Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
652943 | 6tj3 RC | 34459 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 -3.222 16.303 -3.582
2 H2 MET 1 HT2 MET 1 -4.619 15.357 -3.659
3 H3 MET 1 HT3 MET 1 -4.607 16.899 -4.350
4 HA MET 1 HA MET 1 -4.451 15.229 -6.051
5 HB2 MET 1 HB2 MET 1 -2.515 16.066 -7.217
6 HB3 MET 1 HB1 MET 1 -3.238 17.395 -6.326
7 HG2 MET 1 HG2 MET 1 -1.527 16.967 -4.536
8 HG3 MET 1 HG1 MET 1 -0.756 15.859 -5.666
9 HE1 MET 1 HE1 MET 1 -1.193 17.314 -8.464
10 HE2 MET 1 HE2 MET 1 0.343 16.604 -7.969
11 HE3 MET 1 HE3 MET 1 0.293 18.256 -8.583
12 H ALA 2 HN ALA 2 -3.033 13.596 -7.114
13 HA ALA 2 HA ALA 2 -2.605 11.460 -5.382
14 HB1 ALA 2 HB1 ALA 2 -3.047 11.215 -7.774
15 HB2 ALA 2 HB2 ALA 2 -1.623 10.305 -7.273
16 HB3 ALA 2 HB3 ALA 2 -1.435 11.833 -8.131
17 H SER 3 HN SER 3 -0.230 13.704 -6.771
18 HA SER 3 HA SER 3 2.082 12.414 -5.862
19 HB2 SER 3 HB2 SER 3 2.120 14.203 -7.548
20 HB3 SER 3 HB1 SER 3 1.632 15.374 -6.325
21 HG SER 3 HG SER 3 3.587 15.162 -5.330
22 H ASP 4 HN ASP 4 0.040 14.842 -4.301
23 HA ASP 4 HA ASP 4 1.685 15.239 -2.038
24 HB2 ASP 4 HB2 ASP 4 -0.026 16.855 -2.573
25 HB3 ASP 4 HB1 ASP 4 -1.287 15.636 -2.430
26 H MET 5 HN MET 5 -1.000 13.060 -2.708
27 HA MET 5 HA MET 5 -1.074 11.835 -0.154
28 HB2 MET 5 HB2 MET 5 -2.893 11.756 -1.881
29 HB3 MET 5 HB1 MET 5 -1.898 10.643 -2.810
30 HG2 MET 5 HG2 MET 5 -3.600 9.471 -1.532
31 HG3 MET 5 HG1 MET 5 -1.979 9.029 -1.000
32 HE1 MET 5 HE1 MET 5 -4.143 8.853 2.293
33 HE2 MET 5 HE2 MET 5 -3.118 7.946 1.181
34 HE3 MET 5 HE3 MET 5 -4.718 8.483 0.667
35 H GLU 6 HN GLU 6 0.697 11.218 -3.112
36 HA GLU 6 HA GLU 6 1.874 8.760 -2.537
37 HB2 GLU 6 HB2 GLU 6 2.103 9.564 -4.722
38 HB3 GLU 6 HB1 GLU 6 2.714 11.122 -4.191
39 HG2 GLU 6 HG2 GLU 6 4.803 10.027 -3.496
40 HG3 GLU 6 HG1 GLU 6 4.176 8.499 -4.103
41 H GLU 7 HN GLU 7 2.867 12.022 -1.626
42 HA GLU 7 HA GLU 7 5.333 11.444 -0.479
43 HB2 GLU 7 HB2 GLU 7 3.307 13.486 0.436
44 HB3 GLU 7 HB1 GLU 7 5.016 13.490 0.843
45 HG2 GLU 7 HG2 GLU 7 3.799 13.859 -1.874
46 HG3 GLU 7 HG1 GLU 7 4.577 15.093 -0.888
47 H LYS 8 HN LYS 8 2.088 11.320 0.952
48 HA LYS 8 HA LYS 8 2.957 10.670 3.565
49 HB2 LYS 8 HB2 LYS 8 0.291 10.157 2.237
50 HB3 LYS 8 HB1 LYS 8 0.606 9.959 3.956
51 HG2 LYS 8 HG2 LYS 8 1.390 12.445 3.790
52 HG3 LYS 8 HG1 LYS 8 0.372 12.443 2.349
53 HD2 LYS 8 HD2 LYS 8 -0.571 11.469 5.030
54 HD3 LYS 8 HD1 LYS 8 -0.760 13.143 4.502
55 HE2 LYS 8 HE2 LYS 8 -1.823 10.748 3.010
56 HE3 LYS 8 HE1 LYS 8 -2.771 11.710 4.141
57 HZ1 LYS 8 HZ1 LYS 8 -3.122 12.362 1.825
58 HZ2 LYS 8 HZ2 LYS 8 -1.485 12.766 1.686
59 HZ3 LYS 8 HZ3 LYS 8 -2.477 13.629 2.742
60 H PHE 9 HN PHE 9 2.075 8.702 0.775
61 HA PHE 9 HA PHE 9 2.140 6.210 2.114
62 HB2 PHE 9 HB2 PHE 9 2.555 6.919 -0.794
63 HB3 PHE 9 HB1 PHE 9 2.521 5.264 -0.202
64 HD1 PHE 9 HD1 PHE 9 0.661 7.352 -1.995
65 HD2 PHE 9 HD2 PHE 9 0.336 5.144 1.623
66 HE1 PHE 9 HE1 PHE 9 -1.784 7.323 -2.240
67 HE2 PHE 9 HE2 PHE 9 -2.113 5.110 1.386
68 HZ PHE 9 HZ PHE 9 -3.176 6.202 -0.550
69 H ARG 10 HN ARG 10 4.578 8.133 0.456
70 HA ARG 10 HA ARG 10 6.657 6.242 0.540
71 HB2 ARG 10 HB2 ARG 10 6.701 8.223 -0.909
72 HB3 ARG 10 HB1 ARG 10 6.821 9.257 0.507
73 HG2 ARG 10 HG2 ARG 10 8.994 8.348 1.039
74 HG3 ARG 10 HG1 ARG 10 8.867 7.197 -0.292
75 HD2 ARG 10 HD2 ARG 10 8.932 10.200 -0.552
76 HD3 ARG 10 HD1 ARG 10 10.276 9.110 -0.879
77 HE ARG 10 HE ARG 10 9.070 8.266 -2.771
78 HH11 ARG 10 HH11 ARG 10 7.692 11.110 -1.281
79 HH12 ARG 10 HH12 ARG 10 6.782 11.581 -2.686
80 HH21 ARG 10 HH21 ARG 10 7.887 8.866 -4.625
81 HH22 ARG 10 HH22 ARG 10 6.880 10.286 -4.594
82 H GLU 11 HN GLU 11 5.768 8.844 2.750
83 HA GLU 11 HA GLU 11 7.921 8.543 4.523
84 HB2 GLU 11 HB2 GLU 11 6.546 10.523 4.591
85 HB3 GLU 11 HB1 GLU 11 5.126 9.574 5.011
86 HG2 GLU 11 HG2 GLU 11 6.112 9.001 7.149
87 HG3 GLU 11 HG1 GLU 11 7.580 9.879 6.727
88 H ALA 12 HN ALA 12 4.710 7.078 4.508
89 HA ALA 12 HA ALA 12 5.019 5.672 6.949
90 HB1 ALA 12 HB1 ALA 12 3.068 4.381 6.234
91 HB2 ALA 12 HB2 ALA 12 3.202 5.075 4.618
92 HB3 ALA 12 HB3 ALA 12 2.825 6.110 5.995
93 H PHE 13 HN PHE 13 5.666 4.879 3.592
94 HA PHE 13 HA PHE 13 6.224 2.160 3.817
95 HB2 PHE 13 HB2 PHE 13 6.057 3.587 1.716
96 HB3 PHE 13 HB1 PHE 13 7.700 4.113 2.046
97 HD1 PHE 13 HD1 PHE 13 5.585 1.430 0.855
98 HD2 PHE 13 HD2 PHE 13 9.572 2.540 1.825
99 HE1 PHE 13 HE1 PHE 13 6.420 -0.497 -0.411
100 HE2 PHE 13 HE2 PHE 13 10.421 0.609 0.556
101 HZ PHE 13 HZ PHE 13 8.845 -0.913 -0.564
102 H ILE 14 HN ILE 14 8.360 4.963 4.110
103 HA ILE 14 HA ILE 14 10.741 3.588 4.656
104 HB ILE 14 HB ILE 14 9.893 6.369 5.473
105 HG12 ILE 14 HG12 ILE 14 11.605 5.432 3.161
106 HG13 ILE 14 HG11 ILE 14 9.908 5.881 3.030
107 HG21 ILE 14 HG21 ILE 14 12.286 6.842 5.733
108 HG22 ILE 14 HG22 ILE 14 12.648 5.143 5.429
109 HG23 ILE 14 HG23 ILE 14 11.736 5.605 6.865
110 HD11 ILE 14 HD11 ILE 14 11.344 7.681 2.294
111 HD12 ILE 14 HD12 ILE 14 12.161 7.692 3.857
112 HD13 ILE 14 HD13 ILE 14 10.461 8.148 3.747
113 H LEU 15 HN LEU 15 8.171 4.729 6.788
114 HA LEU 15 HA LEU 15 9.489 4.259 9.231
115 HB2 LEU 15 HB2 LEU 15 6.536 4.131 8.630
116 HB3 LEU 15 HB1 LEU 15 7.246 4.233 10.228
117 HG LEU 15 HG LEU 15 7.429 6.359 8.093
118 HD11 LEU 15 HD11 LEU 15 5.185 6.140 9.023
119 HD12 LEU 15 HD12 LEU 15 5.952 7.639 9.547
120 HD13 LEU 15 HD13 LEU 15 5.842 6.271 10.655
121 HD21 LEU 15 HD21 LEU 15 8.382 7.743 9.888
122 HD22 LEU 15 HD22 LEU 15 9.402 6.357 9.504
123 HD23 LEU 15 HD23 LEU 15 8.394 6.336 10.951
124 H PHE 16 HN PHE 16 7.455 2.203 7.208
125 HA PHE 16 HA PHE 16 7.457 0.031 9.072
126 HB2 PHE 16 HB2 PHE 16 6.472 0.386 6.263
127 HB3 PHE 16 HB1 PHE 16 6.520 -1.213 6.995
128 HD1 PHE 16 HD1 PHE 16 4.736 -1.946 8.251
129 HD2 PHE 16 HD2 PHE 16 5.228 2.229 7.614
130 HE1 PHE 16 HE1 PHE 16 2.571 -1.531 9.338
131 HE2 PHE 16 HE2 PHE 16 3.064 2.655 8.702
132 HZ PHE 16 HZ PHE 16 1.732 0.774 9.567
133 H SER 17 HN SER 17 9.232 0.737 6.066
134 HA SER 17 HA SER 17 10.511 -1.848 6.101
135 HB2 SER 17 HB2 SER 17 11.768 -0.993 4.148
136 HB3 SER 17 HB1 SER 17 10.030 -0.755 3.964
137 HG SER 17 HG SER 17 11.596 1.073 3.507
138 H SER 18 HN SER 18 11.063 1.193 7.488
139 HA SER 18 HA SER 18 12.551 2.016 8.940
140 HB2 SER 18 HB2 SER 18 14.000 0.625 10.217
141 HB3 SER 18 HB1 SER 18 12.532 -0.299 9.920
142 HG SER 18 HG SER 18 13.776 -1.206 8.073
143 H CYS 19 HN CYS 19 13.790 0.410 6.124
144 HA CYS 19 HA CYS 19 15.481 2.619 5.516
145 HB2 CYS 19 HB2 CYS 19 16.864 1.252 7.167
146 HB3 CYS 19 HB1 CYS 19 16.887 -0.025 5.956
147 HG CYS 19 HG CYS 19 18.451 2.992 5.903
148 H SER 20 HN SER 20 16.788 2.025 3.462
149 HA SER 20 HA SER 20 16.790 1.507 1.278
150 HB2 SER 20 HB2 SER 20 16.417 -0.760 0.606
151 HB3 SER 20 HB1 SER 20 17.133 -0.802 2.212
152 HG SER 20 HG SER 20 14.708 -0.842 2.824
153 H ASP 21 HN ASP 21 15.273 0.617 -0.589
154 HA ASP 21 HA ASP 21 12.811 2.204 -0.347
155 HB2 ASP 21 HB2 ASP 21 14.558 2.796 -2.082
156 HB3 ASP 21 HB1 ASP 21 14.192 1.270 -2.874
157 H HIS 22 HN HIS 22 13.614 -0.827 0.122
158 HA HIS 22 HA HIS 22 11.323 -1.957 -1.348
159 HB2 HIS 22 HB2 HIS 22 13.776 -3.406 -0.322
160 HB3 HIS 22 HB1 HIS 22 12.438 -4.138 -1.200
161 HD1 HIS 22 HD1 HIS 22 15.725 -2.838 -1.721
162 HD2 HIS 22 HD2 HIS 22 12.202 -2.886 -3.927
163 HE1 HIS 22 HE1 HIS 22 16.410 -2.388 -4.095
164 HE2 HIS 22 HE2 HIS 22 14.255 -2.331 -5.400
165 H ILE 23 HN ILE 23 9.877 -3.272 -0.222
166 HA ILE 23 HA ILE 23 10.165 -3.150 2.709
167 HB ILE 23 HB ILE 23 8.333 -1.728 1.867
168 HG12 ILE 23 HG12 ILE 23 7.224 -4.116 3.344
169 HG13 ILE 23 HG11 ILE 23 8.263 -2.911 4.100
170 HG21 ILE 23 HG21 ILE 23 7.090 -4.305 0.905
171 HG22 ILE 23 HG22 ILE 23 7.743 -3.032 -0.124
172 HG23 ILE 23 HG23 ILE 23 6.329 -2.712 0.881
173 HD11 ILE 23 HD11 ILE 23 5.592 -2.369 2.828
174 HD12 ILE 23 HD12 ILE 23 6.622 -1.188 3.639
175 HD13 ILE 23 HD13 ILE 23 5.904 -2.512 4.558
176 H GLU 24 HN GLU 24 9.950 -4.976 3.852
177 HA GLU 24 HA GLU 24 9.945 -7.509 2.644
178 HB2 GLU 24 HB2 GLU 24 9.435 -6.609 5.472
179 HB3 GLU 24 HB1 GLU 24 9.438 -8.305 5.005
180 HG2 GLU 24 HG2 GLU 24 11.715 -8.001 4.134
181 HG3 GLU 24 HG1 GLU 24 11.717 -6.367 4.782
182 H MET 25 HN MET 25 8.409 -9.065 2.502
183 HA MET 25 HA MET 25 5.915 -8.132 1.603
184 HB2 MET 25 HB2 MET 25 7.395 -10.346 1.148
185 HB3 MET 25 HB1 MET 25 6.186 -11.006 2.240
186 HG2 MET 25 HG2 MET 25 5.455 -11.336 -0.006
187 HG3 MET 25 HG1 MET 25 4.422 -10.124 0.752
188 HE1 MET 25 HE1 MET 25 4.695 -9.081 -3.065
189 HE2 MET 25 HE2 MET 25 3.592 -9.569 -1.779
190 HE3 MET 25 HE3 MET 25 4.751 -10.726 -2.431
191 H TYR 26 HN TYR 26 6.963 -9.555 4.652
192 HA TYR 26 HA TYR 26 4.291 -10.006 5.595
193 HB2 TYR 26 HB2 TYR 26 5.264 -10.890 7.477
194 HB3 TYR 26 HB1 TYR 26 6.580 -11.083 6.341
195 HD1 TYR 26 HD1 TYR 26 8.419 -9.297 6.349
196 HD2 TYR 26 HD2 TYR 26 5.559 -9.690 9.470
197 HE1 TYR 26 HE1 TYR 26 9.889 -8.028 7.848
198 HE2 TYR 26 HE2 TYR 26 7.024 -8.419 10.980
199 HH TYR 26 HH TYR 26 9.412 -7.861 11.201
200 H LYS 27 HN LYS 27 6.580 -7.419 5.655
201 HA LYS 27 HA LYS 27 5.246 -5.879 7.689
202 HB2 LYS 27 HB2 LYS 27 7.678 -5.975 7.503
203 HB3 LYS 27 HB1 LYS 27 7.595 -5.388 5.852
204 HG2 LYS 27 HG2 LYS 27 8.289 -3.674 7.373
205 HG3 LYS 27 HG1 LYS 27 6.746 -3.279 6.623
206 HD2 LYS 27 HD2 LYS 27 6.627 -2.710 8.952
207 HD3 LYS 27 HD1 LYS 27 5.603 -4.108 8.664
208 HE2 LYS 27 HE2 LYS 27 7.382 -5.570 9.512
209 HE3 LYS 27 HE1 LYS 27 8.388 -4.156 9.823
210 HZ1 LYS 27 HZ1 LYS 27 7.218 -4.955 11.811
211 HZ2 LYS 27 HZ2 LYS 27 5.734 -4.647 11.060
212 HZ3 LYS 27 HZ3 LYS 27 6.788 -3.370 11.412
213 H PHE 28 HN PHE 28 4.791 -6.523 4.484
214 HA PHE 28 HA PHE 28 4.251 -3.888 3.501
215 HB2 PHE 28 HB2 PHE 28 5.151 -5.431 1.948
216 HB3 PHE 28 HB1 PHE 28 3.958 -6.657 2.358
217 HD1 PHE 28 HD1 PHE 28 4.351 -3.323 0.797
218 HD2 PHE 28 HD2 PHE 28 1.988 -6.837 1.171
219 HE1 PHE 28 HE1 PHE 28 2.920 -2.550 -1.044
220 HE2 PHE 28 HE2 PHE 28 0.547 -6.080 -0.659
221 HZ PHE 28 HZ PHE 28 1.000 -3.933 -1.774
222 H PHE 29 HN PHE 29 2.226 -6.671 4.446
223 HA PHE 29 HA PHE 29 -0.155 -5.459 3.494
224 HB2 PHE 29 HB2 PHE 29 0.183 -7.933 3.895
225 HB3 PHE 29 HB1 PHE 29 -0.021 -7.604 5.612
226 HD1 PHE 29 HD1 PHE 29 -1.699 -8.091 2.419
227 HD2 PHE 29 HD2 PHE 29 -2.179 -6.684 6.430
228 HE1 PHE 29 HE1 PHE 29 -4.143 -8.248 2.204
229 HE2 PHE 29 HE2 PHE 29 -4.617 -6.833 6.195
230 HZ PHE 29 HZ PHE 29 -5.601 -7.621 4.083
231 H GLU 30 HN GLU 30 1.455 -5.480 6.624
232 HA GLU 30 HA GLU 30 -0.612 -4.174 8.038
233 HB2 GLU 30 HB2 GLU 30 1.087 -3.652 9.729
234 HB3 GLU 30 HB1 GLU 30 1.109 -5.340 9.255
235 HG2 GLU 30 HG2 GLU 30 3.054 -4.928 7.856
236 HG3 GLU 30 HG1 GLU 30 3.022 -3.227 8.305
237 H LEU 31 HN LEU 31 1.943 -3.044 5.990
238 HA LEU 31 HA LEU 31 1.882 -0.315 6.576
239 HB2 LEU 31 HB2 LEU 31 3.629 -1.189 5.217
240 HB3 LEU 31 HB1 LEU 31 2.491 -1.863 4.070
241 HG LEU 31 HG LEU 31 1.850 0.569 3.551
242 HD11 LEU 31 HD11 LEU 31 3.594 2.219 3.958
243 HD12 LEU 31 HD12 LEU 31 4.499 1.036 4.902
244 HD13 LEU 31 HD13 LEU 31 2.928 1.605 5.473
245 HD21 LEU 31 HD21 LEU 31 3.091 -0.886 2.035
246 HD22 LEU 31 HD22 LEU 31 4.597 -0.440 2.837
247 HD23 LEU 31 HD23 LEU 31 3.674 0.776 1.956
248 H MET 32 HN MET 32 -0.251 -2.314 4.661
249 HA MET 32 HA MET 32 -1.461 0.004 3.400
250 HB2 MET 32 HB2 MET 32 -2.194 -2.901 3.153
251 HB3 MET 32 HB1 MET 32 -2.800 -1.598 2.147
252 HG2 MET 32 HG2 MET 32 -0.569 -1.210 1.275
253 HG3 MET 32 HG1 MET 32 0.064 -2.495 2.307
254 HE1 MET 32 HE1 MET 32 -1.644 -4.540 2.504
255 HE2 MET 32 HE2 MET 32 -0.428 -5.361 1.522
256 HE3 MET 32 HE3 MET 32 -2.132 -5.457 1.086
257 H ASN 33 HN ASN 33 -2.371 -2.355 5.876
258 HA ASN 33 HA ASN 33 -5.103 -1.583 5.885
259 HB2 ASN 33 HB2 ASN 33 -5.424 -2.874 7.820
260 HB3 ASN 33 HB1 ASN 33 -4.153 -3.719 6.945
261 HD21 ASN 33 HD21 ASN 33 -2.185 -3.916 7.846
262 HD22 ASN 33 HD22 ASN 33 -1.793 -3.385 9.444
263 H SER 34 HN SER 34 -2.244 -0.194 7.072
264 HA SER 34 HA SER 34 -3.287 1.408 9.163
265 HB2 SER 34 HB2 SER 34 -0.870 0.975 8.855
266 HB3 SER 34 HB1 SER 34 -0.899 1.916 7.365
267 HG SER 34 HG SER 34 -1.949 3.316 9.442
268 H PHE 35 HN PHE 35 -3.246 1.706 5.690
269 HA PHE 35 HA PHE 35 -4.285 4.439 5.817
270 HB2 PHE 35 HB2 PHE 35 -3.259 2.719 3.569
271 HB3 PHE 35 HB1 PHE 35 -4.115 4.229 3.266
272 HD1 PHE 35 HD1 PHE 35 -3.141 6.366 4.033
273 HD2 PHE 35 HD2 PHE 35 -1.006 2.695 4.289
274 HE1 PHE 35 HE1 PHE 35 -1.039 7.613 4.297
275 HE2 PHE 35 HE2 PHE 35 1.100 3.936 4.558
276 HZ PHE 35 HZ PHE 35 1.085 6.398 4.561
277 H GLY 36 HN GLY 36 -5.426 1.303 5.768
278 HA2 GLY 36 HA2 GLY 36 -7.700 0.701 5.806
279 HA3 GLY 36 HA1 GLY 36 -8.090 2.216 5.007
280 H ILE 37 HN ILE 37 -5.487 0.629 3.570
281 HA ILE 37 HA ILE 37 -7.109 -0.113 1.274
282 HB ILE 37 HB ILE 37 -4.125 -0.049 1.734
283 HG12 ILE 37 HG12 ILE 37 -5.868 1.633 -0.075
284 HG13 ILE 37 HG11 ILE 37 -5.352 2.126 1.534
285 HG21 ILE 37 HG21 ILE 37 -4.627 -1.848 0.189
286 HG22 ILE 37 HG22 ILE 37 -3.889 -0.497 -0.672
287 HG23 ILE 37 HG23 ILE 37 -5.629 -0.767 -0.779
288 HD11 ILE 37 HD11 ILE 37 -3.989 3.112 -0.242
289 HD12 ILE 37 HD12 ILE 37 -3.507 1.493 -0.753
290 HD13 ILE 37 HD13 ILE 37 -3.048 2.091 0.841
291 H ILE 38 HN ILE 38 -7.747 -2.130 0.861
292 HA ILE 38 HA ILE 38 -6.563 -4.282 2.478
293 HB ILE 38 HB ILE 38 -8.663 -5.565 1.799
294 HG12 ILE 38 HG12 ILE 38 -9.605 -2.752 1.208
295 HG13 ILE 38 HG11 ILE 38 -9.376 -4.023 0.013
296 HG21 ILE 38 HG21 ILE 38 -8.876 -3.176 3.618
297 HG22 ILE 38 HG22 ILE 38 -8.235 -4.764 4.042
298 HG23 ILE 38 HG23 ILE 38 -9.943 -4.581 3.636
299 HD11 ILE 38 HD11 ILE 38 -11.720 -3.743 0.582
300 HD12 ILE 38 HD12 ILE 38 -11.358 -4.073 2.276
301 HD13 ILE 38 HD13 ILE 38 -11.136 -5.336 1.065
302 H LEU 39 HN LEU 39 -5.903 -6.165 1.583
303 HA LEU 39 HA LEU 39 -5.382 -6.065 -1.309
304 HB2 LEU 39 HB2 LEU 39 -3.747 -6.560 0.901
305 HB3 LEU 39 HB1 LEU 39 -3.994 -8.127 0.177
306 HG LEU 39 HG LEU 39 -2.768 -5.700 -1.121
307 HD11 LEU 39 HD11 LEU 39 -1.121 -6.680 0.170
308 HD12 LEU 39 HD12 LEU 39 -0.905 -7.485 -1.382
309 HD13 LEU 39 HD13 LEU 39 -1.752 -8.301 -0.070
310 HD21 LEU 39 HD21 LEU 39 -2.460 -7.055 -3.091
311 HD22 LEU 39 HD22 LEU 39 -4.177 -6.926 -2.712
312 HD23 LEU 39 HD23 LEU 39 -3.296 -8.403 -2.324
313 H THR 40 HN THR 40 -6.517 -7.447 -2.565
314 HA THR 40 HA THR 40 -8.033 -9.566 -1.298
315 HB THR 40 HB THR 40 -8.755 -9.994 -3.744
316 HG1 THR 40 HG1 THR 40 -7.949 -8.703 -5.192
317 HG21 THR 40 HG21 THR 40 -9.468 -7.453 -2.287
318 HG22 THR 40 HG22 THR 40 -10.237 -9.029 -2.114
319 HG23 THR 40 HG23 THR 40 -10.389 -8.136 -3.626
320 H ASN 41 HN ASN 41 -8.052 -11.755 -2.311
321 HA ASN 41 HA ASN 41 -5.520 -12.916 -2.138
322 HB2 ASN 41 HB2 ASN 41 -7.620 -14.155 -1.779
323 HB3 ASN 41 HB1 ASN 41 -7.981 -14.034 -3.498
324 HD21 ASN 41 HD21 ASN 41 -5.991 -15.541 -1.082
325 HD22 ASN 41 HD22 ASN 41 -5.369 -16.798 -2.098
326 H ASP 42 HN ASP 42 -7.415 -12.005 -4.973
327 HA ASP 42 HA ASP 42 -5.726 -13.132 -6.916
328 HB2 ASP 42 HB2 ASP 42 -6.913 -11.769 -8.535
329 HB3 ASP 42 HB1 ASP 42 -8.055 -12.420 -7.369
330 H GLU 43 HN GLU 43 -5.761 -9.921 -5.431
331 HA GLU 43 HA GLU 43 -3.705 -8.887 -7.096
332 HB2 GLU 43 HB2 GLU 43 -4.866 -7.979 -4.480
333 HB3 GLU 43 HB1 GLU 43 -3.509 -7.149 -5.224
334 HG2 GLU 43 HG2 GLU 43 -4.915 -6.849 -7.261
335 HG3 GLU 43 HG1 GLU 43 -6.274 -7.495 -6.342
336 H LYS 44 HN LYS 44 -3.712 -10.282 -3.824
337 HA LYS 44 HA LYS 44 -1.002 -9.991 -3.270
338 HB2 LYS 44 HB2 LYS 44 -3.051 -11.986 -2.388
339 HB3 LYS 44 HB1 LYS 44 -1.364 -12.222 -1.950
340 HG2 LYS 44 HG2 LYS 44 -1.511 -9.777 -1.133
341 HG3 LYS 44 HG1 LYS 44 -3.248 -10.060 -1.100
342 HD2 LYS 44 HD2 LYS 44 -2.582 -10.630 1.048
343 HD3 LYS 44 HD1 LYS 44 -2.645 -12.191 0.225
344 HE2 LYS 44 HE2 LYS 44 -0.620 -12.060 1.526
345 HE3 LYS 44 HE1 LYS 44 -0.213 -12.024 -0.188
346 HZ1 LYS 44 HZ1 LYS 44 1.060 -10.387 1.019
347 HZ2 LYS 44 HZ2 LYS 44 -0.349 -9.673 1.624
348 HZ3 LYS 44 HZ3 LYS 44 -0.009 -9.604 -0.036
349 H ALA 45 HN ALA 45 -2.659 -12.423 -5.163
350 HA ALA 45 HA ALA 45 -0.365 -14.052 -5.624
351 HB1 ALA 45 HB1 ALA 45 -2.923 -13.847 -7.210
352 HB2 ALA 45 HB2 ALA 45 -2.657 -14.898 -5.821
353 HB3 ALA 45 HB3 ALA 45 -1.738 -15.149 -7.303
354 H ALA 46 HN ALA 46 -1.261 -11.007 -6.762
355 HA ALA 46 HA ALA 46 0.046 -11.403 -9.369
356 HB1 ALA 46 HB1 ALA 46 -1.081 -9.379 -10.084
357 HB2 ALA 46 HB2 ALA 46 -1.726 -9.140 -8.460
358 HB3 ALA 46 HB3 ALA 46 -2.243 -10.527 -9.419
359 H LEU 47 HN LEU 47 0.514 -9.897 -6.308
360 HA LEU 47 HA LEU 47 2.143 -7.736 -7.247
361 HB2 LEU 47 HB2 LEU 47 2.300 -8.862 -4.466
362 HB3 LEU 47 HB1 LEU 47 2.609 -7.226 -4.994
363 HG LEU 47 HG LEU 47 -0.055 -8.574 -4.627
364 HD11 LEU 47 HD11 LEU 47 -0.416 -6.625 -3.139
365 HD12 LEU 47 HD12 LEU 47 1.263 -6.157 -3.410
366 HD13 LEU 47 HD13 LEU 47 0.889 -7.688 -2.615
367 HD21 LEU 47 HD21 LEU 47 -0.040 -7.252 -6.735
368 HD22 LEU 47 HD22 LEU 47 0.384 -5.829 -5.783
369 HD23 LEU 47 HD23 LEU 47 -1.152 -6.653 -5.508
370 HA PRO 48 HA PRO 48 5.963 -9.962 -7.917
371 HB2 PRO 48 HB2 PRO 48 7.227 -7.390 -7.171
372 HB3 PRO 48 HB1 PRO 48 7.391 -8.332 -8.656
373 HG2 PRO 48 HG2 PRO 48 6.004 -6.046 -8.606
374 HG3 PRO 48 HG1 PRO 48 5.493 -7.420 -9.603
375 HD2 PRO 48 HD2 PRO 48 4.407 -6.467 -6.986
376 HD3 PRO 48 HD1 PRO 48 3.548 -7.117 -8.399
377 H ASN 49 HN ASN 49 7.597 -10.848 -6.673
378 HA ASN 49 HA ASN 49 7.025 -11.109 -3.929
379 HB2 ASN 49 HB2 ASN 49 9.444 -11.971 -5.520
380 HB3 ASN 49 HB1 ASN 49 9.169 -12.408 -3.839
381 HD21 ASN 49 HD21 ASN 49 9.411 -14.131 -6.146
382 HD22 ASN 49 HD22 ASN 49 7.938 -15.034 -6.237
383 H ASP 50 HN ASP 50 9.116 -8.959 -5.657
384 HA ASP 50 HA ASP 50 9.968 -7.842 -3.066
385 HB2 ASP 50 HB2 ASP 50 11.898 -8.494 -4.399
386 HB3 ASP 50 HB1 ASP 50 11.279 -7.604 -5.785
387 H ILE 51 HN ILE 51 8.841 -6.120 -2.521
388 HA ILE 51 HA ILE 51 7.631 -4.485 -4.637
389 HB ILE 51 HB ILE 51 6.851 -4.755 -1.730
390 HG12 ILE 51 HG12 ILE 51 5.476 -5.648 -4.276
391 HG13 ILE 51 HG11 ILE 51 6.307 -6.703 -3.139
392 HG21 ILE 51 HG21 ILE 51 4.933 -3.347 -2.281
393 HG22 ILE 51 HG22 ILE 51 5.538 -3.150 -3.924
394 HG23 ILE 51 HG23 ILE 51 6.445 -2.485 -2.566
395 HD11 ILE 51 HD11 ILE 51 3.844 -5.076 -2.566
396 HD12 ILE 51 HD12 ILE 51 4.675 -6.127 -1.419
397 HD13 ILE 51 HD13 ILE 51 3.907 -6.816 -2.850
398 H ASN 52 HN ASN 52 8.268 -2.437 -4.922
399 HA ASN 52 HA ASN 52 10.051 -1.282 -2.893
400 HB2 ASN 52 HB2 ASN 52 10.977 0.140 -4.628
401 HB3 ASN 52 HB1 ASN 52 11.100 -1.539 -5.095
402 HD21 ASN 52 HD21 ASN 52 11.156 0.848 -6.724
403 HD22 ASN 52 HD22 ASN 52 9.870 0.686 -7.874
404 H MET 53 HN MET 53 10.065 1.274 -3.427
405 HA MET 53 HA MET 53 7.743 2.251 -2.189
406 HB2 MET 53 HB2 MET 53 9.973 3.341 -2.149
407 HB3 MET 53 HB1 MET 53 9.746 3.793 -3.832
408 HG2 MET 53 HG2 MET 53 9.133 5.702 -2.703
409 HG3 MET 53 HG1 MET 53 7.596 4.898 -3.023
410 HE1 MET 53 HE1 MET 53 10.279 3.920 -0.273
411 HE2 MET 53 HE2 MET 53 9.709 4.906 1.072
412 HE3 MET 53 HE3 MET 53 10.349 5.679 -0.378
413 H ASP 54 HN ASP 54 8.770 2.324 -5.583
414 HA ASP 54 HA ASP 54 6.706 3.980 -6.510
415 HB2 ASP 54 HB2 ASP 54 8.718 3.586 -7.827
416 HB3 ASP 54 HB1 ASP 54 8.278 1.891 -8.025
417 H TYR 55 HN TYR 55 6.897 0.430 -6.306
418 HA TYR 55 HA TYR 55 4.444 -0.026 -7.635
419 HB2 TYR 55 HB2 TYR 55 6.234 -1.778 -7.111
420 HB3 TYR 55 HB1 TYR 55 5.556 -1.832 -5.487
421 HD1 TYR 55 HD1 TYR 55 3.496 -2.985 -5.038
422 HD2 TYR 55 HD2 TYR 55 4.844 -2.474 -9.044
423 HE1 TYR 55 HE1 TYR 55 1.796 -4.560 -5.807
424 HE2 TYR 55 HE2 TYR 55 3.136 -4.057 -9.822
425 HH TYR 55 HH TYR 55 0.548 -5.078 -7.900
426 H TRP 56 HN TRP 56 5.275 0.397 -4.212
427 HA TRP 56 HA TRP 56 2.750 0.055 -3.116
428 HB2 TRP 56 HB2 TRP 56 4.669 0.237 -1.690
429 HB3 TRP 56 HB1 TRP 56 5.046 1.839 -2.300
430 HD1 TRP 56 HD1 TRP 56 4.789 3.311 -0.206
431 HE1 TRP 56 HE1 TRP 56 2.894 3.792 1.462
432 HE3 TRP 56 HE3 TRP 56 1.452 -0.231 -1.744
433 HZ2 TRP 56 HZ2 TRP 56 0.310 2.807 2.041
434 HZ3 TRP 56 HZ3 TRP 56 -0.715 -0.394 -0.587
435 HH2 TRP 56 HH2 TRP 56 -1.271 1.095 1.269
436 H LEU 57 HN LEU 57 4.291 3.012 -4.332
437 HA LEU 57 HA LEU 57 2.208 4.780 -3.734
438 HB2 LEU 57 HB2 LEU 57 4.079 4.940 -6.095
439 HB3 LEU 57 HB1 LEU 57 3.195 6.271 -5.372
440 HG LEU 57 HG LEU 57 5.345 4.676 -4.006
441 HD11 LEU 57 HD11 LEU 57 6.295 5.998 -5.783
442 HD12 LEU 57 HD12 LEU 57 6.691 6.730 -4.229
443 HD13 LEU 57 HD13 LEU 57 5.420 7.426 -5.233
444 HD21 LEU 57 HD21 LEU 57 3.684 7.036 -3.153
445 HD22 LEU 57 HD22 LEU 57 5.223 6.635 -2.390
446 HD23 LEU 57 HD23 LEU 57 3.887 5.484 -2.338
447 H ASN 58 HN ASN 58 2.886 3.014 -6.712
448 HA ASN 58 HA ASN 58 0.669 3.992 -8.175
449 HB2 ASN 58 HB2 ASN 58 2.749 2.926 -9.127
450 HB3 ASN 58 HB1 ASN 58 2.107 1.369 -8.621
451 HD21 ASN 58 HD21 ASN 58 2.744 2.418 -11.278
452 HD22 ASN 58 HD22 ASN 58 1.291 2.269 -12.204
453 H PHE 59 HN PHE 59 1.155 0.956 -6.387
454 HA PHE 59 HA PHE 59 -1.375 -0.171 -6.875
455 HB2 PHE 59 HB2 PHE 59 0.431 -1.494 -5.994
456 HB3 PHE 59 HB1 PHE 59 0.575 -0.467 -4.578
457 HD1 PHE 59 HD1 PHE 59 -1.129 -3.257 -6.118
458 HD2 PHE 59 HD2 PHE 59 -1.111 -0.615 -2.783
459 HE1 PHE 59 HE1 PHE 59 -2.557 -4.824 -4.873
460 HE2 PHE 59 HE2 PHE 59 -2.545 -2.173 -1.535
461 HZ PHE 59 HZ PHE 59 -3.266 -4.284 -2.579
462 H ALA 60 HN ALA 60 -0.197 2.022 -4.395
463 HA ALA 60 HA ALA 60 -2.634 2.276 -2.968
464 HB1 ALA 60 HB1 ALA 60 -0.343 4.225 -3.164
465 HB2 ALA 60 HB2 ALA 60 -0.475 2.898 -2.008
466 HB3 ALA 60 HB3 ALA 60 -1.621 4.237 -1.948
467 H LYS 61 HN LYS 61 -1.429 3.765 -5.897
468 HA LYS 61 HA LYS 61 -3.258 5.956 -5.986
469 HB2 LYS 61 HB2 LYS 61 -1.942 4.493 -8.281
470 HB3 LYS 61 HB1 LYS 61 -2.798 6.018 -8.385
471 HG2 LYS 61 HG2 LYS 61 -0.369 5.655 -6.683
472 HG3 LYS 61 HG1 LYS 61 -0.301 6.143 -8.369
473 HD2 LYS 61 HD2 LYS 61 -0.686 8.252 -7.777
474 HD3 LYS 61 HD1 LYS 61 -2.232 7.769 -7.079
475 HE2 LYS 61 HE2 LYS 61 0.449 7.846 -5.716
476 HE3 LYS 61 HE1 LYS 61 -0.959 8.854 -5.374
477 HZ1 LYS 61 HZ1 LYS 61 -2.156 6.796 -4.775
478 HZ2 LYS 61 HZ2 LYS 61 -0.846 7.130 -3.754
479 HZ3 LYS 61 HZ3 LYS 61 -0.709 5.932 -4.946
480 H LYS 62 HN LYS 62 -3.312 2.630 -6.974
481 HA LYS 62 HA LYS 62 -5.670 2.753 -8.544
482 HB2 LYS 62 HB2 LYS 62 -3.900 1.087 -8.874
483 HB3 LYS 62 HB1 LYS 62 -4.237 0.416 -7.289
484 HG2 LYS 62 HG2 LYS 62 -6.492 -0.217 -8.076
485 HG3 LYS 62 HG1 LYS 62 -6.062 0.380 -9.681
486 HD2 LYS 62 HD2 LYS 62 -5.726 -1.999 -9.647
487 HD3 LYS 62 HD1 LYS 62 -4.146 -1.214 -9.691
488 HE2 LYS 62 HE2 LYS 62 -4.114 -1.449 -7.168
489 HE3 LYS 62 HE1 LYS 62 -5.517 -2.498 -7.340
490 HZ1 LYS 62 HZ1 LYS 62 -3.749 -3.956 -7.302
491 HZ2 LYS 62 HZ2 LYS 62 -2.744 -2.951 -8.228
492 HZ3 LYS 62 HZ3 LYS 62 -4.025 -3.779 -8.965
493 H HIS 63 HN HIS 63 -5.008 1.539 -5.273
494 HA HIS 63 HA HIS 63 -7.776 0.941 -4.769
495 HB2 HIS 63 HB2 HIS 63 -5.386 1.139 -2.928
496 HB3 HIS 63 HB1 HIS 63 -6.997 0.703 -2.377
497 HD1 HIS 63 HD1 HIS 63 -7.153 -1.719 -2.025
498 HD2 HIS 63 HD2 HIS 63 -4.711 -0.788 -5.260
499 HE1 HIS 63 HE1 HIS 63 -6.324 -3.911 -2.894
500 HE2 HIS 63 HE2 HIS 63 -5.087 -3.351 -5.011
501 H TYR 64 HN TYR 64 -5.670 3.619 -4.417
502 HA TYR 64 HA TYR 64 -5.570 5.388 -2.986
503 HB2 TYR 64 HB2 TYR 64 -7.412 5.733 -5.005
504 HB3 TYR 64 HB1 TYR 64 -8.272 6.292 -3.572
505 HD1 TYR 64 HD1 TYR 64 -5.503 6.911 -5.840
506 HD2 TYR 64 HD2 TYR 64 -7.415 8.180 -2.260
507 HE1 TYR 64 HE1 TYR 64 -4.240 9.013 -5.921
508 HE2 TYR 64 HE2 TYR 64 -6.162 10.294 -2.332
509 HH TYR 64 HH TYR 64 -4.588 11.401 -5.024
510 H ASN 65 HN ASN 65 -9.036 5.288 -2.553
511 HA ASN 65 HA ASN 65 -9.019 3.918 -0.073
512 HB2 ASN 65 HB2 ASN 65 -7.935 6.139 0.532
513 HB3 ASN 65 HB1 ASN 65 -9.462 6.909 0.124
514 HD21 ASN 65 HD21 ASN 65 -7.849 4.735 2.322
515 HD22 ASN 65 HD22 ASN 65 -9.013 4.847 3.595
516 H TYR 66 HN TYR 66 -10.388 3.843 -2.543
517 HA TYR 66 HA TYR 66 -13.101 4.663 -1.736
518 HB2 TYR 66 HB2 TYR 66 -13.634 5.199 -4.047
519 HB3 TYR 66 HB1 TYR 66 -12.238 6.133 -3.528
520 HD1 TYR 66 HD1 TYR 66 -10.019 5.665 -4.452
521 HD2 TYR 66 HD2 TYR 66 -13.436 3.496 -5.755
522 HE1 TYR 66 HE1 TYR 66 -8.758 4.854 -6.401
523 HE2 TYR 66 HE2 TYR 66 -12.184 2.678 -7.703
524 HH TYR 66 HH TYR 66 -8.806 2.986 -7.977
525 H GLU 67 HN GLU 67 -11.461 2.070 -1.715
526 HA GLU 67 HA GLU 67 -12.476 0.253 -3.570
527 HB2 GLU 67 HB2 GLU 67 -11.775 -0.298 -0.681
528 HB3 GLU 67 HB1 GLU 67 -11.854 -1.484 -1.977
529 HG2 GLU 67 HG2 GLU 67 -10.013 -0.342 -3.121
530 HG3 GLU 67 HG1 GLU 67 -9.917 0.811 -1.791
531 H GLN 68 HN GLN 68 -13.647 1.008 -0.316
532 HA GLN 68 HA GLN 68 -16.341 1.118 -1.162
533 HB2 GLN 68 HB2 GLN 68 -16.138 -1.339 -1.088
534 HB3 GLN 68 HB1 GLN 68 -15.598 -1.243 0.583
535 HG2 GLN 68 HG2 GLN 68 -17.964 -1.894 0.359
536 HG3 GLN 68 HG1 GLN 68 -17.737 -0.416 1.290
537 HE21 GLN 68 HE21 GLN 68 -18.479 1.521 0.475
538 HE22 GLN 68 HE22 GLN 68 -19.523 1.621 -0.899
539 HA PRO 69 HA PRO 69 -15.270 3.795 2.406
540 HB2 PRO 69 HB2 PRO 69 -17.708 5.105 1.316
541 HB3 PRO 69 HB1 PRO 69 -16.163 5.821 1.791
542 HG2 PRO 69 HG2 PRO 69 -16.795 5.538 -0.780
543 HG3 PRO 69 HG1 PRO 69 -15.137 5.261 -0.214
544 HD2 PRO 69 HD2 PRO 69 -17.247 3.274 -0.950
545 HD3 PRO 69 HD1 PRO 69 -15.497 3.224 -1.247
546 H PHE 70 HN PHE 70 -16.001 3.451 4.385
547 HA PHE 70 HA PHE 70 -17.223 2.666 6.124
548 HB2 PHE 70 HB2 PHE 70 -19.558 3.484 4.382
549 HB3 PHE 70 HB1 PHE 70 -19.662 3.083 6.093
550 HD1 PHE 70 HD1 PHE 70 -18.858 5.620 3.658
551 HD2 PHE 70 HD2 PHE 70 -18.542 4.546 7.763
552 HE1 PHE 70 HE1 PHE 70 -18.371 7.963 4.228
553 HE2 PHE 70 HE2 PHE 70 -18.058 6.888 8.342
554 HZ PHE 70 HZ PHE 70 -17.971 8.600 6.573
555 H LYS 71 HN LYS 71 -16.226 0.711 4.637
556 HA LYS 71 HA LYS 71 -18.172 -1.189 3.746
557 HB2 LYS 71 HB2 LYS 71 -15.587 -0.927 3.202
558 HB3 LYS 71 HB1 LYS 71 -15.415 -1.994 4.586
559 HG2 LYS 71 HG2 LYS 71 -16.974 -2.576 2.077
560 HG3 LYS 71 HG1 LYS 71 -15.399 -3.239 2.504
561 HD2 LYS 71 HD2 LYS 71 -16.386 -4.363 4.431
562 HD3 LYS 71 HD1 LYS 71 -17.961 -3.670 4.040
563 HE2 LYS 71 HE2 LYS 71 -16.375 -5.594 2.347
564 HE3 LYS 71 HE1 LYS 71 -17.833 -5.961 3.258
565 HZ1 LYS 71 HZ1 LYS 71 -19.051 -4.422 1.854
566 HZ2 LYS 71 HZ2 LYS 71 -18.322 -5.632 0.931
567 HZ3 LYS 71 HZ3 LYS 71 -17.651 -4.084 0.967
568 H HIS 72 HN HIS 72 -19.528 -2.117 5.165
569 HA HIS 72 HA HIS 72 -18.581 -2.532 7.915
570 HB2 HIS 72 HB2 HIS 72 -21.431 -2.441 6.904
571 HB3 HIS 72 HB1 HIS 72 -20.925 -2.541 8.584
572 HD1 HIS 72 HD1 HIS 72 -18.969 -0.317 8.912
573 HD2 HIS 72 HD2 HIS 72 -22.352 0.060 6.523
574 HE1 HIS 72 HE1 HIS 72 -19.377 2.156 8.698
575 HE2 HIS 72 HE2 HIS 72 -21.507 2.354 7.364
576 H ILE 73 HN ILE 73 -19.501 -4.415 9.045
577 HA ILE 73 HA ILE 73 -19.427 -6.646 9.354
578 HB ILE 73 HB ILE 73 -21.799 -6.217 8.821
579 HG12 ILE 73 HG12 ILE 73 -20.794 -8.930 7.942
580 HG13 ILE 73 HG11 ILE 73 -21.045 -8.420 9.608
581 HG21 ILE 73 HG21 ILE 73 -21.636 -5.572 6.492
582 HG22 ILE 73 HG22 ILE 73 -22.743 -6.934 6.681
583 HG23 ILE 73 HG23 ILE 73 -21.114 -7.200 6.058
584 HD11 ILE 73 HD11 ILE 73 -23.433 -8.180 9.169
585 HD12 ILE 73 HD12 ILE 73 -22.865 -9.816 8.833
586 HD13 ILE 73 HD13 ILE 73 -23.176 -8.699 7.503
587 H ASN 74 HN ASN 74 -17.254 -5.991 7.934
588 HA ASN 74 HA ASN 74 -16.299 -8.457 7.141
589 HB2 ASN 74 HB2 ASN 74 -17.706 -8.235 5.127
590 HB3 ASN 74 HB1 ASN 74 -16.910 -6.712 4.746
591 HD21 ASN 74 HD21 ASN 74 -16.227 -7.539 2.756
592 HD22 ASN 74 HD22 ASN 74 -14.915 -8.652 2.637
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 -5.562 14.923 -2.968
2 H2 MET 1 HT2 MET 1 -6.082 14.530 -4.523
3 H3 MET 1 HT3 MET 1 -6.291 16.099 -3.939
4 HA MET 1 HA MET 1 -4.465 15.996 -5.494
5 HB2 MET 1 HB2 MET 1 -4.425 17.592 -3.586
6 HB3 MET 1 HB1 MET 1 -3.529 16.407 -2.646
7 HG2 MET 1 HG2 MET 1 -2.068 18.118 -3.580
8 HG3 MET 1 HG1 MET 1 -1.686 16.517 -4.213
9 HE1 MET 1 HE1 MET 1 -0.280 17.549 -6.221
10 HE2 MET 1 HE2 MET 1 -0.586 19.147 -5.543
11 HE3 MET 1 HE3 MET 1 -0.879 18.845 -7.254
12 H ALA 2 HN ALA 2 -3.567 14.332 -6.479
13 HA ALA 2 HA ALA 2 -2.942 11.889 -5.220
14 HB1 ALA 2 HB1 ALA 2 -2.064 12.867 -7.933
15 HB2 ALA 2 HB2 ALA 2 -3.619 12.116 -7.576
16 HB3 ALA 2 HB3 ALA 2 -2.130 11.193 -7.389
17 H SER 3 HN SER 3 -0.850 14.523 -6.363
18 HA SER 3 HA SER 3 1.584 13.200 -5.863
19 HB2 SER 3 HB2 SER 3 1.360 15.237 -7.276
20 HB3 SER 3 HB1 SER 3 1.064 16.180 -5.817
21 HG SER 3 HG SER 3 3.275 14.775 -5.418
22 H ASP 4 HN ASP 4 -0.511 15.144 -3.828
23 HA ASP 4 HA ASP 4 1.277 15.381 -1.639
24 HB2 ASP 4 HB2 ASP 4 -0.617 16.883 -1.805
25 HB3 ASP 4 HB1 ASP 4 -1.742 15.530 -1.762
26 H MET 5 HN MET 5 -1.281 13.107 -2.476
27 HA MET 5 HA MET 5 -1.196 11.592 -0.109
28 HB2 MET 5 HB2 MET 5 -2.984 11.591 -1.926
29 HB3 MET 5 HB1 MET 5 -1.924 10.525 -2.837
30 HG2 MET 5 HG2 MET 5 -3.611 9.260 -1.643
31 HG3 MET 5 HG1 MET 5 -2.000 8.894 -1.027
32 HE1 MET 5 HE1 MET 5 -4.714 8.154 0.495
33 HE2 MET 5 HE2 MET 5 -4.304 8.594 2.152
34 HE3 MET 5 HE3 MET 5 -3.119 7.768 1.140
35 H GLU 6 HN GLU 6 0.599 11.378 -3.136
36 HA GLU 6 HA GLU 6 1.944 8.960 -2.670
37 HB2 GLU 6 HB2 GLU 6 2.012 9.889 -4.845
38 HB3 GLU 6 HB1 GLU 6 2.667 11.413 -4.266
39 HG2 GLU 6 HG2 GLU 6 4.751 10.190 -3.658
40 HG3 GLU 6 HG1 GLU 6 4.070 8.761 -4.431
41 H GLU 7 HN GLU 7 2.736 12.275 -1.737
42 HA GLU 7 HA GLU 7 5.246 11.866 -0.599
43 HB2 GLU 7 HB2 GLU 7 3.057 13.729 0.341
44 HB3 GLU 7 HB1 GLU 7 4.758 13.856 0.763
45 HG2 GLU 7 HG2 GLU 7 3.656 14.082 -2.026
46 HG3 GLU 7 HG1 GLU 7 4.057 15.440 -0.978
47 H LYS 8 HN LYS 8 2.038 11.680 0.867
48 HA LYS 8 HA LYS 8 2.817 10.971 3.456
49 HB2 LYS 8 HB2 LYS 8 0.299 10.640 1.890
50 HB3 LYS 8 HB1 LYS 8 0.445 9.830 3.437
51 HG2 LYS 8 HG2 LYS 8 -0.704 11.956 3.613
52 HG3 LYS 8 HG1 LYS 8 0.807 11.963 4.512
53 HD2 LYS 8 HD2 LYS 8 1.898 13.204 2.751
54 HD3 LYS 8 HD1 LYS 8 0.446 13.108 1.753
55 HE2 LYS 8 HE2 LYS 8 0.554 14.446 4.448
56 HE3 LYS 8 HE1 LYS 8 0.776 15.297 2.920
57 HZ1 LYS 8 HZ1 LYS 8 -1.509 15.405 3.802
58 HZ2 LYS 8 HZ2 LYS 8 -1.647 13.731 3.621
59 HZ3 LYS 8 HZ3 LYS 8 -1.428 14.716 2.257
60 H PHE 9 HN PHE 9 1.999 8.907 0.674
61 HA PHE 9 HA PHE 9 2.271 6.447 2.011
62 HB2 PHE 9 HB2 PHE 9 2.566 7.184 -0.897
63 HB3 PHE 9 HB1 PHE 9 2.732 5.530 -0.324
64 HD1 PHE 9 HD1 PHE 9 0.597 7.409 -2.037
65 HD2 PHE 9 HD2 PHE 9 0.639 5.169 1.579
66 HE1 PHE 9 HE1 PHE 9 -1.838 7.109 -2.201
67 HE2 PHE 9 HE2 PHE 9 -1.797 4.867 1.425
68 HZ PHE 9 HZ PHE 9 -3.038 5.837 -0.463
69 H ARG 10 HN ARG 10 4.607 8.420 0.243
70 HA ARG 10 HA ARG 10 6.773 6.649 0.329
71 HB2 ARG 10 HB2 ARG 10 6.819 8.590 -1.099
72 HB3 ARG 10 HB1 ARG 10 6.688 9.665 0.284
73 HG2 ARG 10 HG2 ARG 10 8.899 8.990 1.041
74 HG3 ARG 10 HG1 ARG 10 9.029 7.867 -0.314
75 HD2 ARG 10 HD2 ARG 10 8.783 10.865 -0.489
76 HD3 ARG 10 HD1 ARG 10 10.235 9.917 -0.796
77 HE ARG 10 HE ARG 10 9.096 8.967 -2.728
78 HH11 ARG 10 HH11 ARG 10 7.750 11.890 -1.345
79 HH12 ARG 10 HH12 ARG 10 6.918 12.359 -2.796
80 HH21 ARG 10 HH21 ARG 10 8.016 9.565 -4.637
81 HH22 ARG 10 HH22 ARG 10 7.049 11.007 -4.676
82 H GLU 11 HN GLU 11 5.791 9.187 2.557
83 HA GLU 11 HA GLU 11 7.981 9.006 4.308
84 HB2 GLU 11 HB2 GLU 11 6.408 10.883 4.185
85 HB3 GLU 11 HB1 GLU 11 5.191 9.870 4.958
86 HG2 GLU 11 HG2 GLU 11 6.192 11.211 6.611
87 HG3 GLU 11 HG1 GLU 11 6.742 9.564 6.851
88 H ALA 12 HN ALA 12 4.780 7.549 4.435
89 HA ALA 12 HA ALA 12 5.183 6.147 6.858
90 HB1 ALA 12 HB1 ALA 12 3.232 5.543 4.645
91 HB2 ALA 12 HB2 ALA 12 2.960 6.669 5.975
92 HB3 ALA 12 HB3 ALA 12 3.150 4.946 6.302
93 H PHE 13 HN PHE 13 5.690 5.288 3.475
94 HA PHE 13 HA PHE 13 6.145 2.551 3.771
95 HB2 PHE 13 HB2 PHE 13 5.965 3.728 1.582
96 HB3 PHE 13 HB1 PHE 13 7.554 4.429 1.859
97 HD1 PHE 13 HD1 PHE 13 5.777 1.212 1.452
98 HD2 PHE 13 HD2 PHE 13 9.494 3.267 1.251
99 HE1 PHE 13 HE1 PHE 13 6.804 -0.763 0.422
100 HE2 PHE 13 HE2 PHE 13 10.531 1.289 0.214
101 HZ PHE 13 HZ PHE 13 9.186 -0.729 -0.201
102 H ILE 14 HN ILE 14 8.381 5.279 3.986
103 HA ILE 14 HA ILE 14 10.727 3.827 4.425
104 HB ILE 14 HB ILE 14 10.003 6.594 5.386
105 HG12 ILE 14 HG12 ILE 14 11.614 5.710 2.983
106 HG13 ILE 14 HG11 ILE 14 9.927 6.206 2.920
107 HG21 ILE 14 HG21 ILE 14 12.734 5.348 5.115
108 HG22 ILE 14 HG22 ILE 14 11.876 5.562 6.640
109 HG23 ILE 14 HG23 ILE 14 12.363 6.974 5.696
110 HD11 ILE 14 HD11 ILE 14 12.232 7.931 3.787
111 HD12 ILE 14 HD12 ILE 14 10.540 8.425 3.696
112 HD13 ILE 14 HD13 ILE 14 11.415 7.995 2.225
113 H LEU 15 HN LEU 15 8.237 4.910 6.676
114 HA LEU 15 HA LEU 15 9.574 4.434 9.078
115 HB2 LEU 15 HB2 LEU 15 6.645 4.162 8.427
116 HB3 LEU 15 HB1 LEU 15 7.302 4.112 10.050
117 HG LEU 15 HG LEU 15 7.492 6.474 8.181
118 HD11 LEU 15 HD11 LEU 15 5.759 6.044 10.608
119 HD12 LEU 15 HD12 LEU 15 5.202 6.052 8.935
120 HD13 LEU 15 HD13 LEU 15 5.864 7.522 9.650
121 HD21 LEU 15 HD21 LEU 15 8.252 7.668 10.199
122 HD22 LEU 15 HD22 LEU 15 9.365 6.390 9.714
123 HD23 LEU 15 HD23 LEU 15 8.272 6.139 11.076
124 H PHE 16 HN PHE 16 7.591 2.239 7.119
125 HA PHE 16 HA PHE 16 8.097 -0.008 8.833
126 HB2 PHE 16 HB2 PHE 16 6.891 0.222 6.072
127 HB3 PHE 16 HB1 PHE 16 7.076 -1.312 6.911
128 HD1 PHE 16 HD1 PHE 16 5.701 2.100 7.605
129 HD2 PHE 16 HD2 PHE 16 5.222 -2.112 8.001
130 HE1 PHE 16 HE1 PHE 16 3.527 2.454 8.701
131 HE2 PHE 16 HE2 PHE 16 3.040 -1.764 9.096
132 HZ PHE 16 HZ PHE 16 2.196 0.522 9.448
133 H SER 17 HN SER 17 9.598 1.415 6.048
134 HA SER 17 HA SER 17 11.166 -0.965 5.463
135 HB2 SER 17 HB2 SER 17 11.149 1.715 4.063
136 HB3 SER 17 HB1 SER 17 11.887 0.226 3.472
137 HG SER 17 HG SER 17 9.129 0.744 3.892
138 H SER 18 HN SER 18 11.500 1.217 7.759
139 HA SER 18 HA SER 18 14.037 2.310 7.571
140 HB2 SER 18 HB2 SER 18 12.729 1.206 10.065
141 HB3 SER 18 HB1 SER 18 14.004 2.425 10.001
142 HG SER 18 HG SER 18 12.069 3.278 8.433
143 H CYS 19 HN CYS 19 13.126 -0.996 8.031
144 HA CYS 19 HA CYS 19 15.830 -1.776 8.763
145 HB2 CYS 19 HB2 CYS 19 14.795 -4.103 8.713
146 HB3 CYS 19 HB1 CYS 19 14.169 -2.997 9.928
147 HG CYS 19 HG CYS 19 12.020 -4.465 8.973
148 H SER 20 HN SER 20 13.527 -2.901 6.292
149 HA SER 20 HA SER 20 15.786 -3.231 4.434
150 HB2 SER 20 HB2 SER 20 14.230 -4.870 3.292
151 HB3 SER 20 HB1 SER 20 14.737 -5.349 4.910
152 HG SER 20 HG SER 20 12.251 -4.281 4.075
153 H ASP 21 HN ASP 21 15.696 -2.223 2.445
154 HA ASP 21 HA ASP 21 13.829 -0.046 2.230
155 HB2 ASP 21 HB2 ASP 21 15.059 0.554 0.176
156 HB3 ASP 21 HB1 ASP 21 16.135 0.324 1.548
157 H HIS 22 HN HIS 22 14.074 -3.235 0.973
158 HA HIS 22 HA HIS 22 11.671 -2.766 -0.657
159 HB2 HIS 22 HB2 HIS 22 13.389 -5.252 -0.368
160 HB3 HIS 22 HB1 HIS 22 11.977 -5.109 -1.411
161 HD1 HIS 22 HD1 HIS 22 15.333 -5.367 -1.898
162 HD2 HIS 22 HD2 HIS 22 12.625 -2.427 -3.035
163 HE1 HIS 22 HE1 HIS 22 16.386 -4.201 -3.862
164 HE2 HIS 22 HE2 HIS 22 14.669 -2.516 -4.618
165 H ILE 23 HN ILE 23 9.681 -3.748 -0.016
166 HA ILE 23 HA ILE 23 9.782 -4.331 2.853
167 HB ILE 23 HB ILE 23 8.448 -2.385 2.167
168 HG12 ILE 23 HG12 ILE 23 6.686 -4.561 3.286
169 HG13 ILE 23 HG11 ILE 23 7.959 -3.772 4.212
170 HG21 ILE 23 HG21 ILE 23 7.623 -3.109 0.016
171 HG22 ILE 23 HG22 ILE 23 6.255 -2.728 1.064
172 HG23 ILE 23 HG23 ILE 23 6.702 -4.409 0.772
173 HD11 ILE 23 HD11 ILE 23 5.576 -2.406 2.988
174 HD12 ILE 23 HD12 ILE 23 6.840 -1.632 3.944
175 HD13 ILE 23 HD13 ILE 23 5.773 -2.824 4.689
176 H GLU 24 HN GLU 24 9.372 -6.197 3.616
177 HA GLU 24 HA GLU 24 8.670 -8.438 2.024
178 HB2 GLU 24 HB2 GLU 24 8.906 -8.051 5.010
179 HB3 GLU 24 HB1 GLU 24 8.656 -9.611 4.233
180 HG2 GLU 24 HG2 GLU 24 10.706 -9.399 3.053
181 HG3 GLU 24 HG1 GLU 24 10.969 -7.791 3.698
182 H MET 25 HN MET 25 6.849 -9.709 2.150
183 HA MET 25 HA MET 25 4.462 -8.335 1.929
184 HB2 MET 25 HB2 MET 25 4.959 -11.272 2.368
185 HB3 MET 25 HB1 MET 25 3.389 -10.597 1.958
186 HG2 MET 25 HG2 MET 25 5.869 -10.340 0.279
187 HG3 MET 25 HG1 MET 25 4.588 -11.520 0.022
188 HE1 MET 25 HE1 MET 25 5.636 -9.526 -2.231
189 HE2 MET 25 HE2 MET 25 4.105 -9.037 -2.959
190 HE3 MET 25 HE3 MET 25 4.358 -10.716 -2.483
191 H TYR 26 HN TYR 26 5.910 -9.812 4.776
192 HA TYR 26 HA TYR 26 3.445 -9.871 6.216
193 HB2 TYR 26 HB2 TYR 26 4.747 -10.486 8.131
194 HB3 TYR 26 HB1 TYR 26 5.312 -11.383 6.747
195 HD1 TYR 26 HD1 TYR 26 6.113 -8.560 9.007
196 HD2 TYR 26 HD2 TYR 26 7.582 -11.276 6.087
197 HE1 TYR 26 HE1 TYR 26 8.414 -7.901 9.554
198 HE2 TYR 26 HE2 TYR 26 9.877 -10.624 6.627
199 HH TYR 26 HH TYR 26 11.088 -8.787 7.598
200 H LYS 27 HN LYS 27 6.061 -7.553 5.903
201 HA LYS 27 HA LYS 27 4.849 -5.739 7.816
202 HB2 LYS 27 HB2 LYS 27 7.337 -5.745 6.165
203 HB3 LYS 27 HB1 LYS 27 6.715 -4.197 6.726
204 HG2 LYS 27 HG2 LYS 27 7.375 -6.534 8.501
205 HG3 LYS 27 HG1 LYS 27 8.448 -5.171 8.187
206 HD2 LYS 27 HD2 LYS 27 6.915 -3.646 9.208
207 HD3 LYS 27 HD1 LYS 27 5.680 -4.897 9.344
208 HE2 LYS 27 HE2 LYS 27 7.207 -6.151 10.854
209 HE3 LYS 27 HE1 LYS 27 8.316 -4.780 10.798
210 HZ1 LYS 27 HZ1 LYS 27 5.491 -4.540 11.669
211 HZ2 LYS 27 HZ2 LYS 27 6.735 -3.407 11.852
212 HZ3 LYS 27 HZ3 LYS 27 6.767 -4.839 12.744
213 H PHE 28 HN PHE 28 4.749 -6.438 4.505
214 HA PHE 28 HA PHE 28 4.101 -3.913 3.443
215 HB2 PHE 28 HB2 PHE 28 4.960 -5.606 2.011
216 HB3 PHE 28 HB1 PHE 28 3.704 -6.737 2.487
217 HD1 PHE 28 HD1 PHE 28 4.154 -3.455 0.793
218 HD2 PHE 28 HD2 PHE 28 1.873 -7.024 1.167
219 HE1 PHE 28 HE1 PHE 28 2.815 -2.794 -1.152
220 HE2 PHE 28 HE2 PHE 28 0.521 -6.375 -0.770
221 HZ PHE 28 HZ PHE 28 0.973 -4.262 -1.939
222 H PHE 29 HN PHE 29 2.047 -6.623 4.522
223 HA PHE 29 HA PHE 29 -0.339 -5.376 3.617
224 HB2 PHE 29 HB2 PHE 29 0.055 -7.877 4.096
225 HB3 PHE 29 HB1 PHE 29 -0.298 -7.469 5.774
226 HD1 PHE 29 HD1 PHE 29 -2.507 -6.597 6.395
227 HD2 PHE 29 HD2 PHE 29 -1.694 -7.990 2.436
228 HE1 PHE 29 HE1 PHE 29 -4.918 -6.717 5.944
229 HE2 PHE 29 HE2 PHE 29 -4.109 -8.115 1.997
230 HZ PHE 29 HZ PHE 29 -5.722 -7.478 3.745
231 H GLU 30 HN GLU 30 1.271 -5.487 6.785
232 HA GLU 30 HA GLU 30 -0.727 -4.000 8.125
233 HB2 GLU 30 HB2 GLU 30 1.084 -3.493 9.801
234 HB3 GLU 30 HB1 GLU 30 0.733 -5.188 9.525
235 HG2 GLU 30 HG2 GLU 30 2.701 -5.291 8.023
236 HG3 GLU 30 HG1 GLU 30 3.079 -3.632 8.480
237 H LEU 31 HN LEU 31 1.999 -3.062 6.154
238 HA LEU 31 HA LEU 31 1.942 -0.313 6.655
239 HB2 LEU 31 HB2 LEU 31 3.727 -1.218 5.362
240 HB3 LEU 31 HB1 LEU 31 2.618 -1.900 4.190
241 HG LEU 31 HG LEU 31 1.998 0.456 3.543
242 HD11 LEU 31 HD11 LEU 31 4.413 1.130 5.213
243 HD12 LEU 31 HD12 LEU 31 2.747 1.603 5.547
244 HD13 LEU 31 HD13 LEU 31 3.573 2.231 4.121
245 HD21 LEU 31 HD21 LEU 31 3.546 -0.957 2.251
246 HD22 LEU 31 HD22 LEU 31 4.892 -0.293 3.179
247 HD23 LEU 31 HD23 LEU 31 3.930 0.759 2.140
248 H MET 32 HN MET 32 -0.150 -2.359 4.751
249 HA MET 32 HA MET 32 -1.357 -0.073 3.430
250 HB2 MET 32 HB2 MET 32 -2.079 -2.994 3.226
251 HB3 MET 32 HB1 MET 32 -2.663 -1.712 2.182
252 HG2 MET 32 HG2 MET 32 -0.323 -1.327 1.455
253 HG3 MET 32 HG1 MET 32 0.144 -2.752 2.382
254 HE1 MET 32 HE1 MET 32 -2.185 -4.689 2.077
255 HE2 MET 32 HE2 MET 32 -0.570 -5.291 1.694
256 HE3 MET 32 HE3 MET 32 -1.905 -5.571 0.576
257 H ASN 33 HN ASN 33 -2.230 -2.431 5.912
258 HA ASN 33 HA ASN 33 -4.960 -1.677 5.926
259 HB2 ASN 33 HB2 ASN 33 -5.313 -3.127 7.676
260 HB3 ASN 33 HB1 ASN 33 -3.882 -3.824 6.941
261 HD21 ASN 33 HD21 ASN 33 -1.982 -1.998 8.079
262 HD22 ASN 33 HD22 ASN 33 -1.912 -2.340 9.769
263 H SER 34 HN SER 34 -2.152 -0.208 7.109
264 HA SER 34 HA SER 34 -3.249 1.286 9.260
265 HB2 SER 34 HB2 SER 34 -0.846 1.836 7.503
266 HB3 SER 34 HB1 SER 34 -1.227 2.711 8.986
267 HG SER 34 HG SER 34 -0.307 0.084 8.639
268 H PHE 35 HN PHE 35 -3.043 1.802 5.793
269 HA PHE 35 HA PHE 35 -4.217 4.463 6.009
270 HB2 PHE 35 HB2 PHE 35 -3.231 2.822 3.677
271 HB3 PHE 35 HB1 PHE 35 -4.086 4.344 3.463
272 HD1 PHE 35 HD1 PHE 35 -3.023 6.427 3.873
273 HD2 PHE 35 HD2 PHE 35 -0.999 2.777 4.702
274 HE1 PHE 35 HE1 PHE 35 -0.906 7.657 4.084
275 HE2 PHE 35 HE2 PHE 35 1.123 4.000 4.920
276 HZ PHE 35 HZ PHE 35 1.172 6.444 4.610
277 H GLY 36 HN GLY 36 -5.358 1.412 6.152
278 HA2 GLY 36 HA2 GLY 36 -7.539 0.627 6.033
279 HA3 GLY 36 HA1 GLY 36 -8.021 2.169 5.335
280 H ILE 37 HN ILE 37 -5.339 0.549 3.956
281 HA ILE 37 HA ILE 37 -6.817 0.136 1.491
282 HB ILE 37 HB ILE 37 -3.887 -0.202 2.157
283 HG12 ILE 37 HG12 ILE 37 -5.277 1.938 0.541
284 HG13 ILE 37 HG11 ILE 37 -4.791 2.125 2.222
285 HG21 ILE 37 HG21 ILE 37 -3.526 -0.353 -0.263
286 HG22 ILE 37 HG22 ILE 37 -5.271 -0.329 -0.520
287 HG23 ILE 37 HG23 ILE 37 -4.523 -1.681 0.332
288 HD11 ILE 37 HD11 ILE 37 -2.476 1.882 1.616
289 HD12 ILE 37 HD12 ILE 37 -3.220 3.155 0.651
290 HD13 ILE 37 HD13 ILE 37 -2.917 1.571 -0.061
291 H ILE 38 HN ILE 38 -7.628 -1.776 0.927
292 HA ILE 38 HA ILE 38 -6.680 -4.161 2.343
293 HB ILE 38 HB ILE 38 -8.790 -5.221 1.390
294 HG12 ILE 38 HG12 ILE 38 -9.553 -2.314 1.044
295 HG13 ILE 38 HG11 ILE 38 -9.249 -3.440 -0.273
296 HG21 ILE 38 HG21 ILE 38 -10.171 -4.306 3.215
297 HG22 ILE 38 HG22 ILE 38 -8.977 -3.027 3.443
298 HG23 ILE 38 HG23 ILE 38 -8.530 -4.711 3.723
299 HD11 ILE 38 HD11 ILE 38 -11.443 -3.678 1.772
300 HD12 ILE 38 HD12 ILE 38 -11.143 -4.793 0.439
301 HD13 ILE 38 HD13 ILE 38 -11.627 -3.129 0.105
302 H LEU 39 HN LEU 39 -6.087 -5.971 1.252
303 HA LEU 39 HA LEU 39 -5.916 -5.814 -1.668
304 HB2 LEU 39 HB2 LEU 39 -3.766 -5.194 -0.222
305 HB3 LEU 39 HB1 LEU 39 -3.602 -6.938 -0.174
306 HG LEU 39 HG LEU 39 -3.861 -5.423 -2.767
307 HD11 LEU 39 HD11 LEU 39 -1.478 -5.463 -2.965
308 HD12 LEU 39 HD12 LEU 39 -1.322 -6.301 -1.421
309 HD13 LEU 39 HD13 LEU 39 -1.902 -4.634 -1.464
310 HD21 LEU 39 HD21 LEU 39 -2.617 -8.085 -2.185
311 HD22 LEU 39 HD22 LEU 39 -2.971 -7.375 -3.759
312 HD23 LEU 39 HD23 LEU 39 -4.290 -7.885 -2.704
313 H THR 40 HN THR 40 -6.752 -7.639 -2.526
314 HA THR 40 HA THR 40 -7.504 -9.740 -0.700
315 HB THR 40 HB THR 40 -8.449 -10.772 -2.880
316 HG1 THR 40 HG1 THR 40 -8.193 -9.641 -4.636
317 HG21 THR 40 HG21 THR 40 -9.501 -8.165 -1.785
318 HG22 THR 40 HG22 THR 40 -9.828 -9.777 -1.149
319 HG23 THR 40 HG23 THR 40 -10.426 -9.320 -2.743
320 H ASN 41 HN ASN 41 -7.195 -12.060 -1.328
321 HA ASN 41 HA ASN 41 -4.420 -12.552 -1.369
322 HB2 ASN 41 HB2 ASN 41 -6.078 -14.029 -0.265
323 HB3 ASN 41 HB1 ASN 41 -6.645 -14.538 -1.852
324 HD21 ASN 41 HD21 ASN 41 -4.045 -14.678 0.446
325 HD22 ASN 41 HD22 ASN 41 -3.215 -16.015 -0.277
326 H ASP 42 HN ASP 42 -6.894 -12.759 -3.876
327 HA ASP 42 HA ASP 42 -5.319 -14.029 -5.835
328 HB2 ASP 42 HB2 ASP 42 -6.970 -13.299 -7.446
329 HB3 ASP 42 HB1 ASP 42 -7.799 -13.784 -5.971
330 H GLU 43 HN GLU 43 -5.804 -10.610 -5.056
331 HA GLU 43 HA GLU 43 -4.092 -9.656 -7.115
332 HB2 GLU 43 HB2 GLU 43 -5.254 -8.419 -4.643
333 HB3 GLU 43 HB1 GLU 43 -4.049 -7.558 -5.586
334 HG2 GLU 43 HG2 GLU 43 -5.610 -8.060 -7.585
335 HG3 GLU 43 HG1 GLU 43 -6.822 -8.363 -6.342
336 H LYS 44 HN LYS 44 -3.619 -10.460 -3.714
337 HA LYS 44 HA LYS 44 -0.975 -9.683 -3.408
338 HB2 LYS 44 HB2 LYS 44 -2.620 -11.854 -2.167
339 HB3 LYS 44 HB1 LYS 44 -0.903 -11.745 -1.806
340 HG2 LYS 44 HG2 LYS 44 -1.288 -9.374 -1.137
341 HG3 LYS 44 HG1 LYS 44 -3.014 -9.670 -1.280
342 HD2 LYS 44 HD2 LYS 44 -2.397 -9.918 1.019
343 HD3 LYS 44 HD1 LYS 44 -2.798 -11.507 0.367
344 HE2 LYS 44 HE2 LYS 44 -0.791 -11.547 1.787
345 HE3 LYS 44 HE1 LYS 44 -0.455 -12.041 0.130
346 HZ1 LYS 44 HZ1 LYS 44 1.197 -10.492 1.118
347 HZ2 LYS 44 HZ2 LYS 44 0.006 -9.289 1.139
348 HZ3 LYS 44 HZ3 LYS 44 0.523 -9.947 -0.334
349 H ALA 45 HN ALA 45 -2.284 -12.631 -4.819
350 HA ALA 45 HA ALA 45 0.234 -13.862 -5.305
351 HB1 ALA 45 HB1 ALA 45 -2.401 -14.311 -6.703
352 HB2 ALA 45 HB2 ALA 45 -1.873 -15.119 -5.228
353 HB3 ALA 45 HB3 ALA 45 -1.002 -15.386 -6.739
354 H ALA 46 HN ALA 46 -1.290 -11.196 -6.688
355 HA ALA 46 HA ALA 46 -0.061 -11.624 -9.330
356 HB1 ALA 46 HB1 ALA 46 -1.513 -9.854 -10.132
357 HB2 ALA 46 HB2 ALA 46 -2.091 -9.558 -8.491
358 HB3 ALA 46 HB3 ALA 46 -2.458 -11.085 -9.293
359 H LEU 47 HN LEU 47 0.600 -10.141 -6.436
360 HA LEU 47 HA LEU 47 1.753 -7.706 -7.442
361 HB2 LEU 47 HB2 LEU 47 2.218 -9.000 -4.756
362 HB3 LEU 47 HB1 LEU 47 2.515 -7.329 -5.185
363 HG LEU 47 HG LEU 47 -0.138 -8.684 -4.767
364 HD11 LEU 47 HD11 LEU 47 1.025 -7.897 -2.789
365 HD12 LEU 47 HD12 LEU 47 -0.435 -6.959 -3.108
366 HD13 LEU 47 HD13 LEU 47 1.149 -6.287 -3.502
367 HD21 LEU 47 HD21 LEU 47 -0.279 -7.271 -6.776
368 HD22 LEU 47 HD22 LEU 47 0.303 -5.902 -5.826
369 HD23 LEU 47 HD23 LEU 47 -1.244 -6.660 -5.432
370 HA PRO 48 HA PRO 48 5.832 -9.093 -8.529
371 HB2 PRO 48 HB2 PRO 48 6.841 -6.783 -6.960
372 HB3 PRO 48 HB1 PRO 48 7.125 -7.202 -8.652
373 HG2 PRO 48 HG2 PRO 48 5.501 -5.195 -8.003
374 HG3 PRO 48 HG1 PRO 48 5.118 -6.278 -9.355
375 HD2 PRO 48 HD2 PRO 48 3.982 -6.223 -6.589
376 HD3 PRO 48 HD1 PRO 48 3.167 -6.511 -8.140
377 H ASN 49 HN ASN 49 7.542 -10.210 -7.669
378 HA ASN 49 HA ASN 49 7.162 -11.339 -5.106
379 HB2 ASN 49 HB2 ASN 49 9.467 -11.510 -7.049
380 HB3 ASN 49 HB1 ASN 49 9.395 -12.431 -5.553
381 HD21 ASN 49 HD21 ASN 49 7.959 -14.111 -5.372
382 HD22 ASN 49 HD22 ASN 49 7.141 -14.784 -6.737
383 H ASP 50 HN ASP 50 9.023 -8.662 -6.256
384 HA ASP 50 HA ASP 50 9.862 -8.166 -3.484
385 HB2 ASP 50 HB2 ASP 50 11.914 -7.117 -4.259
386 HB3 ASP 50 HB1 ASP 50 11.831 -8.758 -4.881
387 H ILE 51 HN ILE 51 8.918 -6.420 -2.692
388 HA ILE 51 HA ILE 51 7.775 -4.490 -4.588
389 HB ILE 51 HB ILE 51 6.976 -5.056 -1.730
390 HG12 ILE 51 HG12 ILE 51 5.587 -5.645 -4.355
391 HG13 ILE 51 HG11 ILE 51 6.362 -6.835 -3.315
392 HG21 ILE 51 HG21 ILE 51 6.633 -2.707 -2.297
393 HG22 ILE 51 HG22 ILE 51 5.088 -3.548 -2.162
394 HG23 ILE 51 HG23 ILE 51 5.755 -3.176 -3.752
395 HD11 ILE 51 HD11 ILE 51 4.741 -6.374 -1.567
396 HD12 ILE 51 HD12 ILE 51 3.945 -6.853 -3.067
397 HD13 ILE 51 HD13 ILE 51 3.976 -5.157 -2.588
398 H ASN 52 HN ASN 52 8.551 -2.517 -4.693
399 HA ASN 52 HA ASN 52 10.116 -1.471 -2.424
400 HB2 ASN 52 HB2 ASN 52 11.405 -1.881 -4.568
401 HB3 ASN 52 HB1 ASN 52 10.397 -0.660 -5.331
402 HD21 ASN 52 HD21 ASN 52 12.084 0.698 -5.780
403 HD22 ASN 52 HD22 ASN 52 12.932 1.579 -4.555
404 H MET 53 HN MET 53 10.148 1.141 -2.767
405 HA MET 53 HA MET 53 7.617 2.060 -2.116
406 HB2 MET 53 HB2 MET 53 9.689 3.254 -1.579
407 HB3 MET 53 HB1 MET 53 9.933 3.612 -3.283
408 HG2 MET 53 HG2 MET 53 7.912 4.953 -3.309
409 HG3 MET 53 HG1 MET 53 7.621 4.562 -1.617
410 HE1 MET 53 HE1 MET 53 10.635 6.330 0.156
411 HE2 MET 53 HE2 MET 53 10.610 4.670 -0.436
412 HE3 MET 53 HE3 MET 53 9.191 5.340 0.370
413 H ASP 54 HN ASP 54 9.164 1.771 -5.246
414 HA ASP 54 HA ASP 54 7.580 3.493 -6.752
415 HB2 ASP 54 HB2 ASP 54 8.826 0.871 -7.607
416 HB3 ASP 54 HB1 ASP 54 8.210 2.104 -8.702
417 H TYR 55 HN TYR 55 7.086 -0.004 -6.137
418 HA TYR 55 HA TYR 55 4.601 0.032 -7.557
419 HB2 TYR 55 HB2 TYR 55 5.971 -2.049 -7.354
420 HB3 TYR 55 HB1 TYR 55 5.545 -2.108 -5.643
421 HD1 TYR 55 HD1 TYR 55 3.600 -3.222 -4.972
422 HD2 TYR 55 HD2 TYR 55 3.991 -1.969 -9.020
423 HE1 TYR 55 HE1 TYR 55 1.492 -4.338 -5.517
424 HE2 TYR 55 HE2 TYR 55 1.880 -3.092 -9.577
425 HH TYR 55 HH TYR 55 0.490 -4.946 -8.680
426 H TRP 56 HN TRP 56 5.565 0.439 -4.220
427 HA TRP 56 HA TRP 56 3.099 0.089 -2.985
428 HB2 TRP 56 HB2 TRP 56 5.091 0.373 -1.656
429 HB3 TRP 56 HB1 TRP 56 5.364 1.978 -2.318
430 HD1 TRP 56 HD1 TRP 56 5.083 3.519 -0.283
431 HE1 TRP 56 HE1 TRP 56 3.237 3.932 1.459
432 HE3 TRP 56 HE3 TRP 56 1.929 -0.296 -1.540
433 HZ2 TRP 56 HZ2 TRP 56 0.755 2.789 2.196
434 HZ3 TRP 56 HZ3 TRP 56 -0.161 -0.561 -0.280
435 HH2 TRP 56 HH2 TRP 56 -0.734 0.948 1.551
436 H LEU 57 HN LEU 57 4.531 3.036 -4.342
437 HA LEU 57 HA LEU 57 2.280 4.688 -3.899
438 HB2 LEU 57 HB2 LEU 57 4.341 4.922 -6.096
439 HB3 LEU 57 HB1 LEU 57 3.307 6.205 -5.493
440 HG LEU 57 HG LEU 57 5.384 4.806 -3.828
441 HD11 LEU 57 HD11 LEU 57 6.721 6.852 -4.120
442 HD12 LEU 57 HD12 LEU 57 5.548 7.423 -5.307
443 HD13 LEU 57 HD13 LEU 57 6.490 5.965 -5.629
444 HD21 LEU 57 HD21 LEU 57 3.718 7.286 -3.393
445 HD22 LEU 57 HD22 LEU 57 5.084 6.811 -2.378
446 HD23 LEU 57 HD23 LEU 57 3.656 5.779 -2.476
447 H ASN 58 HN ASN 58 3.403 2.922 -6.711
448 HA ASN 58 HA ASN 58 1.451 3.581 -8.548
449 HB2 ASN 58 HB2 ASN 58 3.490 2.358 -9.139
450 HB3 ASN 58 HB1 ASN 58 2.919 0.952 -8.252
451 HD21 ASN 58 HD21 ASN 58 2.630 2.833 -11.132
452 HD22 ASN 58 HD22 ASN 58 1.651 1.714 -12.012
453 H PHE 59 HN PHE 59 1.503 0.800 -6.329
454 HA PHE 59 HA PHE 59 -1.030 -0.214 -7.012
455 HB2 PHE 59 HB2 PHE 59 0.562 -1.547 -5.730
456 HB3 PHE 59 HB1 PHE 59 0.498 -0.394 -4.400
457 HD1 PHE 59 HD1 PHE 59 -1.663 -0.130 -3.132
458 HD2 PHE 59 HD2 PHE 59 -0.986 -3.293 -5.898
459 HE1 PHE 59 HE1 PHE 59 -3.537 -1.378 -2.150
460 HE2 PHE 59 HE2 PHE 59 -2.846 -4.559 -4.907
461 HZ PHE 59 HZ PHE 59 -4.139 -3.586 -3.044
462 H ALA 60 HN ALA 60 0.035 2.120 -4.595
463 HA ALA 60 HA ALA 60 -2.426 2.410 -3.270
464 HB1 ALA 60 HB1 ALA 60 -1.498 4.471 -2.369
465 HB2 ALA 60 HB2 ALA 60 -0.208 4.424 -3.572
466 HB3 ALA 60 HB3 ALA 60 -0.306 3.171 -2.333
467 H LYS 61 HN LYS 61 -1.005 4.135 -5.986
468 HA LYS 61 HA LYS 61 -3.074 6.042 -6.305
469 HB2 LYS 61 HB2 LYS 61 -1.218 5.017 -8.444
470 HB3 LYS 61 HB1 LYS 61 -2.021 6.579 -8.386
471 HG2 LYS 61 HG2 LYS 61 0.034 5.673 -6.391
472 HG3 LYS 61 HG1 LYS 61 0.407 6.605 -7.826
473 HD2 LYS 61 HD2 LYS 61 -1.482 7.481 -5.646
474 HD3 LYS 61 HD1 LYS 61 0.203 7.988 -5.782
475 HE2 LYS 61 HE2 LYS 61 -1.992 8.513 -7.782
476 HE3 LYS 61 HE1 LYS 61 -1.283 9.682 -6.672
477 HZ1 LYS 61 HZ1 LYS 61 -0.371 9.863 -8.915
478 HZ2 LYS 61 HZ2 LYS 61 0.192 8.273 -8.827
479 HZ3 LYS 61 HZ3 LYS 61 0.826 9.449 -7.794
480 H LYS 62 HN LYS 62 -2.589 2.790 -7.295
481 HA LYS 62 HA LYS 62 -4.429 2.821 -9.496
482 HB2 LYS 62 HB2 LYS 62 -2.413 1.460 -9.570
483 HB3 LYS 62 HB1 LYS 62 -2.924 0.602 -8.121
484 HG2 LYS 62 HG2 LYS 62 -4.640 -0.525 -9.275
485 HG3 LYS 62 HG1 LYS 62 -4.515 0.550 -10.670
486 HD2 LYS 62 HD2 LYS 62 -3.488 -1.615 -11.140
487 HD3 LYS 62 HD1 LYS 62 -2.286 -0.327 -11.157
488 HE2 LYS 62 HE2 LYS 62 -1.331 -2.182 -10.009
489 HE3 LYS 62 HE1 LYS 62 -1.706 -0.954 -8.804
490 HZ1 LYS 62 HZ1 LYS 62 -3.715 -2.182 -8.235
491 HZ2 LYS 62 HZ2 LYS 62 -2.345 -3.159 -8.057
492 HZ3 LYS 62 HZ3 LYS 62 -3.351 -3.352 -9.400
493 H HIS 63 HN HIS 63 -4.357 1.361 -6.275
494 HA HIS 63 HA HIS 63 -6.766 -0.075 -6.619
495 HB2 HIS 63 HB2 HIS 63 -6.441 -0.847 -4.486
496 HB3 HIS 63 HB1 HIS 63 -4.820 -0.285 -4.854
497 HD1 HIS 63 HD1 HIS 63 -7.495 0.069 -2.430
498 HD2 HIS 63 HD2 HIS 63 -4.252 2.324 -3.706
499 HE1 HIS 63 HE1 HIS 63 -7.123 1.778 -0.630
500 HE2 HIS 63 HE2 HIS 63 -5.266 3.244 -1.498
501 H TYR 64 HN TYR 64 -6.071 3.173 -5.618
502 HA TYR 64 HA TYR 64 -8.910 3.476 -4.910
503 HB2 TYR 64 HB2 TYR 64 -8.389 5.427 -3.603
504 HB3 TYR 64 HB1 TYR 64 -7.389 4.089 -3.086
505 HD1 TYR 64 HD1 TYR 64 -6.535 6.130 -6.069
506 HD2 TYR 64 HD2 TYR 64 -5.844 5.464 -1.928
507 HE1 TYR 64 HE1 TYR 64 -4.586 7.620 -6.159
508 HE2 TYR 64 HE2 TYR 64 -3.889 6.944 -2.011
509 HH TYR 64 HH TYR 64 -3.299 9.056 -4.516
510 H ASN 65 HN ASN 65 -8.970 6.327 -5.132
511 HA ASN 65 HA ASN 65 -9.558 7.918 -6.621
512 HB2 ASN 65 HB2 ASN 65 -7.202 7.658 -7.440
513 HB3 ASN 65 HB1 ASN 65 -7.783 6.478 -8.606
514 HD21 ASN 65 HD21 ASN 65 -7.125 7.693 -10.354
515 HD22 ASN 65 HD22 ASN 65 -7.927 9.147 -10.834
516 H TYR 66 HN TYR 66 -11.000 5.529 -6.231
517 HA TYR 66 HA TYR 66 -12.279 5.019 -8.798
518 HB2 TYR 66 HB2 TYR 66 -13.649 3.375 -7.507
519 HB3 TYR 66 HB1 TYR 66 -11.923 3.056 -7.433
520 HD1 TYR 66 HD1 TYR 66 -14.815 4.357 -5.526
521 HD2 TYR 66 HD2 TYR 66 -10.771 3.047 -5.354
522 HE1 TYR 66 HE1 TYR 66 -14.941 4.295 -3.075
523 HE2 TYR 66 HE2 TYR 66 -10.894 2.981 -2.897
524 HH TYR 66 HH TYR 66 -12.334 4.182 -1.097
525 H GLU 67 HN GLU 67 -14.414 5.577 -9.220
526 HA GLU 67 HA GLU 67 -15.371 7.800 -7.565
527 HB2 GLU 67 HB2 GLU 67 -16.037 7.028 -10.407
528 HB3 GLU 67 HB1 GLU 67 -16.717 8.411 -9.557
529 HG2 GLU 67 HG2 GLU 67 -14.436 9.321 -9.292
530 HG3 GLU 67 HG1 GLU 67 -13.820 7.975 -10.247
531 H GLN 68 HN GLN 68 -15.863 4.598 -7.979
532 HA GLN 68 HA GLN 68 -18.702 4.744 -7.226
533 HB2 GLN 68 HB2 GLN 68 -17.112 2.407 -8.301
534 HB3 GLN 68 HB1 GLN 68 -18.819 2.372 -7.880
535 HG2 GLN 68 HG2 GLN 68 -19.339 3.924 -9.636
536 HG3 GLN 68 HG1 GLN 68 -17.626 4.140 -10.000
537 HE21 GLN 68 HE21 GLN 68 -16.510 2.514 -11.054
538 HE22 GLN 68 HE22 GLN 68 -17.317 1.235 -11.891
539 HA PRO 69 HA PRO 69 -16.694 3.666 -3.244
540 HB2 PRO 69 HB2 PRO 69 -19.167 4.794 -2.139
541 HB3 PRO 69 HB1 PRO 69 -17.492 5.265 -1.836
542 HG2 PRO 69 HG2 PRO 69 -19.177 6.824 -3.244
543 HG3 PRO 69 HG1 PRO 69 -17.444 6.737 -3.610
544 HD2 PRO 69 HD2 PRO 69 -19.741 5.387 -4.985
545 HD3 PRO 69 HD1 PRO 69 -18.318 6.185 -5.690
546 H PHE 70 HN PHE 70 -16.906 1.484 -3.322
547 HA PHE 70 HA PHE 70 -19.479 0.209 -3.415
548 HB2 PHE 70 HB2 PHE 70 -17.990 -1.896 -3.114
549 HB3 PHE 70 HB1 PHE 70 -17.888 -0.987 -4.616
550 HD1 PHE 70 HD1 PHE 70 -16.155 -1.883 -1.514
551 HD2 PHE 70 HD2 PHE 70 -15.903 0.264 -5.180
552 HE1 PHE 70 HE1 PHE 70 -13.722 -1.671 -1.221
553 HE2 PHE 70 HE2 PHE 70 -13.469 0.481 -4.890
554 HZ PHE 70 HZ PHE 70 -12.375 -0.488 -2.908
555 H LYS 71 HN LYS 71 -19.973 1.499 -1.356
556 HA LYS 71 HA LYS 71 -19.012 0.258 1.086
557 HB2 LYS 71 HB2 LYS 71 -21.074 2.427 0.709
558 HB3 LYS 71 HB1 LYS 71 -20.357 1.917 2.229
559 HG2 LYS 71 HG2 LYS 71 -18.834 3.135 -0.060
560 HG3 LYS 71 HG1 LYS 71 -19.383 4.004 1.374
561 HD2 LYS 71 HD2 LYS 71 -17.995 2.640 2.791
562 HD3 LYS 71 HD1 LYS 71 -17.544 1.617 1.432
563 HE2 LYS 71 HE2 LYS 71 -15.737 3.127 1.888
564 HE3 LYS 71 HE1 LYS 71 -16.486 3.585 0.361
565 HZ1 LYS 71 HZ1 LYS 71 -16.019 5.515 1.715
566 HZ2 LYS 71 HZ2 LYS 71 -16.948 4.897 2.983
567 HZ3 LYS 71 HZ3 LYS 71 -17.689 5.332 1.529
568 H HIS 72 HN HIS 72 -21.033 -0.787 -1.128
569 HA HIS 72 HA HIS 72 -23.225 -1.631 0.553
570 HB2 HIS 72 HB2 HIS 72 -23.923 -2.946 -1.482
571 HB3 HIS 72 HB1 HIS 72 -23.811 -1.208 -1.717
572 HD1 HIS 72 HD1 HIS 72 -22.504 -0.461 -3.680
573 HD2 HIS 72 HD2 HIS 72 -21.558 -4.356 -2.583
574 HE1 HIS 72 HE1 HIS 72 -20.942 -1.301 -5.459
575 HE2 HIS 72 HE2 HIS 72 -20.300 -3.623 -4.721
576 H ILE 73 HN ILE 73 -20.108 -2.786 -0.207
577 HA ILE 73 HA ILE 73 -20.805 -5.475 0.742
578 HB ILE 73 HB ILE 73 -19.516 -5.473 -1.319
579 HG12 ILE 73 HG12 ILE 73 -17.569 -6.861 -0.586
580 HG13 ILE 73 HG11 ILE 73 -17.920 -6.397 1.076
581 HG21 ILE 73 HG21 ILE 73 -17.206 -4.642 -1.400
582 HG22 ILE 73 HG22 ILE 73 -17.416 -3.952 0.210
583 HG23 ILE 73 HG23 ILE 73 -18.382 -3.354 -1.141
584 HD11 ILE 73 HD11 ILE 73 -18.794 -8.605 0.546
585 HD12 ILE 73 HD12 ILE 73 -19.771 -7.914 -0.749
586 HD13 ILE 73 HD13 ILE 73 -20.092 -7.477 0.929
587 H ASN 74 HN ASN 74 -18.717 -2.717 1.370
588 HA ASN 74 HA ASN 74 -18.495 -3.599 4.152
589 HB2 ASN 74 HB2 ASN 74 -16.329 -4.056 3.220
590 HB3 ASN 74 HB1 ASN 74 -16.281 -2.491 2.418
591 HD21 ASN 74 HD21 ASN 74 -15.808 -0.658 3.601
592 HD22 ASN 74 HD22 ASN 74 -15.147 -0.729 5.199
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 -5.832 13.740 -2.627
2 H2 MET 1 HT2 MET 1 -6.545 12.674 -3.724
3 H3 MET 1 HT3 MET 1 -6.904 14.324 -3.795
4 HA MET 1 HA MET 1 -5.393 13.723 -5.550
5 HB2 MET 1 HB2 MET 1 -5.239 15.960 -4.429
6 HB3 MET 1 HB1 MET 1 -3.982 15.305 -3.389
7 HG2 MET 1 HG2 MET 1 -3.002 16.578 -5.187
8 HG3 MET 1 HG1 MET 1 -2.591 14.872 -5.356
9 HE1 MET 1 HE1 MET 1 -2.866 16.106 -9.078
10 HE2 MET 1 HE2 MET 1 -1.841 15.302 -7.889
11 HE3 MET 1 HE3 MET 1 -2.241 17.009 -7.697
12 H ALA 2 HN ALA 2 -4.336 11.937 -6.062
13 HA ALA 2 HA ALA 2 -3.125 10.211 -4.214
14 HB1 ALA 2 HB1 ALA 2 -2.354 8.960 -6.142
15 HB2 ALA 2 HB2 ALA 2 -2.692 10.333 -7.194
16 HB3 ALA 2 HB3 ALA 2 -4.016 9.494 -6.387
17 H SER 3 HN SER 3 -1.799 12.790 -6.195
18 HA SER 3 HA SER 3 0.919 12.177 -5.879
19 HB2 SER 3 HB2 SER 3 -0.360 14.894 -6.254
20 HB3 SER 3 HB1 SER 3 1.331 14.495 -6.554
21 HG SER 3 HG SER 3 0.562 12.961 -8.122
22 H ASP 4 HN ASP 4 -1.324 13.933 -3.809
23 HA ASP 4 HA ASP 4 0.668 14.886 -1.998
24 HB2 ASP 4 HB2 ASP 4 -1.576 15.918 -2.131
25 HB3 ASP 4 HB1 ASP 4 -2.290 14.427 -1.521
26 H MET 5 HN MET 5 -1.541 12.140 -2.054
27 HA MET 5 HA MET 5 -0.803 11.001 0.403
28 HB2 MET 5 HB2 MET 5 -1.894 9.713 -2.104
29 HB3 MET 5 HB1 MET 5 -1.730 8.881 -0.564
30 HG2 MET 5 HG2 MET 5 -3.433 11.309 -1.082
31 HG3 MET 5 HG1 MET 5 -4.008 9.649 -0.943
32 HE1 MET 5 HE1 MET 5 -2.205 8.520 1.455
33 HE2 MET 5 HE2 MET 5 -3.938 8.235 1.282
34 HE3 MET 5 HE3 MET 5 -3.287 8.828 2.813
35 H GLU 6 HN GLU 6 0.529 10.685 -2.832
36 HA GLU 6 HA GLU 6 2.270 8.554 -2.461
37 HB2 GLU 6 HB2 GLU 6 1.880 9.403 -4.640
38 HB3 GLU 6 HB1 GLU 6 2.421 11.013 -4.194
39 HG2 GLU 6 HG2 GLU 6 4.704 10.155 -3.956
40 HG3 GLU 6 HG1 GLU 6 4.139 8.560 -4.446
41 H GLU 7 HN GLU 7 2.736 11.985 -1.731
42 HA GLU 7 HA GLU 7 5.449 11.778 -0.949
43 HB2 GLU 7 HB2 GLU 7 3.417 13.790 0.029
44 HB3 GLU 7 HB1 GLU 7 5.165 13.982 0.003
45 HG2 GLU 7 HG2 GLU 7 5.071 13.825 -2.474
46 HG3 GLU 7 HG1 GLU 7 3.314 13.819 -2.348
47 H LYS 8 HN LYS 8 2.401 11.504 0.762
48 HA LYS 8 HA LYS 8 3.450 11.232 3.375
49 HB2 LYS 8 HB2 LYS 8 0.882 10.023 2.331
50 HB3 LYS 8 HB1 LYS 8 1.260 10.456 3.986
51 HG2 LYS 8 HG2 LYS 8 0.982 12.404 1.745
52 HG3 LYS 8 HG1 LYS 8 -0.267 12.028 2.927
53 HD2 LYS 8 HD2 LYS 8 1.095 12.856 4.713
54 HD3 LYS 8 HD1 LYS 8 2.467 13.073 3.626
55 HE2 LYS 8 HE2 LYS 8 1.333 15.196 4.115
56 HE3 LYS 8 HE1 LYS 8 1.271 14.786 2.404
57 HZ1 LYS 8 HZ1 LYS 8 -0.844 15.625 3.512
58 HZ2 LYS 8 HZ2 LYS 8 -0.953 14.093 4.215
59 HZ3 LYS 8 HZ3 LYS 8 -0.967 14.257 2.527
60 H PHE 9 HN PHE 9 2.567 8.906 0.865
61 HA PHE 9 HA PHE 9 3.004 6.566 2.348
62 HB2 PHE 9 HB2 PHE 9 3.132 7.068 -0.624
63 HB3 PHE 9 HB1 PHE 9 3.264 5.466 0.095
64 HD1 PHE 9 HD1 PHE 9 1.231 5.752 2.263
65 HD2 PHE 9 HD2 PHE 9 1.152 6.891 -1.834
66 HE1 PHE 9 HE1 PHE 9 -1.213 5.539 2.258
67 HE2 PHE 9 HE2 PHE 9 -1.301 6.683 -1.846
68 HZ PHE 9 HZ PHE 9 -2.479 6.004 0.206
69 H ARG 10 HN ARG 10 5.206 8.595 0.509
70 HA ARG 10 HA ARG 10 7.388 6.867 0.382
71 HB2 ARG 10 HB2 ARG 10 7.305 9.013 -0.806
72 HB3 ARG 10 HB1 ARG 10 7.388 9.871 0.726
73 HG2 ARG 10 HG2 ARG 10 9.617 8.981 1.125
74 HG3 ARG 10 HG1 ARG 10 9.533 8.075 -0.384
75 HD2 ARG 10 HD2 ARG 10 9.316 10.177 -1.624
76 HD3 ARG 10 HD1 ARG 10 9.433 11.065 -0.109
77 HE ARG 10 HE ARG 10 11.685 9.529 -0.162
78 HH11 ARG 10 HH11 ARG 10 10.265 11.911 -2.292
79 HH12 ARG 10 HH12 ARG 10 11.790 12.431 -2.937
80 HH21 ARG 10 HH21 ARG 10 13.698 10.199 -1.020
81 HH22 ARG 10 HH22 ARG 10 13.740 11.461 -2.213
82 H GLU 11 HN GLU 11 6.474 9.172 2.880
83 HA GLU 11 HA GLU 11 8.642 8.578 4.617
84 HB2 GLU 11 HB2 GLU 11 7.499 10.698 4.755
85 HB3 GLU 11 HB1 GLU 11 5.971 9.900 5.097
86 HG2 GLU 11 HG2 GLU 11 6.845 9.125 7.234
87 HG3 GLU 11 HG1 GLU 11 8.390 9.907 6.889
88 H ALA 12 HN ALA 12 5.279 7.526 4.465
89 HA ALA 12 HA ALA 12 5.280 6.051 6.872
90 HB1 ALA 12 HB1 ALA 12 3.186 5.106 6.090
91 HB2 ALA 12 HB2 ALA 12 3.512 5.691 4.458
92 HB3 ALA 12 HB3 ALA 12 3.237 6.840 5.768
93 H PHE 13 HN PHE 13 5.906 5.149 3.530
94 HA PHE 13 HA PHE 13 6.063 2.376 3.808
95 HB2 PHE 13 HB2 PHE 13 6.084 3.684 1.666
96 HB3 PHE 13 HB1 PHE 13 7.756 4.116 2.001
97 HD1 PHE 13 HD1 PHE 13 9.528 2.587 1.599
98 HD2 PHE 13 HD2 PHE 13 5.477 1.356 1.201
99 HE1 PHE 13 HE1 PHE 13 10.268 0.527 0.476
100 HE2 PHE 13 HE2 PHE 13 6.204 -0.704 0.085
101 HZ PHE 13 HZ PHE 13 8.605 -1.122 -0.283
102 H ILE 14 HN ILE 14 8.526 4.887 4.194
103 HA ILE 14 HA ILE 14 10.699 3.187 4.747
104 HB ILE 14 HB ILE 14 10.249 6.054 5.587
105 HG12 ILE 14 HG12 ILE 14 11.858 4.908 3.295
106 HG13 ILE 14 HG11 ILE 14 10.252 5.613 3.134
107 HG21 ILE 14 HG21 ILE 14 11.923 4.941 6.988
108 HG22 ILE 14 HG22 ILE 14 12.656 6.164 5.946
109 HG23 ILE 14 HG23 ILE 14 12.806 4.453 5.540
110 HD11 ILE 14 HD11 ILE 14 11.110 7.759 3.891
111 HD12 ILE 14 HD12 ILE 14 11.991 7.180 2.476
112 HD13 ILE 14 HD13 ILE 14 12.717 7.057 4.079
113 H LEU 15 HN LEU 15 8.231 4.626 6.821
114 HA LEU 15 HA LEU 15 9.406 4.037 9.294
115 HB2 LEU 15 HB2 LEU 15 6.467 4.082 8.618
116 HB3 LEU 15 HB1 LEU 15 7.153 4.189 10.226
117 HG LEU 15 HG LEU 15 7.473 6.237 8.032
118 HD11 LEU 15 HD11 LEU 15 5.227 6.172 9.002
119 HD12 LEU 15 HD12 LEU 15 6.085 7.651 9.431
120 HD13 LEU 15 HD13 LEU 15 5.922 6.352 10.612
121 HD21 LEU 15 HD21 LEU 15 9.455 6.139 9.434
122 HD22 LEU 15 HD22 LEU 15 8.456 6.255 10.883
123 HD23 LEU 15 HD23 LEU 15 8.540 7.611 9.758
124 H PHE 16 HN PHE 16 7.184 2.113 7.301
125 HA PHE 16 HA PHE 16 7.200 -0.082 9.148
126 HB2 PHE 16 HB2 PHE 16 6.034 0.340 6.422
127 HB3 PHE 16 HB1 PHE 16 6.061 -1.264 7.144
128 HD1 PHE 16 HD1 PHE 16 5.029 2.233 7.953
129 HD2 PHE 16 HD2 PHE 16 4.289 -1.929 8.438
130 HE1 PHE 16 HE1 PHE 16 2.960 2.747 9.181
131 HE2 PHE 16 HE2 PHE 16 2.218 -1.425 9.662
132 HZ PHE 16 HZ PHE 16 1.552 0.918 10.039
133 H SER 17 HN SER 17 9.035 0.771 6.304
134 HA SER 17 HA SER 17 10.176 -1.922 6.174
135 HB2 SER 17 HB2 SER 17 9.380 -0.749 4.097
136 HB3 SER 17 HB1 SER 17 10.678 0.420 4.325
137 HG SER 17 HG SER 17 11.690 -0.984 3.101
138 H SER 18 HN SER 18 10.732 0.724 7.921
139 HA SER 18 HA SER 18 12.387 1.311 9.333
140 HB2 SER 18 HB2 SER 18 12.920 -1.114 9.469
141 HB3 SER 18 HB1 SER 18 14.028 -0.921 8.112
142 HG SER 18 HG SER 18 14.201 0.360 10.645
143 H CYS 19 HN CYS 19 14.190 0.292 6.423
144 HA CYS 19 HA CYS 19 14.826 3.083 5.849
145 HB2 CYS 19 HB2 CYS 19 16.985 0.999 6.250
146 HB3 CYS 19 HB1 CYS 19 17.235 2.662 5.730
147 HG CYS 19 HG CYS 19 15.594 2.565 8.599
148 H SER 20 HN SER 20 14.897 -0.295 4.966
149 HA SER 20 HA SER 20 15.977 -0.044 2.390
150 HB2 SER 20 HB2 SER 20 14.714 -2.304 2.093
151 HB3 SER 20 HB1 SER 20 16.026 -2.199 3.267
152 HG SER 20 HG SER 20 13.374 -1.665 4.061
153 H ASP 21 HN ASP 21 15.122 0.304 0.419
154 HA ASP 21 HA ASP 21 12.483 1.459 0.257
155 HB2 ASP 21 HB2 ASP 21 13.042 1.849 -2.117
156 HB3 ASP 21 HB1 ASP 21 14.286 2.462 -1.034
157 H HIS 22 HN HIS 22 13.866 -1.618 -0.163
158 HA HIS 22 HA HIS 22 11.453 -2.611 -1.499
159 HB2 HIS 22 HB2 HIS 22 13.951 -4.112 -0.650
160 HB3 HIS 22 HB1 HIS 22 12.613 -4.780 -1.578
161 HD1 HIS 22 HD1 HIS 22 15.886 -3.628 -2.089
162 HD2 HIS 22 HD2 HIS 22 12.293 -3.031 -4.090
163 HE1 HIS 22 HE1 HIS 22 16.520 -2.863 -4.400
164 HE2 HIS 22 HE2 HIS 22 14.329 -2.343 -5.530
165 H ILE 23 HN ILE 23 9.873 -3.641 -0.355
166 HA ILE 23 HA ILE 23 10.274 -3.568 2.553
167 HB ILE 23 HB ILE 23 8.536 -2.079 1.711
168 HG12 ILE 23 HG12 ILE 23 7.271 -4.365 3.224
169 HG13 ILE 23 HG11 ILE 23 8.361 -3.195 3.961
170 HG21 ILE 23 HG21 ILE 23 7.157 -4.583 0.752
171 HG22 ILE 23 HG22 ILE 23 7.853 -3.324 -0.266
172 HG23 ILE 23 HG23 ILE 23 6.459 -2.964 0.751
173 HD11 ILE 23 HD11 ILE 23 6.010 -2.668 4.372
174 HD12 ILE 23 HD12 ILE 23 5.742 -2.537 2.633
175 HD13 ILE 23 HD13 ILE 23 6.818 -1.402 3.449
176 H GLU 24 HN GLU 24 10.148 -5.315 3.753
177 HA GLU 24 HA GLU 24 9.857 -7.915 2.784
178 HB2 GLU 24 HB2 GLU 24 9.506 -6.755 5.542
179 HB3 GLU 24 HB1 GLU 24 9.417 -8.481 5.213
180 HG2 GLU 24 HG2 GLU 24 11.675 -8.401 4.308
181 HG3 GLU 24 HG1 GLU 24 11.773 -6.691 4.714
182 H MET 25 HN MET 25 8.196 -9.264 2.576
183 HA MET 25 HA MET 25 5.725 -8.165 1.890
184 HB2 MET 25 HB2 MET 25 7.004 -10.654 1.646
185 HB3 MET 25 HB1 MET 25 5.478 -10.971 2.460
186 HG2 MET 25 HG2 MET 25 5.174 -11.190 0.095
187 HG3 MET 25 HG1 MET 25 4.304 -9.765 0.660
188 HE1 MET 25 HE1 MET 25 4.912 -10.318 -2.373
189 HE2 MET 25 HE2 MET 25 5.488 -8.754 -2.945
190 HE3 MET 25 HE3 MET 25 4.109 -8.838 -1.849
191 H TYR 26 HN TYR 26 6.837 -9.541 4.928
192 HA TYR 26 HA TYR 26 4.217 -9.904 5.986
193 HB2 TYR 26 HB2 TYR 26 5.245 -10.659 7.896
194 HB3 TYR 26 HB1 TYR 26 6.515 -10.937 6.725
195 HD1 TYR 26 HD1 TYR 26 8.499 -9.460 6.682
196 HD2 TYR 26 HD2 TYR 26 5.495 -9.065 9.660
197 HE1 TYR 26 HE1 TYR 26 10.044 -8.133 8.058
198 HE2 TYR 26 HE2 TYR 26 7.029 -7.737 11.042
199 HH TYR 26 HH TYR 26 9.484 -7.459 11.315
200 H LYS 27 HN LYS 27 6.486 -7.264 5.870
201 HA LYS 27 HA LYS 27 4.950 -5.627 7.706
202 HB2 LYS 27 HB2 LYS 27 7.549 -5.403 6.300
203 HB3 LYS 27 HB1 LYS 27 6.703 -3.892 6.610
204 HG2 LYS 27 HG2 LYS 27 7.353 -5.937 8.720
205 HG3 LYS 27 HG1 LYS 27 8.338 -4.515 8.361
206 HD2 LYS 27 HD2 LYS 27 6.513 -3.051 8.946
207 HD3 LYS 27 HD1 LYS 27 5.435 -4.427 9.172
208 HE2 LYS 27 HE2 LYS 27 6.856 -5.216 11.013
209 HE3 LYS 27 HE1 LYS 27 7.890 -3.803 10.801
210 HZ1 LYS 27 HZ1 LYS 27 6.063 -2.380 11.374
211 HZ2 LYS 27 HZ2 LYS 27 6.256 -3.533 12.593
212 HZ3 LYS 27 HZ3 LYS 27 4.996 -3.693 11.467
213 H PHE 28 HN PHE 28 4.912 -6.405 4.447
214 HA PHE 28 HA PHE 28 4.313 -3.887 3.312
215 HB2 PHE 28 HB2 PHE 28 5.255 -5.544 1.910
216 HB3 PHE 28 HB1 PHE 28 4.020 -6.721 2.343
217 HD1 PHE 28 HD1 PHE 28 4.495 -3.467 0.619
218 HD2 PHE 28 HD2 PHE 28 2.153 -6.990 1.035
219 HE1 PHE 28 HE1 PHE 28 3.176 -2.812 -1.348
220 HE2 PHE 28 HE2 PHE 28 0.824 -6.351 -0.920
221 HZ PHE 28 HZ PHE 28 1.325 -4.259 -2.127
222 H PHE 29 HN PHE 29 2.228 -6.595 4.324
223 HA PHE 29 HA PHE 29 -0.124 -5.390 3.268
224 HB2 PHE 29 HB2 PHE 29 0.182 -7.850 3.695
225 HB3 PHE 29 HB1 PHE 29 -0.013 -7.512 5.407
226 HD1 PHE 29 HD1 PHE 29 -2.163 -6.693 6.269
227 HD2 PHE 29 HD2 PHE 29 -1.694 -7.909 2.197
228 HE1 PHE 29 HE1 PHE 29 -4.603 -6.857 6.042
229 HE2 PHE 29 HE2 PHE 29 -4.143 -8.081 1.987
230 HZ PHE 29 HZ PHE 29 -5.596 -7.553 3.900
231 H GLU 30 HN GLU 30 1.243 -5.567 6.557
232 HA GLU 30 HA GLU 30 -0.806 -4.060 7.778
233 HB2 GLU 30 HB2 GLU 30 0.824 -3.661 9.606
234 HB3 GLU 30 HB1 GLU 30 0.646 -5.352 9.171
235 HG2 GLU 30 HG2 GLU 30 2.726 -5.275 7.932
236 HG3 GLU 30 HG1 GLU 30 2.895 -3.558 8.295
237 H LEU 31 HN LEU 31 2.025 -3.150 5.983
238 HA LEU 31 HA LEU 31 2.168 -0.441 6.637
239 HB2 LEU 31 HB2 LEU 31 3.916 -1.581 5.445
240 HB3 LEU 31 HB1 LEU 31 2.836 -1.973 4.132
241 HG LEU 31 HG LEU 31 4.610 -0.166 3.792
242 HD11 LEU 31 HD11 LEU 31 3.191 1.103 2.298
243 HD12 LEU 31 HD12 LEU 31 1.762 0.403 3.062
244 HD13 LEU 31 HD13 LEU 31 2.885 -0.631 2.178
245 HD21 LEU 31 HD21 LEU 31 2.561 1.483 5.245
246 HD22 LEU 31 HD22 LEU 31 3.953 2.104 4.359
247 HD23 LEU 31 HD23 LEU 31 4.194 1.127 5.809
248 H MET 32 HN MET 32 0.199 -2.139 4.284
249 HA MET 32 HA MET 32 -0.945 0.356 3.355
250 HB2 MET 32 HB2 MET 32 -2.069 -0.879 1.667
251 HB3 MET 32 HB1 MET 32 -0.445 -1.538 1.793
252 HG2 MET 32 HG2 MET 32 -1.203 -3.473 2.891
253 HG3 MET 32 HG1 MET 32 -2.787 -2.767 3.204
254 HE1 MET 32 HE1 MET 32 -0.706 -2.535 -0.073
255 HE2 MET 32 HE2 MET 32 -1.342 -3.881 -1.020
256 HE3 MET 32 HE3 MET 32 -0.373 -4.198 0.422
257 H ASN 33 HN ASN 33 -1.956 -2.282 5.473
258 HA ASN 33 HA ASN 33 -4.711 -1.613 5.317
259 HB2 ASN 33 HB2 ASN 33 -5.149 -3.272 6.821
260 HB3 ASN 33 HB1 ASN 33 -3.572 -3.804 6.267
261 HD21 ASN 33 HD21 ASN 33 -1.923 -2.109 7.741
262 HD22 ASN 33 HD22 ASN 33 -2.100 -2.488 9.412
263 H SER 34 HN SER 34 -2.054 -0.221 6.876
264 HA SER 34 HA SER 34 -3.320 1.026 9.074
265 HB2 SER 34 HB2 SER 34 -0.861 0.786 8.838
266 HB3 SER 34 HB1 SER 34 -0.893 1.941 7.507
267 HG SER 34 HG SER 34 -1.504 3.543 8.917
268 H PHE 35 HN PHE 35 -3.250 1.714 5.676
269 HA PHE 35 HA PHE 35 -4.403 4.373 6.088
270 HB2 PHE 35 HB2 PHE 35 -3.444 2.972 3.589
271 HB3 PHE 35 HB1 PHE 35 -4.187 4.569 3.599
272 HD1 PHE 35 HD1 PHE 35 -1.191 2.647 4.280
273 HD2 PHE 35 HD2 PHE 35 -3.034 6.464 4.642
274 HE1 PHE 35 HE1 PHE 35 1.009 3.663 4.702
275 HE2 PHE 35 HE2 PHE 35 -0.839 7.490 5.063
276 HZ PHE 35 HZ PHE 35 1.186 6.088 5.092
277 H GLY 36 HN GLY 36 -5.586 1.432 6.227
278 HA2 GLY 36 HA2 GLY 36 -7.809 0.770 6.215
279 HA3 GLY 36 HA1 GLY 36 -8.224 2.277 5.413
280 H ILE 37 HN ILE 37 -5.688 0.806 3.816
281 HA ILE 37 HA ILE 37 -7.435 0.042 1.635
282 HB ILE 37 HB ILE 37 -4.415 0.045 1.811
283 HG12 ILE 37 HG12 ILE 37 -6.273 2.016 0.458
284 HG13 ILE 37 HG11 ILE 37 -5.513 2.282 2.023
285 HG21 ILE 37 HG21 ILE 37 -4.488 -0.094 -0.648
286 HG22 ILE 37 HG22 ILE 37 -6.240 -0.275 -0.573
287 HG23 ILE 37 HG23 ILE 37 -5.195 -1.515 0.120
288 HD11 ILE 37 HD11 ILE 37 -4.031 1.852 -0.558
289 HD12 ILE 37 HD12 ILE 37 -3.331 2.249 1.012
290 HD13 ILE 37 HD13 ILE 37 -4.356 3.419 0.182
291 H ILE 38 HN ILE 38 -7.882 -2.009 1.019
292 HA ILE 38 HA ILE 38 -6.616 -4.159 2.566
293 HB ILE 38 HB ILE 38 -8.560 -5.559 1.795
294 HG12 ILE 38 HG12 ILE 38 -9.734 -2.859 1.125
295 HG13 ILE 38 HG11 ILE 38 -9.252 -4.065 -0.060
296 HG21 ILE 38 HG21 ILE 38 -9.120 -3.187 3.561
297 HG22 ILE 38 HG22 ILE 38 -8.376 -4.710 4.051
298 HG23 ILE 38 HG23 ILE 38 -10.059 -4.681 3.519
299 HD11 ILE 38 HD11 ILE 38 -11.656 -4.070 0.306
300 HD12 ILE 38 HD12 ILE 38 -11.401 -4.412 2.017
301 HD13 ILE 38 HD13 ILE 38 -10.930 -5.599 0.800
302 H LEU 39 HN LEU 39 -5.995 -6.053 1.560
303 HA LEU 39 HA LEU 39 -5.502 -5.854 -1.343
304 HB2 LEU 39 HB2 LEU 39 -3.616 -5.777 0.644
305 HB3 LEU 39 HB1 LEU 39 -3.656 -7.479 0.254
306 HG LEU 39 HG LEU 39 -2.899 -5.185 -1.521
307 HD11 LEU 39 HD11 LEU 39 -0.942 -6.864 -1.806
308 HD12 LEU 39 HD12 LEU 39 -1.552 -7.534 -0.294
309 HD13 LEU 39 HD13 LEU 39 -1.039 -5.853 -0.369
310 HD21 LEU 39 HD21 LEU 39 -3.407 -8.034 -2.335
311 HD22 LEU 39 HD22 LEU 39 -2.650 -6.796 -3.336
312 HD23 LEU 39 HD23 LEU 39 -4.334 -6.623 -2.840
313 H THR 40 HN THR 40 -6.394 -7.569 -2.440
314 HA THR 40 HA THR 40 -7.470 -9.722 -0.805
315 HB THR 40 HB THR 40 -8.495 -10.502 -2.999
316 HG1 THR 40 HG1 THR 40 -7.590 -7.904 -3.787
317 HG21 THR 40 HG21 THR 40 -9.744 -9.361 -1.258
318 HG22 THR 40 HG22 THR 40 -10.285 -8.845 -2.855
319 HG23 THR 40 HG23 THR 40 -9.238 -7.797 -1.897
320 H ASN 41 HN ASN 41 -7.357 -11.971 -1.624
321 HA ASN 41 HA ASN 41 -4.678 -12.803 -1.630
322 HB2 ASN 41 HB2 ASN 41 -6.604 -14.177 -0.846
323 HB3 ASN 41 HB1 ASN 41 -7.087 -14.405 -2.523
324 HD21 ASN 41 HD21 ASN 41 -5.966 -15.830 -3.803
325 HD22 ASN 41 HD22 ASN 41 -4.765 -16.908 -3.182
326 H ASP 42 HN ASP 42 -7.019 -12.529 -4.262
327 HA ASP 42 HA ASP 42 -5.489 -13.636 -6.328
328 HB2 ASP 42 HB2 ASP 42 -7.846 -13.169 -6.638
329 HB3 ASP 42 HB1 ASP 42 -7.572 -11.444 -6.419
330 H GLU 43 HN GLU 43 -5.636 -10.342 -5.091
331 HA GLU 43 HA GLU 43 -3.876 -9.245 -7.033
332 HB2 GLU 43 HB2 GLU 43 -4.633 -8.253 -4.287
333 HB3 GLU 43 HB1 GLU 43 -3.764 -7.315 -5.491
334 HG2 GLU 43 HG2 GLU 43 -5.679 -7.415 -6.978
335 HG3 GLU 43 HG1 GLU 43 -6.547 -8.408 -5.806
336 H LYS 44 HN LYS 44 -3.425 -10.260 -3.646
337 HA LYS 44 HA LYS 44 -0.717 -9.672 -3.416
338 HB2 LYS 44 HB2 LYS 44 -2.339 -11.837 -2.080
339 HB3 LYS 44 HB1 LYS 44 -0.677 -11.456 -1.641
340 HG2 LYS 44 HG2 LYS 44 -1.506 -9.075 -1.318
341 HG3 LYS 44 HG1 LYS 44 -3.125 -9.755 -1.344
342 HD2 LYS 44 HD2 LYS 44 -2.516 -9.610 0.930
343 HD3 LYS 44 HD1 LYS 44 -2.380 -11.313 0.490
344 HE2 LYS 44 HE2 LYS 44 -0.490 -10.577 1.857
345 HE3 LYS 44 HE1 LYS 44 0.026 -11.080 0.251
346 HZ1 LYS 44 HZ1 LYS 44 1.092 -9.016 1.044
347 HZ2 LYS 44 HZ2 LYS 44 -0.414 -8.247 1.039
348 HZ3 LYS 44 HZ3 LYS 44 0.255 -8.812 -0.410
349 H ALA 45 HN ALA 45 -2.273 -12.577 -4.662
350 HA ALA 45 HA ALA 45 0.108 -14.051 -5.085
351 HB1 ALA 45 HB1 ALA 45 -1.264 -15.500 -6.482
352 HB2 ALA 45 HB2 ALA 45 -2.550 -14.293 -6.490
353 HB3 ALA 45 HB3 ALA 45 -2.105 -15.098 -4.984
354 H ALA 46 HN ALA 46 -1.135 -11.317 -6.631
355 HA ALA 46 HA ALA 46 0.258 -11.969 -9.148
356 HB1 ALA 46 HB1 ALA 46 -2.139 -11.565 -9.406
357 HB2 ALA 46 HB2 ALA 46 -1.180 -10.344 -10.242
358 HB3 ALA 46 HB3 ALA 46 -1.945 -9.963 -8.698
359 H LEU 47 HN LEU 47 0.782 -10.314 -6.371
360 HA LEU 47 HA LEU 47 1.927 -7.928 -7.557
361 HB2 LEU 47 HB2 LEU 47 2.267 -8.907 -4.721
362 HB3 LEU 47 HB1 LEU 47 2.584 -7.297 -5.325
363 HG LEU 47 HG LEU 47 -0.084 -8.605 -4.860
364 HD11 LEU 47 HD11 LEU 47 1.312 -6.182 -3.771
365 HD12 LEU 47 HD12 LEU 47 0.806 -7.631 -2.901
366 HD13 LEU 47 HD13 LEU 47 -0.402 -6.509 -3.529
367 HD21 LEU 47 HD21 LEU 47 -0.167 -7.449 -7.021
368 HD22 LEU 47 HD22 LEU 47 0.418 -5.977 -6.246
369 HD23 LEU 47 HD23 LEU 47 -1.152 -6.648 -5.796
370 HA PRO 48 HA PRO 48 5.992 -9.520 -8.367
371 HB2 PRO 48 HB2 PRO 48 6.988 -6.981 -7.188
372 HB3 PRO 48 HB1 PRO 48 7.299 -7.678 -8.781
373 HG2 PRO 48 HG2 PRO 48 5.675 -5.585 -8.503
374 HG3 PRO 48 HG1 PRO 48 5.316 -6.873 -9.668
375 HD2 PRO 48 HD2 PRO 48 4.108 -6.354 -6.983
376 HD3 PRO 48 HD1 PRO 48 3.336 -6.913 -8.480
377 H ASN 49 HN ASN 49 7.584 -10.567 -7.287
378 HA ASN 49 HA ASN 49 7.145 -11.234 -4.588
379 HB2 ASN 49 HB2 ASN 49 9.592 -11.724 -6.303
380 HB3 ASN 49 HB1 ASN 49 9.243 -12.523 -4.776
381 HD21 ASN 49 HD21 ASN 49 9.249 -14.547 -5.712
382 HD22 ASN 49 HD22 ASN 49 7.975 -15.095 -6.745
383 H ASP 50 HN ASP 50 9.302 -8.979 -6.158
384 HA ASP 50 HA ASP 50 10.150 -8.031 -3.498
385 HB2 ASP 50 HB2 ASP 50 12.048 -8.769 -4.870
386 HB3 ASP 50 HB1 ASP 50 11.532 -7.708 -6.175
387 H ILE 51 HN ILE 51 9.114 -6.256 -2.905
388 HA ILE 51 HA ILE 51 7.968 -4.546 -4.994
389 HB ILE 51 HB ILE 51 7.146 -4.905 -2.112
390 HG12 ILE 51 HG12 ILE 51 5.799 -5.595 -4.731
391 HG13 ILE 51 HG11 ILE 51 6.510 -6.740 -3.601
392 HG21 ILE 51 HG21 ILE 51 6.849 -2.574 -2.788
393 HG22 ILE 51 HG22 ILE 51 5.294 -3.386 -2.599
394 HG23 ILE 51 HG23 ILE 51 5.948 -3.099 -4.210
395 HD11 ILE 51 HD11 ILE 51 4.136 -4.974 -3.062
396 HD12 ILE 51 HD12 ILE 51 4.841 -6.135 -1.936
397 HD13 ILE 51 HD13 ILE 51 4.091 -6.699 -3.429
398 H ASN 52 HN ASN 52 8.740 -2.595 -5.319
399 HA ASN 52 HA ASN 52 10.420 -1.333 -3.278
400 HB2 ASN 52 HB2 ASN 52 11.455 -1.392 -5.454
401 HB3 ASN 52 HB1 ASN 52 10.006 -0.769 -6.224
402 HD21 ASN 52 HD21 ASN 52 12.775 0.048 -4.230
403 HD22 ASN 52 HD22 ASN 52 12.675 1.757 -4.489
404 H MET 53 HN MET 53 10.073 1.116 -3.069
405 HA MET 53 HA MET 53 7.552 1.675 -2.074
406 HB2 MET 53 HB2 MET 53 9.568 2.942 -1.506
407 HB3 MET 53 HB1 MET 53 9.634 3.591 -3.139
408 HG2 MET 53 HG2 MET 53 7.468 4.696 -2.756
409 HG3 MET 53 HG1 MET 53 7.488 4.097 -1.100
410 HE1 MET 53 HE1 MET 53 10.641 4.389 -0.409
411 HE2 MET 53 HE2 MET 53 9.329 4.800 0.696
412 HE3 MET 53 HE3 MET 53 10.614 5.967 0.382
413 H ASP 54 HN ASP 54 8.824 2.096 -5.324
414 HA ASP 54 HA ASP 54 6.945 3.889 -6.345
415 HB2 ASP 54 HB2 ASP 54 8.969 3.303 -7.565
416 HB3 ASP 54 HB1 ASP 54 8.388 1.655 -7.780
417 H TYR 55 HN TYR 55 6.790 0.342 -6.132
418 HA TYR 55 HA TYR 55 4.358 0.177 -7.602
419 HB2 TYR 55 HB2 TYR 55 5.943 -1.752 -7.304
420 HB3 TYR 55 HB1 TYR 55 5.384 -1.876 -5.638
421 HD1 TYR 55 HD1 TYR 55 3.400 -3.039 -5.113
422 HD2 TYR 55 HD2 TYR 55 4.244 -2.028 -9.158
423 HE1 TYR 55 HE1 TYR 55 1.496 -4.389 -5.843
424 HE2 TYR 55 HE2 TYR 55 2.338 -3.388 -9.899
425 HH TYR 55 HH TYR 55 0.990 -5.288 -9.066
426 H TRP 56 HN TRP 56 5.141 0.467 -4.181
427 HA TRP 56 HA TRP 56 2.599 0.099 -3.117
428 HB2 TRP 56 HB2 TRP 56 4.468 0.248 -1.633
429 HB3 TRP 56 HB1 TRP 56 4.911 1.836 -2.240
430 HD1 TRP 56 HD1 TRP 56 4.638 3.327 -0.154
431 HE1 TRP 56 HE1 TRP 56 2.702 3.874 1.451
432 HE3 TRP 56 HE3 TRP 56 1.252 -0.136 -1.765
433 HZ2 TRP 56 HZ2 TRP 56 0.086 2.965 1.963
434 HZ3 TRP 56 HZ3 TRP 56 -0.954 -0.231 -0.666
435 HH2 TRP 56 HH2 TRP 56 -1.520 1.290 1.158
436 H LEU 57 HN LEU 57 4.183 3.051 -4.244
437 HA LEU 57 HA LEU 57 2.078 4.840 -3.801
438 HB2 LEU 57 HB2 LEU 57 4.033 4.951 -6.099
439 HB3 LEU 57 HB1 LEU 57 3.187 6.300 -5.365
440 HG LEU 57 HG LEU 57 5.276 4.624 -3.981
441 HD11 LEU 57 HD11 LEU 57 5.474 7.363 -5.222
442 HD12 LEU 57 HD12 LEU 57 6.295 5.899 -5.760
443 HD13 LEU 57 HD13 LEU 57 6.705 6.618 -4.203
444 HD21 LEU 57 HD21 LEU 57 5.226 6.434 -2.305
445 HD22 LEU 57 HD22 LEU 57 3.693 5.572 -2.421
446 HD23 LEU 57 HD23 LEU 57 3.864 7.163 -3.162
447 H ASN 58 HN ASN 58 2.922 2.941 -6.620
448 HA ASN 58 HA ASN 58 0.905 3.819 -8.358
449 HB2 ASN 58 HB2 ASN 58 3.028 2.595 -8.965
450 HB3 ASN 58 HB1 ASN 58 2.274 1.121 -8.377
451 HD21 ASN 58 HD21 ASN 58 3.243 1.891 -11.043
452 HD22 ASN 58 HD22 ASN 58 1.895 1.667 -12.105
453 H PHE 59 HN PHE 59 1.102 1.020 -6.200
454 HA PHE 59 HA PHE 59 -1.381 -0.129 -6.855
455 HB2 PHE 59 HB2 PHE 59 0.362 -1.335 -5.635
456 HB3 PHE 59 HB1 PHE 59 0.211 -0.227 -4.278
457 HD1 PHE 59 HD1 PHE 59 -1.981 -0.210 -2.986
458 HD2 PHE 59 HD2 PHE 59 -0.949 -3.252 -5.781
459 HE1 PHE 59 HE1 PHE 59 -3.624 -1.713 -1.949
460 HE2 PHE 59 HE2 PHE 59 -2.600 -4.757 -4.752
461 HZ PHE 59 HZ PHE 59 -3.940 -3.988 -2.836
462 H ALA 60 HN ALA 60 -0.436 2.221 -4.374
463 HA ALA 60 HA ALA 60 -3.006 2.285 -3.134
464 HB1 ALA 60 HB1 ALA 60 -2.154 4.215 -1.917
465 HB2 ALA 60 HB2 ALA 60 -0.770 4.300 -3.007
466 HB3 ALA 60 HB3 ALA 60 -0.971 2.908 -1.944
467 H LYS 61 HN LYS 61 -1.388 4.353 -5.502
468 HA LYS 61 HA LYS 61 -3.473 6.251 -5.660
469 HB2 LYS 61 HB2 LYS 61 -2.304 7.208 -7.484
470 HB3 LYS 61 HB1 LYS 61 -1.145 6.734 -6.254
471 HG2 LYS 61 HG2 LYS 61 -0.082 5.928 -8.032
472 HG3 LYS 61 HG1 LYS 61 -1.093 4.531 -7.715
473 HD2 LYS 61 HD2 LYS 61 -1.268 4.969 -10.045
474 HD3 LYS 61 HD1 LYS 61 -2.774 5.493 -9.281
475 HE2 LYS 61 HE2 LYS 61 -2.006 7.112 -10.948
476 HE3 LYS 61 HE1 LYS 61 -2.022 7.805 -9.329
477 HZ1 LYS 61 HZ1 LYS 61 0.361 7.477 -9.196
478 HZ2 LYS 61 HZ2 LYS 61 -0.027 8.406 -10.553
479 HZ3 LYS 61 HZ3 LYS 61 0.382 6.777 -10.736
480 H LYS 62 HN LYS 62 -2.952 3.182 -7.076
481 HA LYS 62 HA LYS 62 -4.662 3.460 -9.329
482 HB2 LYS 62 HB2 LYS 62 -2.934 1.714 -9.151
483 HB3 LYS 62 HB1 LYS 62 -3.813 0.976 -7.823
484 HG2 LYS 62 HG2 LYS 62 -5.715 0.601 -9.384
485 HG3 LYS 62 HG1 LYS 62 -4.686 1.179 -10.693
486 HD2 LYS 62 HD2 LYS 62 -3.862 -1.091 -8.903
487 HD3 LYS 62 HD1 LYS 62 -4.850 -1.350 -10.337
488 HE2 LYS 62 HE2 LYS 62 -2.627 -1.758 -11.007
489 HE3 LYS 62 HE1 LYS 62 -3.033 -0.169 -11.642
490 HZ1 LYS 62 HZ1 LYS 62 -1.540 -0.586 -9.111
491 HZ2 LYS 62 HZ2 LYS 62 -1.755 0.870 -9.950
492 HZ3 LYS 62 HZ3 LYS 62 -0.796 -0.352 -10.609
493 H HIS 63 HN HIS 63 -5.150 2.656 -5.977
494 HA HIS 63 HA HIS 63 -7.762 1.568 -6.292
495 HB2 HIS 63 HB2 HIS 63 -6.129 2.468 -3.951
496 HB3 HIS 63 HB1 HIS 63 -7.851 2.151 -3.740
497 HD1 HIS 63 HD1 HIS 63 -8.210 -0.130 -2.876
498 HD2 HIS 63 HD2 HIS 63 -4.974 0.056 -5.473
499 HE1 HIS 63 HE1 HIS 63 -7.328 -2.481 -3.021
500 HE2 HIS 63 HE2 HIS 63 -5.503 -2.373 -4.756
501 H TYR 64 HN TYR 64 -6.491 4.781 -5.882
502 HA TYR 64 HA TYR 64 -9.201 5.781 -6.305
503 HB2 TYR 64 HB2 TYR 64 -8.488 7.720 -4.654
504 HB3 TYR 64 HB1 TYR 64 -9.263 6.252 -4.075
505 HD1 TYR 64 HD1 TYR 64 -6.001 7.984 -4.397
506 HD2 TYR 64 HD2 TYR 64 -8.162 4.797 -2.589
507 HE1 TYR 64 HE1 TYR 64 -4.133 7.604 -2.842
508 HE2 TYR 64 HE2 TYR 64 -6.302 4.409 -1.034
509 HH TYR 64 HH TYR 64 -3.810 6.614 -0.592
510 H ASN 65 HN ASN 65 -8.189 5.880 -8.442
511 HA ASN 65 HA ASN 65 -6.859 8.485 -8.758
512 HB2 ASN 65 HB2 ASN 65 -5.477 6.471 -9.442
513 HB3 ASN 65 HB1 ASN 65 -6.669 6.172 -10.701
514 HD21 ASN 65 HD21 ASN 65 -4.319 8.493 -9.509
515 HD22 ASN 65 HD22 ASN 65 -4.018 9.252 -11.035
516 H TYR 66 HN TYR 66 -9.632 7.880 -8.479
517 HA TYR 66 HA TYR 66 -10.738 8.231 -11.147
518 HB2 TYR 66 HB2 TYR 66 -12.958 8.059 -9.991
519 HB3 TYR 66 HB1 TYR 66 -11.940 6.638 -9.815
520 HD1 TYR 66 HD1 TYR 66 -10.739 6.277 -7.613
521 HD2 TYR 66 HD2 TYR 66 -13.770 9.218 -8.108
522 HE1 TYR 66 HE1 TYR 66 -11.049 6.364 -5.175
523 HE2 TYR 66 HE2 TYR 66 -14.079 9.319 -5.673
524 HH TYR 66 HH TYR 66 -11.901 7.999 -3.480
525 H GLU 67 HN GLU 67 -9.190 10.266 -10.606
526 HA GLU 67 HA GLU 67 -10.153 12.507 -9.300
527 HB2 GLU 67 HB2 GLU 67 -8.697 12.470 -11.947
528 HB3 GLU 67 HB1 GLU 67 -8.753 13.803 -10.802
529 HG2 GLU 67 HG2 GLU 67 -7.520 11.113 -10.263
530 HG3 GLU 67 HG1 GLU 67 -6.642 12.561 -10.734
531 H GLN 68 HN GLN 68 -10.653 11.507 -12.644
532 HA GLN 68 HA GLN 68 -13.261 12.839 -12.615
533 HB2 GLN 68 HB2 GLN 68 -11.190 12.910 -14.812
534 HB3 GLN 68 HB1 GLN 68 -12.886 13.275 -15.098
535 HG2 GLN 68 HG2 GLN 68 -11.155 14.742 -13.124
536 HG3 GLN 68 HG1 GLN 68 -11.442 15.267 -14.783
537 HE21 GLN 68 HE21 GLN 68 -12.860 14.798 -11.635
538 HE22 GLN 68 HE22 GLN 68 -14.275 15.760 -11.915
539 HA PRO 69 HA PRO 69 -13.706 8.353 -13.477
540 HB2 PRO 69 HB2 PRO 69 -16.322 8.278 -12.637
541 HB3 PRO 69 HB1 PRO 69 -14.930 8.036 -11.577
542 HG2 PRO 69 HG2 PRO 69 -16.581 10.486 -12.013
543 HG3 PRO 69 HG1 PRO 69 -15.906 9.841 -10.505
544 HD2 PRO 69 HD2 PRO 69 -14.784 11.917 -11.804
545 HD3 PRO 69 HD1 PRO 69 -13.813 10.726 -10.917
546 H PHE 70 HN PHE 70 -13.719 8.304 -15.656
547 HA PHE 70 HA PHE 70 -15.632 9.662 -17.263
548 HB2 PHE 70 HB2 PHE 70 -13.806 7.386 -18.042
549 HB3 PHE 70 HB1 PHE 70 -14.597 8.517 -19.133
550 HD1 PHE 70 HD1 PHE 70 -11.690 7.828 -17.221
551 HD2 PHE 70 HD2 PHE 70 -13.979 10.992 -18.909
552 HE1 PHE 70 HE1 PHE 70 -9.735 9.313 -17.073
553 HE2 PHE 70 HE2 PHE 70 -12.028 12.484 -18.769
554 HZ PHE 70 HZ PHE 70 -9.902 11.643 -17.850
555 H LYS 71 HN LYS 71 -15.043 6.282 -16.549
556 HA LYS 71 HA LYS 71 -16.329 4.422 -16.530
557 HB2 LYS 71 HB2 LYS 71 -18.640 6.335 -16.151
558 HB3 LYS 71 HB1 LYS 71 -18.636 4.618 -15.776
559 HG2 LYS 71 HG2 LYS 71 -16.892 6.683 -14.443
560 HG3 LYS 71 HG1 LYS 71 -18.400 6.047 -13.784
561 HD2 LYS 71 HD2 LYS 71 -16.094 4.264 -14.523
562 HD3 LYS 71 HD1 LYS 71 -16.231 5.014 -12.933
563 HE2 LYS 71 HE2 LYS 71 -18.361 3.281 -14.174
564 HE3 LYS 71 HE1 LYS 71 -17.131 2.686 -13.061
565 HZ1 LYS 71 HZ1 LYS 71 -19.236 3.206 -11.955
566 HZ2 LYS 71 HZ2 LYS 71 -19.095 4.822 -12.432
567 HZ3 LYS 71 HZ3 LYS 71 -17.965 4.155 -11.368
568 H HIS 72 HN HIS 72 -18.983 6.270 -17.859
569 HA HIS 72 HA HIS 72 -20.027 6.327 -19.847
570 HB2 HIS 72 HB2 HIS 72 -17.296 5.575 -20.880
571 HB3 HIS 72 HB1 HIS 72 -18.651 6.001 -21.918
572 HD1 HIS 72 HD1 HIS 72 -15.745 7.510 -20.939
573 HD2 HIS 72 HD2 HIS 72 -19.714 8.704 -20.604
574 HE1 HIS 72 HE1 HIS 72 -15.677 10.002 -20.624
575 HE2 HIS 72 HE2 HIS 72 -18.077 10.694 -20.329
576 H ILE 73 HN ILE 73 -20.431 4.957 -21.923
577 HA ILE 73 HA ILE 73 -21.710 3.218 -22.590
578 HB ILE 73 HB ILE 73 -19.411 2.558 -23.258
579 HG12 ILE 73 HG12 ILE 73 -21.219 0.232 -22.584
580 HG13 ILE 73 HG11 ILE 73 -21.401 1.289 -23.978
581 HG21 ILE 73 HG21 ILE 73 -18.276 0.726 -22.099
582 HG22 ILE 73 HG22 ILE 73 -19.475 0.810 -20.809
583 HG23 ILE 73 HG23 ILE 73 -18.396 2.174 -21.098
584 HD11 ILE 73 HD11 ILE 73 -19.069 -0.534 -23.428
585 HD12 ILE 73 HD12 ILE 73 -19.225 0.545 -24.815
586 HD13 ILE 73 HD13 ILE 73 -20.351 -0.797 -24.610
587 H ASN 74 HN ASN 74 -22.546 3.971 -20.167
588 HA ASN 74 HA ASN 74 -22.947 1.528 -18.595
589 HB2 ASN 74 HB2 ASN 74 -23.494 4.433 -17.947
590 HB3 ASN 74 HB1 ASN 74 -23.942 3.097 -16.897
591 HD21 ASN 74 HD21 ASN 74 -21.558 1.548 -17.417
592 HD22 ASN 74 HD22 ASN 74 -20.257 2.359 -16.616
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 -7.364 14.605 -1.563
2 H2 MET 1 HT2 MET 1 -7.492 16.266 -1.290
3 H3 MET 1 HT3 MET 1 -6.422 15.335 -0.367
4 HA MET 1 HA MET 1 -6.229 15.852 -3.267
5 HB2 MET 1 HB2 MET 1 -5.626 17.821 -2.020
6 HB3 MET 1 HB1 MET 1 -4.636 16.878 -0.916
7 HG2 MET 1 HG2 MET 1 -3.367 18.187 -2.608
8 HG3 MET 1 HG1 MET 1 -3.010 16.463 -2.587
9 HE1 MET 1 HE1 MET 1 -5.607 18.534 -5.788
10 HE2 MET 1 HE2 MET 1 -4.826 19.382 -4.453
11 HE3 MET 1 HE3 MET 1 -6.160 18.274 -4.134
12 H ALA 2 HN ALA 2 -5.634 14.026 -4.164
13 HA ALA 2 HA ALA 2 -4.400 11.889 -2.825
14 HB1 ALA 2 HB1 ALA 2 -4.241 10.834 -4.998
15 HB2 ALA 2 HB2 ALA 2 -4.568 12.372 -5.791
16 HB3 ALA 2 HB3 ALA 2 -5.812 11.610 -4.802
17 H SER 3 HN SER 3 -3.062 14.558 -4.674
18 HA SER 3 HA SER 3 -0.494 13.521 -5.097
19 HB2 SER 3 HB2 SER 3 -1.337 15.565 -6.204
20 HB3 SER 3 HB1 SER 3 -1.304 16.413 -4.659
21 HG SER 3 HG SER 3 0.932 15.315 -6.027
22 H ASP 4 HN ASP 4 -1.850 15.241 -2.323
23 HA ASP 4 HA ASP 4 0.589 15.206 -0.836
24 HB2 ASP 4 HB2 ASP 4 -1.143 16.833 -0.291
25 HB3 ASP 4 HB1 ASP 4 -2.277 15.538 0.083
26 H MET 5 HN MET 5 -2.159 13.116 -1.215
27 HA MET 5 HA MET 5 -1.690 11.405 0.980
28 HB2 MET 5 HB2 MET 5 -3.853 11.618 -0.188
29 HB3 MET 5 HB1 MET 5 -3.152 10.851 -1.603
30 HG2 MET 5 HG2 MET 5 -4.432 9.228 -0.455
31 HG3 MET 5 HG1 MET 5 -2.730 8.834 -0.230
32 HE1 MET 5 HE1 MET 5 -5.165 7.656 1.356
33 HE2 MET 5 HE2 MET 5 -4.616 7.672 3.035
34 HE3 MET 5 HE3 MET 5 -3.521 7.150 1.754
35 H GLU 6 HN GLU 6 -0.695 11.221 -2.449
36 HA GLU 6 HA GLU 6 0.461 8.651 -2.238
37 HB2 GLU 6 HB2 GLU 6 1.688 9.208 -4.311
38 HB3 GLU 6 HB1 GLU 6 -0.033 9.538 -4.421
39 HG2 GLU 6 HG2 GLU 6 0.420 11.918 -4.026
40 HG3 GLU 6 HG1 GLU 6 2.147 11.561 -3.982
41 H GLU 7 HN GLU 7 1.743 11.871 -1.654
42 HA GLU 7 HA GLU 7 4.391 11.107 -1.111
43 HB2 GLU 7 HB2 GLU 7 2.726 13.430 -0.187
44 HB3 GLU 7 HB1 GLU 7 4.390 13.215 0.340
45 HG2 GLU 7 HG2 GLU 7 3.400 13.577 -2.466
46 HG3 GLU 7 HG1 GLU 7 4.340 14.720 -1.511
47 H LYS 8 HN LYS 8 1.490 11.146 0.908
48 HA LYS 8 HA LYS 8 2.722 10.547 3.357
49 HB2 LYS 8 HB2 LYS 8 -0.009 9.719 2.373
50 HB3 LYS 8 HB1 LYS 8 0.530 9.614 4.037
51 HG2 LYS 8 HG2 LYS 8 0.818 12.052 4.032
52 HG3 LYS 8 HG1 LYS 8 0.176 12.098 2.394
53 HD2 LYS 8 HD2 LYS 8 -1.628 12.615 3.851
54 HD3 LYS 8 HD1 LYS 8 -1.877 10.964 3.280
55 HE2 LYS 8 HE2 LYS 8 -1.006 10.075 5.353
56 HE3 LYS 8 HE1 LYS 8 -0.624 11.700 5.922
57 HZ1 LYS 8 HZ1 LYS 8 -2.983 12.221 5.897
58 HZ2 LYS 8 HZ2 LYS 8 -2.678 10.885 6.886
59 HZ3 LYS 8 HZ3 LYS 8 -3.347 10.662 5.349
60 H PHE 9 HN PHE 9 1.665 8.447 0.703
61 HA PHE 9 HA PHE 9 2.232 5.979 1.941
62 HB2 PHE 9 HB2 PHE 9 2.426 6.721 -0.990
63 HB3 PHE 9 HB1 PHE 9 2.446 5.081 -0.364
64 HD1 PHE 9 HD1 PHE 9 0.537 6.717 -2.325
65 HD2 PHE 9 HD2 PHE 9 0.273 5.321 1.683
66 HE1 PHE 9 HE1 PHE 9 -1.911 6.627 -2.527
67 HE2 PHE 9 HE2 PHE 9 -2.176 5.229 1.493
68 HZ PHE 9 HZ PHE 9 -3.272 5.882 -0.612
69 H ARG 10 HN ARG 10 4.173 8.185 0.020
70 HA ARG 10 HA ARG 10 6.547 6.712 -0.126
71 HB2 ARG 10 HB2 ARG 10 6.135 8.630 -1.533
72 HB3 ARG 10 HB1 ARG 10 6.026 9.685 -0.137
73 HG2 ARG 10 HG2 ARG 10 8.417 9.258 0.316
74 HG3 ARG 10 HG1 ARG 10 8.493 8.300 -1.164
75 HD2 ARG 10 HD2 ARG 10 7.775 10.252 -2.443
76 HD3 ARG 10 HD1 ARG 10 7.719 11.206 -0.969
77 HE ARG 10 HE ARG 10 10.266 9.972 -1.671
78 HH11 ARG 10 HH11 ARG 10 8.270 12.860 -1.610
79 HH12 ARG 10 HH12 ARG 10 9.621 13.937 -1.802
80 HH21 ARG 10 HH21 ARG 10 12.026 11.388 -1.950
81 HH22 ARG 10 HH22 ARG 10 11.753 13.101 -2.006
82 H GLU 11 HN GLU 11 5.461 9.119 2.201
83 HA GLU 11 HA GLU 11 7.816 9.219 3.741
84 HB2 GLU 11 HB2 GLU 11 6.167 10.980 3.829
85 HB3 GLU 11 HB1 GLU 11 4.952 9.865 4.434
86 HG2 GLU 11 HG2 GLU 11 6.240 9.590 6.494
87 HG3 GLU 11 HG1 GLU 11 7.444 10.726 5.883
88 H ALA 12 HN ALA 12 4.839 7.355 4.120
89 HA ALA 12 HA ALA 12 5.641 6.097 6.547
90 HB1 ALA 12 HB1 ALA 12 3.286 6.330 5.918
91 HB2 ALA 12 HB2 ALA 12 3.716 4.644 6.215
92 HB3 ALA 12 HB3 ALA 12 3.543 5.232 4.562
93 H PHE 13 HN PHE 13 5.937 5.297 3.143
94 HA PHE 13 HA PHE 13 6.720 2.615 3.460
95 HB2 PHE 13 HB2 PHE 13 6.040 3.645 1.288
96 HB3 PHE 13 HB1 PHE 13 7.586 4.489 1.252
97 HD1 PHE 13 HD1 PHE 13 9.582 3.380 0.609
98 HD2 PHE 13 HD2 PHE 13 5.983 1.186 1.177
99 HE1 PHE 13 HE1 PHE 13 10.625 1.402 -0.418
100 HE2 PHE 13 HE2 PHE 13 7.016 -0.792 0.159
101 HZ PHE 13 HZ PHE 13 9.341 -0.688 -0.641
102 H ILE 14 HN ILE 14 8.582 5.627 3.368
103 HA ILE 14 HA ILE 14 11.136 4.481 3.456
104 HB ILE 14 HB ILE 14 10.243 7.095 4.685
105 HG12 ILE 14 HG12 ILE 14 11.531 6.548 2.001
106 HG13 ILE 14 HG11 ILE 14 9.815 6.863 2.237
107 HG21 ILE 14 HG21 ILE 14 12.368 6.315 5.593
108 HG22 ILE 14 HG22 ILE 14 12.606 7.724 4.553
109 HG23 ILE 14 HG23 ILE 14 12.998 6.110 3.957
110 HD11 ILE 14 HD11 ILE 14 10.965 8.847 1.467
111 HD12 ILE 14 HD12 ILE 14 12.068 8.764 2.843
112 HD13 ILE 14 HD13 ILE 14 10.353 9.086 3.103
113 H LEU 15 HN LEU 15 8.809 5.175 5.997
114 HA LEU 15 HA LEU 15 10.521 4.689 8.177
115 HB2 LEU 15 HB2 LEU 15 7.528 4.350 7.988
116 HB3 LEU 15 HB1 LEU 15 8.451 4.396 9.477
117 HG LEU 15 HG LEU 15 8.190 6.675 7.512
118 HD11 LEU 15 HD11 LEU 15 6.112 6.223 8.711
119 HD12 LEU 15 HD12 LEU 15 6.844 7.738 9.242
120 HD13 LEU 15 HD13 LEU 15 6.978 6.293 10.246
121 HD21 LEU 15 HD21 LEU 15 9.529 6.534 10.211
122 HD22 LEU 15 HD22 LEU 15 9.284 8.002 9.265
123 HD23 LEU 15 HD23 LEU 15 10.332 6.722 8.652
124 H PHE 16 HN PHE 16 8.269 2.552 6.431
125 HA PHE 16 HA PHE 16 8.934 0.273 8.044
126 HB2 PHE 16 HB2 PHE 16 7.351 0.608 5.503
127 HB3 PHE 16 HB1 PHE 16 7.670 -0.974 6.193
128 HD1 PHE 16 HD1 PHE 16 5.760 -1.836 7.126
129 HD2 PHE 16 HD2 PHE 16 6.620 2.300 7.675
130 HE1 PHE 16 HE1 PHE 16 3.739 -1.610 8.533
131 HE2 PHE 16 HE2 PHE 16 4.618 2.530 9.086
132 HZ PHE 16 HZ PHE 16 3.181 0.580 9.515
133 H SER 17 HN SER 17 9.865 1.385 4.795
134 HA SER 17 HA SER 17 11.440 -1.069 4.487
135 HB2 SER 17 HB2 SER 17 10.205 0.701 2.389
136 HB3 SER 17 HB1 SER 17 11.218 -0.700 2.052
137 HG SER 17 HG SER 17 9.459 -1.596 3.708
138 H SER 18 HN SER 18 12.177 1.731 5.552
139 HA SER 18 HA SER 18 13.692 3.467 4.620
140 HB2 SER 18 HB2 SER 18 15.037 1.493 6.463
141 HB3 SER 18 HB1 SER 18 15.416 3.206 6.295
142 HG SER 18 HG SER 18 12.943 3.308 6.810
143 H CYS 19 HN CYS 19 15.803 0.613 4.983
144 HA CYS 19 HA CYS 19 16.788 1.133 2.257
145 HB2 CYS 19 HB2 CYS 19 19.124 0.619 3.168
146 HB3 CYS 19 HB1 CYS 19 18.440 2.197 3.548
147 HG CYS 19 HG CYS 19 19.816 0.235 5.602
148 H SER 20 HN SER 20 18.056 -1.163 4.650
149 HA SER 20 HA SER 20 17.472 -3.374 2.851
150 HB2 SER 20 HB2 SER 20 18.711 -3.450 5.609
151 HB3 SER 20 HB1 SER 20 18.761 -4.722 4.389
152 HG SER 20 HG SER 20 19.788 -2.883 3.078
153 H ASP 21 HN ASP 21 15.402 -1.869 3.952
154 HA ASP 21 HA ASP 21 14.133 -3.552 5.961
155 HB2 ASP 21 HB2 ASP 21 13.596 -0.677 5.221
156 HB3 ASP 21 HB1 ASP 21 12.718 -1.586 6.444
157 H HIS 22 HN HIS 22 14.182 -4.079 3.012
158 HA HIS 22 HA HIS 22 11.772 -2.893 1.968
159 HB2 HIS 22 HB2 HIS 22 13.817 -4.790 0.831
160 HB3 HIS 22 HB1 HIS 22 12.322 -4.442 -0.028
161 HD1 HIS 22 HD1 HIS 22 15.525 -3.527 -0.512
162 HD2 HIS 22 HD2 HIS 22 12.156 -1.279 0.360
163 HE1 HIS 22 HE1 HIS 22 16.045 -1.199 -1.324
164 HE2 HIS 22 HE2 HIS 22 13.993 0.161 -0.760
165 H ILE 23 HN ILE 23 9.987 -4.186 1.050
166 HA ILE 23 HA ILE 23 9.320 -5.515 3.550
167 HB ILE 23 HB ILE 23 8.429 -3.251 2.865
168 HG12 ILE 23 HG12 ILE 23 6.277 -5.217 3.566
169 HG13 ILE 23 HG11 ILE 23 7.555 -4.762 4.692
170 HG21 ILE 23 HG21 ILE 23 6.343 -3.238 1.523
171 HG22 ILE 23 HG22 ILE 23 6.655 -4.920 1.095
172 HG23 ILE 23 HG23 ILE 23 7.778 -3.660 0.586
173 HD11 ILE 23 HD11 ILE 23 6.862 -2.433 4.548
174 HD12 ILE 23 HD12 ILE 23 5.534 -3.467 5.073
175 HD13 ILE 23 HD13 ILE 23 5.589 -2.878 3.411
176 H GLU 24 HN GLU 24 8.697 -7.443 3.660
177 HA GLU 24 HA GLU 24 8.029 -9.074 1.404
178 HB2 GLU 24 HB2 GLU 24 7.886 -9.566 4.380
179 HB3 GLU 24 HB1 GLU 24 7.493 -10.779 3.167
180 HG2 GLU 24 HG2 GLU 24 9.758 -10.473 2.260
181 HG3 GLU 24 HG1 GLU 24 10.141 -9.462 3.642
182 H MET 25 HN MET 25 5.949 -10.318 1.378
183 HA MET 25 HA MET 25 3.851 -8.470 1.211
184 HB2 MET 25 HB2 MET 25 4.080 -10.623 -0.076
185 HB3 MET 25 HB1 MET 25 3.537 -11.463 1.369
186 HG2 MET 25 HG2 MET 25 1.416 -10.419 1.289
187 HG3 MET 25 HG1 MET 25 1.948 -9.288 0.047
188 HE1 MET 25 HE1 MET 25 2.841 -10.107 -2.285
189 HE2 MET 25 HE2 MET 25 2.449 -11.658 -3.022
190 HE3 MET 25 HE3 MET 25 3.684 -11.567 -1.766
191 H TYR 26 HN TYR 26 4.875 -10.618 3.794
192 HA TYR 26 HA TYR 26 2.415 -10.456 5.242
193 HB2 TYR 26 HB2 TYR 26 3.405 -11.827 6.801
194 HB3 TYR 26 HB1 TYR 26 4.360 -12.210 5.387
195 HD1 TYR 26 HD1 TYR 26 4.377 -10.826 8.731
196 HD2 TYR 26 HD2 TYR 26 6.666 -11.285 5.175
197 HE1 TYR 26 HE1 TYR 26 6.417 -10.253 9.977
198 HE2 TYR 26 HE2 TYR 26 8.711 -10.714 6.414
199 HH TYR 26 HH TYR 26 8.821 -10.567 9.817
200 H LYS 27 HN LYS 27 5.468 -8.709 5.340
201 HA LYS 27 HA LYS 27 4.718 -7.073 7.600
202 HB2 LYS 27 HB2 LYS 27 7.077 -7.910 6.500
203 HB3 LYS 27 HB1 LYS 27 6.968 -6.276 5.870
204 HG2 LYS 27 HG2 LYS 27 6.762 -6.964 8.787
205 HG3 LYS 27 HG1 LYS 27 8.256 -6.511 7.973
206 HD2 LYS 27 HD2 LYS 27 7.140 -4.382 7.290
207 HD3 LYS 27 HD1 LYS 27 5.775 -4.839 8.306
208 HE2 LYS 27 HE2 LYS 27 8.609 -4.479 9.268
209 HE3 LYS 27 HE1 LYS 27 7.321 -3.291 9.438
210 HZ1 LYS 27 HZ1 LYS 27 7.573 -4.538 11.460
211 HZ2 LYS 27 HZ2 LYS 27 7.378 -6.003 10.642
212 HZ3 LYS 27 HZ3 LYS 27 6.079 -4.919 10.757
213 H PHE 28 HN PHE 28 4.120 -7.163 4.344
214 HA PHE 28 HA PHE 28 4.171 -4.370 3.721
215 HB2 PHE 28 HB2 PHE 28 4.702 -5.871 1.990
216 HB3 PHE 28 HB1 PHE 28 3.318 -6.891 2.336
217 HD1 PHE 28 HD1 PHE 28 1.384 -6.676 1.161
218 HD2 PHE 28 HD2 PHE 28 4.263 -3.560 1.025
219 HE1 PHE 28 HE1 PHE 28 0.123 -5.618 -0.641
220 HE2 PHE 28 HE2 PHE 28 3.020 -2.476 -0.783
221 HZ PHE 28 HZ PHE 28 0.928 -3.507 -1.637
222 H PHE 29 HN PHE 29 1.753 -6.696 4.714
223 HA PHE 29 HA PHE 29 -0.472 -5.108 3.960
224 HB2 PHE 29 HB2 PHE 29 -0.269 -7.678 4.549
225 HB3 PHE 29 HB1 PHE 29 -0.723 -7.105 6.151
226 HD1 PHE 29 HD1 PHE 29 -1.812 -7.610 2.703
227 HD2 PHE 29 HD2 PHE 29 -2.890 -6.078 6.537
228 HE1 PHE 29 HE1 PHE 29 -4.171 -7.566 2.026
229 HE2 PHE 29 HE2 PHE 29 -5.247 -6.008 5.856
230 HZ PHE 29 HZ PHE 29 -5.896 -6.758 3.597
231 H GLU 30 HN GLU 30 1.430 -5.354 6.924
232 HA GLU 30 HA GLU 30 -0.302 -3.776 8.507
233 HB2 GLU 30 HB2 GLU 30 1.730 -3.409 9.959
234 HB3 GLU 30 HB1 GLU 30 1.213 -5.070 9.727
235 HG2 GLU 30 HG2 GLU 30 2.960 -5.246 7.938
236 HG3 GLU 30 HG1 GLU 30 3.552 -3.677 8.480
237 H LEU 31 HN LEU 31 2.175 -3.007 6.228
238 HA LEU 31 HA LEU 31 2.378 -0.256 6.725
239 HB2 LEU 31 HB2 LEU 31 3.967 -1.349 5.306
240 HB3 LEU 31 HB1 LEU 31 2.706 -1.886 4.217
241 HG LEU 31 HG LEU 31 2.311 0.507 3.596
242 HD11 LEU 31 HD11 LEU 31 4.833 0.951 5.185
243 HD12 LEU 31 HD12 LEU 31 3.229 1.579 5.571
244 HD13 LEU 31 HD13 LEU 31 4.067 2.130 4.121
245 HD21 LEU 31 HD21 LEU 31 4.271 0.661 2.160
246 HD22 LEU 31 HD22 LEU 31 3.658 -0.991 2.214
247 HD23 LEU 31 HD23 LEU 31 5.095 -0.553 3.137
248 H MET 32 HN MET 32 0.011 -2.132 4.931
249 HA MET 32 HA MET 32 -1.070 0.302 3.758
250 HB2 MET 32 HB2 MET 32 -2.226 -1.012 2.217
251 HB3 MET 32 HB1 MET 32 -0.722 -1.881 2.469
252 HG2 MET 32 HG2 MET 32 -1.776 -3.505 3.822
253 HG3 MET 32 HG1 MET 32 -3.249 -2.546 3.947
254 HE1 MET 32 HE1 MET 32 -1.013 -4.724 1.464
255 HE2 MET 32 HE2 MET 32 -1.022 -3.052 0.895
256 HE3 MET 32 HE3 MET 32 -1.833 -4.304 -0.040
257 H ASN 33 HN ASN 33 -2.050 -2.069 6.180
258 HA ASN 33 HA ASN 33 -4.766 -1.245 6.185
259 HB2 ASN 33 HB2 ASN 33 -5.115 -2.522 8.122
260 HB3 ASN 33 HB1 ASN 33 -3.867 -3.397 7.244
261 HD21 ASN 33 HD21 ASN 33 -1.886 -3.618 8.138
262 HD22 ASN 33 HD22 ASN 33 -1.493 -3.113 9.745
263 H SER 34 HN SER 34 -1.881 0.093 7.419
264 HA SER 34 HA SER 34 -2.985 1.763 9.430
265 HB2 SER 34 HB2 SER 34 -0.552 1.270 9.228
266 HB3 SER 34 HB1 SER 34 -0.505 2.230 7.751
267 HG SER 34 HG SER 34 -0.106 3.815 9.071
268 H PHE 35 HN PHE 35 -2.879 1.891 5.981
269 HA PHE 35 HA PHE 35 -3.843 4.652 5.934
270 HB2 PHE 35 HB2 PHE 35 -2.866 2.765 3.806
271 HB3 PHE 35 HB1 PHE 35 -3.740 4.236 3.392
272 HD1 PHE 35 HD1 PHE 35 -0.591 2.818 4.425
273 HD2 PHE 35 HD2 PHE 35 -2.789 6.436 4.014
274 HE1 PHE 35 HE1 PHE 35 1.505 4.101 4.549
275 HE2 PHE 35 HE2 PHE 35 -0.704 7.726 4.135
276 HZ PHE 35 HZ PHE 35 1.450 6.560 4.404
277 H GLY 36 HN GLY 36 -5.073 1.571 6.154
278 HA2 GLY 36 HA2 GLY 36 -7.308 0.938 6.203
279 HA3 GLY 36 HA1 GLY 36 -7.737 2.487 5.496
280 H ILE 37 HN ILE 37 -5.260 0.693 3.933
281 HA ILE 37 HA ILE 37 -6.974 0.300 1.616
282 HB ILE 37 HB ILE 37 -4.029 -0.287 1.975
283 HG12 ILE 37 HG12 ILE 37 -5.354 2.073 0.626
284 HG13 ILE 37 HG11 ILE 37 -4.638 2.116 2.234
285 HG21 ILE 37 HG21 ILE 37 -3.951 -0.346 -0.472
286 HG22 ILE 37 HG22 ILE 37 -5.698 -0.119 -0.532
287 HG23 ILE 37 HG23 ILE 37 -5.024 -1.588 0.172
288 HD11 ILE 37 HD11 ILE 37 -3.158 3.048 0.530
289 HD12 ILE 37 HD12 ILE 37 -3.158 1.496 -0.312
290 HD13 ILE 37 HD13 ILE 37 -2.461 1.625 1.305
291 H ILE 38 HN ILE 38 -7.685 -1.648 0.883
292 HA ILE 38 HA ILE 38 -6.920 -4.017 2.444
293 HB ILE 38 HB ILE 38 -9.044 -5.027 1.482
294 HG12 ILE 38 HG12 ILE 38 -9.648 -2.112 0.948
295 HG13 ILE 38 HG11 ILE 38 -9.397 -3.345 -0.282
296 HG21 ILE 38 HG21 ILE 38 -10.446 -3.974 3.214
297 HG22 ILE 38 HG22 ILE 38 -9.218 -2.725 3.417
298 HG23 ILE 38 HG23 ILE 38 -8.839 -4.404 3.799
299 HD11 ILE 38 HD11 ILE 38 -11.754 -2.872 0.025
300 HD12 ILE 38 HD12 ILE 38 -11.630 -3.291 1.734
301 HD13 ILE 38 HD13 ILE 38 -11.381 -4.528 0.501
302 H LEU 39 HN LEU 39 -6.591 -5.984 1.353
303 HA LEU 39 HA LEU 39 -5.745 -5.643 -1.451
304 HB2 LEU 39 HB2 LEU 39 -4.205 -6.167 0.810
305 HB3 LEU 39 HB1 LEU 39 -4.375 -7.721 0.031
306 HG LEU 39 HG LEU 39 -3.138 -5.225 -1.089
307 HD11 LEU 39 HD11 LEU 39 -1.513 -6.207 0.167
308 HD12 LEU 39 HD12 LEU 39 -1.265 -7.047 -1.365
309 HD13 LEU 39 HD13 LEU 39 -2.157 -7.823 -0.058
310 HD21 LEU 39 HD21 LEU 39 -3.640 -7.840 -2.486
311 HD22 LEU 39 HD22 LEU 39 -2.663 -6.508 -3.108
312 HD23 LEU 39 HD23 LEU 39 -4.398 -6.295 -2.863
313 H THR 40 HN THR 40 -6.623 -7.093 -2.847
314 HA THR 40 HA THR 40 -8.187 -9.275 -1.729
315 HB THR 40 HB THR 40 -8.743 -9.621 -4.244
316 HG1 THR 40 HG1 THR 40 -7.901 -8.214 -5.562
317 HG21 THR 40 HG21 THR 40 -10.499 -7.910 -4.105
318 HG22 THR 40 HG22 THR 40 -9.662 -7.171 -2.741
319 HG23 THR 40 HG23 THR 40 -10.327 -8.797 -2.590
320 H ASN 41 HN ASN 41 -8.059 -11.449 -2.791
321 HA ASN 41 HA ASN 41 -5.458 -12.469 -2.515
322 HB2 ASN 41 HB2 ASN 41 -7.987 -13.627 -3.646
323 HB3 ASN 41 HB1 ASN 41 -6.476 -14.522 -3.747
324 HD21 ASN 41 HD21 ASN 41 -5.528 -15.303 -1.876
325 HD22 ASN 41 HD22 ASN 41 -6.389 -15.403 -0.379
326 H ASP 42 HN ASP 42 -7.310 -11.618 -5.392
327 HA ASP 42 HA ASP 42 -5.567 -12.703 -7.296
328 HB2 ASP 42 HB2 ASP 42 -6.745 -11.457 -8.931
329 HB3 ASP 42 HB1 ASP 42 -7.928 -11.825 -7.683
330 H GLU 43 HN GLU 43 -5.630 -9.526 -5.765
331 HA GLU 43 HA GLU 43 -3.438 -8.516 -7.262
332 HB2 GLU 43 HB2 GLU 43 -4.870 -7.610 -4.795
333 HB3 GLU 43 HB1 GLU 43 -3.382 -6.821 -5.294
334 HG2 GLU 43 HG2 GLU 43 -4.500 -6.510 -7.559
335 HG3 GLU 43 HG1 GLU 43 -5.999 -6.964 -6.749
336 H LYS 44 HN LYS 44 -3.700 -9.911 -3.991
337 HA LYS 44 HA LYS 44 -1.057 -9.528 -3.197
338 HB2 LYS 44 HB2 LYS 44 -2.849 -11.851 -2.488
339 HB3 LYS 44 HB1 LYS 44 -1.378 -11.400 -1.641
340 HG2 LYS 44 HG2 LYS 44 -2.464 -9.178 -1.169
341 HG3 LYS 44 HG1 LYS 44 -3.954 -9.878 -1.804
342 HD2 LYS 44 HD2 LYS 44 -3.970 -10.081 0.584
343 HD3 LYS 44 HD1 LYS 44 -3.731 -11.689 -0.103
344 HE2 LYS 44 HE2 LYS 44 -2.236 -11.351 1.782
345 HE3 LYS 44 HE1 LYS 44 -1.315 -11.487 0.289
346 HZ1 LYS 44 HZ1 LYS 44 -0.547 -9.692 1.772
347 HZ2 LYS 44 HZ2 LYS 44 -2.030 -8.907 1.573
348 HZ3 LYS 44 HZ3 LYS 44 -1.003 -9.121 0.244
349 H ALA 45 HN ALA 45 -2.482 -12.189 -5.035
350 HA ALA 45 HA ALA 45 -0.148 -13.783 -5.127
351 HB1 ALA 45 HB1 ALA 45 -1.280 -14.997 -6.916
352 HB2 ALA 45 HB2 ALA 45 -2.478 -13.709 -7.041
353 HB3 ALA 45 HB3 ALA 45 -2.378 -14.680 -5.572
354 H ALA 46 HN ALA 46 -0.898 -10.846 -6.626
355 HA ALA 46 HA ALA 46 0.877 -11.395 -8.911
356 HB1 ALA 46 HB1 ALA 46 -1.082 -9.138 -8.526
357 HB2 ALA 46 HB2 ALA 46 -1.359 -10.594 -9.478
358 HB3 ALA 46 HB3 ALA 46 -0.118 -9.444 -9.971
359 H LEU 47 HN LEU 47 1.193 -10.188 -5.882
360 HA LEU 47 HA LEU 47 2.751 -7.837 -6.599
361 HB2 LEU 47 HB2 LEU 47 2.512 -9.028 -3.849
362 HB3 LEU 47 HB1 LEU 47 2.987 -7.404 -4.273
363 HG LEU 47 HG LEU 47 0.229 -8.594 -4.289
364 HD11 LEU 47 HD11 LEU 47 0.948 -7.737 -2.182
365 HD12 LEU 47 HD12 LEU 47 -0.203 -6.597 -2.886
366 HD13 LEU 47 HD13 LEU 47 1.528 -6.246 -2.936
367 HD21 LEU 47 HD21 LEU 47 -0.652 -6.703 -5.369
368 HD22 LEU 47 HD22 LEU 47 0.685 -7.246 -6.387
369 HD23 LEU 47 HD23 LEU 47 0.893 -5.857 -5.322
370 HA PRO 48 HA PRO 48 6.737 -9.850 -6.581
371 HB2 PRO 48 HB2 PRO 48 8.234 -7.738 -5.702
372 HB3 PRO 48 HB1 PRO 48 7.662 -7.898 -7.365
373 HG2 PRO 48 HG2 PRO 48 6.523 -6.291 -5.116
374 HG3 PRO 48 HG1 PRO 48 6.734 -5.842 -6.819
375 HD2 PRO 48 HD2 PRO 48 4.350 -6.605 -5.839
376 HD3 PRO 48 HD1 PRO 48 4.855 -7.014 -7.491
377 H ASN 49 HN ASN 49 8.442 -10.425 -5.095
378 HA ASN 49 HA ASN 49 7.379 -11.154 -2.563
379 HB2 ASN 49 HB2 ASN 49 10.170 -11.419 -3.704
380 HB3 ASN 49 HB1 ASN 49 9.630 -12.166 -2.203
381 HD21 ASN 49 HD21 ASN 49 10.079 -14.204 -3.042
382 HD22 ASN 49 HD22 ASN 49 9.045 -14.967 -4.198
383 H ASP 50 HN ASP 50 9.429 -8.583 -3.683
384 HA ASP 50 HA ASP 50 9.148 -7.415 -1.012
385 HB2 ASP 50 HB2 ASP 50 11.316 -6.303 -1.144
386 HB3 ASP 50 HB1 ASP 50 11.533 -8.051 -1.271
387 H ILE 51 HN ILE 51 7.947 -5.700 -1.116
388 HA ILE 51 HA ILE 51 7.437 -4.417 -3.658
389 HB ILE 51 HB ILE 51 6.251 -4.185 -0.916
390 HG12 ILE 51 HG12 ILE 51 4.132 -4.431 -2.358
391 HG13 ILE 51 HG11 ILE 51 5.231 -4.851 -3.666
392 HG21 ILE 51 HG21 ILE 51 5.801 -2.211 -3.137
393 HG22 ILE 51 HG22 ILE 51 6.521 -1.891 -1.559
394 HG23 ILE 51 HG23 ILE 51 4.822 -2.343 -1.678
395 HD11 ILE 51 HD11 ILE 51 6.073 -6.724 -2.360
396 HD12 ILE 51 HD12 ILE 51 4.327 -6.826 -2.595
397 HD13 ILE 51 HD13 ILE 51 4.979 -6.296 -1.044
398 H ASN 52 HN ASN 52 8.362 -2.587 -4.354
399 HA ASN 52 HA ASN 52 10.052 -1.113 -2.468
400 HB2 ASN 52 HB2 ASN 52 11.096 -0.072 -4.449
401 HB3 ASN 52 HB1 ASN 52 11.278 -1.808 -4.420
402 HD21 ASN 52 HD21 ASN 52 11.347 0.187 -6.595
403 HD22 ASN 52 HD22 ASN 52 10.219 -0.390 -7.777
404 H MET 53 HN MET 53 10.247 1.311 -3.447
405 HA MET 53 HA MET 53 7.856 2.457 -2.478
406 HB2 MET 53 HB2 MET 53 9.951 3.598 -2.136
407 HB3 MET 53 HB1 MET 53 10.228 3.706 -3.869
408 HG2 MET 53 HG2 MET 53 8.535 5.296 -4.156
409 HG3 MET 53 HG1 MET 53 7.855 4.962 -2.569
410 HE1 MET 53 HE1 MET 53 10.190 4.970 -0.576
411 HE2 MET 53 HE2 MET 53 8.704 5.894 -0.357
412 HE3 MET 53 HE3 MET 53 10.270 6.673 -0.127
413 H ASP 54 HN ASP 54 9.243 2.188 -5.711
414 HA ASP 54 HA ASP 54 7.334 3.715 -7.070
415 HB2 ASP 54 HB2 ASP 54 9.001 1.389 -8.043
416 HB3 ASP 54 HB1 ASP 54 8.043 2.425 -9.096
417 H TYR 55 HN TYR 55 7.337 0.288 -6.169
418 HA TYR 55 HA TYR 55 4.926 -0.253 -7.617
419 HB2 TYR 55 HB2 TYR 55 6.684 -1.992 -6.931
420 HB3 TYR 55 HB1 TYR 55 5.945 -1.932 -5.332
421 HD1 TYR 55 HD1 TYR 55 4.140 -3.363 -4.851
422 HD2 TYR 55 HD2 TYR 55 5.044 -2.414 -8.909
423 HE1 TYR 55 HE1 TYR 55 2.428 -4.926 -5.601
424 HE2 TYR 55 HE2 TYR 55 3.321 -3.993 -9.661
425 HH TYR 55 HH TYR 55 2.095 -5.882 -8.902
426 H TRP 56 HN TRP 56 5.719 0.458 -4.243
427 HA TRP 56 HA TRP 56 3.241 -0.030 -3.096
428 HB2 TRP 56 HB2 TRP 56 5.198 0.366 -1.742
429 HB3 TRP 56 HB1 TRP 56 5.365 1.995 -2.378
430 HD1 TRP 56 HD1 TRP 56 4.864 3.575 -0.438
431 HE1 TRP 56 HE1 TRP 56 3.012 3.795 1.334
432 HE3 TRP 56 HE3 TRP 56 2.226 -0.660 -1.510
433 HZ2 TRP 56 HZ2 TRP 56 0.719 2.367 2.158
434 HZ3 TRP 56 HZ3 TRP 56 0.208 -1.161 -0.187
435 HH2 TRP 56 HH2 TRP 56 -0.527 0.323 1.606
436 H LEU 57 HN LEU 57 4.503 2.998 -4.452
437 HA LEU 57 HA LEU 57 2.209 4.542 -3.871
438 HB2 LEU 57 HB2 LEU 57 4.113 4.982 -6.169
439 HB3 LEU 57 HB1 LEU 57 3.123 6.184 -5.365
440 HG LEU 57 HG LEU 57 5.395 4.708 -4.048
441 HD11 LEU 57 HD11 LEU 57 6.640 6.807 -4.285
442 HD12 LEU 57 HD12 LEU 57 5.318 7.468 -5.250
443 HD13 LEU 57 HD13 LEU 57 6.240 6.086 -5.845
444 HD21 LEU 57 HD21 LEU 57 3.829 7.142 -3.181
445 HD22 LEU 57 HD22 LEU 57 5.204 6.436 -2.327
446 HD23 LEU 57 HD23 LEU 57 3.700 5.527 -2.484
447 H ASN 58 HN ASN 58 3.266 2.922 -6.818
448 HA ASN 58 HA ASN 58 1.098 3.649 -8.445
449 HB2 ASN 58 HB2 ASN 58 3.155 2.838 -9.437
450 HB3 ASN 58 HB1 ASN 58 2.976 1.283 -8.632
451 HD21 ASN 58 HD21 ASN 58 1.836 3.339 -11.192
452 HD22 ASN 58 HD22 ASN 58 0.975 2.115 -12.061
453 H PHE 59 HN PHE 59 1.676 0.846 -6.398
454 HA PHE 59 HA PHE 59 -0.598 -0.646 -7.060
455 HB2 PHE 59 HB2 PHE 59 1.176 -1.626 -5.746
456 HB3 PHE 59 HB1 PHE 59 0.973 -0.420 -4.482
457 HD1 PHE 59 HD1 PHE 59 -0.927 -0.537 -2.947
458 HD2 PHE 59 HD2 PHE 59 -0.251 -3.529 -5.898
459 HE1 PHE 59 HE1 PHE 59 -2.452 -2.049 -1.754
460 HE2 PHE 59 HE2 PHE 59 -1.783 -5.042 -4.713
461 HZ PHE 59 HZ PHE 59 -2.884 -4.301 -2.645
462 H ALA 60 HN ALA 60 -0.058 1.906 -4.697
463 HA ALA 60 HA ALA 60 -2.672 1.793 -3.580
464 HB1 ALA 60 HB1 ALA 60 -2.100 3.920 -2.536
465 HB2 ALA 60 HB2 ALA 60 -0.682 4.056 -3.575
466 HB3 ALA 60 HB3 ALA 60 -0.781 2.761 -2.383
467 H LYS 61 HN LYS 61 -1.176 3.754 -6.114
468 HA LYS 61 HA LYS 61 -3.401 5.459 -6.566
469 HB2 LYS 61 HB2 LYS 61 -1.314 4.680 -8.596
470 HB3 LYS 61 HB1 LYS 61 -2.282 6.151 -8.553
471 HG2 LYS 61 HG2 LYS 61 -0.596 5.631 -6.203
472 HG3 LYS 61 HG1 LYS 61 0.232 6.001 -7.706
473 HD2 LYS 61 HD2 LYS 61 -1.974 7.670 -6.500
474 HD3 LYS 61 HD1 LYS 61 -0.252 8.009 -6.313
475 HE2 LYS 61 HE2 LYS 61 -0.003 8.387 -8.662
476 HE3 LYS 61 HE1 LYS 61 -1.638 7.818 -8.983
477 HZ1 LYS 61 HZ1 LYS 61 -0.951 10.239 -7.409
478 HZ2 LYS 61 HZ2 LYS 61 -2.515 9.700 -7.793
479 HZ3 LYS 61 HZ3 LYS 61 -1.480 10.229 -9.019
480 H LYS 62 HN LYS 62 -2.493 2.324 -7.625
481 HA LYS 62 HA LYS 62 -4.348 2.018 -9.735
482 HB2 LYS 62 HB2 LYS 62 -2.442 0.525 -9.450
483 HB3 LYS 62 HB1 LYS 62 -3.068 -0.011 -7.901
484 HG2 LYS 62 HG2 LYS 62 -5.005 -0.994 -9.050
485 HG3 LYS 62 HG1 LYS 62 -4.307 -0.507 -10.595
486 HD2 LYS 62 HD2 LYS 62 -3.782 -2.829 -10.172
487 HD3 LYS 62 HD1 LYS 62 -2.307 -1.868 -10.081
488 HE2 LYS 62 HE2 LYS 62 -2.475 -1.848 -7.637
489 HE3 LYS 62 HE1 LYS 62 -3.945 -2.813 -7.731
490 HZ1 LYS 62 HZ1 LYS 62 -2.587 -4.543 -8.859
491 HZ2 LYS 62 HZ2 LYS 62 -2.151 -4.257 -7.255
492 HZ3 LYS 62 HZ3 LYS 62 -1.204 -3.630 -8.510
493 H HIS 63 HN HIS 63 -4.579 1.757 -6.284
494 HA HIS 63 HA HIS 63 -7.128 0.434 -6.282
495 HB2 HIS 63 HB2 HIS 63 -5.366 1.609 -4.160
496 HB3 HIS 63 HB1 HIS 63 -7.036 1.186 -3.784
497 HD1 HIS 63 HD1 HIS 63 -6.952 -0.970 -2.564
498 HD2 HIS 63 HD2 HIS 63 -4.343 -0.893 -5.791
499 HE1 HIS 63 HE1 HIS 63 -5.960 -3.271 -2.676
500 HE2 HIS 63 HE2 HIS 63 -4.612 -3.277 -4.814
501 H TYR 64 HN TYR 64 -6.023 3.730 -6.287
502 HA TYR 64 HA TYR 64 -8.714 4.689 -6.666
503 HB2 TYR 64 HB2 TYR 64 -8.944 6.085 -4.802
504 HB3 TYR 64 HB1 TYR 64 -8.409 4.550 -4.111
505 HD1 TYR 64 HD1 TYR 64 -8.067 7.869 -3.602
506 HD2 TYR 64 HD2 TYR 64 -5.586 4.504 -4.372
507 HE1 TYR 64 HE1 TYR 64 -6.152 9.054 -2.612
508 HE2 TYR 64 HE2 TYR 64 -3.674 5.679 -3.387
509 HH TYR 64 HH TYR 64 -2.974 8.010 -3.020
510 H ASN 65 HN ASN 65 -8.703 7.125 -6.895
511 HA ASN 65 HA ASN 65 -7.949 8.961 -7.992
512 HB2 ASN 65 HB2 ASN 65 -6.311 9.049 -6.112
513 HB3 ASN 65 HB1 ASN 65 -5.205 8.066 -7.062
514 HD21 ASN 65 HD21 ASN 65 -7.244 10.727 -8.192
515 HD22 ASN 65 HD22 ASN 65 -5.937 11.757 -8.656
516 H TYR 66 HN TYR 66 -8.254 6.447 -9.290
517 HA TYR 66 HA TYR 66 -6.267 6.668 -11.446
518 HB2 TYR 66 HB2 TYR 66 -7.449 4.582 -12.354
519 HB3 TYR 66 HB1 TYR 66 -6.479 4.404 -10.900
520 HD1 TYR 66 HD1 TYR 66 -9.899 4.450 -12.250
521 HD2 TYR 66 HD2 TYR 66 -7.489 3.850 -8.800
522 HE1 TYR 66 HE1 TYR 66 -11.807 3.407 -11.105
523 HE2 TYR 66 HE2 TYR 66 -9.394 2.808 -7.646
524 HH TYR 66 HH TYR 66 -11.936 2.916 -7.822
525 H GLU 67 HN GLU 67 -7.738 8.817 -11.316
526 HA GLU 67 HA GLU 67 -10.021 8.685 -13.093
527 HB2 GLU 67 HB2 GLU 67 -8.591 11.092 -11.946
528 HB3 GLU 67 HB1 GLU 67 -10.184 11.076 -12.689
529 HG2 GLU 67 HG2 GLU 67 -11.117 9.866 -10.886
530 HG3 GLU 67 HG1 GLU 67 -9.526 9.508 -10.216
531 H GLN 68 HN GLN 68 -6.663 9.675 -13.117
532 HA GLN 68 HA GLN 68 -5.213 10.263 -14.748
533 HB2 GLN 68 HB2 GLN 68 -5.802 8.037 -15.605
534 HB3 GLN 68 HB1 GLN 68 -7.142 8.731 -16.505
535 HG2 GLN 68 HG2 GLN 68 -5.241 8.278 -17.948
536 HG3 GLN 68 HG1 GLN 68 -5.594 10.003 -17.875
537 HE21 GLN 68 HE21 GLN 68 -3.945 8.222 -15.343
538 HE22 GLN 68 HE22 GLN 68 -2.410 8.986 -15.557
539 HA PRO 69 HA PRO 69 -7.777 13.762 -16.309
540 HB2 PRO 69 HB2 PRO 69 -6.793 15.723 -14.769
541 HB3 PRO 69 HB1 PRO 69 -8.066 14.645 -14.188
542 HG2 PRO 69 HG2 PRO 69 -5.156 14.653 -13.557
543 HG3 PRO 69 HG1 PRO 69 -6.532 14.258 -12.515
544 HD2 PRO 69 HD2 PRO 69 -4.881 12.413 -13.814
545 HD3 PRO 69 HD1 PRO 69 -6.473 12.071 -13.113
546 H PHE 70 HN PHE 70 -7.033 14.605 -18.155
547 HA PHE 70 HA PHE 70 -4.156 14.800 -18.560
548 HB2 PHE 70 HB2 PHE 70 -6.435 15.211 -20.510
549 HB3 PHE 70 HB1 PHE 70 -4.725 15.166 -20.924
550 HD1 PHE 70 HD1 PHE 70 -7.670 13.212 -20.112
551 HD2 PHE 70 HD2 PHE 70 -3.468 13.058 -20.769
552 HE1 PHE 70 HE1 PHE 70 -7.806 10.771 -20.388
553 HE2 PHE 70 HE2 PHE 70 -3.600 10.620 -21.048
554 HZ PHE 70 HZ PHE 70 -5.768 9.473 -20.857
555 H LYS 71 HN LYS 71 -5.100 16.586 -16.726
556 HA LYS 71 HA LYS 71 -5.452 19.164 -18.028
557 HB2 LYS 71 HB2 LYS 71 -6.726 18.423 -15.966
558 HB3 LYS 71 HB1 LYS 71 -5.218 18.560 -15.077
559 HG2 LYS 71 HG2 LYS 71 -6.482 20.535 -14.694
560 HG3 LYS 71 HG1 LYS 71 -5.131 20.959 -15.745
561 HD2 LYS 71 HD2 LYS 71 -6.556 20.981 -17.673
562 HD3 LYS 71 HD1 LYS 71 -7.907 20.338 -16.738
563 HE2 LYS 71 HE2 LYS 71 -8.211 22.707 -17.063
564 HE3 LYS 71 HE1 LYS 71 -7.886 22.384 -15.363
565 HZ1 LYS 71 HZ1 LYS 71 -6.023 23.506 -17.379
566 HZ2 LYS 71 HZ2 LYS 71 -5.520 22.971 -15.855
567 HZ3 LYS 71 HZ3 LYS 71 -6.611 24.257 -15.978
568 H HIS 72 HN HIS 72 -3.362 19.264 -19.039
569 HA HIS 72 HA HIS 72 -1.066 19.267 -17.226
570 HB2 HIS 72 HB2 HIS 72 -1.201 19.188 -20.243
571 HB3 HIS 72 HB1 HIS 72 0.300 19.289 -19.330
572 HD1 HIS 72 HD1 HIS 72 -2.112 16.905 -20.659
573 HD2 HIS 72 HD2 HIS 72 0.746 16.942 -17.641
574 HE1 HIS 72 HE1 HIS 72 -1.714 14.493 -20.080
575 HE2 HIS 72 HE2 HIS 72 0.100 14.530 -18.327
576 H ILE 73 HN ILE 73 -1.372 21.146 -20.213
577 HA ILE 73 HA ILE 73 -0.550 23.482 -18.636
578 HB ILE 73 HB ILE 73 0.084 24.448 -20.915
579 HG12 ILE 73 HG12 ILE 73 0.812 22.512 -22.497
580 HG13 ILE 73 HG11 ILE 73 -0.415 21.577 -21.657
581 HG21 ILE 73 HG21 ILE 73 1.582 22.093 -19.795
582 HG22 ILE 73 HG22 ILE 73 1.705 23.770 -19.265
583 HG23 ILE 73 HG23 ILE 73 2.256 23.311 -20.875
584 HD11 ILE 73 HD11 ILE 73 -0.880 24.135 -23.171
585 HD12 ILE 73 HD12 ILE 73 -2.113 23.184 -22.342
586 HD13 ILE 73 HD13 ILE 73 -1.263 22.506 -23.731
587 H ASN 74 HN ASN 74 -3.150 22.222 -20.402
588 HA ASN 74 HA ASN 74 -4.350 24.867 -20.766
589 HB2 ASN 74 HB2 ASN 74 -4.463 23.376 -22.706
590 HB3 ASN 74 HB1 ASN 74 -5.262 22.145 -21.734
591 HD21 ASN 74 HD21 ASN 74 -7.407 22.464 -21.094
592 HD22 ASN 74 HD22 ASN 74 -8.428 23.609 -21.897
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 -4.790 15.440 -1.743
2 H2 MET 1 HT2 MET 1 -5.814 14.136 -1.439
3 H3 MET 1 HT3 MET 1 -6.461 15.615 -1.936
4 HA MET 1 HA MET 1 -6.443 14.006 -3.730
5 HB2 MET 1 HB2 MET 1 -6.160 16.463 -4.139
6 HB3 MET 1 HB1 MET 1 -4.423 16.216 -4.178
7 HG2 MET 1 HG2 MET 1 -4.636 14.813 -6.118
8 HG3 MET 1 HG1 MET 1 -6.390 14.913 -6.019
9 HE1 MET 1 HE1 MET 1 -3.078 16.828 -6.730
10 HE2 MET 1 HE2 MET 1 -3.781 17.862 -5.485
11 HE3 MET 1 HE3 MET 1 -3.646 18.445 -7.143
12 H ALA 2 HN ALA 2 -5.029 12.856 -5.346
13 HA ALA 2 HA ALA 2 -3.692 10.943 -3.841
14 HB1 ALA 2 HB1 ALA 2 -4.788 10.544 -6.019
15 HB2 ALA 2 HB2 ALA 2 -3.182 9.827 -5.884
16 HB3 ALA 2 HB3 ALA 2 -3.410 11.313 -6.812
17 H SER 3 HN SER 3 -2.297 13.606 -5.722
18 HA SER 3 HA SER 3 0.364 12.720 -5.630
19 HB2 SER 3 HB2 SER 3 -0.367 14.486 -7.152
20 HB3 SER 3 HB1 SER 3 -0.703 15.548 -5.788
21 HG SER 3 HG SER 3 1.801 14.613 -6.729
22 H ASP 4 HN ASP 4 -1.421 14.825 -3.377
23 HA ASP 4 HA ASP 4 0.786 15.154 -1.596
24 HB2 ASP 4 HB2 ASP 4 -1.032 16.760 -1.572
25 HB3 ASP 4 HB1 ASP 4 -2.190 15.499 -1.167
26 H MET 5 HN MET 5 -1.754 12.830 -1.982
27 HA MET 5 HA MET 5 -1.470 11.534 0.516
28 HB2 MET 5 HB2 MET 5 -3.450 11.408 -1.043
29 HB3 MET 5 HB1 MET 5 -2.499 10.323 -2.046
30 HG2 MET 5 HG2 MET 5 -3.998 9.075 -0.625
31 HG3 MET 5 HG1 MET 5 -2.321 8.756 -0.186
32 HE1 MET 5 HE1 MET 5 -3.053 7.715 2.149
33 HE2 MET 5 HE2 MET 5 -4.731 7.963 1.668
34 HE3 MET 5 HE3 MET 5 -4.177 8.509 3.251
35 H GLU 6 HN GLU 6 -0.021 10.962 -2.687
36 HA GLU 6 HA GLU 6 1.050 8.437 -2.061
37 HB2 GLU 6 HB2 GLU 6 2.377 8.632 -4.080
38 HB3 GLU 6 HB1 GLU 6 0.731 9.176 -4.363
39 HG2 GLU 6 HG2 GLU 6 1.450 11.488 -4.234
40 HG3 GLU 6 HG1 GLU 6 3.098 10.965 -3.881
41 H GLU 7 HN GLU 7 2.454 11.664 -1.725
42 HA GLU 7 HA GLU 7 5.065 10.819 -1.117
43 HB2 GLU 7 HB2 GLU 7 5.335 13.020 -0.002
44 HB3 GLU 7 HB1 GLU 7 4.673 13.132 -1.624
45 HG2 GLU 7 HG2 GLU 7 2.494 13.534 -0.784
46 HG3 GLU 7 HG1 GLU 7 3.015 13.222 0.871
47 H LYS 8 HN LYS 8 2.191 11.177 0.866
48 HA LYS 8 HA LYS 8 3.373 10.651 3.362
49 HB2 LYS 8 HB2 LYS 8 0.588 10.312 2.281
50 HB3 LYS 8 HB1 LYS 8 0.999 9.809 3.916
51 HG2 LYS 8 HG2 LYS 8 1.587 12.577 2.956
52 HG3 LYS 8 HG1 LYS 8 0.004 12.131 3.605
53 HD2 LYS 8 HD2 LYS 8 1.060 11.357 5.661
54 HD3 LYS 8 HD1 LYS 8 2.645 11.780 5.017
55 HE2 LYS 8 HE2 LYS 8 0.421 13.774 5.379
56 HE3 LYS 8 HE1 LYS 8 1.642 13.452 6.609
57 HZ1 LYS 8 HZ1 LYS 8 2.245 15.358 5.273
58 HZ2 LYS 8 HZ2 LYS 8 2.163 14.439 3.859
59 HZ3 LYS 8 HZ3 LYS 8 3.348 14.102 5.014
60 H PHE 9 HN PHE 9 2.190 8.507 0.809
61 HA PHE 9 HA PHE 9 2.526 6.085 2.252
62 HB2 PHE 9 HB2 PHE 9 2.717 6.527 -0.737
63 HB3 PHE 9 HB1 PHE 9 2.530 4.972 0.061
64 HD1 PHE 9 HD1 PHE 9 0.803 6.606 -2.042
65 HD2 PHE 9 HD2 PHE 9 0.488 5.756 2.113
66 HE1 PHE 9 HE1 PHE 9 -1.636 6.872 -2.177
67 HE2 PHE 9 HE2 PHE 9 -1.951 6.009 1.982
68 HZ PHE 9 HZ PHE 9 -3.012 6.577 -0.163
69 H ARG 10 HN ARG 10 4.593 7.992 0.155
70 HA ARG 10 HA ARG 10 6.807 6.315 0.009
71 HB2 ARG 10 HB2 ARG 10 6.604 8.288 -1.386
72 HB3 ARG 10 HB1 ARG 10 6.653 9.331 0.027
73 HG2 ARG 10 HG2 ARG 10 8.961 8.573 0.466
74 HG3 ARG 10 HG1 ARG 10 8.899 7.629 -1.021
75 HD2 ARG 10 HD2 ARG 10 8.535 9.645 -2.317
76 HD3 ARG 10 HD1 ARG 10 8.521 10.602 -0.840
77 HE ARG 10 HE ARG 10 10.930 9.060 -1.313
78 HH11 ARG 10 HH11 ARG 10 9.300 12.132 -1.651
79 HH12 ARG 10 HH12 ARG 10 10.764 13.036 -1.868
80 HH21 ARG 10 HH21 ARG 10 12.863 10.237 -1.589
81 HH22 ARG 10 HH22 ARG 10 12.796 11.954 -1.830
82 H GLU 11 HN GLU 11 5.999 8.797 2.376
83 HA GLU 11 HA GLU 11 8.375 8.513 3.888
84 HB2 GLU 11 HB2 GLU 11 7.058 10.537 4.018
85 HB3 GLU 11 HB1 GLU 11 5.679 9.640 4.641
86 HG2 GLU 11 HG2 GLU 11 6.945 9.095 6.654
87 HG3 GLU 11 HG1 GLU 11 8.325 9.999 6.029
88 H ALA 12 HN ALA 12 5.116 7.197 4.256
89 HA ALA 12 HA ALA 12 5.551 5.827 6.669
90 HB1 ALA 12 HB1 ALA 12 3.319 6.261 5.757
91 HB2 ALA 12 HB2 ALA 12 3.552 4.548 6.110
92 HB3 ALA 12 HB3 ALA 12 3.635 5.124 4.446
93 H PHE 13 HN PHE 13 6.057 4.921 3.318
94 HA PHE 13 HA PHE 13 6.627 2.208 3.618
95 HB2 PHE 13 HB2 PHE 13 6.349 3.477 1.456
96 HB3 PHE 13 HB1 PHE 13 7.976 4.103 1.685
97 HD1 PHE 13 HD1 PHE 13 9.848 2.859 1.011
98 HD2 PHE 13 HD2 PHE 13 6.033 0.995 1.260
99 HE1 PHE 13 HE1 PHE 13 10.744 0.872 -0.138
100 HE2 PHE 13 HE2 PHE 13 6.918 -0.992 0.130
101 HZ PHE 13 HZ PHE 13 9.279 -1.061 -0.574
102 H ILE 14 HN ILE 14 8.703 5.047 3.902
103 HA ILE 14 HA ILE 14 11.131 3.668 4.250
104 HB ILE 14 HB ILE 14 10.373 6.404 5.288
105 HG12 ILE 14 HG12 ILE 14 11.782 5.602 2.728
106 HG13 ILE 14 HG11 ILE 14 10.107 6.133 2.832
107 HG21 ILE 14 HG21 ILE 14 12.774 6.819 5.352
108 HG22 ILE 14 HG22 ILE 14 13.083 5.172 4.799
109 HG23 ILE 14 HG23 ILE 14 12.349 5.448 6.381
110 HD11 ILE 14 HD11 ILE 14 12.518 7.785 3.548
111 HD12 ILE 14 HD12 ILE 14 10.837 8.317 3.611
112 HD13 ILE 14 HD13 ILE 14 11.577 7.913 2.062
113 H LEU 15 HN LEU 15 8.756 4.895 6.595
114 HA LEU 15 HA LEU 15 10.191 4.192 8.903
115 HB2 LEU 15 HB2 LEU 15 7.319 4.727 8.332
116 HB3 LEU 15 HB1 LEU 15 7.772 4.049 9.879
117 HG LEU 15 HG LEU 15 9.263 5.999 10.257
118 HD11 LEU 15 HD11 LEU 15 7.968 7.076 7.764
119 HD12 LEU 15 HD12 LEU 15 9.666 6.639 7.950
120 HD13 LEU 15 HD13 LEU 15 8.995 7.984 8.872
121 HD21 LEU 15 HD21 LEU 15 7.454 7.588 10.724
122 HD22 LEU 15 HD22 LEU 15 7.035 5.945 11.211
123 HD23 LEU 15 HD23 LEU 15 6.364 6.623 9.728
124 H PHE 16 HN PHE 16 7.720 2.399 7.085
125 HA PHE 16 HA PHE 16 7.705 0.188 8.871
126 HB2 PHE 16 HB2 PHE 16 6.617 0.653 6.119
127 HB3 PHE 16 HB1 PHE 16 6.600 -0.964 6.812
128 HD1 PHE 16 HD1 PHE 16 4.792 -1.621 8.070
129 HD2 PHE 16 HD2 PHE 16 5.598 2.535 7.640
130 HE1 PHE 16 HE1 PHE 16 2.700 -1.098 9.253
131 HE2 PHE 16 HE2 PHE 16 3.509 3.066 8.826
132 HZ PHE 16 HZ PHE 16 2.058 1.248 9.635
133 H SER 17 HN SER 17 9.502 0.871 5.904
134 HA SER 17 HA SER 17 10.637 -1.794 5.858
135 HB2 SER 17 HB2 SER 17 11.424 0.625 4.216
136 HB3 SER 17 HB1 SER 17 11.812 -1.061 3.871
137 HG SER 17 HG SER 17 9.370 0.300 3.636
138 H SER 18 HN SER 18 11.345 1.233 7.250
139 HA SER 18 HA SER 18 12.886 1.942 8.718
140 HB2 SER 18 HB2 SER 18 13.891 -0.912 8.679
141 HB3 SER 18 HB1 SER 18 14.340 0.322 9.857
142 HG SER 18 HG SER 18 12.086 0.447 10.409
143 H CYS 19 HN CYS 19 14.795 -0.443 6.902
144 HA CYS 19 HA CYS 19 16.369 1.720 5.728
145 HB2 CYS 19 HB2 CYS 19 17.603 -0.544 7.318
146 HB3 CYS 19 HB1 CYS 19 18.490 0.675 6.410
147 HG CYS 19 HG CYS 19 18.890 1.899 8.658
148 H SER 20 HN SER 20 14.509 0.107 4.503
149 HA SER 20 HA SER 20 16.204 -1.513 2.753
150 HB2 SER 20 HB2 SER 20 15.057 -3.075 4.243
151 HB3 SER 20 HB1 SER 20 13.504 -2.344 3.846
152 HG SER 20 HG SER 20 13.482 -3.853 2.374
153 H ASP 21 HN ASP 21 15.590 -1.560 0.615
154 HA ASP 21 HA ASP 21 13.827 0.590 -0.232
155 HB2 ASP 21 HB2 ASP 21 15.766 -1.205 -1.677
156 HB3 ASP 21 HB1 ASP 21 14.639 -0.176 -2.552
157 H HIS 22 HN HIS 22 13.662 -2.717 0.355
158 HA HIS 22 HA HIS 22 11.210 -2.923 -1.268
159 HB2 HIS 22 HB2 HIS 22 13.203 -5.120 -0.659
160 HB3 HIS 22 HB1 HIS 22 11.636 -5.381 -1.411
161 HD1 HIS 22 HD1 HIS 22 13.808 -6.371 -3.072
162 HD2 HIS 22 HD2 HIS 22 12.731 -2.356 -3.162
163 HE1 HIS 22 HE1 HIS 22 14.695 -5.477 -5.251
164 HE2 HIS 22 HE2 HIS 22 14.174 -3.013 -5.204
165 H ILE 23 HN ILE 23 9.428 -3.843 -0.271
166 HA ILE 23 HA ILE 23 9.669 -3.948 2.650
167 HB ILE 23 HB ILE 23 8.107 -2.291 1.789
168 HG12 ILE 23 HG12 ILE 23 6.002 -3.151 2.959
169 HG13 ILE 23 HG11 ILE 23 6.915 -4.625 3.260
170 HG21 ILE 23 HG21 ILE 23 7.468 -3.273 -0.303
171 HG22 ILE 23 HG22 ILE 23 6.020 -2.983 0.664
172 HG23 ILE 23 HG23 ILE 23 6.677 -4.615 0.525
173 HD11 ILE 23 HD11 ILE 23 6.972 -3.128 5.165
174 HD12 ILE 23 HD12 ILE 23 7.682 -1.864 4.160
175 HD13 ILE 23 HD13 ILE 23 8.581 -3.348 4.479
176 H GLU 24 HN GLU 24 9.255 -5.723 3.774
177 HA GLU 24 HA GLU 24 8.860 -8.254 2.567
178 HB2 GLU 24 HB2 GLU 24 8.585 -7.313 5.424
179 HB3 GLU 24 HB1 GLU 24 8.500 -9.000 4.933
180 HG2 GLU 24 HG2 GLU 24 10.732 -8.890 4.077
181 HG3 GLU 24 HG1 GLU 24 10.847 -7.185 4.488
182 H MET 25 HN MET 25 7.068 -9.534 2.460
183 HA MET 25 HA MET 25 4.639 -8.283 1.904
184 HB2 MET 25 HB2 MET 25 5.412 -11.143 2.356
185 HB3 MET 25 HB1 MET 25 3.729 -10.702 2.108
186 HG2 MET 25 HG2 MET 25 5.960 -10.055 0.200
187 HG3 MET 25 HG1 MET 25 4.882 -11.442 0.056
188 HE1 MET 25 HE1 MET 25 4.198 -10.737 -2.393
189 HE2 MET 25 HE2 MET 25 5.313 -9.376 -2.281
190 HE3 MET 25 HE3 MET 25 3.657 -9.116 -2.827
191 H TYR 26 HN TYR 26 5.834 -9.667 4.910
192 HA TYR 26 HA TYR 26 3.247 -9.702 6.144
193 HB2 TYR 26 HB2 TYR 26 4.286 -10.687 7.921
194 HB3 TYR 26 HB1 TYR 26 5.508 -11.006 6.711
195 HD1 TYR 26 HD1 TYR 26 4.667 -9.099 9.713
196 HD2 TYR 26 HD2 TYR 26 7.649 -9.806 6.761
197 HE1 TYR 26 HE1 TYR 26 6.328 -7.979 11.129
198 HE2 TYR 26 HE2 TYR 26 9.317 -8.684 8.174
199 HH TYR 26 HH TYR 26 8.667 -7.835 11.457
200 H LYS 27 HN LYS 27 6.001 -7.501 6.117
201 HA LYS 27 HA LYS 27 4.912 -5.725 8.055
202 HB2 LYS 27 HB2 LYS 27 7.341 -6.260 7.583
203 HB3 LYS 27 HB1 LYS 27 7.180 -5.326 6.107
204 HG2 LYS 27 HG2 LYS 27 8.192 -4.017 7.814
205 HG3 LYS 27 HG1 LYS 27 6.601 -3.379 7.419
206 HD2 LYS 27 HD2 LYS 27 5.662 -4.444 9.394
207 HD3 LYS 27 HD1 LYS 27 7.235 -5.144 9.777
208 HE2 LYS 27 HE2 LYS 27 8.166 -2.962 10.168
209 HE3 LYS 27 HE1 LYS 27 6.684 -2.184 9.611
210 HZ1 LYS 27 HZ1 LYS 27 5.502 -3.142 11.473
211 HZ2 LYS 27 HZ2 LYS 27 6.825 -2.239 12.030
212 HZ3 LYS 27 HZ3 LYS 27 6.908 -3.928 12.004
213 H PHE 28 HN PHE 28 4.883 -6.163 4.662
214 HA PHE 28 HA PHE 28 4.094 -3.587 3.833
215 HB2 PHE 28 HB2 PHE 28 4.948 -5.036 2.170
216 HB3 PHE 28 HB1 PHE 28 3.843 -6.331 2.615
217 HD1 PHE 28 HD1 PHE 28 4.039 -2.992 1.053
218 HD2 PHE 28 HD2 PHE 28 1.742 -6.525 1.624
219 HE1 PHE 28 HE1 PHE 28 2.458 -2.240 -0.671
220 HE2 PHE 28 HE2 PHE 28 0.153 -5.783 -0.091
221 HZ PHE 28 HZ PHE 28 0.494 -3.640 -1.240
222 H PHE 29 HN PHE 29 2.265 -6.417 4.914
223 HA PHE 29 HA PHE 29 -0.219 -5.444 3.959
224 HB2 PHE 29 HB2 PHE 29 0.470 -7.870 4.624
225 HB3 PHE 29 HB1 PHE 29 -0.043 -7.384 6.238
226 HD1 PHE 29 HD1 PHE 29 -2.387 -6.639 6.603
227 HD2 PHE 29 HD2 PHE 29 -1.124 -8.397 2.920
228 HE1 PHE 29 HE1 PHE 29 -4.729 -7.083 6.014
229 HE2 PHE 29 HE2 PHE 29 -3.469 -8.847 2.341
230 HZ PHE 29 HZ PHE 29 -5.273 -8.189 3.881
231 H GLU 30 HN GLU 30 1.373 -5.279 7.144
232 HA GLU 30 HA GLU 30 -0.718 -3.809 8.369
233 HB2 GLU 30 HB2 GLU 30 0.983 -3.152 10.056
234 HB3 GLU 30 HB1 GLU 30 0.878 -4.883 9.787
235 HG2 GLU 30 HG2 GLU 30 2.884 -4.819 8.433
236 HG3 GLU 30 HG1 GLU 30 2.971 -3.067 8.621
237 H LEU 31 HN LEU 31 1.964 -2.938 6.359
238 HA LEU 31 HA LEU 31 2.013 -0.174 6.748
239 HB2 LEU 31 HB2 LEU 31 3.836 -1.134 5.634
240 HB3 LEU 31 HB1 LEU 31 2.808 -1.984 4.502
241 HG LEU 31 HG LEU 31 2.225 0.307 3.540
242 HD11 LEU 31 HD11 LEU 31 3.015 1.685 5.370
243 HD12 LEU 31 HD12 LEU 31 3.894 2.061 3.886
244 HD13 LEU 31 HD13 LEU 31 4.655 1.080 5.138
245 HD21 LEU 31 HD21 LEU 31 5.058 -0.694 3.331
246 HD22 LEU 31 HD22 LEU 31 4.241 0.355 2.172
247 HD23 LEU 31 HD23 LEU 31 3.675 -1.297 2.419
248 H MET 32 HN MET 32 -0.032 -2.143 4.686
249 HA MET 32 HA MET 32 -1.046 0.305 3.457
250 HB2 MET 32 HB2 MET 32 -2.092 -1.320 1.772
251 HB3 MET 32 HB1 MET 32 -0.350 -1.098 1.741
252 HG2 MET 32 HG2 MET 32 -0.737 -3.384 1.471
253 HG3 MET 32 HG1 MET 32 -0.187 -3.179 3.132
254 HE1 MET 32 HE1 MET 32 -1.636 -5.766 1.960
255 HE2 MET 32 HE2 MET 32 -2.569 -4.749 0.861
256 HE3 MET 32 HE3 MET 32 -3.401 -5.767 2.042
257 H ASN 33 HN ASN 33 -2.197 -2.369 5.414
258 HA ASN 33 HA ASN 33 -4.941 -1.890 4.881
259 HB2 ASN 33 HB2 ASN 33 -5.470 -3.415 6.557
260 HB3 ASN 33 HB1 ASN 33 -3.884 -3.967 6.035
261 HD21 ASN 33 HD21 ASN 33 -2.155 -3.768 7.411
262 HD22 ASN 33 HD22 ASN 33 -2.332 -3.366 9.086
263 H SER 34 HN SER 34 -2.603 -0.320 6.832
264 HA SER 34 HA SER 34 -4.351 0.900 8.712
265 HB2 SER 34 HB2 SER 34 -2.395 2.482 9.029
266 HB3 SER 34 HB1 SER 34 -2.027 0.771 9.256
267 HG SER 34 HG SER 34 -0.599 2.178 7.848
268 H PHE 35 HN PHE 35 -3.411 1.621 5.452
269 HA PHE 35 HA PHE 35 -4.530 4.299 5.530
270 HB2 PHE 35 HB2 PHE 35 -3.280 2.659 3.326
271 HB3 PHE 35 HB1 PHE 35 -3.972 4.256 3.057
272 HD1 PHE 35 HD1 PHE 35 -3.042 6.176 4.496
273 HD2 PHE 35 HD2 PHE 35 -1.066 2.446 3.968
274 HE1 PHE 35 HE1 PHE 35 -0.913 7.215 5.146
275 HE2 PHE 35 HE2 PHE 35 1.069 3.479 4.622
276 HZ PHE 35 HZ PHE 35 1.147 5.868 5.213
277 H GLY 36 HN GLY 36 -5.854 1.343 5.480
278 HA2 GLY 36 HA2 GLY 36 -8.053 0.737 5.113
279 HA3 GLY 36 HA1 GLY 36 -8.338 2.327 4.421
280 H ILE 37 HN ILE 37 -5.687 0.549 3.167
281 HA ILE 37 HA ILE 37 -6.904 0.404 0.581
282 HB ILE 37 HB ILE 37 -4.264 -0.683 1.572
283 HG12 ILE 37 HG12 ILE 37 -4.893 1.782 -0.068
284 HG13 ILE 37 HG11 ILE 37 -4.512 1.787 1.651
285 HG21 ILE 37 HG21 ILE 37 -5.294 -0.408 -1.252
286 HG22 ILE 37 HG22 ILE 37 -5.018 -1.919 -0.385
287 HG23 ILE 37 HG23 ILE 37 -3.655 -0.877 -0.798
288 HD11 ILE 37 HD11 ILE 37 -2.680 0.868 -0.549
289 HD12 ILE 37 HD12 ILE 37 -2.301 0.915 1.174
290 HD13 ILE 37 HD13 ILE 37 -2.596 2.415 0.294
291 H ILE 38 HN ILE 38 -7.954 -1.235 -0.307
292 HA ILE 38 HA ILE 38 -8.292 -3.679 1.229
293 HB ILE 38 HB ILE 38 -9.751 -2.600 -1.191
294 HG12 ILE 38 HG12 ILE 38 -10.649 -2.811 1.692
295 HG13 ILE 38 HG11 ILE 38 -10.100 -1.327 0.920
296 HG21 ILE 38 HG21 ILE 38 -10.388 -4.984 0.520
297 HG22 ILE 38 HG22 ILE 38 -9.741 -5.034 -1.116
298 HG23 ILE 38 HG23 ILE 38 -11.353 -4.380 -0.825
299 HD11 ILE 38 HD11 ILE 38 -11.968 -1.446 -0.639
300 HD12 ILE 38 HD12 ILE 38 -12.523 -1.430 1.034
301 HD13 ILE 38 HD13 ILE 38 -12.512 -2.940 0.123
302 H LEU 39 HN LEU 39 -7.016 -5.345 0.729
303 HA LEU 39 HA LEU 39 -6.204 -5.727 -2.068
304 HB2 LEU 39 HB2 LEU 39 -4.492 -4.637 -0.393
305 HB3 LEU 39 HB1 LEU 39 -4.300 -6.286 0.165
306 HG LEU 39 HG LEU 39 -3.947 -5.596 -2.736
307 HD11 LEU 39 HD11 LEU 39 -1.748 -5.623 -0.686
308 HD12 LEU 39 HD12 LEU 39 -2.504 -4.144 -1.277
309 HD13 LEU 39 HD13 LEU 39 -1.637 -5.197 -2.393
310 HD21 LEU 39 HD21 LEU 39 -4.138 -7.966 -2.031
311 HD22 LEU 39 HD22 LEU 39 -2.706 -7.734 -1.021
312 HD23 LEU 39 HD23 LEU 39 -2.588 -7.563 -2.775
313 H THR 40 HN THR 40 -6.782 -7.678 -2.725
314 HA THR 40 HA THR 40 -7.581 -9.658 -0.750
315 HB THR 40 HB THR 40 -8.340 -10.922 -2.846
316 HG1 THR 40 HG1 THR 40 -7.834 -8.337 -3.975
317 HG21 THR 40 HG21 THR 40 -9.557 -8.245 -2.177
318 HG22 THR 40 HG22 THR 40 -9.873 -9.774 -1.357
319 HG23 THR 40 HG23 THR 40 -10.370 -9.555 -3.034
320 H ASN 41 HN ASN 41 -7.117 -12.006 -1.299
321 HA ASN 41 HA ASN 41 -4.329 -12.448 -1.242
322 HB2 ASN 41 HB2 ASN 41 -5.886 -14.019 -0.211
323 HB3 ASN 41 HB1 ASN 41 -6.580 -14.402 -1.781
324 HD21 ASN 41 HD21 ASN 41 -3.811 -14.772 0.295
325 HD22 ASN 41 HD22 ASN 41 -3.084 -16.073 -0.579
326 H ASP 42 HN ASP 42 -6.716 -12.620 -3.800
327 HA ASP 42 HA ASP 42 -5.149 -13.708 -5.843
328 HB2 ASP 42 HB2 ASP 42 -7.482 -13.520 -6.222
329 HB3 ASP 42 HB1 ASP 42 -7.483 -11.799 -5.856
330 H GLU 43 HN GLU 43 -5.519 -10.385 -4.724
331 HA GLU 43 HA GLU 43 -3.821 -9.256 -6.705
332 HB2 GLU 43 HB2 GLU 43 -4.724 -8.210 -4.021
333 HB3 GLU 43 HB1 GLU 43 -3.804 -7.267 -5.188
334 HG2 GLU 43 HG2 GLU 43 -5.579 -7.393 -6.784
335 HG3 GLU 43 HG1 GLU 43 -6.473 -8.521 -5.770
336 H LYS 44 HN LYS 44 -3.294 -10.361 -3.364
337 HA LYS 44 HA LYS 44 -0.621 -9.733 -3.076
338 HB2 LYS 44 HB2 LYS 44 -2.154 -12.143 -2.118
339 HB3 LYS 44 HB1 LYS 44 -0.540 -11.719 -1.563
340 HG2 LYS 44 HG2 LYS 44 -2.819 -9.795 -1.382
341 HG3 LYS 44 HG1 LYS 44 -2.522 -10.992 -0.131
342 HD2 LYS 44 HD2 LYS 44 -0.490 -8.981 -1.081
343 HD3 LYS 44 HD1 LYS 44 -1.511 -8.766 0.342
344 HE2 LYS 44 HE2 LYS 44 -0.540 -10.774 1.341
345 HE3 LYS 44 HE1 LYS 44 0.475 -10.994 -0.083
346 HZ1 LYS 44 HZ1 LYS 44 1.540 -9.877 1.876
347 HZ2 LYS 44 HZ2 LYS 44 0.556 -8.539 1.556
348 HZ3 LYS 44 HZ3 LYS 44 1.678 -9.060 0.402
349 H ALA 45 HN ALA 45 -2.089 -12.401 -4.832
350 HA ALA 45 HA ALA 45 0.326 -13.758 -5.439
351 HB1 ALA 45 HB1 ALA 45 -2.280 -13.768 -6.962
352 HB2 ALA 45 HB2 ALA 45 -1.880 -14.823 -5.606
353 HB3 ALA 45 HB3 ALA 45 -0.976 -14.947 -7.115
354 H ALA 46 HN ALA 46 -1.245 -10.970 -6.750
355 HA ALA 46 HA ALA 46 0.319 -11.014 -9.204
356 HB1 ALA 46 HB1 ALA 46 -2.012 -10.266 -9.288
357 HB2 ALA 46 HB2 ALA 46 -0.904 -8.991 -9.793
358 HB3 ALA 46 HB3 ALA 46 -1.627 -8.946 -8.185
359 H LEU 47 HN LEU 47 0.503 -9.743 -6.037
360 HA LEU 47 HA LEU 47 2.151 -7.492 -6.552
361 HB2 LEU 47 HB2 LEU 47 1.879 -9.175 -4.076
362 HB3 LEU 47 HB1 LEU 47 2.753 -7.668 -4.138
363 HG LEU 47 HG LEU 47 -0.104 -8.204 -3.846
364 HD11 LEU 47 HD11 LEU 47 1.730 -5.936 -3.166
365 HD12 LEU 47 HD12 LEU 47 1.050 -7.151 -2.076
366 HD13 LEU 47 HD13 LEU 47 0.004 -5.939 -2.818
367 HD21 LEU 47 HD21 LEU 47 0.005 -7.383 -6.155
368 HD22 LEU 47 HD22 LEU 47 0.703 -5.882 -5.542
369 HD23 LEU 47 HD23 LEU 47 -0.926 -6.371 -5.055
370 HA PRO 48 HA PRO 48 5.898 -9.676 -7.673
371 HB2 PRO 48 HB2 PRO 48 7.144 -7.115 -6.840
372 HB3 PRO 48 HB1 PRO 48 7.280 -7.985 -8.371
373 HG2 PRO 48 HG2 PRO 48 5.832 -5.751 -8.184
374 HG3 PRO 48 HG1 PRO 48 5.308 -7.106 -9.201
375 HD2 PRO 48 HD2 PRO 48 4.322 -6.262 -6.508
376 HD3 PRO 48 HD1 PRO 48 3.416 -6.897 -7.897
377 H ASN 49 HN ASN 49 7.611 -10.609 -6.603
378 HA ASN 49 HA ASN 49 7.327 -10.978 -3.821
379 HB2 ASN 49 HB2 ASN 49 9.538 -11.738 -5.729
380 HB3 ASN 49 HB1 ASN 49 9.564 -12.165 -4.021
381 HD21 ASN 49 HD21 ASN 49 8.102 -12.762 -7.102
382 HD22 ASN 49 HD22 ASN 49 7.202 -14.164 -6.633
383 H ASP 50 HN ASP 50 9.253 -8.794 -5.725
384 HA ASP 50 HA ASP 50 10.189 -7.596 -3.201
385 HB2 ASP 50 HB2 ASP 50 11.356 -7.474 -5.984
386 HB3 ASP 50 HB1 ASP 50 11.811 -6.334 -4.726
387 H ILE 51 HN ILE 51 8.937 -5.960 -2.618
388 HA ILE 51 HA ILE 51 7.677 -4.330 -4.708
389 HB ILE 51 HB ILE 51 6.984 -4.512 -1.774
390 HG12 ILE 51 HG12 ILE 51 5.513 -5.563 -4.202
391 HG13 ILE 51 HG11 ILE 51 6.421 -6.548 -3.059
392 HG21 ILE 51 HG21 ILE 51 4.994 -3.196 -2.392
393 HG22 ILE 51 HG22 ILE 51 5.634 -3.025 -4.025
394 HG23 ILE 51 HG23 ILE 51 6.492 -2.308 -2.664
395 HD11 ILE 51 HD11 ILE 51 4.878 -5.896 -1.282
396 HD12 ILE 51 HD12 ILE 51 4.041 -6.674 -2.625
397 HD13 ILE 51 HD13 ILE 51 3.966 -4.922 -2.436
398 H ASN 52 HN ASN 52 8.598 -2.436 -5.147
399 HA ASN 52 HA ASN 52 10.132 -1.131 -3.004
400 HB2 ASN 52 HB2 ASN 52 11.161 0.223 -4.884
401 HB3 ASN 52 HB1 ASN 52 11.609 -1.463 -4.797
402 HD21 ASN 52 HD21 ASN 52 8.524 -0.386 -6.053
403 HD22 ASN 52 HD22 ASN 52 8.840 -0.808 -7.700
404 H MET 53 HN MET 53 10.300 1.375 -3.680
405 HA MET 53 HA MET 53 7.937 2.496 -2.737
406 HB2 MET 53 HB2 MET 53 10.215 3.516 -2.650
407 HB3 MET 53 HB1 MET 53 10.055 3.903 -4.358
408 HG2 MET 53 HG2 MET 53 9.452 5.865 -3.285
409 HG3 MET 53 HG1 MET 53 7.922 5.095 -3.702
410 HE1 MET 53 HE1 MET 53 9.731 5.193 0.533
411 HE2 MET 53 HE2 MET 53 10.442 5.981 -0.876
412 HE3 MET 53 HE3 MET 53 10.426 4.221 -0.763
413 H ASP 54 HN ASP 54 9.154 2.316 -6.062
414 HA ASP 54 HA ASP 54 7.278 3.932 -7.311
415 HB2 ASP 54 HB2 ASP 54 8.910 1.607 -8.264
416 HB3 ASP 54 HB1 ASP 54 7.720 2.342 -9.332
417 H TYR 55 HN TYR 55 7.104 0.450 -6.686
418 HA TYR 55 HA TYR 55 4.579 0.144 -7.966
419 HB2 TYR 55 HB2 TYR 55 6.264 -1.708 -7.556
420 HB3 TYR 55 HB1 TYR 55 5.747 -1.687 -5.873
421 HD1 TYR 55 HD1 TYR 55 3.848 -2.904 -5.189
422 HD2 TYR 55 HD2 TYR 55 4.498 -2.179 -9.330
423 HE1 TYR 55 HE1 TYR 55 2.004 -4.413 -5.738
424 HE2 TYR 55 HE2 TYR 55 2.647 -3.694 -9.886
425 HH TYR 55 HH TYR 55 1.445 -5.581 -8.879
426 H TRP 56 HN TRP 56 5.636 0.598 -4.630
427 HA TRP 56 HA TRP 56 3.228 0.195 -3.322
428 HB2 TRP 56 HB2 TRP 56 5.293 0.369 -2.108
429 HB3 TRP 56 HB1 TRP 56 5.562 2.003 -2.690
430 HD1 TRP 56 HD1 TRP 56 5.492 3.401 -0.547
431 HE1 TRP 56 HE1 TRP 56 3.798 3.760 1.352
432 HE3 TRP 56 HE3 TRP 56 2.116 -0.219 -1.796
433 HZ2 TRP 56 HZ2 TRP 56 1.336 2.662 2.200
434 HZ3 TRP 56 HZ3 TRP 56 0.108 -0.499 -0.393
435 HH2 TRP 56 HH2 TRP 56 -0.266 0.916 1.563
436 H LEU 57 HN LEU 57 4.590 3.220 -4.590
437 HA LEU 57 HA LEU 57 2.455 4.877 -3.781
438 HB2 LEU 57 HB2 LEU 57 4.231 5.279 -6.187
439 HB3 LEU 57 HB1 LEU 57 3.354 6.516 -5.307
440 HG LEU 57 HG LEU 57 5.624 4.888 -4.181
441 HD11 LEU 57 HD11 LEU 57 5.566 7.710 -5.236
442 HD12 LEU 57 HD12 LEU 57 6.429 6.340 -5.936
443 HD13 LEU 57 HD13 LEU 57 6.912 6.979 -4.364
444 HD21 LEU 57 HD21 LEU 57 4.047 5.664 -2.483
445 HD22 LEU 57 HD22 LEU 57 4.188 7.311 -3.096
446 HD23 LEU 57 HD23 LEU 57 5.584 6.520 -2.362
447 H ASN 58 HN ASN 58 3.156 3.265 -6.830
448 HA ASN 58 HA ASN 58 0.956 4.330 -8.259
449 HB2 ASN 58 HB2 ASN 58 2.878 3.479 -9.469
450 HB3 ASN 58 HB1 ASN 58 2.632 1.870 -8.797
451 HD21 ASN 58 HD21 ASN 58 1.436 4.254 -11.037
452 HD22 ASN 58 HD22 ASN 58 0.420 3.183 -11.942
453 H PHE 59 HN PHE 59 1.470 1.328 -6.499
454 HA PHE 59 HA PHE 59 -0.929 0.067 -7.217
455 HB2 PHE 59 HB2 PHE 59 0.958 -1.087 -6.104
456 HB3 PHE 59 HB1 PHE 59 0.629 -0.181 -4.631
457 HD1 PHE 59 HD1 PHE 59 -0.323 -2.976 -6.703
458 HD2 PHE 59 HD2 PHE 59 -1.444 -0.592 -3.364
459 HE1 PHE 59 HE1 PHE 59 -1.912 -4.715 -5.999
460 HE2 PHE 59 HE2 PHE 59 -3.029 -2.323 -2.652
461 HZ PHE 59 HZ PHE 59 -3.270 -4.384 -3.982
462 H ALA 60 HN ALA 60 -0.098 2.240 -4.547
463 HA ALA 60 HA ALA 60 -2.624 1.972 -3.254
464 HB1 ALA 60 HB1 ALA 60 -1.906 3.852 -1.880
465 HB2 ALA 60 HB2 ALA 60 -0.571 4.164 -2.990
466 HB3 ALA 60 HB3 ALA 60 -0.608 2.669 -2.056
467 H LYS 61 HN LYS 61 -1.249 4.401 -5.443
468 HA LYS 61 HA LYS 61 -3.537 6.054 -5.357
469 HB2 LYS 61 HB2 LYS 61 -2.539 7.306 -7.174
470 HB3 LYS 61 HB1 LYS 61 -1.454 7.058 -5.818
471 HG2 LYS 61 HG2 LYS 61 -0.121 6.672 -7.596
472 HG3 LYS 61 HG1 LYS 61 -0.607 5.047 -7.170
473 HD2 LYS 61 HD2 LYS 61 -0.767 5.261 -9.551
474 HD3 LYS 61 HD1 LYS 61 -2.394 5.195 -8.862
475 HE2 LYS 61 HE2 LYS 61 -2.183 6.884 -10.642
476 HE3 LYS 61 HE1 LYS 61 -2.644 7.577 -9.093
477 HZ1 LYS 61 HZ1 LYS 61 -0.391 8.324 -8.768
478 HZ2 LYS 61 HZ2 LYS 61 -0.968 8.895 -10.253
479 HZ3 LYS 61 HZ3 LYS 61 0.108 7.588 -10.208
480 H LYS 62 HN LYS 62 -2.752 3.264 -7.188
481 HA LYS 62 HA LYS 62 -4.582 3.763 -9.328
482 HB2 LYS 62 HB2 LYS 62 -2.692 2.238 -9.622
483 HB3 LYS 62 HB1 LYS 62 -3.341 1.171 -8.385
484 HG2 LYS 62 HG2 LYS 62 -5.192 0.579 -9.742
485 HG3 LYS 62 HG1 LYS 62 -4.818 1.840 -10.913
486 HD2 LYS 62 HD2 LYS 62 -4.176 -0.393 -11.719
487 HD3 LYS 62 HD1 LYS 62 -2.791 0.685 -11.568
488 HE2 LYS 62 HE2 LYS 62 -3.445 -1.053 -9.252
489 HE3 LYS 62 HE1 LYS 62 -2.756 -1.821 -10.679
490 HZ1 LYS 62 HZ1 LYS 62 -1.547 0.431 -9.163
491 HZ2 LYS 62 HZ2 LYS 62 -0.894 -0.271 -10.555
492 HZ3 LYS 62 HZ3 LYS 62 -1.031 -1.181 -9.137
493 H HIS 63 HN HIS 63 -4.873 2.556 -6.127
494 HA HIS 63 HA HIS 63 -7.395 1.247 -6.517
495 HB2 HIS 63 HB2 HIS 63 -5.741 1.968 -4.127
496 HB3 HIS 63 HB1 HIS 63 -7.429 1.511 -3.905
497 HD1 HIS 63 HD1 HIS 63 -7.626 -0.882 -3.344
498 HD2 HIS 63 HD2 HIS 63 -4.478 -0.161 -5.956
499 HE1 HIS 63 HE1 HIS 63 -6.612 -3.132 -3.812
500 HE2 HIS 63 HE2 HIS 63 -4.892 -2.693 -5.596
501 H TYR 64 HN TYR 64 -6.310 4.446 -5.817
502 HA TYR 64 HA TYR 64 -9.025 5.414 -6.158
503 HB2 TYR 64 HB2 TYR 64 -8.384 7.111 -4.205
504 HB3 TYR 64 HB1 TYR 64 -9.210 5.595 -3.888
505 HD1 TYR 64 HD1 TYR 64 -5.918 7.287 -3.793
506 HD2 TYR 64 HD2 TYR 64 -8.200 3.906 -2.582
507 HE1 TYR 64 HE1 TYR 64 -4.121 6.642 -2.246
508 HE2 TYR 64 HE2 TYR 64 -6.416 3.249 -1.031
509 HH TYR 64 HH TYR 64 -3.915 5.277 -0.129
510 H ASN 65 HN ASN 65 -8.172 6.014 -8.185
511 HA ASN 65 HA ASN 65 -5.891 7.730 -8.412
512 HB2 ASN 65 HB2 ASN 65 -7.966 6.820 -10.403
513 HB3 ASN 65 HB1 ASN 65 -6.666 7.926 -10.828
514 HD21 ASN 65 HD21 ASN 65 -4.563 7.172 -10.953
515 HD22 ASN 65 HD22 ASN 65 -4.196 5.476 -10.976
516 H TYR 66 HN TYR 66 -6.885 9.283 -6.805
517 HA TYR 66 HA TYR 66 -8.856 11.114 -7.810
518 HB2 TYR 66 HB2 TYR 66 -7.034 11.114 -5.414
519 HB3 TYR 66 HB1 TYR 66 -8.014 12.520 -5.816
520 HD1 TYR 66 HD1 TYR 66 -10.219 12.654 -5.095
521 HD2 TYR 66 HD2 TYR 66 -8.272 8.866 -5.091
522 HE1 TYR 66 HE1 TYR 66 -12.135 11.678 -3.906
523 HE2 TYR 66 HE2 TYR 66 -10.190 7.886 -3.898
524 HH TYR 66 HH TYR 66 -12.031 8.691 -2.390
525 H GLU 67 HN GLU 67 -7.149 10.959 -9.790
526 HA GLU 67 HA GLU 67 -5.422 13.344 -9.656
527 HB2 GLU 67 HB2 GLU 67 -5.424 11.128 -11.712
528 HB3 GLU 67 HB1 GLU 67 -4.249 12.427 -11.573
529 HG2 GLU 67 HG2 GLU 67 -3.343 11.524 -9.592
530 HG3 GLU 67 HG1 GLU 67 -4.690 10.401 -9.401
531 H GLN 68 HN GLN 68 -8.063 11.784 -11.280
532 HA GLN 68 HA GLN 68 -9.027 14.225 -12.390
533 HB2 GLN 68 HB2 GLN 68 -9.013 13.331 -14.773
534 HB3 GLN 68 HB1 GLN 68 -7.467 13.884 -14.143
535 HG2 GLN 68 HG2 GLN 68 -6.834 11.563 -13.681
536 HG3 GLN 68 HG1 GLN 68 -8.378 11.019 -14.333
537 HE21 GLN 68 HE21 GLN 68 -7.398 9.801 -15.924
538 HE22 GLN 68 HE22 GLN 68 -6.631 10.509 -17.300
539 HA PRO 69 HA PRO 69 -12.367 11.307 -11.542
540 HB2 PRO 69 HB2 PRO 69 -14.174 13.127 -10.750
541 HB3 PRO 69 HB1 PRO 69 -12.838 12.627 -9.707
542 HG2 PRO 69 HG2 PRO 69 -13.137 15.102 -11.349
543 HG3 PRO 69 HG1 PRO 69 -12.449 14.907 -9.728
544 HD2 PRO 69 HD2 PRO 69 -10.973 15.102 -12.058
545 HD3 PRO 69 HD1 PRO 69 -10.390 14.376 -10.547
546 H PHE 70 HN PHE 70 -12.051 11.338 -14.092
547 HA PHE 70 HA PHE 70 -14.155 12.827 -15.427
548 HB2 PHE 70 HB2 PHE 70 -13.249 11.889 -17.514
549 HB3 PHE 70 HB1 PHE 70 -12.008 12.686 -16.563
550 HD1 PHE 70 HD1 PHE 70 -10.583 11.087 -15.031
551 HD2 PHE 70 HD2 PHE 70 -12.835 9.823 -18.410
552 HE1 PHE 70 HE1 PHE 70 -9.177 9.079 -15.214
553 HE2 PHE 70 HE2 PHE 70 -11.434 7.809 -18.594
554 HZ PHE 70 HZ PHE 70 -9.604 7.437 -16.991
555 H LYS 71 HN LYS 71 -15.815 11.785 -14.173
556 HA LYS 71 HA LYS 71 -16.273 9.016 -14.160
557 HB2 LYS 71 HB2 LYS 71 -17.208 10.675 -12.555
558 HB3 LYS 71 HB1 LYS 71 -18.334 11.182 -13.808
559 HG2 LYS 71 HG2 LYS 71 -19.490 9.166 -13.761
560 HG3 LYS 71 HG1 LYS 71 -18.165 8.318 -12.960
561 HD2 LYS 71 HD2 LYS 71 -18.550 9.756 -10.973
562 HD3 LYS 71 HD1 LYS 71 -19.990 10.397 -11.769
563 HE2 LYS 71 HE2 LYS 71 -20.671 8.645 -10.277
564 HE3 LYS 71 HE1 LYS 71 -20.854 8.067 -11.933
565 HZ1 LYS 71 HZ1 LYS 71 -18.664 7.400 -10.046
566 HZ2 LYS 71 HZ2 LYS 71 -18.666 6.963 -11.675
567 HZ3 LYS 71 HZ3 LYS 71 -19.854 6.354 -10.638
568 H HIS 72 HN HIS 72 -16.819 11.317 -16.630
569 HA HIS 72 HA HIS 72 -19.025 10.074 -17.894
570 HB2 HIS 72 HB2 HIS 72 -18.373 11.391 -19.909
571 HB3 HIS 72 HB1 HIS 72 -18.554 12.356 -18.454
572 HD1 HIS 72 HD1 HIS 72 -16.495 13.596 -17.593
573 HD2 HIS 72 HD2 HIS 72 -15.733 11.216 -20.917
574 HE1 HIS 72 HE1 HIS 72 -14.213 14.274 -18.406
575 HE2 HIS 72 HE2 HIS 72 -13.759 12.808 -20.399
576 H ILE 73 HN ILE 73 -15.821 9.063 -17.585
577 HA ILE 73 HA ILE 73 -16.363 6.993 -19.613
578 HB ILE 73 HB ILE 73 -13.609 7.977 -18.835
579 HG12 ILE 73 HG12 ILE 73 -15.172 8.397 -21.394
580 HG13 ILE 73 HG11 ILE 73 -14.821 9.634 -20.191
581 HG21 ILE 73 HG21 ILE 73 -14.488 5.996 -20.937
582 HG22 ILE 73 HG22 ILE 73 -13.668 5.610 -19.424
583 HG23 ILE 73 HG23 ILE 73 -12.833 6.544 -20.665
584 HD11 ILE 73 HD11 ILE 73 -12.796 8.169 -21.865
585 HD12 ILE 73 HD12 ILE 73 -12.435 9.395 -20.652
586 HD13 ILE 73 HD13 ILE 73 -13.344 9.827 -22.098
587 H ASN 74 HN ASN 74 -17.327 5.668 -18.093
588 HA ASN 74 HA ASN 74 -15.471 4.385 -16.221
589 HB2 ASN 74 HB2 ASN 74 -16.770 5.891 -14.832
590 HB3 ASN 74 HB1 ASN 74 -18.271 5.328 -15.555
591 HD21 ASN 74 HD21 ASN 74 -19.164 4.660 -13.645
592 HD22 ASN 74 HD22 ASN 74 -18.589 3.287 -12.763
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 -6.316 16.186 -2.609
2 H2 MET 1 HT2 MET 1 -5.059 15.325 -1.876
3 H3 MET 1 HT3 MET 1 -6.386 14.500 -2.516
4 HA MET 1 HA MET 1 -5.801 15.160 -4.737
5 HB2 MET 1 HB2 MET 1 -4.722 17.321 -3.884
6 HB3 MET 1 HB1 MET 1 -3.300 16.351 -3.529
7 HG2 MET 1 HG2 MET 1 -2.992 17.429 -5.635
8 HG3 MET 1 HG1 MET 1 -3.202 15.701 -5.912
9 HE1 MET 1 HE1 MET 1 -4.850 17.469 -9.051
10 HE2 MET 1 HE2 MET 1 -3.564 16.393 -8.508
11 HE3 MET 1 HE3 MET 1 -3.497 18.111 -8.122
12 H ALA 2 HN ALA 2 -4.900 13.475 -5.801
13 HA ALA 2 HA ALA 2 -3.954 11.289 -4.290
14 HB1 ALA 2 HB1 ALA 2 -3.887 11.675 -7.279
15 HB2 ALA 2 HB2 ALA 2 -5.234 11.015 -6.353
16 HB3 ALA 2 HB3 ALA 2 -3.702 10.143 -6.425
17 H SER 3 HN SER 3 -2.295 13.712 -6.229
18 HA SER 3 HA SER 3 0.258 12.495 -6.152
19 HB2 SER 3 HB2 SER 3 1.041 14.888 -6.613
20 HB3 SER 3 HB1 SER 3 -0.085 14.192 -7.778
21 HG SER 3 HG SER 3 -0.551 16.391 -7.012
22 H ASP 4 HN ASP 4 -1.437 14.656 -3.979
23 HA ASP 4 HA ASP 4 0.743 15.057 -2.189
24 HB2 ASP 4 HB2 ASP 4 -1.083 16.628 -2.149
25 HB3 ASP 4 HB1 ASP 4 -2.251 15.343 -1.857
26 H MET 5 HN MET 5 -1.878 12.764 -2.464
27 HA MET 5 HA MET 5 -1.534 11.536 0.057
28 HB2 MET 5 HB2 MET 5 -3.612 11.453 -1.343
29 HB3 MET 5 HB1 MET 5 -2.788 10.317 -2.402
30 HG2 MET 5 HG2 MET 5 -4.238 9.167 -0.834
31 HG3 MET 5 HG1 MET 5 -2.548 8.751 -0.562
32 HE1 MET 5 HE1 MET 5 -4.900 8.172 1.530
33 HE2 MET 5 HE2 MET 5 -4.103 8.617 3.039
34 HE3 MET 5 HE3 MET 5 -3.216 7.725 1.802
35 H GLU 6 HN GLU 6 -0.225 10.787 -3.177
36 HA GLU 6 HA GLU 6 0.852 8.284 -2.527
37 HB2 GLU 6 HB2 GLU 6 2.307 8.510 -4.446
38 HB3 GLU 6 HB1 GLU 6 0.697 9.092 -4.839
39 HG2 GLU 6 HG2 GLU 6 1.443 11.381 -4.607
40 HG3 GLU 6 HG1 GLU 6 3.047 10.822 -4.131
41 H GLU 7 HN GLU 7 2.122 11.512 -2.080
42 HA GLU 7 HA GLU 7 4.712 10.880 -1.233
43 HB2 GLU 7 HB2 GLU 7 2.947 13.163 -0.342
44 HB3 GLU 7 HB1 GLU 7 4.695 13.095 -0.183
45 HG2 GLU 7 HG2 GLU 7 4.907 13.051 -2.612
46 HG3 GLU 7 HG1 GLU 7 3.152 13.113 -2.753
47 H LYS 8 HN LYS 8 1.650 10.970 0.480
48 HA LYS 8 HA LYS 8 2.681 10.762 3.105
49 HB2 LYS 8 HB2 LYS 8 -0.013 9.823 2.095
50 HB3 LYS 8 HB1 LYS 8 0.415 10.185 3.755
51 HG2 LYS 8 HG2 LYS 8 0.364 12.169 1.531
52 HG3 LYS 8 HG1 LYS 8 -0.888 11.959 2.749
53 HD2 LYS 8 HD2 LYS 8 0.626 12.593 4.495
54 HD3 LYS 8 HD1 LYS 8 1.980 12.629 3.370
55 HE2 LYS 8 HE2 LYS 8 -0.430 14.430 3.246
56 HE3 LYS 8 HE1 LYS 8 1.138 14.880 3.908
57 HZ1 LYS 8 HZ1 LYS 8 0.679 14.026 1.100
58 HZ2 LYS 8 HZ2 LYS 8 2.131 14.597 1.758
59 HZ3 LYS 8 HZ3 LYS 8 0.804 15.637 1.607
60 H PHE 9 HN PHE 9 1.856 8.392 0.648
61 HA PHE 9 HA PHE 9 2.166 6.126 2.362
62 HB2 PHE 9 HB2 PHE 9 2.251 6.360 -0.653
63 HB3 PHE 9 HB1 PHE 9 2.303 4.835 0.223
64 HD1 PHE 9 HD1 PHE 9 0.241 7.091 -1.415
65 HD2 PHE 9 HD2 PHE 9 0.319 4.516 1.950
66 HE1 PHE 9 HE1 PHE 9 -2.204 7.045 -1.418
67 HE2 PHE 9 HE2 PHE 9 -2.139 4.451 1.962
68 HZ PHE 9 HZ PHE 9 -3.409 5.718 0.274
69 H ARG 10 HN ARG 10 4.256 7.931 0.175
70 HA ARG 10 HA ARG 10 6.518 6.300 0.266
71 HB2 ARG 10 HB2 ARG 10 6.344 8.204 -1.261
72 HB3 ARG 10 HB1 ARG 10 6.366 9.317 0.102
73 HG2 ARG 10 HG2 ARG 10 8.636 8.564 0.659
74 HG3 ARG 10 HG1 ARG 10 8.608 7.496 -0.742
75 HD2 ARG 10 HD2 ARG 10 8.257 9.472 -2.185
76 HD3 ARG 10 HD1 ARG 10 8.425 10.493 -0.760
77 HE ARG 10 HE ARG 10 10.681 8.884 -0.855
78 HH11 ARG 10 HH11 ARG 10 9.193 11.410 -2.760
79 HH12 ARG 10 HH12 ARG 10 10.684 11.935 -3.468
80 HH21 ARG 10 HH21 ARG 10 12.653 9.576 -1.771
81 HH22 ARG 10 HH22 ARG 10 12.657 10.875 -2.922
82 H GLU 11 HN GLU 11 5.516 8.934 2.368
83 HA GLU 11 HA GLU 11 7.688 8.937 4.118
84 HB2 GLU 11 HB2 GLU 11 6.078 10.727 4.121
85 HB3 GLU 11 HB1 GLU 11 4.785 9.626 4.573
86 HG2 GLU 11 HG2 GLU 11 5.927 9.238 6.729
87 HG3 GLU 11 HG1 GLU 11 7.130 10.443 6.271
88 H ALA 12 HN ALA 12 4.677 7.094 4.201
89 HA ALA 12 HA ALA 12 5.155 5.850 6.697
90 HB1 ALA 12 HB1 ALA 12 2.922 5.998 5.743
91 HB2 ALA 12 HB2 ALA 12 3.354 4.321 6.067
92 HB3 ALA 12 HB3 ALA 12 3.404 4.942 4.418
93 H PHE 13 HN PHE 13 5.841 4.928 3.363
94 HA PHE 13 HA PHE 13 6.684 2.301 3.789
95 HB2 PHE 13 HB2 PHE 13 6.311 3.448 1.568
96 HB3 PHE 13 HB1 PHE 13 7.875 4.222 1.781
97 HD1 PHE 13 HD1 PHE 13 6.127 1.135 1.011
98 HD2 PHE 13 HD2 PHE 13 9.942 2.913 1.630
99 HE1 PHE 13 HE1 PHE 13 7.195 -0.809 -0.038
100 HE2 PHE 13 HE2 PHE 13 11.019 0.965 0.573
101 HZ PHE 13 HZ PHE 13 9.646 -0.898 -0.260
102 H ILE 14 HN ILE 14 8.438 5.358 3.995
103 HA ILE 14 HA ILE 14 10.996 4.313 4.453
104 HB ILE 14 HB ILE 14 9.847 6.907 5.494
105 HG12 ILE 14 HG12 ILE 14 11.446 6.335 2.985
106 HG13 ILE 14 HG11 ILE 14 9.717 6.659 3.027
107 HG21 ILE 14 HG21 ILE 14 11.880 6.207 6.665
108 HG22 ILE 14 HG22 ILE 14 12.169 7.633 5.665
109 HG23 ILE 14 HG23 ILE 14 12.713 6.046 5.119
110 HD11 ILE 14 HD11 ILE 14 10.156 8.898 3.890
111 HD12 ILE 14 HD12 ILE 14 10.968 8.624 2.348
112 HD13 ILE 14 HD13 ILE 14 11.890 8.573 3.850
113 H LEU 15 HN LEU 15 8.407 5.177 6.742
114 HA LEU 15 HA LEU 15 9.895 4.580 9.066
115 HB2 LEU 15 HB2 LEU 15 6.992 4.901 8.478
116 HB3 LEU 15 HB1 LEU 15 7.507 4.293 10.037
117 HG LEU 15 HG LEU 15 7.055 6.701 10.081
118 HD11 LEU 15 HD11 LEU 15 9.103 7.390 11.189
119 HD12 LEU 15 HD12 LEU 15 9.969 6.041 10.458
120 HD13 LEU 15 HD13 LEU 15 8.685 5.734 11.626
121 HD21 LEU 15 HD21 LEU 15 9.371 6.934 8.175
122 HD22 LEU 15 HD22 LEU 15 8.520 8.270 8.948
123 HD23 LEU 15 HD23 LEU 15 7.680 7.244 7.785
124 H PHE 16 HN PHE 16 7.567 2.650 7.204
125 HA PHE 16 HA PHE 16 7.683 0.452 9.008
126 HB2 PHE 16 HB2 PHE 16 6.535 0.821 6.265
127 HB3 PHE 16 HB1 PHE 16 6.569 -0.768 7.021
128 HD1 PHE 16 HD1 PHE 16 5.327 2.701 7.461
129 HD2 PHE 16 HD2 PHE 16 4.962 -1.383 8.600
130 HE1 PHE 16 HE1 PHE 16 3.249 3.227 8.669
131 HE2 PHE 16 HE2 PHE 16 2.881 -0.866 9.808
132 HZ PHE 16 HZ PHE 16 2.022 1.443 9.843
133 H SER 17 HN SER 17 9.385 1.209 5.998
134 HA SER 17 HA SER 17 10.695 -1.380 6.036
135 HB2 SER 17 HB2 SER 17 10.073 -0.134 3.910
136 HB3 SER 17 HB1 SER 17 11.377 0.991 4.287
137 HG SER 17 HG SER 17 11.783 -1.805 4.111
138 H SER 18 HN SER 18 11.216 1.809 7.211
139 HA SER 18 HA SER 18 12.609 2.583 8.801
140 HB2 SER 18 HB2 SER 18 13.776 -0.203 8.890
141 HB3 SER 18 HB1 SER 18 13.972 1.058 10.111
142 HG SER 18 HG SER 18 11.428 0.906 9.861
143 H CYS 19 HN CYS 19 14.675 0.277 7.011
144 HA CYS 19 HA CYS 19 16.201 2.467 5.888
145 HB2 CYS 19 HB2 CYS 19 17.178 2.148 8.163
146 HB3 CYS 19 HB1 CYS 19 17.546 0.481 7.740
147 HG CYS 19 HG CYS 19 19.183 1.399 5.512
148 H SER 20 HN SER 20 14.559 0.315 4.918
149 HA SER 20 HA SER 20 16.558 -1.230 3.410
150 HB2 SER 20 HB2 SER 20 13.733 -2.039 4.139
151 HB3 SER 20 HB1 SER 20 14.885 -3.012 3.223
152 HG SER 20 HG SER 20 16.258 -2.927 5.099
153 H ASP 21 HN ASP 21 15.953 -1.762 1.204
154 HA ASP 21 HA ASP 21 14.664 0.531 -0.053
155 HB2 ASP 21 HB2 ASP 21 16.901 -0.254 -0.825
156 HB3 ASP 21 HB1 ASP 21 16.160 -1.767 -1.333
157 H HIS 22 HN HIS 22 14.346 -2.968 0.155
158 HA HIS 22 HA HIS 22 11.751 -2.751 -1.226
159 HB2 HIS 22 HB2 HIS 22 13.537 -5.172 -0.897
160 HB3 HIS 22 HB1 HIS 22 11.964 -5.176 -1.686
161 HD1 HIS 22 HD1 HIS 22 15.034 -5.677 -2.836
162 HD2 HIS 22 HD2 HIS 22 12.414 -2.549 -3.609
163 HE1 HIS 22 HE1 HIS 22 15.752 -4.726 -5.047
164 HE2 HIS 22 HE2 HIS 22 14.289 -2.704 -5.377
165 H ILE 23 HN ILE 23 9.935 -3.718 -0.285
166 HA ILE 23 HA ILE 23 10.271 -4.223 2.583
167 HB ILE 23 HB ILE 23 8.783 -2.365 2.040
168 HG12 ILE 23 HG12 ILE 23 7.194 -4.682 3.137
169 HG13 ILE 23 HG11 ILE 23 8.441 -3.837 4.050
170 HG21 ILE 23 HG21 ILE 23 6.582 -2.774 0.990
171 HG22 ILE 23 HG22 ILE 23 7.080 -4.431 0.650
172 HG23 ILE 23 HG23 ILE 23 7.925 -3.086 -0.113
173 HD11 ILE 23 HD11 ILE 23 6.211 -3.056 4.623
174 HD12 ILE 23 HD12 ILE 23 5.934 -2.600 2.942
175 HD13 ILE 23 HD13 ILE 23 7.171 -1.773 3.889
176 H GLU 24 HN GLU 24 10.004 -6.143 3.381
177 HA GLU 24 HA GLU 24 9.334 -8.451 1.994
178 HB2 GLU 24 HB2 GLU 24 9.172 -7.733 4.916
179 HB3 GLU 24 HB1 GLU 24 8.857 -9.354 4.314
180 HG2 GLU 24 HG2 GLU 24 11.090 -9.227 5.122
181 HG3 GLU 24 HG1 GLU 24 11.112 -9.419 3.379
182 H MET 25 HN MET 25 7.457 -9.539 1.660
183 HA MET 25 HA MET 25 5.132 -7.979 1.410
184 HB2 MET 25 HB2 MET 25 5.527 -10.959 1.177
185 HB3 MET 25 HB1 MET 25 4.017 -10.138 0.801
186 HG2 MET 25 HG2 MET 25 5.163 -8.823 -0.915
187 HG3 MET 25 HG1 MET 25 6.668 -9.656 -0.546
188 HE1 MET 25 HE1 MET 25 2.973 -11.586 -2.514
189 HE2 MET 25 HE2 MET 25 3.149 -9.861 -2.190
190 HE3 MET 25 HE3 MET 25 2.961 -10.995 -0.853
191 H TYR 26 HN TYR 26 6.213 -10.132 3.983
192 HA TYR 26 HA TYR 26 3.670 -10.297 5.238
193 HB2 TYR 26 HB2 TYR 26 4.834 -11.193 7.137
194 HB3 TYR 26 HB1 TYR 26 5.538 -11.877 5.693
195 HD1 TYR 26 HD1 TYR 26 7.856 -11.747 5.329
196 HD2 TYR 26 HD2 TYR 26 6.081 -9.290 8.315
197 HE1 TYR 26 HE1 TYR 26 10.092 -11.114 6.133
198 HE2 TYR 26 HE2 TYR 26 8.309 -8.645 9.118
199 HH TYR 26 HH TYR 26 11.202 -9.441 7.386
200 H LYS 27 HN LYS 27 6.253 -7.976 5.260
201 HA LYS 27 HA LYS 27 5.281 -6.491 7.516
202 HB2 LYS 27 HB2 LYS 27 7.676 -6.818 6.908
203 HB3 LYS 27 HB1 LYS 27 7.395 -5.891 5.446
204 HG2 LYS 27 HG2 LYS 27 8.392 -4.445 6.972
205 HG3 LYS 27 HG1 LYS 27 6.689 -4.010 6.900
206 HD2 LYS 27 HD2 LYS 27 6.238 -4.963 8.997
207 HD3 LYS 27 HD1 LYS 27 7.748 -5.878 8.997
208 HE2 LYS 27 HE2 LYS 27 7.580 -2.870 9.109
209 HE3 LYS 27 HE1 LYS 27 7.747 -3.909 10.524
210 HZ1 LYS 27 HZ1 LYS 27 9.675 -3.823 8.266
211 HZ2 LYS 27 HZ2 LYS 27 9.844 -4.697 9.704
212 HZ3 LYS 27 HZ3 LYS 27 9.875 -3.006 9.732
213 H PHE 28 HN PHE 28 5.043 -6.574 4.106
214 HA PHE 28 HA PHE 28 4.377 -3.983 3.421
215 HB2 PHE 28 HB2 PHE 28 4.811 -5.655 1.743
216 HB3 PHE 28 HB1 PHE 28 3.426 -6.605 2.267
217 HD1 PHE 28 HD1 PHE 28 1.227 -6.107 1.506
218 HD2 PHE 28 HD2 PHE 28 4.474 -3.513 0.593
219 HE1 PHE 28 HE1 PHE 28 -0.180 -4.938 -0.114
220 HE2 PHE 28 HE2 PHE 28 3.079 -2.327 -1.034
221 HZ PHE 28 HZ PHE 28 0.722 -3.040 -1.394
222 H PHE 29 HN PHE 29 2.263 -6.563 4.626
223 HA PHE 29 HA PHE 29 -0.134 -5.271 3.952
224 HB2 PHE 29 HB2 PHE 29 0.280 -7.744 4.598
225 HB3 PHE 29 HB1 PHE 29 0.017 -7.190 6.248
226 HD1 PHE 29 HD1 PHE 29 -2.147 -6.624 7.030
227 HD2 PHE 29 HD2 PHE 29 -1.540 -7.556 2.909
228 HE1 PHE 29 HE1 PHE 29 -4.579 -6.756 6.702
229 HE2 PHE 29 HE2 PHE 29 -3.971 -7.690 2.585
230 HZ PHE 29 HZ PHE 29 -5.492 -7.288 4.481
231 H GLU 30 HN GLU 30 1.745 -5.171 6.983
232 HA GLU 30 HA GLU 30 -0.212 -3.677 8.392
233 HB2 GLU 30 HB2 GLU 30 1.611 -3.111 9.973
234 HB3 GLU 30 HB1 GLU 30 1.440 -4.831 9.672
235 HG2 GLU 30 HG2 GLU 30 3.353 -4.776 8.179
236 HG3 GLU 30 HG1 GLU 30 3.511 -3.039 8.436
237 H LEU 31 HN LEU 31 2.371 -2.830 6.243
238 HA LEU 31 HA LEU 31 2.447 -0.061 6.671
239 HB2 LEU 31 HB2 LEU 31 4.222 -0.998 5.456
240 HB3 LEU 31 HB1 LEU 31 3.143 -1.843 4.366
241 HG LEU 31 HG LEU 31 2.476 0.452 3.477
242 HD11 LEU 31 HD11 LEU 31 4.988 1.244 4.934
243 HD12 LEU 31 HD12 LEU 31 3.353 1.794 5.303
244 HD13 LEU 31 HD13 LEU 31 4.109 2.236 3.771
245 HD21 LEU 31 HD21 LEU 31 3.894 -1.121 2.262
246 HD22 LEU 31 HD22 LEU 31 5.314 -0.480 3.088
247 HD23 LEU 31 HD23 LEU 31 4.394 0.547 1.990
248 H MET 32 HN MET 32 0.304 -2.050 4.761
249 HA MET 32 HA MET 32 -0.780 0.356 3.507
250 HB2 MET 32 HB2 MET 32 -1.863 -1.336 1.923
251 HB3 MET 32 HB1 MET 32 -0.123 -1.110 1.828
252 HG2 MET 32 HG2 MET 32 -0.271 -3.382 1.751
253 HG3 MET 32 HG1 MET 32 -0.054 -3.122 3.479
254 HE1 MET 32 HE1 MET 32 -3.871 -4.418 1.320
255 HE2 MET 32 HE2 MET 32 -2.254 -4.247 0.623
256 HE3 MET 32 HE3 MET 32 -3.188 -2.813 1.057
257 H ASN 33 HN ASN 33 -1.817 -2.321 5.537
258 HA ASN 33 HA ASN 33 -4.591 -1.809 5.193
259 HB2 ASN 33 HB2 ASN 33 -5.012 -3.401 6.814
260 HB3 ASN 33 HB1 ASN 33 -3.424 -3.904 6.257
261 HD21 ASN 33 HD21 ASN 33 -1.670 -3.654 7.592
262 HD22 ASN 33 HD22 ASN 33 -1.823 -3.304 9.283
263 H SER 34 HN SER 34 -2.109 -0.266 6.955
264 HA SER 34 HA SER 34 -3.581 0.818 9.104
265 HB2 SER 34 HB2 SER 34 -1.682 2.527 9.111
266 HB3 SER 34 HB1 SER 34 -1.207 0.834 9.257
267 HG SER 34 HG SER 34 0.029 1.300 7.617
268 H PHE 35 HN PHE 35 -3.131 1.828 5.786
269 HA PHE 35 HA PHE 35 -4.445 4.377 6.184
270 HB2 PHE 35 HB2 PHE 35 -3.459 2.955 3.710
271 HB3 PHE 35 HB1 PHE 35 -4.247 4.528 3.676
272 HD1 PHE 35 HD1 PHE 35 -3.129 6.495 4.533
273 HD2 PHE 35 HD2 PHE 35 -1.218 2.694 4.545
274 HE1 PHE 35 HE1 PHE 35 -0.960 7.592 4.905
275 HE2 PHE 35 HE2 PHE 35 0.955 3.783 4.920
276 HZ PHE 35 HZ PHE 35 1.084 6.236 5.098
277 H GLY 36 HN GLY 36 -5.546 1.305 6.065
278 HA2 GLY 36 HA2 GLY 36 -7.790 0.647 6.020
279 HA3 GLY 36 HA1 GLY 36 -8.201 2.170 5.245
280 H ILE 37 HN ILE 37 -5.540 0.633 3.837
281 HA ILE 37 HA ILE 37 -7.029 0.083 1.436
282 HB ILE 37 HB ILE 37 -4.114 -0.422 2.073
283 HG12 ILE 37 HG12 ILE 37 -5.406 1.839 0.531
284 HG13 ILE 37 HG11 ILE 37 -4.806 1.963 2.182
285 HG21 ILE 37 HG21 ILE 37 -3.808 -0.586 -0.344
286 HG22 ILE 37 HG22 ILE 37 -5.544 -0.394 -0.582
287 HG23 ILE 37 HG23 ILE 37 -4.919 -1.823 0.242
288 HD11 ILE 37 HD11 ILE 37 -2.553 1.514 1.413
289 HD12 ILE 37 HD12 ILE 37 -3.242 2.895 0.561
290 HD13 ILE 37 HD13 ILE 37 -3.137 1.327 -0.239
291 H ILE 38 HN ILE 38 -7.746 -1.827 0.740
292 HA ILE 38 HA ILE 38 -7.035 -4.219 2.297
293 HB ILE 38 HB ILE 38 -9.206 -5.172 1.435
294 HG12 ILE 38 HG12 ILE 38 -9.802 -2.264 0.870
295 HG13 ILE 38 HG11 ILE 38 -9.525 -3.487 -0.364
296 HG21 ILE 38 HG21 ILE 38 -10.539 -4.064 3.172
297 HG22 ILE 38 HG22 ILE 38 -9.305 -2.810 3.297
298 HG23 ILE 38 HG23 ILE 38 -8.914 -4.476 3.725
299 HD11 ILE 38 HD11 ILE 38 -11.774 -3.465 1.632
300 HD12 ILE 38 HD12 ILE 38 -11.491 -4.708 0.414
301 HD13 ILE 38 HD13 ILE 38 -11.887 -3.064 -0.081
302 H LEU 39 HN LEU 39 -6.762 -6.171 1.189
303 HA LEU 39 HA LEU 39 -6.298 -5.876 -1.696
304 HB2 LEU 39 HB2 LEU 39 -4.603 -6.954 0.453
305 HB3 LEU 39 HB1 LEU 39 -4.649 -7.890 -1.015
306 HG LEU 39 HG LEU 39 -3.940 -4.966 -0.912
307 HD11 LEU 39 HD11 LEU 39 -2.066 -7.297 -1.258
308 HD12 LEU 39 HD12 LEU 39 -2.306 -6.459 0.273
309 HD13 LEU 39 HD13 LEU 39 -1.651 -5.593 -1.117
310 HD21 LEU 39 HD21 LEU 39 -3.184 -5.282 -3.160
311 HD22 LEU 39 HD22 LEU 39 -4.859 -5.816 -3.044
312 HD23 LEU 39 HD23 LEU 39 -3.553 -7.003 -3.085
313 H THR 40 HN THR 40 -6.923 -7.512 -2.995
314 HA THR 40 HA THR 40 -8.652 -9.533 -1.814
315 HB THR 40 HB THR 40 -9.071 -10.154 -4.253
316 HG1 THR 40 HG1 THR 40 -8.040 -7.570 -4.819
317 HG21 THR 40 HG21 THR 40 -10.618 -8.279 -4.586
318 HG22 THR 40 HG22 THR 40 -9.806 -7.391 -3.296
319 HG23 THR 40 HG23 THR 40 -10.662 -8.891 -2.933
320 H ASN 41 HN ASN 41 -8.483 -11.779 -2.801
321 HA ASN 41 HA ASN 41 -5.998 -12.867 -2.080
322 HB2 ASN 41 HB2 ASN 41 -8.219 -14.059 -3.751
323 HB3 ASN 41 HB1 ASN 41 -6.815 -14.966 -3.205
324 HD21 ASN 41 HD21 ASN 41 -9.860 -13.638 -2.343
325 HD22 ASN 41 HD22 ASN 41 -9.907 -14.241 -0.724
326 H ASP 42 HN ASP 42 -7.385 -12.222 -5.263
327 HA ASP 42 HA ASP 42 -5.267 -13.253 -6.794
328 HB2 ASP 42 HB2 ASP 42 -7.448 -12.832 -7.778
329 HB3 ASP 42 HB1 ASP 42 -7.285 -11.105 -7.472
330 H GLU 43 HN GLU 43 -5.921 -9.953 -5.658
331 HA GLU 43 HA GLU 43 -3.811 -8.721 -7.036
332 HB2 GLU 43 HB2 GLU 43 -5.310 -7.934 -4.551
333 HB3 GLU 43 HB1 GLU 43 -4.040 -6.931 -5.238
334 HG2 GLU 43 HG2 GLU 43 -5.294 -6.780 -7.330
335 HG3 GLU 43 HG1 GLU 43 -6.572 -7.772 -6.627
336 H LYS 44 HN LYS 44 -3.941 -9.974 -3.704
337 HA LYS 44 HA LYS 44 -1.390 -9.203 -2.904
338 HB2 LYS 44 HB2 LYS 44 -2.911 -11.684 -2.091
339 HB3 LYS 44 HB1 LYS 44 -1.507 -11.038 -1.254
340 HG2 LYS 44 HG2 LYS 44 -2.830 -8.914 -0.933
341 HG3 LYS 44 HG1 LYS 44 -4.233 -9.821 -1.508
342 HD2 LYS 44 HD2 LYS 44 -4.245 -9.862 0.881
343 HD3 LYS 44 HD1 LYS 44 -3.772 -11.471 0.327
344 HE2 LYS 44 HE2 LYS 44 -2.411 -10.522 2.233
345 HE3 LYS 44 HE1 LYS 44 -1.490 -11.077 0.834
346 HZ1 LYS 44 HZ1 LYS 44 -1.265 -8.812 0.084
347 HZ2 LYS 44 HZ2 LYS 44 -0.729 -8.918 1.682
348 HZ3 LYS 44 HZ3 LYS 44 -2.242 -8.246 1.344
349 H ALA 45 HN ALA 45 -2.427 -12.139 -4.578
350 HA ALA 45 HA ALA 45 0.185 -13.294 -4.648
351 HB1 ALA 45 HB1 ALA 45 -2.237 -13.930 -6.333
352 HB2 ALA 45 HB2 ALA 45 -1.853 -14.654 -4.770
353 HB3 ALA 45 HB3 ALA 45 -0.797 -14.932 -6.154
354 H ALA 46 HN ALA 46 -1.384 -10.856 -6.420
355 HA ALA 46 HA ALA 46 0.182 -11.259 -8.843
356 HB1 ALA 46 HB1 ALA 46 -1.093 -9.410 -9.760
357 HB2 ALA 46 HB2 ALA 46 -1.804 -9.091 -8.179
358 HB3 ALA 46 HB3 ALA 46 -2.173 -10.593 -9.024
359 H LEU 47 HN LEU 47 0.621 -9.744 -5.889
360 HA LEU 47 HA LEU 47 2.076 -7.447 -6.817
361 HB2 LEU 47 HB2 LEU 47 2.324 -8.726 -4.098
362 HB3 LEU 47 HB1 LEU 47 2.704 -7.078 -4.538
363 HG LEU 47 HG LEU 47 0.008 -8.325 -4.112
364 HD11 LEU 47 HD11 LEU 47 1.197 -7.401 -2.187
365 HD12 LEU 47 HD12 LEU 47 -0.255 -6.477 -2.563
366 HD13 LEU 47 HD13 LEU 47 1.333 -5.849 -3.017
367 HD21 LEU 47 HD21 LEU 47 0.479 -5.608 -5.323
368 HD22 LEU 47 HD22 LEU 47 -1.071 -6.378 -4.971
369 HD23 LEU 47 HD23 LEU 47 -0.029 -7.028 -6.236
370 HA PRO 48 HA PRO 48 6.025 -9.402 -7.617
371 HB2 PRO 48 HB2 PRO 48 7.162 -6.937 -6.418
372 HB3 PRO 48 HB1 PRO 48 7.458 -7.652 -8.005
373 HG2 PRO 48 HG2 PRO 48 5.985 -5.439 -7.740
374 HG3 PRO 48 HG1 PRO 48 5.583 -6.679 -8.944
375 HD2 PRO 48 HD2 PRO 48 4.305 -6.109 -6.304
376 HD3 PRO 48 HD1 PRO 48 3.560 -6.606 -7.837
377 H ASN 49 HN ASN 49 7.403 -10.622 -6.410
378 HA ASN 49 HA ASN 49 6.833 -11.029 -3.674
379 HB2 ASN 49 HB2 ASN 49 9.073 -12.011 -5.442
380 HB3 ASN 49 HB1 ASN 49 8.952 -12.460 -3.745
381 HD21 ASN 49 HD21 ASN 49 7.631 -12.865 -6.917
382 HD22 ASN 49 HD22 ASN 49 6.564 -14.168 -6.528
383 H ASP 50 HN ASP 50 9.174 -9.077 -5.345
384 HA ASP 50 HA ASP 50 10.032 -8.028 -2.727
385 HB2 ASP 50 HB2 ASP 50 11.428 -7.782 -5.410
386 HB3 ASP 50 HB1 ASP 50 12.000 -7.098 -3.894
387 H ILE 51 HN ILE 51 9.022 -6.185 -2.228
388 HA ILE 51 HA ILE 51 7.857 -4.620 -4.423
389 HB ILE 51 HB ILE 51 7.094 -4.652 -1.498
390 HG12 ILE 51 HG12 ILE 51 5.684 -5.780 -3.927
391 HG13 ILE 51 HG11 ILE 51 6.535 -6.729 -2.715
392 HG21 ILE 51 HG21 ILE 51 6.676 -2.479 -2.512
393 HG22 ILE 51 HG22 ILE 51 5.156 -3.320 -2.206
394 HG23 ILE 51 HG23 ILE 51 5.812 -3.250 -3.842
395 HD11 ILE 51 HD11 ILE 51 4.083 -5.053 -2.246
396 HD12 ILE 51 HD12 ILE 51 4.932 -6.001 -1.026
397 HD13 ILE 51 HD13 ILE 51 4.138 -6.810 -2.378
398 H ASN 52 HN ASN 52 8.547 -2.624 -4.832
399 HA ASN 52 HA ASN 52 10.427 -1.391 -2.932
400 HB2 ASN 52 HB2 ASN 52 11.350 -1.919 -5.176
401 HB3 ASN 52 HB1 ASN 52 10.116 -0.907 -5.906
402 HD21 ASN 52 HD21 ASN 52 11.536 0.487 -6.848
403 HD22 ASN 52 HD22 ASN 52 12.497 1.603 -5.937
404 H MET 53 HN MET 53 10.405 1.113 -3.115
405 HA MET 53 HA MET 53 7.960 2.168 -2.314
406 HB2 MET 53 HB2 MET 53 10.134 3.248 -1.914
407 HB3 MET 53 HB1 MET 53 10.275 3.594 -3.634
408 HG2 MET 53 HG2 MET 53 9.489 5.592 -2.878
409 HG3 MET 53 HG1 MET 53 7.983 4.765 -3.269
410 HE1 MET 53 HE1 MET 53 10.410 4.293 -0.168
411 HE2 MET 53 HE2 MET 53 9.641 5.391 0.981
412 HE3 MET 53 HE3 MET 53 10.371 6.025 -0.494
413 H ASP 54 HN ASP 54 9.413 1.934 -5.495
414 HA ASP 54 HA ASP 54 7.769 3.657 -6.920
415 HB2 ASP 54 HB2 ASP 54 9.826 2.641 -7.823
416 HB3 ASP 54 HB1 ASP 54 9.009 1.083 -7.900
417 H TYR 55 HN TYR 55 7.360 0.137 -6.400
418 HA TYR 55 HA TYR 55 4.855 0.092 -7.753
419 HB2 TYR 55 HB2 TYR 55 6.230 -1.970 -7.458
420 HB3 TYR 55 HB1 TYR 55 5.858 -1.934 -5.735
421 HD1 TYR 55 HD1 TYR 55 4.177 -1.979 -9.058
422 HD2 TYR 55 HD2 TYR 55 3.965 -3.084 -4.948
423 HE1 TYR 55 HE1 TYR 55 2.079 -3.182 -9.488
424 HE2 TYR 55 HE2 TYR 55 1.880 -4.281 -5.376
425 HH TYR 55 HH TYR 55 0.772 -5.037 -8.473
426 H TRP 56 HN TRP 56 5.836 0.589 -4.427
427 HA TRP 56 HA TRP 56 3.421 0.172 -3.138
428 HB2 TRP 56 HB2 TRP 56 5.464 0.450 -1.905
429 HB3 TRP 56 HB1 TRP 56 5.683 2.075 -2.532
430 HD1 TRP 56 HD1 TRP 56 5.537 3.519 -0.427
431 HE1 TRP 56 HE1 TRP 56 3.797 3.878 1.430
432 HE3 TRP 56 HE3 TRP 56 2.292 -0.224 -1.644
433 HZ2 TRP 56 HZ2 TRP 56 1.351 2.736 2.255
434 HZ3 TRP 56 HZ3 TRP 56 0.264 -0.519 -0.277
435 HH2 TRP 56 HH2 TRP 56 -0.193 0.933 1.630
436 H LEU 57 HN LEU 57 4.707 3.201 -4.483
437 HA LEU 57 HA LEU 57 2.494 4.810 -3.806
438 HB2 LEU 57 HB2 LEU 57 4.298 5.171 -6.196
439 HB3 LEU 57 HB1 LEU 57 3.371 6.412 -5.374
440 HG LEU 57 HG LEU 57 5.687 4.897 -4.181
441 HD11 LEU 57 HD11 LEU 57 5.519 7.718 -5.228
442 HD12 LEU 57 HD12 LEU 57 6.412 6.385 -5.958
443 HD13 LEU 57 HD13 LEU 57 6.900 7.016 -4.386
444 HD21 LEU 57 HD21 LEU 57 5.550 6.539 -2.374
445 HD22 LEU 57 HD22 LEU 57 4.053 5.616 -2.506
446 HD23 LEU 57 HD23 LEU 57 4.131 7.265 -3.131
447 H ASN 58 HN ASN 58 3.302 3.059 -6.735
448 HA ASN 58 HA ASN 58 1.101 3.835 -8.310
449 HB2 ASN 58 HB2 ASN 58 3.264 2.786 -9.107
450 HB3 ASN 58 HB1 ASN 58 2.660 1.248 -8.512
451 HD21 ASN 58 HD21 ASN 58 3.390 2.142 -11.204
452 HD22 ASN 58 HD22 ASN 58 2.002 1.852 -12.192
453 H PHE 59 HN PHE 59 1.695 1.083 -6.212
454 HA PHE 59 HA PHE 59 -0.671 -0.350 -6.648
455 HB2 PHE 59 HB2 PHE 59 1.160 -1.381 -5.515
456 HB3 PHE 59 HB1 PHE 59 1.206 -0.122 -4.294
457 HD1 PHE 59 HD1 PHE 59 -0.611 -0.022 -2.577
458 HD2 PHE 59 HD2 PHE 59 -0.179 -3.283 -5.273
459 HE1 PHE 59 HE1 PHE 59 -1.972 -1.425 -1.088
460 HE2 PHE 59 HE2 PHE 59 -1.542 -4.686 -3.796
461 HZ PHE 59 HZ PHE 59 -2.445 -3.759 -1.699
462 H ALA 60 HN ALA 60 0.154 2.169 -4.308
463 HA ALA 60 HA ALA 60 -2.318 2.006 -2.906
464 HB1 ALA 60 HB1 ALA 60 -1.603 4.054 -1.799
465 HB2 ALA 60 HB2 ALA 60 -0.322 4.263 -2.994
466 HB3 ALA 60 HB3 ALA 60 -0.280 2.891 -1.887
467 H LYS 61 HN LYS 61 -1.088 4.150 -5.435
468 HA LYS 61 HA LYS 61 -3.368 5.823 -5.494
469 HB2 LYS 61 HB2 LYS 61 -2.410 6.827 -7.434
470 HB3 LYS 61 HB1 LYS 61 -1.166 6.558 -6.222
471 HG2 LYS 61 HG2 LYS 61 -0.030 5.714 -7.907
472 HG3 LYS 61 HG1 LYS 61 -1.002 4.276 -7.644
473 HD2 LYS 61 HD2 LYS 61 -1.338 4.587 -9.892
474 HD3 LYS 61 HD1 LYS 61 -2.691 5.493 -9.205
475 HE2 LYS 61 HE2 LYS 61 -0.058 6.702 -10.052
476 HE3 LYS 61 HE1 LYS 61 -1.518 6.699 -11.034
477 HZ1 LYS 61 HZ1 LYS 61 -1.137 8.051 -8.418
478 HZ2 LYS 61 HZ2 LYS 61 -2.620 7.943 -9.223
479 HZ3 LYS 61 HZ3 LYS 61 -1.339 8.784 -9.927
480 H LYS 62 HN LYS 62 -2.615 2.802 -6.889
481 HA LYS 62 HA LYS 62 -4.552 2.834 -8.977
482 HB2 LYS 62 HB2 LYS 62 -2.665 1.354 -9.137
483 HB3 LYS 62 HB1 LYS 62 -3.046 0.618 -7.590
484 HG2 LYS 62 HG2 LYS 62 -5.044 -0.387 -8.536
485 HG3 LYS 62 HG1 LYS 62 -4.715 0.391 -10.084
486 HD2 LYS 62 HD2 LYS 62 -3.993 -1.950 -10.086
487 HD3 LYS 62 HD1 LYS 62 -2.628 -0.852 -10.283
488 HE2 LYS 62 HE2 LYS 62 -2.091 -1.097 -7.907
489 HE3 LYS 62 HE1 LYS 62 -3.461 -2.185 -7.706
490 HZ1 LYS 62 HZ1 LYS 62 -2.413 -3.735 -9.226
491 HZ2 LYS 62 HZ2 LYS 62 -1.369 -3.390 -7.943
492 HZ3 LYS 62 HZ3 LYS 62 -1.112 -2.681 -9.457
493 H HIS 63 HN HIS 63 -4.568 1.904 -5.605
494 HA HIS 63 HA HIS 63 -7.034 0.489 -5.701
495 HB2 HIS 63 HB2 HIS 63 -5.323 1.545 -3.485
496 HB3 HIS 63 HB1 HIS 63 -6.957 0.981 -3.133
497 HD1 HIS 63 HD1 HIS 63 -6.940 -1.371 -2.375
498 HD2 HIS 63 HD2 HIS 63 -3.980 -0.623 -5.189
499 HE1 HIS 63 HE1 HIS 63 -5.760 -3.562 -2.704
500 HE2 HIS 63 HE2 HIS 63 -4.134 -3.132 -4.579
501 H TYR 64 HN TYR 64 -6.197 3.851 -5.306
502 HA TYR 64 HA TYR 64 -9.083 4.379 -5.111
503 HB2 TYR 64 HB2 TYR 64 -8.528 6.600 -4.128
504 HB3 TYR 64 HB1 TYR 64 -8.102 5.236 -3.113
505 HD1 TYR 64 HD1 TYR 64 -6.656 7.734 -5.468
506 HD2 TYR 64 HD2 TYR 64 -5.943 5.022 -2.272
507 HE1 TYR 64 HE1 TYR 64 -4.396 8.657 -5.198
508 HE2 TYR 64 HE2 TYR 64 -3.686 5.933 -1.997
509 HH TYR 64 HH TYR 64 -1.999 7.143 -3.374
510 H ASN 65 HN ASN 65 -7.708 3.829 -7.505
511 HA ASN 65 HA ASN 65 -7.607 6.389 -8.889
512 HB2 ASN 65 HB2 ASN 65 -5.984 4.553 -9.438
513 HB3 ASN 65 HB1 ASN 65 -7.333 3.602 -10.047
514 HD21 ASN 65 HD21 ASN 65 -8.212 4.089 -12.021
515 HD22 ASN 65 HD22 ASN 65 -7.510 5.232 -13.112
516 H TYR 66 HN TYR 66 -9.868 6.723 -8.177
517 HA TYR 66 HA TYR 66 -11.771 5.423 -10.010
518 HB2 TYR 66 HB2 TYR 66 -13.508 5.742 -8.305
519 HB3 TYR 66 HB1 TYR 66 -12.182 4.778 -7.673
520 HD1 TYR 66 HD1 TYR 66 -10.387 6.083 -6.277
521 HD2 TYR 66 HD2 TYR 66 -14.295 7.547 -7.089
522 HE1 TYR 66 HE1 TYR 66 -10.212 7.615 -4.362
523 HE2 TYR 66 HE2 TYR 66 -14.123 9.086 -5.178
524 HH TYR 66 HH TYR 66 -11.195 9.763 -3.636
525 H GLU 67 HN GLU 67 -13.576 6.783 -10.706
526 HA GLU 67 HA GLU 67 -12.549 9.406 -11.420
527 HB2 GLU 67 HB2 GLU 67 -15.041 7.954 -12.284
528 HB3 GLU 67 HB1 GLU 67 -14.462 9.466 -12.973
529 HG2 GLU 67 HG2 GLU 67 -13.111 6.779 -13.096
530 HG3 GLU 67 HG1 GLU 67 -13.863 7.658 -14.426
531 H GLN 68 HN GLN 68 -14.154 8.291 -8.902
532 HA GLN 68 HA GLN 68 -15.106 9.309 -7.112
533 HB2 GLN 68 HB2 GLN 68 -13.697 11.316 -8.061
534 HB3 GLN 68 HB1 GLN 68 -15.270 11.946 -8.517
535 HG2 GLN 68 HG2 GLN 68 -14.514 11.150 -5.713
536 HG3 GLN 68 HG1 GLN 68 -14.400 12.787 -6.346
537 HE21 GLN 68 HE21 GLN 68 -16.529 10.281 -5.243
538 HE22 GLN 68 HE22 GLN 68 -17.960 11.243 -5.175
539 HA PRO 69 HA PRO 69 -19.234 9.243 -9.087
540 HB2 PRO 69 HB2 PRO 69 -19.962 6.739 -8.532
541 HB3 PRO 69 HB1 PRO 69 -18.889 7.080 -9.895
542 HG2 PRO 69 HG2 PRO 69 -18.248 5.961 -7.212
543 HG3 PRO 69 HG1 PRO 69 -17.517 5.601 -8.785
544 HD2 PRO 69 HD2 PRO 69 -16.503 7.351 -6.819
545 HD3 PRO 69 HD1 PRO 69 -15.938 7.202 -8.494
546 H PHE 70 HN PHE 70 -21.302 9.072 -7.964
547 HA PHE 70 HA PHE 70 -21.057 9.659 -5.140
548 HB2 PHE 70 HB2 PHE 70 -23.425 9.640 -7.021
549 HB3 PHE 70 HB1 PHE 70 -23.555 10.005 -5.304
550 HD1 PHE 70 HD1 PHE 70 -22.103 11.151 -8.499
551 HD2 PHE 70 HD2 PHE 70 -22.969 12.117 -4.448
552 HE1 PHE 70 HE1 PHE 70 -21.558 13.510 -8.947
553 HE2 PHE 70 HE2 PHE 70 -22.428 14.476 -4.886
554 HZ PHE 70 HZ PHE 70 -21.722 15.174 -7.139
555 H LYS 71 HN LYS 71 -20.183 7.209 -5.433
556 HA LYS 71 HA LYS 71 -22.248 5.210 -5.247
557 HB2 LYS 71 HB2 LYS 71 -20.011 4.849 -6.339
558 HB3 LYS 71 HB1 LYS 71 -19.279 4.932 -4.743
559 HG2 LYS 71 HG2 LYS 71 -19.521 2.637 -5.394
560 HG3 LYS 71 HG1 LYS 71 -20.624 2.978 -4.062
561 HD2 LYS 71 HD2 LYS 71 -22.487 3.136 -5.584
562 HD3 LYS 71 HD1 LYS 71 -21.415 2.967 -6.973
563 HE2 LYS 71 HE2 LYS 71 -21.794 0.877 -4.836
564 HE3 LYS 71 HE1 LYS 71 -22.630 0.883 -6.385
565 HZ1 LYS 71 HZ1 LYS 71 -20.513 0.699 -7.507
566 HZ2 LYS 71 HZ2 LYS 71 -20.688 -0.564 -6.396
567 HZ3 LYS 71 HZ3 LYS 71 -19.684 0.745 -6.031
568 H HIS 72 HN HIS 72 -23.255 6.340 -3.390
569 HA HIS 72 HA HIS 72 -21.861 5.921 -0.846
570 HB2 HIS 72 HB2 HIS 72 -24.464 7.353 -1.427
571 HB3 HIS 72 HB1 HIS 72 -23.676 7.264 0.143
572 HD1 HIS 72 HD1 HIS 72 -24.144 9.582 -2.403
573 HD2 HIS 72 HD2 HIS 72 -20.783 8.325 -0.306
574 HE1 HIS 72 HE1 HIS 72 -22.450 11.423 -2.667
575 HE2 HIS 72 HE2 HIS 72 -20.380 10.577 -1.509
576 H ILE 73 HN ILE 73 -23.907 4.323 -2.880
577 HA ILE 73 HA ILE 73 -25.650 3.124 -0.933
578 HB ILE 73 HB ILE 73 -26.147 3.507 -3.429
579 HG12 ILE 73 HG12 ILE 73 -27.527 1.423 -3.559
580 HG13 ILE 73 HG11 ILE 73 -26.699 0.845 -2.115
581 HG21 ILE 73 HG21 ILE 73 -24.579 0.945 -3.658
582 HG22 ILE 73 HG22 ILE 73 -24.135 2.507 -4.343
583 HG23 ILE 73 HG23 ILE 73 -25.567 1.662 -4.930
584 HD11 ILE 73 HD11 ILE 73 -27.575 2.701 -0.837
585 HD12 ILE 73 HD12 ILE 73 -28.885 1.820 -1.618
586 HD13 ILE 73 HD13 ILE 73 -28.340 3.359 -2.282
587 H ASN 74 HN ASN 74 -22.470 2.711 -1.804
588 HA ASN 74 HA ASN 74 -22.153 0.429 -0.123
589 HB2 ASN 74 HB2 ASN 74 -22.801 -0.620 -2.330
590 HB3 ASN 74 HB1 ASN 74 -21.352 0.094 -3.025
591 HD21 ASN 74 HD21 ASN 74 -22.088 -2.698 -2.782
592 HD22 ASN 74 HD22 ASN 74 -20.831 -3.457 -1.866
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 -5.321 17.029 -2.682
2 H2 MET 1 HT2 MET 1 -4.338 15.952 -1.829
3 H3 MET 1 HT3 MET 1 -5.488 15.362 -2.916
4 HA MET 1 HA MET 1 -4.318 16.347 -4.759
5 HB2 MET 1 HB2 MET 1 -3.361 18.241 -3.461
6 HB3 MET 1 HB1 MET 1 -2.262 17.118 -2.675
7 HG2 MET 1 HG2 MET 1 -0.859 17.814 -4.280
8 HG3 MET 1 HG1 MET 1 -1.676 16.574 -5.224
9 HE1 MET 1 HE1 MET 1 -4.583 18.114 -5.708
10 HE2 MET 1 HE2 MET 1 -3.725 17.123 -6.889
11 HE3 MET 1 HE3 MET 1 -4.233 18.758 -7.313
12 H ALA 2 HN ALA 2 -3.706 14.583 -5.782
13 HA ALA 2 HA ALA 2 -3.025 12.193 -4.508
14 HB1 ALA 2 HB1 ALA 2 -2.550 12.933 -7.388
15 HB2 ALA 2 HB2 ALA 2 -4.070 12.337 -6.723
16 HB3 ALA 2 HB3 ALA 2 -2.641 11.303 -6.723
17 H SER 3 HN SER 3 -0.967 14.672 -5.933
18 HA SER 3 HA SER 3 1.444 13.206 -5.825
19 HB2 SER 3 HB2 SER 3 1.085 15.319 -7.138
20 HB3 SER 3 HB1 SER 3 1.125 16.211 -5.619
21 HG SER 3 HG SER 3 3.269 14.982 -5.397
22 H ASP 4 HN ASP 4 -0.170 15.350 -3.533
23 HA ASP 4 HA ASP 4 1.846 15.311 -1.546
24 HB2 ASP 4 HB2 ASP 4 0.188 17.044 -1.458
25 HB3 ASP 4 HB1 ASP 4 -1.121 15.868 -1.418
26 H MET 5 HN MET 5 -0.913 13.288 -2.263
27 HA MET 5 HA MET 5 -0.844 11.656 0.031
28 HB2 MET 5 HB2 MET 5 -2.688 11.807 -1.679
29 HB3 MET 5 HB1 MET 5 -1.683 10.845 -2.753
30 HG2 MET 5 HG2 MET 5 -3.289 9.429 -1.698
31 HG3 MET 5 HG1 MET 5 -1.684 9.039 -1.080
32 HE1 MET 5 HE1 MET 5 -4.241 8.440 1.890
33 HE2 MET 5 HE2 MET 5 -2.979 7.685 0.916
34 HE3 MET 5 HE3 MET 5 -4.490 8.194 0.159
35 H GLU 6 HN GLU 6 0.718 11.404 -3.130
36 HA GLU 6 HA GLU 6 2.069 8.981 -2.744
37 HB2 GLU 6 HB2 GLU 6 1.952 9.866 -4.931
38 HB3 GLU 6 HB1 GLU 6 2.642 11.404 -4.439
39 HG2 GLU 6 HG2 GLU 6 4.800 10.333 -4.104
40 HG3 GLU 6 HG1 GLU 6 4.104 8.777 -4.548
41 H GLU 7 HN GLU 7 2.972 12.303 -1.936
42 HA GLU 7 HA GLU 7 5.527 11.839 -0.909
43 HB2 GLU 7 HB2 GLU 7 3.441 13.777 0.111
44 HB3 GLU 7 HB1 GLU 7 5.163 13.854 0.450
45 HG2 GLU 7 HG2 GLU 7 3.951 14.080 -2.290
46 HG3 GLU 7 HG1 GLU 7 4.407 15.444 -1.271
47 H LYS 8 HN LYS 8 2.380 11.788 0.703
48 HA LYS 8 HA LYS 8 3.278 11.103 3.265
49 HB2 LYS 8 HB2 LYS 8 0.621 10.509 1.953
50 HB3 LYS 8 HB1 LYS 8 0.948 10.387 3.668
51 HG2 LYS 8 HG2 LYS 8 1.084 12.886 2.047
52 HG3 LYS 8 HG1 LYS 8 -0.202 12.433 3.160
53 HD2 LYS 8 HD2 LYS 8 1.408 12.421 5.001
54 HD3 LYS 8 HD1 LYS 8 2.685 12.906 3.885
55 HE2 LYS 8 HE2 LYS 8 1.466 14.976 3.405
56 HE3 LYS 8 HE1 LYS 8 0.205 14.492 4.537
57 HZ1 LYS 8 HZ1 LYS 8 1.744 16.027 5.564
58 HZ2 LYS 8 HZ2 LYS 8 3.049 15.009 5.226
59 HZ3 LYS 8 HZ3 LYS 8 1.852 14.517 6.314
60 H PHE 9 HN PHE 9 2.261 9.048 0.550
61 HA PHE 9 HA PHE 9 2.433 6.584 1.869
62 HB2 PHE 9 HB2 PHE 9 2.843 7.322 -1.026
63 HB3 PHE 9 HB1 PHE 9 2.941 5.660 -0.458
64 HD1 PHE 9 HD1 PHE 9 0.959 7.362 -2.367
65 HD2 PHE 9 HD2 PHE 9 0.729 5.594 1.499
66 HE1 PHE 9 HE1 PHE 9 -1.476 7.133 -2.621
67 HE2 PHE 9 HE2 PHE 9 -1.706 5.364 1.253
68 HZ PHE 9 HZ PHE 9 -2.811 6.133 -0.808
69 H ARG 10 HN ARG 10 4.904 8.567 0.338
70 HA ARG 10 HA ARG 10 7.002 6.699 0.437
71 HB2 ARG 10 HB2 ARG 10 7.199 8.687 -0.918
72 HB3 ARG 10 HB1 ARG 10 7.050 9.716 0.500
73 HG2 ARG 10 HG2 ARG 10 9.180 8.826 1.348
74 HG3 ARG 10 HG1 ARG 10 9.333 7.849 -0.115
75 HD2 ARG 10 HD2 ARG 10 10.656 9.841 -0.361
76 HD3 ARG 10 HD1 ARG 10 9.276 9.925 -1.450
77 HE ARG 10 HE ARG 10 9.466 11.385 1.103
78 HH11 ARG 10 HH11 ARG 10 8.319 11.100 -2.190
79 HH12 ARG 10 HH12 ARG 10 7.597 12.681 -2.220
80 HH21 ARG 10 HH21 ARG 10 8.539 13.480 1.072
81 HH22 ARG 10 HH22 ARG 10 7.746 14.046 -0.371
82 H GLU 11 HN GLU 11 5.999 9.203 2.714
83 HA GLU 11 HA GLU 11 8.122 8.868 4.537
84 HB2 GLU 11 HB2 GLU 11 5.353 9.748 5.304
85 HB3 GLU 11 HB1 GLU 11 6.885 10.263 5.997
86 HG2 GLU 11 HG2 GLU 11 7.402 11.354 3.816
87 HG3 GLU 11 HG1 GLU 11 5.761 10.952 3.307
88 H ALA 12 HN ALA 12 4.865 7.552 4.397
89 HA ALA 12 HA ALA 12 5.026 6.037 6.788
90 HB1 ALA 12 HB1 ALA 12 3.269 5.572 4.379
91 HB2 ALA 12 HB2 ALA 12 2.898 6.639 5.733
92 HB3 ALA 12 HB3 ALA 12 3.027 4.899 5.992
93 H PHE 13 HN PHE 13 5.696 5.258 3.400
94 HA PHE 13 HA PHE 13 6.109 2.507 3.724
95 HB2 PHE 13 HB2 PHE 13 5.902 3.674 1.521
96 HB3 PHE 13 HB1 PHE 13 7.525 4.314 1.751
97 HD1 PHE 13 HD1 PHE 13 9.438 3.000 1.278
98 HD2 PHE 13 HD2 PHE 13 5.576 1.222 1.305
99 HE1 PHE 13 HE1 PHE 13 10.376 0.955 0.283
100 HE2 PHE 13 HE2 PHE 13 6.503 -0.825 0.313
101 HZ PHE 13 HZ PHE 13 8.908 -0.963 -0.202
102 H ILE 14 HN ILE 14 8.384 5.227 3.923
103 HA ILE 14 HA ILE 14 10.713 3.721 4.317
104 HB ILE 14 HB ILE 14 10.087 6.487 5.368
105 HG12 ILE 14 HG12 ILE 14 11.613 5.645 2.892
106 HG13 ILE 14 HG11 ILE 14 9.942 6.199 2.887
107 HG21 ILE 14 HG21 ILE 14 12.735 5.075 5.044
108 HG22 ILE 14 HG22 ILE 14 11.942 5.459 6.571
109 HG23 ILE 14 HG23 ILE 14 12.520 6.759 5.525
110 HD11 ILE 14 HD11 ILE 14 10.651 8.365 3.737
111 HD12 ILE 14 HD12 ILE 14 11.480 7.965 2.232
112 HD13 ILE 14 HD13 ILE 14 12.325 7.810 3.772
113 H LEU 15 HN LEU 15 8.326 4.931 6.634
114 HA LEU 15 HA LEU 15 9.669 4.321 8.997
115 HB2 LEU 15 HB2 LEU 15 6.715 4.226 8.396
116 HB3 LEU 15 HB1 LEU 15 7.401 4.136 10.006
117 HG LEU 15 HG LEU 15 7.697 6.486 8.136
118 HD11 LEU 15 HD11 LEU 15 6.141 7.620 9.634
119 HD12 LEU 15 HD12 LEU 15 5.939 6.132 10.560
120 HD13 LEU 15 HD13 LEU 15 5.392 6.209 8.886
121 HD21 LEU 15 HD21 LEU 15 9.568 6.276 9.672
122 HD22 LEU 15 HD22 LEU 15 8.457 6.124 11.032
123 HD23 LEU 15 HD23 LEU 15 8.545 7.637 10.132
124 H PHE 16 HN PHE 16 7.476 2.309 7.076
125 HA PHE 16 HA PHE 16 7.815 0.040 8.794
126 HB2 PHE 16 HB2 PHE 16 6.481 0.433 6.122
127 HB3 PHE 16 HB1 PHE 16 6.581 -1.144 6.896
128 HD1 PHE 16 HD1 PHE 16 4.873 -1.808 8.285
129 HD2 PHE 16 HD2 PHE 16 5.486 2.349 7.626
130 HE1 PHE 16 HE1 PHE 16 2.844 -1.307 9.585
131 HE2 PHE 16 HE2 PHE 16 3.461 2.858 8.925
132 HZ PHE 16 HZ PHE 16 2.138 1.030 9.909
133 H SER 17 HN SER 17 9.253 1.158 5.795
134 HA SER 17 HA SER 17 10.509 -1.398 5.268
135 HB2 SER 17 HB2 SER 17 9.616 -0.037 3.419
136 HB3 SER 17 HB1 SER 17 10.757 1.245 3.812
137 HG SER 17 HG SER 17 12.257 -0.832 3.549
138 H SER 18 HN SER 18 11.264 1.053 7.332
139 HA SER 18 HA SER 18 14.030 1.417 6.903
140 HB2 SER 18 HB2 SER 18 12.560 2.906 8.293
141 HB3 SER 18 HB1 SER 18 12.535 1.647 9.525
142 HG SER 18 HG SER 18 14.939 2.759 8.525
143 H CYS 19 HN CYS 19 14.471 -0.864 6.439
144 HA CYS 19 HA CYS 19 15.912 -2.111 8.515
145 HB2 CYS 19 HB2 CYS 19 13.675 -2.770 9.309
146 HB3 CYS 19 HB1 CYS 19 13.320 -3.470 7.735
147 HG CYS 19 HG CYS 19 15.897 -4.611 9.658
148 H SER 20 HN SER 20 14.179 -2.500 5.469
149 HA SER 20 HA SER 20 16.564 -3.754 4.321
150 HB2 SER 20 HB2 SER 20 13.734 -4.768 3.924
151 HB3 SER 20 HB1 SER 20 15.177 -5.403 3.136
152 HG SER 20 HG SER 20 14.253 -5.767 5.724
153 H ASP 21 HN ASP 21 16.174 -3.906 1.799
154 HA ASP 21 HA ASP 21 15.488 -1.218 0.942
155 HB2 ASP 21 HB2 ASP 21 16.628 -3.580 -0.568
156 HB3 ASP 21 HB1 ASP 21 16.325 -2.003 -1.287
157 H HIS 22 HN HIS 22 14.313 -4.483 0.603
158 HA HIS 22 HA HIS 22 11.955 -3.490 -0.860
159 HB2 HIS 22 HB2 HIS 22 12.852 -6.360 -0.457
160 HB3 HIS 22 HB1 HIS 22 11.550 -5.804 -1.501
161 HD1 HIS 22 HD1 HIS 22 15.065 -6.663 -1.538
162 HD2 HIS 22 HD2 HIS 22 12.581 -4.163 -3.743
163 HE1 HIS 22 HE1 HIS 22 16.303 -6.193 -3.670
164 HE2 HIS 22 HE2 HIS 22 14.860 -4.545 -4.908
165 H ILE 23 HN ILE 23 9.840 -4.331 -0.093
166 HA ILE 23 HA ILE 23 9.934 -4.575 2.825
167 HB ILE 23 HB ILE 23 8.665 -2.670 1.904
168 HG12 ILE 23 HG12 ILE 23 6.854 -4.621 3.316
169 HG13 ILE 23 HG11 ILE 23 8.156 -3.745 4.115
170 HG21 ILE 23 HG21 ILE 23 7.766 -3.597 -0.127
171 HG22 ILE 23 HG22 ILE 23 6.424 -3.078 0.894
172 HG23 ILE 23 HG23 ILE 23 6.837 -4.789 0.780
173 HD11 ILE 23 HD11 ILE 23 7.088 -1.632 3.562
174 HD12 ILE 23 HD12 ILE 23 5.998 -2.679 4.473
175 HD13 ILE 23 HD13 ILE 23 5.794 -2.495 2.731
176 H GLU 24 HN GLU 24 9.415 -6.342 3.804
177 HA GLU 24 HA GLU 24 8.699 -8.713 2.394
178 HB2 GLU 24 HB2 GLU 24 8.960 -8.093 5.337
179 HB3 GLU 24 HB1 GLU 24 8.608 -9.699 4.709
180 HG2 GLU 24 HG2 GLU 24 10.673 -9.582 3.405
181 HG3 GLU 24 HG1 GLU 24 11.058 -8.056 4.179
182 H MET 25 HN MET 25 6.877 -9.977 2.662
183 HA MET 25 HA MET 25 4.487 -8.626 2.304
184 HB2 MET 25 HB2 MET 25 5.135 -11.497 2.870
185 HB3 MET 25 HB1 MET 25 3.466 -10.964 2.734
186 HG2 MET 25 HG2 MET 25 5.550 -10.545 0.608
187 HG3 MET 25 HG1 MET 25 4.426 -11.903 0.646
188 HE1 MET 25 HE1 MET 25 4.794 -9.870 -1.801
189 HE2 MET 25 HE2 MET 25 3.117 -9.608 -2.280
190 HE3 MET 25 HE3 MET 25 3.668 -11.227 -1.848
191 H TYR 26 HN TYR 26 5.922 -9.780 5.310
192 HA TYR 26 HA TYR 26 3.422 -9.653 6.720
193 HB2 TYR 26 HB2 TYR 26 4.694 -10.107 8.704
194 HB3 TYR 26 HB1 TYR 26 5.268 -11.154 7.429
195 HD1 TYR 26 HD1 TYR 26 6.076 -8.095 9.373
196 HD2 TYR 26 HD2 TYR 26 7.545 -11.147 6.805
197 HE1 TYR 26 HE1 TYR 26 8.379 -7.368 9.828
198 HE2 TYR 26 HE2 TYR 26 9.839 -10.428 7.252
199 HH TYR 26 HH TYR 26 11.059 -8.577 7.993
200 H LYS 27 HN LYS 27 6.120 -7.521 6.138
201 HA LYS 27 HA LYS 27 5.268 -5.513 8.003
202 HB2 LYS 27 HB2 LYS 27 7.619 -5.977 7.539
203 HB3 LYS 27 HB1 LYS 27 7.373 -5.609 5.844
204 HG2 LYS 27 HG2 LYS 27 8.453 -3.802 7.034
205 HG3 LYS 27 HG1 LYS 27 6.900 -3.331 6.352
206 HD2 LYS 27 HD2 LYS 27 7.075 -2.404 8.564
207 HD3 LYS 27 HD1 LYS 27 5.869 -3.682 8.582
208 HE2 LYS 27 HE2 LYS 27 7.500 -5.220 9.540
209 HE3 LYS 27 HE1 LYS 27 8.730 -3.958 9.493
210 HZ1 LYS 27 HZ1 LYS 27 7.688 -4.228 11.692
211 HZ2 LYS 27 HZ2 LYS 27 6.195 -3.776 11.032
212 HZ3 LYS 27 HZ3 LYS 27 7.479 -2.674 11.061
213 H PHE 28 HN PHE 28 5.149 -6.220 4.614
214 HA PHE 28 HA PHE 28 4.242 -3.767 3.628
215 HB2 PHE 28 HB2 PHE 28 5.072 -5.400 2.106
216 HB3 PHE 28 HB1 PHE 28 3.919 -6.606 2.664
217 HD1 PHE 28 HD1 PHE 28 4.335 -3.540 0.690
218 HD2 PHE 28 HD2 PHE 28 1.707 -6.681 1.831
219 HE1 PHE 28 HE1 PHE 28 2.786 -2.880 -1.090
220 HE2 PHE 28 HE2 PHE 28 0.146 -6.027 0.060
221 HZ PHE 28 HZ PHE 28 0.660 -4.134 -1.405
222 H PHE 29 HN PHE 29 2.444 -6.573 4.861
223 HA PHE 29 HA PHE 29 -0.072 -5.581 4.013
224 HB2 PHE 29 HB2 PHE 29 0.704 -8.017 4.707
225 HB3 PHE 29 HB1 PHE 29 0.089 -7.516 6.279
226 HD1 PHE 29 HD1 PHE 29 -2.292 -6.740 6.449
227 HD2 PHE 29 HD2 PHE 29 -0.769 -8.681 2.971
228 HE1 PHE 29 HE1 PHE 29 -4.584 -7.255 5.735
229 HE2 PHE 29 HE2 PHE 29 -3.063 -9.200 2.263
230 HZ PHE 29 HZ PHE 29 -4.973 -8.487 3.640
231 H GLU 30 HN GLU 30 1.665 -5.412 7.111
232 HA GLU 30 HA GLU 30 -0.429 -4.078 8.474
233 HB2 GLU 30 HB2 GLU 30 1.342 -3.370 10.096
234 HB3 GLU 30 HB1 GLU 30 1.225 -5.100 9.830
235 HG2 GLU 30 HG2 GLU 30 3.165 -4.990 8.345
236 HG3 GLU 30 HG1 GLU 30 3.284 -3.257 8.646
237 H LEU 31 HN LEU 31 2.111 -2.983 6.365
238 HA LEU 31 HA LEU 31 1.974 -0.233 6.883
239 HB2 LEU 31 HB2 LEU 31 3.809 -1.015 5.631
240 HB3 LEU 31 HB1 LEU 31 2.774 -1.846 4.486
241 HG LEU 31 HG LEU 31 1.972 0.470 3.763
242 HD11 LEU 31 HD11 LEU 31 4.465 1.289 5.240
243 HD12 LEU 31 HD12 LEU 31 2.812 1.731 5.664
244 HD13 LEU 31 HD13 LEU 31 3.519 2.310 4.156
245 HD21 LEU 31 HD21 LEU 31 4.846 -0.284 3.275
246 HD22 LEU 31 HD22 LEU 31 3.851 0.762 2.261
247 HD23 LEU 31 HD23 LEU 31 3.448 -0.945 2.428
248 H MET 32 HN MET 32 0.015 -2.280 4.807
249 HA MET 32 HA MET 32 -1.164 0.120 3.646
250 HB2 MET 32 HB2 MET 32 -2.183 -1.577 1.990
251 HB3 MET 32 HB1 MET 32 -0.473 -1.192 1.888
252 HG2 MET 32 HG2 MET 32 -0.615 -3.490 1.611
253 HG3 MET 32 HG1 MET 32 -0.085 -3.266 3.277
254 HE1 MET 32 HE1 MET 32 -2.232 -5.034 0.980
255 HE2 MET 32 HE2 MET 32 -3.024 -6.125 2.122
256 HE3 MET 32 HE3 MET 32 -1.264 -5.985 2.110
257 H ASN 33 HN ASN 33 -2.151 -2.645 5.585
258 HA ASN 33 HA ASN 33 -4.925 -2.152 5.306
259 HB2 ASN 33 HB2 ASN 33 -5.304 -3.662 7.039
260 HB3 ASN 33 HB1 ASN 33 -3.763 -4.215 6.399
261 HD21 ASN 33 HD21 ASN 33 -1.948 -4.053 7.641
262 HD22 ASN 33 HD22 ASN 33 -1.980 -3.596 9.315
263 H SER 34 HN SER 34 -2.403 -0.603 7.046
264 HA SER 34 HA SER 34 -3.947 0.759 8.989
265 HB2 SER 34 HB2 SER 34 -1.287 1.487 7.739
266 HB3 SER 34 HB1 SER 34 -1.975 2.261 9.165
267 HG SER 34 HG SER 34 -0.792 -0.243 8.884
268 H PHE 35 HN PHE 35 -3.401 1.292 5.608
269 HA PHE 35 HA PHE 35 -4.506 3.988 5.711
270 HB2 PHE 35 HB2 PHE 35 -3.360 2.298 3.500
271 HB3 PHE 35 HB1 PHE 35 -4.228 3.791 3.160
272 HD1 PHE 35 HD1 PHE 35 -1.159 2.323 4.459
273 HD2 PHE 35 HD2 PHE 35 -3.303 5.943 3.824
274 HE1 PHE 35 HE1 PHE 35 0.909 3.606 4.817
275 HE2 PHE 35 HE2 PHE 35 -1.240 7.233 4.179
276 HZ PHE 35 HZ PHE 35 0.872 6.066 4.676
277 H GLY 36 HN GLY 36 -5.826 1.091 5.998
278 HA2 GLY 36 HA2 GLY 36 -8.027 0.419 5.838
279 HA3 GLY 36 HA1 GLY 36 -8.402 1.966 5.094
280 H ILE 37 HN ILE 37 -5.841 0.362 3.588
281 HA ILE 37 HA ILE 37 -7.431 -0.053 1.220
282 HB ILE 37 HB ILE 37 -4.497 -0.580 1.726
283 HG12 ILE 37 HG12 ILE 37 -5.838 1.729 0.302
284 HG13 ILE 37 HG11 ILE 37 -5.199 1.802 1.941
285 HG21 ILE 37 HG21 ILE 37 -6.056 -0.505 -0.856
286 HG22 ILE 37 HG22 ILE 37 -5.310 -1.923 -0.120
287 HG23 ILE 37 HG23 ILE 37 -4.301 -0.612 -0.727
288 HD11 ILE 37 HD11 ILE 37 -3.603 1.280 -0.557
289 HD12 ILE 37 HD12 ILE 37 -2.960 1.356 1.084
290 HD13 ILE 37 HD13 ILE 37 -3.665 2.795 0.347
291 H ILE 38 HN ILE 38 -8.295 -1.921 0.583
292 HA ILE 38 HA ILE 38 -7.661 -4.318 2.125
293 HB ILE 38 HB ILE 38 -9.662 -5.264 0.799
294 HG12 ILE 38 HG12 ILE 38 -10.168 -2.296 0.478
295 HG13 ILE 38 HG11 ILE 38 -9.786 -3.410 -0.831
296 HG21 ILE 38 HG21 ILE 38 -10.033 -3.130 2.889
297 HG22 ILE 38 HG22 ILE 38 -9.652 -4.828 3.179
298 HG23 ILE 38 HG23 ILE 38 -11.207 -4.379 2.473
299 HD11 ILE 38 HD11 ILE 38 -12.235 -3.491 0.914
300 HD12 ILE 38 HD12 ILE 38 -11.854 -4.633 -0.373
301 HD13 ILE 38 HD13 ILE 38 -12.157 -2.941 -0.760
302 H LEU 39 HN LEU 39 -6.664 -6.003 1.336
303 HA LEU 39 HA LEU 39 -6.201 -6.210 -1.555
304 HB2 LEU 39 HB2 LEU 39 -4.312 -5.065 -0.178
305 HB3 LEU 39 HB1 LEU 39 -3.990 -6.675 0.425
306 HG LEU 39 HG LEU 39 -3.926 -5.980 -2.514
307 HD11 LEU 39 HD11 LEU 39 -2.250 -4.691 -1.196
308 HD12 LEU 39 HD12 LEU 39 -1.538 -5.834 -2.336
309 HD13 LEU 39 HD13 LEU 39 -1.600 -6.225 -0.617
310 HD21 LEU 39 HD21 LEU 39 -2.661 -8.022 -2.709
311 HD22 LEU 39 HD22 LEU 39 -4.226 -8.351 -1.957
312 HD23 LEU 39 HD23 LEU 39 -2.765 -8.279 -0.970
313 H THR 40 HN THR 40 -6.834 -8.188 -2.171
314 HA THR 40 HA THR 40 -7.158 -10.251 -0.144
315 HB THR 40 HB THR 40 -8.219 -11.532 -2.073
316 HG1 THR 40 HG1 THR 40 -8.008 -8.941 -3.267
317 HG21 THR 40 HG21 THR 40 -9.427 -8.898 -1.236
318 HG22 THR 40 HG22 THR 40 -9.499 -10.407 -0.327
319 HG23 THR 40 HG23 THR 40 -10.306 -10.281 -1.889
320 H ASN 41 HN ASN 41 -6.719 -12.572 -0.913
321 HA ASN 41 HA ASN 41 -3.941 -12.876 -1.159
322 HB2 ASN 41 HB2 ASN 41 -6.155 -14.880 -1.634
323 HB3 ASN 41 HB1 ASN 41 -4.446 -15.294 -1.599
324 HD21 ASN 41 HD21 ASN 41 -4.590 -16.623 0.158
325 HD22 ASN 41 HD22 ASN 41 -4.915 -16.049 1.757
326 H ASP 42 HN ASP 42 -6.516 -13.089 -3.550
327 HA ASP 42 HA ASP 42 -5.024 -13.936 -5.755
328 HB2 ASP 42 HB2 ASP 42 -7.437 -13.898 -5.838
329 HB3 ASP 42 HB1 ASP 42 -7.463 -12.155 -5.597
330 H GLU 43 HN GLU 43 -5.694 -10.678 -4.554
331 HA GLU 43 HA GLU 43 -4.510 -9.294 -6.684
332 HB2 GLU 43 HB2 GLU 43 -5.028 -8.471 -3.834
333 HB3 GLU 43 HB1 GLU 43 -4.446 -7.367 -5.074
334 HG2 GLU 43 HG2 GLU 43 -6.436 -7.688 -6.373
335 HG3 GLU 43 HG1 GLU 43 -6.999 -8.945 -5.273
336 H LYS 44 HN LYS 44 -3.141 -10.535 -3.674
337 HA LYS 44 HA LYS 44 -0.661 -9.268 -3.664
338 HB2 LYS 44 HB2 LYS 44 -1.174 -12.157 -2.904
339 HB3 LYS 44 HB1 LYS 44 0.162 -11.153 -2.360
340 HG2 LYS 44 HG2 LYS 44 -1.340 -9.744 -1.114
341 HG3 LYS 44 HG1 LYS 44 -2.733 -10.614 -1.766
342 HD2 LYS 44 HD2 LYS 44 -2.350 -11.430 0.443
343 HD3 LYS 44 HD1 LYS 44 -1.819 -12.686 -0.675
344 HE2 LYS 44 HE2 LYS 44 -0.194 -12.468 1.085
345 HE3 LYS 44 HE1 LYS 44 0.505 -11.872 -0.420
346 HZ1 LYS 44 HZ1 LYS 44 1.024 -10.402 1.407
347 HZ2 LYS 44 HZ2 LYS 44 -0.616 -10.204 1.768
348 HZ3 LYS 44 HZ3 LYS 44 0.007 -9.607 0.311
349 H ALA 45 HN ALA 45 -1.819 -11.882 -5.672
350 HA ALA 45 HA ALA 45 0.652 -12.833 -6.612
351 HB1 ALA 45 HB1 ALA 45 -1.443 -14.055 -6.888
352 HB2 ALA 45 HB2 ALA 45 -0.612 -13.834 -8.427
353 HB3 ALA 45 HB3 ALA 45 -2.007 -12.832 -8.026
354 H ALA 46 HN ALA 46 -0.814 -9.790 -7.151
355 HA ALA 46 HA ALA 46 0.422 -9.511 -9.813
356 HB1 ALA 46 HB1 ALA 46 -1.869 -8.686 -9.592
357 HB2 ALA 46 HB2 ALA 46 -0.756 -7.358 -9.920
358 HB3 ALA 46 HB3 ALA 46 -1.367 -7.614 -8.285
359 H LEU 47 HN LEU 47 0.718 -8.685 -6.524
360 HA LEU 47 HA LEU 47 2.753 -6.775 -6.620
361 HB2 LEU 47 HB2 LEU 47 1.983 -8.885 -4.601
362 HB3 LEU 47 HB1 LEU 47 3.179 -7.644 -4.293
363 HG LEU 47 HG LEU 47 1.444 -5.956 -4.567
364 HD11 LEU 47 HD11 LEU 47 -0.942 -6.699 -4.397
365 HD12 LEU 47 HD12 LEU 47 -0.350 -8.195 -5.125
366 HD13 LEU 47 HD13 LEU 47 -0.146 -6.658 -5.965
367 HD21 LEU 47 HD21 LEU 47 0.776 -8.034 -2.541
368 HD22 LEU 47 HD22 LEU 47 0.236 -6.354 -2.508
369 HD23 LEU 47 HD23 LEU 47 1.952 -6.730 -2.357
370 HA PRO 48 HA PRO 48 6.101 -9.479 -7.980
371 HB2 PRO 48 HB2 PRO 48 7.829 -7.353 -6.897
372 HB3 PRO 48 HB1 PRO 48 7.732 -7.986 -8.542
373 HG2 PRO 48 HG2 PRO 48 6.813 -5.541 -7.908
374 HG3 PRO 48 HG1 PRO 48 6.029 -6.548 -9.137
375 HD2 PRO 48 HD2 PRO 48 5.218 -6.035 -6.302
376 HD3 PRO 48 HD1 PRO 48 4.209 -6.171 -7.759
377 H ASN 49 HN ASN 49 7.922 -10.580 -6.915
378 HA ASN 49 HA ASN 49 7.408 -11.291 -4.242
379 HB2 ASN 49 HB2 ASN 49 9.843 -11.681 -5.987
380 HB3 ASN 49 HB1 ASN 49 9.709 -12.351 -4.367
381 HD21 ASN 49 HD21 ASN 49 9.905 -14.411 -5.221
382 HD22 ASN 49 HD22 ASN 49 8.588 -15.207 -6.008
383 H ASP 50 HN ASP 50 9.453 -8.881 -5.706
384 HA ASP 50 HA ASP 50 10.159 -7.911 -3.015
385 HB2 ASP 50 HB2 ASP 50 11.444 -7.232 -5.677
386 HB3 ASP 50 HB1 ASP 50 11.944 -6.614 -4.109
387 H ILE 51 HN ILE 51 8.886 -6.290 -2.363
388 HA ILE 51 HA ILE 51 7.586 -4.644 -4.412
389 HB ILE 51 HB ILE 51 6.863 -4.898 -1.490
390 HG12 ILE 51 HG12 ILE 51 5.504 -6.091 -3.918
391 HG13 ILE 51 HG11 ILE 51 6.510 -6.991 -2.789
392 HG21 ILE 51 HG21 ILE 51 4.804 -3.742 -2.131
393 HG22 ILE 51 HG22 ILE 51 5.403 -3.589 -3.783
394 HG23 ILE 51 HG23 ILE 51 6.225 -2.752 -2.465
395 HD11 ILE 51 HD11 ILE 51 4.153 -7.337 -2.342
396 HD12 ILE 51 HD12 ILE 51 3.926 -5.601 -2.126
397 HD13 ILE 51 HD13 ILE 51 4.932 -6.507 -0.995
398 H ASN 52 HN ASN 52 8.257 -2.656 -4.731
399 HA ASN 52 HA ASN 52 9.885 -1.370 -2.648
400 HB2 ASN 52 HB2 ASN 52 9.933 -1.096 -5.651
401 HB3 ASN 52 HB1 ASN 52 10.709 0.070 -4.587
402 HD21 ASN 52 HD21 ASN 52 12.533 -0.514 -3.450
403 HD22 ASN 52 HD22 ASN 52 13.441 -1.935 -3.828
404 H MET 53 HN MET 53 9.835 1.162 -3.052
405 HA MET 53 HA MET 53 7.318 2.042 -2.235
406 HB2 MET 53 HB2 MET 53 9.472 3.205 -1.814
407 HB3 MET 53 HB1 MET 53 9.515 3.683 -3.505
408 HG2 MET 53 HG2 MET 53 7.488 4.975 -3.220
409 HG3 MET 53 HG1 MET 53 7.374 4.448 -1.542
410 HE1 MET 53 HE1 MET 53 10.562 6.131 0.025
411 HE2 MET 53 HE2 MET 53 10.433 4.511 -0.661
412 HE3 MET 53 HE3 MET 53 9.136 5.147 0.351
413 H ASP 54 HN ASP 54 8.778 1.883 -5.424
414 HA ASP 54 HA ASP 54 7.031 3.500 -6.854
415 HB2 ASP 54 HB2 ASP 54 8.593 1.060 -7.663
416 HB3 ASP 54 HB1 ASP 54 7.592 1.943 -8.809
417 H TYR 55 HN TYR 55 6.746 -0.008 -6.210
418 HA TYR 55 HA TYR 55 4.261 -0.223 -7.577
419 HB2 TYR 55 HB2 TYR 55 5.846 -2.163 -6.966
420 HB3 TYR 55 HB1 TYR 55 5.106 -2.091 -5.369
421 HD1 TYR 55 HD1 TYR 55 4.258 -2.437 -8.964
422 HD2 TYR 55 HD2 TYR 55 3.082 -3.267 -4.951
423 HE1 TYR 55 HE1 TYR 55 2.385 -3.789 -9.789
424 HE2 TYR 55 HE2 TYR 55 1.217 -4.600 -5.774
425 HH TYR 55 HH TYR 55 0.938 -5.608 -9.004
426 H TRP 56 HN TRP 56 5.197 0.403 -4.257
427 HA TRP 56 HA TRP 56 2.742 0.140 -2.997
428 HB2 TRP 56 HB2 TRP 56 4.779 0.422 -1.737
429 HB3 TRP 56 HB1 TRP 56 5.050 2.009 -2.437
430 HD1 TRP 56 HD1 TRP 56 4.821 3.634 -0.467
431 HE1 TRP 56 HE1 TRP 56 3.049 4.086 1.342
432 HE3 TRP 56 HE3 TRP 56 1.680 -0.271 -1.431
433 HZ2 TRP 56 HZ2 TRP 56 0.623 2.942 2.232
434 HZ3 TRP 56 HZ3 TRP 56 -0.350 -0.520 -0.064
435 HH2 TRP 56 HH2 TRP 56 -0.863 1.055 1.730
436 H LEU 57 HN LEU 57 4.180 3.018 -4.499
437 HA LEU 57 HA LEU 57 2.028 4.760 -3.941
438 HB2 LEU 57 HB2 LEU 57 3.918 4.882 -6.290
439 HB3 LEU 57 HB1 LEU 57 2.988 6.213 -5.631
440 HG LEU 57 HG LEU 57 5.171 4.766 -4.151
441 HD11 LEU 57 HD11 LEU 57 6.120 5.927 -6.043
442 HD12 LEU 57 HD12 LEU 57 6.504 6.803 -4.562
443 HD13 LEU 57 HD13 LEU 57 5.231 7.393 -5.629
444 HD21 LEU 57 HD21 LEU 57 3.596 7.269 -3.548
445 HD22 LEU 57 HD22 LEU 57 5.038 6.761 -2.665
446 HD23 LEU 57 HD23 LEU 57 3.589 5.756 -2.641
447 H ASN 58 HN ASN 58 2.856 2.892 -6.810
448 HA ASN 58 HA ASN 58 0.753 3.831 -8.439
449 HB2 ASN 58 HB2 ASN 58 2.788 2.789 -9.353
450 HB3 ASN 58 HB1 ASN 58 2.320 1.246 -8.645
451 HD21 ASN 58 HD21 ASN 58 1.695 3.563 -11.143
452 HD22 ASN 58 HD22 ASN 58 0.673 2.553 -12.107
453 H PHE 59 HN PHE 59 1.092 0.975 -6.419
454 HA PHE 59 HA PHE 59 -1.339 -0.274 -7.050
455 HB2 PHE 59 HB2 PHE 59 0.438 -1.417 -5.867
456 HB3 PHE 59 HB1 PHE 59 0.333 -0.286 -4.526
457 HD1 PHE 59 HD1 PHE 59 -0.820 -3.362 -5.912
458 HD2 PHE 59 HD2 PHE 59 -1.777 -0.290 -3.129
459 HE1 PHE 59 HE1 PHE 59 -2.372 -4.885 -4.765
460 HE2 PHE 59 HE2 PHE 59 -3.342 -1.801 -1.993
461 HZ PHE 59 HZ PHE 59 -3.645 -4.094 -2.813
462 H ALA 60 HN ALA 60 -0.470 2.130 -4.612
463 HA ALA 60 HA ALA 60 -3.040 2.233 -3.394
464 HB1 ALA 60 HB1 ALA 60 -2.220 4.242 -2.291
465 HB2 ALA 60 HB2 ALA 60 -0.839 4.292 -3.389
466 HB3 ALA 60 HB3 ALA 60 -1.011 2.958 -2.245
467 H LYS 61 HN LYS 61 -1.518 3.948 -6.042
468 HA LYS 61 HA LYS 61 -3.456 5.986 -6.388
469 HB2 LYS 61 HB2 LYS 61 -1.654 4.710 -8.454
470 HB3 LYS 61 HB1 LYS 61 -2.509 6.234 -8.631
471 HG2 LYS 61 HG2 LYS 61 -0.449 5.710 -6.512
472 HG3 LYS 61 HG1 LYS 61 -0.097 6.430 -8.073
473 HD2 LYS 61 HD2 LYS 61 -2.100 7.566 -6.133
474 HD3 LYS 61 HD1 LYS 61 -0.410 8.069 -6.200
475 HE2 LYS 61 HE2 LYS 61 -2.424 8.268 -8.438
476 HE3 LYS 61 HE1 LYS 61 -1.822 9.602 -7.457
477 HZ1 LYS 61 HZ1 LYS 61 -0.687 9.506 -9.577
478 HZ2 LYS 61 HZ2 LYS 61 -0.193 7.917 -9.277
479 HZ3 LYS 61 HZ3 LYS 61 0.402 9.176 -8.323
480 H LYS 62 HN LYS 62 -3.251 2.658 -7.332
481 HA LYS 62 HA LYS 62 -5.286 2.686 -9.338
482 HB2 LYS 62 HB2 LYS 62 -3.487 1.009 -9.261
483 HB3 LYS 62 HB1 LYS 62 -4.104 0.408 -7.735
484 HG2 LYS 62 HG2 LYS 62 -6.183 -0.252 -8.868
485 HG3 LYS 62 HG1 LYS 62 -5.498 0.295 -10.398
486 HD2 LYS 62 HD2 LYS 62 -4.205 -1.800 -8.661
487 HD3 LYS 62 HD1 LYS 62 -5.349 -2.185 -9.945
488 HE2 LYS 62 HE2 LYS 62 -3.280 -2.448 -10.973
489 HE3 LYS 62 HE1 LYS 62 -3.771 -0.832 -11.463
490 HZ1 LYS 62 HZ1 LYS 62 -1.937 -1.388 -9.191
491 HZ2 LYS 62 HZ2 LYS 62 -2.292 0.121 -9.873
492 HZ3 LYS 62 HZ3 LYS 62 -1.422 -1.020 -10.759
493 H HIS 63 HN HIS 63 -5.123 1.816 -5.940
494 HA HIS 63 HA HIS 63 -7.836 0.973 -5.727
495 HB2 HIS 63 HB2 HIS 63 -5.700 1.586 -3.699
496 HB3 HIS 63 HB1 HIS 63 -7.348 1.193 -3.213
497 HD1 HIS 63 HD1 HIS 63 -7.520 -1.196 -2.593
498 HD2 HIS 63 HD2 HIS 63 -4.836 -0.601 -5.708
499 HE1 HIS 63 HE1 HIS 63 -6.693 -3.482 -3.213
500 HE2 HIS 63 HE2 HIS 63 -5.295 -3.112 -5.273
501 H TYR 64 HN TYR 64 -6.217 3.963 -5.581
502 HA TYR 64 HA TYR 64 -7.385 5.753 -4.071
503 HB2 TYR 64 HB2 TYR 64 -6.135 5.787 -6.573
504 HB3 TYR 64 HB1 TYR 64 -7.594 6.742 -6.771
505 HD1 TYR 64 HD1 TYR 64 -7.789 8.903 -5.792
506 HD2 TYR 64 HD2 TYR 64 -4.472 6.413 -4.880
507 HE1 TYR 64 HE1 TYR 64 -6.644 10.818 -4.755
508 HE2 TYR 64 HE2 TYR 64 -3.315 8.297 -3.851
509 HH TYR 64 HH TYR 64 -4.886 11.230 -3.105
510 H ASN 65 HN ASN 65 -9.314 6.414 -3.509
511 HA ASN 65 HA ASN 65 -11.624 5.655 -5.124
512 HB2 ASN 65 HB2 ASN 65 -11.467 6.751 -2.306
513 HB3 ASN 65 HB1 ASN 65 -12.939 6.235 -3.117
514 HD21 ASN 65 HD21 ASN 65 -13.301 4.046 -3.463
515 HD22 ASN 65 HD22 ASN 65 -12.418 2.826 -2.616
516 H TYR 66 HN TYR 66 -11.618 7.165 -6.741
517 HA TYR 66 HA TYR 66 -12.179 9.913 -5.880
518 HB2 TYR 66 HB2 TYR 66 -10.952 10.754 -7.871
519 HB3 TYR 66 HB1 TYR 66 -9.908 9.947 -6.711
520 HD1 TYR 66 HD1 TYR 66 -11.025 10.061 -10.118
521 HD2 TYR 66 HD2 TYR 66 -9.176 7.554 -7.214
522 HE1 TYR 66 HE1 TYR 66 -10.135 8.637 -11.915
523 HE2 TYR 66 HE2 TYR 66 -8.286 6.128 -9.006
524 HH TYR 66 HH TYR 66 -8.262 7.059 -12.257
525 H GLU 67 HN GLU 67 -13.771 10.966 -6.987
526 HA GLU 67 HA GLU 67 -15.895 9.477 -7.851
527 HB2 GLU 67 HB2 GLU 67 -15.381 12.290 -8.768
528 HB3 GLU 67 HB1 GLU 67 -16.933 11.505 -8.528
529 HG2 GLU 67 HG2 GLU 67 -16.729 12.838 -6.674
530 HG3 GLU 67 HG1 GLU 67 -16.197 11.280 -6.078
531 H GLN 68 HN GLN 68 -14.018 11.559 -10.068
532 HA GLN 68 HA GLN 68 -14.092 9.561 -12.143
533 HB2 GLN 68 HB2 GLN 68 -16.347 10.412 -12.361
534 HB3 GLN 68 HB1 GLN 68 -15.764 12.069 -12.348
535 HG2 GLN 68 HG2 GLN 68 -14.685 11.748 -14.481
536 HG3 GLN 68 HG1 GLN 68 -15.146 10.047 -14.487
537 HE21 GLN 68 HE21 GLN 68 -17.271 12.546 -13.318
538 HE22 GLN 68 HE22 GLN 68 -18.413 12.447 -14.613
539 HA PRO 69 HA PRO 69 -10.492 12.028 -13.100
540 HB2 PRO 69 HB2 PRO 69 -9.607 10.571 -15.185
541 HB3 PRO 69 HB1 PRO 69 -9.473 9.992 -13.520
542 HG2 PRO 69 HG2 PRO 69 -11.494 9.290 -15.614
543 HG3 PRO 69 HG1 PRO 69 -10.653 8.227 -14.473
544 HD2 PRO 69 HD2 PRO 69 -13.200 9.120 -14.092
545 HD3 PRO 69 HD1 PRO 69 -12.101 8.712 -12.761
546 H PHE 70 HN PHE 70 -10.042 13.677 -14.501
547 HA PHE 70 HA PHE 70 -11.800 13.939 -16.852
548 HB2 PHE 70 HB2 PHE 70 -10.618 16.189 -15.211
549 HB3 PHE 70 HB1 PHE 70 -11.722 16.352 -16.575
550 HD1 PHE 70 HD1 PHE 70 -11.497 16.329 -13.103
551 HD2 PHE 70 HD2 PHE 70 -13.985 14.990 -16.282
552 HE1 PHE 70 HE1 PHE 70 -13.408 16.217 -11.557
553 HE2 PHE 70 HE2 PHE 70 -15.900 14.879 -14.745
554 HZ PHE 70 HZ PHE 70 -15.611 15.495 -12.378
555 H LYS 71 HN LYS 71 -9.552 12.520 -17.154
556 HA LYS 71 HA LYS 71 -7.513 14.327 -18.240
557 HB2 LYS 71 HB2 LYS 71 -6.889 12.532 -16.598
558 HB3 LYS 71 HB1 LYS 71 -7.335 11.342 -17.809
559 HG2 LYS 71 HG2 LYS 71 -4.993 11.551 -17.911
560 HG3 LYS 71 HG1 LYS 71 -5.617 12.419 -19.314
561 HD2 LYS 71 HD2 LYS 71 -5.325 14.537 -18.174
562 HD3 LYS 71 HD1 LYS 71 -4.813 13.705 -16.705
563 HE2 LYS 71 HE2 LYS 71 -2.893 12.768 -17.969
564 HE3 LYS 71 HE1 LYS 71 -3.383 13.733 -19.360
565 HZ1 LYS 71 HZ1 LYS 71 -3.078 15.730 -18.000
566 HZ2 LYS 71 HZ2 LYS 71 -1.647 14.843 -18.143
567 HZ3 LYS 71 HZ3 LYS 71 -2.542 14.775 -16.711
568 H HIS 72 HN HIS 72 -9.436 14.600 -19.869
569 HA HIS 72 HA HIS 72 -9.902 12.384 -21.653
570 HB2 HIS 72 HB2 HIS 72 -10.790 15.261 -21.936
571 HB3 HIS 72 HB1 HIS 72 -11.413 13.885 -22.835
572 HD1 HIS 72 HD1 HIS 72 -12.234 15.947 -20.070
573 HD2 HIS 72 HD2 HIS 72 -12.598 11.886 -20.877
574 HE1 HIS 72 HE1 HIS 72 -13.973 15.094 -18.469
575 HE2 HIS 72 HE2 HIS 72 -14.323 12.689 -19.124
576 H ILE 73 HN ILE 73 -7.186 13.555 -21.441
577 HA ILE 73 HA ILE 73 -6.689 14.698 -24.055
578 HB ILE 73 HB ILE 73 -4.708 13.785 -21.955
579 HG12 ILE 73 HG12 ILE 73 -5.816 16.553 -22.479
580 HG13 ILE 73 HG11 ILE 73 -6.251 15.529 -21.116
581 HG21 ILE 73 HG21 ILE 73 -3.136 15.268 -23.116
582 HG22 ILE 73 HG22 ILE 73 -4.367 15.614 -24.331
583 HG23 ILE 73 HG23 ILE 73 -3.720 13.981 -24.170
584 HD11 ILE 73 HD11 ILE 73 -3.953 15.629 -20.308
585 HD12 ILE 73 HD12 ILE 73 -4.652 17.238 -20.473
586 HD13 ILE 73 HD13 ILE 73 -3.514 16.645 -21.681
587 H ASN 74 HN ASN 74 -6.844 11.639 -22.545
588 HA ASN 74 HA ASN 74 -5.216 10.250 -24.479
589 HB2 ASN 74 HB2 ASN 74 -7.121 9.150 -22.398
590 HB3 ASN 74 HB1 ASN 74 -5.980 8.204 -23.345
591 HD21 ASN 74 HD21 ASN 74 -6.435 10.231 -20.622
592 HD22 ASN 74 HD22 ASN 74 -4.813 10.153 -20.024
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 -4.329 17.012 -3.339
2 H2 MET 1 HT2 MET 1 -2.678 16.647 -3.310
3 H3 MET 1 HT3 MET 1 -3.760 15.755 -2.364
4 HA MET 1 HA MET 1 -4.801 14.825 -4.255
5 HB2 MET 1 HB2 MET 1 -4.003 15.287 -6.523
6 HB3 MET 1 HB1 MET 1 -4.588 16.749 -5.749
7 HG2 MET 1 HG2 MET 1 -2.352 17.483 -5.339
8 HG3 MET 1 HG1 MET 1 -1.697 15.985 -5.995
9 HE1 MET 1 HE1 MET 1 -2.004 15.265 -8.546
10 HE2 MET 1 HE2 MET 1 -2.717 16.297 -9.784
11 HE3 MET 1 HE3 MET 1 -3.738 15.590 -8.532
12 H ALA 2 HN ALA 2 -3.101 13.721 -6.254
13 HA ALA 2 HA ALA 2 -2.216 11.528 -4.830
14 HB1 ALA 2 HB1 ALA 2 -2.777 11.475 -7.199
15 HB2 ALA 2 HB2 ALA 2 -1.187 10.770 -6.898
16 HB3 ALA 2 HB3 ALA 2 -1.319 12.396 -7.569
17 H SER 3 HN SER 3 -0.307 14.330 -5.870
18 HA SER 3 HA SER 3 2.218 13.185 -5.431
19 HB2 SER 3 HB2 SER 3 1.852 15.261 -6.738
20 HB3 SER 3 HB1 SER 3 1.456 16.110 -5.246
21 HG SER 3 HG SER 3 3.532 15.942 -4.578
22 H ASP 4 HN ASP 4 0.217 15.209 -3.301
23 HA ASP 4 HA ASP 4 2.034 15.193 -1.129
24 HB2 ASP 4 HB2 ASP 4 0.251 16.864 -1.318
25 HB3 ASP 4 HB1 ASP 4 -0.966 15.605 -1.147
26 H MET 5 HN MET 5 -0.679 13.158 -2.047
27 HA MET 5 HA MET 5 -0.704 11.583 0.306
28 HB2 MET 5 HB2 MET 5 -2.545 11.801 -1.448
29 HB3 MET 5 HB1 MET 5 -1.621 10.655 -2.411
30 HG2 MET 5 HG2 MET 5 -3.386 9.544 -1.169
31 HG3 MET 5 HG1 MET 5 -1.795 9.000 -0.640
32 HE1 MET 5 HE1 MET 5 -2.906 7.942 1.557
33 HE2 MET 5 HE2 MET 5 -4.492 8.500 1.021
34 HE3 MET 5 HE3 MET 5 -3.939 8.857 2.658
35 H GLU 6 HN GLU 6 1.002 11.320 -2.782
36 HA GLU 6 HA GLU 6 2.170 8.810 -2.463
37 HB2 GLU 6 HB2 GLU 6 2.442 9.957 -4.538
38 HB3 GLU 6 HB1 GLU 6 3.211 11.333 -3.757
39 HG2 GLU 6 HG2 GLU 6 5.068 9.751 -3.106
40 HG3 GLU 6 HG1 GLU 6 4.327 8.587 -4.200
41 H GLU 7 HN GLU 7 3.256 11.980 -1.312
42 HA GLU 7 HA GLU 7 5.608 11.113 -0.051
43 HB2 GLU 7 HB2 GLU 7 3.815 13.444 0.641
44 HB3 GLU 7 HB1 GLU 7 5.450 13.213 1.243
45 HG2 GLU 7 HG2 GLU 7 6.230 13.250 -1.127
46 HG3 GLU 7 HG1 GLU 7 4.589 13.700 -1.584
47 H LYS 8 HN LYS 8 2.272 11.310 1.069
48 HA LYS 8 HA LYS 8 2.716 10.625 3.759
49 HB2 LYS 8 HB2 LYS 8 0.316 10.035 2.011
50 HB3 LYS 8 HB1 LYS 8 0.350 9.902 3.757
51 HG2 LYS 8 HG2 LYS 8 0.805 12.434 2.247
52 HG3 LYS 8 HG1 LYS 8 -0.722 11.949 2.977
53 HD2 LYS 8 HD2 LYS 8 0.404 11.850 5.170
54 HD3 LYS 8 HD1 LYS 8 1.883 12.441 4.411
55 HE2 LYS 8 HE2 LYS 8 -0.751 13.908 4.495
56 HE3 LYS 8 HE1 LYS 8 0.634 14.237 5.532
57 HZ1 LYS 8 HZ1 LYS 8 0.398 14.655 2.606
58 HZ2 LYS 8 HZ2 LYS 8 1.895 14.642 3.400
59 HZ3 LYS 8 HZ3 LYS 8 0.736 15.798 3.810
60 H PHE 9 HN PHE 9 2.164 8.613 0.883
61 HA PHE 9 HA PHE 9 2.249 6.146 2.312
62 HB2 PHE 9 HB2 PHE 9 2.583 6.785 -0.621
63 HB3 PHE 9 HB1 PHE 9 2.572 5.146 0.019
64 HD1 PHE 9 HD1 PHE 9 0.447 5.080 1.916
65 HD2 PHE 9 HD2 PHE 9 0.652 7.168 -1.785
66 HE1 PHE 9 HE1 PHE 9 -2.006 5.016 1.749
67 HE2 PHE 9 HE2 PHE 9 -1.802 7.107 -1.960
68 HZ PHE 9 HZ PHE 9 -3.134 6.030 -0.190
69 H ARG 10 HN ARG 10 4.610 8.061 0.535
70 HA ARG 10 HA ARG 10 6.780 6.304 0.629
71 HB2 ARG 10 HB2 ARG 10 6.856 8.271 -0.752
72 HB3 ARG 10 HB1 ARG 10 6.647 9.319 0.641
73 HG2 ARG 10 HG2 ARG 10 8.856 8.710 1.456
74 HG3 ARG 10 HG1 ARG 10 9.063 7.607 0.096
75 HD2 ARG 10 HD2 ARG 10 8.938 9.438 -1.464
76 HD3 ARG 10 HD1 ARG 10 8.596 10.563 -0.158
77 HE ARG 10 HE ARG 10 11.055 9.257 0.315
78 HH11 ARG 10 HH11 ARG 10 9.603 11.628 -1.805
79 HH12 ARG 10 HH12 ARG 10 11.066 12.533 -2.018
80 HH21 ARG 10 HH21 ARG 10 13.008 10.445 0.034
81 HH22 ARG 10 HH22 ARG 10 13.007 11.857 -0.973
82 H GLU 11 HN GLU 11 5.756 8.794 2.886
83 HA GLU 11 HA GLU 11 7.791 8.587 4.764
84 HB2 GLU 11 HB2 GLU 11 6.256 10.392 4.807
85 HB3 GLU 11 HB1 GLU 11 4.889 9.318 5.048
86 HG2 GLU 11 HG2 GLU 11 5.926 8.692 7.251
87 HG3 GLU 11 HG1 GLU 11 7.066 10.014 6.995
88 H ALA 12 HN ALA 12 4.743 6.827 4.528
89 HA ALA 12 HA ALA 12 5.125 5.309 6.908
90 HB1 ALA 12 HB1 ALA 12 3.238 3.978 6.130
91 HB2 ALA 12 HB2 ALA 12 3.346 4.732 4.540
92 HB3 ALA 12 HB3 ALA 12 2.902 5.699 5.946
93 H PHE 13 HN PHE 13 5.745 4.772 3.486
94 HA PHE 13 HA PHE 13 6.439 2.075 3.564
95 HB2 PHE 13 HB2 PHE 13 6.077 3.496 1.511
96 HB3 PHE 13 HB1 PHE 13 7.685 4.164 1.767
97 HD1 PHE 13 HD1 PHE 13 9.651 2.902 1.231
98 HD2 PHE 13 HD2 PHE 13 5.786 1.160 0.894
99 HE1 PHE 13 HE1 PHE 13 10.611 1.019 -0.028
100 HE2 PHE 13 HE2 PHE 13 6.735 -0.723 -0.359
101 HZ PHE 13 HZ PHE 13 9.152 -0.799 -0.825
102 H ILE 14 HN ILE 14 8.453 4.966 3.971
103 HA ILE 14 HA ILE 14 10.930 3.679 4.213
104 HB ILE 14 HB ILE 14 10.029 6.257 5.512
105 HG12 ILE 14 HG12 ILE 14 11.559 5.804 2.940
106 HG13 ILE 14 HG11 ILE 14 9.842 6.188 3.025
107 HG21 ILE 14 HG21 ILE 14 12.397 6.800 5.681
108 HG22 ILE 14 HG22 ILE 14 12.817 5.230 4.994
109 HG23 ILE 14 HG23 ILE 14 12.031 5.319 6.570
110 HD11 ILE 14 HD11 ILE 14 12.100 7.941 3.967
111 HD12 ILE 14 HD12 ILE 14 10.381 8.326 4.079
112 HD13 ILE 14 HD13 ILE 14 11.147 8.156 2.498
113 H LEU 15 HN LEU 15 8.429 4.345 6.596
114 HA LEU 15 HA LEU 15 9.943 3.699 8.885
115 HB2 LEU 15 HB2 LEU 15 8.112 4.981 9.378
116 HB3 LEU 15 HB1 LEU 15 7.096 4.181 8.197
117 HG LEU 15 HG LEU 15 7.037 2.208 9.734
118 HD11 LEU 15 HD11 LEU 15 8.983 2.711 11.096
119 HD12 LEU 15 HD12 LEU 15 7.540 2.618 12.104
120 HD13 LEU 15 HD13 LEU 15 8.215 4.189 11.677
121 HD21 LEU 15 HD21 LEU 15 5.898 4.799 10.764
122 HD22 LEU 15 HD22 LEU 15 5.322 3.181 11.166
123 HD23 LEU 15 HD23 LEU 15 5.186 3.780 9.513
124 H PHE 16 HN PHE 16 7.651 1.854 6.889
125 HA PHE 16 HA PHE 16 7.901 -0.504 8.497
126 HB2 PHE 16 HB2 PHE 16 6.570 0.075 5.863
127 HB3 PHE 16 HB1 PHE 16 6.654 -1.558 6.510
128 HD1 PHE 16 HD1 PHE 16 5.216 -2.265 8.260
129 HD2 PHE 16 HD2 PHE 16 5.350 1.837 7.124
130 HE1 PHE 16 HE1 PHE 16 3.227 -1.823 9.628
131 HE2 PHE 16 HE2 PHE 16 3.350 2.280 8.486
132 HZ PHE 16 HZ PHE 16 2.287 0.448 9.740
133 H SER 17 HN SER 17 9.523 0.725 5.660
134 HA SER 17 HA SER 17 10.708 -1.868 5.078
135 HB2 SER 17 HB2 SER 17 11.214 0.774 3.702
136 HB3 SER 17 HB1 SER 17 11.628 -0.832 3.103
137 HG SER 17 HG SER 17 9.067 0.316 3.435
138 H SER 18 HN SER 18 11.441 0.913 6.879
139 HA SER 18 HA SER 18 13.184 1.487 8.196
140 HB2 SER 18 HB2 SER 18 13.223 -0.941 8.778
141 HB3 SER 18 HB1 SER 18 14.386 -1.198 7.481
142 HG SER 18 HG SER 18 15.879 -0.593 8.808
143 H CYS 19 HN CYS 19 13.357 2.943 6.250
144 HA CYS 19 HA CYS 19 14.594 4.118 4.753
145 HB2 CYS 19 HB2 CYS 19 16.874 2.847 6.277
146 HB3 CYS 19 HB1 CYS 19 17.041 4.200 5.163
147 HG CYS 19 HG CYS 19 15.268 4.250 8.091
148 H SER 20 HN SER 20 13.590 2.026 3.507
149 HA SER 20 HA SER 20 15.726 1.221 1.694
150 HB2 SER 20 HB2 SER 20 15.468 -0.631 3.330
151 HB3 SER 20 HB1 SER 20 13.764 -0.751 2.900
152 HG SER 20 HG SER 20 16.013 -1.602 1.528
153 H ASP 21 HN ASP 21 14.870 0.353 -0.340
154 HA ASP 21 HA ASP 21 12.346 1.657 -1.057
155 HB2 ASP 21 HB2 ASP 21 13.067 1.406 -3.379
156 HB3 ASP 21 HB1 ASP 21 14.320 2.201 -2.436
157 H HIS 22 HN HIS 22 13.305 -1.229 0.040
158 HA HIS 22 HA HIS 22 11.235 -2.661 -1.483
159 HB2 HIS 22 HB2 HIS 22 13.904 -3.580 -0.481
160 HB3 HIS 22 HB1 HIS 22 12.586 -4.739 -0.626
161 HD1 HIS 22 HD1 HIS 22 15.383 -4.113 -2.417
162 HD2 HIS 22 HD2 HIS 22 11.373 -3.931 -3.482
163 HE1 HIS 22 HE1 HIS 22 15.333 -4.415 -4.910
164 HE2 HIS 22 HE2 HIS 22 12.883 -4.625 -5.463
165 H ILE 23 HN ILE 23 9.673 -3.686 -0.357
166 HA ILE 23 HA ILE 23 9.775 -3.393 2.571
167 HB ILE 23 HB ILE 23 8.065 -1.986 1.592
168 HG12 ILE 23 HG12 ILE 23 6.022 -3.012 2.705
169 HG13 ILE 23 HG11 ILE 23 7.036 -4.404 3.061
170 HG21 ILE 23 HG21 ILE 23 7.692 -3.179 -0.489
171 HG22 ILE 23 HG22 ILE 23 6.168 -2.904 0.355
172 HG23 ILE 23 HG23 ILE 23 6.920 -4.498 0.390
173 HD11 ILE 23 HD11 ILE 23 8.556 -2.947 4.305
174 HD12 ILE 23 HD12 ILE 23 6.920 -2.940 4.959
175 HD13 ILE 23 HD13 ILE 23 7.485 -1.584 3.983
176 H GLU 24 HN GLU 24 9.528 -5.135 3.812
177 HA GLU 24 HA GLU 24 9.294 -7.759 2.713
178 HB2 GLU 24 HB2 GLU 24 9.177 -6.733 5.552
179 HB3 GLU 24 HB1 GLU 24 9.162 -8.438 5.117
180 HG2 GLU 24 HG2 GLU 24 11.313 -8.183 4.057
181 HG3 GLU 24 HG1 GLU 24 11.358 -6.485 4.510
182 H MET 25 HN MET 25 7.597 -9.127 2.749
183 HA MET 25 HA MET 25 5.062 -8.066 2.331
184 HB2 MET 25 HB2 MET 25 6.060 -10.849 2.801
185 HB3 MET 25 HB1 MET 25 4.337 -10.535 2.647
186 HG2 MET 25 HG2 MET 25 6.400 -9.786 0.592
187 HG3 MET 25 HG1 MET 25 5.416 -11.247 0.545
188 HE1 MET 25 HE1 MET 25 5.560 -9.147 -1.856
189 HE2 MET 25 HE2 MET 25 3.857 -9.082 -2.310
190 HE3 MET 25 HE3 MET 25 4.595 -10.625 -1.883
191 H TYR 26 HN TYR 26 6.526 -9.225 5.312
192 HA TYR 26 HA TYR 26 4.011 -9.505 6.650
193 HB2 TYR 26 HB2 TYR 26 5.204 -10.260 8.458
194 HB3 TYR 26 HB1 TYR 26 6.319 -10.628 7.165
195 HD1 TYR 26 HD1 TYR 26 8.182 -8.886 6.718
196 HD2 TYR 26 HD2 TYR 26 5.907 -9.040 10.303
197 HE1 TYR 26 HE1 TYR 26 9.940 -7.625 7.879
198 HE2 TYR 26 HE2 TYR 26 7.658 -7.778 11.478
199 HH TYR 26 HH TYR 26 10.102 -7.348 11.238
200 H LYS 27 HN LYS 27 6.355 -6.946 6.254
201 HA LYS 27 HA LYS 27 4.945 -5.183 8.080
202 HB2 LYS 27 HB2 LYS 27 7.372 -4.899 6.335
203 HB3 LYS 27 HB1 LYS 27 6.594 -3.478 7.012
204 HG2 LYS 27 HG2 LYS 27 7.656 -5.784 8.626
205 HG3 LYS 27 HG1 LYS 27 8.516 -4.274 8.328
206 HD2 LYS 27 HD2 LYS 27 6.638 -3.054 9.400
207 HD3 LYS 27 HD1 LYS 27 5.903 -4.608 9.798
208 HE2 LYS 27 HE2 LYS 27 7.113 -3.758 11.711
209 HE3 LYS 27 HE1 LYS 27 7.918 -5.197 11.089
210 HZ1 LYS 27 HZ1 LYS 27 9.489 -3.441 11.642
211 HZ2 LYS 27 HZ2 LYS 27 8.745 -2.398 10.541
212 HZ3 LYS 27 HZ3 LYS 27 9.531 -3.790 9.988
213 H PHE 28 HN PHE 28 5.200 -5.842 4.680
214 HA PHE 28 HA PHE 28 4.111 -3.525 3.601
215 HB2 PHE 28 HB2 PHE 28 5.133 -5.082 2.124
216 HB3 PHE 28 HB1 PHE 28 4.066 -6.381 2.645
217 HD1 PHE 28 HD1 PHE 28 4.177 -3.188 0.786
218 HD2 PHE 28 HD2 PHE 28 2.002 -6.749 1.610
219 HE1 PHE 28 HE1 PHE 28 2.625 -2.657 -1.044
220 HE2 PHE 28 HE2 PHE 28 0.440 -6.231 -0.211
221 HZ PHE 28 HZ PHE 28 0.744 -4.179 -1.549
222 H PHE 29 HN PHE 29 2.468 -6.442 4.773
223 HA PHE 29 HA PHE 29 -0.073 -5.666 3.809
224 HB2 PHE 29 HB2 PHE 29 0.777 -7.995 4.633
225 HB3 PHE 29 HB1 PHE 29 0.242 -7.430 6.213
226 HD1 PHE 29 HD1 PHE 29 -0.776 -8.771 3.006
227 HD2 PHE 29 HD2 PHE 29 -2.147 -6.793 6.534
228 HE1 PHE 29 HE1 PHE 29 -3.086 -9.435 2.490
229 HE2 PHE 29 HE2 PHE 29 -4.453 -7.443 6.007
230 HZ PHE 29 HZ PHE 29 -4.928 -8.773 3.987
231 H GLU 30 HN GLU 30 1.622 -5.114 6.843
232 HA GLU 30 HA GLU 30 -0.480 -3.803 8.204
233 HB2 GLU 30 HB2 GLU 30 2.356 -2.966 8.550
234 HB3 GLU 30 HB1 GLU 30 1.114 -3.184 9.770
235 HG2 GLU 30 HG2 GLU 30 2.663 -5.312 8.333
236 HG3 GLU 30 HG1 GLU 30 2.790 -4.862 10.025
237 H LEU 31 HN LEU 31 1.931 -2.814 5.916
238 HA LEU 31 HA LEU 31 1.827 -0.048 6.215
239 HB2 LEU 31 HB2 LEU 31 3.655 -1.038 5.082
240 HB3 LEU 31 HB1 LEU 31 2.602 -1.841 3.938
241 HG LEU 31 HG LEU 31 2.004 0.476 3.072
242 HD11 LEU 31 HD11 LEU 31 4.447 1.198 4.677
243 HD12 LEU 31 HD12 LEU 31 2.805 1.781 4.953
244 HD13 LEU 31 HD13 LEU 31 3.664 2.227 3.479
245 HD21 LEU 31 HD21 LEU 31 3.985 0.576 1.672
246 HD22 LEU 31 HD22 LEU 31 3.468 -1.094 1.898
247 HD23 LEU 31 HD23 LEU 31 4.852 -0.470 2.796
248 H MET 32 HN MET 32 -0.160 -2.193 4.261
249 HA MET 32 HA MET 32 -1.376 0.174 3.058
250 HB2 MET 32 HB2 MET 32 -2.455 -1.701 1.537
251 HB3 MET 32 HB1 MET 32 -0.833 -1.089 1.248
252 HG2 MET 32 HG2 MET 32 -0.748 -3.420 1.039
253 HG3 MET 32 HG1 MET 32 0.004 -3.031 2.586
254 HE1 MET 32 HE1 MET 32 -2.074 -5.313 0.819
255 HE2 MET 32 HE2 MET 32 -2.539 -6.366 2.156
256 HE3 MET 32 HE3 MET 32 -0.843 -5.945 1.909
257 H ASN 33 HN ASN 33 -2.301 -2.596 5.040
258 HA ASN 33 HA ASN 33 -5.086 -2.118 4.726
259 HB2 ASN 33 HB2 ASN 33 -5.493 -3.734 6.326
260 HB3 ASN 33 HB1 ASN 33 -3.917 -4.239 5.727
261 HD21 ASN 33 HD21 ASN 33 -2.130 -4.035 7.053
262 HD22 ASN 33 HD22 ASN 33 -2.267 -3.721 8.751
263 H SER 34 HN SER 34 -2.615 -0.600 6.538
264 HA SER 34 HA SER 34 -4.207 0.408 8.667
265 HB2 SER 34 HB2 SER 34 -2.235 2.026 8.921
266 HB3 SER 34 HB1 SER 34 -1.899 0.304 9.098
267 HG SER 34 HG SER 34 -0.745 0.325 7.327
268 H PHE 35 HN PHE 35 -3.673 1.431 5.410
269 HA PHE 35 HA PHE 35 -4.738 4.090 5.920
270 HB2 PHE 35 HB2 PHE 35 -3.661 2.739 3.455
271 HB3 PHE 35 HB1 PHE 35 -4.471 4.301 3.381
272 HD1 PHE 35 HD1 PHE 35 -3.488 6.256 4.508
273 HD2 PHE 35 HD2 PHE 35 -1.436 2.537 4.269
274 HE1 PHE 35 HE1 PHE 35 -1.378 7.392 5.062
275 HE2 PHE 35 HE2 PHE 35 0.679 3.664 4.828
276 HZ PHE 35 HZ PHE 35 0.710 6.096 5.226
277 H GLY 36 HN GLY 36 -6.120 1.205 5.777
278 HA2 GLY 36 HA2 GLY 36 -8.420 0.794 5.696
279 HA3 GLY 36 HA1 GLY 36 -8.646 2.332 4.872
280 H ILE 37 HN ILE 37 -6.139 0.692 3.455
281 HA ILE 37 HA ILE 37 -7.772 -0.087 1.187
282 HB ILE 37 HB ILE 37 -4.775 -0.204 1.585
283 HG12 ILE 37 HG12 ILE 37 -6.432 1.769 -0.000
284 HG13 ILE 37 HG11 ILE 37 -5.762 2.090 1.595
285 HG21 ILE 37 HG21 ILE 37 -6.421 -0.566 -0.917
286 HG22 ILE 37 HG22 ILE 37 -5.522 -1.824 -0.068
287 HG23 ILE 37 HG23 ILE 37 -4.661 -0.497 -0.848
288 HD11 ILE 37 HD11 ILE 37 -4.411 3.071 -0.177
289 HD12 ILE 37 HD12 ILE 37 -4.167 1.470 -0.877
290 HD13 ILE 37 HD13 ILE 37 -3.517 1.842 0.720
291 H ILE 38 HN ILE 38 -8.435 -2.123 0.836
292 HA ILE 38 HA ILE 38 -7.266 -4.215 2.521
293 HB ILE 38 HB ILE 38 -9.354 -5.528 1.740
294 HG12 ILE 38 HG12 ILE 38 -10.254 -2.675 1.260
295 HG13 ILE 38 HG11 ILE 38 -10.110 -3.936 0.038
296 HG21 ILE 38 HG21 ILE 38 -8.911 -4.855 4.017
297 HG22 ILE 38 HG22 ILE 38 -10.618 -4.620 3.638
298 HG23 ILE 38 HG23 ILE 38 -9.526 -3.236 3.687
299 HD11 ILE 38 HD11 ILE 38 -11.875 -5.204 1.130
300 HD12 ILE 38 HD12 ILE 38 -12.423 -3.584 0.703
301 HD13 ILE 38 HD13 ILE 38 -12.008 -3.962 2.373
302 H LEU 39 HN LEU 39 -6.195 -5.806 1.729
303 HA LEU 39 HA LEU 39 -6.257 -6.405 -1.145
304 HB2 LEU 39 HB2 LEU 39 -4.342 -4.845 -0.436
305 HB3 LEU 39 HB1 LEU 39 -3.718 -6.198 0.476
306 HG LEU 39 HG LEU 39 -4.112 -6.262 -2.519
307 HD11 LEU 39 HD11 LEU 39 -1.578 -5.777 -0.960
308 HD12 LEU 39 HD12 LEU 39 -2.452 -4.554 -1.880
309 HD13 LEU 39 HD13 LEU 39 -1.721 -5.932 -2.711
310 HD21 LEU 39 HD21 LEU 39 -2.486 -7.992 -0.681
311 HD22 LEU 39 HD22 LEU 39 -2.641 -8.159 -2.434
312 HD23 LEU 39 HD23 LEU 39 -4.040 -8.436 -1.388
313 H THR 40 HN THR 40 -6.585 -8.584 -1.389
314 HA THR 40 HA THR 40 -6.651 -10.124 1.070
315 HB THR 40 HB THR 40 -7.653 -11.905 -0.517
316 HG1 THR 40 HG1 THR 40 -7.769 -11.324 -2.539
317 HG21 THR 40 HG21 THR 40 -8.964 -10.702 1.127
318 HG22 THR 40 HG22 THR 40 -9.863 -10.806 -0.387
319 HG23 THR 40 HG23 THR 40 -9.064 -9.299 0.062
320 H ASN 41 HN ASN 41 -6.071 -12.513 0.895
321 HA ASN 41 HA ASN 41 -3.316 -12.744 0.729
322 HB2 ASN 41 HB2 ASN 41 -4.715 -14.272 2.033
323 HB3 ASN 41 HB1 ASN 41 -5.382 -14.945 0.550
324 HD21 ASN 41 HD21 ASN 41 -2.587 -14.735 2.601
325 HD22 ASN 41 HD22 ASN 41 -1.721 -16.057 1.898
326 H ASP 42 HN ASP 42 -5.763 -13.784 -1.614
327 HA ASP 42 HA ASP 42 -4.026 -14.992 -3.442
328 HB2 ASP 42 HB2 ASP 42 -5.829 -14.926 -5.017
329 HB3 ASP 42 HB1 ASP 42 -6.540 -15.184 -3.430
330 H GLU 43 HN GLU 43 -5.012 -11.633 -3.075
331 HA GLU 43 HA GLU 43 -3.852 -10.750 -5.517
332 HB2 GLU 43 HB2 GLU 43 -4.610 -9.182 -3.060
333 HB3 GLU 43 HB1 GLU 43 -4.174 -8.482 -4.608
334 HG2 GLU 43 HG2 GLU 43 -6.105 -9.727 -5.602
335 HG3 GLU 43 HG1 GLU 43 -6.584 -10.146 -3.956
336 H LYS 44 HN LYS 44 -2.764 -10.600 -2.119
337 HA LYS 44 HA LYS 44 -0.405 -9.215 -2.642
338 HB2 LYS 44 HB2 LYS 44 0.441 -9.963 -0.498
339 HB3 LYS 44 HB1 LYS 44 -1.195 -9.353 -0.381
340 HG2 LYS 44 HG2 LYS 44 -2.073 -11.458 0.003
341 HG3 LYS 44 HG1 LYS 44 -0.637 -12.282 -0.610
342 HD2 LYS 44 HD2 LYS 44 -0.889 -10.705 1.952
343 HD3 LYS 44 HD1 LYS 44 -0.702 -12.451 1.800
344 HE2 LYS 44 HE2 LYS 44 1.462 -11.875 2.241
345 HE3 LYS 44 HE1 LYS 44 1.480 -11.748 0.484
346 HZ1 LYS 44 HZ1 LYS 44 2.492 -9.803 1.247
347 HZ2 LYS 44 HZ2 LYS 44 1.358 -9.570 2.481
348 HZ3 LYS 44 HZ3 LYS 44 0.916 -9.306 0.869
349 H ALA 45 HN ALA 45 -1.133 -12.616 -2.778
350 HA ALA 45 HA ALA 45 1.503 -13.562 -3.144
351 HB1 ALA 45 HB1 ALA 45 -0.373 -15.021 -2.555
352 HB2 ALA 45 HB2 ALA 45 0.459 -15.588 -4.002
353 HB3 ALA 45 HB3 ALA 45 -1.085 -14.747 -4.145
354 H ALA 46 HN ALA 46 -0.742 -11.978 -5.252
355 HA ALA 46 HA ALA 46 0.704 -12.757 -7.656
356 HB1 ALA 46 HB1 ALA 46 -1.719 -10.990 -7.346
357 HB2 ALA 46 HB2 ALA 46 -1.742 -12.718 -7.698
358 HB3 ALA 46 HB3 ALA 46 -1.053 -11.589 -8.864
359 H LEU 47 HN LEU 47 1.097 -10.460 -5.321
360 HA LEU 47 HA LEU 47 1.981 -8.293 -7.011
361 HB2 LEU 47 HB2 LEU 47 2.760 -8.705 -4.130
362 HB3 LEU 47 HB1 LEU 47 2.692 -7.200 -5.020
363 HG LEU 47 HG LEU 47 0.314 -8.827 -4.151
364 HD11 LEU 47 HD11 LEU 47 1.489 -6.272 -3.087
365 HD12 LEU 47 HD12 LEU 47 1.358 -7.823 -2.242
366 HD13 LEU 47 HD13 LEU 47 -0.095 -6.907 -2.641
367 HD21 LEU 47 HD21 LEU 47 0.342 -6.085 -5.362
368 HD22 LEU 47 HD22 LEU 47 -1.068 -7.038 -4.864
369 HD23 LEU 47 HD23 LEU 47 -0.076 -7.566 -6.228
370 HA PRO 48 HA PRO 48 6.078 -9.694 -7.964
371 HB2 PRO 48 HB2 PRO 48 7.109 -7.119 -6.891
372 HB3 PRO 48 HB1 PRO 48 7.341 -7.847 -8.483
373 HG2 PRO 48 HG2 PRO 48 5.702 -5.776 -8.167
374 HG3 PRO 48 HG1 PRO 48 5.294 -7.103 -9.273
375 HD2 PRO 48 HD2 PRO 48 4.240 -6.521 -6.537
376 HD3 PRO 48 HD1 PRO 48 3.391 -7.142 -7.968
377 H ASN 49 HN ASN 49 7.963 -10.487 -7.018
378 HA ASN 49 HA ASN 49 7.663 -11.404 -4.376
379 HB2 ASN 49 HB2 ASN 49 10.095 -11.415 -6.173
380 HB3 ASN 49 HB1 ASN 49 9.984 -12.290 -4.652
381 HD21 ASN 49 HD21 ASN 49 10.378 -13.241 -7.397
382 HD22 ASN 49 HD22 ASN 49 9.114 -14.391 -7.670
383 H ASP 50 HN ASP 50 9.445 -8.753 -5.755
384 HA ASP 50 HA ASP 50 9.926 -7.817 -3.020
385 HB2 ASP 50 HB2 ASP 50 11.923 -6.613 -3.797
386 HB3 ASP 50 HB1 ASP 50 12.086 -8.345 -4.046
387 H ILE 51 HN ILE 51 8.806 -6.084 -2.549
388 HA ILE 51 HA ILE 51 7.538 -4.634 -4.749
389 HB ILE 51 HB ILE 51 6.846 -4.672 -1.809
390 HG12 ILE 51 HG12 ILE 51 5.448 -5.878 -4.208
391 HG13 ILE 51 HG11 ILE 51 6.340 -6.774 -2.983
392 HG21 ILE 51 HG21 ILE 51 6.313 -2.519 -2.843
393 HG22 ILE 51 HG22 ILE 51 4.848 -3.416 -2.441
394 HG23 ILE 51 HG23 ILE 51 5.412 -3.351 -4.110
395 HD11 ILE 51 HD11 ILE 51 3.846 -5.161 -2.505
396 HD12 ILE 51 HD12 ILE 51 4.727 -6.098 -1.298
397 HD13 ILE 51 HD13 ILE 51 3.935 -6.916 -2.644
398 H ASN 52 HN ASN 52 8.368 -2.807 -5.342
399 HA ASN 52 HA ASN 52 10.162 -1.338 -3.595
400 HB2 ASN 52 HB2 ASN 52 10.847 -1.737 -5.913
401 HB3 ASN 52 HB1 ASN 52 9.399 -0.940 -6.501
402 HD21 ASN 52 HD21 ASN 52 12.531 -0.499 -5.041
403 HD22 ASN 52 HD22 ASN 52 12.627 1.203 -5.331
404 H MET 53 HN MET 53 9.885 1.050 -3.425
405 HA MET 53 HA MET 53 7.416 1.773 -2.399
406 HB2 MET 53 HB2 MET 53 9.495 2.986 -1.912
407 HB3 MET 53 HB1 MET 53 9.543 3.578 -3.568
408 HG2 MET 53 HG2 MET 53 7.399 4.731 -3.180
409 HG3 MET 53 HG1 MET 53 7.451 4.192 -1.505
410 HE1 MET 53 HE1 MET 53 10.595 6.070 -0.138
411 HE2 MET 53 HE2 MET 53 10.567 4.454 -0.840
412 HE3 MET 53 HE3 MET 53 9.274 4.969 0.244
413 H ASP 54 HN ASP 54 8.699 2.074 -5.661
414 HA ASP 54 HA ASP 54 6.749 3.814 -6.692
415 HB2 ASP 54 HB2 ASP 54 8.527 1.766 -8.002
416 HB3 ASP 54 HB1 ASP 54 7.393 2.740 -8.930
417 H TYR 55 HN TYR 55 6.783 0.287 -6.386
418 HA TYR 55 HA TYR 55 4.376 -0.157 -7.822
419 HB2 TYR 55 HB2 TYR 55 6.057 -1.948 -7.202
420 HB3 TYR 55 HB1 TYR 55 5.435 -1.858 -5.558
421 HD1 TYR 55 HD1 TYR 55 3.353 -2.909 -4.951
422 HD2 TYR 55 HD2 TYR 55 4.589 -2.767 -9.025
423 HE1 TYR 55 HE1 TYR 55 1.597 -4.499 -5.535
424 HE2 TYR 55 HE2 TYR 55 2.821 -4.366 -9.614
425 HH TYR 55 HH TYR 55 0.257 -5.088 -7.646
426 H TRP 56 HN TRP 56 5.111 0.384 -4.415
427 HA TRP 56 HA TRP 56 2.554 0.076 -3.361
428 HB2 TRP 56 HB2 TRP 56 4.495 0.185 -1.929
429 HB3 TRP 56 HB1 TRP 56 4.875 1.805 -2.485
430 HD1 TRP 56 HD1 TRP 56 4.686 3.108 -0.267
431 HE1 TRP 56 HE1 TRP 56 2.785 3.580 1.400
432 HE3 TRP 56 HE3 TRP 56 1.197 -0.154 -2.079
433 HZ2 TRP 56 HZ2 TRP 56 0.148 2.695 1.876
434 HZ3 TRP 56 HZ3 TRP 56 -0.995 -0.275 -0.964
435 HH2 TRP 56 HH2 TRP 56 -1.504 1.121 0.972
436 H LEU 57 HN LEU 57 4.194 2.991 -4.536
437 HA LEU 57 HA LEU 57 2.080 4.785 -4.048
438 HB2 LEU 57 HB2 LEU 57 4.142 4.966 -6.244
439 HB3 LEU 57 HB1 LEU 57 3.218 6.292 -5.560
440 HG LEU 57 HG LEU 57 5.232 4.640 -4.060
441 HD11 LEU 57 HD11 LEU 57 5.452 7.387 -5.273
442 HD12 LEU 57 HD12 LEU 57 6.361 5.946 -5.725
443 HD13 LEU 57 HD13 LEU 57 6.619 6.692 -4.149
444 HD21 LEU 57 HD21 LEU 57 3.648 7.095 -3.297
445 HD22 LEU 57 HD22 LEU 57 5.033 6.488 -2.385
446 HD23 LEU 57 HD23 LEU 57 3.585 5.497 -2.549
447 H ASN 58 HN ASN 58 2.995 3.007 -6.952
448 HA ASN 58 HA ASN 58 0.953 3.966 -8.633
449 HB2 ASN 58 HB2 ASN 58 2.886 2.855 -9.574
450 HB3 ASN 58 HB1 ASN 58 2.496 1.367 -8.720
451 HD21 ASN 58 HD21 ASN 58 1.633 3.469 -11.360
452 HD22 ASN 58 HD22 ASN 58 0.631 2.333 -12.190
453 H PHE 59 HN PHE 59 1.143 1.114 -6.562
454 HA PHE 59 HA PHE 59 -1.354 -0.003 -7.178
455 HB2 PHE 59 HB2 PHE 59 0.482 -1.125 -5.901
456 HB3 PHE 59 HB1 PHE 59 0.137 -0.074 -4.535
457 HD1 PHE 59 HD1 PHE 59 -0.480 -3.196 -6.012
458 HD2 PHE 59 HD2 PHE 59 -2.317 -0.194 -3.620
459 HE1 PHE 59 HE1 PHE 59 -2.082 -4.860 -5.162
460 HE2 PHE 59 HE2 PHE 59 -3.931 -1.846 -2.780
461 HZ PHE 59 HZ PHE 59 -3.815 -4.182 -3.553
462 H ALA 60 HN ALA 60 -0.353 2.358 -4.739
463 HA ALA 60 HA ALA 60 -2.915 2.567 -3.514
464 HB1 ALA 60 HB1 ALA 60 -0.606 4.501 -3.428
465 HB2 ALA 60 HB2 ALA 60 -0.829 3.120 -2.354
466 HB3 ALA 60 HB3 ALA 60 -1.977 4.458 -2.320
467 H LYS 61 HN LYS 61 -1.212 4.513 -5.946
468 HA LYS 61 HA LYS 61 -3.198 6.513 -6.100
469 HB2 LYS 61 HB2 LYS 61 -2.025 7.382 -7.967
470 HB3 LYS 61 HB1 LYS 61 -0.873 6.881 -6.742
471 HG2 LYS 61 HG2 LYS 61 0.130 6.003 -8.520
472 HG3 LYS 61 HG1 LYS 61 -0.933 4.653 -8.164
473 HD2 LYS 61 HD2 LYS 61 -1.121 5.064 -10.501
474 HD3 LYS 61 HD1 LYS 61 -2.595 5.657 -9.724
475 HE2 LYS 61 HE2 LYS 61 -1.739 7.206 -11.447
476 HE3 LYS 61 HE1 LYS 61 -1.798 7.933 -9.845
477 HZ1 LYS 61 HZ1 LYS 61 0.566 7.574 -9.619
478 HZ2 LYS 61 HZ2 LYS 61 0.253 8.462 -11.020
479 HZ3 LYS 61 HZ3 LYS 61 0.634 6.821 -11.130
480 H LYS 62 HN LYS 62 -2.861 3.434 -7.516
481 HA LYS 62 HA LYS 62 -4.740 3.754 -9.627
482 HB2 LYS 62 HB2 LYS 62 -3.099 2.001 -9.730
483 HB3 LYS 62 HB1 LYS 62 -3.612 1.360 -8.180
484 HG2 LYS 62 HG2 LYS 62 -5.681 0.591 -9.127
485 HG3 LYS 62 HG1 LYS 62 -5.295 1.349 -10.673
486 HD2 LYS 62 HD2 LYS 62 -4.855 -1.120 -10.592
487 HD3 LYS 62 HD1 LYS 62 -3.457 -0.139 -11.033
488 HE2 LYS 62 HE2 LYS 62 -2.679 -0.264 -8.688
489 HE3 LYS 62 HE1 LYS 62 -4.037 -1.320 -8.317
490 HZ1 LYS 62 HZ1 LYS 62 -1.924 -1.922 -10.309
491 HZ2 LYS 62 HZ2 LYS 62 -3.169 -2.958 -9.827
492 HZ3 LYS 62 HZ3 LYS 62 -1.953 -2.526 -8.732
493 H HIS 63 HN HIS 63 -4.956 3.133 -6.235
494 HA HIS 63 HA HIS 63 -7.643 2.128 -6.325
495 HB2 HIS 63 HB2 HIS 63 -5.767 2.819 -4.099
496 HB3 HIS 63 HB1 HIS 63 -7.481 2.568 -3.766
497 HD1 HIS 63 HD1 HIS 63 -7.737 0.259 -2.870
498 HD2 HIS 63 HD2 HIS 63 -5.031 0.434 -6.015
499 HE1 HIS 63 HE1 HIS 63 -7.054 -2.120 -3.310
500 HE2 HIS 63 HE2 HIS 63 -5.574 -1.999 -5.336
501 H TYR 64 HN TYR 64 -6.187 5.268 -6.075
502 HA TYR 64 HA TYR 64 -8.214 6.739 -4.820
503 HB2 TYR 64 HB2 TYR 64 -6.714 7.684 -7.252
504 HB3 TYR 64 HB1 TYR 64 -7.518 8.685 -6.062
505 HD1 TYR 64 HD1 TYR 64 -6.346 7.047 -3.661
506 HD2 TYR 64 HD2 TYR 64 -4.732 8.837 -7.140
507 HE1 TYR 64 HE1 TYR 64 -4.198 7.361 -2.479
508 HE2 TYR 64 HE2 TYR 64 -2.567 9.162 -5.991
509 HH TYR 64 HH TYR 64 -1.694 9.326 -3.743
510 H ASN 65 HN ASN 65 -7.819 5.703 -8.145
511 HA ASN 65 HA ASN 65 -10.029 7.262 -8.991
512 HB2 ASN 65 HB2 ASN 65 -8.230 5.339 -10.442
513 HB3 ASN 65 HB1 ASN 65 -9.621 6.076 -11.228
514 HD21 ASN 65 HD21 ASN 65 -8.268 7.088 -12.709
515 HD22 ASN 65 HD22 ASN 65 -7.329 8.477 -12.287
516 H TYR 66 HN TYR 66 -9.882 4.714 -7.298
517 HA TYR 66 HA TYR 66 -11.052 2.846 -6.808
518 HB2 TYR 66 HB2 TYR 66 -13.069 4.922 -7.503
519 HB3 TYR 66 HB1 TYR 66 -13.627 3.289 -7.141
520 HD1 TYR 66 HD1 TYR 66 -14.312 2.983 -4.972
521 HD2 TYR 66 HD2 TYR 66 -11.093 5.662 -5.720
522 HE1 TYR 66 HE1 TYR 66 -14.118 3.413 -2.561
523 HE2 TYR 66 HE2 TYR 66 -10.895 6.111 -3.315
524 HH TYR 66 HH TYR 66 -12.381 5.978 -1.277
525 H GLU 67 HN GLU 67 -9.856 2.232 -9.025
526 HA GLU 67 HA GLU 67 -11.396 1.401 -11.202
527 HB2 GLU 67 HB2 GLU 67 -8.938 0.111 -10.005
528 HB3 GLU 67 HB1 GLU 67 -9.591 -0.247 -11.598
529 HG2 GLU 67 HG2 GLU 67 -8.571 2.439 -10.700
530 HG3 GLU 67 HG1 GLU 67 -7.680 1.278 -11.682
531 H GLN 68 HN GLN 68 -10.786 -0.032 -8.081
532 HA GLN 68 HA GLN 68 -13.027 -1.871 -8.521
533 HB2 GLN 68 HB2 GLN 68 -10.832 -3.084 -8.685
534 HB3 GLN 68 HB1 GLN 68 -10.491 -2.588 -7.035
535 HG2 GLN 68 HG2 GLN 68 -11.284 -4.856 -7.055
536 HG3 GLN 68 HG1 GLN 68 -12.472 -3.818 -6.269
537 HE21 GLN 68 HE21 GLN 68 -12.053 -3.914 -9.734
538 HE22 GLN 68 HE22 GLN 68 -13.556 -4.691 -10.085
539 HA PRO 69 HA PRO 69 -13.942 0.988 -5.031
540 HB2 PRO 69 HB2 PRO 69 -16.536 -0.420 -5.476
541 HB3 PRO 69 HB1 PRO 69 -16.218 1.302 -5.232
542 HG2 PRO 69 HG2 PRO 69 -16.767 0.382 -7.654
543 HG3 PRO 69 HG1 PRO 69 -15.512 1.614 -7.426
544 HD2 PRO 69 HD2 PRO 69 -15.224 -1.315 -7.935
545 HD3 PRO 69 HD1 PRO 69 -14.244 0.037 -8.538
546 H PHE 70 HN PHE 70 -13.159 0.280 -3.148
547 HA PHE 70 HA PHE 70 -13.737 -2.462 -2.333
548 HB2 PHE 70 HB2 PHE 70 -11.796 -2.136 -0.779
549 HB3 PHE 70 HB1 PHE 70 -11.404 -2.055 -2.488
550 HD1 PHE 70 HD1 PHE 70 -10.906 0.126 -3.541
551 HD2 PHE 70 HD2 PHE 70 -11.459 -0.274 0.659
552 HE1 PHE 70 HE1 PHE 70 -9.811 2.301 -3.195
553 HE2 PHE 70 HE2 PHE 70 -10.368 1.903 1.012
554 HZ PHE 70 HZ PHE 70 -9.542 3.193 -0.915
555 H LYS 71 HN LYS 71 -15.408 0.099 -1.887
556 HA LYS 71 HA LYS 71 -15.574 0.116 1.005
557 HB2 LYS 71 HB2 LYS 71 -16.106 2.134 -0.419
558 HB3 LYS 71 HB1 LYS 71 -17.537 1.285 -0.979
559 HG2 LYS 71 HG2 LYS 71 -18.164 2.815 0.750
560 HG3 LYS 71 HG1 LYS 71 -18.339 1.168 1.356
561 HD2 LYS 71 HD2 LYS 71 -16.190 1.361 2.506
562 HD3 LYS 71 HD1 LYS 71 -16.004 3.005 1.892
563 HE2 LYS 71 HE2 LYS 71 -18.016 3.684 3.099
564 HE3 LYS 71 HE1 LYS 71 -18.215 2.038 3.699
565 HZ1 LYS 71 HZ1 LYS 71 -17.177 3.462 5.346
566 HZ2 LYS 71 HZ2 LYS 71 -15.913 3.821 4.282
567 HZ3 LYS 71 HZ3 LYS 71 -16.109 2.244 4.860
568 H HIS 72 HN HIS 72 -17.086 -1.345 -1.743
569 HA HIS 72 HA HIS 72 -18.339 -3.189 -2.020
570 HB2 HIS 72 HB2 HIS 72 -17.569 -3.616 0.856
571 HB3 HIS 72 HB1 HIS 72 -18.561 -4.770 -0.031
572 HD1 HIS 72 HD1 HIS 72 -15.068 -3.636 0.431
573 HD2 HIS 72 HD2 HIS 72 -17.197 -6.099 -2.154
574 HE1 HIS 72 HE1 HIS 72 -13.335 -4.959 -0.826
575 HE2 HIS 72 HE2 HIS 72 -14.644 -6.359 -2.467
576 H ILE 73 HN ILE 73 -19.334 -2.563 1.330
577 HA ILE 73 HA ILE 73 -21.925 -1.635 0.359
578 HB ILE 73 HB ILE 73 -23.190 -3.042 1.879
579 HG12 ILE 73 HG12 ILE 73 -21.318 -3.345 3.556
580 HG13 ILE 73 HG11 ILE 73 -22.283 -4.778 3.227
581 HG21 ILE 73 HG21 ILE 73 -22.945 -5.199 0.754
582 HG22 ILE 73 HG22 ILE 73 -21.396 -4.672 0.097
583 HG23 ILE 73 HG23 ILE 73 -22.882 -3.848 -0.377
584 HD11 ILE 73 HD11 ILE 73 -19.923 -5.312 3.415
585 HD12 ILE 73 HD12 ILE 73 -19.552 -4.193 2.103
586 HD13 ILE 73 HD13 ILE 73 -20.514 -5.637 1.785
587 H ASN 74 HN ASN 74 -23.179 -0.558 2.034
588 HA ASN 74 HA ASN 74 -21.481 0.686 4.057
589 HB2 ASN 74 HB2 ASN 74 -24.284 1.303 3.102
590 HB3 ASN 74 HB1 ASN 74 -23.512 2.146 4.437
591 HD21 ASN 74 HD21 ASN 74 -20.882 2.134 3.219
592 HD22 ASN 74 HD22 ASN 74 -20.936 3.297 1.938
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 -5.955 14.638 -2.557
2 H2 MET 1 HT2 MET 1 -6.738 13.739 -3.751
3 H3 MET 1 HT3 MET 1 -6.918 15.418 -3.705
4 HA MET 1 HA MET 1 -5.420 14.803 -5.461
5 HB2 MET 1 HB2 MET 1 -5.051 16.900 -4.143
6 HB3 MET 1 HB1 MET 1 -3.910 16.019 -3.138
7 HG2 MET 1 HG2 MET 1 -2.803 17.373 -4.850
8 HG3 MET 1 HG1 MET 1 -2.460 15.653 -5.029
9 HE1 MET 1 HE1 MET 1 -2.039 18.002 -7.288
10 HE2 MET 1 HE2 MET 1 -2.522 17.094 -8.720
11 HE3 MET 1 HE3 MET 1 -1.525 16.327 -7.485
12 H ALA 2 HN ALA 2 -4.337 13.112 -6.189
13 HA ALA 2 HA ALA 2 -3.511 11.014 -4.485
14 HB1 ALA 2 HB1 ALA 2 -4.302 10.674 -6.791
15 HB2 ALA 2 HB2 ALA 2 -2.746 9.904 -6.486
16 HB3 ALA 2 HB3 ALA 2 -2.819 11.415 -7.390
17 H SER 3 HN SER 3 -1.766 13.635 -6.043
18 HA SER 3 HA SER 3 0.848 12.720 -5.533
19 HB2 SER 3 HB2 SER 3 0.329 14.568 -7.099
20 HB3 SER 3 HB1 SER 3 -0.134 15.581 -5.734
21 HG SER 3 HG SER 3 2.289 15.197 -6.756
22 H ASP 4 HN ASP 4 -1.448 14.556 -3.597
23 HA ASP 4 HA ASP 4 0.324 15.156 -1.469
24 HB2 ASP 4 HB2 ASP 4 -1.806 16.352 -1.751
25 HB3 ASP 4 HB1 ASP 4 -2.689 14.863 -1.433
26 H MET 5 HN MET 5 -1.859 12.491 -2.156
27 HA MET 5 HA MET 5 -1.483 11.187 0.327
28 HB2 MET 5 HB2 MET 5 -2.422 10.103 -2.326
29 HB3 MET 5 HB1 MET 5 -2.463 9.205 -0.815
30 HG2 MET 5 HG2 MET 5 -3.979 11.711 -1.490
31 HG3 MET 5 HG1 MET 5 -4.637 10.096 -1.238
32 HE1 MET 5 HE1 MET 5 -2.766 9.245 1.346
33 HE2 MET 5 HE2 MET 5 -4.476 8.839 1.203
34 HE3 MET 5 HE3 MET 5 -3.880 9.645 2.653
35 H GLU 6 HN GLU 6 0.183 10.933 -2.793
36 HA GLU 6 HA GLU 6 1.534 8.536 -2.180
37 HB2 GLU 6 HB2 GLU 6 2.826 8.858 -4.131
38 HB3 GLU 6 HB1 GLU 6 1.225 9.484 -4.474
39 HG2 GLU 6 HG2 GLU 6 2.048 11.760 -4.119
40 HG3 GLU 6 HG1 GLU 6 3.660 11.110 -3.811
41 H GLU 7 HN GLU 7 2.458 11.916 -1.668
42 HA GLU 7 HA GLU 7 5.071 11.365 -0.769
43 HB2 GLU 7 HB2 GLU 7 5.016 13.577 0.279
44 HB3 GLU 7 HB1 GLU 7 4.380 13.635 -1.358
45 HG2 GLU 7 HG2 GLU 7 2.088 13.522 -0.347
46 HG3 GLU 7 HG1 GLU 7 2.861 13.742 1.220
47 H LYS 8 HN LYS 8 1.950 11.384 0.846
48 HA LYS 8 HA LYS 8 2.900 10.946 3.477
49 HB2 LYS 8 HB2 LYS 8 0.273 9.934 2.380
50 HB3 LYS 8 HB1 LYS 8 0.655 10.359 4.035
51 HG2 LYS 8 HG2 LYS 8 0.422 12.256 1.746
52 HG3 LYS 8 HG1 LYS 8 -0.743 12.025 3.043
53 HD2 LYS 8 HD2 LYS 8 0.840 12.830 4.667
54 HD3 LYS 8 HD1 LYS 8 2.097 12.942 3.437
55 HE2 LYS 8 HE2 LYS 8 1.073 15.129 3.992
56 HE3 LYS 8 HE1 LYS 8 0.907 14.689 2.294
57 HZ1 LYS 8 HZ1 LYS 8 -1.114 15.632 3.493
58 HZ2 LYS 8 HZ2 LYS 8 -1.248 14.119 4.231
59 HZ3 LYS 8 HZ3 LYS 8 -1.344 14.254 2.543
60 H PHE 9 HN PHE 9 1.929 8.759 0.852
61 HA PHE 9 HA PHE 9 2.263 6.335 2.236
62 HB2 PHE 9 HB2 PHE 9 2.690 6.875 -0.713
63 HB3 PHE 9 HB1 PHE 9 2.505 5.286 0.013
64 HD1 PHE 9 HD1 PHE 9 0.878 6.732 -2.218
65 HD2 PHE 9 HD2 PHE 9 0.253 6.112 1.945
66 HE1 PHE 9 HE1 PHE 9 -1.553 6.883 -2.572
67 HE2 PHE 9 HE2 PHE 9 -2.176 6.257 1.605
68 HZ PHE 9 HZ PHE 9 -3.083 6.645 -0.649
69 H ARG 10 HN ARG 10 4.509 8.323 0.389
70 HA ARG 10 HA ARG 10 6.740 6.635 0.509
71 HB2 ARG 10 HB2 ARG 10 6.810 8.433 -1.025
72 HB3 ARG 10 HB1 ARG 10 6.446 9.614 0.225
73 HG2 ARG 10 HG2 ARG 10 8.622 9.444 1.146
74 HG3 ARG 10 HG1 ARG 10 8.993 8.019 0.173
75 HD2 ARG 10 HD2 ARG 10 8.389 10.734 -0.981
76 HD3 ARG 10 HD1 ARG 10 10.019 10.150 -0.648
77 HE ARG 10 HE ARG 10 8.914 8.198 -2.190
78 HH11 ARG 10 HH11 ARG 10 9.400 11.644 -2.570
79 HH12 ARG 10 HH12 ARG 10 9.523 11.565 -4.300
80 HH21 ARG 10 HH21 ARG 10 9.091 8.089 -4.465
81 HH22 ARG 10 HH22 ARG 10 9.349 9.540 -5.378
82 H GLU 11 HN GLU 11 5.706 9.222 2.677
83 HA GLU 11 HA GLU 11 7.910 9.094 4.420
84 HB2 GLU 11 HB2 GLU 11 6.408 10.997 4.413
85 HB3 GLU 11 HB1 GLU 11 5.069 9.983 4.930
86 HG2 GLU 11 HG2 GLU 11 6.234 9.550 7.041
87 HG3 GLU 11 HG1 GLU 11 7.544 10.608 6.521
88 H ALA 12 HN ALA 12 4.748 7.537 4.504
89 HA ALA 12 HA ALA 12 5.125 6.167 6.942
90 HB1 ALA 12 HB1 ALA 12 3.332 5.465 4.624
91 HB2 ALA 12 HB2 ALA 12 2.917 6.511 5.982
92 HB3 ALA 12 HB3 ALA 12 3.223 4.796 6.251
93 H PHE 13 HN PHE 13 5.822 5.331 3.586
94 HA PHE 13 HA PHE 13 6.538 2.658 3.954
95 HB2 PHE 13 HB2 PHE 13 6.312 3.790 1.731
96 HB3 PHE 13 HB1 PHE 13 7.842 4.605 2.035
97 HD1 PHE 13 HD1 PHE 13 6.260 1.330 1.452
98 HD2 PHE 13 HD2 PHE 13 9.922 3.482 1.702
99 HE1 PHE 13 HE1 PHE 13 7.453 -0.597 0.493
100 HE2 PHE 13 HE2 PHE 13 11.118 1.555 0.741
101 HZ PHE 13 HZ PHE 13 9.881 -0.483 0.135
102 H ILE 14 HN ILE 14 8.487 5.617 4.201
103 HA ILE 14 HA ILE 14 10.934 4.364 4.789
104 HB ILE 14 HB ILE 14 9.997 7.109 5.627
105 HG12 ILE 14 HG12 ILE 14 11.690 6.245 3.268
106 HG13 ILE 14 HG11 ILE 14 9.985 6.676 3.170
107 HG21 ILE 14 HG21 ILE 14 12.335 7.628 5.963
108 HG22 ILE 14 HG22 ILE 14 12.801 6.008 5.445
109 HG23 ILE 14 HG23 ILE 14 11.900 6.225 6.946
110 HD11 ILE 14 HD11 ILE 14 12.220 8.504 4.019
111 HD12 ILE 14 HD12 ILE 14 10.513 8.936 3.907
112 HD13 ILE 14 HD13 ILE 14 11.410 8.504 2.452
113 H LEU 15 HN LEU 15 8.357 5.549 6.917
114 HA LEU 15 HA LEU 15 9.598 5.098 9.371
115 HB2 LEU 15 HB2 LEU 15 6.682 4.779 8.661
116 HB3 LEU 15 HB1 LEU 15 7.318 4.882 10.291
117 HG LEU 15 HG LEU 15 7.510 7.072 8.224
118 HD11 LEU 15 HD11 LEU 15 5.212 6.717 8.966
119 HD12 LEU 15 HD12 LEU 15 5.858 8.231 9.597
120 HD13 LEU 15 HD13 LEU 15 5.733 6.820 10.647
121 HD21 LEU 15 HD21 LEU 15 9.363 7.106 9.799
122 HD22 LEU 15 HD22 LEU 15 8.233 7.021 11.150
123 HD23 LEU 15 HD23 LEU 15 8.260 8.444 10.112
124 H PHE 16 HN PHE 16 7.785 2.916 7.293
125 HA PHE 16 HA PHE 16 8.160 0.641 8.996
126 HB2 PHE 16 HB2 PHE 16 7.078 1.042 6.231
127 HB3 PHE 16 HB1 PHE 16 7.451 -0.581 6.798
128 HD1 PHE 16 HD1 PHE 16 5.516 2.460 7.744
129 HD2 PHE 16 HD2 PHE 16 5.860 -1.777 7.964
130 HE1 PHE 16 HE1 PHE 16 3.310 2.338 8.821
131 HE2 PHE 16 HE2 PHE 16 3.648 -1.905 9.043
132 HZ PHE 16 HZ PHE 16 2.375 0.158 9.473
133 H SER 17 HN SER 17 10.162 2.270 6.766
134 HA SER 17 HA SER 17 11.563 -0.192 6.018
135 HB2 SER 17 HB2 SER 17 11.409 2.442 4.571
136 HB3 SER 17 HB1 SER 17 12.415 1.089 4.061
137 HG SER 17 HG SER 17 9.591 1.196 4.263
138 H SER 18 HN SER 18 12.031 1.886 8.327
139 HA SER 18 HA SER 18 14.432 3.136 8.136
140 HB2 SER 18 HB2 SER 18 12.909 3.129 10.109
141 HB3 SER 18 HB1 SER 18 13.558 1.553 10.553
142 HG SER 18 HG SER 18 15.689 2.756 10.407
143 H CYS 19 HN CYS 19 14.079 -0.385 8.204
144 HA CYS 19 HA CYS 19 17.022 -0.578 8.359
145 HB2 CYS 19 HB2 CYS 19 16.769 -2.739 9.527
146 HB3 CYS 19 HB1 CYS 19 16.075 -1.406 10.438
147 HG CYS 19 HG CYS 19 13.552 -2.366 8.835
148 H SER 20 HN SER 20 16.680 -3.595 7.969
149 HA SER 20 HA SER 20 16.749 -3.649 5.103
150 HB2 SER 20 HB2 SER 20 17.939 -5.228 6.777
151 HB3 SER 20 HB1 SER 20 16.400 -6.076 6.825
152 HG SER 20 HG SER 20 17.992 -5.587 4.528
153 H ASP 21 HN ASP 21 14.752 -2.715 4.720
154 HA ASP 21 HA ASP 21 12.398 -4.205 5.527
155 HB2 ASP 21 HB2 ASP 21 12.876 -1.297 5.303
156 HB3 ASP 21 HB1 ASP 21 11.235 -1.941 5.173
157 H HIS 22 HN HIS 22 13.903 -4.625 3.015
158 HA HIS 22 HA HIS 22 12.084 -3.538 1.045
159 HB2 HIS 22 HB2 HIS 22 14.579 -4.202 0.673
160 HB3 HIS 22 HB1 HIS 22 13.971 -5.856 0.567
161 HD1 HIS 22 HD1 HIS 22 14.713 -5.873 -1.970
162 HD2 HIS 22 HD2 HIS 22 11.741 -3.160 -0.941
163 HE1 HIS 22 HE1 HIS 22 13.720 -5.120 -4.159
164 HE2 HIS 22 HE2 HIS 22 11.825 -3.589 -3.514
165 H ILE 23 HN ILE 23 10.295 -4.769 0.116
166 HA ILE 23 HA ILE 23 9.456 -6.037 2.599
167 HB ILE 23 HB ILE 23 8.709 -3.704 1.738
168 HG12 ILE 23 HG12 ILE 23 6.602 -5.490 2.913
169 HG13 ILE 23 HG11 ILE 23 8.026 -4.980 3.817
170 HG21 ILE 23 HG21 ILE 23 6.490 -3.734 0.661
171 HG22 ILE 23 HG22 ILE 23 6.668 -5.473 0.417
172 HG23 ILE 23 HG23 ILE 23 7.774 -4.354 -0.379
173 HD11 ILE 23 HD11 ILE 23 7.392 -2.653 3.545
174 HD12 ILE 23 HD12 ILE 23 6.089 -3.575 4.298
175 HD13 ILE 23 HD13 ILE 23 5.988 -3.134 2.592
176 H GLU 24 HN GLU 24 8.688 -7.848 2.748
177 HA GLU 24 HA GLU 24 7.856 -9.505 0.549
178 HB2 GLU 24 HB2 GLU 24 7.827 -9.944 3.540
179 HB3 GLU 24 HB1 GLU 24 7.519 -11.179 2.324
180 HG2 GLU 24 HG2 GLU 24 9.700 -11.069 1.536
181 HG3 GLU 24 HG1 GLU 24 10.072 -9.627 2.459
182 H MET 25 HN MET 25 5.752 -10.708 0.757
183 HA MET 25 HA MET 25 3.566 -9.026 0.709
184 HB2 MET 25 HB2 MET 25 3.863 -11.978 1.034
185 HB3 MET 25 HB1 MET 25 2.279 -11.257 1.263
186 HG2 MET 25 HG2 MET 25 2.567 -12.079 -1.000
187 HG3 MET 25 HG1 MET 25 2.348 -10.332 -0.971
188 HE1 MET 25 HE1 MET 25 4.676 -10.635 -4.011
189 HE2 MET 25 HE2 MET 25 3.181 -9.972 -3.348
190 HE3 MET 25 HE3 MET 25 3.355 -11.714 -3.563
191 H TYR 26 HN TYR 26 4.915 -10.805 3.464
192 HA TYR 26 HA TYR 26 2.568 -10.370 5.057
193 HB2 TYR 26 HB2 TYR 26 3.524 -11.756 6.601
194 HB3 TYR 26 HB1 TYR 26 4.359 -12.280 5.158
195 HD1 TYR 26 HD1 TYR 26 4.681 -10.837 8.440
196 HD2 TYR 26 HD2 TYR 26 6.736 -11.539 4.785
197 HE1 TYR 26 HE1 TYR 26 6.819 -10.462 9.583
198 HE2 TYR 26 HE2 TYR 26 8.885 -11.162 5.920
199 HH TYR 26 HH TYR 26 9.209 -11.121 9.267
200 H LYS 27 HN LYS 27 5.669 -8.787 4.710
201 HA LYS 27 HA LYS 27 5.229 -7.018 6.971
202 HB2 LYS 27 HB2 LYS 27 7.423 -7.736 5.221
203 HB3 LYS 27 HB1 LYS 27 7.292 -5.992 5.390
204 HG2 LYS 27 HG2 LYS 27 7.249 -7.767 7.793
205 HG3 LYS 27 HG1 LYS 27 8.771 -7.295 7.037
206 HD2 LYS 27 HD2 LYS 27 6.692 -5.281 7.849
207 HD3 LYS 27 HD1 LYS 27 7.936 -5.851 8.960
208 HE2 LYS 27 HE2 LYS 27 9.648 -5.152 7.278
209 HE3 LYS 27 HE1 LYS 27 8.348 -4.438 6.328
210 HZ1 LYS 27 HZ1 LYS 27 7.883 -2.910 8.086
211 HZ2 LYS 27 HZ2 LYS 27 9.547 -2.838 7.766
212 HZ3 LYS 27 HZ3 LYS 27 8.977 -3.672 9.124
213 H PHE 28 HN PHE 28 4.446 -7.189 3.699
214 HA PHE 28 HA PHE 28 4.342 -4.382 3.140
215 HB2 PHE 28 HB2 PHE 28 4.826 -5.882 1.347
216 HB3 PHE 28 HB1 PHE 28 3.398 -6.847 1.686
217 HD1 PHE 28 HD1 PHE 28 1.405 -6.424 0.621
218 HD2 PHE 28 HD2 PHE 28 4.494 -3.510 0.528
219 HE1 PHE 28 HE1 PHE 28 0.129 -5.149 -1.030
220 HE2 PHE 28 HE2 PHE 28 3.241 -2.216 -1.130
221 HZ PHE 28 HZ PHE 28 1.039 -3.028 -1.922
222 H PHE 29 HN PHE 29 2.039 -6.861 4.103
223 HA PHE 29 HA PHE 29 -0.249 -5.320 3.447
224 HB2 PHE 29 HB2 PHE 29 -0.042 -7.877 3.791
225 HB3 PHE 29 HB1 PHE 29 -0.298 -7.505 5.495
226 HD1 PHE 29 HD1 PHE 29 -1.802 -7.442 2.130
227 HD2 PHE 29 HD2 PHE 29 -2.424 -6.780 6.301
228 HE1 PHE 29 HE1 PHE 29 -4.234 -7.361 1.763
229 HE2 PHE 29 HE2 PHE 29 -4.848 -6.689 5.929
230 HZ PHE 29 HZ PHE 29 -5.758 -6.984 3.659
231 H GLU 30 HN GLU 30 1.689 -5.654 6.371
232 HA GLU 30 HA GLU 30 -0.061 -4.196 8.045
233 HB2 GLU 30 HB2 GLU 30 1.927 -3.864 9.507
234 HB3 GLU 30 HB1 GLU 30 1.565 -5.534 9.118
235 HG2 GLU 30 HG2 GLU 30 3.356 -5.527 7.456
236 HG3 GLU 30 HG1 GLU 30 3.724 -3.852 7.875
237 H LEU 31 HN LEU 31 2.362 -3.251 5.760
238 HA LEU 31 HA LEU 31 2.557 -0.534 6.500
239 HB2 LEU 31 HB2 LEU 31 4.273 -1.424 5.149
240 HB3 LEU 31 HB1 LEU 31 3.133 -2.058 3.979
241 HG LEU 31 HG LEU 31 2.585 0.317 3.356
242 HD11 LEU 31 HD11 LEU 31 3.368 1.417 5.381
243 HD12 LEU 31 HD12 LEU 31 4.192 2.051 3.956
244 HD13 LEU 31 HD13 LEU 31 5.023 0.918 5.023
245 HD21 LEU 31 HD21 LEU 31 4.524 0.574 1.954
246 HD22 LEU 31 HD22 LEU 31 4.096 -1.133 2.057
247 HD23 LEU 31 HD23 LEU 31 5.458 -0.506 2.987
248 H MET 32 HN MET 32 0.211 -2.299 4.641
249 HA MET 32 HA MET 32 -0.831 0.211 3.555
250 HB2 MET 32 HB2 MET 32 -2.106 -1.130 1.976
251 HB3 MET 32 HB1 MET 32 -0.398 -1.535 1.917
252 HG2 MET 32 HG2 MET 32 -0.712 -3.613 2.759
253 HG3 MET 32 HG1 MET 32 -2.136 -3.151 3.688
254 HE1 MET 32 HE1 MET 32 -1.569 -2.217 -0.022
255 HE2 MET 32 HE2 MET 32 -2.313 -3.558 -0.893
256 HE3 MET 32 HE3 MET 32 -0.810 -3.810 -0.003
257 H ASN 33 HN ASN 33 -1.806 -2.385 5.720
258 HA ASN 33 HA ASN 33 -4.568 -1.775 5.645
259 HB2 ASN 33 HB2 ASN 33 -4.882 -3.198 7.469
260 HB3 ASN 33 HB1 ASN 33 -3.465 -3.871 6.679
261 HD21 ASN 33 HD21 ASN 33 -1.534 -3.824 7.702
262 HD22 ASN 33 HD22 ASN 33 -1.330 -3.346 9.352
263 H SER 34 HN SER 34 -1.881 -0.236 7.096
264 HA SER 34 HA SER 34 -3.196 1.142 9.194
265 HB2 SER 34 HB2 SER 34 -1.201 2.704 8.975
266 HB3 SER 34 HB1 SER 34 -0.813 1.005 9.246
267 HG SER 34 HG SER 34 0.276 2.302 7.450
268 H PHE 35 HN PHE 35 -2.903 1.660 5.775
269 HA PHE 35 HA PHE 35 -4.057 4.331 5.924
270 HB2 PHE 35 HB2 PHE 35 -2.935 2.650 3.704
271 HB3 PHE 35 HB1 PHE 35 -3.872 4.100 3.356
272 HD1 PHE 35 HD1 PHE 35 -0.689 2.772 4.406
273 HD2 PHE 35 HD2 PHE 35 -3.043 6.305 4.136
274 HE1 PHE 35 HE1 PHE 35 1.337 4.139 4.673
275 HE2 PHE 35 HE2 PHE 35 -1.024 7.681 4.401
276 HZ PHE 35 HZ PHE 35 1.172 6.599 4.669
277 H GLY 36 HN GLY 36 -5.192 1.226 5.935
278 HA2 GLY 36 HA2 GLY 36 -7.375 0.459 5.784
279 HA3 GLY 36 HA1 GLY 36 -7.861 2.050 5.218
280 H ILE 37 HN ILE 37 -5.243 0.399 3.677
281 HA ILE 37 HA ILE 37 -6.509 0.539 1.131
282 HB ILE 37 HB ILE 37 -4.011 -0.957 1.940
283 HG12 ILE 37 HG12 ILE 37 -3.920 1.480 2.411
284 HG13 ILE 37 HG11 ILE 37 -2.764 0.977 1.183
285 HG21 ILE 37 HG21 ILE 37 -3.409 -0.832 -0.431
286 HG22 ILE 37 HG22 ILE 37 -4.979 -0.108 -0.784
287 HG23 ILE 37 HG23 ILE 37 -4.885 -1.760 -0.171
288 HD11 ILE 37 HD11 ILE 37 -5.401 2.336 0.690
289 HD12 ILE 37 HD12 ILE 37 -4.268 1.810 -0.556
290 HD13 ILE 37 HD13 ILE 37 -3.804 3.075 0.585
291 H ILE 38 HN ILE 38 -7.606 -1.001 0.007
292 HA ILE 38 HA ILE 38 -8.109 -3.540 1.321
293 HB ILE 38 HB ILE 38 -9.416 -2.206 -1.050
294 HG12 ILE 38 HG12 ILE 38 -10.434 -2.752 1.746
295 HG13 ILE 38 HG11 ILE 38 -9.917 -1.184 1.138
296 HG21 ILE 38 HG21 ILE 38 -11.055 -4.014 -0.957
297 HG22 ILE 38 HG22 ILE 38 -10.096 -4.810 0.290
298 HG23 ILE 38 HG23 ILE 38 -9.437 -4.602 -1.332
299 HD11 ILE 38 HD11 ILE 38 -12.330 -1.356 1.152
300 HD12 ILE 38 HD12 ILE 38 -12.252 -2.793 0.134
301 HD13 ILE 38 HD13 ILE 38 -11.731 -1.233 -0.501
302 H LEU 39 HN LEU 39 -6.842 -5.159 0.814
303 HA LEU 39 HA LEU 39 -6.117 -5.602 -1.995
304 HB2 LEU 39 HB2 LEU 39 -4.157 -4.675 -0.899
305 HB3 LEU 39 HB1 LEU 39 -4.300 -5.832 0.406
306 HG LEU 39 HG LEU 39 -3.848 -7.652 -1.264
307 HD11 LEU 39 HD11 LEU 39 -4.492 -6.342 -3.260
308 HD12 LEU 39 HD12 LEU 39 -2.900 -7.093 -3.384
309 HD13 LEU 39 HD13 LEU 39 -3.036 -5.370 -3.039
310 HD21 LEU 39 HD21 LEU 39 -1.418 -7.076 -1.475
311 HD22 LEU 39 HD22 LEU 39 -2.083 -6.976 0.156
312 HD23 LEU 39 HD23 LEU 39 -1.811 -5.505 -0.774
313 H THR 40 HN THR 40 -6.919 -7.533 -2.598
314 HA THR 40 HA THR 40 -7.687 -9.420 -0.525
315 HB THR 40 HB THR 40 -8.649 -10.733 -2.459
316 HG1 THR 40 HG1 THR 40 -8.042 -8.309 -3.855
317 HG21 THR 40 HG21 THR 40 -9.629 -7.921 -2.009
318 HG22 THR 40 HG22 THR 40 -10.000 -9.329 -1.014
319 HG23 THR 40 HG23 THR 40 -10.578 -9.249 -2.678
320 H ASN 41 HN ASN 41 -7.374 -11.809 -1.074
321 HA ASN 41 HA ASN 41 -4.604 -12.324 -0.949
322 HB2 ASN 41 HB2 ASN 41 -6.937 -14.188 -1.405
323 HB3 ASN 41 HB1 ASN 41 -5.281 -14.741 -1.172
324 HD21 ASN 41 HD21 ASN 41 -4.320 -14.521 0.847
325 HD22 ASN 41 HD22 ASN 41 -5.242 -14.211 2.275
326 H ASP 42 HN ASP 42 -6.947 -12.716 -3.564
327 HA ASP 42 HA ASP 42 -5.235 -13.937 -5.417
328 HB2 ASP 42 HB2 ASP 42 -7.719 -12.275 -5.740
329 HB3 ASP 42 HB1 ASP 42 -6.835 -12.874 -7.140
330 H GLU 43 HN GLU 43 -5.797 -10.545 -4.670
331 HA GLU 43 HA GLU 43 -4.187 -9.495 -6.753
332 HB2 GLU 43 HB2 GLU 43 -4.974 -8.331 -4.085
333 HB3 GLU 43 HB1 GLU 43 -4.133 -7.435 -5.342
334 HG2 GLU 43 HG2 GLU 43 -6.010 -7.674 -6.827
335 HG3 GLU 43 HG1 GLU 43 -6.841 -8.697 -5.656
336 H LYS 44 HN LYS 44 -3.523 -10.256 -3.345
337 HA LYS 44 HA LYS 44 -0.854 -9.495 -3.251
338 HB2 LYS 44 HB2 LYS 44 -2.211 -11.776 -1.816
339 HB3 LYS 44 HB1 LYS 44 -0.599 -11.184 -1.436
340 HG2 LYS 44 HG2 LYS 44 -1.789 -8.898 -1.198
341 HG3 LYS 44 HG1 LYS 44 -3.243 -9.866 -1.013
342 HD2 LYS 44 HD2 LYS 44 -2.428 -9.449 1.171
343 HD3 LYS 44 HD1 LYS 44 -2.042 -11.131 0.803
344 HE2 LYS 44 HE2 LYS 44 -0.179 -9.958 1.903
345 HE3 LYS 44 HE1 LYS 44 0.248 -10.528 0.294
346 HZ1 LYS 44 HZ1 LYS 44 -0.067 -8.305 -0.558
347 HZ2 LYS 44 HZ2 LYS 44 1.043 -8.277 0.718
348 HZ3 LYS 44 HZ3 LYS 44 -0.545 -7.745 0.966
349 H ALA 45 HN ALA 45 -2.297 -12.439 -4.496
350 HA ALA 45 HA ALA 45 0.179 -13.747 -5.044
351 HB1 ALA 45 HB1 ALA 45 -1.902 -14.993 -4.788
352 HB2 ALA 45 HB2 ALA 45 -1.170 -15.298 -6.362
353 HB3 ALA 45 HB3 ALA 45 -2.554 -14.215 -6.228
354 H ALA 46 HN ALA 46 -1.456 -11.157 -6.486
355 HA ALA 46 HA ALA 46 -0.252 -11.628 -9.120
356 HB1 ALA 46 HB1 ALA 46 -2.257 -9.542 -8.273
357 HB2 ALA 46 HB2 ALA 46 -2.634 -11.064 -9.079
358 HB3 ALA 46 HB3 ALA 46 -1.691 -9.833 -9.919
359 H LEU 47 HN LEU 47 0.322 -9.971 -6.247
360 HA LEU 47 HA LEU 47 1.695 -7.702 -7.361
361 HB2 LEU 47 HB2 LEU 47 2.008 -8.810 -4.573
362 HB3 LEU 47 HB1 LEU 47 2.351 -7.185 -5.115
363 HG LEU 47 HG LEU 47 -0.341 -8.448 -4.669
364 HD11 LEU 47 HD11 LEU 47 -0.604 -6.515 -3.160
365 HD12 LEU 47 HD12 LEU 47 1.073 -6.078 -3.483
366 HD13 LEU 47 HD13 LEU 47 0.698 -7.608 -2.687
367 HD21 LEU 47 HD21 LEU 47 0.176 -5.726 -5.842
368 HD22 LEU 47 HD22 LEU 47 -1.391 -6.470 -5.493
369 HD23 LEU 47 HD23 LEU 47 -0.362 -7.131 -6.764
370 HA PRO 48 HA PRO 48 5.682 -9.572 -8.051
371 HB2 PRO 48 HB2 PRO 48 7.322 -7.527 -7.242
372 HB3 PRO 48 HB1 PRO 48 6.506 -7.574 -8.808
373 HG2 PRO 48 HG2 PRO 48 5.739 -6.117 -6.315
374 HG3 PRO 48 HG1 PRO 48 5.669 -5.569 -7.999
375 HD2 PRO 48 HD2 PRO 48 3.477 -6.409 -6.680
376 HD3 PRO 48 HD1 PRO 48 3.697 -6.697 -8.415
377 H ASN 49 HN ASN 49 7.337 -10.574 -6.946
378 HA ASN 49 HA ASN 49 6.683 -11.432 -4.350
379 HB2 ASN 49 HB2 ASN 49 7.845 -12.890 -5.896
380 HB3 ASN 49 HB1 ASN 49 9.216 -11.787 -5.967
381 HD21 ASN 49 HD21 ASN 49 10.715 -11.794 -4.340
382 HD22 ASN 49 HD22 ASN 49 10.735 -12.977 -3.079
383 H ASP 50 HN ASP 50 8.902 -9.015 -5.525
384 HA ASP 50 HA ASP 50 9.368 -8.232 -2.732
385 HB2 ASP 50 HB2 ASP 50 11.553 -7.341 -3.353
386 HB3 ASP 50 HB1 ASP 50 11.465 -9.049 -3.765
387 H ILE 51 HN ILE 51 8.394 -6.407 -2.263
388 HA ILE 51 HA ILE 51 7.725 -4.569 -4.454
389 HB ILE 51 HB ILE 51 6.465 -4.925 -1.733
390 HG12 ILE 51 HG12 ILE 51 5.356 -5.373 -4.508
391 HG13 ILE 51 HG11 ILE 51 5.968 -6.647 -3.461
392 HG21 ILE 51 HG21 ILE 51 4.809 -3.261 -2.452
393 HG22 ILE 51 HG22 ILE 51 5.759 -2.959 -3.905
394 HG23 ILE 51 HG23 ILE 51 6.426 -2.571 -2.320
395 HD11 ILE 51 HD11 ILE 51 3.606 -4.871 -2.899
396 HD12 ILE 51 HD12 ILE 51 4.221 -6.135 -1.834
397 HD13 ILE 51 HD13 ILE 51 3.552 -6.557 -3.410
398 H ASN 52 HN ASN 52 8.403 -2.486 -4.445
399 HA ASN 52 HA ASN 52 9.853 -1.527 -2.067
400 HB2 ASN 52 HB2 ASN 52 11.313 -1.943 -4.091
401 HB3 ASN 52 HB1 ASN 52 10.402 -0.698 -4.932
402 HD21 ASN 52 HD21 ASN 52 12.249 0.555 -5.205
403 HD22 ASN 52 HD22 ASN 52 12.958 1.441 -3.897
404 H MET 53 HN MET 53 9.996 1.096 -2.403
405 HA MET 53 HA MET 53 7.453 2.058 -1.869
406 HB2 MET 53 HB2 MET 53 9.574 3.195 -1.267
407 HB3 MET 53 HB1 MET 53 9.788 3.638 -2.956
408 HG2 MET 53 HG2 MET 53 7.614 4.850 -2.832
409 HG3 MET 53 HG1 MET 53 7.603 4.524 -1.101
410 HE1 MET 53 HE1 MET 53 10.789 6.485 0.093
411 HE2 MET 53 HE2 MET 53 10.741 4.799 -0.427
412 HE3 MET 53 HE3 MET 53 9.448 5.448 0.581
413 H ASP 54 HN ASP 54 9.131 1.747 -4.925
414 HA ASP 54 HA ASP 54 7.671 3.554 -6.469
415 HB2 ASP 54 HB2 ASP 54 9.749 2.443 -7.221
416 HB3 ASP 54 HB1 ASP 54 8.870 0.926 -7.370
417 H TYR 55 HN TYR 55 7.092 0.058 -5.973
418 HA TYR 55 HA TYR 55 4.657 0.143 -7.480
419 HB2 TYR 55 HB2 TYR 55 6.025 -1.934 -7.276
420 HB3 TYR 55 HB1 TYR 55 5.572 -2.023 -5.578
421 HD1 TYR 55 HD1 TYR 55 3.566 -3.075 -4.932
422 HD2 TYR 55 HD2 TYR 55 4.151 -1.986 -9.003
423 HE1 TYR 55 HE1 TYR 55 1.510 -4.252 -5.534
424 HE2 TYR 55 HE2 TYR 55 2.091 -3.171 -9.618
425 HH TYR 55 HH TYR 55 0.661 -4.964 -8.745
426 H TRP 56 HN TRP 56 5.532 0.474 -4.118
427 HA TRP 56 HA TRP 56 3.070 0.121 -2.899
428 HB2 TRP 56 HB2 TRP 56 5.064 0.354 -1.584
429 HB3 TRP 56 HB1 TRP 56 5.382 1.950 -2.240
430 HD1 TRP 56 HD1 TRP 56 5.232 3.460 -0.169
431 HE1 TRP 56 HE1 TRP 56 3.443 3.941 1.616
432 HE3 TRP 56 HE3 TRP 56 1.870 -0.177 -1.405
433 HZ2 TRP 56 HZ2 TRP 56 0.924 2.921 2.388
434 HZ3 TRP 56 HZ3 TRP 56 -0.211 -0.360 -0.097
435 HH2 TRP 56 HH2 TRP 56 -0.670 1.162 1.760
436 H LEU 57 HN LEU 57 4.498 3.089 -4.222
437 HA LEU 57 HA LEU 57 2.271 4.754 -3.693
438 HB2 LEU 57 HB2 LEU 57 4.264 5.058 -5.942
439 HB3 LEU 57 HB1 LEU 57 3.298 6.325 -5.213
440 HG LEU 57 HG LEU 57 5.435 4.788 -3.749
441 HD11 LEU 57 HD11 LEU 57 5.571 7.489 -5.081
442 HD12 LEU 57 HD12 LEU 57 6.461 6.037 -5.543
443 HD13 LEU 57 HD13 LEU 57 6.797 6.826 -4.000
444 HD21 LEU 57 HD21 LEU 57 5.258 6.575 -2.106
445 HD22 LEU 57 HD22 LEU 57 3.701 5.775 -2.321
446 HD23 LEU 57 HD23 LEU 57 3.994 7.351 -3.062
447 H ASN 58 HN ASN 58 3.303 3.029 -6.568
448 HA ASN 58 HA ASN 58 1.301 3.872 -8.319
449 HB2 ASN 58 HB2 ASN 58 3.368 2.854 -9.116
450 HB3 ASN 58 HB1 ASN 58 2.933 1.326 -8.362
451 HD21 ASN 58 HD21 ASN 58 2.296 3.516 -10.978
452 HD22 ASN 58 HD22 ASN 58 1.361 2.423 -11.934
453 H PHE 59 HN PHE 59 1.479 0.981 -6.253
454 HA PHE 59 HA PHE 59 -0.932 -0.191 -7.103
455 HB2 PHE 59 HB2 PHE 59 0.636 -1.452 -5.735
456 HB3 PHE 59 HB1 PHE 59 0.449 -0.310 -4.407
457 HD1 PHE 59 HD1 PHE 59 -0.969 -3.172 -6.127
458 HD2 PHE 59 HD2 PHE 59 -1.636 -0.243 -3.113
459 HE1 PHE 59 HE1 PHE 59 -2.832 -4.509 -5.238
460 HE2 PHE 59 HE2 PHE 59 -3.503 -1.569 -2.228
461 HZ PHE 59 HZ PHE 59 -4.104 -3.703 -3.289
462 H ALA 60 HN ALA 60 -0.185 2.153 -4.587
463 HA ALA 60 HA ALA 60 -2.796 2.362 -3.523
464 HB1 ALA 60 HB1 ALA 60 -0.598 4.426 -3.576
465 HB2 ALA 60 HB2 ALA 60 -0.812 3.176 -2.350
466 HB3 ALA 60 HB3 ALA 60 -2.020 4.449 -2.531
467 H LYS 61 HN LYS 61 -1.080 4.098 -6.064
468 HA LYS 61 HA LYS 61 -3.096 5.963 -6.682
469 HB2 LYS 61 HB2 LYS 61 -0.992 4.773 -8.493
470 HB3 LYS 61 HB1 LYS 61 -1.900 6.251 -8.794
471 HG2 LYS 61 HG2 LYS 61 -0.038 5.810 -6.487
472 HG3 LYS 61 HG1 LYS 61 0.355 6.683 -7.964
473 HD2 LYS 61 HD2 LYS 61 -1.793 8.055 -7.381
474 HD3 LYS 61 HD1 LYS 61 -1.519 7.422 -5.756
475 HE2 LYS 61 HE2 LYS 61 -0.469 9.564 -5.945
476 HE3 LYS 61 HE1 LYS 61 0.775 8.314 -5.850
477 HZ1 LYS 61 HZ1 LYS 61 1.076 8.433 -8.215
478 HZ2 LYS 61 HZ2 LYS 61 1.257 9.983 -7.550
479 HZ3 LYS 61 HZ3 LYS 61 -0.171 9.567 -8.366
480 H LYS 62 HN LYS 62 -2.408 2.718 -7.855
481 HA LYS 62 HA LYS 62 -4.061 2.777 -10.118
482 HB2 LYS 62 HB2 LYS 62 -2.299 1.165 -9.961
483 HB3 LYS 62 HB1 LYS 62 -2.955 0.512 -8.471
484 HG2 LYS 62 HG2 LYS 62 -4.963 -0.221 -9.805
485 HG3 LYS 62 HG1 LYS 62 -4.058 0.223 -11.253
486 HD2 LYS 62 HD2 LYS 62 -3.796 -2.140 -10.857
487 HD3 LYS 62 HD1 LYS 62 -2.259 -1.333 -10.548
488 HE2 LYS 62 HE2 LYS 62 -2.801 -1.335 -8.125
489 HE3 LYS 62 HE1 LYS 62 -4.262 -2.249 -8.486
490 HZ1 LYS 62 HZ1 LYS 62 -2.823 -3.991 -9.441
491 HZ2 LYS 62 HZ2 LYS 62 -2.560 -3.746 -7.794
492 HZ3 LYS 62 HZ3 LYS 62 -1.462 -3.129 -8.923
493 H HIS 63 HN HIS 63 -4.638 1.431 -6.902
494 HA HIS 63 HA HIS 63 -7.244 0.504 -7.640
495 HB2 HIS 63 HB2 HIS 63 -7.301 -0.547 -5.606
496 HB3 HIS 63 HB1 HIS 63 -5.572 -0.366 -5.818
497 HD1 HIS 63 HD1 HIS 63 -8.084 0.032 -3.351
498 HD2 HIS 63 HD2 HIS 63 -4.652 2.135 -4.376
499 HE1 HIS 63 HE1 HIS 63 -7.468 1.356 -1.312
500 HE2 HIS 63 HE2 HIS 63 -5.556 2.808 -2.049
501 H TYR 64 HN TYR 64 -5.913 3.361 -6.377
502 HA TYR 64 HA TYR 64 -7.768 4.409 -4.673
503 HB2 TYR 64 HB2 TYR 64 -5.582 5.430 -6.160
504 HB3 TYR 64 HB1 TYR 64 -6.915 6.569 -6.322
505 HD1 TYR 64 HD1 TYR 64 -4.104 6.450 -4.691
506 HD2 TYR 64 HD2 TYR 64 -8.237 6.313 -3.712
507 HE1 TYR 64 HE1 TYR 64 -3.596 7.318 -2.461
508 HE2 TYR 64 HE2 TYR 64 -7.742 7.183 -1.472
509 HH TYR 64 HH TYR 64 -4.698 8.472 -0.634
510 H ASN 65 HN ASN 65 -7.709 6.079 -7.768
511 HA ASN 65 HA ASN 65 -10.614 5.809 -7.938
512 HB2 ASN 65 HB2 ASN 65 -9.059 8.399 -8.027
513 HB3 ASN 65 HB1 ASN 65 -10.764 8.243 -8.403
514 HD21 ASN 65 HD21 ASN 65 -12.230 7.764 -6.724
515 HD22 ASN 65 HD22 ASN 65 -11.818 8.056 -5.071
516 H TYR 66 HN TYR 66 -8.560 4.561 -9.419
517 HA TYR 66 HA TYR 66 -9.138 5.656 -12.088
518 HB2 TYR 66 HB2 TYR 66 -6.595 4.235 -11.255
519 HB3 TYR 66 HB1 TYR 66 -6.950 4.885 -12.850
520 HD1 TYR 66 HD1 TYR 66 -5.919 5.658 -9.455
521 HD2 TYR 66 HD2 TYR 66 -6.920 7.323 -13.232
522 HE1 TYR 66 HE1 TYR 66 -4.902 7.778 -8.768
523 HE2 TYR 66 HE2 TYR 66 -5.903 9.462 -12.561
524 HH TYR 66 HH TYR 66 -3.902 9.774 -9.849
525 H GLU 67 HN GLU 67 -9.590 4.089 -13.693
526 HA GLU 67 HA GLU 67 -10.724 1.695 -12.526
527 HB2 GLU 67 HB2 GLU 67 -11.084 2.876 -15.286
528 HB3 GLU 67 HB1 GLU 67 -12.051 1.603 -14.555
529 HG2 GLU 67 HG2 GLU 67 -12.939 3.128 -12.936
530 HG3 GLU 67 HG1 GLU 67 -11.870 4.410 -13.504
531 H GLN 68 HN GLN 68 -10.884 0.380 -15.020
532 HA GLN 68 HA GLN 68 -9.885 -1.480 -15.884
533 HB2 GLN 68 HB2 GLN 68 -7.680 0.540 -16.333
534 HB3 GLN 68 HB1 GLN 68 -7.787 -1.026 -17.125
535 HG2 GLN 68 HG2 GLN 68 -9.789 1.207 -17.376
536 HG3 GLN 68 HG1 GLN 68 -8.558 0.786 -18.564
537 HE21 GLN 68 HE21 GLN 68 -8.791 -1.093 -19.776
538 HE22 GLN 68 HE22 GLN 68 -10.304 -1.923 -19.901
539 HA PRO 69 HA PRO 69 -7.307 -2.213 -12.092
540 HB2 PRO 69 HB2 PRO 69 -8.857 -4.034 -10.882
541 HB3 PRO 69 HB1 PRO 69 -9.203 -2.304 -10.770
542 HG2 PRO 69 HG2 PRO 69 -10.489 -4.389 -12.480
543 HG3 PRO 69 HG1 PRO 69 -11.232 -3.032 -11.616
544 HD2 PRO 69 HD2 PRO 69 -10.623 -3.043 -14.314
545 HD3 PRO 69 HD1 PRO 69 -10.833 -1.583 -13.332
546 H PHE 70 HN PHE 70 -6.479 -3.203 -14.443
547 HA PHE 70 HA PHE 70 -6.670 -6.079 -14.492
548 HB2 PHE 70 HB2 PHE 70 -5.082 -5.851 -16.447
549 HB3 PHE 70 HB1 PHE 70 -6.649 -5.076 -16.617
550 HD1 PHE 70 HD1 PHE 70 -3.153 -4.300 -15.548
551 HD2 PHE 70 HD2 PHE 70 -6.723 -2.911 -17.401
552 HE1 PHE 70 HE1 PHE 70 -2.029 -2.190 -16.123
553 HE2 PHE 70 HE2 PHE 70 -5.605 -0.796 -17.975
554 HZ PHE 70 HZ PHE 70 -3.255 -0.434 -17.337
555 H LYS 71 HN LYS 71 -4.058 -6.705 -15.387
556 HA LYS 71 HA LYS 71 -2.171 -7.611 -14.548
557 HB2 LYS 71 HB2 LYS 71 -1.546 -5.223 -14.315
558 HB3 LYS 71 HB1 LYS 71 -2.159 -5.242 -12.669
559 HG2 LYS 71 HG2 LYS 71 0.282 -5.438 -12.766
560 HG3 LYS 71 HG1 LYS 71 -0.470 -6.854 -12.033
561 HD2 LYS 71 HD2 LYS 71 -0.231 -8.093 -14.102
562 HD3 LYS 71 HD1 LYS 71 0.429 -6.665 -14.903
563 HE2 LYS 71 HE2 LYS 71 1.684 -7.990 -12.507
564 HE3 LYS 71 HE1 LYS 71 2.133 -8.342 -14.174
565 HZ1 LYS 71 HZ1 LYS 71 2.708 -5.986 -14.439
566 HZ2 LYS 71 HZ2 LYS 71 3.635 -6.740 -13.248
567 HZ3 LYS 71 HZ3 LYS 71 2.365 -5.720 -12.806
568 H HIS 72 HN HIS 72 -4.478 -8.686 -13.715
569 HA HIS 72 HA HIS 72 -3.948 -9.415 -10.913
570 HB2 HIS 72 HB2 HIS 72 -6.429 -9.854 -10.725
571 HB3 HIS 72 HB1 HIS 72 -5.980 -8.162 -10.885
572 HD1 HIS 72 HD1 HIS 72 -7.003 -6.878 -12.777
573 HD2 HIS 72 HD2 HIS 72 -7.598 -10.978 -13.125
574 HE1 HIS 72 HE1 HIS 72 -8.461 -7.175 -14.805
575 HE2 HIS 72 HE2 HIS 72 -9.012 -9.640 -14.831
576 H ILE 73 HN ILE 73 -3.927 -10.486 -14.038
577 HA ILE 73 HA ILE 73 -3.627 -13.207 -13.239
578 HB ILE 73 HB ILE 73 -6.098 -13.070 -13.309
579 HG12 ILE 73 HG12 ILE 73 -4.896 -14.776 -15.499
580 HG13 ILE 73 HG11 ILE 73 -4.937 -15.189 -13.788
581 HG21 ILE 73 HG21 ILE 73 -6.374 -11.373 -15.018
582 HG22 ILE 73 HG22 ILE 73 -7.248 -12.838 -15.464
583 HG23 ILE 73 HG23 ILE 73 -5.708 -12.461 -16.236
584 HD11 ILE 73 HD11 ILE 73 -7.338 -14.820 -15.563
585 HD12 ILE 73 HD12 ILE 73 -7.368 -15.256 -13.856
586 HD13 ILE 73 HD13 ILE 73 -6.662 -16.359 -15.035
587 H ASN 74 HN ASN 74 -3.895 -10.811 -15.766
588 HA ASN 74 HA ASN 74 -2.927 -10.546 -17.789
589 HB2 ASN 74 HB2 ASN 74 -0.893 -12.350 -16.491
590 HB3 ASN 74 HB1 ASN 74 -0.685 -11.739 -18.127
591 HD21 ASN 74 HD21 ASN 74 0.949 -11.272 -15.810
592 HD22 ASN 74 HD22 ASN 74 0.977 -9.561 -15.572
Start of MODEL 10
1 H1 MET 1 HT1 MET 1 -6.044 13.422 -3.105
2 H2 MET 1 HT2 MET 1 -6.505 14.963 -3.621
3 H3 MET 1 HT3 MET 1 -5.069 14.758 -2.756
4 HA MET 1 HA MET 1 -5.619 13.623 -5.428
5 HB2 MET 1 HB2 MET 1 -5.429 16.022 -5.599
6 HB3 MET 1 HB1 MET 1 -3.993 16.031 -4.589
7 HG2 MET 1 HG2 MET 1 -2.735 14.913 -6.301
8 HG3 MET 1 HG1 MET 1 -4.189 14.720 -7.273
9 HE1 MET 1 HE1 MET 1 -5.360 16.529 -8.586
10 HE2 MET 1 HE2 MET 1 -4.984 18.251 -8.521
11 HE3 MET 1 HE3 MET 1 -5.677 17.446 -7.113
12 H ALA 2 HN ALA 2 -3.847 12.618 -6.394
13 HA ALA 2 HA ALA 2 -2.658 10.766 -4.648
14 HB1 ALA 2 HB1 ALA 2 -1.650 9.799 -6.617
15 HB2 ALA 2 HB2 ALA 2 -1.994 11.258 -7.543
16 HB3 ALA 2 HB3 ALA 2 -3.319 10.255 -6.955
17 H SER 3 HN SER 3 -1.344 13.656 -6.183
18 HA SER 3 HA SER 3 1.368 13.148 -5.658
19 HB2 SER 3 HB2 SER 3 0.639 14.904 -7.204
20 HB3 SER 3 HB1 SER 3 -0.080 15.801 -5.870
21 HG SER 3 HG SER 3 2.677 15.208 -6.229
22 H ASP 4 HN ASP 4 -1.154 14.637 -3.694
23 HA ASP 4 HA ASP 4 0.533 15.358 -1.523
24 HB2 ASP 4 HB2 ASP 4 -1.617 16.426 -1.756
25 HB3 ASP 4 HB1 ASP 4 -2.447 14.876 -1.674
26 H MET 5 HN MET 5 -1.505 12.574 -2.223
27 HA MET 5 HA MET 5 -1.011 11.207 0.203
28 HB2 MET 5 HB2 MET 5 -1.909 10.163 -2.480
29 HB3 MET 5 HB1 MET 5 -1.852 9.201 -1.013
30 HG2 MET 5 HG2 MET 5 -3.559 11.621 -1.514
31 HG3 MET 5 HG1 MET 5 -4.097 9.944 -1.404
32 HE1 MET 5 HE1 MET 5 -3.500 9.144 2.384
33 HE2 MET 5 HE2 MET 5 -2.403 8.839 1.039
34 HE3 MET 5 HE3 MET 5 -4.131 8.543 0.850
35 H GLU 6 HN GLU 6 0.661 11.315 -2.869
36 HA GLU 6 HA GLU 6 2.296 9.092 -2.692
37 HB2 GLU 6 HB2 GLU 6 2.175 10.498 -4.667
38 HB3 GLU 6 HB1 GLU 6 2.895 11.843 -3.801
39 HG2 GLU 6 HG2 GLU 6 4.962 10.489 -3.557
40 HG3 GLU 6 HG1 GLU 6 4.213 9.260 -4.574
41 H GLU 7 HN GLU 7 2.832 12.346 -1.382
42 HA GLU 7 HA GLU 7 5.289 11.868 -0.122
43 HB2 GLU 7 HB2 GLU 7 3.029 13.750 0.547
44 HB3 GLU 7 HB1 GLU 7 4.564 13.760 1.401
45 HG2 GLU 7 HG2 GLU 7 4.180 14.232 -1.535
46 HG3 GLU 7 HG1 GLU 7 4.440 15.480 -0.320
47 H LYS 8 HN LYS 8 1.978 11.346 0.934
48 HA LYS 8 HA LYS 8 2.569 10.792 3.647
49 HB2 LYS 8 HB2 LYS 8 0.172 9.815 2.092
50 HB3 LYS 8 HB1 LYS 8 0.293 10.058 3.822
51 HG2 LYS 8 HG2 LYS 8 0.394 12.219 1.769
52 HG3 LYS 8 HG1 LYS 8 -0.998 11.800 2.759
53 HD2 LYS 8 HD2 LYS 8 0.255 12.367 4.771
54 HD3 LYS 8 HD1 LYS 8 1.667 12.765 3.790
55 HE2 LYS 8 HE2 LYS 8 -1.012 14.142 3.608
56 HE3 LYS 8 HE1 LYS 8 0.381 14.760 4.491
57 HZ1 LYS 8 HZ1 LYS 8 1.591 15.007 2.487
58 HZ2 LYS 8 HZ2 LYS 8 0.067 15.696 2.212
59 HZ3 LYS 8 HZ3 LYS 8 0.431 14.168 1.585
60 H PHE 9 HN PHE 9 1.965 8.695 0.840
61 HA PHE 9 HA PHE 9 2.264 6.257 2.259
62 HB2 PHE 9 HB2 PHE 9 2.516 6.886 -0.688
63 HB3 PHE 9 HB1 PHE 9 2.561 5.256 -0.029
64 HD1 PHE 9 HD1 PHE 9 0.496 4.847 1.694
65 HD2 PHE 9 HD2 PHE 9 0.529 7.513 -1.619
66 HE1 PHE 9 HE1 PHE 9 -1.956 4.721 1.574
67 HE2 PHE 9 HE2 PHE 9 -1.924 7.390 -1.747
68 HZ PHE 9 HZ PHE 9 -3.170 5.994 -0.144
69 H ARG 10 HN ARG 10 4.471 8.319 0.470
70 HA ARG 10 HA ARG 10 6.686 6.638 0.340
71 HB2 ARG 10 HB2 ARG 10 6.534 8.715 -0.914
72 HB3 ARG 10 HB1 ARG 10 6.540 9.645 0.575
73 HG2 ARG 10 HG2 ARG 10 8.817 8.997 1.021
74 HG3 ARG 10 HG1 ARG 10 8.820 7.938 -0.389
75 HD2 ARG 10 HD2 ARG 10 8.482 9.853 -1.847
76 HD3 ARG 10 HD1 ARG 10 8.433 10.917 -0.447
77 HE ARG 10 HE ARG 10 10.841 9.542 -0.343
78 HH11 ARG 10 HH11 ARG 10 9.247 11.843 -2.441
79 HH12 ARG 10 HH12 ARG 10 10.728 12.559 -2.994
80 HH21 ARG 10 HH21 ARG 10 12.797 10.485 -1.064
81 HH22 ARG 10 HH22 ARG 10 12.747 11.789 -2.210
82 H GLU 11 HN GLU 11 5.749 8.949 2.835
83 HA GLU 11 HA GLU 11 8.051 8.577 4.441
84 HB2 GLU 11 HB2 GLU 11 6.733 10.590 4.624
85 HB3 GLU 11 HB1 GLU 11 5.315 9.666 5.099
86 HG2 GLU 11 HG2 GLU 11 6.494 8.975 7.149
87 HG3 GLU 11 HG1 GLU 11 7.853 9.997 6.681
88 H ALA 12 HN ALA 12 4.796 7.215 4.562
89 HA ALA 12 HA ALA 12 5.169 5.798 6.986
90 HB1 ALA 12 HB1 ALA 12 3.196 5.278 4.769
91 HB2 ALA 12 HB2 ALA 12 2.953 6.359 6.141
92 HB3 ALA 12 HB3 ALA 12 3.113 4.623 6.405
93 H PHE 13 HN PHE 13 5.556 4.937 3.591
94 HA PHE 13 HA PHE 13 5.952 2.193 3.858
95 HB2 PHE 13 HB2 PHE 13 5.706 3.457 1.704
96 HB3 PHE 13 HB1 PHE 13 7.365 4.013 1.899
97 HD1 PHE 13 HD1 PHE 13 9.204 2.605 1.365
98 HD2 PHE 13 HD2 PHE 13 5.240 1.066 1.374
99 HE1 PHE 13 HE1 PHE 13 9.998 0.562 0.248
100 HE2 PHE 13 HE2 PHE 13 6.020 -0.974 0.266
101 HZ PHE 13 HZ PHE 13 8.405 -1.233 -0.304
102 H ILE 14 HN ILE 14 8.266 4.871 4.033
103 HA ILE 14 HA ILE 14 10.592 3.335 4.376
104 HB ILE 14 HB ILE 14 9.998 6.123 5.384
105 HG12 ILE 14 HG12 ILE 14 11.457 5.218 2.893
106 HG13 ILE 14 HG11 ILE 14 9.793 5.796 2.922
107 HG21 ILE 14 HG21 ILE 14 12.631 4.693 5.046
108 HG22 ILE 14 HG22 ILE 14 11.881 5.152 6.574
109 HG23 ILE 14 HG23 ILE 14 12.441 6.398 5.457
110 HD11 ILE 14 HD11 ILE 14 11.310 7.534 2.190
111 HD12 ILE 14 HD12 ILE 14 12.231 7.382 3.686
112 HD13 ILE 14 HD13 ILE 14 10.567 7.966 3.729
113 H LEU 15 HN LEU 15 8.321 4.703 6.718
114 HA LEU 15 HA LEU 15 9.758 4.054 9.039
115 HB2 LEU 15 HB2 LEU 15 6.776 4.315 8.686
116 HB3 LEU 15 HB1 LEU 15 7.629 4.340 10.216
117 HG LEU 15 HG LEU 15 7.892 6.392 8.019
118 HD11 LEU 15 HD11 LEU 15 6.793 7.887 9.608
119 HD12 LEU 15 HD12 LEU 15 6.598 6.546 10.735
120 HD13 LEU 15 HD13 LEU 15 5.762 6.521 9.183
121 HD21 LEU 15 HD21 LEU 15 9.226 7.644 9.661
122 HD22 LEU 15 HD22 LEU 15 9.992 6.124 9.205
123 HD23 LEU 15 HD23 LEU 15 9.161 6.263 10.754
124 H PHE 16 HN PHE 16 7.306 2.231 7.245
125 HA PHE 16 HA PHE 16 7.247 0.093 9.150
126 HB2 PHE 16 HB2 PHE 16 6.055 0.545 6.447
127 HB3 PHE 16 HB1 PHE 16 6.063 -1.078 7.125
128 HD1 PHE 16 HD1 PHE 16 5.196 2.404 8.187
129 HD2 PHE 16 HD2 PHE 16 4.206 -1.733 8.266
130 HE1 PHE 16 HE1 PHE 16 3.141 2.922 9.436
131 HE2 PHE 16 HE2 PHE 16 2.148 -1.227 9.512
132 HZ PHE 16 HZ PHE 16 1.616 1.106 10.104
133 H SER 17 HN SER 17 8.814 0.563 5.991
134 HA SER 17 HA SER 17 9.731 -2.182 5.970
135 HB2 SER 17 HB2 SER 17 10.770 -1.584 3.822
136 HB3 SER 17 HB1 SER 17 9.084 -1.065 3.870
137 HG SER 17 HG SER 17 9.692 1.000 4.010
138 H SER 18 HN SER 18 10.863 0.812 7.136
139 HA SER 18 HA SER 18 12.821 1.586 7.963
140 HB2 SER 18 HB2 SER 18 13.647 -1.328 8.043
141 HB3 SER 18 HB1 SER 18 14.392 -0.005 8.942
142 HG SER 18 HG SER 18 11.700 -0.885 9.204
143 H CYS 19 HN CYS 19 12.370 0.776 5.048
144 HA CYS 19 HA CYS 19 15.094 1.214 4.100
145 HB2 CYS 19 HB2 CYS 19 13.324 -1.044 3.121
146 HB3 CYS 19 HB1 CYS 19 14.902 -0.616 2.475
147 HG CYS 19 HG CYS 19 16.078 -2.382 3.910
148 H SER 20 HN SER 20 14.105 0.547 1.334
149 HA SER 20 HA SER 20 11.931 2.392 0.882
150 HB2 SER 20 HB2 SER 20 14.004 3.826 1.081
151 HB3 SER 20 HB1 SER 20 14.620 3.009 -0.353
152 HG SER 20 HG SER 20 13.127 5.114 -0.320
153 H ASP 21 HN ASP 21 14.568 0.532 -0.600
154 HA ASP 21 HA ASP 21 13.123 0.278 -3.082
155 HB2 ASP 21 HB2 ASP 21 15.759 -0.869 -2.158
156 HB3 ASP 21 HB1 ASP 21 15.086 -1.133 -3.762
157 H HIS 22 HN HIS 22 13.325 -1.504 -0.170
158 HA HIS 22 HA HIS 22 11.645 -3.576 -1.348
159 HB2 HIS 22 HB2 HIS 22 14.283 -4.061 -0.011
160 HB3 HIS 22 HB1 HIS 22 13.003 -5.261 0.114
161 HD1 HIS 22 HD1 HIS 22 15.876 -5.193 -1.572
162 HD2 HIS 22 HD2 HIS 22 11.971 -5.209 -2.986
163 HE1 HIS 22 HE1 HIS 22 16.000 -6.164 -3.884
164 HE2 HIS 22 HE2 HIS 22 13.606 -6.348 -4.638
165 H ILE 23 HN ILE 23 10.276 -4.629 0.103
166 HA ILE 23 HA ILE 23 10.364 -3.781 2.903
167 HB ILE 23 HB ILE 23 8.788 -2.257 1.821
168 HG12 ILE 23 HG12 ILE 23 7.279 -4.305 3.456
169 HG13 ILE 23 HG11 ILE 23 8.378 -3.117 4.146
170 HG21 ILE 23 HG21 ILE 23 6.722 -3.077 0.788
171 HG22 ILE 23 HG22 ILE 23 7.278 -4.737 1.002
172 HG23 ILE 23 HG23 ILE 23 8.148 -3.650 -0.078
173 HD11 ILE 23 HD11 ILE 23 6.962 -1.319 3.299
174 HD12 ILE 23 HD12 ILE 23 6.068 -2.410 4.359
175 HD13 ILE 23 HD13 ILE 23 5.863 -2.512 2.611
176 H GLU 24 HN GLU 24 9.859 -5.371 4.315
177 HA GLU 24 HA GLU 24 9.551 -8.040 3.596
178 HB2 GLU 24 HB2 GLU 24 8.843 -6.534 6.106
179 HB3 GLU 24 HB1 GLU 24 8.719 -8.284 5.975
180 HG2 GLU 24 HG2 GLU 24 10.776 -7.693 7.030
181 HG3 GLU 24 HG1 GLU 24 11.093 -8.400 5.455
182 H MET 25 HN MET 25 7.852 -9.321 3.195
183 HA MET 25 HA MET 25 5.481 -8.191 2.209
184 HB2 MET 25 HB2 MET 25 6.425 -10.966 2.723
185 HB3 MET 25 HB1 MET 25 4.710 -10.713 2.445
186 HG2 MET 25 HG2 MET 25 6.907 -9.856 0.580
187 HG3 MET 25 HG1 MET 25 5.937 -11.317 0.407
188 HE1 MET 25 HE1 MET 25 5.127 -10.793 -1.978
189 HE2 MET 25 HE2 MET 25 6.147 -9.354 -2.012
190 HE3 MET 25 HE3 MET 25 4.451 -9.248 -2.493
191 H TYR 26 HN TYR 26 6.245 -9.566 5.371
192 HA TYR 26 HA TYR 26 3.514 -9.703 6.167
193 HB2 TYR 26 HB2 TYR 26 4.459 -10.027 8.451
194 HB3 TYR 26 HB1 TYR 26 5.040 -11.171 7.264
195 HD1 TYR 26 HD1 TYR 26 7.359 -11.329 6.755
196 HD2 TYR 26 HD2 TYR 26 5.956 -8.206 9.280
197 HE1 TYR 26 HE1 TYR 26 9.672 -10.831 7.417
198 HE2 TYR 26 HE2 TYR 26 8.269 -7.696 9.944
199 HH TYR 26 HH TYR 26 10.991 -9.102 8.329
200 H LYS 27 HN LYS 27 6.056 -7.305 6.422
201 HA LYS 27 HA LYS 27 4.584 -5.586 8.142
202 HB2 LYS 27 HB2 LYS 27 7.111 -5.886 7.935
203 HB3 LYS 27 HB1 LYS 27 6.991 -4.949 6.453
204 HG2 LYS 27 HG2 LYS 27 7.626 -3.516 8.218
205 HG3 LYS 27 HG1 LYS 27 5.974 -3.138 7.737
206 HD2 LYS 27 HD2 LYS 27 5.120 -4.433 9.624
207 HD3 LYS 27 HD1 LYS 27 6.771 -4.825 10.104
208 HE2 LYS 27 HE2 LYS 27 7.230 -2.510 10.574
209 HE3 LYS 27 HE1 LYS 27 5.648 -2.033 9.952
210 HZ1 LYS 27 HZ1 LYS 27 5.653 -2.131 12.361
211 HZ2 LYS 27 HZ2 LYS 27 6.130 -3.751 12.324
212 HZ3 LYS 27 HZ3 LYS 27 4.607 -3.304 11.725
213 H PHE 28 HN PHE 28 5.076 -6.065 4.756
214 HA PHE 28 HA PHE 28 4.284 -3.608 3.708
215 HB2 PHE 28 HB2 PHE 28 5.342 -5.199 2.287
216 HB3 PHE 28 HB1 PHE 28 4.128 -6.422 2.634
217 HD1 PHE 28 HD1 PHE 28 4.637 -3.148 0.974
218 HD2 PHE 28 HD2 PHE 28 2.249 -6.653 1.291
219 HE1 PHE 28 HE1 PHE 28 3.385 -2.467 -1.026
220 HE2 PHE 28 HE2 PHE 28 0.983 -5.983 -0.702
221 HZ PHE 28 HZ PHE 28 1.547 -3.883 -1.872
222 H PHE 29 HN PHE 29 2.351 -6.405 4.674
223 HA PHE 29 HA PHE 29 -0.049 -5.453 3.502
224 HB2 PHE 29 HB2 PHE 29 0.511 -7.842 4.170
225 HB3 PHE 29 HB1 PHE 29 0.120 -7.370 5.819
226 HD1 PHE 29 HD1 PHE 29 -1.230 -7.880 2.427
227 HD2 PHE 29 HD2 PHE 29 -2.127 -7.055 6.516
228 HE1 PHE 29 HE1 PHE 29 -3.607 -8.351 2.004
229 HE2 PHE 29 HE2 PHE 29 -4.503 -7.509 6.091
230 HZ PHE 29 HZ PHE 29 -5.245 -8.164 3.834
231 H GLU 30 HN GLU 30 1.164 -5.363 6.863
232 HA GLU 30 HA GLU 30 -1.047 -3.897 7.854
233 HB2 GLU 30 HB2 GLU 30 0.423 -3.382 9.802
234 HB3 GLU 30 HB1 GLU 30 0.240 -5.089 9.443
235 HG2 GLU 30 HG2 GLU 30 2.429 -5.068 8.335
236 HG3 GLU 30 HG1 GLU 30 2.607 -3.367 8.764
237 H LEU 31 HN LEU 31 1.872 -3.003 6.260
238 HA LEU 31 HA LEU 31 1.980 -0.280 6.821
239 HB2 LEU 31 HB2 LEU 31 3.791 -1.414 5.755
240 HB3 LEU 31 HB1 LEU 31 2.771 -1.946 4.443
241 HG LEU 31 HG LEU 31 4.503 -0.145 3.982
242 HD11 LEU 31 HD11 LEU 31 2.804 -0.737 2.390
243 HD12 LEU 31 HD12 LEU 31 3.074 1.006 2.388
244 HD13 LEU 31 HD13 LEU 31 1.652 0.333 3.189
245 HD21 LEU 31 HD21 LEU 31 3.828 2.155 4.382
246 HD22 LEU 31 HD22 LEU 31 4.069 1.284 5.896
247 HD23 LEU 31 HD23 LEU 31 2.435 1.590 5.304
248 H MET 32 HN MET 32 0.109 -2.063 4.447
249 HA MET 32 HA MET 32 -1.038 0.382 3.412
250 HB2 MET 32 HB2 MET 32 -2.140 -0.921 1.777
251 HB3 MET 32 HB1 MET 32 -0.535 -1.610 1.961
252 HG2 MET 32 HG2 MET 32 -1.365 -3.462 3.154
253 HG3 MET 32 HG1 MET 32 -2.944 -2.706 3.370
254 HE1 MET 32 HE1 MET 32 -0.597 -2.876 0.297
255 HE2 MET 32 HE2 MET 32 -1.355 -4.100 -0.720
256 HE3 MET 32 HE3 MET 32 -0.551 -4.576 0.778
257 H ASN 33 HN ASN 33 -2.043 -2.173 5.638
258 HA ASN 33 HA ASN 33 -4.793 -1.627 5.697
259 HB2 ASN 33 HB2 ASN 33 -3.125 -2.290 8.117
260 HB3 ASN 33 HB1 ASN 33 -4.853 -2.532 7.930
261 HD21 ASN 33 HD21 ASN 33 -2.698 -4.279 8.602
262 HD22 ASN 33 HD22 ASN 33 -2.757 -5.585 7.470
263 H SER 34 HN SER 34 -2.073 0.069 6.955
264 HA SER 34 HA SER 34 -3.366 1.436 9.034
265 HB2 SER 34 HB2 SER 34 -0.894 2.268 7.490
266 HB3 SER 34 HB1 SER 34 -1.374 2.862 9.079
267 HG SER 34 HG SER 34 -0.413 0.318 8.338
268 H PHE 35 HN PHE 35 -3.211 1.937 5.622
269 HA PHE 35 HA PHE 35 -4.327 4.634 5.815
270 HB2 PHE 35 HB2 PHE 35 -3.297 3.022 3.482
271 HB3 PHE 35 HB1 PHE 35 -4.063 4.598 3.307
272 HD1 PHE 35 HD1 PHE 35 -1.070 2.804 4.321
273 HD2 PHE 35 HD2 PHE 35 -2.960 6.609 4.122
274 HE1 PHE 35 HE1 PHE 35 1.102 3.898 4.683
275 HE2 PHE 35 HE2 PHE 35 -0.792 7.712 4.481
276 HZ PHE 35 HZ PHE 35 1.242 6.356 4.761
277 H GLY 36 HN GLY 36 -5.527 1.629 5.978
278 HA2 GLY 36 HA2 GLY 36 -7.723 0.904 5.813
279 HA3 GLY 36 HA1 GLY 36 -8.140 2.426 5.040
280 H ILE 37 HN ILE 37 -5.480 0.667 3.775
281 HA ILE 37 HA ILE 37 -6.917 0.269 1.284
282 HB ILE 37 HB ILE 37 -4.012 -0.127 2.013
283 HG12 ILE 37 HG12 ILE 37 -5.353 2.008 0.347
284 HG13 ILE 37 HG11 ILE 37 -4.901 2.208 2.035
285 HG21 ILE 37 HG21 ILE 37 -3.599 -0.321 -0.392
286 HG22 ILE 37 HG22 ILE 37 -5.334 -0.254 -0.698
287 HG23 ILE 37 HG23 ILE 37 -4.647 -1.617 0.185
288 HD11 ILE 37 HD11 ILE 37 -2.578 1.961 1.480
289 HD12 ILE 37 HD12 ILE 37 -3.301 3.218 0.476
290 HD13 ILE 37 HD13 ILE 37 -2.983 1.620 -0.201
291 H ILE 38 HN ILE 38 -7.612 -1.654 0.531
292 HA ILE 38 HA ILE 38 -7.119 -4.002 2.198
293 HB ILE 38 HB ILE 38 -9.313 -3.487 0.193
294 HG12 ILE 38 HG12 ILE 38 -9.404 -3.478 3.217
295 HG13 ILE 38 HG11 ILE 38 -9.455 -2.042 2.200
296 HG21 ILE 38 HG21 ILE 38 -10.337 -5.489 1.144
297 HG22 ILE 38 HG22 ILE 38 -8.923 -5.715 2.171
298 HG23 ILE 38 HG23 ILE 38 -8.767 -5.832 0.421
299 HD11 ILE 38 HD11 ILE 38 -11.499 -4.246 2.233
300 HD12 ILE 38 HD12 ILE 38 -11.559 -2.790 1.242
301 HD13 ILE 38 HD13 ILE 38 -11.662 -2.667 2.998
302 H LEU 39 HN LEU 39 -5.721 -5.418 1.428
303 HA LEU 39 HA LEU 39 -5.490 -5.794 -1.484
304 HB2 LEU 39 HB2 LEU 39 -3.414 -5.113 -0.420
305 HB3 LEU 39 HB1 LEU 39 -3.563 -6.402 0.754
306 HG LEU 39 HG LEU 39 -3.320 -8.044 -1.121
307 HD11 LEU 39 HD11 LEU 39 -2.385 -7.256 -3.216
308 HD12 LEU 39 HD12 LEU 39 -2.573 -5.586 -2.685
309 HD13 LEU 39 HD13 LEU 39 -3.998 -6.590 -2.956
310 HD21 LEU 39 HD21 LEU 39 -1.448 -7.475 0.307
311 HD22 LEU 39 HD22 LEU 39 -1.082 -6.078 -0.703
312 HD23 LEU 39 HD23 LEU 39 -0.906 -7.705 -1.357
313 H THR 40 HN THR 40 -6.461 -7.601 -2.218
314 HA THR 40 HA THR 40 -7.158 -9.671 -0.304
315 HB THR 40 HB THR 40 -8.261 -10.752 -2.319
316 HG1 THR 40 HG1 THR 40 -7.789 -8.177 -3.466
317 HG21 THR 40 HG21 THR 40 -9.151 -8.005 -1.462
318 HG22 THR 40 HG22 THR 40 -9.500 -9.526 -0.640
319 HG23 THR 40 HG23 THR 40 -10.169 -9.217 -2.242
320 H ASN 41 HN ASN 41 -6.891 -11.977 -0.983
321 HA ASN 41 HA ASN 41 -4.139 -12.544 -1.306
322 HB2 ASN 41 HB2 ASN 41 -6.590 -14.294 -1.362
323 HB3 ASN 41 HB1 ASN 41 -4.975 -14.946 -1.613
324 HD21 ASN 41 HD21 ASN 41 -5.074 -16.189 0.248
325 HD22 ASN 41 HD22 ASN 41 -4.960 -15.492 1.827
326 H ASP 42 HN ASP 42 -6.835 -12.476 -3.545
327 HA ASP 42 HA ASP 42 -5.542 -13.643 -5.760
328 HB2 ASP 42 HB2 ASP 42 -7.947 -13.310 -5.765
329 HB3 ASP 42 HB1 ASP 42 -7.739 -11.564 -5.653
330 H GLU 43 HN GLU 43 -5.841 -10.269 -4.723
331 HA GLU 43 HA GLU 43 -4.315 -9.165 -6.826
332 HB2 GLU 43 HB2 GLU 43 -4.852 -8.123 -4.043
333 HB3 GLU 43 HB1 GLU 43 -4.135 -7.178 -5.342
334 HG2 GLU 43 HG2 GLU 43 -6.142 -7.349 -6.644
335 HG3 GLU 43 HG1 GLU 43 -6.859 -8.446 -5.466
336 H LYS 44 HN LYS 44 -3.462 -10.324 -3.607
337 HA LYS 44 HA LYS 44 -0.776 -9.683 -3.534
338 HB2 LYS 44 HB2 LYS 44 -2.410 -11.868 -2.347
339 HB3 LYS 44 HB1 LYS 44 -0.658 -12.004 -2.266
340 HG2 LYS 44 HG2 LYS 44 -0.640 -9.702 -1.288
341 HG3 LYS 44 HG1 LYS 44 -2.389 -9.831 -1.132
342 HD2 LYS 44 HD2 LYS 44 -2.214 -11.669 0.353
343 HD3 LYS 44 HD1 LYS 44 -0.487 -11.852 0.029
344 HE2 LYS 44 HE2 LYS 44 -1.876 -9.628 1.500
345 HE3 LYS 44 HE1 LYS 44 -0.713 -10.784 2.143
346 HZ1 LYS 44 HZ1 LYS 44 -0.151 -8.643 0.154
347 HZ2 LYS 44 HZ2 LYS 44 0.971 -9.805 0.668
348 HZ3 LYS 44 HZ3 LYS 44 0.357 -8.680 1.770
349 H ALA 45 HN ALA 45 -2.340 -12.448 -5.084
350 HA ALA 45 HA ALA 45 0.038 -13.718 -5.939
351 HB1 ALA 45 HB1 ALA 45 -1.401 -14.981 -7.453
352 HB2 ALA 45 HB2 ALA 45 -2.724 -13.856 -7.147
353 HB3 ALA 45 HB3 ALA 45 -2.115 -14.876 -5.844
354 H ALA 46 HN ALA 46 -1.443 -10.843 -6.907
355 HA ALA 46 HA ALA 46 -0.433 -10.995 -9.652
356 HB1 ALA 46 HB1 ALA 46 -2.121 -8.874 -8.332
357 HB2 ALA 46 HB2 ALA 46 -2.717 -10.190 -9.341
358 HB3 ALA 46 HB3 ALA 46 -1.688 -8.942 -10.040
359 H LEU 47 HN LEU 47 0.390 -9.675 -6.581
360 HA LEU 47 HA LEU 47 1.960 -7.489 -7.587
361 HB2 LEU 47 HB2 LEU 47 2.410 -8.751 -4.902
362 HB3 LEU 47 HB1 LEU 47 2.646 -7.088 -5.380
363 HG LEU 47 HG LEU 47 0.051 -8.476 -4.753
364 HD11 LEU 47 HD11 LEU 47 -0.127 -6.744 -3.061
365 HD12 LEU 47 HD12 LEU 47 1.401 -6.043 -3.600
366 HD13 LEU 47 HD13 LEU 47 1.376 -7.649 -2.873
367 HD21 LEU 47 HD21 LEU 47 -0.194 -7.031 -6.771
368 HD22 LEU 47 HD22 LEU 47 0.342 -5.663 -5.790
369 HD23 LEU 47 HD23 LEU 47 -1.150 -6.518 -5.380
370 HA PRO 48 HA PRO 48 5.617 -9.823 -8.743
371 HB2 PRO 48 HB2 PRO 48 7.004 -7.311 -7.977
372 HB3 PRO 48 HB1 PRO 48 7.063 -8.208 -9.498
373 HG2 PRO 48 HG2 PRO 48 5.726 -5.906 -9.312
374 HG3 PRO 48 HG1 PRO 48 5.111 -7.250 -10.292
375 HD2 PRO 48 HD2 PRO 48 4.240 -6.319 -7.591
376 HD3 PRO 48 HD1 PRO 48 3.267 -6.931 -8.944
377 H ASN 49 HN ASN 49 7.447 -10.697 -7.719
378 HA ASN 49 HA ASN 49 7.109 -11.206 -4.971
379 HB2 ASN 49 HB2 ASN 49 8.188 -12.773 -6.587
380 HB3 ASN 49 HB1 ASN 49 9.584 -11.708 -6.633
381 HD21 ASN 49 HD21 ASN 49 7.684 -12.461 -3.779
382 HD22 ASN 49 HD22 ASN 49 8.948 -13.297 -2.955
383 H ASP 50 HN ASP 50 9.076 -8.891 -6.707
384 HA ASP 50 HA ASP 50 10.144 -7.936 -4.141
385 HB2 ASP 50 HB2 ASP 50 10.976 -7.352 -6.989
386 HB3 ASP 50 HB1 ASP 50 11.624 -6.496 -5.594
387 H ILE 51 HN ILE 51 8.947 -6.446 -3.205
388 HA ILE 51 HA ILE 51 7.517 -4.508 -4.880
389 HB ILE 51 HB ILE 51 7.079 -5.195 -1.967
390 HG12 ILE 51 HG12 ILE 51 5.426 -5.791 -4.433
391 HG13 ILE 51 HG11 ILE 51 6.357 -6.965 -3.512
392 HG21 ILE 51 HG21 ILE 51 5.091 -3.767 -2.138
393 HG22 ILE 51 HG22 ILE 51 5.552 -3.328 -3.783
394 HG23 ILE 51 HG23 ILE 51 6.572 -2.854 -2.424
395 HD11 ILE 51 HD11 ILE 51 3.981 -7.086 -3.004
396 HD12 ILE 51 HD12 ILE 51 4.004 -5.402 -2.482
397 HD13 ILE 51 HD13 ILE 51 4.921 -6.615 -1.588
398 H ASN 52 HN ASN 52 8.051 -2.415 -4.846
399 HA ASN 52 HA ASN 52 9.894 -1.482 -2.753
400 HB2 ASN 52 HB2 ASN 52 10.945 0.006 -4.396
401 HB3 ASN 52 HB1 ASN 52 11.123 -1.672 -4.849
402 HD21 ASN 52 HD21 ASN 52 11.296 0.686 -6.487
403 HD22 ASN 52 HD22 ASN 52 10.114 0.498 -7.737
404 H MET 53 HN MET 53 9.980 1.126 -3.220
405 HA MET 53 HA MET 53 7.497 2.018 -2.206
406 HB2 MET 53 HB2 MET 53 9.559 3.148 -1.607
407 HB3 MET 53 HB1 MET 53 9.841 3.587 -3.286
408 HG2 MET 53 HG2 MET 53 7.933 5.029 -3.291
409 HG3 MET 53 HG1 MET 53 7.480 4.495 -1.678
410 HE1 MET 53 HE1 MET 53 8.895 5.030 0.501
411 HE2 MET 53 HE2 MET 53 10.372 5.992 0.507
412 HE3 MET 53 HE3 MET 53 10.366 4.393 -0.235
413 H ASP 54 HN ASP 54 9.009 2.170 -5.387
414 HA ASP 54 HA ASP 54 7.185 3.895 -6.621
415 HB2 ASP 54 HB2 ASP 54 9.272 3.345 -7.705
416 HB3 ASP 54 HB1 ASP 54 8.828 1.645 -7.795
417 H TYR 55 HN TYR 55 7.152 0.310 -6.459
418 HA TYR 55 HA TYR 55 4.753 0.038 -7.929
419 HB2 TYR 55 HB2 TYR 55 6.340 -1.856 -7.460
420 HB3 TYR 55 HB1 TYR 55 5.748 -1.872 -5.801
421 HD1 TYR 55 HD1 TYR 55 3.630 -2.869 -5.243
422 HD2 TYR 55 HD2 TYR 55 4.807 -2.461 -9.315
423 HE1 TYR 55 HE1 TYR 55 1.780 -4.311 -5.916
424 HE2 TYR 55 HE2 TYR 55 2.946 -3.911 -9.997
425 HH TYR 55 HH TYR 55 0.378 -4.666 -8.003
426 H TRP 56 HN TRP 56 5.407 0.277 -4.461
427 HA TRP 56 HA TRP 56 2.810 -0.018 -3.509
428 HB2 TRP 56 HB2 TRP 56 4.647 -0.036 -1.969
429 HB3 TRP 56 HB1 TRP 56 5.158 1.572 -2.464
430 HD1 TRP 56 HD1 TRP 56 4.702 3.173 -0.501
431 HE1 TRP 56 HE1 TRP 56 2.733 3.585 1.104
432 HE3 TRP 56 HE3 TRP 56 1.639 -0.612 -2.010
433 HZ2 TRP 56 HZ2 TRP 56 0.204 2.455 1.647
434 HZ3 TRP 56 HZ3 TRP 56 -0.543 -0.880 -0.905
435 HH2 TRP 56 HH2 TRP 56 -1.239 0.624 0.884
436 H LEU 57 HN LEU 57 4.576 2.883 -4.446
437 HA LEU 57 HA LEU 57 2.709 4.816 -3.782
438 HB2 LEU 57 HB2 LEU 57 5.195 4.743 -4.647
439 HB3 LEU 57 HB1 LEU 57 4.431 5.003 -6.198
440 HG LEU 57 HG LEU 57 3.512 7.085 -5.445
441 HD11 LEU 57 HD11 LEU 57 4.886 6.464 -2.817
442 HD12 LEU 57 HD12 LEU 57 3.141 6.538 -3.080
443 HD13 LEU 57 HD13 LEU 57 4.113 7.997 -3.228
444 HD21 LEU 57 HD21 LEU 57 6.400 6.462 -5.165
445 HD22 LEU 57 HD22 LEU 57 5.849 8.108 -4.826
446 HD23 LEU 57 HD23 LEU 57 5.569 7.391 -6.415
447 H ASN 58 HN ASN 58 3.322 3.290 -6.888
448 HA ASN 58 HA ASN 58 1.193 4.409 -8.321
449 HB2 ASN 58 HB2 ASN 58 3.239 3.218 -9.256
450 HB3 ASN 58 HB1 ASN 58 2.437 1.707 -8.853
451 HD21 ASN 58 HD21 ASN 58 3.261 2.785 -11.431
452 HD22 ASN 58 HD22 ASN 58 1.838 2.838 -12.412
453 H PHE 59 HN PHE 59 1.484 1.427 -6.438
454 HA PHE 59 HA PHE 59 -1.004 0.293 -7.055
455 HB2 PHE 59 HB2 PHE 59 0.743 -0.940 -5.852
456 HB3 PHE 59 HB1 PHE 59 0.613 0.161 -4.490
457 HD1 PHE 59 HD1 PHE 59 -0.510 -2.888 -5.919
458 HD2 PHE 59 HD2 PHE 59 -1.637 0.216 -3.233
459 HE1 PHE 59 HE1 PHE 59 -2.158 -4.387 -4.876
460 HE2 PHE 59 HE2 PHE 59 -3.294 -1.274 -2.194
461 HZ PHE 59 HZ PHE 59 -3.553 -3.582 -3.014
462 H ALA 60 HN ALA 60 -0.019 2.658 -4.645
463 HA ALA 60 HA ALA 60 -2.507 2.746 -3.275
464 HB1 ALA 60 HB1 ALA 60 -0.307 4.797 -3.395
465 HB2 ALA 60 HB2 ALA 60 -0.402 3.448 -2.262
466 HB3 ALA 60 HB3 ALA 60 -1.607 4.733 -2.204
467 H LYS 61 HN LYS 61 -1.076 4.806 -5.786
468 HA LYS 61 HA LYS 61 -3.275 6.583 -5.864
469 HB2 LYS 61 HB2 LYS 61 -2.229 7.549 -7.814
470 HB3 LYS 61 HB1 LYS 61 -1.101 7.347 -6.483
471 HG2 LYS 61 HG2 LYS 61 0.151 6.594 -8.159
472 HG3 LYS 61 HG1 LYS 61 -0.603 5.078 -7.710
473 HD2 LYS 61 HD2 LYS 61 -0.960 5.032 -9.975
474 HD3 LYS 61 HD1 LYS 61 -2.421 5.863 -9.430
475 HE2 LYS 61 HE2 LYS 61 0.076 7.202 -10.478
476 HE3 LYS 61 HE1 LYS 61 -1.406 6.947 -11.394
477 HZ1 LYS 61 HZ1 LYS 61 -1.115 8.627 -8.965
478 HZ2 LYS 61 HZ2 LYS 61 -2.569 8.353 -9.783
479 HZ3 LYS 61 HZ3 LYS 61 -1.313 9.185 -10.548
480 H LYS 62 HN LYS 62 -2.590 3.592 -7.301
481 HA LYS 62 HA LYS 62 -4.393 3.838 -9.523
482 HB2 LYS 62 HB2 LYS 62 -2.345 2.506 -9.658
483 HB3 LYS 62 HB1 LYS 62 -2.924 1.490 -8.343
484 HG2 LYS 62 HG2 LYS 62 -4.690 0.625 -9.741
485 HG3 LYS 62 HG1 LYS 62 -4.233 1.722 -11.049
486 HD2 LYS 62 HD2 LYS 62 -3.345 -0.507 -11.463
487 HD3 LYS 62 HD1 LYS 62 -2.031 0.632 -11.174
488 HE2 LYS 62 HE2 LYS 62 -1.958 -0.148 -8.812
489 HE3 LYS 62 HE1 LYS 62 -3.159 -1.371 -9.219
490 HZ1 LYS 62 HZ1 LYS 62 -0.964 -2.315 -9.287
491 HZ2 LYS 62 HZ2 LYS 62 -0.428 -1.129 -10.360
492 HZ3 LYS 62 HZ3 LYS 62 -1.579 -2.260 -10.860
493 H HIS 63 HN HIS 63 -4.341 2.023 -6.497
494 HA HIS 63 HA HIS 63 -6.680 0.560 -7.052
495 HB2 HIS 63 HB2 HIS 63 -6.328 -0.463 -5.046
496 HB3 HIS 63 HB1 HIS 63 -4.744 0.250 -5.280
497 HD1 HIS 63 HD1 HIS 63 -7.490 0.085 -2.917
498 HD2 HIS 63 HD2 HIS 63 -4.381 2.704 -3.777
499 HE1 HIS 63 HE1 HIS 63 -7.261 1.543 -0.885
500 HE2 HIS 63 HE2 HIS 63 -5.510 3.244 -1.496
501 H TYR 64 HN TYR 64 -6.171 3.713 -5.683
502 HA TYR 64 HA TYR 64 -9.046 3.780 -5.012
503 HB2 TYR 64 HB2 TYR 64 -8.650 5.680 -3.559
504 HB3 TYR 64 HB1 TYR 64 -7.664 4.312 -3.081
505 HD1 TYR 64 HD1 TYR 64 -7.019 6.942 -5.677
506 HD2 TYR 64 HD2 TYR 64 -5.847 5.219 -1.975
507 HE1 TYR 64 HE1 TYR 64 -5.068 8.425 -5.614
508 HE2 TYR 64 HE2 TYR 64 -3.882 6.684 -1.911
509 HH TYR 64 HH TYR 64 -3.552 9.377 -3.919
510 H ASN 65 HN ASN 65 -9.681 6.348 -4.986
511 HA ASN 65 HA ASN 65 -10.443 8.038 -6.260
512 HB2 ASN 65 HB2 ASN 65 -7.993 8.586 -6.287
513 HB3 ASN 65 HB1 ASN 65 -7.872 7.746 -7.827
514 HD21 ASN 65 HD21 ASN 65 -9.320 10.475 -6.168
515 HD22 ASN 65 HD22 ASN 65 -9.578 11.436 -7.582
516 H TYR 66 HN TYR 66 -11.591 5.763 -6.826
517 HA TYR 66 HA TYR 66 -11.720 5.635 -9.755
518 HB2 TYR 66 HB2 TYR 66 -13.213 3.570 -9.213
519 HB3 TYR 66 HB1 TYR 66 -11.469 3.436 -9.057
520 HD1 TYR 66 HD1 TYR 66 -14.657 3.499 -7.246
521 HD2 TYR 66 HD2 TYR 66 -10.427 3.242 -6.867
522 HE1 TYR 66 HE1 TYR 66 -14.915 2.700 -4.931
523 HE2 TYR 66 HE2 TYR 66 -10.675 2.447 -4.556
524 HH TYR 66 HH TYR 66 -13.612 1.379 -3.282
525 H GLU 67 HN GLU 67 -13.160 6.934 -10.618
526 HA GLU 67 HA GLU 67 -15.396 7.959 -9.135
527 HB2 GLU 67 HB2 GLU 67 -14.846 8.221 -12.097
528 HB3 GLU 67 HB1 GLU 67 -15.901 9.237 -11.123
529 HG2 GLU 67 HG2 GLU 67 -13.926 9.989 -9.843
530 HG3 GLU 67 HG1 GLU 67 -12.905 9.048 -10.928
531 H GLN 68 HN GLN 68 -14.821 5.509 -11.529
532 HA GLN 68 HA GLN 68 -17.511 4.467 -11.033
533 HB2 GLN 68 HB2 GLN 68 -17.149 5.721 -13.333
534 HB3 GLN 68 HB1 GLN 68 -16.332 4.234 -13.783
535 HG2 GLN 68 HG2 GLN 68 -19.145 4.318 -12.728
536 HG3 GLN 68 HG1 GLN 68 -18.748 4.409 -14.439
537 HE21 GLN 68 HE21 GLN 68 -16.560 2.525 -14.292
538 HE22 GLN 68 HE22 GLN 68 -17.269 0.963 -14.069
539 HA PRO 69 HA PRO 69 -14.394 1.291 -10.195
540 HB2 PRO 69 HB2 PRO 69 -15.923 -0.153 -8.487
541 HB3 PRO 69 HB1 PRO 69 -15.057 1.307 -7.997
542 HG2 PRO 69 HG2 PRO 69 -17.942 0.956 -8.690
543 HG3 PRO 69 HG1 PRO 69 -17.207 1.928 -7.403
544 HD2 PRO 69 HD2 PRO 69 -18.091 2.974 -9.764
545 HD3 PRO 69 HD1 PRO 69 -16.777 3.688 -8.810
546 H PHE 70 HN PHE 70 -14.051 -0.510 -11.321
547 HA PHE 70 HA PHE 70 -16.146 -1.629 -12.957
548 HB2 PHE 70 HB2 PHE 70 -13.265 -2.492 -12.590
549 HB3 PHE 70 HB1 PHE 70 -14.364 -3.093 -13.821
550 HD1 PHE 70 HD1 PHE 70 -15.232 -1.463 -15.553
551 HD2 PHE 70 HD2 PHE 70 -11.990 -0.577 -12.948
552 HE1 PHE 70 HE1 PHE 70 -14.492 0.309 -17.088
553 HE2 PHE 70 HE2 PHE 70 -11.245 1.201 -14.474
554 HZ PHE 70 HZ PHE 70 -12.497 1.647 -16.548
555 H LYS 71 HN LYS 71 -17.321 -2.144 -10.837
556 HA LYS 71 HA LYS 71 -16.340 -4.226 -9.177
557 HB2 LYS 71 HB2 LYS 71 -19.085 -3.048 -9.556
558 HB3 LYS 71 HB1 LYS 71 -18.766 -4.339 -8.413
559 HG2 LYS 71 HG2 LYS 71 -17.550 -1.585 -8.388
560 HG3 LYS 71 HG1 LYS 71 -18.778 -2.206 -7.285
561 HD2 LYS 71 HD2 LYS 71 -17.144 -3.953 -6.566
562 HD3 LYS 71 HD1 LYS 71 -15.924 -3.144 -7.548
563 HE2 LYS 71 HE2 LYS 71 -15.670 -2.432 -5.275
564 HE3 LYS 71 HE1 LYS 71 -16.299 -1.081 -6.217
565 HZ1 LYS 71 HZ1 LYS 71 -18.515 -1.583 -5.375
566 HZ2 LYS 71 HZ2 LYS 71 -17.442 -1.279 -4.105
567 HZ3 LYS 71 HZ3 LYS 71 -17.899 -2.868 -4.463
568 H HIS 72 HN HIS 72 -19.136 -4.275 -11.374
569 HA HIS 72 HA HIS 72 -20.148 -5.947 -12.524
570 HB2 HIS 72 HB2 HIS 72 -17.279 -6.821 -12.882
571 HB3 HIS 72 HB1 HIS 72 -18.638 -7.405 -13.838
572 HD1 HIS 72 HD1 HIS 72 -16.001 -5.059 -14.034
573 HD2 HIS 72 HD2 HIS 72 -20.021 -4.983 -15.089
574 HE1 HIS 72 HE1 HIS 72 -16.237 -3.171 -15.671
575 HE2 HIS 72 HE2 HIS 72 -18.701 -3.033 -16.152
576 H ILE 73 HN ILE 73 -21.131 -6.732 -10.592
577 HA ILE 73 HA ILE 73 -21.810 -8.372 -9.177
578 HB ILE 73 HB ILE 73 -19.832 -10.178 -10.590
579 HG12 ILE 73 HG12 ILE 73 -22.780 -9.783 -11.151
580 HG13 ILE 73 HG11 ILE 73 -21.479 -9.116 -12.131
581 HG21 ILE 73 HG21 ILE 73 -20.592 -11.060 -8.449
582 HG22 ILE 73 HG22 ILE 73 -21.268 -11.993 -9.784
583 HG23 ILE 73 HG23 ILE 73 -22.271 -10.818 -8.933
584 HD11 ILE 73 HD11 ILE 73 -22.394 -11.115 -13.142
585 HD12 ILE 73 HD12 ILE 73 -22.038 -12.038 -11.682
586 HD13 ILE 73 HD13 ILE 73 -20.721 -11.379 -12.652
587 H ASN 74 HN ASN 74 -20.751 -6.993 -7.608
588 HA ASN 74 HA ASN 74 -18.155 -7.908 -6.631
589 HB2 ASN 74 HB2 ASN 74 -18.608 -5.470 -6.914
590 HB3 ASN 74 HB1 ASN 74 -19.859 -5.589 -5.687
591 HD21 ASN 74 HD21 ASN 74 -16.778 -7.277 -5.588
592 HD22 ASN 74 HD22 ASN 74 -16.145 -6.406 -4.235