG 80 HA ARG 80 -10.679 5.077 -3.948
521 HB2 ARG 80 1HB ARG 80 -9.161 4.427 -6.427
522 HB3 ARG 80 2HB ARG 80 -10.825 5.055 -6.410
523 HG2 ARG 80 1HG ARG 80 -10.071 7.075 -5.260
524 HG3 ARG 80 2HG ARG 80 -8.408 6.442 -5.207
525 HD2 ARG 80 1HD ARG 80 -8.324 6.495 -7.629
526 HD3 ARG 80 2HD ARG 80 -9.976 7.157 -7.666
527 HE ARG 80 HE ARG 80 -8.338 9.019 -6.181
528 HH11 ARG 80 1HH1 ARG 80 -8.547 7.785 -9.435
529 HH12 ARG 80 2HH1 ARG 80 -7.926 9.301 -10.057
530 HH21 ARG 80 1HH2 ARG 80 -7.618 10.759 -6.876
531 HH22 ARG 80 2HH2 ARG 80 -7.394 10.998 -8.598
532 H GLU 81 H GLU 81 -9.407 2.003 -5.184
533 HA GLU 81 HA GLU 81 -11.981 0.918 -5.902
534 HB2 GLU 81 1HB GLU 81 -9.324 -0.329 -5.207
535 HB3 GLU 81 2HB GLU 81 -10.757 -1.278 -5.673
536 HG2 GLU 81 1HG GLU 81 -9.304 0.765 -7.460
537 HG3 GLU 81 2HG GLU 81 -9.291 -1.012 -7.507
538 H LEU 82 H LEU 82 -10.056 0.800 -2.925
539 HA LEU 82 HA LEU 82 -11.874 -0.942 -1.514
540 HB2 LEU 82 1HB LEU 82 -9.896 1.092 -0.742
541 HB3 LEU 82 2HB LEU 82 -10.680 0.146 0.544
542 HG LEU 82 HG LEU 82 -8.939 -0.965 -1.691
543 HD11 LEU 82 1HD1 LEU 82 -7.329 -1.486 0.163
544 HD12 LEU 82 2HD1 LEU 82 -7.637 0.263 0.045
545 HD13 LEU 82 3HD1 LEU 82 -8.429 -0.698 1.318
546 HD21 LEU 82 3HD2 LEU 82 -10.690 -2.515 -1.052
547 HD22 LEU 82 1HD2 LEU 82 -9.115 -3.108 -0.475
548 HD23 LEU 82 2HD2 LEU 82 -10.253 -2.348 0.665
549 H ALA 83 H ALA 83 -11.632 2.583 -1.812
550 HA ALA 83 HA ALA 83 -13.804 3.113 0.010
551 HB1 ALA 83 3HB ALA 83 -12.690 4.791 -2.264
552 HB2 ALA 83 1HB ALA 83 -13.786 5.367 -0.987
553 HB3 ALA 83 2HB ALA 83 -12.144 4.824 -0.571
554 H LYS 84 H LYS 84 -13.631 2.181 -3.340
555 HA LYS 84 HA LYS 84 -16.413 2.906 -3.924
556 HB2 LYS 84 1HB LYS 84 -14.649 2.825 -5.646
557 HB3 LYS 84 2HB LYS 84 -14.498 1.073 -5.375
558 HG2 LYS 84 1HG LYS 84 -16.764 0.708 -6.164
559 HG3 LYS 84 2HG LYS 84 -17.029 2.461 -6.313
560 HD2 LYS 84 1HD LYS 84 -15.270 2.588 -8.027
561 HD3 LYS 84 2HD LYS 84 -14.991 0.837 -7.874
562 HE2 LYS 84 1HE LYS 84 -17.292 0.397 -8.601
563 HE3 LYS 84 2HE LYS 84 -17.591 2.145 -8.733
564 HZ1 LYS 84 3HZ LYS 84 -15.623 0.618 -10.314
565 HZ2 LYS 84 1HZ LYS 84 -17.078 1.167 -10.865
566 HZ3 LYS 84 2HZ LYS 84 -15.900 2.240 -10.436
567 H SER 85 H SER 85 -14.682 0.081 -2.762
568 HA SER 85 HA SER 85 -17.119 -1.656 -2.950
569 HB2 SER 85 1HB SER 85 -15.779 -3.401 -2.309
570 HB3 SER 85 2HB SER 85 -15.031 -2.516 -3.658
571 HG SER 85 HG SER 85 -13.530 -3.071 -2.019
572 H SER 86 H SER 86 -15.696 0.589 -0.805
573 HA SER 86 HA SER 86 -16.058 -0.556 1.796
574 HB2 SER 86 1HB SER 86 -14.841 1.393 1.462
575 HB3 SER 86 2HB SER 86 -16.297 2.258 0.918
576 HG SER 86 HG SER 86 -17.195 1.831 2.985
Start of MODEL 9
1 H PHE 16 H PHE 16 0.997 -2.558 10.879
2 HA PHE 16 HA PHE 16 1.504 -2.116 7.848
3 HB2 PHE 16 1HB PHE 16 -1.327 -2.391 8.940
4 HB3 PHE 16 2HB PHE 16 -0.951 -1.936 7.262
5 HD1 PHE 16 HD2 PHE 16 0.224 -3.538 5.789
6 HD2 PHE 16 HD1 PHE 16 -1.246 -4.617 9.653
7 HE1 PHE 16 HE2 PHE 16 0.340 -5.927 5.164
8 HE2 PHE 16 HE1 PHE 16 -1.128 -7.007 9.032
9 HZ PHE 16 HZ PHE 16 -0.334 -7.662 6.788
10 H LYS 17 H LYS 17 1.581 -0.216 6.874
11 HA LYS 17 HA LYS 17 0.677 2.156 8.479
12 HB2 LYS 17 1HB LYS 17 3.133 1.818 6.751
13 HB3 LYS 17 2HB LYS 17 2.570 3.362 7.433
14 HG2 LYS 17 1HG LYS 17 2.872 2.462 9.710
15 HG3 LYS 17 2HG LYS 17 3.452 0.927 9.021
16 HD2 LYS 17 1HD LYS 17 5.333 2.097 7.964
17 HD3 LYS 17 2HD LYS 17 4.749 3.644 8.621
18 HE2 LYS 17 1HE LYS 17 5.034 2.773 10.909
19 HE3 LYS 17 2HE LYS 17 5.640 1.239 10.243
20 HZ1 LYS 17 3HZ LYS 17 6.906 3.880 9.890
21 HZ2 LYS 17 1HZ LYS 17 7.434 2.692 10.905
22 HZ3 LYS 17 2HZ LYS 17 7.469 2.458 9.272
23 H SER 18 H SER 18 0.175 4.067 7.295
24 HA SER 18 HA SER 18 -0.728 5.245 5.402
25 HB2 SER 18 1HB SER 18 1.061 4.092 4.198
26 HB3 SER 18 2HB SER 18 -0.153 2.869 3.756
27 HG SER 18 HG SER 18 -0.334 5.660 3.271
28 H ARG 19 H ARG 19 -2.636 5.116 3.982
29 HA ARG 19 HA ARG 19 -4.851 4.030 5.434
30 HB2 ARG 19 1HB ARG 19 -4.656 5.184 2.695
31 HB3 ARG 19 2HB ARG 19 -6.171 4.605 3.426
32 HG2 ARG 19 1HG ARG 19 -5.939 6.228 5.239
33 HG3 ARG 19 2HG ARG 19 -4.392 6.787 4.558
34 HD2 ARG 19 1HD ARG 19 -5.573 7.528 2.559
35 HD3 ARG 19 2HD ARG 19 -7.109 7.034 3.309
36 HE ARG 19 HE ARG 19 -5.642 9.527 4.005
37 HH11 ARG 19 1HH1 ARG 19 -8.110 7.260 4.975
38 HH12 ARG 19 2HH1 ARG 19 -8.795 8.459 6.053
39 HH21 ARG 19 1HH2 ARG 19 -6.421 10.913 5.230
40 HH22 ARG 19 2HH2 ARG 19 -7.834 10.543 6.200
41 H LEU 20 H LEU 20 -3.536 3.054 2.251
42 HA LEU 20 HA LEU 20 -5.392 1.029 1.709
43 HB2 LEU 20 1HB LEU 20 -3.864 1.826 0.193
44 HB3 LEU 20 2HB LEU 20 -2.415 1.174 0.992
45 HG LEU 20 HG LEU 20 -3.373 -1.136 0.630
46 HD11 LEU 20 1HD1 LEU 20 -5.124 -1.357 -1.151
47 HD12 LEU 20 2HD1 LEU 20 -5.736 -0.442 0.246
48 HD13 LEU 20 3HD1 LEU 20 -5.243 0.416 -1.233
49 HD21 LEU 20 3HD2 LEU 20 -1.589 -0.269 -0.765
50 HD22 LEU 20 1HD2 LEU 20 -2.703 -1.252 -1.745
51 HD23 LEU 20 2HD2 LEU 20 -2.771 0.526 -1.832
52 H GLN 21 H GLN 21 -2.281 0.646 3.426
53 HA GLN 21 HA GLN 21 -2.694 -2.204 3.774
54 HB2 GLN 21 1HB GLN 21 -0.819 -0.242 5.111
55 HB3 GLN 21 2HB GLN 21 -0.771 -2.006 5.335
56 HG2 GLN 21 1HG GLN 21 -0.199 -2.145 2.688
57 HG3 GLN 21 2HG GLN 21 -0.434 -0.403 2.954
58 HE21 GLN 21 2HE2 GLN 21 1.892 -1.520 1.822
59 HE22 GLN 21 1HE2 GLN 21 3.214 -1.255 2.910
60 H GLU 22 H GLU 22 -3.147 0.634 5.849
61 HA GLU 22 HA GLU 22 -3.823 -0.797 8.236
62 HB2 GLU 22 1HB GLU 22 -3.304 1.604 8.133
63 HB3 GLU 22 2HB GLU 22 -4.822 1.881 7.247
64 HG2 GLU 22 1HG GLU 22 -6.110 1.086 9.290
65 HG3 GLU 22 2HG GLU 22 -4.512 0.800 10.017
66 H TYR 23 H TYR 23 -5.858 0.368 5.556
67 HA TYR 23 HA TYR 23 -8.327 -0.602 6.705
68 HB2 TYR 23 1HB TYR 23 -7.536 -0.035 3.841
69 HB3 TYR 23 2HB TYR 23 -9.191 -0.376 4.405
70 HD1 TYR 23 HD1 TYR 23 -8.168 1.309 7.086
71 HD2 TYR 23 HD2 TYR 23 -8.738 2.089 2.933
72 HE1 TYR 23 HE1 TYR 23 -8.492 3.712 7.590
73 HE2 TYR 23 HE2 TYR 23 -9.064 4.490 3.418
74 HH TYR 23 HH TYR 23 -8.907 5.779 6.745
75 H ALA 24 H ALA 24 -5.942 -2.021 4.496
76 HA ALA 24 HA ALA 24 -7.390 -4.413 3.946
77 HB1 ALA 24 3HB ALA 24 -4.391 -3.967 4.121
78 HB2 ALA 24 1HB ALA 24 -5.192 -5.364 3.367
79 HB3 ALA 24 2HB ALA 24 -5.402 -3.739 2.676
80 H GLN 25 H GLN 25 -5.209 -3.543 6.606
81 HA GLN 25 HA GLN 25 -5.271 -6.092 7.923
82 HB2 GLN 25 1HB GLN 25 -3.695 -4.280 8.459
83 HB3 GLN 25 2HB GLN 25 -5.047 -3.303 9.078
84 HG2 GLN 25 1HG GLN 25 -5.328 -5.278 10.949
85 HG3 GLN 25 2HG GLN 25 -3.943 -5.816 9.971
86 HE21 GLN 25 2HE2 GLN 25 -3.648 -5.569 12.671
87 HE22 GLN 25 1HE2 GLN 25 -2.652 -4.202 13.046
88 H LYS 26 H LYS 26 -7.345 -3.214 8.266
89 HA LYS 26 HA LYS 26 -9.088 -4.346 10.242
90 HB2 LYS 26 1HB LYS 26 -9.558 -2.273 8.096
91 HB3 LYS 26 2HB LYS 26 -10.723 -2.679 9.379
92 HG2 LYS 26 1HG LYS 26 -9.139 -1.937 11.086
93 HG3 LYS 26 2HG LYS 26 -7.922 -1.594 9.833
94 HD2 LYS 26 1HD LYS 26 -9.432 0.089 8.839
95 HD3 LYS 26 2HD LYS 26 -10.628 -0.242 10.115
96 HE2 LYS 26 1HE LYS 26 -9.009 0.469 11.821
97 HE3 LYS 26 2HE LYS 26 -7.810 0.797 10.548
98 HZ1 LYS 26 3HZ LYS 26 -10.408 2.162 10.848
99 HZ2 LYS 26 1HZ LYS 26 -8.939 2.799 11.243
100 HZ3 LYS 26 2HZ LYS 26 -9.297 2.466 9.667
101 H TYR 27 H TYR 27 -8.861 -4.786 6.787
102 HA TYR 27 HA TYR 27 -11.524 -6.114 6.710
103 HB2 TYR 27 1HB TYR 27 -9.495 -5.558 4.536
104 HB3 TYR 27 2HB TYR 27 -11.115 -6.261 4.307
105 HD1 TYR 27 HD1 TYR 27 -12.066 -4.210 6.673
106 HD2 TYR 27 HD2 TYR 27 -10.275 -3.834 2.821
107 HE1 TYR 27 HE1 TYR 27 -13.024 -1.935 6.459
108 HE2 TYR 27 HE2 TYR 27 -11.224 -1.563 2.590
109 HH TYR 27 HH TYR 27 -13.226 -0.086 5.155
110 H LYS 28 H LYS 28 -8.638 -7.030 7.778
111 HA LYS 28 HA LYS 28 -7.543 -9.075 7.970
112 HB2 LYS 28 1HB LYS 28 -10.280 -10.127 7.238
113 HB3 LYS 28 2HB LYS 28 -8.952 -11.061 7.966
114 HG2 LYS 28 1HG LYS 28 -9.063 -9.632 9.979
115 HG3 LYS 28 2HG LYS 28 -10.414 -8.729 9.252
116 HD2 LYS 28 1HD LYS 28 -11.728 -10.833 9.146
117 HD3 LYS 28 2HD LYS 28 -10.389 -11.684 9.953
118 HE2 LYS 28 1HE LYS 28 -10.625 -10.259 11.916
119 HE3 LYS 28 2HE LYS 28 -11.903 -9.322 11.108
120 HZ1 LYS 28 3HZ LYS 28 -12.060 -12.182 11.815
121 HZ2 LYS 28 1HZ LYS 28 -12.814 -10.952 12.617
122 HZ3 LYS 28 2HZ LYS 28 -13.246 -11.313 11.066
123 H LEU 29 H LEU 29 -7.180 -7.799 5.532
124 HA LEU 29 HA LEU 29 -7.322 -9.993 3.520
125 HB2 LEU 29 1HB LEU 29 -6.485 -7.170 3.396
126 HB3 LEU 29 2HB LEU 29 -6.578 -8.160 1.921
127 HG LEU 29 HG LEU 29 -8.896 -7.297 3.695
128 HD11 LEU 29 1HD1 LEU 29 -9.639 -6.060 1.642
129 HD12 LEU 29 2HD1 LEU 29 -8.034 -5.512 2.183
130 HD13 LEU 29 3HD1 LEU 29 -8.177 -6.619 0.795
131 HD21 LEU 29 3HD2 LEU 29 -9.249 -9.550 2.869
132 HD22 LEU 29 1HD2 LEU 29 -10.346 -8.420 2.039
133 HD23 LEU 29 2HD2 LEU 29 -8.894 -9.027 1.205
134 HA PRO 30 HA PRO 30 -3.230 -11.192 3.793
135 HB2 PRO 30 1HB PRO 30 -3.307 -11.112 1.068
136 HB3 PRO 30 2HB PRO 30 -2.965 -12.340 2.082
137 HG2 PRO 30 1HG PRO 30 -5.324 -11.601 1.260
138 HG3 PRO 30 2HG PRO 30 -4.802 -13.134 1.460
139 HD2 PRO 30 1HD PRO 30 -6.204 -10.150 1.610
140 HD3 PRO 30 2HD PRO 30 -6.159 -11.604 2.350
141 H THR 31 H THR 31 -1.049 -10.538 3.607
142 HA THR 31 HA THR 31 -0.676 -7.722 3.590
143 HB THR 31 HB THR 31 1.384 -9.884 2.981
144 HG1 THR 31 HG1 THR 31 0.316 -10.140 5.020
145 HG21 THR 31 1HG2 THR 31 3.004 -8.209 3.800
146 HG22 THR 31 2HG2 THR 31 2.124 -7.605 2.376
147 HG23 THR 31 3HG2 THR 31 1.686 -7.031 4.002
148 HA PRO 32 HA PRO 32 -1.069 -6.758 -0.587
149 HB2 PRO 32 1HB PRO 32 0.208 -4.527 0.329
150 HB3 PRO 32 2HB PRO 32 -1.196 -4.686 -0.483
151 HG2 PRO 32 1HG PRO 32 -0.855 -4.838 2.096
152 HG3 PRO 32 2HG PRO 32 -2.100 -4.124 1.322
153 HD2 PRO 32 1HD PRO 32 0.014 -6.035 3.019
154 HD3 PRO 32 2HD PRO 32 -1.546 -5.912 2.557
155 H VAL 33 H VAL 33 0.091 -6.971 -2.437
156 HA VAL 33 HA VAL 33 3.074 -7.169 -2.032
157 HB VAL 33 HB VAL 33 1.297 -8.517 -4.108
158 HG11 VAL 33 1HG1 VAL 33 3.372 -9.702 -4.745
159 HG12 VAL 33 2HG1 VAL 33 3.545 -7.944 -4.961
160 HG13 VAL 33 3HG1 VAL 33 4.283 -8.746 -3.553
161 HG21 VAL 33 3HG2 VAL 33 0.993 -9.503 -1.917
162 HG22 VAL 33 1HG2 VAL 33 1.896 -10.603 -2.985
163 HG23 VAL 33 2HG2 VAL 33 2.755 -9.679 -1.730
164 H TYR 34 H TYR 34 4.334 -5.796 -2.919
165 HA TYR 34 HA TYR 34 3.177 -4.033 -5.052
166 HB2 TYR 34 1HB TYR 34 5.442 -3.498 -3.121
167 HB3 TYR 34 2HB TYR 34 4.789 -2.369 -4.335
168 HD1 TYR 34 HD1 TYR 34 3.859 -4.273 -1.256
169 HD2 TYR 34 HD2 TYR 34 2.991 -0.951 -3.785
170 HE1 TYR 34 HE1 TYR 34 2.212 -3.451 0.402
171 HE2 TYR 34 HE2 TYR 34 1.344 -0.117 -2.142
172 HH TYR 34 HH TYR 34 0.338 -0.462 -0.128
173 H GLU 35 H GLU 35 3.956 -4.096 -6.998
174 HA GLU 35 HA GLU 35 6.788 -5.005 -7.367
175 HB2 GLU 35 1HB GLU 35 4.385 -5.736 -9.050
176 HB3 GLU 35 2HB GLU 35 6.083 -6.085 -9.460
177 HG2 GLU 35 1HG GLU 35 6.218 -7.561 -7.377
178 HG3 GLU 35 2HG GLU 35 4.521 -7.095 -7.120
179 H ILE 36 H ILE 36 7.990 -3.994 -8.862
180 HA ILE 36 HA ILE 36 6.683 -1.723 -10.336
181 HB ILE 36 HB ILE 36 9.393 -1.719 -8.928
182 HG12 ILE 36 1HG1 ILE 36 6.949 -0.062 -8.366
183 HG13 ILE 36 2HG1 ILE 36 7.424 -1.517 -7.460
184 HG21 ILE 36 1HG2 ILE 36 9.519 0.630 -9.685
185 HG22 ILE 36 2HG2 ILE 36 9.416 -0.483 -11.068
186 HG23 ILE 36 3HG2 ILE 36 7.980 0.433 -10.556
187 HD11 ILE 36 3HD1 ILE 36 9.055 1.035 -7.708
188 HD12 ILE 36 1HD1 ILE 36 8.119 0.532 -6.282
189 HD13 ILE 36 2HD1 ILE 36 9.530 -0.419 -6.802
190 H VAL 37 H VAL 37 6.941 -1.652 -12.383
191 HA VAL 37 HA VAL 37 9.089 -3.390 -13.594
192 HB VAL 37 HB VAL 37 6.416 -2.511 -14.766
193 HG11 VAL 37 1HG1 VAL 37 7.010 -4.055 -16.603
194 HG12 VAL 37 2HG1 VAL 37 8.211 -2.751 -16.449
195 HG13 VAL 37 3HG1 VAL 37 8.576 -4.379 -15.826
196 HG21 VAL 37 3HG2 VAL 37 6.098 -4.159 -13.018
197 HG22 VAL 37 1HG2 VAL 37 5.788 -4.867 -14.620
198 HG23 VAL 37 2HG2 VAL 37 7.312 -5.220 -13.771
199 H LYS 38 H LYS 38 10.636 -2.548 -14.675
200 HA LYS 38 HA LYS 38 10.368 0.319 -15.501
201 HB2 LYS 38 1HB LYS 38 12.182 -0.239 -13.926
202 HB3 LYS 38 2HB LYS 38 12.835 -1.384 -15.121
203 HG2 LYS 38 1HG LYS 38 13.185 0.492 -16.699
204 HG3 LYS 38 2HG LYS 38 12.581 1.624 -15.466
205 HD2 LYS 38 1HD LYS 38 14.412 0.955 -13.957
206 HD3 LYS 38 2HD LYS 38 15.017 -0.171 -15.195
207 HE2 LYS 38 1HE LYS 38 15.382 1.710 -16.732
208 HE3 LYS 38 2HE LYS 38 14.771 2.838 -15.499
209 HZ1 LYS 38 3HZ LYS 38 17.171 1.143 -15.234
210 HZ2 LYS 38 1HZ LYS 38 17.171 2.765 -15.528
211 HZ3 LYS 38 2HZ LYS 38 16.605 2.188 -14.090
212 H GLU 39 H GLU 39 10.069 0.783 -17.518
213 HA GLU 39 HA GLU 39 11.114 -1.106 -19.593
214 HB2 GLU 39 1HB GLU 39 8.384 0.186 -19.485
215 HB3 GLU 39 2HB GLU 39 9.061 -0.665 -20.894
216 HG2 GLU 39 1HG GLU 39 9.149 -2.795 -19.468
217 HG3 GLU 39 2HG GLU 39 8.442 -1.780 -18.191
218 H GLY 40 H GLY 40 11.416 -0.210 -21.683
219 HA2 GLY 40 1HA GLY 40 11.379 1.726 -23.156
220 HA3 GLY 40 2HA GLY 40 11.530 2.774 -21.727
221 HA PRO 41 HA PRO 41 15.645 1.941 -23.723
222 HB2 PRO 41 1HB PRO 41 16.116 4.368 -24.225
223 HB3 PRO 41 2HB PRO 41 15.302 3.384 -25.237
224 HG2 PRO 41 1HG PRO 41 14.294 5.245 -23.717
225 HG3 PRO 41 2HG PRO 41 13.843 4.888 -25.244
226 HD2 PRO 41 1HD PRO 41 12.479 4.070 -23.347
227 HD3 PRO 41 2HD PRO 41 12.731 3.143 -24.666
228 H SER 42 H SER 42 17.728 2.361 -22.867
229 HA SER 42 HA SER 42 17.791 2.738 -20.011
230 HB2 SER 42 1HB SER 42 20.068 2.690 -20.154
231 HB3 SER 42 2HB SER 42 19.376 1.470 -21.247
232 HG SER 42 HG SER 42 19.763 2.942 -22.964
233 H HIS 43 H HIS 43 17.767 4.983 -22.693
234 HA HIS 43 HA HIS 43 18.882 7.199 -21.088
235 HB2 HIS 43 1HB HIS 43 17.717 7.097 -23.908
236 HB3 HIS 43 2HB HIS 43 18.414 8.547 -23.147
237 HD2 HIS 43 HD2 HIS 43 19.607 5.771 -25.491
238 HE1 HIS 43 HE1 HIS 43 23.010 7.195 -23.385
239 HE2 HIS 43 HE2 HIS 43 22.107 5.772 -25.403
240 H LYS 44 H LYS 44 15.740 6.170 -22.375
241 HA LYS 44 HA LYS 44 14.478 8.124 -20.484
242 HB2 LYS 44 1HB LYS 44 13.602 7.404 -23.284
243 HB3 LYS 44 2HB LYS 44 12.649 8.357 -22.122
244 HG2 LYS 44 1HG LYS 44 14.447 10.069 -22.097
245 HG3 LYS 44 2HG LYS 44 15.330 9.129 -23.323
246 HD2 LYS 44 1HD LYS 44 13.430 9.373 -24.875
247 HD3 LYS 44 2HD LYS 44 12.556 10.321 -23.649
248 HE2 LYS 44 1HE LYS 44 14.326 12.019 -23.687
249 HE3 LYS 44 2HE LYS 44 15.220 11.067 -24.895
250 HZ1 LYS 44 3HZ LYS 44 12.545 12.251 -25.282
251 HZ2 LYS 44 1HZ LYS 44 13.953 12.835 -25.914
252 HZ3 LYS 44 2HZ LYS 44 13.374 11.370 -26.403
253 H SER 45 H SER 45 14.590 6.232 -19.070
254 HA SER 45 HA SER 45 12.765 3.953 -19.687
255 HB2 SER 45 1HB SER 45 14.534 4.561 -17.400
256 HB3 SER 45 2HB SER 45 13.429 3.172 -17.520
257 HG SER 45 HG SER 45 15.488 3.812 -19.366
258 H LEU 46 H LEU 46 10.735 3.761 -18.957
259 HA LEU 46 HA LEU 46 9.777 5.735 -16.911
260 HB2 LEU 46 1HB LEU 46 8.372 4.192 -18.993
261 HB3 LEU 46 2HB LEU 46 7.473 5.268 -17.898
262 HG LEU 46 HG LEU 46 9.527 6.095 -19.986
263 HD11 LEU 46 1HD1 LEU 46 7.571 7.241 -21.059
264 HD12 LEU 46 2HD1 LEU 46 7.302 5.487 -20.931
265 HD13 LEU 46 3HD1 LEU 46 6.512 6.595 -19.784
266 HD21 LEU 46 3HD2 LEU 46 9.690 7.496 -18.013
267 HD22 LEU 46 1HD2 LEU 46 8.961 8.415 -19.352
268 HD23 LEU 46 2HD2 LEU 46 7.934 7.788 -18.041
269 H PHE 47 H PHE 47 8.566 5.081 -15.202
270 HA PHE 47 HA PHE 47 8.758 2.151 -14.615
271 HB2 PHE 47 1HB PHE 47 8.522 4.574 -12.780
272 HB3 PHE 47 2HB PHE 47 8.463 2.885 -12.229
273 HD1 PHE 47 HD2 PHE 47 10.444 1.462 -12.378
274 HD2 PHE 47 HD1 PHE 47 10.559 5.620 -13.355
275 HE1 PHE 47 HE2 PHE 47 12.908 1.439 -12.182
276 HE2 PHE 47 HE1 PHE 47 13.024 5.600 -13.161
277 HZ PHE 47 HZ PHE 47 14.198 3.508 -12.574
278 H GLN 48 H GLN 48 7.059 0.983 -13.850
279 HA GLN 48 HA GLN 48 4.507 2.374 -13.307
280 HB2 GLN 48 1HB GLN 48 4.459 1.802 -15.719
281 HB3 GLN 48 2HB GLN 48 4.731 0.097 -15.286
282 HG2 GLN 48 1HG GLN 48 2.323 0.405 -13.916
283 HG3 GLN 48 2HG GLN 48 2.534 1.897 -14.863
284 HE21 GLN 48 2HE2 GLN 48 0.319 0.199 -15.146
285 HE22 GLN 48 1HE2 GLN 48 0.372 -0.526 -16.719
286 H SER 49 H SER 49 3.423 1.538 -11.676
287 HA SER 49 HA SER 49 4.652 -0.910 -10.379
288 HB2 SER 49 1HB SER 49 5.205 1.002 -9.220
289 HB3 SER 49 2HB SER 49 3.508 1.533 -9.169
290 HG SER 49 HG SER 49 4.554 -0.843 -8.021
291 H THR 50 H THR 50 3.293 -2.371 -9.367
292 HA THR 50 HA THR 50 0.348 -1.974 -9.670
293 HB THR 50 HB THR 50 1.188 -3.440 -11.548
294 HG1 THR 50 HG1 THR 50 -0.891 -3.847 -11.003
295 HG21 THR 50 1HG2 THR 50 1.917 -5.728 -10.967
296 HG22 THR 50 2HG2 THR 50 3.048 -4.513 -10.324
297 HG23 THR 50 3HG2 THR 50 1.878 -5.302 -9.240
298 H VAL 51 H VAL 51 -0.909 -2.744 -8.093
299 HA VAL 51 HA VAL 51 0.512 -4.023 -5.758
300 HB VAL 51 HB VAL 51 -1.779 -2.014 -5.715
301 HG11 VAL 51 1HG1 VAL 51 -1.489 -2.121 -3.262
302 HG12 VAL 51 2HG1 VAL 51 -1.923 -3.714 -3.926
303 HG13 VAL 51 3HG1 VAL 51 -0.239 -3.371 -3.464
304 HG21 VAL 51 3HG2 VAL 51 0.321 -0.938 -6.265
305 HG22 VAL 51 1HG2 VAL 51 -0.192 -0.517 -4.614
306 HG23 VAL 51 2HG2 VAL 51 1.105 -1.710 -4.865
307 H ILE 52 H ILE 52 -0.086 -5.926 -5.250
308 HA ILE 52 HA ILE 52 -2.817 -6.841 -6.107
309 HB ILE 52 HB ILE 52 -0.321 -8.447 -5.385
310 HG12 ILE 52 1HG1 ILE 52 -1.678 -8.131 -8.049
311 HG13 ILE 52 2HG1 ILE 52 -0.234 -7.230 -7.529
312 HG21 ILE 52 1HG2 ILE 52 -1.645 -10.395 -6.134
313 HG22 ILE 52 2HG2 ILE 52 -2.419 -9.589 -4.751
314 HG23 ILE 52 3HG2 ILE 52 -3.053 -9.339 -6.395
315 HD11 ILE 52 3HD1 ILE 52 -0.440 -10.248 -7.815
316 HD12 ILE 52 1HD1 ILE 52 0.378 -9.148 -8.949
317 HD13 ILE 52 2HD1 ILE 52 1.004 -9.348 -7.296
318 H LEU 53 H LEU 53 -4.328 -6.945 -4.718
319 HA LEU 53 HA LEU 53 -3.605 -7.622 -1.892
320 HB2 LEU 53 1HB LEU 53 -3.919 -5.364 -2.014
321 HB3 LEU 53 2HB LEU 53 -5.484 -5.402 -2.859
322 HG LEU 53 HG LEU 53 -6.412 -6.631 -0.843
323 HD11 LEU 53 1HD1 LEU 53 -5.141 -6.353 1.302
324 HD12 LEU 53 2HD1 LEU 53 -4.224 -7.328 0.129
325 HD13 LEU 53 3HD1 LEU 53 -3.799 -5.620 0.394
326 HD21 LEU 53 3HD2 LEU 53 -6.892 -4.290 -1.249
327 HD22 LEU 53 1HD2 LEU 53 -6.696 -4.575 0.497
328 HD23 LEU 53 2HD2 LEU 53 -5.385 -3.809 -0.433
329 H ASP 54 H ASP 54 -4.576 -9.315 -1.137
330 HA ASP 54 HA ASP 54 -6.022 -11.131 -1.025
331 HB2 ASP 54 1HB ASP 54 -7.638 -9.056 -0.512
332 HB3 ASP 54 2HB ASP 54 -8.057 -9.387 -2.211
333 H GLY 55 H GLY 55 -4.530 -10.655 -3.481
334 HA2 GLY 55 1HA GLY 55 -4.309 -12.033 -5.356
335 HA3 GLY 55 2HA GLY 55 -5.927 -12.700 -5.039
336 H VAL 56 H VAL 56 -5.987 -9.334 -4.943
337 HA VAL 56 HA VAL 56 -7.038 -9.207 -7.766
338 HB VAL 56 HB VAL 56 -7.648 -7.410 -5.382
339 HG11 VAL 56 1HG1 VAL 56 -9.387 -6.477 -6.872
340 HG12 VAL 56 2HG1 VAL 56 -7.763 -6.263 -7.569
341 HG13 VAL 56 3HG1 VAL 56 -8.834 -7.545 -8.185
342 HG21 VAL 56 3HG2 VAL 56 -8.612 -9.609 -5.059
343 HG22 VAL 56 1HG2 VAL 56 -9.877 -8.412 -5.422
344 HG23 VAL 56 2HG2 VAL 56 -9.342 -9.548 -6.682
345 H ARG 57 H ARG 57 -5.758 -8.403 -9.173
346 HA ARG 57 HA ARG 57 -3.477 -6.753 -8.288
347 HB2 ARG 57 1HB ARG 57 -3.164 -8.564 -9.860
348 HB3 ARG 57 2HB ARG 57 -4.185 -7.696 -11.030
349 HG2 ARG 57 1HG ARG 57 -2.586 -5.847 -11.083
350 HG3 ARG 57 2HG ARG 57 -1.574 -6.673 -9.873
351 HD2 ARG 57 1HD ARG 57 -1.169 -8.468 -11.441
352 HD3 ARG 57 2HD ARG 57 -2.179 -7.641 -12.650
353 HE ARG 57 HE ARG 57 0.094 -5.942 -11.902
354 HH11 ARG 57 1HH1 ARG 57 -0.702 -8.764 -13.790
355 HH12 ARG 57 2HH1 ARG 57 0.630 -8.421 -14.876
356 HH21 ARG 57 1HH2 ARG 57 1.629 -5.541 -13.131
357 HH22 ARG 57 2HH2 ARG 57 1.961 -6.583 -14.501
358 H TYR 58 H TYR 58 -3.542 -4.674 -8.082
359 HA TYR 58 HA TYR 58 -5.381 -3.116 -9.867
360 HB2 TYR 58 1HB TYR 58 -3.994 -2.292 -7.308
361 HB3 TYR 58 2HB TYR 58 -5.128 -1.310 -8.267
362 HD1 TYR 58 HD2 TYR 58 -7.522 -2.252 -8.558
363 HD2 TYR 58 HD1 TYR 58 -4.812 -3.647 -5.575
364 HE1 TYR 58 HE2 TYR 58 -9.424 -3.178 -7.278
365 HE2 TYR 58 HE1 TYR 58 -6.706 -4.580 -4.279
366 HH TYR 58 HH TYR 58 -10.078 -4.301 -5.408
367 H ASN 59 H ASN 59 -4.614 -1.984 -11.458
368 HA ASN 59 HA ASN 59 -1.636 -1.633 -11.575
369 HB2 ASN 59 1HB ASN 59 -3.476 -1.867 -14.069
370 HB3 ASN 59 2HB ASN 59 -1.759 -1.551 -13.715
371 HD21 ASN 59 2HD2 ASN 59 -4.185 -3.892 -14.171
372 HD22 ASN 59 1HD2 ASN 59 -3.226 -5.301 -13.858
373 H SER 60 H SER 60 -0.793 0.292 -11.608
374 HA SER 60 HA SER 60 -2.511 2.721 -11.935
375 HB2 SER 60 1HB SER 60 -0.729 3.945 -11.217
376 HB3 SER 60 2HB SER 60 -0.977 2.567 -10.120
377 HG SER 60 HG SER 60 0.981 2.746 -12.166
378 H LEU 61 H LEU 61 -1.631 4.476 -13.296
379 HA LEU 61 HA LEU 61 -1.017 3.505 -15.993
380 HB2 LEU 61 1HB LEU 61 -1.216 6.164 -14.740
381 HB3 LEU 61 2HB LEU 61 -1.024 6.029 -16.504
382 HG LEU 61 HG LEU 61 -3.387 5.068 -14.843
383 HD11 LEU 61 1HD1 LEU 61 -4.654 6.793 -16.155
384 HD12 LEU 61 2HD1 LEU 61 -3.334 7.532 -15.220
385 HD13 LEU 61 3HD1 LEU 61 -3.142 7.261 -16.968
386 HD21 LEU 61 3HD2 LEU 61 -2.938 3.533 -16.665
387 HD22 LEU 61 1HD2 LEU 61 -4.420 4.458 -17.003
388 HD23 LEU 61 2HD2 LEU 61 -2.899 4.878 -17.829
389 HA PRO 62 HA PRO 62 3.241 3.785 -15.746
390 HB2 PRO 62 1HB PRO 62 3.743 3.740 -18.193
391 HB3 PRO 62 2HB PRO 62 3.088 2.465 -17.417
392 HG2 PRO 62 1HG PRO 62 1.870 4.107 -19.033
393 HG3 PRO 62 2HG PRO 62 1.658 2.493 -18.949
394 HD2 PRO 62 1HD PRO 62 -0.029 3.808 -17.746
395 HD3 PRO 62 2HD PRO 62 0.531 2.445 -17.045
396 H GLY 63 H GLY 63 5.181 5.008 -16.571
397 HA2 GLY 63 1HA GLY 63 5.930 6.978 -17.800
398 HA3 GLY 63 2HA GLY 63 4.357 7.738 -17.465
399 H PHE 64 H PHE 64 5.982 5.899 -14.986
400 HA PHE 64 HA PHE 64 6.371 8.358 -13.380
401 HB2 PHE 64 1HB PHE 64 6.693 5.393 -12.760
402 HB3 PHE 64 2HB PHE 64 7.059 6.694 -11.604
403 HD1 PHE 64 HD2 PHE 64 5.128 8.401 -11.201
404 HD2 PHE 64 HD1 PHE 64 4.618 4.456 -12.759
405 HE1 PHE 64 HE2 PHE 64 2.767 8.418 -10.466
406 HE2 PHE 64 HE1 PHE 64 2.256 4.471 -12.029
407 HZ PHE 64 HZ PHE 64 1.331 6.452 -10.883
408 H PHE 65 H PHE 65 8.297 8.977 -12.417
409 HA PHE 65 HA PHE 65 10.710 8.127 -13.989
410 HB2 PHE 65 1HB PHE 65 10.111 10.800 -12.646
411 HB3 PHE 65 2HB PHE 65 11.603 10.385 -13.521
412 HD1 PHE 65 HD2 PHE 65 11.416 9.797 -15.975
413 HD2 PHE 65 HD1 PHE 65 8.291 11.680 -13.752
414 HE1 PHE 65 HE2 PHE 65 10.408 10.607 -18.082
415 HE2 PHE 65 HE1 PHE 65 7.279 12.489 -15.857
416 HZ PHE 65 HZ PHE 65 8.337 11.953 -18.023
417 H ASN 66 H ASN 66 9.317 7.423 -11.207
418 HA ASN 66 HA ASN 66 11.905 6.842 -9.917
419 HB2 ASN 66 1HB ASN 66 11.017 9.277 -8.978
420 HB3 ASN 66 2HB ASN 66 9.815 8.073 -8.451
421 HD21 ASN 66 2HD2 ASN 66 10.478 9.007 -6.351
422 HD22 ASN 66 1HD2 ASN 66 11.811 8.266 -5.528
423 H ARG 67 H ARG 67 11.898 5.089 -8.675
424 HA ARG 67 HA ARG 67 9.723 3.238 -8.971
425 HB2 ARG 67 1HB ARG 67 12.130 3.214 -7.219
426 HB3 ARG 67 2HB ARG 67 10.908 1.922 -7.245
427 HG2 ARG 67 1HG ARG 67 11.343 1.735 -9.739
428 HG3 ARG 67 2HG ARG 67 12.746 2.801 -9.485
429 HD2 ARG 67 1HD ARG 67 12.311 0.144 -8.157
430 HD3 ARG 67 2HD ARG 67 13.322 0.436 -9.592
431 HE ARG 67 HE ARG 67 14.137 1.130 -6.806
432 HH11 ARG 67 1HH1 ARG 67 14.801 1.476 -10.212
433 HH12 ARG 67 2HH1 ARG 67 16.438 1.987 -9.848
434 HH21 ARG 67 1HH2 ARG 67 16.010 1.705 -6.373
435 HH22 ARG 67 2HH2 ARG 67 17.128 2.117 -7.658
436 H LYS 68 H LYS 68 10.739 5.278 -6.240
437 HA LYS 68 HA LYS 68 8.750 4.265 -4.418
438 HB2 LYS 68 1HB LYS 68 10.280 6.864 -4.543
439 HB3 LYS 68 2HB LYS 68 9.179 6.423 -3.217
440 HG2 LYS 68 1HG LYS 68 10.577 4.460 -2.709
441 HG3 LYS 68 2HG LYS 68 11.679 4.905 -4.033
442 HD2 LYS 68 1HD LYS 68 12.159 7.047 -2.900
443 HD3 LYS 68 2HD LYS 68 11.080 6.573 -1.566
444 HE2 LYS 68 1HE LYS 68 12.507 4.640 -1.084
445 HE3 LYS 68 2HE LYS 68 13.576 5.082 -2.434
446 HZ1 LYS 68 3HZ LYS 68 13.087 6.718 -0.028
447 HZ2 LYS 68 1HZ LYS 68 14.448 5.834 -0.327
448 HZ3 LYS 68 2HZ LYS 68 14.079 7.129 -1.281
449 H ALA 69 H ALA 69 8.767 6.986 -6.695
450 HA ALA 69 HA ALA 69 6.208 8.018 -5.943
451 HB1 ALA 69 3HB ALA 69 7.623 8.107 -8.629
452 HB2 ALA 69 1HB ALA 69 6.237 9.113 -8.149
453 HB3 ALA 69 2HB ALA 69 7.797 9.290 -7.312
454 H ALA 70 H ALA 70 7.167 5.605 -8.378
455 HA ALA 70 HA ALA 70 4.561 5.159 -9.435
456 HB1 ALA 70 3HB ALA 70 6.891 3.229 -9.175
457 HB2 ALA 70 1HB ALA 70 5.470 3.008 -10.221
458 HB3 ALA 70 2HB ALA 70 6.602 4.346 -10.529
459 H GLU 71 H GLU 71 6.267 3.635 -6.709
460 HA GLU 71 HA GLU 71 4.230 1.655 -6.209
461 HB2 GLU 71 1HB GLU 71 6.560 1.496 -5.429
462 HB3 GLU 71 2HB GLU 71 6.267 2.869 -4.334
463 HG2 GLU 71 1HG GLU 71 4.555 1.461 -3.092
464 HG3 GLU 71 2HG GLU 71 4.904 0.208 -4.305
465 H GLN 72 H GLN 72 4.838 4.881 -4.842
466 HA GLN 72 HA GLN 72 2.729 4.754 -2.897
467 HB2 GLN 72 1HB GLN 72 4.596 6.386 -2.900
468 HB3 GLN 72 2HB GLN 72 3.874 7.159 -4.332
469 HG2 GLN 72 1HG GLN 72 3.001 8.550 -2.332
470 HG3 GLN 72 2HG GLN 72 1.902 7.393 -3.118
471 HE21 GLN 72 2HE2 GLN 72 0.567 7.314 -1.278
472 HE22 GLN 72 1HE2 GLN 72 1.041 6.465 0.156
473 H SER 73 H SER 73 2.803 5.937 -6.247
474 HA SER 73 HA SER 73 0.101 6.980 -6.337
475 HB2 SER 73 1HB SER 73 1.915 6.033 -8.470
476 HB3 SER 73 2HB SER 73 0.328 6.800 -8.702
477 HG SER 73 HG SER 73 2.542 7.920 -7.327
478 H ALA 74 H ALA 74 1.548 3.809 -7.178
479 HA ALA 74 HA ALA 74 -0.884 2.630 -8.121
480 HB1 ALA 74 3HB ALA 74 1.582 1.315 -6.930
481 HB2 ALA 74 1HB ALA 74 0.302 0.487 -7.847
482 HB3 ALA 74 2HB ALA 74 1.326 1.703 -8.647
483 H ALA 75 H ALA 75 0.583 2.843 -4.909
484 HA ALA 75 HA ALA 75 -1.324 1.162 -3.583
485 HB1 ALA 75 3HB ALA 75 0.268 3.519 -2.521
486 HB2 ALA 75 1HB ALA 75 -0.582 2.309 -1.533
487 HB3 ALA 75 2HB ALA 75 0.798 1.820 -2.546
488 H GLU 76 H GLU 76 -1.293 4.632 -4.330
489 HA GLU 76 HA GLU 76 -3.753 5.255 -2.968
490 HB2 GLU 76 1HB GLU 76 -2.315 6.513 -5.304
491 HB3 GLU 76 2HB GLU 76 -3.807 7.177 -4.592
492 HG2 GLU 76 1HG GLU 76 -2.604 7.535 -2.414
493 HG3 GLU 76 2HG GLU 76 -1.231 6.684 -3.158
494 H VAL 77 H VAL 77 -3.041 4.095 -6.238
495 HA VAL 77 HA VAL 77 -5.777 4.220 -7.201
496 HB VAL 77 HB VAL 77 -3.404 2.489 -8.002
497 HG11 VAL 77 1HG1 VAL 77 -4.729 1.934 -10.014
498 HG12 VAL 77 2HG1 VAL 77 -5.536 1.356 -8.538
499 HG13 VAL 77 3HG1 VAL 77 -6.115 2.831 -9.350
500 HG21 VAL 77 3HG2 VAL 77 -3.088 4.851 -8.435
501 HG22 VAL 77 1HG2 VAL 77 -3.314 3.955 -9.955
502 HG23 VAL 77 2HG2 VAL 77 -4.650 4.923 -9.288
503 H ALA 78 H ALA 78 -3.905 1.593 -5.692
504 HA ALA 78 HA ALA 78 -6.068 -0.271 -5.690
505 HB1 ALA 78 3HB ALA 78 -3.720 -0.025 -3.779
506 HB2 ALA 78 1HB ALA 78 -4.778 -1.445 -3.950
507 HB3 ALA 78 2HB ALA 78 -3.740 -0.942 -5.304
508 H LEU 79 H LEU 79 -5.186 2.338 -3.495
509 HA LEU 79 HA LEU 79 -7.045 1.638 -1.405
510 HB2 LEU 79 1HB LEU 79 -5.245 3.028 -1.076
511 HB3 LEU 79 2HB LEU 79 -5.770 4.315 -2.186
512 HG LEU 79 HG LEU 79 -7.794 4.638 -0.728
513 HD11 LEU 79 1HD1 LEU 79 -7.678 3.721 1.605
514 HD12 LEU 79 2HD1 LEU 79 -7.739 2.414 0.399
515 HD13 LEU 79 3HD1 LEU 79 -6.193 2.844 1.170
516 HD21 LEU 79 3HD2 LEU 79 -5.897 6.140 -0.588
517 HD22 LEU 79 1HD2 LEU 79 -6.597 5.895 1.029
518 HD23 LEU 79 2HD2 LEU 79 -5.091 5.061 0.576
519 H ARG 80 H ARG 80 -7.296 3.841 -4.195
520 HA ARG 80 HA ARG 80 -9.968 4.711 -3.611
521 HB2 ARG 80 1HB ARG 80 -8.425 4.635 -6.159
522 HB3 ARG 80 2HB ARG 80 -10.076 5.281 -6.006
523 HG2 ARG 80 1HG ARG 80 -9.305 6.959 -4.417
524 HG3 ARG 80 2HG ARG 80 -7.658 6.284 -4.472
525 HD2 ARG 80 1HD ARG 80 -7.495 6.896 -6.810
526 HD3 ARG 80 2HD ARG 80 -9.133 7.586 -6.738
527 HE ARG 80 HE ARG 80 -7.545 9.031 -4.820
528 HH11 ARG 80 1HH1 ARG 80 -7.544 8.529 -8.271
529 HH12 ARG 80 2HH1 ARG 80 -6.849 10.120 -8.508
530 HH21 ARG 80 1HH2 ARG 80 -6.741 10.853 -5.076
531 HH22 ARG 80 2HH2 ARG 80 -6.390 11.446 -6.687
532 H GLU 81 H GLU 81 -8.712 1.922 -5.377
533 HA GLU 81 HA GLU 81 -11.346 1.059 -6.288
534 HB2 GLU 81 1HB GLU 81 -8.704 -0.382 -6.012
535 HB3 GLU 81 2HB GLU 81 -10.170 -1.075 -6.746
536 HG2 GLU 81 1HG GLU 81 -8.723 1.410 -7.842
537 HG3 GLU 81 2HG GLU 81 -8.518 -0.285 -8.339
538 H LEU 82 H LEU 82 -9.284 0.358 -3.501
539 HA LEU 82 HA LEU 82 -10.925 -1.763 -2.451
540 HB2 LEU 82 1HB LEU 82 -8.718 -1.407 -1.857
541 HB3 LEU 82 2HB LEU 82 -8.983 0.159 -1.056
542 HG LEU 82 HG LEU 82 -10.495 -1.013 0.573
543 HD11 LEU 82 1HD1 LEU 82 -10.285 -3.508 0.738
544 HD12 LEU 82 2HD1 LEU 82 -10.983 -3.019 -0.824
545 HD13 LEU 82 3HD1 LEU 82 -9.274 -3.505 -0.726
546 HD21 LEU 82 3HD2 LEU 82 -8.212 -0.451 1.168
547 HD22 LEU 82 1HD2 LEU 82 -8.662 -2.010 1.899
548 HD23 LEU 82 2HD2 LEU 82 -7.621 -1.970 0.455
549 H ALA 83 H ALA 83 -11.030 1.749 -2.121
550 HA ALA 83 HA ALA 83 -12.865 1.808 0.068
551 HB1 ALA 83 3HB ALA 83 -12.424 3.839 -2.148
552 HB2 ALA 83 1HB ALA 83 -13.280 4.139 -0.619
553 HB3 ALA 83 2HB ALA 83 -11.541 3.762 -0.606
554 H LYS 84 H LYS 84 -13.298 1.141 -3.300
555 HA LYS 84 HA LYS 84 -16.057 1.899 -3.556
556 HB2 LYS 84 1HB LYS 84 -14.384 -0.188 -4.955
557 HB3 LYS 84 2HB LYS 84 -16.056 0.216 -5.408
558 HG2 LYS 84 1HG LYS 84 -15.372 2.527 -5.897
559 HG3 LYS 84 2HG LYS 84 -13.699 2.132 -5.435
560 HD2 LYS 84 1HD LYS 84 -13.582 0.474 -7.246
561 HD3 LYS 84 2HD LYS 84 -15.261 0.849 -7.702
562 HE2 LYS 84 1HE LYS 84 -14.620 3.161 -8.207
563 HE3 LYS 84 2HE LYS 84 -12.944 2.808 -7.727
564 HZ1 LYS 84 3HZ LYS 84 -14.386 1.548 -9.971
565 HZ2 LYS 84 1HZ LYS 84 -13.226 2.712 -10.109
566 HZ3 LYS 84 2HZ LYS 84 -12.832 1.219 -9.526
567 H SER 85 H SER 85 -14.515 -0.779 -1.991
568 HA SER 85 HA SER 85 -16.892 -2.554 -2.016
569 HB2 SER 85 1HB SER 85 -15.654 -4.045 -0.842
570 HB3 SER 85 2HB SER 85 -14.650 -3.384 -2.153
571 HG SER 85 HG SER 85 -13.527 -3.535 -0.163
572 H SER 86 H SER 86 -15.912 0.214 -0.281
573 HA SER 86 HA SER 86 -16.686 -0.405 2.437
574 HB2 SER 86 1HB SER 86 -15.310 1.407 1.910
575 HB3 SER 86 2HB SER 86 -16.634 2.188 1.014
576 HG SER 86 HG SER 86 -17.823 2.182 2.977
Start of MODEL 10
1 H PHE 16 H PHE 16 -1.429 2.610 -0.764
2 HA PHE 16 HA PHE 16 -3.696 1.278 0.889
3 HB2 PHE 16 1HB PHE 16 -2.566 -0.973 0.931
4 HB3 PHE 16 2HB PHE 16 -2.921 -0.394 -0.712
5 HD1 PHE 16 HD1 PHE 16 -0.308 -1.138 1.733
6 HD2 PHE 16 HD2 PHE 16 -1.168 0.236 -2.219
7 HE1 PHE 16 HE1 PHE 16 2.056 -1.486 1.100
8 HE2 PHE 16 HE2 PHE 16 1.195 -0.114 -2.857
9 HZ PHE 16 HZ PHE 16 2.808 -0.974 -1.196
10 H LYS 17 H LYS 17 -0.460 2.405 1.285
11 HA LYS 17 HA LYS 17 0.278 1.127 3.703
12 HB2 LYS 17 1HB LYS 17 0.878 3.916 2.708
13 HB3 LYS 17 2HB LYS 17 1.678 3.135 4.092
14 HG2 LYS 17 1HG LYS 17 2.547 1.380 2.597
15 HG3 LYS 17 2HG LYS 17 1.752 2.167 1.214
16 HD2 LYS 17 1HD LYS 17 3.106 4.201 1.614
17 HD3 LYS 17 2HD LYS 17 3.927 3.372 2.959
18 HE2 LYS 17 1HE LYS 17 4.782 1.677 1.418
19 HE3 LYS 17 2HE LYS 17 3.925 2.454 0.068
20 HZ1 LYS 17 3HZ LYS 17 6.085 3.680 1.659
21 HZ2 LYS 17 1HZ LYS 17 6.242 3.082 0.131
22 HZ3 LYS 17 2HZ LYS 17 5.292 4.402 0.406
23 H SER 18 H SER 18 -0.305 1.220 5.725
24 HA SER 18 HA SER 18 -1.158 2.175 7.762
25 HB2 SER 18 1HB SER 18 -0.165 4.218 6.948
26 HB3 SER 18 2HB SER 18 -1.732 4.616 6.205
27 HG SER 18 HG SER 18 -2.654 4.414 8.296
28 H ARG 19 H ARG 19 -3.159 3.703 5.218
29 HA ARG 19 HA ARG 19 -5.567 3.326 6.737
30 HB2 ARG 19 1HB ARG 19 -5.270 5.134 5.191
31 HB3 ARG 19 2HB ARG 19 -5.265 3.978 3.839
32 HG2 ARG 19 1HG ARG 19 -7.563 3.344 4.328
33 HG3 ARG 19 2HG ARG 19 -7.578 4.409 5.754
34 HD2 ARG 19 1HD ARG 19 -7.315 6.335 4.312
35 HD3 ARG 19 2HD ARG 19 -7.313 5.266 2.890
36 HE ARG 19 HE ARG 19 -9.839 4.922 4.281
37 HH11 ARG 19 1HH1 ARG 19 -8.154 7.363 2.448
38 HH12 ARG 19 2HH1 ARG 19 -9.685 8.016 1.899
39 HH21 ARG 19 1HH2 ARG 19 -11.601 5.664 3.668
40 HH22 ARG 19 2HH2 ARG 19 -11.651 7.049 2.595
41 H LEU 20 H LEU 20 -4.873 1.944 3.513
42 HA LEU 20 HA LEU 20 -6.916 -0.050 3.730
43 HB2 LEU 20 1HB LEU 20 -5.578 0.930 1.828
44 HB3 LEU 20 2HB LEU 20 -4.438 -0.425 2.004
45 HG LEU 20 HG LEU 20 -7.429 -0.631 1.477
46 HD11 LEU 20 1HD1 LEU 20 -6.708 -1.584 -0.729
47 HD12 LEU 20 2HD1 LEU 20 -6.109 0.078 -0.516
48 HD13 LEU 20 3HD1 LEU 20 -5.010 -1.303 -0.278
49 HD21 LEU 20 3HD2 LEU 20 -6.655 -2.444 2.889
50 HD22 LEU 20 1HD2 LEU 20 -7.022 -3.057 1.260
51 HD23 LEU 20 2HD2 LEU 20 -5.332 -2.801 1.755
52 H GLN 21 H GLN 21 -3.446 -0.146 4.464
53 HA GLN 21 HA GLN 21 -3.188 -2.883 5.075
54 HB2 GLN 21 1HB GLN 21 -1.347 -1.255 5.064
55 HB3 GLN 21 2HB GLN 21 -2.011 -0.509 6.536
56 HG2 GLN 21 1HG GLN 21 -1.492 -2.891 7.744
57 HG3 GLN 21 2HG GLN 21 -0.984 -3.166 6.062
58 HE21 GLN 21 2HE2 GLN 21 0.776 -3.637 8.105
59 HE22 GLN 21 1HE2 GLN 21 2.022 -2.434 8.109
60 H GLU 22 H GLU 22 -4.390 -0.262 7.162
61 HA GLU 22 HA GLU 22 -4.789 -1.888 9.487
62 HB2 GLU 22 1HB GLU 22 -4.784 0.571 9.473
63 HB3 GLU 22 2HB GLU 22 -6.310 0.553 8.557
64 HG2 GLU 22 1HG GLU 22 -7.445 -0.555 10.539
65 HG3 GLU 22 2HG GLU 22 -5.836 -0.550 11.295
66 H TYR 23 H TYR 23 -6.991 -1.053 6.814
67 HA TYR 23 HA TYR 23 -9.237 -2.537 7.793
68 HB2 TYR 23 1HB TYR 23 -8.319 -1.728 5.038
69 HB3 TYR 23 2HB TYR 23 -9.807 -2.665 5.312
70 HD1 TYR 23 HD2 TYR 23 -11.550 -1.634 6.924
71 HD2 TYR 23 HD1 TYR 23 -8.383 0.615 5.165
72 HE1 TYR 23 HE2 TYR 23 -12.794 0.453 7.378
73 HE2 TYR 23 HE1 TYR 23 -9.616 2.716 5.612
74 HH TYR 23 HH TYR 23 -12.809 2.724 7.201
75 H ALA 24 H ALA 24 -6.490 -3.502 5.758
76 HA ALA 24 HA ALA 24 -7.435 -6.120 5.166
77 HB1 ALA 24 3HB ALA 24 -4.581 -5.128 5.478
78 HB2 ALA 24 1HB ALA 24 -5.074 -6.645 4.693
79 HB3 ALA 24 2HB ALA 24 -5.549 -5.084 3.986
80 H GLN 25 H GLN 25 -5.512 -4.894 7.893
81 HA GLN 25 HA GLN 25 -5.113 -7.458 9.136
82 HB2 GLN 25 1HB GLN 25 -5.195 -4.636 10.211
83 HB3 GLN 25 2HB GLN 25 -4.812 -6.057 11.212
84 HG2 GLN 25 1HG GLN 25 -2.673 -6.419 9.611
85 HG3 GLN 25 2HG GLN 25 -3.508 -5.054 8.835
86 HE21 GLN 25 2HE2 GLN 25 -0.790 -5.052 9.672
87 HE22 GLN 25 1HE2 GLN 25 -0.620 -3.874 10.931
88 H LYS 26 H LYS 26 -7.642 -4.990 9.503
89 HA LYS 26 HA LYS 26 -9.089 -6.382 11.567
90 HB2 LYS 26 1HB LYS 26 -9.935 -4.385 9.467
91 HB3 LYS 26 2HB LYS 26 -11.013 -5.008 10.740
92 HG2 LYS 26 1HG LYS 26 -9.528 -4.072 12.463
93 HG3 LYS 26 2HG LYS 26 -8.439 -3.460 11.196
94 HD2 LYS 26 1HD LYS 26 -10.233 -2.032 10.323
95 HD3 LYS 26 2HD LYS 26 -11.348 -2.663 11.557
96 HE2 LYS 26 1HE LYS 26 -9.900 -1.762 13.328
97 HE3 LYS 26 2HE LYS 26 -8.786 -1.129 12.094
98 HZ1 LYS 26 3HZ LYS 26 -11.600 -0.316 12.441
99 HZ2 LYS 26 1HZ LYS 26 -10.284 0.568 12.894
100 HZ3 LYS 26 2HZ LYS 26 -10.568 0.271 11.296
101 H TYR 27 H TYR 27 -8.950 -6.746 8.093
102 HA TYR 27 HA TYR 27 -11.313 -8.544 8.106
103 HB2 TYR 27 1HB TYR 27 -9.452 -7.709 5.873
104 HB3 TYR 27 2HB TYR 27 -10.945 -8.664 5.702
105 HD1 TYR 27 HD1 TYR 27 -12.166 -6.742 8.045
106 HD2 TYR 27 HD2 TYR 27 -10.520 -6.161 4.154
107 HE1 TYR 27 HE1 TYR 27 -13.477 -4.653 7.810
108 HE2 TYR 27 HE2 TYR 27 -11.822 -4.074 3.903
109 HH TYR 27 HH TYR 27 -13.991 -2.885 6.481
110 H LYS 28 H LYS 28 -8.205 -8.870 9.018
111 HA LYS 28 HA LYS 28 -6.675 -10.623 9.074
112 HB2 LYS 28 1HB LYS 28 -9.166 -12.273 8.625
113 HB3 LYS 28 2HB LYS 28 -7.599 -12.862 9.229
114 HG2 LYS 28 1HG LYS 28 -7.852 -11.412 11.226
115 HG3 LYS 28 2HG LYS 28 -9.451 -10.906 10.632
116 HD2 LYS 28 1HD LYS 28 -10.185 -13.283 10.684
117 HD3 LYS 28 2HD LYS 28 -8.606 -13.728 11.374
118 HE2 LYS 28 1HE LYS 28 -9.033 -12.289 13.311
119 HE3 LYS 28 2HE LYS 28 -10.600 -11.811 12.620
120 HZ1 LYS 28 3HZ LYS 28 -9.846 -14.547 13.422
121 HZ2 LYS 28 1HZ LYS 28 -10.846 -13.542 14.265
122 HZ3 LYS 28 2HZ LYS 28 -11.299 -14.103 12.782
123 H LEU 29 H LEU 29 -7.162 -9.345 6.530
124 HA LEU 29 HA LEU 29 -6.463 -11.635 4.723
125 HB2 LEU 29 1HB LEU 29 -7.474 -8.918 4.187
126 HB3 LEU 29 2HB LEU 29 -7.147 -10.049 2.853
127 HG LEU 29 HG LEU 29 -9.280 -10.333 5.005
128 HD11 LEU 29 1HD1 LEU 29 -10.866 -10.128 3.072
129 HD12 LEU 29 2HD1 LEU 29 -9.839 -8.682 3.223
130 HD13 LEU 29 3HD1 LEU 29 -9.480 -9.903 1.979
131 HD21 LEU 29 3HD2 LEU 29 -8.341 -12.494 4.434
132 HD22 LEU 29 1HD2 LEU 29 -9.987 -12.355 3.775
133 HD23 LEU 29 2HD2 LEU 29 -8.581 -12.173 2.700
134 HA PRO 30 HA PRO 30 -2.446 -10.246 4.172
135 HB2 PRO 30 1HB PRO 30 -2.977 -10.700 1.533
136 HB3 PRO 30 2HB PRO 30 -1.798 -11.288 2.492
137 HG2 PRO 30 1HG PRO 30 -4.212 -12.233 2.219
138 HG3 PRO 30 2HG PRO 30 -2.838 -13.102 2.358
139 HD2 PRO 30 1HD PRO 30 -5.738 -11.482 2.647
140 HD3 PRO 30 2HD PRO 30 -4.729 -12.496 3.430
141 H THR 31 H THR 31 -1.221 -8.438 3.694
142 HA THR 31 HA THR 31 -2.850 -6.111 2.924
143 HB THR 31 HB THR 31 -0.810 -4.810 3.381
144 HG1 THR 31 HG1 THR 31 0.705 -6.395 2.636
145 HG21 THR 31 1HG2 THR 31 -0.545 -5.371 5.772
146 HG22 THR 31 2HG2 THR 31 -2.256 -5.440 5.284
147 HG23 THR 31 3HG2 THR 31 -1.327 -6.944 5.490
148 HA PRO 32 HA PRO 32 -1.915 -5.784 -1.214
149 HB2 PRO 32 1HB PRO 32 -1.504 -3.143 -0.659
150 HB3 PRO 32 2HB PRO 32 -2.534 -3.859 -1.700
151 HG2 PRO 32 1HG PRO 32 -2.934 -3.404 0.835
152 HG3 PRO 32 2HG PRO 32 -4.029 -3.249 -0.364
153 HD2 PRO 32 1HD PRO 32 -2.100 -4.082 2.216
154 HD3 PRO 32 2HD PRO 32 -3.449 -4.513 1.406
155 H VAL 33 H VAL 33 -0.220 -6.337 -2.419
156 HA VAL 33 HA VAL 33 2.454 -5.282 -1.510
157 HB VAL 33 HB VAL 33 1.776 -7.771 -3.134
158 HG11 VAL 33 1HG1 VAL 33 4.186 -8.272 -2.901
159 HG12 VAL 33 2HG1 VAL 33 3.932 -6.740 -3.770
160 HG13 VAL 33 3HG1 VAL 33 4.427 -6.723 -2.060
161 HG21 VAL 33 3HG2 VAL 33 1.142 -8.035 -0.811
162 HG22 VAL 33 1HG2 VAL 33 2.573 -9.020 -1.190
163 HG23 VAL 33 2HG2 VAL 33 2.757 -7.497 -0.288
164 H TYR 34 H TYR 34 3.581 -4.001 -2.687
165 HA TYR 34 HA TYR 34 2.471 -3.322 -5.379
166 HB2 TYR 34 1HB TYR 34 3.295 -1.197 -5.112
167 HB3 TYR 34 2HB TYR 34 2.772 -1.623 -3.464
168 HD1 TYR 34 HD2 TYR 34 4.447 -2.114 -1.721
169 HD2 TYR 34 HD1 TYR 34 5.635 -0.865 -5.621
170 HE1 TYR 34 HE2 TYR 34 6.713 -1.624 -0.861
171 HE2 TYR 34 HE1 TYR 34 7.911 -0.368 -4.777
172 HH TYR 34 HH TYR 34 8.804 -0.874 -1.361
173 H GLU 35 H GLU 35 3.664 -3.245 -7.198
174 HA GLU 35 HA GLU 35 6.538 -4.047 -6.994
175 HB2 GLU 35 1HB GLU 35 4.480 -5.191 -8.888
176 HB3 GLU 35 2HB GLU 35 6.238 -5.459 -8.985
177 HG2 GLU 35 1HG GLU 35 6.119 -6.607 -6.701
178 HG3 GLU 35 2HG GLU 35 4.377 -6.256 -6.785
179 H ILE 36 H ILE 36 7.901 -3.269 -8.533
180 HA ILE 36 HA ILE 36 6.724 -1.204 -10.380
181 HB ILE 36 HB ILE 36 9.360 -1.096 -8.840
182 HG12 ILE 36 1HG1 ILE 36 6.951 0.689 -8.630
183 HG13 ILE 36 2HG1 ILE 36 7.321 -0.655 -7.526
184 HG21 ILE 36 1HG2 ILE 36 9.606 1.135 -9.877
185 HG22 ILE 36 2HG2 ILE 36 9.539 -0.142 -11.114
186 HG23 ILE 36 3HG2 ILE 36 8.110 0.870 -10.802
187 HD11 ILE 36 3HD1 ILE 36 9.058 1.794 -7.990
188 HD12 ILE 36 1HD1 ILE 36 8.029 1.502 -6.569
189 HD13 ILE 36 2HD1 ILE 36 9.428 0.450 -6.885
190 H VAL 37 H VAL 37 7.079 -1.389 -12.405
191 HA VAL 37 HA VAL 37 9.263 -3.276 -13.289
192 HB VAL 37 HB VAL 37 6.585 -2.677 -14.616
193 HG11 VAL 37 1HG1 VAL 37 7.265 -4.446 -16.204
194 HG12 VAL 37 2HG1 VAL 37 8.415 -3.088 -16.228
195 HG13 VAL 37 3HG1 VAL 37 8.831 -4.592 -15.372
196 HG21 VAL 37 3HG2 VAL 37 6.302 -4.066 -12.651
197 HG22 VAL 37 1HG2 VAL 37 6.043 -5.011 -14.136
198 HG23 VAL 37 2HG2 VAL 37 7.566 -5.177 -13.230
199 H LYS 38 H LYS 38 10.845 -2.504 -14.360
200 HA LYS 38 HA LYS 38 10.573 0.203 -15.576
201 HB2 LYS 38 1HB LYS 38 12.480 -0.292 -14.094
202 HB3 LYS 38 2HB LYS 38 12.986 -1.581 -15.212
203 HG2 LYS 38 1HG LYS 38 13.330 0.087 -16.987
204 HG3 LYS 38 2HG LYS 38 12.819 1.379 -15.874
205 HD2 LYS 38 1HD LYS 38 14.703 0.843 -14.383
206 HD3 LYS 38 2HD LYS 38 15.213 -0.453 -15.492
207 HE2 LYS 38 1HE LYS 38 15.567 1.199 -17.271
208 HE3 LYS 38 2HE LYS 38 15.037 2.498 -16.179
209 HZ1 LYS 38 3HZ LYS 38 17.402 0.781 -15.779
210 HZ2 LYS 38 1HZ LYS 38 17.430 2.349 -16.288
211 HZ3 LYS 38 2HZ LYS 38 16.911 1.985 -14.765
212 H GLU 39 H GLU 39 10.285 0.552 -17.622
213 HA GLU 39 HA GLU 39 11.090 -1.575 -19.569
214 HB2 GLU 39 1HB GLU 39 8.483 -0.046 -19.518
215 HB3 GLU 39 2HB GLU 39 9.049 -1.079 -20.854
216 HG2 GLU 39 1HG GLU 39 8.979 -3.074 -19.253
217 HG3 GLU 39 2HG GLU 39 8.417 -1.893 -18.048
218 H GLY 40 H GLY 40 11.330 -0.844 -21.755
219 HA2 GLY 40 1HA GLY 40 11.511 0.889 -23.391
220 HA3 GLY 40 2HA GLY 40 11.559 2.099 -22.088
221 HA PRO 41 HA PRO 41 15.811 1.105 -23.600
222 HB2 PRO 41 1HB PRO 41 16.284 3.339 -24.649
223 HB3 PRO 41 2HB PRO 41 15.515 2.137 -25.436
224 HG2 PRO 41 1HG PRO 41 14.443 4.295 -24.446
225 HG3 PRO 41 2HG PRO 41 14.061 3.584 -25.864
226 HD2 PRO 41 1HD PRO 41 12.583 3.145 -23.941
227 HD3 PRO 41 2HD PRO 41 12.943 1.941 -24.981
228 H SER 42 H SER 42 17.802 1.745 -22.702
229 HA SER 42 HA SER 42 17.715 2.660 -20.019
230 HB2 SER 42 1HB SER 42 19.944 2.722 -21.960
231 HB3 SER 42 2HB SER 42 20.050 3.042 -20.213
232 HG SER 42 HG SER 42 19.194 0.939 -19.883
233 H HIS 43 H HIS 43 18.179 4.470 -23.066
234 HA HIS 43 HA HIS 43 18.862 6.943 -21.643
235 HB2 HIS 43 1HB HIS 43 18.967 7.929 -23.911
236 HB3 HIS 43 2HB HIS 43 19.885 6.406 -23.849
237 HD2 HIS 43 HD2 HIS 43 19.075 4.476 -25.770
238 HE1 HIS 43 HE1 HIS 43 15.622 6.626 -26.997
239 HE2 HIS 43 HE2 HIS 43 17.196 4.563 -27.420
240 H LYS 44 H LYS 44 15.989 5.361 -22.341
241 HA LYS 44 HA LYS 44 14.436 7.749 -21.603
242 HB2 LYS 44 1HB LYS 44 14.683 7.958 -24.046
243 HB3 LYS 44 2HB LYS 44 13.971 6.338 -24.235
244 HG2 LYS 44 1HG LYS 44 11.865 7.123 -23.273
245 HG3 LYS 44 2HG LYS 44 12.571 8.734 -23.002
246 HD2 LYS 44 1HD LYS 44 12.890 9.011 -25.424
247 HD3 LYS 44 2HD LYS 44 12.199 7.394 -25.702
248 HE2 LYS 44 1HE LYS 44 10.075 8.127 -24.706
249 HE3 LYS 44 2HE LYS 44 10.763 9.743 -24.427
250 HZ1 LYS 44 3HZ LYS 44 10.375 8.478 -27.063
251 HZ2 LYS 44 1HZ LYS 44 9.436 9.676 -26.426
252 HZ3 LYS 44 2HZ LYS 44 11.013 9.978 -26.805
253 H SER 45 H SER 45 14.696 5.779 -19.954
254 HA SER 45 HA SER 45 12.755 3.573 -20.381
255 HB2 SER 45 1HB SER 45 13.425 2.760 -18.355
256 HB3 SER 45 2HB SER 45 14.850 3.209 -19.319
257 HG SER 45 HG SER 45 14.962 5.128 -18.064
258 H LEU 46 H LEU 46 10.843 3.292 -19.281
259 HA LEU 46 HA LEU 46 9.990 5.457 -17.400
260 HB2 LEU 46 1HB LEU 46 8.496 4.100 -19.545
261 HB3 LEU 46 2HB LEU 46 7.613 5.085 -18.355
262 HG LEU 46 HG LEU 46 9.731 6.108 -20.286
263 HD11 LEU 46 1HD1 LEU 46 7.810 7.270 -21.405
264 HD12 LEU 46 2HD1 LEU 46 7.603 5.504 -21.434
265 HD13 LEU 46 3HD1 LEU 46 6.692 6.487 -20.264
266 HD21 LEU 46 3HD2 LEU 46 9.700 7.348 -18.202
267 HD22 LEU 46 1HD2 LEU 46 9.030 8.348 -19.514
268 HD23 LEU 46 2HD2 LEU 46 7.940 7.580 -18.333
269 H PHE 47 H PHE 47 8.666 4.878 -15.719
270 HA PHE 47 HA PHE 47 8.797 1.956 -15.088
271 HB2 PHE 47 1HB PHE 47 8.528 4.410 -13.301
272 HB3 PHE 47 2HB PHE 47 8.447 2.730 -12.724
273 HD1 PHE 47 HD2 PHE 47 10.427 1.289 -12.831
274 HD2 PHE 47 HD1 PHE 47 10.580 5.445 -13.809
275 HE1 PHE 47 HE2 PHE 47 12.885 1.258 -12.570
276 HE2 PHE 47 HE1 PHE 47 13.038 5.417 -13.552
277 HZ PHE 47 HZ PHE 47 14.191 3.323 -12.933
278 H GLN 48 H GLN 48 7.068 0.830 -14.273
279 HA GLN 48 HA GLN 48 4.485 2.286 -14.017
280 HB2 GLN 48 1HB GLN 48 4.566 1.281 -16.279
281 HB3 GLN 48 2HB GLN 48 4.850 -0.308 -15.531
282 HG2 GLN 48 1HG GLN 48 2.378 0.089 -14.377
283 HG3 GLN 48 2HG GLN 48 2.604 1.493 -15.445
284 HE21 GLN 48 2HE2 GLN 48 0.430 -0.282 -15.641
285 HE22 GLN 48 1HE2 GLN 48 0.550 -1.137 -17.143
286 H SER 49 H SER 49 3.266 1.694 -12.368
287 HA SER 49 HA SER 49 4.453 -0.391 -10.523
288 HB2 SER 49 1HB SER 49 3.532 0.774 -8.758
289 HB3 SER 49 2HB SER 49 4.587 1.821 -9.736
290 HG SER 49 HG SER 49 2.633 2.849 -9.127
291 H THR 50 H THR 50 3.105 -1.836 -9.483
292 HA THR 50 HA THR 50 0.185 -1.726 -10.019
293 HB THR 50 HB THR 50 1.171 -3.226 -11.784
294 HG1 THR 50 HG1 THR 50 -0.416 -4.728 -11.463
295 HG21 THR 50 1HG2 THR 50 2.064 -5.416 -11.068
296 HG22 THR 50 2HG2 THR 50 3.080 -4.082 -10.469
297 HG23 THR 50 3HG2 THR 50 1.951 -4.906 -9.367
298 H VAL 51 H VAL 51 -1.103 -2.727 -8.529
299 HA VAL 51 HA VAL 51 0.309 -3.738 -6.062
300 HB VAL 51 HB VAL 51 -2.203 -2.018 -6.212
301 HG11 VAL 51 1HG1 VAL 51 -2.072 -2.061 -3.743
302 HG12 VAL 51 2HG1 VAL 51 -2.270 -3.702 -4.403
303 HG13 VAL 51 3HG1 VAL 51 -0.673 -3.156 -3.836
304 HG21 VAL 51 3HG2 VAL 51 -0.210 -0.707 -6.640
305 HG22 VAL 51 1HG2 VAL 51 -0.882 -0.330 -5.036
306 HG23 VAL 51 2HG2 VAL 51 0.559 -1.364 -5.176
307 H ILE 52 H ILE 52 -0.074 -5.701 -5.578
308 HA ILE 52 HA ILE 52 -2.621 -6.951 -6.561
309 HB ILE 52 HB ILE 52 -0.027 -8.230 -5.576
310 HG12 ILE 52 1HG1 ILE 52 -1.177 -8.181 -8.352
311 HG13 ILE 52 2HG1 ILE 52 0.086 -7.075 -7.764
312 HG21 ILE 52 1HG2 ILE 52 -1.057 -10.341 -6.345
313 HG22 ILE 52 2HG2 ILE 52 -2.032 -9.583 -5.065
314 HG23 ILE 52 3HG2 ILE 52 -2.546 -9.463 -6.764
315 HD11 ILE 52 3HD1 ILE 52 0.303 -10.102 -7.913
316 HD12 ILE 52 1HD1 ILE 52 1.065 -8.947 -9.030
317 HD13 ILE 52 2HD1 ILE 52 1.565 -8.995 -7.323
318 H LEU 53 H LEU 53 -4.208 -7.279 -5.293
319 HA LEU 53 HA LEU 53 -3.654 -7.794 -2.407
320 HB2 LEU 53 1HB LEU 53 -4.070 -5.600 -2.439
321 HB3 LEU 53 2HB LEU 53 -5.457 -5.611 -3.553
322 HG LEU 53 HG LEU 53 -6.711 -6.938 -1.784
323 HD11 LEU 53 1HD1 LEU 53 -5.856 -6.715 0.564
324 HD12 LEU 53 2HD1 LEU 53 -4.721 -7.632 -0.454
325 HD13 LEU 53 3HD1 LEU 53 -4.389 -5.928 -0.062
326 HD21 LEU 53 3HD2 LEU 53 -7.163 -4.591 -2.197
327 HD22 LEU 53 1HD2 LEU 53 -7.278 -4.935 -0.453
328 HD23 LEU 53 2HD2 LEU 53 -5.839 -4.115 -1.106
329 H ASP 54 H ASP 54 -4.646 -9.478 -1.648
330 HA ASP 54 HA ASP 54 -6.033 -11.344 -1.588
331 HB2 ASP 54 1HB ASP 54 -8.110 -9.380 -2.734
332 HB3 ASP 54 2HB ASP 54 -8.294 -11.034 -2.100
333 H GLY 55 H GLY 55 -4.377 -10.894 -3.951
334 HA2 GLY 55 1HA GLY 55 -3.973 -12.380 -5.716
335 HA3 GLY 55 2HA GLY 55 -5.614 -13.040 -5.522
336 H VAL 56 H VAL 56 -5.916 -9.748 -5.538
337 HA VAL 56 HA VAL 56 -6.592 -9.726 -8.472
338 HB VAL 56 HB VAL 56 -7.558 -7.907 -6.225
339 HG11 VAL 56 1HG1 VAL 56 -9.167 -7.111 -7.926
340 HG12 VAL 56 2HG1 VAL 56 -7.490 -6.825 -8.447
341 HG13 VAL 56 3HG1 VAL 56 -8.417 -8.179 -9.136
342 HG21 VAL 56 3HG2 VAL 56 -8.435 -10.148 -5.941
343 HG22 VAL 56 1HG2 VAL 56 -9.713 -9.031 -6.477
344 HG23 VAL 56 2HG2 VAL 56 -8.983 -10.169 -7.635
345 H ARG 57 H ARG 57 -5.222 -8.877 -9.758
346 HA ARG 57 HA ARG 57 -3.189 -7.005 -8.712
347 HB2 ARG 57 1HB ARG 57 -2.548 -8.815 -10.172
348 HB3 ARG 57 2HB ARG 57 -3.536 -8.100 -11.469
349 HG2 ARG 57 1HG ARG 57 -2.130 -6.113 -11.490
350 HG3 ARG 57 2HG ARG 57 -1.180 -6.743 -10.123
351 HD2 ARG 57 1HD ARG 57 -1.354 -7.923 -12.876
352 HD3 ARG 57 2HD ARG 57 -0.006 -6.977 -12.205
353 HE ARG 57 HE ARG 57 -0.245 -9.305 -10.547
354 HH11 ARG 57 1HH1 ARG 57 0.383 -8.667 -13.916
355 HH12 ARG 57 2HH1 ARG 57 1.368 -10.113 -14.013
356 HH21 ARG 57 1HH2 ARG 57 0.872 -10.969 -10.643
357 HH22 ARG 57 2HH2 ARG 57 1.647 -11.428 -12.147
358 H TYR 58 H TYR 58 -3.243 -4.910 -8.785
359 HA TYR 58 HA TYR 58 -5.136 -3.611 -10.722
360 HB2 TYR 58 1HB TYR 58 -4.041 -2.497 -8.134
361 HB3 TYR 58 2HB TYR 58 -5.242 -1.745 -9.212
362 HD1 TYR 58 HD2 TYR 58 -7.437 -3.124 -9.594
363 HD2 TYR 58 HD1 TYR 58 -4.791 -3.749 -6.308
364 HE1 TYR 58 HE2 TYR 58 -9.263 -4.228 -8.347
365 HE2 TYR 58 HE1 TYR 58 -6.610 -4.857 -5.044
366 HH TYR 58 HH TYR 58 -9.881 -5.258 -6.412
367 H ASN 59 H ASN 59 -4.078 -3.033 -12.456
368 HA ASN 59 HA ASN 59 -1.238 -2.182 -12.209
369 HB2 ASN 59 1HB ASN 59 -2.754 -2.707 -14.870
370 HB3 ASN 59 2HB ASN 59 -1.125 -2.208 -14.355
371 HD21 ASN 59 2HD2 ASN 59 -3.238 -4.793 -14.962
372 HD22 ASN 59 1HD2 ASN 59 -2.202 -6.085 -14.454
373 H SER 60 H SER 60 -0.611 -0.189 -12.148
374 HA SER 60 HA SER 60 -2.499 2.060 -12.591
375 HB2 SER 60 1HB SER 60 -0.981 3.409 -11.699
376 HB3 SER 60 2HB SER 60 -0.872 1.901 -10.761
377 HG SER 60 HG SER 60 1.189 2.461 -11.198
378 H LEU 61 H LEU 61 -1.542 3.970 -13.815
379 HA LEU 61 HA LEU 61 -0.964 3.140 -16.564
380 HB2 LEU 61 1HB LEU 61 -1.102 5.727 -15.159
381 HB3 LEU 61 2HB LEU 61 -0.917 5.691 -16.928
382 HG LEU 61 HG LEU 61 -3.296 4.678 -15.324
383 HD11 LEU 61 1HD1 LEU 61 -4.530 6.505 -16.521
384 HD12 LEU 61 2HD1 LEU 61 -3.195 7.160 -15.545
385 HD13 LEU 61 3HD1 LEU 61 -3.012 6.994 -17.308
386 HD21 LEU 61 3HD2 LEU 61 -2.879 3.251 -17.238
387 HD22 LEU 61 1HD2 LEU 61 -4.343 4.223 -17.514
388 HD23 LEU 61 2HD2 LEU 61 -2.816 4.666 -18.316
389 HA PRO 62 HA PRO 62 3.315 3.407 -16.279
390 HB2 PRO 62 1HB PRO 62 3.807 3.187 -18.716
391 HB3 PRO 62 2HB PRO 62 3.160 1.967 -17.851
392 HG2 PRO 62 1HG PRO 62 1.931 3.484 -19.576
393 HG3 PRO 62 2HG PRO 62 1.727 1.878 -19.377
394 HD2 PRO 62 1HD PRO 62 0.033 3.249 -18.253
395 HD3 PRO 62 2HD PRO 62 0.613 1.947 -17.460
396 H GLY 63 H GLY 63 5.165 4.710 -16.774
397 HA2 GLY 63 1HA GLY 63 5.930 6.511 -18.356
398 HA3 GLY 63 2HA GLY 63 4.377 7.313 -18.026
399 H PHE 64 H PHE 64 5.852 5.639 -15.395
400 HA PHE 64 HA PHE 64 6.290 8.143 -13.934
401 HB2 PHE 64 1HB PHE 64 6.797 5.218 -13.241
402 HB3 PHE 64 2HB PHE 64 7.102 6.574 -12.131
403 HD1 PHE 64 HD2 PHE 64 5.096 8.145 -11.676
404 HD2 PHE 64 HD1 PHE 64 4.764 4.180 -13.234
405 HE1 PHE 64 HE2 PHE 64 2.753 8.036 -10.894
406 HE2 PHE 64 HE1 PHE 64 2.419 4.069 -12.457
407 HZ PHE 64 HZ PHE 64 1.415 5.997 -11.287
408 H PHE 65 H PHE 65 8.137 9.083 -13.293
409 HA PHE 65 HA PHE 65 10.525 8.323 -14.921
410 HB2 PHE 65 1HB PHE 65 9.819 10.924 -13.495
411 HB3 PHE 65 2HB PHE 65 11.289 10.636 -14.451
412 HD1 PHE 65 HD2 PHE 65 11.052 10.127 -16.899
413 HD2 PHE 65 HD1 PHE 65 7.849 11.615 -14.495
414 HE1 PHE 65 HE2 PHE 65 9.877 10.883 -18.938
415 HE2 PHE 65 HE1 PHE 65 6.669 12.371 -16.533
416 HZ PHE 65 HZ PHE 65 7.684 12.004 -18.754
417 H ASN 66 H ASN 66 9.306 8.132 -11.769
418 HA ASN 66 HA ASN 66 12.022 7.331 -10.828
419 HB2 ASN 66 1HB ASN 66 10.247 9.202 -9.086
420 HB3 ASN 66 2HB ASN 66 11.653 8.139 -8.827
421 HD21 ASN 66 2HD2 ASN 66 10.481 11.089 -10.239
422 HD22 ASN 66 1HD2 ASN 66 12.028 11.789 -10.582
423 H ARG 67 H ARG 67 12.105 5.724 -9.326
424 HA ARG 67 HA ARG 67 9.881 3.881 -9.267
425 HB2 ARG 67 1HB ARG 67 12.435 3.984 -7.739
426 HB3 ARG 67 2HB ARG 67 11.194 2.728 -7.523
427 HG2 ARG 67 1HG ARG 67 11.411 2.267 -10.010
428 HG3 ARG 67 2HG ARG 67 12.848 3.318 -9.989
429 HD2 ARG 67 1HD ARG 67 12.487 0.834 -8.344
430 HD3 ARG 67 2HD ARG 67 13.363 0.935 -9.888
431 HE ARG 67 HE ARG 67 14.452 1.910 -7.287
432 HH11 ARG 67 1HH1 ARG 67 14.796 1.857 -10.756
433 HH12 ARG 67 2HH1 ARG 67 16.468 2.358 -10.604
434 HH21 ARG 67 1HH2 ARG 67 16.368 2.476 -7.096
435 HH22 ARG 67 2HH2 ARG 67 17.366 2.711 -8.517
436 H LYS 68 H LYS 68 11.118 6.277 -6.964
437 HA LYS 68 HA LYS 68 9.293 5.612 -4.840
438 HB2 LYS 68 1HB LYS 68 10.719 8.167 -5.583
439 HB3 LYS 68 2HB LYS 68 9.740 7.966 -4.111
440 HG2 LYS 68 1HG LYS 68 11.244 6.167 -3.357
441 HG3 LYS 68 2HG LYS 68 12.225 6.372 -4.827
442 HD2 LYS 68 1HD LYS 68 12.711 8.703 -4.165
443 HD3 LYS 68 2HD LYS 68 11.756 8.470 -2.681
444 HE2 LYS 68 1HE LYS 68 13.285 6.696 -1.961
445 HE3 LYS 68 2HE LYS 68 14.231 6.894 -3.453
446 HZ1 LYS 68 3HZ LYS 68 13.867 8.951 -1.369
447 HZ2 LYS 68 1HZ LYS 68 15.233 8.056 -1.605
448 HZ3 LYS 68 2HZ LYS 68 14.744 9.135 -2.754
449 H ALA 69 H ALA 69 9.059 7.844 -7.588
450 HA ALA 69 HA ALA 69 6.501 8.912 -6.855
451 HB1 ALA 69 3HB ALA 69 7.769 8.600 -9.596
452 HB2 ALA 69 1HB ALA 69 6.364 9.619 -9.210
453 HB3 ALA 69 2HB ALA 69 7.955 9.995 -8.506
454 H ALA 70 H ALA 70 7.455 6.131 -8.853
455 HA ALA 70 HA ALA 70 4.800 5.391 -9.620
456 HB1 ALA 70 3HB ALA 70 7.269 3.660 -9.246
457 HB2 ALA 70 1HB ALA 70 5.787 3.185 -10.106
458 HB3 ALA 70 2HB ALA 70 6.797 4.507 -10.738
459 H GLU 71 H GLU 71 6.790 4.550 -6.805
460 HA GLU 71 HA GLU 71 4.967 2.615 -5.706
461 HB2 GLU 71 1HB GLU 71 7.321 2.852 -5.041
462 HB3 GLU 71 2HB GLU 71 6.941 4.433 -4.315
463 HG2 GLU 71 1HG GLU 71 5.406 3.254 -2.662
464 HG3 GLU 71 2HG GLU 71 5.840 1.765 -3.533
465 H GLN 72 H GLN 72 5.331 6.116 -5.158
466 HA GLN 72 HA GLN 72 3.312 6.309 -3.142
467 HB2 GLN 72 1HB GLN 72 4.990 8.049 -3.678
468 HB3 GLN 72 2HB GLN 72 4.147 8.349 -5.215
469 HG2 GLN 72 1HG GLN 72 3.193 10.133 -3.603
470 HG3 GLN 72 2HG GLN 72 2.199 8.706 -3.981
471 HE21 GLN 72 2HE2 GLN 72 0.953 8.998 -2.101
472 HE22 GLN 72 1HE2 GLN 72 1.573 8.618 -0.528
473 H SER 73 H SER 73 3.112 6.695 -6.677
474 HA SER 73 HA SER 73 0.290 7.338 -6.809
475 HB2 SER 73 1HB SER 73 2.123 6.170 -8.814
476 HB3 SER 73 2HB SER 73 0.446 6.697 -9.089
477 HG SER 73 HG SER 73 2.573 8.314 -8.133
478 H ALA 74 H ALA 74 2.141 4.283 -6.852
479 HA ALA 74 HA ALA 74 -0.014 2.535 -7.451
480 HB1 ALA 74 3HB ALA 74 2.425 2.041 -5.712
481 HB2 ALA 74 1HB ALA 74 1.365 0.788 -6.394
482 HB3 ALA 74 2HB ALA 74 2.332 1.820 -7.474
483 H ALA 75 H ALA 75 1.145 3.785 -4.327
484 HA ALA 75 HA ALA 75 -0.781 2.366 -2.743
485 HB1 ALA 75 3HB ALA 75 0.651 4.987 -2.190
486 HB2 ALA 75 1HB ALA 75 -0.222 4.005 -0.991
487 HB3 ALA 75 2HB ALA 75 1.241 3.361 -1.773
488 H GLU 76 H GLU 76 -0.814 5.571 -4.276
489 HA GLU 76 HA GLU 76 -3.309 6.450 -3.186
490 HB2 GLU 76 1HB GLU 76 -1.896 7.057 -5.783
491 HB3 GLU 76 2HB GLU 76 -3.394 7.865 -5.260
492 HG2 GLU 76 1HG GLU 76 -2.198 8.839 -3.290
493 HG3 GLU 76 2HG GLU 76 -0.823 7.806 -3.741
494 H VAL 77 H VAL 77 -2.563 4.554 -6.095
495 HA VAL 77 HA VAL 77 -5.327 4.391 -7.001
496 HB VAL 77 HB VAL 77 -2.889 2.651 -7.553
497 HG11 VAL 77 1HG1 VAL 77 -4.225 1.709 -9.407
498 HG12 VAL 77 2HG1 VAL 77 -4.980 1.364 -7.834
499 HG13 VAL 77 3HG1 VAL 77 -5.634 2.653 -8.872
500 HG21 VAL 77 3HG2 VAL 77 -2.679 4.914 -8.392
501 HG22 VAL 77 1HG2 VAL 77 -2.895 3.760 -9.730
502 HG23 VAL 77 2HG2 VAL 77 -4.257 4.779 -9.205
503 H ALA 78 H ALA 78 -3.306 2.298 -4.974
504 HA ALA 78 HA ALA 78 -5.229 0.229 -4.651
505 HB1 ALA 78 3HB ALA 78 -3.128 1.219 -2.694
506 HB2 ALA 78 1HB ALA 78 -3.987 -0.335 -2.600
507 HB3 ALA 78 2HB ALA 78 -2.887 -0.007 -3.961
508 H LEU 79 H LEU 79 -4.790 3.293 -2.921
509 HA LEU 79 HA LEU 79 -6.889 2.772 -0.988
510 HB2 LEU 79 1HB LEU 79 -5.572 5.176 -2.058
511 HB3 LEU 79 2HB LEU 79 -6.732 5.360 -0.721
512 HG LEU 79 HG LEU 79 -4.123 3.796 -0.640
513 HD11 LEU 79 1HD1 LEU 79 -3.410 5.569 0.986
514 HD12 LEU 79 2HD1 LEU 79 -3.796 6.268 -0.604
515 HD13 LEU 79 3HD1 LEU 79 -4.961 6.401 0.735
516 HD21 LEU 79 3HD2 LEU 79 -5.830 2.757 0.732
517 HD22 LEU 79 1HD2 LEU 79 -4.600 3.521 1.768
518 HD23 LEU 79 2HD2 LEU 79 -6.178 4.311 1.527
519 H ARG 80 H ARG 80 -6.790 4.242 -4.194
520 HA ARG 80 HA ARG 80 -9.524 5.137 -4.225
521 HB2 ARG 80 1HB ARG 80 -7.664 4.355 -6.418
522 HB3 ARG 80 2HB ARG 80 -9.331 4.922 -6.675
523 HG2 ARG 80 1HG ARG 80 -8.802 7.052 -5.622
524 HG3 ARG 80 2HG ARG 80 -7.153 6.488 -5.258
525 HD2 ARG 80 1HD ARG 80 -6.687 6.349 -7.630
526 HD3 ARG 80 2HD ARG 80 -8.331 6.929 -7.984
527 HE ARG 80 HE ARG 80 -7.042 8.993 -6.446
528 HH11 ARG 80 1HH1 ARG 80 -6.565 7.436 -9.529
529 HH12 ARG 80 2HH1 ARG 80 -5.871 8.910 -10.173
530 HH21 ARG 80 1HH2 ARG 80 -6.242 10.687 -7.167
531 HH22 ARG 80 2HH2 ARG 80 -5.685 10.765 -8.827
532 H GLU 81 H GLU 81 -8.021 2.006 -4.870
533 HA GLU 81 HA GLU 81 -10.509 0.743 -5.710
534 HB2 GLU 81 1HB GLU 81 -7.883 -0.338 -4.683
535 HB3 GLU 81 2HB GLU 81 -9.244 -1.357 -5.209
536 HG2 GLU 81 1HG GLU 81 -7.638 0.564 -7.001
537 HG3 GLU 81 2HG GLU 81 -7.621 -1.212 -6.911
538 H LEU 82 H LEU 82 -8.783 1.073 -2.626
539 HA LEU 82 HA LEU 82 -10.545 -0.464 -1.017
540 HB2 LEU 82 1HB LEU 82 -8.613 0.277 -0.172
541 HB3 LEU 82 2HB LEU 82 -8.857 2.019 -0.449
542 HG LEU 82 HG LEU 82 -10.766 1.922 1.198
543 HD11 LEU 82 1HD1 LEU 82 -10.798 -0.030 2.775
544 HD12 LEU 82 2HD1 LEU 82 -11.142 -0.542 1.106
545 HD13 LEU 82 3HD1 LEU 82 -9.528 -0.814 1.806
546 HD21 LEU 82 3HD2 LEU 82 -8.601 2.817 1.824
547 HD22 LEU 82 1HD2 LEU 82 -9.309 1.929 3.194
548 HD23 LEU 82 2HD2 LEU 82 -8.011 1.186 2.228
549 H ALA 83 H ALA 83 -10.754 2.989 -1.902
550 HA ALA 83 HA ALA 83 -13.254 3.439 -0.599
551 HB1 ALA 83 3HB ALA 83 -12.067 4.805 -3.039
552 HB2 ALA 83 1HB ALA 83 -13.417 5.420 -2.058
553 HB3 ALA 83 2HB ALA 83 -11.795 5.268 -1.343
554 H LYS 84 H LYS 84 -12.463 2.371 -3.893
555 HA LYS 84 HA LYS 84 -15.119 2.398 -4.935
556 HB2 LYS 84 1HB LYS 84 -13.084 2.126 -6.281
557 HB3 LYS 84 2HB LYS 84 -12.834 0.519 -5.556
558 HG2 LYS 84 1HG LYS 84 -14.904 -0.291 -6.565
559 HG3 LYS 84 2HG LYS 84 -15.235 1.324 -7.233
560 HD2 LYS 84 1HD LYS 84 -13.195 1.192 -8.594
561 HD3 LYS 84 2HD LYS 84 -12.837 -0.411 -7.911
562 HE2 LYS 84 1HE LYS 84 -14.938 -1.279 -8.856
563 HE3 LYS 84 2HE LYS 84 -15.285 0.322 -9.547
564 HZ1 LYS 84 3HZ LYS 84 -12.973 -1.376 -10.232
565 HZ2 LYS 84 1HZ LYS 84 -14.311 -1.155 -11.170
566 HZ3 LYS 84 2HZ LYS 84 -13.294 0.109 -10.874
567 H SER 85 H SER 85 -13.397 -0.030 -3.021
568 HA SER 85 HA SER 85 -15.623 -2.003 -3.250
569 HB2 SER 85 1HB SER 85 -14.299 -3.451 -2.086
570 HB3 SER 85 2HB SER 85 -13.355 -2.698 -3.391
571 HG SER 85 HG SER 85 -12.449 -1.319 -1.795
572 H SER 86 H SER 86 -14.919 0.748 -1.383
573 HA SER 86 HA SER 86 -15.778 -0.154 1.273
574 HB2 SER 86 1HB SER 86 -14.297 1.612 1.078
575 HB3 SER 86 2HB SER 86 -15.461 2.548 0.114
576 HG SER 86 HG SER 86 -15.491 3.111 2.334