Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
624599 | 5n2o RC | 34095 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 28.222 -2.479 -2.661
2 HA2 GLY 1 HA2 GLY 1 26.609 -3.853 -0.599
3 HA3 GLY 1 HA3 GLY 1 27.547 -2.364 -0.323
4 HA PRO 2 HA PRO 2 23.187 -1.524 -2.186
5 HB2 PRO 2 HB2 PRO 2 21.658 -1.080 0.071
6 HB3 PRO 2 HB3 PRO 2 21.787 -2.654 -0.747
7 HG2 PRO 2 HG2 PRO 2 23.294 -1.678 1.697
8 HG3 PRO 2 HG3 PRO 2 22.529 -3.272 1.436
9 HD2 PRO 2 HD2 PRO 2 25.217 -2.806 1.107
10 HD3 PRO 2 HD3 PRO 2 24.337 -4.000 0.113
11 H LEU 3 H LEU 3 22.022 0.714 -1.845
12 HA LEU 3 HA LEU 3 23.797 2.602 -0.429
13 HB2 LEU 3 HB2 LEU 3 24.529 2.429 -2.804
14 HB3 LEU 3 HB3 LEU 3 22.934 2.964 -3.318
15 HG LEU 3 HG LEU 3 23.283 5.132 -2.141
16 HD11 LEU 3 HD11 LEU 3 25.565 5.683 -1.305
17 HD12 LEU 3 HD12 LEU 3 26.041 3.981 -1.497
18 HD13 LEU 3 HD13 LEU 3 24.799 4.466 -0.321
19 HD21 LEU 3 HD21 LEU 3 25.001 6.001 -3.692
20 HD22 LEU 3 HD22 LEU 3 23.918 4.868 -4.503
21 HD23 LEU 3 HD23 LEU 3 25.544 4.342 -4.031
22 H GLY 4 H GLY 4 22.104 2.346 1.090
23 HA2 GLY 4 HA2 GLY 4 20.535 3.553 2.271
24 HA3 GLY 4 HA3 GLY 4 20.054 4.439 0.818
25 H SER 5 H SER 5 18.946 3.131 -0.899
26 HA SER 5 HA SER 5 16.787 1.553 0.229
27 HB2 SER 5 HB2 SER 5 17.492 2.169 -2.678
28 HB3 SER 5 HB3 SER 5 15.927 1.621 -2.057
29 HG SER 5 HG SER 5 15.933 3.845 -2.385
30 H THR 6 H THR 6 16.218 -0.584 -0.865
31 HA THR 6 HA THR 6 18.374 -2.138 -2.027
32 HB THR 6 HB THR 6 17.308 -3.084 0.667
33 HG1 THR 6 HG1 THR 6 19.310 -1.331 0.080
34 HG21 THR 6 HG21 THR 6 19.653 -3.986 -1.063
35 HG22 THR 6 HG22 THR 6 18.123 -4.849 -0.866
36 HG23 THR 6 HG23 THR 6 19.206 -4.671 0.523
37 H ASP 7 H ASP 7 15.061 -2.010 -0.632
38 HA ASP 7 HA ASP 7 13.973 -3.473 -2.931
39 HB2 ASP 7 HB2 ASP 7 13.861 -4.478 -0.051
40 HB3 ASP 7 HB3 ASP 7 12.610 -4.863 -1.232
41 H CYS 8 H CYS 8 12.180 -2.133 -3.433
42 HA CYS 8 HA CYS 8 10.967 -0.585 -1.171
43 HB2 CYS 8 HB2 CYS 8 11.445 0.338 -4.019
44 HB3 CYS 8 HB3 CYS 8 10.595 1.240 -2.758
45 HG CYS 8 HG CYS 8 12.925 2.295 -3.056
46 H SER 9 H SER 9 9.228 -1.973 -0.765
47 HA SER 9 HA SER 9 7.078 -1.806 -2.751
48 HB2 SER 9 HB2 SER 9 8.238 -4.386 -1.639
49 HB3 SER 9 HB3 SER 9 6.565 -4.273 -2.220
50 HG SER 9 HG SER 9 8.046 -4.952 -3.818
51 H ILE 10 H ILE 10 5.039 -2.744 -1.578
52 HA ILE 10 HA ILE 10 4.549 -1.059 0.629
53 HB ILE 10 HB ILE 10 2.869 -3.456 -0.196
54 HG12 ILE 10 HG12 ILE 10 2.544 -0.666 -1.282
55 HG13 ILE 10 HG13 ILE 10 3.333 -2.001 -2.104
56 HG21 ILE 10 HG21 ILE 10 2.279 -2.490 1.932
57 HG22 ILE 10 HG22 ILE 10 2.211 -0.849 1.240
58 HG23 ILE 10 HG23 ILE 10 1.020 -2.086 0.787
59 HD11 ILE 10 HD11 ILE 10 1.227 -3.393 -1.767
60 HD12 ILE 10 HD12 ILE 10 0.410 -1.893 -1.303
61 HD13 ILE 10 HD13 ILE 10 1.091 -2.067 -2.922
62 H VAL 11 H VAL 11 5.830 -4.262 0.447
63 HA VAL 11 HA VAL 11 5.234 -5.368 2.932
64 HB VAL 11 HB VAL 11 7.410 -6.542 2.850
65 HG11 VAL 11 HG11 VAL 11 6.011 -6.456 0.141
66 HG12 VAL 11 HG12 VAL 11 7.015 -7.770 0.782
67 HG13 VAL 11 HG13 VAL 11 5.488 -7.394 1.564
68 HG21 VAL 11 HG21 VAL 11 8.997 -5.005 1.977
69 HG22 VAL 11 HG22 VAL 11 8.832 -6.273 0.779
70 HG23 VAL 11 HG23 VAL 11 8.043 -4.710 0.505
71 H SER 12 H SER 12 7.981 -3.159 2.325
72 HA SER 12 HA SER 12 8.786 -2.912 5.050
73 HB2 SER 12 HB2 SER 12 10.105 -2.342 3.004
74 HB3 SER 12 HB3 SER 12 9.110 -0.892 2.787
75 HG SER 12 HG SER 12 11.206 -1.436 4.436
76 H PHE 13 H PHE 13 6.375 -1.167 3.155
77 HA PHE 13 HA PHE 13 5.952 0.970 5.017
78 HB2 PHE 13 HB2 PHE 13 5.494 0.914 2.526
79 HB3 PHE 13 HB3 PHE 13 4.101 -0.108 2.862
80 HD1 PHE 13 HD1 PHE 13 2.046 0.943 3.151
81 HD2 PHE 13 HD2 PHE 13 5.652 3.052 4.138
82 HE1 PHE 13 HE1 PHE 13 0.717 2.956 3.634
83 HE2 PHE 13 HE2 PHE 13 4.338 5.119 4.550
84 HZ PHE 13 HZ PHE 13 1.863 5.085 4.348
85 H PHE 14 H PHE 14 4.484 -2.213 4.476
86 HA PHE 14 HA PHE 14 2.420 -1.851 6.486
87 HB2 PHE 14 HB2 PHE 14 3.412 -4.121 4.776
88 HB3 PHE 14 HB3 PHE 14 2.420 -4.471 6.175
89 HD1 PHE 14 HD1 PHE 14 0.561 -5.306 4.832
90 HD2 PHE 14 HD2 PHE 14 1.933 -1.235 4.298
91 HE1 PHE 14 HE1 PHE 14 -1.461 -4.754 3.537
92 HE2 PHE 14 HE2 PHE 14 -0.042 -0.693 3.074
93 HZ PHE 14 HZ PHE 14 -1.801 -2.412 2.713
94 H ALA 15 H ALA 15 5.675 -3.286 6.426
95 HA ALA 15 HA ALA 15 5.708 -4.364 8.992
96 HB1 ALA 15 HB1 ALA 15 7.469 -4.654 7.265
97 HB2 ALA 15 HB2 ALA 15 8.007 -2.982 7.534
98 HB3 ALA 15 HB3 ALA 15 8.135 -4.184 8.826
99 H ARG 16 H ARG 16 6.577 -0.911 7.991
100 HA ARG 16 HA ARG 16 7.006 -0.101 10.674
101 HB2 ARG 16 HB2 ARG 16 6.739 2.172 9.797
102 HB3 ARG 16 HB3 ARG 16 7.841 1.098 8.873
103 HG2 ARG 16 HG2 ARG 16 6.111 0.854 7.204
104 HG3 ARG 16 HG3 ARG 16 5.160 2.134 7.979
105 HD2 ARG 16 HD2 ARG 16 6.315 3.243 6.287
106 HD3 ARG 16 HD3 ARG 16 7.379 3.518 7.675
107 HE ARG 16 HE ARG 16 8.145 1.072 6.457
108 HH11 ARG 16 HH11 ARG 16 7.997 4.476 5.392
109 HH12 ARG 16 HH12 ARG 16 9.440 4.405 4.480
110 HH21 ARG 16 HH21 ARG 16 9.977 0.897 5.026
111 HH22 ARG 16 HH22 ARG 16 10.523 2.308 4.200
112 H LEU 17 H LEU 17 4.230 0.283 8.697
113 HA LEU 17 HA LEU 17 2.492 1.568 10.597
114 HB2 LEU 17 HB2 LEU 17 1.687 -0.457 8.469
115 HB3 LEU 17 HB3 LEU 17 0.511 0.471 9.401
116 HG LEU 17 HG LEU 17 2.664 1.784 7.785
117 HD11 LEU 17 HD11 LEU 17 1.450 0.412 6.229
118 HD12 LEU 17 HD12 LEU 17 0.929 2.100 6.024
119 HD13 LEU 17 HD13 LEU 17 -0.103 0.948 6.927
120 HD21 LEU 17 HD21 LEU 17 1.432 3.314 9.350
121 HD22 LEU 17 HD22 LEU 17 -0.122 2.769 8.658
122 HD23 LEU 17 HD23 LEU 17 0.996 3.700 7.671
123 H GLY 18 H GLY 18 3.174 -1.942 10.289
124 HA2 GLY 18 HA2 GLY 18 3.115 -3.326 12.216
125 HA3 GLY 18 HA3 GLY 18 1.698 -2.459 12.821
126 H CYS 19 H CYS 19 1.514 -2.770 9.427
127 HA CYS 19 HA CYS 19 -0.732 -4.597 9.658
128 HB2 CYS 19 HB2 CYS 19 0.812 -3.458 7.325
129 HB3 CYS 19 HB3 CYS 19 -0.520 -4.604 7.094
130 HG CYS 19 HG CYS 19 -0.647 -1.788 8.864
131 H SER 20 H SER 20 -0.589 -6.880 9.727
132 HA SER 20 HA SER 20 2.028 -8.121 9.030
133 HB2 SER 20 HB2 SER 20 1.435 -8.179 11.391
134 HB3 SER 20 HB3 SER 20 -0.055 -9.068 11.009
135 HG SER 20 HG SER 20 1.743 -10.426 11.590
136 H SER 21 H SER 21 -1.111 -9.877 9.398
137 HA SER 21 HA SER 21 -0.775 -11.551 7.286
138 HB2 SER 21 HB2 SER 21 -3.454 -10.368 8.116
139 HB3 SER 21 HB3 SER 21 -3.163 -11.968 7.411
140 HG SER 21 HG SER 21 -2.401 -12.678 9.249
141 H CYS 22 H CYS 22 -2.019 -8.222 7.033
142 HA CYS 22 HA CYS 22 -3.093 -8.548 4.405
143 HB2 CYS 22 HB2 CYS 22 -2.014 -5.961 5.598
144 HB3 CYS 22 HB3 CYS 22 -3.296 -6.163 4.395
145 HG CYS 22 HG CYS 22 -5.093 -7.166 5.872
146 H LEU 23 H LEU 23 0.232 -7.991 5.559
147 HA LEU 23 HA LEU 23 1.208 -7.091 3.004
148 HB2 LEU 23 HB2 LEU 23 3.103 -6.601 4.090
149 HB3 LEU 23 HB3 LEU 23 2.101 -6.740 5.514
150 HG LEU 23 HG LEU 23 2.958 -9.215 5.639
151 HD11 LEU 23 HD11 LEU 23 4.162 -9.306 3.443
152 HD12 LEU 23 HD12 LEU 23 5.290 -9.454 4.764
153 HD13 LEU 23 HD13 LEU 23 5.135 -7.909 3.909
154 HD21 LEU 23 HD21 LEU 23 4.620 -6.737 6.250
155 HD22 LEU 23 HD22 LEU 23 4.977 -8.375 6.888
156 HD23 LEU 23 HD23 LEU 23 3.467 -7.572 7.293
157 H ASP 24 H ASP 24 0.903 -10.072 4.876
158 HA ASP 24 HA ASP 24 2.415 -11.823 3.254
159 HB2 ASP 24 HB2 ASP 24 1.625 -12.494 5.476
160 HB3 ASP 24 HB3 ASP 24 -0.056 -12.465 4.924
161 H TYR 25 H TYR 25 -1.079 -11.027 3.223
162 HA TYR 25 HA TYR 25 -1.742 -12.544 0.926
163 HB2 TYR 25 HB2 TYR 25 -2.982 -9.887 1.784
164 HB3 TYR 25 HB3 TYR 25 -3.699 -11.122 0.736
165 HD1 TYR 25 HD1 TYR 25 -4.797 -9.859 3.458
166 HD2 TYR 25 HD2 TYR 25 -2.809 -13.559 2.459
167 HE1 TYR 25 HE1 TYR 25 -5.766 -10.937 5.449
168 HE2 TYR 25 HE2 TYR 25 -3.797 -14.647 4.370
169 HH TYR 25 HH TYR 25 -4.990 -14.349 6.348
170 H PHE 26 H PHE 26 -0.741 -9.018 1.099
171 HA PHE 26 HA PHE 26 -0.804 -8.567 -1.636
172 HB2 PHE 26 HB2 PHE 26 0.328 -7.378 0.800
173 HB3 PHE 26 HB3 PHE 26 1.337 -7.106 -0.557
174 HD1 PHE 26 HD1 PHE 26 0.409 -6.048 -2.680
175 HD2 PHE 26 HD2 PHE 26 -1.828 -6.285 1.012
176 HE1 PHE 26 HE1 PHE 26 -1.064 -4.223 -3.448
177 HE2 PHE 26 HE2 PHE 26 -3.337 -4.552 0.210
178 HZ PHE 26 HZ PHE 26 -2.931 -3.444 -2.038
179 H THR 27 H THR 27 2.088 -9.736 0.247
180 HA THR 27 HA THR 27 3.680 -9.787 -2.151
181 HB THR 27 HB THR 27 4.610 -9.427 0.075
182 HG1 THR 27 HG1 THR 27 6.140 -9.933 -1.274
183 HG21 THR 27 HG21 THR 27 3.399 -11.057 1.444
184 HG22 THR 27 HG22 THR 27 5.135 -11.272 1.580
185 HG23 THR 27 HG23 THR 27 4.186 -12.397 0.579
186 H THR 28 H THR 28 1.607 -12.206 -0.549
187 HA THR 28 HA THR 28 2.430 -14.404 -2.165
188 HB THR 28 HB THR 28 -0.225 -13.854 -0.761
189 HG1 THR 28 HG1 THR 28 1.283 -13.866 0.740
190 HG21 THR 28 HG21 THR 28 1.002 -16.454 -1.763
191 HG22 THR 28 HG22 THR 28 -0.487 -15.695 -2.351
192 HG23 THR 28 HG23 THR 28 -0.425 -16.323 -0.701
193 H GLN 29 H GLN 29 -0.166 -11.853 -2.673
194 HA GLN 29 HA GLN 29 -1.108 -13.015 -5.100
195 HB2 GLN 29 HB2 GLN 29 -1.114 -10.175 -4.011
196 HB3 GLN 29 HB3 GLN 29 -2.018 -10.714 -5.445
197 HG2 GLN 29 HG2 GLN 29 -2.535 -12.077 -2.816
198 HG3 GLN 29 HG3 GLN 29 -3.194 -10.473 -3.113
199 HE21 GLN 29 HE21 GLN 29 -5.417 -10.858 -3.499
200 HE22 GLN 29 HE22 GLN 29 -5.977 -12.014 -4.683
201 H GLY 30 H GLY 30 1.653 -10.935 -4.257
202 HA2 GLY 30 HA2 GLY 30 3.601 -10.608 -5.488
203 HA3 GLY 30 HA3 GLY 30 2.841 -11.364 -6.900
204 H LEU 31 H LEU 31 1.050 -8.877 -5.342
205 HA LEU 31 HA LEU 31 1.720 -6.886 -7.464
206 HB2 LEU 31 HB2 LEU 31 -0.722 -6.180 -7.140
207 HB3 LEU 31 HB3 LEU 31 -0.364 -7.666 -8.000
208 HG LEU 31 HG LEU 31 -0.885 -8.982 -5.998
209 HD11 LEU 31 HD11 LEU 31 -2.209 -7.935 -4.138
210 HD12 LEU 31 HD12 LEU 31 -1.751 -6.342 -4.779
211 HD13 LEU 31 HD13 LEU 31 -0.509 -7.470 -4.174
212 HD21 LEU 31 HD21 LEU 31 -2.584 -8.669 -7.679
213 HD22 LEU 31 HD22 LEU 31 -3.172 -7.208 -6.846
214 HD23 LEU 31 HD23 LEU 31 -3.276 -8.814 -6.058
215 H THR 32 H THR 32 3.083 -7.047 -4.838
216 HA THR 32 HA THR 32 1.960 -4.699 -3.402
217 HB THR 32 HB THR 32 2.546 -6.406 -1.973
218 HG1 THR 32 HG1 THR 32 3.850 -5.481 -0.658
219 HG21 THR 32 HG21 THR 32 5.264 -6.739 -3.216
220 HG22 THR 32 HG22 THR 32 3.900 -7.886 -3.324
221 HG23 THR 32 HG23 THR 32 4.656 -7.561 -1.762
222 H THR 33 H THR 33 2.552 -2.661 -4.021
223 HA THR 33 HA THR 33 5.318 -2.148 -4.598
224 HB THR 33 HB THR 33 5.071 -2.541 -6.794
225 HG1 THR 33 HG1 THR 33 5.278 -0.506 -6.956
226 HG21 THR 33 HG21 THR 33 2.923 -2.577 -8.112
227 HG22 THR 33 HG22 THR 33 1.998 -2.365 -6.605
228 HG23 THR 33 HG23 THR 33 3.013 -3.784 -6.871
229 H ILE 34 H ILE 34 5.728 0.095 -4.379
230 HA ILE 34 HA ILE 34 3.678 1.428 -2.768
231 HB ILE 34 HB ILE 34 6.239 2.866 -3.439
232 HG12 ILE 34 HG12 ILE 34 5.919 0.459 -1.626
233 HG13 ILE 34 HG13 ILE 34 7.192 0.822 -2.809
234 HG21 ILE 34 HG21 ILE 34 5.799 3.880 -1.261
235 HG22 ILE 34 HG22 ILE 34 4.314 3.943 -2.193
236 HG23 ILE 34 HG23 ILE 34 4.499 2.712 -0.923
237 HD11 ILE 34 HD11 ILE 34 8.108 1.009 -0.580
238 HD12 ILE 34 HD12 ILE 34 8.001 2.648 -1.261
239 HD13 ILE 34 HD13 ILE 34 6.810 2.092 -0.055
240 H TYR 35 H TYR 35 5.366 2.342 -5.791
241 HA TYR 35 HA TYR 35 3.906 4.697 -6.242
242 HB2 TYR 35 HB2 TYR 35 5.165 2.918 -8.358
243 HB3 TYR 35 HB3 TYR 35 4.899 4.664 -8.429
244 HD1 TYR 35 HD1 TYR 35 6.956 1.960 -7.057
245 HD2 TYR 35 HD2 TYR 35 6.378 6.219 -7.064
246 HE1 TYR 35 HE1 TYR 35 9.134 2.213 -5.954
247 HE2 TYR 35 HE2 TYR 35 8.605 6.521 -6.056
248 HH TYR 35 HH TYR 35 10.733 3.705 -5.309
249 H GLN 36 H GLN 36 3.021 1.367 -6.775
250 HA GLN 36 HA GLN 36 0.934 2.040 -8.740
251 HB2 GLN 36 HB2 GLN 36 1.480 -0.456 -7.135
252 HB3 GLN 36 HB3 GLN 36 0.091 -0.296 -8.188
253 HG2 GLN 36 HG2 GLN 36 2.980 -0.340 -9.058
254 HG3 GLN 36 HG3 GLN 36 1.681 -1.465 -9.478
255 HE21 GLN 36 HE21 GLN 36 3.602 0.332 -11.090
256 HE22 GLN 36 HE22 GLN 36 2.507 1.124 -12.215
257 H ILE 37 H ILE 37 0.858 1.238 -5.162
258 HA ILE 37 HA ILE 37 -1.967 1.627 -5.011
259 HB ILE 37 HB ILE 37 -1.585 2.033 -2.570
260 HG12 ILE 37 HG12 ILE 37 1.311 1.414 -3.206
261 HG13 ILE 37 HG13 ILE 37 0.691 3.010 -2.751
262 HG21 ILE 37 HG21 ILE 37 -0.302 -0.470 -3.756
263 HG22 ILE 37 HG22 ILE 37 -1.079 -0.331 -2.158
264 HG23 ILE 37 HG23 ILE 37 -2.043 -0.198 -3.627
265 HD11 ILE 37 HD11 ILE 37 0.033 2.142 -0.570
266 HD12 ILE 37 HD12 ILE 37 0.648 0.535 -0.997
267 HD13 ILE 37 HD13 ILE 37 1.767 1.904 -0.884
268 H GLU 38 H GLU 38 0.623 3.950 -5.208
269 HA GLU 38 HA GLU 38 -0.785 6.224 -4.202
270 HB2 GLU 38 HB2 GLU 38 1.666 5.965 -4.401
271 HB3 GLU 38 HB3 GLU 38 1.530 5.908 -6.147
272 HG2 GLU 38 HG2 GLU 38 0.661 8.235 -6.162
273 HG3 GLU 38 HG3 GLU 38 0.819 8.302 -4.411
274 H HIS 39 H HIS 39 -1.047 4.401 -7.175
275 HA HIS 39 HA HIS 39 -2.617 6.574 -8.491
276 HB2 HIS 39 HB2 HIS 39 -0.413 5.221 -9.483
277 HB3 HIS 39 HB3 HIS 39 -1.711 4.231 -10.092
278 HD1 HIS 39 HD1 HIS 39 0.317 6.788 -11.445
279 HD2 HIS 39 HD2 HIS 39 -3.852 6.263 -11.065
280 HE1 HIS 39 HE1 HIS 39 -0.746 8.388 -13.074
281 H TYR 40 H TYR 40 -2.685 3.298 -7.201
282 HA TYR 40 HA TYR 40 -5.218 2.627 -8.487
283 HB2 TYR 40 HB2 TYR 40 -3.432 1.149 -6.526
284 HB3 TYR 40 HB3 TYR 40 -4.993 0.572 -7.060
285 HD1 TYR 40 HD1 TYR 40 -2.075 -0.851 -7.420
286 HD2 TYR 40 HD2 TYR 40 -4.671 1.497 -10.079
287 HE1 TYR 40 HE1 TYR 40 -1.424 -2.173 -9.330
288 HE2 TYR 40 HE2 TYR 40 -3.725 0.344 -11.975
289 HH TYR 40 HH TYR 40 -2.193 -1.276 -12.723
290 H SER 41 H SER 41 -6.781 3.978 -7.838
291 HA SER 41 HA SER 41 -7.101 4.959 -5.211
292 HB2 SER 41 HB2 SER 41 -9.405 4.660 -7.118
293 HB3 SER 41 HB3 SER 41 -8.969 6.045 -6.114
294 HG SER 41 HG SER 41 -8.712 6.056 -8.508
295 H MET 42 H MET 42 -9.252 4.656 -4.087
296 HA MET 42 HA MET 42 -9.544 2.289 -2.796
297 HB2 MET 42 HB2 MET 42 -11.609 3.179 -1.948
298 HB3 MET 42 HB3 MET 42 -10.512 4.532 -2.222
299 HG2 MET 42 HG2 MET 42 -11.612 4.973 -4.416
300 HG3 MET 42 HG3 MET 42 -12.735 3.647 -4.114
301 HE1 MET 42 HE1 MET 42 -14.936 6.746 -4.186
302 HE2 MET 42 HE2 MET 42 -13.463 6.418 -5.108
303 HE3 MET 42 HE3 MET 42 -14.638 5.117 -4.824
304 H ASP 43 H ASP 43 -10.941 2.950 -5.969
305 HA ASP 43 HA ASP 43 -12.907 0.842 -5.874
306 HB2 ASP 43 HB2 ASP 43 -13.134 2.858 -7.271
307 HB3 ASP 43 HB3 ASP 43 -11.750 2.336 -8.227
308 H ASP 44 H ASP 44 -9.588 1.111 -7.319
309 HA ASP 44 HA ASP 44 -9.686 -1.458 -8.624
310 HB2 ASP 44 HB2 ASP 44 -7.703 0.620 -8.205
311 HB3 ASP 44 HB3 ASP 44 -6.990 -0.915 -7.765
312 H LEU 45 H LEU 45 -8.520 -0.295 -5.524
313 HA LEU 45 HA LEU 45 -7.562 -2.716 -4.435
314 HB2 LEU 45 HB2 LEU 45 -8.848 -0.416 -2.919
315 HB3 LEU 45 HB3 LEU 45 -7.716 -1.610 -2.257
316 HG LEU 45 HG LEU 45 -6.990 0.352 -4.477
317 HD11 LEU 45 HD11 LEU 45 -5.979 1.742 -2.849
318 HD12 LEU 45 HD12 LEU 45 -6.398 0.632 -1.508
319 HD13 LEU 45 HD13 LEU 45 -7.649 1.529 -2.383
320 HD21 LEU 45 HD21 LEU 45 -5.088 -1.094 -2.619
321 HD22 LEU 45 HD22 LEU 45 -4.736 -0.195 -4.105
322 HD23 LEU 45 HD23 LEU 45 -5.561 -1.742 -4.203
323 H ALA 46 H ALA 46 -10.896 -1.272 -4.340
324 HA ALA 46 HA ALA 46 -11.991 -3.384 -2.738
325 HB1 ALA 46 HB1 ALA 46 -13.189 -1.262 -3.077
326 HB2 ALA 46 HB2 ALA 46 -13.342 -1.596 -4.807
327 HB3 ALA 46 HB3 ALA 46 -14.171 -2.629 -3.629
328 H SER 47 H SER 47 -11.670 -2.988 -6.308
329 HA SER 47 HA SER 47 -12.883 -5.514 -6.929
330 HB2 SER 47 HB2 SER 47 -11.102 -3.623 -8.497
331 HB3 SER 47 HB3 SER 47 -11.794 -5.129 -9.152
332 HG SER 47 HG SER 47 -13.423 -3.121 -7.963
333 H LEU 48 H LEU 48 -9.746 -4.807 -5.626
334 HA LEU 48 HA LEU 48 -8.480 -7.290 -6.602
335 HB2 LEU 48 HB2 LEU 48 -7.609 -5.121 -4.663
336 HB3 LEU 48 HB3 LEU 48 -6.757 -6.643 -4.775
337 HG LEU 48 HG LEU 48 -6.936 -4.492 -6.876
338 HD11 LEU 48 HD11 LEU 48 -4.457 -4.543 -6.529
339 HD12 LEU 48 HD12 LEU 48 -4.656 -5.778 -5.280
340 HD13 LEU 48 HD13 LEU 48 -5.331 -4.150 -5.045
341 HD21 LEU 48 HD21 LEU 48 -5.684 -7.268 -7.131
342 HD22 LEU 48 HD22 LEU 48 -5.397 -5.889 -8.225
343 HD23 LEU 48 HD23 LEU 48 -7.011 -6.594 -8.124
344 H LYS 49 H LYS 49 -11.017 -6.883 -4.629
345 HA LYS 49 HA LYS 49 -12.084 -8.101 -3.133
346 HB2 LYS 49 HB2 LYS 49 -9.867 -10.191 -3.340
347 HB3 LYS 49 HB3 LYS 49 -11.362 -10.356 -2.449
348 HG2 LYS 49 HG2 LYS 49 -11.788 -11.497 -4.399
349 HG3 LYS 49 HG3 LYS 49 -12.647 -9.968 -4.577
350 HD2 LYS 49 HD2 LYS 49 -10.809 -9.147 -6.059
351 HD3 LYS 49 HD3 LYS 49 -9.933 -10.650 -5.824
352 HE2 LYS 49 HE2 LYS 49 -11.107 -10.605 -7.962
353 HE3 LYS 49 HE3 LYS 49 -11.797 -11.865 -6.928
354 HZ1 LYS 49 HZ1 LYS 49 -12.983 -9.157 -7.223
355 HZ2 LYS 49 HZ2 LYS 49 -13.634 -10.438 -6.468
356 HZ3 LYS 49 HZ3 LYS 49 -13.470 -10.519 -8.069
357 H ILE 50 H ILE 50 -10.212 -6.004 -2.437
358 HA ILE 50 HA ILE 50 -9.212 -6.782 0.213
359 HB ILE 50 HB ILE 50 -9.065 -4.057 -1.102
360 HG12 ILE 50 HG12 ILE 50 -7.994 -5.793 -2.598
361 HG13 ILE 50 HG13 ILE 50 -6.896 -4.585 -1.997
362 HG21 ILE 50 HG21 ILE 50 -7.235 -3.744 0.474
363 HG22 ILE 50 HG22 ILE 50 -8.679 -4.261 1.357
364 HG23 ILE 50 HG23 ILE 50 -7.423 -5.433 1.023
365 HD11 ILE 50 HD11 ILE 50 -7.192 -7.376 -0.813
366 HD12 ILE 50 HD12 ILE 50 -5.992 -6.912 -2.038
367 HD13 ILE 50 HD13 ILE 50 -5.930 -6.179 -0.425
368 HA PRO 51 HA PRO 51 -13.260 -5.277 1.681
369 HB2 PRO 51 HB2 PRO 51 -12.972 -5.860 4.349
370 HB3 PRO 51 HB3 PRO 51 -13.292 -7.098 3.112
371 HG2 PRO 51 HG2 PRO 51 -10.635 -6.315 4.330
372 HG3 PRO 51 HG3 PRO 51 -11.281 -7.963 4.038
373 HD2 PRO 51 HD2 PRO 51 -9.514 -6.752 2.365
374 HD3 PRO 51 HD3 PRO 51 -10.774 -7.869 1.766
375 H GLU 52 H GLU 52 -14.019 -3.418 2.675
376 HA GLU 52 HA GLU 52 -12.572 -1.088 2.861
377 HB2 GLU 52 HB2 GLU 52 -14.426 -0.113 4.046
378 HB3 GLU 52 HB3 GLU 52 -14.964 -1.103 2.705
379 HG2 GLU 52 HG2 GLU 52 -15.102 -1.776 5.683
380 HG3 GLU 52 HG3 GLU 52 -16.437 -1.366 4.598
381 H GLN 53 H GLN 53 -13.149 -3.404 5.503
382 HA GLN 53 HA GLN 53 -12.308 -1.853 7.664
383 HB2 GLN 53 HB2 GLN 53 -12.325 -4.811 7.053
384 HB3 GLN 53 HB3 GLN 53 -11.399 -4.295 8.441
385 HG2 GLN 53 HG2 GLN 53 -14.358 -3.821 7.987
386 HG3 GLN 53 HG3 GLN 53 -13.622 -4.910 9.176
387 HE21 GLN 53 HE21 GLN 53 -11.559 -3.239 10.287
388 HE22 GLN 53 HE22 GLN 53 -12.253 -1.705 10.803
389 H PHE 54 H PHE 54 -10.304 -3.305 5.188
390 HA PHE 54 HA PHE 54 -7.866 -2.266 6.593
391 HB2 PHE 54 HB2 PHE 54 -7.553 -4.539 6.569
392 HB3 PHE 54 HB3 PHE 54 -8.451 -4.778 5.076
393 HD1 PHE 54 HD1 PHE 54 -7.403 -4.988 3.082
394 HD2 PHE 54 HD2 PHE 54 -5.312 -3.084 6.301
395 HE1 PHE 54 HE1 PHE 54 -5.306 -4.933 1.690
396 HE2 PHE 54 HE2 PHE 54 -3.238 -3.009 4.958
397 HZ PHE 54 HZ PHE 54 -3.279 -3.946 2.595
398 H ARG 55 H ARG 55 -9.428 -2.701 3.369
399 HA ARG 55 HA ARG 55 -7.769 -1.436 1.666
400 HB2 ARG 55 HB2 ARG 55 -9.828 -2.525 1.106
401 HB3 ARG 55 HB3 ARG 55 -10.773 -1.255 1.875
402 HG2 ARG 55 HG2 ARG 55 -9.973 0.400 0.192
403 HG3 ARG 55 HG3 ARG 55 -8.997 -0.875 -0.542
404 HD2 ARG 55 HD2 ARG 55 -10.977 -0.664 -1.842
405 HD3 ARG 55 HD3 ARG 55 -11.113 -2.171 -0.962
406 HE ARG 55 HE ARG 55 -12.501 0.413 -0.295
407 HH11 ARG 55 HH11 ARG 55 -12.712 -3.181 -0.383
408 HH12 ARG 55 HH12 ARG 55 -14.441 -3.127 -0.331
409 HH21 ARG 55 HH21 ARG 55 -14.702 0.360 0.045
410 HH22 ARG 55 HH22 ARG 55 -15.539 -1.123 0.303
411 H HIS 56 H HIS 56 -10.265 0.423 3.588
412 HA HIS 56 HA HIS 56 -9.282 2.904 2.468
413 HB2 HIS 56 HB2 HIS 56 -10.957 2.491 4.966
414 HB3 HIS 56 HB3 HIS 56 -10.707 4.008 4.089
415 HD1 HIS 56 HD1 HIS 56 -13.550 2.337 4.461
416 HD2 HIS 56 HD2 HIS 56 -11.085 2.646 1.055
417 HE1 HIS 56 HE1 HIS 56 -14.996 1.723 2.453
418 H ALA 57 H ALA 57 -8.269 0.971 5.296
419 HA ALA 57 HA ALA 57 -6.745 3.064 6.499
420 HB1 ALA 57 HB1 ALA 57 -7.457 0.950 7.673
421 HB2 ALA 57 HB2 ALA 57 -6.234 0.066 6.732
422 HB3 ALA 57 HB3 ALA 57 -5.733 1.349 7.830
423 H ILE 58 H ILE 58 -5.783 0.334 4.206
424 HA ILE 58 HA ILE 58 -3.121 1.012 4.102
425 HB ILE 58 HB ILE 58 -3.652 -1.052 3.241
426 HG12 ILE 58 HG12 ILE 58 -2.997 0.759 0.892
427 HG13 ILE 58 HG13 ILE 58 -1.919 -0.124 1.997
428 HG21 ILE 58 HG21 ILE 58 -5.511 0.026 1.115
429 HG22 ILE 58 HG22 ILE 58 -5.150 -1.675 1.493
430 HG23 ILE 58 HG23 ILE 58 -6.000 -0.726 2.664
431 HD11 ILE 58 HD11 ILE 58 -2.907 -2.269 0.941
432 HD12 ILE 58 HD12 ILE 58 -3.505 -1.180 -0.313
433 HD13 ILE 58 HD13 ILE 58 -1.766 -1.288 -0.010
434 H TRP 59 H TRP 59 -5.766 2.119 2.114
435 HA TRP 59 HA TRP 59 -4.171 3.806 0.476
436 HB2 TRP 59 HB2 TRP 59 -6.622 2.885 0.178
437 HB3 TRP 59 HB3 TRP 59 -7.074 4.398 0.954
438 HD1 TRP 59 HD1 TRP 59 -4.663 3.264 -1.838
439 HE1 TRP 59 HE1 TRP 59 -4.860 4.791 -3.858
440 HE3 TRP 59 HE3 TRP 59 -7.809 6.692 0.187
441 HZ2 TRP 59 HZ2 TRP 59 -6.341 7.271 -4.542
442 HZ3 TRP 59 HZ3 TRP 59 -8.585 8.652 -1.144
443 HH2 TRP 59 HH2 TRP 59 -7.879 8.921 -3.485
444 H LYS 60 H LYS 60 -6.116 4.505 3.437
445 HA LYS 60 HA LYS 60 -5.578 7.262 3.467
446 HB2 LYS 60 HB2 LYS 60 -7.276 6.197 4.906
447 HB3 LYS 60 HB3 LYS 60 -6.004 5.376 5.836
448 HG2 LYS 60 HG2 LYS 60 -5.135 7.530 6.605
449 HG3 LYS 60 HG3 LYS 60 -6.260 8.392 5.537
450 HD2 LYS 60 HD2 LYS 60 -8.165 7.447 6.863
451 HD3 LYS 60 HD3 LYS 60 -7.001 6.626 7.906
452 HE2 LYS 60 HE2 LYS 60 -7.750 8.694 8.960
453 HE3 LYS 60 HE3 LYS 60 -6.026 8.800 8.560
454 HZ1 LYS 60 HZ1 LYS 60 -8.179 9.967 6.902
455 HZ2 LYS 60 HZ2 LYS 60 -6.565 10.136 6.674
456 HZ3 LYS 60 HZ3 LYS 60 -7.226 10.808 7.989
457 H GLY 61 H GLY 61 -3.615 4.506 4.808
458 HA2 GLY 61 HA2 GLY 61 -1.778 6.142 6.201
459 HA3 GLY 61 HA3 GLY 61 -1.473 4.496 5.598
460 H ILE 62 H ILE 62 -1.548 4.731 2.904
461 HA ILE 62 HA ILE 62 0.936 6.092 2.436
462 HB ILE 62 HB ILE 62 0.128 4.076 1.400
463 HG12 ILE 62 HG12 ILE 62 1.173 4.563 -0.922
464 HG13 ILE 62 HG13 ILE 62 1.256 6.237 -0.392
465 HG21 ILE 62 HG21 ILE 62 -1.144 4.037 -0.697
466 HG22 ILE 62 HG22 ILE 62 -2.103 4.692 0.629
467 HG23 ILE 62 HG23 ILE 62 -1.386 5.776 -0.588
468 HD11 ILE 62 HD11 ILE 62 2.769 5.567 1.470
469 HD12 ILE 62 HD12 ILE 62 2.617 3.864 0.963
470 HD13 ILE 62 HD13 ILE 62 3.398 5.057 -0.097
471 H LEU 63 H LEU 63 -2.435 6.988 1.504
472 HA LEU 63 HA LEU 63 -1.581 9.286 0.022
473 HB2 LEU 63 HB2 LEU 63 -4.170 8.399 1.291
474 HB3 LEU 63 HB3 LEU 63 -4.003 10.088 0.919
475 HG LEU 63 HG LEU 63 -5.146 8.734 -0.832
476 HD11 LEU 63 HD11 LEU 63 -4.233 10.953 -1.282
477 HD12 LEU 63 HD12 LEU 63 -4.058 9.893 -2.689
478 HD13 LEU 63 HD13 LEU 63 -2.646 10.252 -1.671
479 HD21 LEU 63 HD21 LEU 63 -2.358 7.702 -1.514
480 HD22 LEU 63 HD22 LEU 63 -3.839 7.465 -2.451
481 HD23 LEU 63 HD23 LEU 63 -3.694 6.726 -0.853
482 H ASP 64 H ASP 64 -2.004 8.619 3.397
483 HA ASP 64 HA ASP 64 -1.934 11.472 4.239
484 HB2 ASP 64 HB2 ASP 64 -1.725 8.884 5.781
485 HB3 ASP 64 HB3 ASP 64 -0.985 10.300 6.451
486 H HIS 65 H HIS 65 0.413 8.878 3.740
487 HA HIS 65 HA HIS 65 2.664 10.250 4.870
488 HB2 HIS 65 HB2 HIS 65 2.727 7.832 4.596
489 HB3 HIS 65 HB3 HIS 65 2.438 7.967 2.874
490 HD1 HIS 65 HD1 HIS 65 5.138 10.080 4.654
491 HD2 HIS 65 HD2 HIS 65 4.538 7.189 1.695
492 HE1 HIS 65 HE1 HIS 65 7.404 9.697 3.547
493 H ARG 66 H ARG 66 1.657 9.725 1.396
494 HA ARG 66 HA ARG 66 3.676 11.486 0.529
495 HB2 ARG 66 HB2 ARG 66 2.921 11.225 -1.630
496 HB3 ARG 66 HB3 ARG 66 2.593 9.717 -0.824
497 HG2 ARG 66 HG2 ARG 66 0.753 10.072 -2.232
498 HG3 ARG 66 HG3 ARG 66 0.144 10.489 -0.617
499 HD2 ARG 66 HD2 ARG 66 0.274 12.814 -1.071
500 HD3 ARG 66 HD3 ARG 66 1.305 12.581 -2.496
501 HE ARG 66 HE ARG 66 -1.059 11.311 -3.150
502 HH11 ARG 66 HH11 ARG 66 0.056 14.586 -2.399
503 HH12 ARG 66 HH12 ARG 66 -1.349 15.396 -2.995
504 HH21 ARG 66 HH21 ARG 66 -2.892 12.386 -4.158
505 HH22 ARG 66 HH22 ARG 66 -2.934 14.103 -4.187
506 H GLN 67 H GLN 67 0.475 12.148 1.904
507 HA GLN 67 HA GLN 67 0.350 14.853 0.815
508 HB2 GLN 67 HB2 GLN 67 -1.662 13.682 1.361
509 HB3 GLN 67 HB3 GLN 67 -1.124 13.354 3.022
510 HG2 GLN 67 HG2 GLN 67 -1.433 15.587 3.690
511 HG3 GLN 67 HG3 GLN 67 -1.518 16.166 2.019
512 HE21 GLN 67 HE21 GLN 67 -3.536 16.512 1.256
513 HE22 GLN 67 HE22 GLN 67 -5.014 15.672 1.753
514 H LEU 68 H LEU 68 1.486 13.312 3.874
515 HA LEU 68 HA LEU 68 2.109 15.906 5.054
516 HB2 LEU 68 HB2 LEU 68 2.611 13.047 5.961
517 HB3 LEU 68 HB3 LEU 68 3.151 14.463 6.859
518 HG LEU 68 HG LEU 68 0.256 13.666 6.339
519 HD11 LEU 68 HD11 LEU 68 1.949 13.992 8.857
520 HD12 LEU 68 HD12 LEU 68 1.430 12.454 8.128
521 HD13 LEU 68 HD13 LEU 68 0.234 13.561 8.819
522 HD21 LEU 68 HD21 LEU 68 1.340 16.221 7.550
523 HD22 LEU 68 HD22 LEU 68 -0.329 15.648 7.763
524 HD23 LEU 68 HD23 LEU 68 0.255 16.064 6.159
525 H HIS 69 H HIS 69 3.880 13.874 2.825
526 HA HIS 69 HA HIS 69 6.299 15.419 3.525
527 HB2 HIS 69 HB2 HIS 69 5.850 12.483 3.373
528 HB3 HIS 69 HB3 HIS 69 7.181 13.050 2.417
529 HD1 HIS 69 HD1 HIS 69 6.352 14.777 5.763
530 HD2 HIS 69 HD2 HIS 69 9.112 12.127 3.963
531 HE1 HIS 69 HE1 HIS 69 8.246 14.414 7.461
532 H ASP 70 H ASP 70 7.939 14.919 1.523
533 HA ASP 70 HA ASP 70 6.621 15.292 -1.030
534 HB2 ASP 70 HB2 ASP 70 6.685 17.597 0.032
535 HB3 ASP 70 HB3 ASP 70 8.443 17.458 0.088
Start of MODEL 2
1 H1 GLY 1 H GLY 1 30.409 -11.681 -1.062
2 HA2 GLY 1 HA2 GLY 1 30.888 -10.169 -2.952
3 HA3 GLY 1 HA3 GLY 1 29.193 -10.412 -3.437
4 HA PRO 2 HA PRO 2 29.121 -6.729 -0.708
5 HB2 PRO 2 HB2 PRO 2 27.316 -5.246 -2.087
6 HB3 PRO 2 HB3 PRO 2 29.024 -5.351 -2.610
7 HG2 PRO 2 HG2 PRO 2 26.646 -6.923 -3.653
8 HG3 PRO 2 HG3 PRO 2 27.908 -6.072 -4.600
9 HD2 PRO 2 HD2 PRO 2 27.999 -8.766 -4.068
10 HD3 PRO 2 HD3 PRO 2 29.484 -7.774 -4.196
11 H LEU 3 H LEU 3 27.058 -5.774 0.427
12 HA LEU 3 HA LEU 3 24.664 -7.360 0.294
13 HB2 LEU 3 HB2 LEU 3 26.547 -8.667 1.712
14 HB3 LEU 3 HB3 LEU 3 26.134 -7.487 2.949
15 HG LEU 3 HG LEU 3 23.758 -8.268 2.804
16 HD11 LEU 3 HD11 LEU 3 24.890 -10.397 0.935
17 HD12 LEU 3 HD12 LEU 3 23.635 -9.205 0.536
18 HD13 LEU 3 HD13 LEU 3 23.291 -10.468 1.710
19 HD21 LEU 3 HD21 LEU 3 24.155 -10.395 3.973
20 HD22 LEU 3 HD22 LEU 3 25.328 -9.180 4.481
21 HD23 LEU 3 HD23 LEU 3 25.809 -10.460 3.339
22 H GLY 4 H GLY 4 23.129 -6.568 2.206
23 HA2 GLY 4 HA2 GLY 4 22.289 -4.875 3.518
24 HA3 GLY 4 HA3 GLY 4 23.805 -3.980 3.364
25 H SER 5 H SER 5 21.742 -5.164 0.645
26 HA SER 5 HA SER 5 21.775 -2.690 -0.727
27 HB2 SER 5 HB2 SER 5 20.052 -3.938 -2.142
28 HB3 SER 5 HB3 SER 5 21.689 -4.595 -2.027
29 HG SER 5 HG SER 5 19.508 -5.862 -1.599
30 H THR 6 H THR 6 20.802 -0.932 0.311
31 HA THR 6 HA THR 6 18.361 -1.102 1.825
32 HB THR 6 HB THR 6 19.531 1.365 0.464
33 HG1 THR 6 HG1 THR 6 21.154 1.318 1.695
34 HG21 THR 6 HG21 THR 6 18.078 0.994 3.129
35 HG22 THR 6 HG22 THR 6 17.385 1.703 1.655
36 HG23 THR 6 HG23 THR 6 18.712 2.527 2.487
37 H ASP 7 H ASP 7 16.248 -0.807 1.060
38 HA ASP 7 HA ASP 7 15.753 0.151 -1.658
39 HB2 ASP 7 HB2 ASP 7 14.574 -1.817 -2.352
40 HB3 ASP 7 HB3 ASP 7 16.220 -2.261 -1.941
41 H CYS 8 H CYS 8 13.277 0.076 -2.050
42 HA CYS 8 HA CYS 8 11.735 0.502 0.450
43 HB2 CYS 8 HB2 CYS 8 11.666 2.333 -1.994
44 HB3 CYS 8 HB3 CYS 8 10.723 2.501 -0.507
45 HG CYS 8 HG CYS 8 12.307 4.359 -0.228
46 H SER 9 H SER 9 9.834 -0.685 0.301
47 HA SER 9 HA SER 9 8.365 -1.002 -2.183
48 HB2 SER 9 HB2 SER 9 9.749 -3.362 -0.849
49 HB3 SER 9 HB3 SER 9 8.445 -3.526 -2.039
50 HG SER 9 HG SER 9 10.484 -1.845 -2.796
51 H ILE 10 H ILE 10 6.265 -2.362 -1.601
52 HA ILE 10 HA ILE 10 5.054 -1.176 0.609
53 HB ILE 10 HB ILE 10 4.376 -3.583 -1.078
54 HG12 ILE 10 HG12 ILE 10 4.159 -1.281 -1.859
55 HG13 ILE 10 HG13 ILE 10 2.630 -2.176 -1.898
56 HG21 ILE 10 HG21 ILE 10 3.402 -4.268 1.012
57 HG22 ILE 10 HG22 ILE 10 2.670 -2.681 1.267
58 HG23 ILE 10 HG23 ILE 10 2.111 -3.717 -0.066
59 HD11 ILE 10 HD11 ILE 10 3.346 -0.066 0.186
60 HD12 ILE 10 HD12 ILE 10 2.380 0.164 -1.264
61 HD13 ILE 10 HD13 ILE 10 1.791 -0.922 0.003
62 H VAL 11 H VAL 11 6.943 -4.065 0.581
63 HA VAL 11 HA VAL 11 6.099 -5.198 3.027
64 HB VAL 11 HB VAL 11 8.472 -5.971 3.364
65 HG11 VAL 11 HG11 VAL 11 6.813 -7.325 2.218
66 HG12 VAL 11 HG12 VAL 11 7.065 -6.462 0.688
67 HG13 VAL 11 HG13 VAL 11 8.341 -7.490 1.359
68 HG21 VAL 11 HG21 VAL 11 8.978 -4.714 0.634
69 HG22 VAL 11 HG22 VAL 11 9.717 -4.173 2.165
70 HG23 VAL 11 HG23 VAL 11 10.067 -5.776 1.534
71 H SER 12 H SER 12 8.488 -2.575 2.668
72 HA SER 12 HA SER 12 8.998 -2.097 5.375
73 HB2 SER 12 HB2 SER 12 10.025 -1.182 3.130
74 HB3 SER 12 HB3 SER 12 8.807 0.066 3.249
75 HG SER 12 HG SER 12 9.788 0.407 5.468
76 H PHE 13 H PHE 13 6.399 -0.881 3.253
77 HA PHE 13 HA PHE 13 5.338 1.020 5.134
78 HB2 PHE 13 HB2 PHE 13 5.052 1.128 2.648
79 HB3 PHE 13 HB3 PHE 13 4.005 -0.278 2.724
80 HD1 PHE 13 HD1 PHE 13 1.818 0.361 2.191
81 HD2 PHE 13 HD2 PHE 13 4.195 2.975 4.689
82 HE1 PHE 13 HE1 PHE 13 -0.115 1.966 2.417
83 HE2 PHE 13 HE2 PHE 13 2.219 4.510 4.899
84 HZ PHE 13 HZ PHE 13 0.088 3.907 3.838
85 H PHE 14 H PHE 14 4.243 -2.341 4.190
86 HA PHE 14 HA PHE 14 2.116 -2.349 6.052
87 HB2 PHE 14 HB2 PHE 14 3.543 -4.394 4.385
88 HB3 PHE 14 HB3 PHE 14 2.540 -4.972 5.701
89 HD1 PHE 14 HD1 PHE 14 0.716 -5.939 4.615
90 HD2 PHE 14 HD2 PHE 14 1.863 -1.921 3.538
91 HE1 PHE 14 HE1 PHE 14 -1.375 -5.672 3.313
92 HE2 PHE 14 HE2 PHE 14 -0.242 -1.652 2.302
93 HZ PHE 14 HZ PHE 14 -1.895 -3.528 2.225
94 H ALA 15 H ALA 15 5.527 -3.390 6.362
95 HA ALA 15 HA ALA 15 5.324 -4.443 8.966
96 HB1 ALA 15 HB1 ALA 15 7.747 -4.000 9.104
97 HB2 ALA 15 HB2 ALA 15 7.308 -4.724 7.547
98 HB3 ALA 15 HB3 ALA 15 7.658 -2.980 7.649
99 H ARG 16 H ARG 16 6.050 -1.028 7.949
100 HA ARG 16 HA ARG 16 6.228 -0.067 10.636
101 HB2 ARG 16 HB2 ARG 16 5.602 1.367 8.010
102 HB3 ARG 16 HB3 ARG 16 5.638 2.195 9.576
103 HG2 ARG 16 HG2 ARG 16 7.958 1.103 9.903
104 HG3 ARG 16 HG3 ARG 16 7.957 0.820 8.174
105 HD2 ARG 16 HD2 ARG 16 7.538 3.532 9.510
106 HD3 ARG 16 HD3 ARG 16 9.085 2.950 8.906
107 HE ARG 16 HE ARG 16 7.584 2.696 6.688
108 HH11 ARG 16 HH11 ARG 16 7.870 5.500 8.923
109 HH12 ARG 16 HH12 ARG 16 7.712 6.654 7.654
110 HH21 ARG 16 HH21 ARG 16 7.155 4.231 5.128
111 HH22 ARG 16 HH22 ARG 16 7.112 5.925 5.475
112 H LEU 17 H LEU 17 3.429 -0.147 8.422
113 HA LEU 17 HA LEU 17 1.626 1.137 10.283
114 HB2 LEU 17 HB2 LEU 17 0.999 -0.881 8.098
115 HB3 LEU 17 HB3 LEU 17 -0.201 0.063 8.981
116 HG LEU 17 HG LEU 17 1.880 1.078 7.067
117 HD11 LEU 17 HD11 LEU 17 0.027 1.681 5.608
118 HD12 LEU 17 HD12 LEU 17 -1.150 1.109 6.786
119 HD13 LEU 17 HD13 LEU 17 -0.040 -0.043 5.994
120 HD21 LEU 17 HD21 LEU 17 0.755 3.318 7.256
121 HD22 LEU 17 HD22 LEU 17 1.564 2.823 8.747
122 HD23 LEU 17 HD23 LEU 17 -0.200 2.688 8.616
123 H GLY 18 H GLY 18 2.696 -2.248 9.928
124 HA2 GLY 18 HA2 GLY 18 2.711 -3.777 11.654
125 HA3 GLY 18 HA3 GLY 18 1.373 -2.940 12.472
126 H CYS 19 H CYS 19 1.239 -3.465 8.976
127 HA CYS 19 HA CYS 19 -1.235 -4.842 9.192
128 HB2 CYS 19 HB2 CYS 19 0.681 -4.840 6.853
129 HB3 CYS 19 HB3 CYS 19 -1.055 -5.196 6.784
130 HG CYS 19 HG CYS 19 -1.441 -2.706 8.155
131 H SER 20 H SER 20 -1.752 -7.069 9.023
132 HA SER 20 HA SER 20 0.513 -8.977 9.392
133 HB2 SER 20 HB2 SER 20 -0.755 -8.718 11.369
134 HB3 SER 20 HB3 SER 20 -2.298 -8.800 10.507
135 HG SER 20 HG SER 20 -0.492 -10.992 10.588
136 H SER 21 H SER 21 -2.455 -10.548 8.855
137 HA SER 21 HA SER 21 -1.716 -11.945 6.662
138 HB2 SER 21 HB2 SER 21 -4.603 -11.191 7.150
139 HB3 SER 21 HB3 SER 21 -3.940 -12.732 6.579
140 HG SER 21 HG SER 21 -2.911 -12.910 8.698
141 H CYS 22 H CYS 22 -2.848 -8.626 6.469
142 HA CYS 22 HA CYS 22 -3.798 -8.785 3.765
143 HB2 CYS 22 HB2 CYS 22 -2.643 -6.383 5.250
144 HB3 CYS 22 HB3 CYS 22 -3.669 -6.344 3.798
145 HG CYS 22 HG CYS 22 -5.719 -7.575 4.870
146 H LEU 23 H LEU 23 -0.521 -8.608 5.183
147 HA LEU 23 HA LEU 23 0.798 -7.816 2.794
148 HB2 LEU 23 HB2 LEU 23 2.711 -7.989 4.005
149 HB3 LEU 23 HB3 LEU 23 1.571 -7.760 5.293
150 HG LEU 23 HG LEU 23 1.675 -10.399 5.506
151 HD11 LEU 23 HD11 LEU 23 3.927 -11.273 4.935
152 HD12 LEU 23 HD12 LEU 23 4.338 -9.739 4.141
153 HD13 LEU 23 HD13 LEU 23 3.100 -10.797 3.458
154 HD21 LEU 23 HD21 LEU 23 3.563 -10.110 7.064
155 HD22 LEU 23 HD22 LEU 23 2.447 -8.743 7.180
156 HD23 LEU 23 HD23 LEU 23 3.966 -8.563 6.291
157 H ASP 24 H ASP 24 -0.074 -10.845 4.347
158 HA ASP 24 HA ASP 24 1.128 -12.720 2.682
159 HB2 ASP 24 HB2 ASP 24 -0.052 -12.994 4.936
160 HB3 ASP 24 HB3 ASP 24 -1.547 -13.099 4.015
161 H TYR 25 H TYR 25 -2.093 -11.158 2.423
162 HA TYR 25 HA TYR 25 -2.926 -12.526 0.049
163 HB2 TYR 25 HB2 TYR 25 -3.678 -9.708 0.918
164 HB3 TYR 25 HB3 TYR 25 -4.569 -10.736 -0.201
165 HD1 TYR 25 HD1 TYR 25 -5.588 -9.298 2.315
166 HD2 TYR 25 HD2 TYR 25 -4.316 -13.362 1.606
167 HE1 TYR 25 HE1 TYR 25 -6.887 -10.058 4.302
168 HE2 TYR 25 HE2 TYR 25 -5.662 -14.124 3.514
169 HH TYR 25 HH TYR 25 -6.746 -13.438 5.479
170 H PHE 26 H PHE 26 -1.377 -9.249 0.475
171 HA PHE 26 HA PHE 26 -1.126 -8.626 -2.222
172 HB2 PHE 26 HB2 PHE 26 0.061 -7.839 0.356
173 HB3 PHE 26 HB3 PHE 26 1.164 -7.606 -0.942
174 HD1 PHE 26 HD1 PHE 26 0.282 -6.206 -3.130
175 HD2 PHE 26 HD2 PHE 26 -1.705 -6.370 0.741
176 HE1 PHE 26 HE1 PHE 26 -0.625 -3.953 -3.463
177 HE2 PHE 26 HE2 PHE 26 -2.674 -4.184 0.312
178 HZ PHE 26 HZ PHE 26 -2.030 -2.878 -1.729
179 H THR 27 H THR 27 1.342 -10.411 -0.202
180 HA THR 27 HA THR 27 3.162 -10.633 -2.380
181 HB THR 27 HB THR 27 3.889 -10.841 -0.107
182 HG1 THR 27 HG1 THR 27 5.395 -11.911 -1.017
183 HG21 THR 27 HG21 THR 27 3.537 -12.775 1.293
184 HG22 THR 27 HG22 THR 27 2.500 -13.543 0.066
185 HG23 THR 27 HG23 THR 27 2.007 -12.052 0.897
186 H THR 28 H THR 28 0.416 -12.733 -1.371
187 HA THR 28 HA THR 28 0.929 -14.790 -3.262
188 HB THR 28 HB THR 28 -1.799 -13.869 -2.261
189 HG1 THR 28 HG1 THR 28 -0.407 -14.236 -0.472
190 HG21 THR 28 HG21 THR 28 -2.341 -16.305 -2.446
191 HG22 THR 28 HG22 THR 28 -0.717 -16.574 -3.134
192 HG23 THR 28 HG23 THR 28 -1.915 -15.603 -4.012
193 H GLN 29 H GLN 29 -0.574 -11.540 -3.640
194 HA GLN 29 HA GLN 29 -1.572 -12.104 -6.310
195 HB2 GLN 29 HB2 GLN 29 -1.320 -9.572 -4.639
196 HB3 GLN 29 HB3 GLN 29 -2.080 -9.694 -6.215
197 HG2 GLN 29 HG2 GLN 29 -3.123 -11.400 -3.969
198 HG3 GLN 29 HG3 GLN 29 -3.622 -9.721 -4.178
199 HE21 GLN 29 HE21 GLN 29 -4.027 -12.983 -5.397
200 HE22 GLN 29 HE22 GLN 29 -5.003 -12.548 -6.810
201 H GLY 30 H GLY 30 1.464 -10.950 -4.863
202 HA2 GLY 30 HA2 GLY 30 3.491 -10.465 -5.804
203 HA3 GLY 30 HA3 GLY 30 2.897 -11.178 -7.309
204 H LEU 31 H LEU 31 1.528 -8.388 -5.588
205 HA LEU 31 HA LEU 31 2.496 -6.482 -7.655
206 HB2 LEU 31 HB2 LEU 31 0.086 -5.621 -7.718
207 HB3 LEU 31 HB3 LEU 31 0.536 -7.053 -8.642
208 HG LEU 31 HG LEU 31 -0.461 -8.371 -6.653
209 HD11 LEU 31 HD11 LEU 31 -2.278 -7.239 -5.446
210 HD12 LEU 31 HD12 LEU 31 -1.786 -5.693 -6.194
211 HD13 LEU 31 HD13 LEU 31 -0.711 -6.536 -5.068
212 HD21 LEU 31 HD21 LEU 31 -2.648 -8.331 -7.711
213 HD22 LEU 31 HD22 LEU 31 -1.346 -8.346 -8.886
214 HD23 LEU 31 HD23 LEU 31 -2.216 -6.824 -8.552
215 H THR 32 H THR 32 3.309 -6.870 -4.967
216 HA THR 32 HA THR 32 1.978 -4.684 -3.458
217 HB THR 32 HB THR 32 2.938 -5.613 -1.637
218 HG1 THR 32 HG1 THR 32 5.258 -5.861 -3.177
219 HG21 THR 32 HG21 THR 32 3.782 -7.985 -3.340
220 HG22 THR 32 HG22 THR 32 2.103 -7.635 -2.927
221 HG23 THR 32 HG23 THR 32 3.276 -7.959 -1.643
222 H THR 33 H THR 33 2.544 -2.481 -4.037
223 HA THR 33 HA THR 33 5.328 -1.919 -4.227
224 HB THR 33 HB THR 33 5.330 -2.264 -6.510
225 HG1 THR 33 HG1 THR 33 5.041 -0.446 -7.634
226 HG21 THR 33 HG21 THR 33 2.276 -1.982 -6.659
227 HG22 THR 33 HG22 THR 33 3.260 -3.451 -6.807
228 HG23 THR 33 HG23 THR 33 3.351 -2.239 -8.057
229 H ILE 34 H ILE 34 5.685 0.322 -3.989
230 HA ILE 34 HA ILE 34 3.497 1.637 -2.569
231 HB ILE 34 HB ILE 34 6.212 2.871 -2.978
232 HG12 ILE 34 HG12 ILE 34 5.417 0.623 -1.120
233 HG13 ILE 34 HG13 ILE 34 6.886 0.833 -2.091
234 HG21 ILE 34 HG21 ILE 34 4.171 3.040 -0.702
235 HG22 ILE 34 HG22 ILE 34 5.584 4.085 -1.002
236 HG23 ILE 34 HG23 ILE 34 4.212 4.187 -2.069
237 HD11 ILE 34 HD11 ILE 34 7.510 2.731 -0.482
238 HD12 ILE 34 HD12 ILE 34 6.140 2.213 0.532
239 HD13 ILE 34 HD13 ILE 34 7.492 1.122 0.229
240 H TYR 35 H TYR 35 5.519 2.425 -5.347
241 HA TYR 35 HA TYR 35 4.472 4.856 -6.141
242 HB2 TYR 35 HB2 TYR 35 5.388 2.673 -8.054
243 HB3 TYR 35 HB3 TYR 35 5.561 4.420 -8.231
244 HD1 TYR 35 HD1 TYR 35 6.886 1.357 -6.629
245 HD2 TYR 35 HD2 TYR 35 7.282 5.657 -6.915
246 HE1 TYR 35 HE1 TYR 35 9.018 1.240 -5.407
247 HE2 TYR 35 HE2 TYR 35 9.492 5.527 -5.841
248 HH TYR 35 HH TYR 35 11.069 4.166 -4.899
249 H GLN 36 H GLN 36 3.095 1.715 -6.376
250 HA GLN 36 HA GLN 36 1.221 2.516 -8.541
251 HB2 GLN 36 HB2 GLN 36 1.691 -0.060 -7.048
252 HB3 GLN 36 HB3 GLN 36 0.344 0.168 -8.140
253 HG2 GLN 36 HG2 GLN 36 3.229 0.367 -8.969
254 HG3 GLN 36 HG3 GLN 36 2.114 -0.961 -9.323
255 HE21 GLN 36 HE21 GLN 36 3.511 0.325 -11.335
256 HE22 GLN 36 HE22 GLN 36 2.341 1.003 -12.412
257 H ILE 37 H ILE 37 1.059 1.702 -4.980
258 HA ILE 37 HA ILE 37 -1.769 2.100 -4.982
259 HB ILE 37 HB ILE 37 -1.550 2.499 -2.552
260 HG12 ILE 37 HG12 ILE 37 1.329 1.685 -2.883
261 HG13 ILE 37 HG13 ILE 37 0.793 3.347 -2.583
262 HG21 ILE 37 HG21 ILE 37 -2.132 0.353 -3.555
263 HG22 ILE 37 HG22 ILE 37 -0.408 -0.080 -3.705
264 HG23 ILE 37 HG23 ILE 37 -1.172 0.103 -2.109
265 HD11 ILE 37 HD11 ILE 37 1.523 2.302 -0.530
266 HD12 ILE 37 HD12 ILE 37 -0.225 2.630 -0.442
267 HD13 ILE 37 HD13 ILE 37 0.347 0.986 -0.730
268 H GLU 38 H GLU 38 0.847 4.446 -5.130
269 HA GLU 38 HA GLU 38 -0.743 6.657 -4.157
270 HB2 GLU 38 HB2 GLU 38 1.777 6.407 -5.832
271 HB3 GLU 38 HB3 GLU 38 0.977 7.974 -5.610
272 HG2 GLU 38 HG2 GLU 38 1.142 7.791 -3.175
273 HG3 GLU 38 HG3 GLU 38 1.859 6.181 -3.316
274 H HIS 39 H HIS 39 -0.868 4.803 -7.106
275 HA HIS 39 HA HIS 39 -2.509 6.923 -8.416
276 HB2 HIS 39 HB2 HIS 39 -0.930 4.669 -9.696
277 HB3 HIS 39 HB3 HIS 39 -1.868 5.903 -10.540
278 HD1 HIS 39 HD1 HIS 39 1.421 5.440 -10.687
279 HD2 HIS 39 HD2 HIS 39 -0.764 8.345 -8.609
280 HE1 HIS 39 HE1 HIS 39 3.039 7.381 -10.269
281 H TYR 40 H TYR 40 -2.533 3.667 -7.217
282 HA TYR 40 HA TYR 40 -4.927 2.823 -8.667
283 HB2 TYR 40 HB2 TYR 40 -3.328 1.695 -6.342
284 HB3 TYR 40 HB3 TYR 40 -4.903 1.053 -6.710
285 HD1 TYR 40 HD1 TYR 40 -1.555 0.073 -7.155
286 HD2 TYR 40 HD2 TYR 40 -5.246 0.713 -9.441
287 HE1 TYR 40 HE1 TYR 40 -0.884 -1.543 -8.823
288 HE2 TYR 40 HE2 TYR 40 -4.454 -0.927 -11.094
289 HH TYR 40 HH TYR 40 -2.740 -2.500 -11.626
290 H SER 41 H SER 41 -7.074 2.603 -7.749
291 HA SER 41 HA SER 41 -7.607 4.452 -5.456
292 HB2 SER 41 HB2 SER 41 -9.264 3.735 -7.919
293 HB3 SER 41 HB3 SER 41 -9.871 4.698 -6.559
294 HG SER 41 HG SER 41 -8.928 5.803 -8.451
295 H MET 42 H MET 42 -9.802 3.959 -4.475
296 HA MET 42 HA MET 42 -9.695 1.709 -2.939
297 HB2 MET 42 HB2 MET 42 -11.780 2.344 -2.095
298 HB3 MET 42 HB3 MET 42 -11.077 3.842 -2.681
299 HG2 MET 42 HG2 MET 42 -12.470 3.585 -4.788
300 HG3 MET 42 HG3 MET 42 -13.225 2.175 -4.045
301 HE1 MET 42 HE1 MET 42 -13.354 5.922 -4.579
302 HE2 MET 42 HE2 MET 42 -14.009 6.597 -3.074
303 HE3 MET 42 HE3 MET 42 -12.346 5.967 -3.116
304 H ASP 43 H ASP 43 -11.132 1.939 -6.142
305 HA ASP 43 HA ASP 43 -12.703 -0.408 -6.175
306 HB2 ASP 43 HB2 ASP 43 -11.381 1.355 -8.274
307 HB3 ASP 43 HB3 ASP 43 -12.245 -0.110 -8.723
308 H ASP 44 H ASP 44 -9.243 0.180 -6.989
309 HA ASP 44 HA ASP 44 -8.907 -2.551 -7.985
310 HB2 ASP 44 HB2 ASP 44 -7.555 -0.697 -8.770
311 HB3 ASP 44 HB3 ASP 44 -6.780 -0.545 -7.197
312 H LEU 45 H LEU 45 -8.129 -0.671 -5.054
313 HA LEU 45 HA LEU 45 -6.817 -2.726 -3.613
314 HB2 LEU 45 HB2 LEU 45 -8.788 -0.722 -2.449
315 HB3 LEU 45 HB3 LEU 45 -7.557 -1.608 -1.567
316 HG LEU 45 HG LEU 45 -7.147 0.666 -3.529
317 HD11 LEU 45 HD11 LEU 45 -6.167 1.764 -1.543
318 HD12 LEU 45 HD12 LEU 45 -6.598 0.392 -0.546
319 HD13 LEU 45 HD13 LEU 45 -7.869 1.397 -1.311
320 HD21 LEU 45 HD21 LEU 45 -5.309 -0.867 -3.890
321 HD22 LEU 45 HD22 LEU 45 -5.019 -0.998 -2.134
322 HD23 LEU 45 HD23 LEU 45 -4.735 0.527 -2.987
323 H ALA 46 H ALA 46 -10.261 -2.032 -4.093
324 HA ALA 46 HA ALA 46 -11.264 -4.102 -2.331
325 HB1 ALA 46 HB1 ALA 46 -12.739 -2.303 -3.083
326 HB2 ALA 46 HB2 ALA 46 -12.619 -2.857 -4.771
327 HB3 ALA 46 HB3 ALA 46 -13.401 -3.874 -3.535
328 H SER 47 H SER 47 -10.608 -4.029 -5.834
329 HA SER 47 HA SER 47 -11.441 -6.643 -6.446
330 HB2 SER 47 HB2 SER 47 -11.040 -4.873 -8.087
331 HB3 SER 47 HB3 SER 47 -9.321 -4.830 -7.686
332 HG SER 47 HG SER 47 -8.948 -6.446 -8.880
333 H LEU 48 H LEU 48 -8.282 -5.435 -5.361
334 HA LEU 48 HA LEU 48 -6.968 -7.995 -5.367
335 HB2 LEU 48 HB2 LEU 48 -6.250 -5.337 -4.092
336 HB3 LEU 48 HB3 LEU 48 -5.157 -6.712 -4.263
337 HG LEU 48 HG LEU 48 -6.392 -5.233 -6.635
338 HD11 LEU 48 HD11 LEU 48 -4.032 -4.375 -6.821
339 HD12 LEU 48 HD12 LEU 48 -3.735 -5.010 -5.192
340 HD13 LEU 48 HD13 LEU 48 -5.002 -3.761 -5.484
341 HD21 LEU 48 HD21 LEU 48 -5.779 -7.464 -7.309
342 HD22 LEU 48 HD22 LEU 48 -4.209 -7.312 -6.519
343 HD23 LEU 48 HD23 LEU 48 -4.594 -6.289 -7.932
344 H LYS 49 H LYS 49 -9.437 -7.892 -3.816
345 HA LYS 49 HA LYS 49 -10.371 -8.734 -2.002
346 HB2 LYS 49 HB2 LYS 49 -7.596 -9.952 -1.883
347 HB3 LYS 49 HB3 LYS 49 -8.616 -10.198 -0.498
348 HG2 LYS 49 HG2 LYS 49 -9.675 -10.686 -3.278
349 HG3 LYS 49 HG3 LYS 49 -8.682 -11.913 -2.475
350 HD2 LYS 49 HD2 LYS 49 -11.089 -10.709 -1.095
351 HD3 LYS 49 HD3 LYS 49 -11.245 -12.108 -2.182
352 HE2 LYS 49 HE2 LYS 49 -9.739 -13.442 -0.867
353 HE3 LYS 49 HE3 LYS 49 -9.239 -12.066 0.112
354 HZ1 LYS 49 HZ1 LYS 49 -11.350 -12.011 1.160
355 HZ2 LYS 49 HZ2 LYS 49 -10.847 -13.570 1.186
356 HZ3 LYS 49 HZ3 LYS 49 -11.992 -13.113 0.113
357 H ILE 50 H ILE 50 -8.731 -6.038 -1.628
358 HA ILE 50 HA ILE 50 -8.395 -6.051 1.290
359 HB ILE 50 HB ILE 50 -8.203 -3.630 -0.484
360 HG12 ILE 50 HG12 ILE 50 -6.069 -5.753 0.100
361 HG13 ILE 50 HG13 ILE 50 -6.719 -5.377 -1.492
362 HG21 ILE 50 HG21 ILE 50 -6.872 -2.776 1.259
363 HG22 ILE 50 HG22 ILE 50 -8.212 -3.573 2.098
364 HG23 ILE 50 HG23 ILE 50 -6.642 -4.401 1.958
365 HD11 ILE 50 HD11 ILE 50 -5.791 -3.071 -1.320
366 HD12 ILE 50 HD12 ILE 50 -4.973 -3.559 0.187
367 HD13 ILE 50 HD13 ILE 50 -4.588 -4.370 -1.343
368 HA PRO 51 HA PRO 51 -12.798 -4.755 1.566
369 HB2 PRO 51 HB2 PRO 51 -13.337 -5.495 4.113
370 HB3 PRO 51 HB3 PRO 51 -13.110 -6.729 2.833
371 HG2 PRO 51 HG2 PRO 51 -11.019 -5.746 4.794
372 HG3 PRO 51 HG3 PRO 51 -11.492 -7.441 4.441
373 HD2 PRO 51 HD2 PRO 51 -9.362 -6.228 3.253
374 HD3 PRO 51 HD3 PRO 51 -10.420 -7.392 2.404
375 H GLU 52 H GLU 52 -13.893 -3.001 2.784
376 HA GLU 52 HA GLU 52 -12.303 -0.807 3.322
377 HB2 GLU 52 HB2 GLU 52 -14.159 0.391 3.836
378 HB3 GLU 52 HB3 GLU 52 -14.670 -0.808 2.661
379 HG2 GLU 52 HG2 GLU 52 -15.170 -0.780 5.657
380 HG3 GLU 52 HG3 GLU 52 -16.359 -0.530 4.386
381 H GLN 53 H GLN 53 -13.158 -3.309 5.646
382 HA GLN 53 HA GLN 53 -12.741 -1.890 8.023
383 HB2 GLN 53 HB2 GLN 53 -12.597 -3.945 9.089
384 HB3 GLN 53 HB3 GLN 53 -13.621 -4.251 7.706
385 HG2 GLN 53 HG2 GLN 53 -11.106 -4.938 6.749
386 HG3 GLN 53 HG3 GLN 53 -10.942 -5.333 8.447
387 HE21 GLN 53 HE21 GLN 53 -11.335 -7.594 8.743
388 HE22 GLN 53 HE22 GLN 53 -12.570 -8.438 7.808
389 H PHE 54 H PHE 54 -10.425 -2.898 5.651
390 HA PHE 54 HA PHE 54 -8.156 -1.927 7.340
391 HB2 PHE 54 HB2 PHE 54 -8.015 -4.288 7.275
392 HB3 PHE 54 HB3 PHE 54 -8.398 -4.355 5.555
393 HD1 PHE 54 HD1 PHE 54 -6.831 -3.669 3.886
394 HD2 PHE 54 HD2 PHE 54 -5.726 -3.756 8.023
395 HE1 PHE 54 HE1 PHE 54 -4.408 -3.439 3.232
396 HE2 PHE 54 HE2 PHE 54 -3.350 -3.510 7.414
397 HZ PHE 54 HZ PHE 54 -2.669 -3.335 5.014
398 H ARG 55 H ARG 55 -9.596 -2.115 4.071
399 HA ARG 55 HA ARG 55 -7.625 -0.986 2.504
400 HB2 ARG 55 HB2 ARG 55 -9.692 -1.980 1.714
401 HB3 ARG 55 HB3 ARG 55 -10.608 -0.616 2.366
402 HG2 ARG 55 HG2 ARG 55 -9.445 0.911 0.768
403 HG3 ARG 55 HG3 ARG 55 -8.609 -0.506 0.127
404 HD2 ARG 55 HD2 ARG 55 -10.462 0.061 -1.322
405 HD3 ARG 55 HD3 ARG 55 -10.805 -1.488 -0.540
406 HE ARG 55 HE ARG 55 -11.951 0.504 1.068
407 HH11 ARG 55 HH11 ARG 55 -12.345 -0.391 -2.383
408 HH12 ARG 55 HH12 ARG 55 -14.034 -0.022 -2.402
409 HH21 ARG 55 HH21 ARG 55 -14.206 0.970 1.003
410 HH22 ARG 55 HH22 ARG 55 -15.072 0.825 -0.481
411 H HIS 56 H HIS 56 -9.899 0.739 4.709
412 HA HIS 56 HA HIS 56 -9.149 3.335 3.764
413 HB2 HIS 56 HB2 HIS 56 -11.177 2.882 5.141
414 HB3 HIS 56 HB3 HIS 56 -10.157 2.456 6.511
415 HD1 HIS 56 HD1 HIS 56 -10.595 4.484 8.203
416 HD2 HIS 56 HD2 HIS 56 -9.806 5.598 4.205
417 HE1 HIS 56 HE1 HIS 56 -10.587 7.001 8.142
418 H ALA 57 H ALA 57 -7.610 1.115 6.144
419 HA ALA 57 HA ALA 57 -5.910 3.037 7.323
420 HB1 ALA 57 HB1 ALA 57 -4.896 1.175 8.334
421 HB2 ALA 57 HB2 ALA 57 -6.574 0.693 8.149
422 HB3 ALA 57 HB3 ALA 57 -5.341 0.059 7.031
423 H ILE 58 H ILE 58 -5.342 0.656 4.694
424 HA ILE 58 HA ILE 58 -2.625 1.372 4.204
425 HB ILE 58 HB ILE 58 -3.237 -0.691 3.384
426 HG12 ILE 58 HG12 ILE 58 -3.478 1.075 0.872
427 HG13 ILE 58 HG13 ILE 58 -1.944 0.720 1.693
428 HG21 ILE 58 HG21 ILE 58 -5.058 -1.339 1.970
429 HG22 ILE 58 HG22 ILE 58 -5.692 -0.502 3.361
430 HG23 ILE 58 HG23 ILE 58 -5.585 0.334 1.778
431 HD11 ILE 58 HD11 ILE 58 -2.416 -1.738 1.200
432 HD12 ILE 58 HD12 ILE 58 -3.721 -1.181 0.137
433 HD13 ILE 58 HD13 ILE 58 -2.049 -0.709 -0.188
434 H TRP 59 H TRP 59 -5.655 2.285 2.528
435 HA TRP 59 HA TRP 59 -4.430 4.028 0.717
436 HB2 TRP 59 HB2 TRP 59 -6.773 2.981 0.692
437 HB3 TRP 59 HB3 TRP 59 -7.280 4.336 1.706
438 HD1 TRP 59 HD1 TRP 59 -5.447 3.676 -1.589
439 HE1 TRP 59 HE1 TRP 59 -5.803 5.671 -3.229
440 HE3 TRP 59 HE3 TRP 59 -8.073 6.702 1.445
441 HZ2 TRP 59 HZ2 TRP 59 -7.192 8.186 -3.218
442 HZ3 TRP 59 HZ3 TRP 59 -8.871 8.957 0.678
443 HH2 TRP 59 HH2 TRP 59 -8.414 9.696 -1.646
444 H LYS 60 H LYS 60 -6.161 4.922 3.788
445 HA LYS 60 HA LYS 60 -5.521 7.639 3.626
446 HB2 LYS 60 HB2 LYS 60 -7.163 6.513 5.186
447 HB3 LYS 60 HB3 LYS 60 -5.770 5.981 6.174
448 HG2 LYS 60 HG2 LYS 60 -5.162 8.420 6.393
449 HG3 LYS 60 HG3 LYS 60 -6.660 8.811 5.529
450 HD2 LYS 60 HD2 LYS 60 -7.941 7.624 7.322
451 HD3 LYS 60 HD3 LYS 60 -6.442 7.367 8.214
452 HE2 LYS 60 HE2 LYS 60 -7.573 10.076 7.359
453 HE3 LYS 60 HE3 LYS 60 -7.749 9.375 8.974
454 HZ1 LYS 60 HZ1 LYS 60 -5.155 10.060 7.708
455 HZ2 LYS 60 HZ2 LYS 60 -5.363 9.461 9.215
456 HZ3 LYS 60 HZ3 LYS 60 -5.971 10.962 8.815
457 H GLY 61 H GLY 61 -3.536 4.925 4.964
458 HA2 GLY 61 HA2 GLY 61 -1.580 6.535 6.203
459 HA3 GLY 61 HA3 GLY 61 -1.294 4.906 5.551
460 H ILE 62 H ILE 62 -1.599 5.217 2.841
461 HA ILE 62 HA ILE 62 0.859 6.613 2.278
462 HB ILE 62 HB ILE 62 -0.052 4.495 1.290
463 HG12 ILE 62 HG12 ILE 62 1.221 4.940 -0.924
464 HG13 ILE 62 HG13 ILE 62 1.367 6.602 -0.391
465 HG21 ILE 62 HG21 ILE 62 -1.120 4.592 -0.940
466 HG22 ILE 62 HG22 ILE 62 -2.171 5.231 0.334
467 HG23 ILE 62 HG23 ILE 62 -1.304 6.329 -0.771
468 HD11 ILE 62 HD11 ILE 62 3.389 5.301 0.094
469 HD12 ILE 62 HD12 ILE 62 2.668 5.823 1.611
470 HD13 ILE 62 HD13 ILE 62 2.452 4.142 1.062
471 H LEU 63 H LEU 63 -2.556 7.286 1.633
472 HA LEU 63 HA LEU 63 -2.057 9.571 -0.038
473 HB2 LEU 63 HB2 LEU 63 -4.388 8.594 1.590
474 HB3 LEU 63 HB3 LEU 63 -4.372 10.270 1.131
475 HG LEU 63 HG LEU 63 -5.609 8.759 -0.395
476 HD11 LEU 63 HD11 LEU 63 -3.390 10.400 -1.664
477 HD12 LEU 63 HD12 LEU 63 -4.898 11.047 -0.985
478 HD13 LEU 63 HD13 LEU 63 -4.946 9.981 -2.398
479 HD21 LEU 63 HD21 LEU 63 -4.416 7.562 -2.153
480 HD22 LEU 63 HD22 LEU 63 -4.014 6.874 -0.575
481 HD23 LEU 63 HD23 LEU 63 -2.858 7.940 -1.422
482 H ASP 64 H ASP 64 -2.050 9.039 3.413
483 HA ASP 64 HA ASP 64 -1.955 11.901 4.133
484 HB2 ASP 64 HB2 ASP 64 -1.284 9.384 5.707
485 HB3 ASP 64 HB3 ASP 64 -0.984 10.988 6.328
486 H HIS 65 H HIS 65 0.369 9.354 3.578
487 HA HIS 65 HA HIS 65 2.739 10.772 4.340
488 HB2 HIS 65 HB2 HIS 65 2.689 8.347 4.227
489 HB3 HIS 65 HB3 HIS 65 2.283 8.379 2.517
490 HD1 HIS 65 HD1 HIS 65 5.311 9.597 4.686
491 HD2 HIS 65 HD2 HIS 65 4.235 7.979 0.923
492 HE1 HIS 65 HE1 HIS 65 7.493 9.047 3.473
493 H ARG 66 H ARG 66 1.386 10.062 1.048
494 HA ARG 66 HA ARG 66 3.219 11.862 -0.213
495 HB2 ARG 66 HB2 ARG 66 1.941 11.616 -2.227
496 HB3 ARG 66 HB3 ARG 66 2.103 10.057 -1.434
497 HG2 ARG 66 HG2 ARG 66 -0.113 9.934 -2.016
498 HG3 ARG 66 HG3 ARG 66 -0.263 10.662 -0.424
499 HD2 ARG 66 HD2 ARG 66 -1.733 11.876 -1.764
500 HD3 ARG 66 HD3 ARG 66 -0.349 12.943 -1.598
501 HE ARG 66 HE ARG 66 0.182 11.521 -3.928
502 HH11 ARG 66 HH11 ARG 66 -2.507 13.624 -2.805
503 HH12 ARG 66 HH12 ARG 66 -2.868 14.156 -4.411
504 HH21 ARG 66 HH21 ARG 66 -0.703 11.926 -6.019
505 HH22 ARG 66 HH22 ARG 66 -1.887 13.147 -6.252
506 H GLN 67 H GLN 67 0.164 12.502 1.526
507 HA GLN 67 HA GLN 67 -0.087 15.143 0.308
508 HB2 GLN 67 HB2 GLN 67 -2.013 13.906 1.035
509 HB3 GLN 67 HB3 GLN 67 -1.377 13.774 2.696
510 HG2 GLN 67 HG2 GLN 67 -1.701 16.118 3.055
511 HG3 GLN 67 HG3 GLN 67 -2.111 16.373 1.343
512 HE21 GLN 67 HE21 GLN 67 -3.268 14.700 4.386
513 HE22 GLN 67 HE22 GLN 67 -4.903 14.531 3.804
514 H LEU 68 H LEU 68 1.738 13.745 3.005
515 HA LEU 68 HA LEU 68 2.406 16.471 3.952
516 HB2 LEU 68 HB2 LEU 68 2.323 13.780 5.322
517 HB3 LEU 68 HB3 LEU 68 3.112 15.179 6.061
518 HG LEU 68 HG LEU 68 0.200 15.301 5.143
519 HD11 LEU 68 HD11 LEU 68 -0.465 14.904 7.445
520 HD12 LEU 68 HD12 LEU 68 1.219 14.644 7.930
521 HD13 LEU 68 HD13 LEU 68 0.406 13.505 6.812
522 HD21 LEU 68 HD21 LEU 68 1.284 17.479 5.512
523 HD22 LEU 68 HD22 LEU 68 1.849 16.967 7.114
524 HD23 LEU 68 HD23 LEU 68 0.114 17.168 6.785
525 H HIS 69 H HIS 69 3.997 14.169 1.921
526 HA HIS 69 HA HIS 69 6.582 15.276 2.761
527 HB2 HIS 69 HB2 HIS 69 5.657 12.428 2.297
528 HB3 HIS 69 HB3 HIS 69 7.189 12.921 1.699
529 HD1 HIS 69 HD1 HIS 69 6.422 14.636 4.954
530 HD2 HIS 69 HD2 HIS 69 8.235 11.113 3.526
531 HE1 HIS 69 HE1 HIS 69 7.822 13.729 6.871
532 H ASP 70 H ASP 70 7.759 16.048 1.056
533 HA ASP 70 HA ASP 70 7.117 15.327 -1.690
534 HB2 ASP 70 HB2 ASP 70 5.644 17.395 -0.954
535 HB3 ASP 70 HB3 ASP 70 7.143 18.292 -1.104
Start of MODEL 3
1 H1 GLY 1 H GLY 1 18.643 -12.852 -0.662
2 HA2 GLY 1 HA2 GLY 1 20.472 -12.237 -2.232
3 HA3 GLY 1 HA3 GLY 1 19.194 -11.578 -3.274
4 HA PRO 2 HA PRO 2 20.430 -8.007 -0.757
5 HB2 PRO 2 HB2 PRO 2 19.402 -6.011 -2.318
6 HB3 PRO 2 HB3 PRO 2 20.875 -6.921 -2.769
7 HG2 PRO 2 HG2 PRO 2 18.023 -7.449 -3.669
8 HG3 PRO 2 HG3 PRO 2 19.478 -7.262 -4.699
9 HD2 PRO 2 HD2 PRO 2 18.557 -9.700 -3.936
10 HD3 PRO 2 HD3 PRO 2 20.319 -9.388 -4.047
11 H LEU 3 H LEU 3 19.132 -6.066 0.107
12 HA LEU 3 HA LEU 3 16.476 -7.046 1.056
13 HB2 LEU 3 HB2 LEU 3 18.272 -4.829 2.165
14 HB3 LEU 3 HB3 LEU 3 16.638 -5.212 2.697
15 HG LEU 3 HG LEU 3 17.583 -7.635 3.102
16 HD11 LEU 3 HD11 LEU 3 19.974 -7.535 3.894
17 HD12 LEU 3 HD12 LEU 3 20.116 -5.926 3.168
18 HD13 LEU 3 HD13 LEU 3 19.815 -7.353 2.150
19 HD21 LEU 3 HD21 LEU 3 16.723 -6.169 4.862
20 HD22 LEU 3 HD22 LEU 3 18.258 -5.275 4.907
21 HD23 LEU 3 HD23 LEU 3 18.197 -6.977 5.406
22 H GLY 4 H GLY 4 17.414 -3.663 0.891
23 HA2 GLY 4 HA2 GLY 4 16.779 -2.592 -1.465
24 HA3 GLY 4 HA3 GLY 4 15.175 -2.909 -0.758
25 H SER 5 H SER 5 16.123 -0.273 -1.184
26 HA SER 5 HA SER 5 17.038 0.795 1.421
27 HB2 SER 5 HB2 SER 5 16.516 2.075 -1.291
28 HB3 SER 5 HB3 SER 5 17.129 2.938 0.136
29 HG SER 5 HG SER 5 18.923 1.554 0.158
30 H THR 6 H THR 6 15.641 3.208 1.596
31 HA THR 6 HA THR 6 13.212 2.351 2.755
32 HB THR 6 HB THR 6 13.917 5.177 1.901
33 HG1 THR 6 HG1 THR 6 14.977 3.876 4.183
34 HG21 THR 6 HG21 THR 6 11.812 4.952 3.139
35 HG22 THR 6 HG22 THR 6 12.995 5.791 4.123
36 HG23 THR 6 HG23 THR 6 12.639 4.078 4.442
37 H ASP 7 H ASP 7 11.078 2.987 2.087
38 HA ASP 7 HA ASP 7 9.327 2.962 0.702
39 HB2 ASP 7 HB2 ASP 7 10.764 5.032 -0.957
40 HB3 ASP 7 HB3 ASP 7 9.034 4.865 -0.635
41 H CYS 8 H CYS 8 11.288 0.940 0.046
42 HA CYS 8 HA CYS 8 11.467 0.765 -2.844
43 HB2 CYS 8 HB2 CYS 8 13.191 -0.140 -1.317
44 HB3 CYS 8 HB3 CYS 8 12.034 -1.338 -0.724
45 HG CYS 8 HG CYS 8 13.751 -2.468 -2.363
46 H SER 9 H SER 9 9.796 -1.571 -0.573
47 HA SER 9 HA SER 9 7.674 -1.861 -2.626
48 HB2 SER 9 HB2 SER 9 9.043 -4.159 -1.198
49 HB3 SER 9 HB3 SER 9 7.808 -4.274 -2.468
50 HG SER 9 HG SER 9 9.369 -3.394 -3.929
51 H ILE 10 H ILE 10 5.690 -2.731 -1.749
52 HA ILE 10 HA ILE 10 4.891 -1.530 0.606
53 HB ILE 10 HB ILE 10 3.736 -3.547 -1.232
54 HG12 ILE 10 HG12 ILE 10 3.760 -1.210 -1.680
55 HG13 ILE 10 HG13 ILE 10 2.129 -1.883 -1.694
56 HG21 ILE 10 HG21 ILE 10 2.887 -4.529 0.829
57 HG22 ILE 10 HG22 ILE 10 2.262 -2.945 1.324
58 HG23 ILE 10 HG23 ILE 10 1.607 -3.777 -0.112
59 HD11 ILE 10 HD11 ILE 10 3.261 -0.347 0.678
60 HD12 ILE 10 HD12 ILE 10 2.496 0.413 -0.688
61 HD13 ILE 10 HD13 ILE 10 1.574 -0.725 0.332
62 H VAL 11 H VAL 11 6.405 -4.608 0.360
63 HA VAL 11 HA VAL 11 5.541 -5.730 2.813
64 HB VAL 11 HB VAL 11 7.967 -6.633 2.902
65 HG11 VAL 11 HG11 VAL 11 7.385 -8.303 1.166
66 HG12 VAL 11 HG12 VAL 11 5.991 -7.881 2.174
67 HG13 VAL 11 HG13 VAL 11 6.139 -7.203 0.534
68 HG21 VAL 11 HG21 VAL 11 9.015 -4.965 1.299
69 HG22 VAL 11 HG22 VAL 11 9.265 -6.656 0.874
70 HG23 VAL 11 HG23 VAL 11 8.054 -5.721 -0.002
71 H SER 12 H SER 12 8.150 -3.353 2.241
72 HA SER 12 HA SER 12 8.824 -3.111 5.027
73 HB2 SER 12 HB2 SER 12 9.499 -1.503 2.541
74 HB3 SER 12 HB3 SER 12 10.247 -1.284 4.151
75 HG SER 12 HG SER 12 11.103 -2.914 2.378
76 H PHE 13 H PHE 13 6.616 -1.298 2.783
77 HA PHE 13 HA PHE 13 6.238 0.869 4.614
78 HB2 PHE 13 HB2 PHE 13 5.420 0.914 2.254
79 HB3 PHE 13 HB3 PHE 13 4.241 -0.308 2.645
80 HD1 PHE 13 HD1 PHE 13 2.143 0.884 2.230
81 HD2 PHE 13 HD2 PHE 13 5.150 2.690 4.772
82 HE1 PHE 13 HE1 PHE 13 0.551 2.712 2.878
83 HE2 PHE 13 HE2 PHE 13 3.550 4.419 5.417
84 HZ PHE 13 HZ PHE 13 1.280 4.459 4.457
85 H PHE 14 H PHE 14 4.456 -2.199 4.102
86 HA PHE 14 HA PHE 14 2.609 -1.848 6.231
87 HB2 PHE 14 HB2 PHE 14 3.606 -4.233 4.656
88 HB3 PHE 14 HB3 PHE 14 2.557 -4.448 6.036
89 HD1 PHE 14 HD1 PHE 14 0.772 -5.423 4.664
90 HD2 PHE 14 HD2 PHE 14 2.110 -1.378 3.896
91 HE1 PHE 14 HE1 PHE 14 -1.167 -5.043 3.190
92 HE2 PHE 14 HE2 PHE 14 0.202 -1.006 2.512
93 HZ PHE 14 HZ PHE 14 -1.491 -2.792 2.124
94 H ALA 15 H ALA 15 5.935 -3.159 6.213
95 HA ALA 15 HA ALA 15 5.875 -4.213 8.857
96 HB1 ALA 15 HB1 ALA 15 8.284 -4.114 8.790
97 HB2 ALA 15 HB2 ALA 15 7.762 -4.537 7.156
98 HB3 ALA 15 HB3 ALA 15 8.283 -2.887 7.518
99 H ARG 16 H ARG 16 6.514 -0.898 7.596
100 HA ARG 16 HA ARG 16 7.156 0.210 10.192
101 HB2 ARG 16 HB2 ARG 16 6.329 1.469 7.543
102 HB3 ARG 16 HB3 ARG 16 6.709 2.404 8.971
103 HG2 ARG 16 HG2 ARG 16 8.717 0.428 7.814
104 HG3 ARG 16 HG3 ARG 16 8.521 2.074 7.220
105 HD2 ARG 16 HD2 ARG 16 10.309 2.198 8.752
106 HD3 ARG 16 HD3 ARG 16 8.921 2.906 9.581
107 HE ARG 16 HE ARG 16 9.334 0.051 10.107
108 HH11 ARG 16 HH11 ARG 16 9.935 3.324 11.343
109 HH12 ARG 16 HH12 ARG 16 10.534 2.786 12.855
110 HH21 ARG 16 HH21 ARG 16 9.958 -0.639 12.074
111 HH22 ARG 16 HH22 ARG 16 10.732 0.378 13.247
112 H LEU 17 H LEU 17 4.150 0.117 8.245
113 HA LEU 17 HA LEU 17 2.605 1.649 10.111
114 HB2 LEU 17 HB2 LEU 17 1.652 -0.612 8.294
115 HB3 LEU 17 HB3 LEU 17 0.614 0.522 9.154
116 HG LEU 17 HG LEU 17 2.503 1.186 6.887
117 HD11 LEU 17 HD11 LEU 17 -0.534 1.195 7.036
118 HD12 LEU 17 HD12 LEU 17 0.469 -0.013 6.198
119 HD13 LEU 17 HD13 LEU 17 0.436 1.661 5.634
120 HD21 LEU 17 HD21 LEU 17 2.443 3.165 8.271
121 HD22 LEU 17 HD22 LEU 17 0.704 2.984 8.562
122 HD23 LEU 17 HD23 LEU 17 1.283 3.455 6.962
123 H GLY 18 H GLY 18 3.337 -1.844 9.908
124 HA2 GLY 18 HA2 GLY 18 3.669 -3.102 11.950
125 HA3 GLY 18 HA3 GLY 18 2.308 -2.245 12.681
126 H CYS 19 H CYS 19 1.782 -3.053 9.362
127 HA CYS 19 HA CYS 19 -0.452 -4.673 9.901
128 HB2 CYS 19 HB2 CYS 19 0.464 -3.498 7.673
129 HB3 CYS 19 HB3 CYS 19 1.081 -5.143 7.372
130 HG CYS 19 HG CYS 19 -2.021 -4.335 8.214
131 H SER 20 H SER 20 -0.820 -6.913 9.461
132 HA SER 20 HA SER 20 1.546 -8.727 9.718
133 HB2 SER 20 HB2 SER 20 0.397 -8.474 11.857
134 HB3 SER 20 HB3 SER 20 -1.144 -8.970 11.118
135 HG SER 20 HG SER 20 -0.015 -10.673 12.185
136 H SER 21 H SER 21 -1.572 -10.258 9.490
137 HA SER 21 HA SER 21 -0.997 -11.717 7.278
138 HB2 SER 21 HB2 SER 21 -3.750 -10.763 8.206
139 HB3 SER 21 HB3 SER 21 -3.480 -12.094 7.084
140 HG SER 21 HG SER 21 -3.623 -13.068 8.984
141 H CYS 22 H CYS 22 -2.235 -8.340 7.003
142 HA CYS 22 HA CYS 22 -3.099 -8.869 4.295
143 HB2 CYS 22 HB2 CYS 22 -2.519 -6.104 5.277
144 HB3 CYS 22 HB3 CYS 22 -3.700 -6.669 4.104
145 HG CYS 22 HG CYS 22 -4.955 -8.251 6.049
146 H LEU 23 H LEU 23 0.106 -8.226 5.702
147 HA LEU 23 HA LEU 23 1.189 -7.251 3.227
148 HB2 LEU 23 HB2 LEU 23 3.155 -7.007 4.347
149 HB3 LEU 23 HB3 LEU 23 2.035 -6.931 5.697
150 HG LEU 23 HG LEU 23 2.581 -9.534 5.936
151 HD11 LEU 23 HD11 LEU 23 3.991 -9.657 3.837
152 HD12 LEU 23 HD12 LEU 23 4.864 -10.089 5.301
153 HD13 LEU 23 HD13 LEU 23 5.106 -8.492 4.565
154 HD21 LEU 23 HD21 LEU 23 4.488 -7.302 6.726
155 HD22 LEU 23 HD22 LEU 23 4.420 -8.924 7.454
156 HD23 LEU 23 HD23 LEU 23 3.051 -7.833 7.615
157 H ASP 24 H ASP 24 0.794 -10.353 4.999
158 HA ASP 24 HA ASP 24 2.225 -11.911 3.129
159 HB2 ASP 24 HB2 ASP 24 1.508 -12.773 5.345
160 HB3 ASP 24 HB3 ASP 24 -0.138 -12.908 4.727
161 H TYR 25 H TYR 25 -1.274 -11.069 3.252
162 HA TYR 25 HA TYR 25 -1.973 -12.587 0.951
163 HB2 TYR 25 HB2 TYR 25 -3.172 -9.995 1.991
164 HB3 TYR 25 HB3 TYR 25 -3.856 -10.927 0.670
165 HD1 TYR 25 HD1 TYR 25 -4.722 -10.186 3.807
166 HD2 TYR 25 HD2 TYR 25 -3.731 -13.744 1.559
167 HE1 TYR 25 HE1 TYR 25 -6.034 -11.558 5.380
168 HE2 TYR 25 HE2 TYR 25 -5.038 -15.098 3.106
169 HH TYR 25 HH TYR 25 -6.152 -15.098 5.222
170 H PHE 26 H PHE 26 -0.790 -9.162 1.178
171 HA PHE 26 HA PHE 26 -0.770 -8.679 -1.578
172 HB2 PHE 26 HB2 PHE 26 0.479 -7.510 0.850
173 HB3 PHE 26 HB3 PHE 26 1.433 -7.290 -0.585
174 HD1 PHE 26 HD1 PHE 26 0.738 -5.861 -2.386
175 HD2 PHE 26 HD2 PHE 26 -1.926 -6.612 0.900
176 HE1 PHE 26 HE1 PHE 26 -0.672 -3.955 -3.114
177 HE2 PHE 26 HE2 PHE 26 -3.368 -4.764 0.145
178 HZ PHE 26 HZ PHE 26 -2.731 -3.407 -1.850
179 H THR 27 H THR 27 1.936 -10.070 0.456
180 HA THR 27 HA THR 27 3.715 -10.310 -1.740
181 HB THR 27 HB THR 27 5.028 -11.805 -0.268
182 HG1 THR 27 HG1 THR 27 3.482 -12.823 1.058
183 HG21 THR 27 HG21 THR 27 5.232 -9.347 -0.069
184 HG22 THR 27 HG22 THR 27 5.483 -10.165 1.495
185 HG23 THR 27 HG23 THR 27 3.964 -9.327 1.194
186 H THR 28 H THR 28 1.408 -12.682 -0.370
187 HA THR 28 HA THR 28 2.071 -14.851 -2.051
188 HB THR 28 HB THR 28 -0.469 -14.076 -0.539
189 HG1 THR 28 HG1 THR 28 0.550 -14.975 1.138
190 HG21 THR 28 HG21 THR 28 -1.004 -15.892 -2.153
191 HG22 THR 28 HG22 THR 28 -0.993 -16.477 -0.483
192 HG23 THR 28 HG23 THR 28 0.387 -16.827 -1.537
193 H GLN 29 H GLN 29 0.087 -11.955 -2.646
194 HA GLN 29 HA GLN 29 -1.106 -13.042 -5.108
195 HB2 GLN 29 HB2 GLN 29 -1.074 -10.300 -3.779
196 HB3 GLN 29 HB3 GLN 29 -1.914 -10.661 -5.291
197 HG2 GLN 29 HG2 GLN 29 -2.576 -12.230 -2.785
198 HG3 GLN 29 HG3 GLN 29 -3.356 -10.699 -3.180
199 HE21 GLN 29 HE21 GLN 29 -4.556 -10.582 -5.297
200 HE22 GLN 29 HE22 GLN 29 -4.845 -12.037 -6.225
201 H GLY 30 H GLY 30 1.765 -11.259 -4.220
202 HA2 GLY 30 HA2 GLY 30 3.598 -10.605 -5.454
203 HA3 GLY 30 HA3 GLY 30 2.892 -11.437 -6.851
204 H LEU 31 H LEU 31 1.463 -8.735 -5.017
205 HA LEU 31 HA LEU 31 1.815 -6.872 -7.320
206 HB2 LEU 31 HB2 LEU 31 -0.596 -6.142 -6.749
207 HB3 LEU 31 HB3 LEU 31 -0.321 -7.603 -7.668
208 HG LEU 31 HG LEU 31 -0.709 -8.980 -5.714
209 HD11 LEU 31 HD11 LEU 31 0.009 -7.568 -3.874
210 HD12 LEU 31 HD12 LEU 31 -1.661 -8.029 -3.633
211 HD13 LEU 31 HD13 LEU 31 -1.273 -6.395 -4.243
212 HD21 LEU 31 HD21 LEU 31 -2.563 -8.465 -7.151
213 HD22 LEU 31 HD22 LEU 31 -2.929 -6.997 -6.213
214 HD23 LEU 31 HD23 LEU 31 -3.099 -8.613 -5.481
215 H THR 32 H THR 32 3.168 -7.113 -4.642
216 HA THR 32 HA THR 32 2.204 -4.693 -3.237
217 HB THR 32 HB THR 32 3.051 -5.646 -1.464
218 HG1 THR 32 HG1 THR 32 5.635 -5.900 -2.600
219 HG21 THR 32 HG21 THR 32 4.447 -7.858 -2.978
220 HG22 THR 32 HG22 THR 32 2.725 -7.837 -2.535
221 HG23 THR 32 HG23 THR 32 3.964 -7.808 -1.275
222 H THR 33 H THR 33 2.752 -2.604 -3.908
223 HA THR 33 HA THR 33 5.513 -2.152 -4.476
224 HB THR 33 HB THR 33 5.284 -2.523 -6.668
225 HG1 THR 33 HG1 THR 33 5.331 -0.681 -7.435
226 HG21 THR 33 HG21 THR 33 3.174 -3.782 -6.658
227 HG22 THR 33 HG22 THR 33 3.186 -2.693 -8.019
228 HG23 THR 33 HG23 THR 33 2.214 -2.291 -6.583
229 H ILE 34 H ILE 34 5.910 0.088 -4.220
230 HA ILE 34 HA ILE 34 3.906 1.417 -2.522
231 HB ILE 34 HB ILE 34 6.550 2.609 -3.380
232 HG12 ILE 34 HG12 ILE 34 7.013 0.400 -2.313
233 HG13 ILE 34 HG13 ILE 34 7.658 1.796 -1.471
234 HG21 ILE 34 HG21 ILE 34 4.654 3.111 -1.021
235 HG22 ILE 34 HG22 ILE 34 6.288 3.781 -1.125
236 HG23 ILE 34 HG23 ILE 34 5.070 4.230 -2.327
237 HD11 ILE 34 HD11 ILE 34 5.835 1.706 0.191
238 HD12 ILE 34 HD12 ILE 34 5.174 0.291 -0.646
239 HD13 ILE 34 HD13 ILE 34 6.772 0.240 0.145
240 H TYR 35 H TYR 35 5.632 2.308 -5.462
241 HA TYR 35 HA TYR 35 4.392 4.730 -6.030
242 HB2 TYR 35 HB2 TYR 35 5.523 2.776 -8.066
243 HB3 TYR 35 HB3 TYR 35 5.474 4.531 -8.151
244 HD1 TYR 35 HD1 TYR 35 7.161 1.615 -6.578
245 HD2 TYR 35 HD2 TYR 35 7.151 5.918 -6.986
246 HE1 TYR 35 HE1 TYR 35 9.419 1.714 -5.564
247 HE2 TYR 35 HE2 TYR 35 9.402 6.014 -5.963
248 HH TYR 35 HH TYR 35 11.019 4.787 -4.803
249 H GLN 36 H GLN 36 3.182 1.567 -6.400
250 HA GLN 36 HA GLN 36 1.236 2.275 -8.529
251 HB2 GLN 36 HB2 GLN 36 1.962 -0.233 -7.008
252 HB3 GLN 36 HB3 GLN 36 0.477 -0.177 -7.957
253 HG2 GLN 36 HG2 GLN 36 3.181 0.562 -9.162
254 HG3 GLN 36 HG3 GLN 36 2.485 -1.055 -9.237
255 HE21 GLN 36 HE21 GLN 36 2.869 1.499 -11.355
256 HE22 GLN 36 HE22 GLN 36 1.366 1.199 -12.201
257 H ILE 37 H ILE 37 1.059 1.564 -4.959
258 HA ILE 37 HA ILE 37 -1.792 1.735 -4.989
259 HB ILE 37 HB ILE 37 -1.613 2.244 -2.552
260 HG12 ILE 37 HG12 ILE 37 1.325 1.573 -2.906
261 HG13 ILE 37 HG13 ILE 37 0.731 3.238 -2.769
262 HG21 ILE 37 HG21 ILE 37 -1.080 -0.072 -2.004
263 HG22 ILE 37 HG22 ILE 37 -2.018 0.015 -3.489
264 HG23 ILE 37 HG23 ILE 37 -0.258 -0.284 -3.574
265 HD11 ILE 37 HD11 ILE 37 -0.259 2.690 -0.576
266 HD12 ILE 37 HD12 ILE 37 0.389 1.053 -0.721
267 HD13 ILE 37 HD13 ILE 37 1.504 2.442 -0.631
268 H GLU 38 H GLU 38 0.602 4.242 -5.346
269 HA GLU 38 HA GLU 38 -1.265 6.246 -4.412
270 HB2 GLU 38 HB2 GLU 38 1.543 6.319 -5.483
271 HB3 GLU 38 HB3 GLU 38 0.566 7.754 -5.762
272 HG2 GLU 38 HG2 GLU 38 1.174 6.492 -3.076
273 HG3 GLU 38 HG3 GLU 38 1.711 8.058 -3.662
274 H HIS 39 H HIS 39 -1.131 4.453 -7.210
275 HA HIS 39 HA HIS 39 -2.769 6.497 -8.660
276 HB2 HIS 39 HB2 HIS 39 -1.149 4.163 -9.722
277 HB3 HIS 39 HB3 HIS 39 -2.035 5.334 -10.683
278 HD1 HIS 39 HD1 HIS 39 -1.013 8.026 -9.175
279 HD2 HIS 39 HD2 HIS 39 1.340 4.690 -10.182
280 HE1 HIS 39 HE1 HIS 39 1.387 8.839 -9.180
281 H TYR 40 H TYR 40 -2.669 3.246 -7.294
282 HA TYR 40 HA TYR 40 -5.116 2.371 -8.524
283 HB2 TYR 40 HB2 TYR 40 -3.334 1.361 -6.289
284 HB3 TYR 40 HB3 TYR 40 -4.927 0.670 -6.529
285 HD1 TYR 40 HD1 TYR 40 -1.589 -0.209 -7.191
286 HD2 TYR 40 HD2 TYR 40 -5.428 0.291 -9.222
287 HE1 TYR 40 HE1 TYR 40 -0.986 -1.889 -8.836
288 HE2 TYR 40 HE2 TYR 40 -4.806 -1.479 -10.794
289 HH TYR 40 HH TYR 40 -3.199 -3.490 -10.747
290 H SER 41 H SER 41 -6.797 3.786 -8.126
291 HA SER 41 HA SER 41 -7.274 4.988 -5.556
292 HB2 SER 41 HB2 SER 41 -9.137 4.518 -7.941
293 HB3 SER 41 HB3 SER 41 -9.491 5.538 -6.541
294 HG SER 41 HG SER 41 -7.698 5.947 -8.640
295 H MET 42 H MET 42 -9.499 4.697 -4.546
296 HA MET 42 HA MET 42 -9.640 2.247 -3.212
297 HB2 MET 42 HB2 MET 42 -11.732 4.409 -3.608
298 HB3 MET 42 HB3 MET 42 -11.914 3.050 -2.489
299 HG2 MET 42 HG2 MET 42 -9.781 3.696 -1.374
300 HG3 MET 42 HG3 MET 42 -9.677 5.121 -2.408
301 HE1 MET 42 HE1 MET 42 -10.908 7.352 -1.968
302 HE2 MET 42 HE2 MET 42 -12.289 6.481 -2.676
303 HE3 MET 42 HE3 MET 42 -12.501 7.416 -1.181
304 H ASP 43 H ASP 43 -11.249 3.122 -6.268
305 HA ASP 43 HA ASP 43 -13.171 1.022 -6.323
306 HB2 ASP 43 HB2 ASP 43 -13.396 2.726 -7.954
307 HB3 ASP 43 HB3 ASP 43 -11.719 2.579 -8.476
308 H ASP 44 H ASP 44 -9.812 1.150 -7.628
309 HA ASP 44 HA ASP 44 -9.846 -1.554 -8.562
310 HB2 ASP 44 HB2 ASP 44 -7.863 0.635 -8.347
311 HB3 ASP 44 HB3 ASP 44 -7.170 -0.960 -8.099
312 H LEU 45 H LEU 45 -8.734 -0.032 -5.552
313 HA LEU 45 HA LEU 45 -7.596 -2.383 -4.389
314 HB2 LEU 45 HB2 LEU 45 -8.933 0.011 -3.055
315 HB3 LEU 45 HB3 LEU 45 -8.018 -1.217 -2.172
316 HG LEU 45 HG LEU 45 -6.798 0.430 -4.431
317 HD11 LEU 45 HD11 LEU 45 -5.766 1.795 -2.709
318 HD12 LEU 45 HD12 LEU 45 -6.704 0.986 -1.429
319 HD13 LEU 45 HD13 LEU 45 -7.513 1.986 -2.665
320 HD21 LEU 45 HD21 LEU 45 -4.670 -0.229 -3.469
321 HD22 LEU 45 HD22 LEU 45 -5.609 -1.698 -3.784
322 HD23 LEU 45 HD23 LEU 45 -5.477 -1.062 -2.135
323 H ALA 46 H ALA 46 -10.967 -1.080 -4.109
324 HA ALA 46 HA ALA 46 -11.957 -3.261 -2.579
325 HB1 ALA 46 HB1 ALA 46 -13.390 -1.507 -4.611
326 HB2 ALA 46 HB2 ALA 46 -14.180 -2.484 -3.355
327 HB3 ALA 46 HB3 ALA 46 -13.152 -1.101 -2.898
328 H SER 47 H SER 47 -11.436 -2.926 -6.061
329 HA SER 47 HA SER 47 -13.044 -5.127 -6.960
330 HB2 SER 47 HB2 SER 47 -12.358 -3.169 -8.316
331 HB3 SER 47 HB3 SER 47 -10.675 -3.675 -8.192
332 HG SER 47 HG SER 47 -12.820 -4.958 -9.495
333 H LEU 48 H LEU 48 -9.640 -4.730 -6.039
334 HA LEU 48 HA LEU 48 -8.717 -7.348 -6.652
335 HB2 LEU 48 HB2 LEU 48 -7.647 -4.994 -5.078
336 HB3 LEU 48 HB3 LEU 48 -6.734 -6.493 -5.157
337 HG LEU 48 HG LEU 48 -7.680 -5.105 -7.691
338 HD11 LEU 48 HD11 LEU 48 -5.017 -4.763 -6.262
339 HD12 LEU 48 HD12 LEU 48 -6.292 -3.527 -6.384
340 HD13 LEU 48 HD13 LEU 48 -5.466 -4.082 -7.846
341 HD21 LEU 48 HD21 LEU 48 -5.463 -7.137 -7.106
342 HD22 LEU 48 HD22 LEU 48 -5.794 -6.395 -8.681
343 HD23 LEU 48 HD23 LEU 48 -6.986 -7.463 -7.960
344 H LYS 49 H LYS 49 -11.048 -7.241 -4.894
345 HA LYS 49 HA LYS 49 -12.058 -8.404 -3.327
346 HB2 LYS 49 HB2 LYS 49 -9.543 -10.066 -2.898
347 HB3 LYS 49 HB3 LYS 49 -11.191 -10.555 -2.562
348 HG2 LYS 49 HG2 LYS 49 -10.071 -10.061 -5.364
349 HG3 LYS 49 HG3 LYS 49 -10.135 -11.625 -4.570
350 HD2 LYS 49 HD2 LYS 49 -12.517 -11.659 -4.535
351 HD3 LYS 49 HD3 LYS 49 -12.646 -9.974 -5.041
352 HE2 LYS 49 HE2 LYS 49 -11.364 -12.176 -6.730
353 HE3 LYS 49 HE3 LYS 49 -13.067 -11.714 -6.849
354 HZ1 LYS 49 HZ1 LYS 49 -11.668 -10.600 -8.504
355 HZ2 LYS 49 HZ2 LYS 49 -10.811 -9.853 -7.362
356 HZ3 LYS 49 HZ3 LYS 49 -12.409 -9.519 -7.525
357 H ILE 50 H ILE 50 -9.924 -6.206 -2.602
358 HA ILE 50 HA ILE 50 -9.230 -6.731 0.119
359 HB ILE 50 HB ILE 50 -9.354 -4.058 -1.280
360 HG12 ILE 50 HG12 ILE 50 -8.051 -5.642 -2.722
361 HG13 ILE 50 HG13 ILE 50 -7.035 -4.430 -2.015
362 HG21 ILE 50 HG21 ILE 50 -7.621 -3.401 0.239
363 HG22 ILE 50 HG22 ILE 50 -8.946 -4.101 1.185
364 HG23 ILE 50 HG23 ILE 50 -7.503 -5.068 0.849
365 HD11 ILE 50 HD11 ILE 50 -6.047 -6.028 -0.488
366 HD12 ILE 50 HD12 ILE 50 -7.318 -7.227 -0.809
367 HD13 ILE 50 HD13 ILE 50 -6.166 -6.827 -2.068
368 HA PRO 51 HA PRO 51 -13.340 -5.633 1.593
369 HB2 PRO 51 HB2 PRO 51 -12.922 -5.890 4.288
370 HB3 PRO 51 HB3 PRO 51 -13.117 -7.294 3.189
371 HG2 PRO 51 HG2 PRO 51 -10.565 -6.108 4.287
372 HG3 PRO 51 HG3 PRO 51 -11.007 -7.835 4.103
373 HD2 PRO 51 HD2 PRO 51 -9.419 -6.482 2.319
374 HD3 PRO 51 HD3 PRO 51 -10.467 -7.849 1.849
375 H GLU 52 H GLU 52 -14.209 -3.688 2.377
376 HA GLU 52 HA GLU 52 -12.815 -1.349 2.103
377 HB2 GLU 52 HB2 GLU 52 -14.738 -0.238 2.960
378 HB3 GLU 52 HB3 GLU 52 -15.242 -1.657 2.040
379 HG2 GLU 52 HG2 GLU 52 -15.123 -2.736 4.560
380 HG3 GLU 52 HG3 GLU 52 -15.527 -1.077 4.967
381 H GLN 53 H GLN 53 -13.321 -3.052 5.175
382 HA GLN 53 HA GLN 53 -12.432 -1.166 6.978
383 HB2 GLN 53 HB2 GLN 53 -12.005 -4.201 6.933
384 HB3 GLN 53 HB3 GLN 53 -11.838 -3.205 8.374
385 HG2 GLN 53 HG2 GLN 53 -14.459 -3.329 6.804
386 HG3 GLN 53 HG3 GLN 53 -14.019 -4.498 8.032
387 HE21 GLN 53 HE21 GLN 53 -15.315 -4.007 9.708
388 HE22 GLN 53 HE22 GLN 53 -15.411 -2.424 10.477
389 H PHE 54 H PHE 54 -10.408 -3.681 5.445
390 HA PHE 54 HA PHE 54 -7.979 -2.498 6.544
391 HB2 PHE 54 HB2 PHE 54 -7.839 -4.811 6.332
392 HB3 PHE 54 HB3 PHE 54 -8.611 -4.827 4.753
393 HD1 PHE 54 HD1 PHE 54 -7.447 -4.678 2.834
394 HD2 PHE 54 HD2 PHE 54 -5.409 -3.730 6.486
395 HE1 PHE 54 HE1 PHE 54 -5.262 -4.554 1.578
396 HE2 PHE 54 HE2 PHE 54 -3.286 -3.556 5.278
397 HZ PHE 54 HZ PHE 54 -3.207 -3.977 2.796
398 H ARG 55 H ARG 55 -9.583 -2.560 3.310
399 HA ARG 55 HA ARG 55 -7.703 -1.207 1.787
400 HB2 ARG 55 HB2 ARG 55 -9.646 -2.058 0.745
401 HB3 ARG 55 HB3 ARG 55 -10.720 -1.149 1.798
402 HG2 ARG 55 HG2 ARG 55 -10.138 0.964 0.736
403 HG3 ARG 55 HG3 ARG 55 -8.882 0.179 -0.224
404 HD2 ARG 55 HD2 ARG 55 -10.847 0.610 -1.595
405 HD3 ARG 55 HD3 ARG 55 -10.576 -1.123 -1.418
406 HE ARG 55 HE ARG 55 -12.601 -1.367 -0.450
407 HH11 ARG 55 HH11 ARG 55 -11.923 2.144 -0.088
408 HH12 ARG 55 HH12 ARG 55 -13.605 2.496 0.132
409 HH21 ARG 55 HH21 ARG 55 -14.712 -0.822 -0.101
410 HH22 ARG 55 HH22 ARG 55 -15.180 0.844 0.161
411 H HIS 56 H HIS 56 -10.169 0.309 3.959
412 HA HIS 56 HA HIS 56 -9.422 2.953 3.278
413 HB2 HIS 56 HB2 HIS 56 -10.668 1.777 5.821
414 HB3 HIS 56 HB3 HIS 56 -10.458 3.503 5.557
415 HD1 HIS 56 HD1 HIS 56 -11.645 4.101 2.831
416 HD2 HIS 56 HD2 HIS 56 -13.207 1.290 5.551
417 HE1 HIS 56 HE1 HIS 56 -14.167 3.936 2.356
418 H ALA 57 H ALA 57 -7.972 0.677 5.654
419 HA ALA 57 HA ALA 57 -6.465 2.727 6.957
420 HB1 ALA 57 HB1 ALA 57 -7.102 0.544 7.959
421 HB2 ALA 57 HB2 ALA 57 -5.996 -0.266 6.824
422 HB3 ALA 57 HB3 ALA 57 -5.359 0.874 8.030
423 H ILE 58 H ILE 58 -5.635 0.353 4.280
424 HA ILE 58 HA ILE 58 -2.913 1.158 4.194
425 HB ILE 58 HB ILE 58 -3.324 -0.867 3.203
426 HG12 ILE 58 HG12 ILE 58 -2.831 -0.753 0.830
427 HG13 ILE 58 HG13 ILE 58 -3.445 0.889 0.674
428 HG21 ILE 58 HG21 ILE 58 -4.893 -1.493 1.463
429 HG22 ILE 58 HG22 ILE 58 -5.715 -0.917 2.885
430 HG23 ILE 58 HG23 ILE 58 -5.573 0.138 1.448
431 HD11 ILE 58 HD11 ILE 58 -1.455 1.795 1.300
432 HD12 ILE 58 HD12 ILE 58 -1.221 0.645 2.630
433 HD13 ILE 58 HD13 ILE 58 -0.803 0.201 0.954
434 H TRP 59 H TRP 59 -5.786 2.087 2.319
435 HA TRP 59 HA TRP 59 -4.441 3.914 0.649
436 HB2 TRP 59 HB2 TRP 59 -6.766 2.827 0.444
437 HB3 TRP 59 HB3 TRP 59 -7.346 4.167 1.431
438 HD1 TRP 59 HD1 TRP 59 -5.253 3.594 -1.790
439 HE1 TRP 59 HE1 TRP 59 -5.762 5.499 -3.461
440 HE3 TRP 59 HE3 TRP 59 -8.107 6.466 1.186
441 HZ2 TRP 59 HZ2 TRP 59 -7.281 7.980 -3.468
442 HZ3 TRP 59 HZ3 TRP 59 -8.884 8.743 0.445
443 HH2 TRP 59 HH2 TRP 59 -8.513 9.455 -1.893
444 H LYS 60 H LYS 60 -6.083 4.419 3.832
445 HA LYS 60 HA LYS 60 -5.551 7.200 3.936
446 HB2 LYS 60 HB2 LYS 60 -7.158 6.062 5.393
447 HB3 LYS 60 HB3 LYS 60 -5.861 5.116 6.129
448 HG2 LYS 60 HG2 LYS 60 -6.604 6.875 7.598
449 HG3 LYS 60 HG3 LYS 60 -4.927 7.159 7.134
450 HD2 LYS 60 HD2 LYS 60 -5.585 8.877 5.532
451 HD3 LYS 60 HD3 LYS 60 -7.299 8.517 5.758
452 HE2 LYS 60 HE2 LYS 60 -5.425 9.466 7.967
453 HE3 LYS 60 HE3 LYS 60 -6.424 10.553 6.998
454 HZ1 LYS 60 HZ1 LYS 60 -7.521 8.361 8.631
455 HZ2 LYS 60 HZ2 LYS 60 -8.376 9.503 7.800
456 HZ3 LYS 60 HZ3 LYS 60 -7.446 9.921 9.112
457 H GLY 61 H GLY 61 -3.488 4.405 4.941
458 HA2 GLY 61 HA2 GLY 61 -1.507 5.926 6.253
459 HA3 GLY 61 HA3 GLY 61 -1.218 4.387 5.402
460 H ILE 62 H ILE 62 -1.612 4.916 2.800
461 HA ILE 62 HA ILE 62 0.800 6.372 2.218
462 HB ILE 62 HB ILE 62 0.014 4.398 1.144
463 HG12 ILE 62 HG12 ILE 62 0.714 5.068 -1.235
464 HG13 ILE 62 HG13 ILE 62 0.781 6.722 -0.638
465 HG21 ILE 62 HG21 ILE 62 -1.992 6.107 -0.354
466 HG22 ILE 62 HG22 ILE 62 -1.529 4.489 -0.850
467 HG23 ILE 62 HG23 ILE 62 -2.315 4.728 0.718
468 HD11 ILE 62 HD11 ILE 62 2.992 5.564 -0.663
469 HD12 ILE 62 HD12 ILE 62 2.552 6.109 0.961
470 HD13 ILE 62 HD13 ILE 62 2.373 4.393 0.526
471 H LEU 63 H LEU 63 -2.641 7.147 1.750
472 HA LEU 63 HA LEU 63 -2.172 9.620 0.370
473 HB2 LEU 63 HB2 LEU 63 -4.482 8.502 1.944
474 HB3 LEU 63 HB3 LEU 63 -4.414 10.241 1.807
475 HG LEU 63 HG LEU 63 -5.821 9.198 0.089
476 HD11 LEU 63 HD11 LEU 63 -4.770 11.430 -0.270
477 HD12 LEU 63 HD12 LEU 63 -5.079 10.533 -1.780
478 HD13 LEU 63 HD13 LEU 63 -3.440 10.626 -1.136
479 HD21 LEU 63 HD21 LEU 63 -3.227 8.117 -1.084
480 HD22 LEU 63 HD22 LEU 63 -4.807 8.099 -1.862
481 HD23 LEU 63 HD23 LEU 63 -4.542 7.150 -0.393
482 H ASP 64 H ASP 64 -2.039 8.669 3.732
483 HA ASP 64 HA ASP 64 -1.969 11.383 4.792
484 HB2 ASP 64 HB2 ASP 64 -1.127 8.743 6.023
485 HB3 ASP 64 HB3 ASP 64 -0.875 10.296 6.786
486 H HIS 65 H HIS 65 0.416 9.038 3.775
487 HA HIS 65 HA HIS 65 2.770 10.435 4.703
488 HB2 HIS 65 HB2 HIS 65 2.712 8.011 4.275
489 HB3 HIS 65 HB3 HIS 65 2.406 8.283 2.578
490 HD1 HIS 65 HD1 HIS 65 5.225 10.030 4.719
491 HD2 HIS 65 HD2 HIS 65 4.500 7.663 1.275
492 HE1 HIS 65 HE1 HIS 65 7.456 9.716 3.575
493 H ARG 66 H ARG 66 1.286 10.042 1.454
494 HA ARG 66 HA ARG 66 3.152 11.806 0.187
495 HB2 ARG 66 HB2 ARG 66 1.696 11.661 -1.765
496 HB3 ARG 66 HB3 ARG 66 1.885 10.072 -1.027
497 HG2 ARG 66 HG2 ARG 66 -0.381 9.959 -1.182
498 HG3 ARG 66 HG3 ARG 66 -0.341 10.885 0.280
499 HD2 ARG 66 HD2 ARG 66 -1.799 12.161 -0.887
500 HD3 ARG 66 HD3 ARG 66 -0.302 12.974 -1.315
501 HE ARG 66 HE ARG 66 -1.352 10.739 -2.984
502 HH11 ARG 66 HH11 ARG 66 0.182 13.958 -3.062
503 HH12 ARG 66 HH12 ARG 66 0.227 13.888 -4.808
504 HH21 ARG 66 HH21 ARG 66 -1.594 10.960 -5.178
505 HH22 ARG 66 HH22 ARG 66 -0.762 12.271 -5.980
506 H GLN 67 H GLN 67 0.111 12.354 2.002
507 HA GLN 67 HA GLN 67 0.043 15.103 0.979
508 HB2 GLN 67 HB2 GLN 67 -1.826 15.505 2.117
509 HB3 GLN 67 HB3 GLN 67 -1.943 13.781 1.777
510 HG2 GLN 67 HG2 GLN 67 -1.461 13.267 4.096
511 HG3 GLN 67 HG3 GLN 67 -1.071 14.934 4.454
512 HE21 GLN 67 HE21 GLN 67 -2.628 15.443 5.966
513 HE22 GLN 67 HE22 GLN 67 -4.355 15.428 5.595
514 H LEU 68 H LEU 68 1.453 13.472 3.662
515 HA LEU 68 HA LEU 68 2.088 15.781 5.295
516 HB2 LEU 68 HB2 LEU 68 3.000 12.903 5.187
517 HB3 LEU 68 HB3 LEU 68 4.001 14.045 6.055
518 HG LEU 68 HG LEU 68 1.041 13.670 6.674
519 HD11 LEU 68 HD11 LEU 68 1.910 12.358 8.631
520 HD12 LEU 68 HD12 LEU 68 3.538 12.413 7.904
521 HD13 LEU 68 HD13 LEU 68 2.224 11.596 7.070
522 HD21 LEU 68 HD21 LEU 68 1.743 15.803 7.453
523 HD22 LEU 68 HD22 LEU 68 3.310 15.215 7.981
524 HD23 LEU 68 HD23 LEU 68 1.815 14.739 8.846
525 H HIS 69 H HIS 69 3.999 13.920 2.838
526 HA HIS 69 HA HIS 69 6.226 15.754 3.188
527 HB2 HIS 69 HB2 HIS 69 5.733 13.134 1.847
528 HB3 HIS 69 HB3 HIS 69 6.950 14.155 1.125
529 HD1 HIS 69 HD1 HIS 69 6.790 14.584 4.873
530 HD2 HIS 69 HD2 HIS 69 8.825 12.318 1.960
531 HE1 HIS 69 HE1 HIS 69 8.804 13.576 6.038
532 H ASP 70 H ASP 70 7.258 16.182 0.728
533 HA ASP 70 HA ASP 70 5.295 17.860 -0.725
534 HB2 ASP 70 HB2 ASP 70 6.523 19.159 1.018
535 HB3 ASP 70 HB3 ASP 70 8.038 18.683 0.281
Start of MODEL 4
1 H1 GLY 1 H GLY 1 13.128 -16.045 10.744
2 HA2 GLY 1 HA2 GLY 1 14.926 -13.732 11.193
3 HA3 GLY 1 HA3 GLY 1 15.010 -14.798 9.778
4 HA PRO 2 HA PRO 2 11.533 -11.446 9.509
5 HB2 PRO 2 HB2 PRO 2 12.885 -9.217 8.525
6 HB3 PRO 2 HB3 PRO 2 12.516 -9.525 10.244
7 HG2 PRO 2 HG2 PRO 2 15.067 -10.011 8.784
8 HG3 PRO 2 HG3 PRO 2 14.823 -9.317 10.419
9 HD2 PRO 2 HD2 PRO 2 15.546 -11.917 9.996
10 HD3 PRO 2 HD3 PRO 2 14.505 -11.423 11.361
11 H LEU 3 H LEU 3 10.966 -10.201 7.388
12 HA LEU 3 HA LEU 3 11.734 -11.880 5.031
13 HB2 LEU 3 HB2 LEU 3 9.235 -10.212 5.459
14 HB3 LEU 3 HB3 LEU 3 9.534 -11.330 4.139
15 HG LEU 3 HG LEU 3 9.053 -12.044 7.062
16 HD11 LEU 3 HD11 LEU 3 7.064 -11.306 5.790
17 HD12 LEU 3 HD12 LEU 3 6.974 -13.005 6.239
18 HD13 LEU 3 HD13 LEU 3 7.372 -12.556 4.566
19 HD21 LEU 3 HD21 LEU 3 9.494 -13.936 4.714
20 HD22 LEU 3 HD22 LEU 3 9.047 -14.391 6.370
21 HD23 LEU 3 HD23 LEU 3 10.625 -13.654 6.055
22 H GLY 4 H GLY 4 11.313 -10.476 2.889
23 HA2 GLY 4 HA2 GLY 4 11.241 -7.866 2.471
24 HA3 GLY 4 HA3 GLY 4 12.778 -7.896 3.310
25 H SER 5 H SER 5 11.398 -10.033 0.675
26 HA SER 5 HA SER 5 13.888 -10.353 -0.597
27 HB2 SER 5 HB2 SER 5 11.476 -11.495 -0.919
28 HB3 SER 5 HB3 SER 5 11.399 -10.367 -2.278
29 HG SER 5 HG SER 5 13.479 -11.250 -2.922
30 H THR 6 H THR 6 11.189 -8.181 -1.656
31 HA THR 6 HA THR 6 13.079 -6.523 -3.203
32 HB THR 6 HB THR 6 10.054 -6.357 -2.934
33 HG1 THR 6 HG1 THR 6 11.590 -8.019 -4.660
34 HG21 THR 6 HG21 THR 6 11.163 -4.452 -4.075
35 HG22 THR 6 HG22 THR 6 10.091 -5.372 -5.136
36 HG23 THR 6 HG23 THR 6 11.861 -5.582 -5.256
37 H ASP 7 H ASP 7 13.574 -4.374 -2.477
38 HA ASP 7 HA ASP 7 12.856 -3.725 0.283
39 HB2 ASP 7 HB2 ASP 7 15.070 -3.114 -0.416
40 HB3 ASP 7 HB3 ASP 7 14.437 -2.151 -1.763
41 H CYS 8 H CYS 8 12.436 -2.175 -2.917
42 HA CYS 8 HA CYS 8 10.431 -0.310 -2.013
43 HB2 CYS 8 HB2 CYS 8 11.216 -1.047 -4.859
44 HB3 CYS 8 HB3 CYS 8 10.416 0.428 -4.283
45 HG CYS 8 HG CYS 8 12.408 1.117 -2.631
46 H SER 9 H SER 9 8.928 -1.777 -1.042
47 HA SER 9 HA SER 9 6.806 -2.617 -2.844
48 HB2 SER 9 HB2 SER 9 8.341 -4.529 -2.924
49 HB3 SER 9 HB3 SER 9 8.454 -4.573 -1.172
50 HG SER 9 HG SER 9 7.075 -6.154 -2.044
51 H ILE 10 H ILE 10 4.841 -2.988 -1.564
52 HA ILE 10 HA ILE 10 4.460 -1.232 0.584
53 HB ILE 10 HB ILE 10 2.751 -3.651 -0.144
54 HG12 ILE 10 HG12 ILE 10 2.353 -0.814 -1.146
55 HG13 ILE 10 HG13 ILE 10 3.176 -2.080 -2.019
56 HG21 ILE 10 HG21 ILE 10 2.054 -1.121 1.380
57 HG22 ILE 10 HG22 ILE 10 0.866 -2.315 0.812
58 HG23 ILE 10 HG23 ILE 10 2.063 -2.801 1.979
59 HD11 ILE 10 HD11 ILE 10 0.248 -2.006 -1.260
60 HD12 ILE 10 HD12 ILE 10 0.955 -2.191 -2.863
61 HD13 ILE 10 HD13 ILE 10 1.056 -3.515 -1.693
62 H VAL 11 H VAL 11 5.660 -4.474 0.552
63 HA VAL 11 HA VAL 11 4.920 -5.413 3.090
64 HB VAL 11 HB VAL 11 7.011 -6.626 3.195
65 HG11 VAL 11 HG11 VAL 11 5.082 -7.425 1.772
66 HG12 VAL 11 HG12 VAL 11 5.844 -6.669 0.363
67 HG13 VAL 11 HG13 VAL 11 6.654 -8.007 1.197
68 HG21 VAL 11 HG21 VAL 11 7.904 -4.980 0.833
69 HG22 VAL 11 HG22 VAL 11 8.725 -5.289 2.378
70 HG23 VAL 11 HG23 VAL 11 8.581 -6.577 1.205
71 H SER 12 H SER 12 7.656 -3.292 2.422
72 HA SER 12 HA SER 12 8.564 -2.930 5.119
73 HB2 SER 12 HB2 SER 12 10.045 -2.440 3.345
74 HB3 SER 12 HB3 SER 12 8.857 -1.460 2.474
75 HG SER 12 HG SER 12 10.638 -0.420 3.631
76 H PHE 13 H PHE 13 6.267 -1.173 3.064
77 HA PHE 13 HA PHE 13 5.804 1.027 4.841
78 HB2 PHE 13 HB2 PHE 13 5.221 0.894 2.405
79 HB3 PHE 13 HB3 PHE 13 3.902 -0.199 2.798
80 HD1 PHE 13 HD1 PHE 13 1.753 0.739 3.046
81 HD2 PHE 13 HD2 PHE 13 5.246 3.181 3.741
82 HE1 PHE 13 HE1 PHE 13 0.294 2.738 3.350
83 HE2 PHE 13 HE2 PHE 13 3.805 5.156 4.010
84 HZ PHE 13 HZ PHE 13 1.344 4.943 3.906
85 H PHE 14 H PHE 14 4.131 -2.071 4.363
86 HA PHE 14 HA PHE 14 2.202 -1.759 6.449
87 HB2 PHE 14 HB2 PHE 14 3.306 -4.062 4.824
88 HB3 PHE 14 HB3 PHE 14 2.259 -4.372 6.177
89 HD1 PHE 14 HD1 PHE 14 0.977 -5.486 4.251
90 HD2 PHE 14 HD2 PHE 14 1.358 -1.203 4.572
91 HE1 PHE 14 HE1 PHE 14 -0.924 -5.191 2.691
92 HE2 PHE 14 HE2 PHE 14 -0.550 -0.907 3.064
93 HZ PHE 14 HZ PHE 14 -1.699 -2.928 2.126
94 H ALA 15 H ALA 15 5.523 -3.033 6.431
95 HA ALA 15 HA ALA 15 5.454 -4.065 9.097
96 HB1 ALA 15 HB1 ALA 15 7.270 -4.507 7.424
97 HB2 ALA 15 HB2 ALA 15 7.864 -2.849 7.668
98 HB3 ALA 15 HB3 ALA 15 7.874 -3.999 9.016
99 H ARG 16 H ARG 16 5.946 -0.757 7.785
100 HA ARG 16 HA ARG 16 6.662 0.361 10.371
101 HB2 ARG 16 HB2 ARG 16 5.650 1.674 7.806
102 HB3 ARG 16 HB3 ARG 16 6.096 2.569 9.239
103 HG2 ARG 16 HG2 ARG 16 8.154 0.702 8.044
104 HG3 ARG 16 HG3 ARG 16 7.769 2.203 7.208
105 HD2 ARG 16 HD2 ARG 16 9.667 2.595 8.634
106 HD3 ARG 16 HD3 ARG 16 8.288 3.518 9.228
107 HE ARG 16 HE ARG 16 7.965 1.879 11.006
108 HH11 ARG 16 HH11 ARG 16 11.232 1.841 9.549
109 HH12 ARG 16 HH12 ARG 16 11.855 0.821 10.790
110 HH21 ARG 16 HH21 ARG 16 8.782 0.546 12.507
111 HH22 ARG 16 HH22 ARG 16 10.444 -0.013 12.469
112 H LEU 17 H LEU 17 3.654 0.293 8.419
113 HA LEU 17 HA LEU 17 1.992 1.666 10.275
114 HB2 LEU 17 HB2 LEU 17 1.259 -0.509 8.274
115 HB3 LEU 17 HB3 LEU 17 0.085 0.491 9.112
116 HG LEU 17 HG LEU 17 2.120 1.413 7.096
117 HD11 LEU 17 HD11 LEU 17 0.230 0.113 6.167
118 HD12 LEU 17 HD12 LEU 17 0.200 1.805 5.637
119 HD13 LEU 17 HD13 LEU 17 -0.904 1.265 6.911
120 HD21 LEU 17 HD21 LEU 17 1.674 3.277 8.669
121 HD22 LEU 17 HD22 LEU 17 -0.079 3.044 8.467
122 HD23 LEU 17 HD23 LEU 17 0.909 3.607 7.111
123 H GLY 18 H GLY 18 2.794 -1.818 10.058
124 HA2 GLY 18 HA2 GLY 18 2.839 -3.166 12.017
125 HA3 GLY 18 HA3 GLY 18 1.420 -2.310 12.650
126 H CYS 19 H CYS 19 1.393 -3.025 9.205
127 HA CYS 19 HA CYS 19 -0.867 -4.838 9.680
128 HB2 CYS 19 HB2 CYS 19 0.322 -4.195 6.971
129 HB3 CYS 19 HB3 CYS 19 -1.329 -4.664 7.358
130 HG CYS 19 HG CYS 19 -1.187 -2.119 6.530
131 H SER 20 H SER 20 -0.158 -6.902 10.383
132 HA SER 20 HA SER 20 2.309 -7.978 9.274
133 HB2 SER 20 HB2 SER 20 0.409 -9.260 11.241
134 HB3 SER 20 HB3 SER 20 2.090 -9.705 10.878
135 HG SER 20 HG SER 20 2.107 -8.422 12.676
136 H SER 21 H SER 21 -0.723 -9.949 9.630
137 HA SER 21 HA SER 21 -0.086 -11.612 7.513
138 HB2 SER 21 HB2 SER 21 -2.838 -11.778 7.726
139 HB3 SER 21 HB3 SER 21 -1.648 -12.661 8.683
140 HG SER 21 HG SER 21 -2.808 -11.752 10.217
141 H CYS 22 H CYS 22 -1.482 -8.397 7.259
142 HA CYS 22 HA CYS 22 -2.767 -8.800 4.750
143 HB2 CYS 22 HB2 CYS 22 -1.502 -6.165 5.531
144 HB3 CYS 22 HB3 CYS 22 -3.011 -6.488 4.665
145 HG CYS 22 HG CYS 22 -4.150 -7.705 6.834
146 H LEU 23 H LEU 23 0.662 -8.156 5.607
147 HA LEU 23 HA LEU 23 1.351 -7.479 2.886
148 HB2 LEU 23 HB2 LEU 23 3.495 -7.170 3.587
149 HB3 LEU 23 HB3 LEU 23 2.575 -6.773 5.016
150 HG LEU 23 HG LEU 23 3.098 -9.353 5.624
151 HD11 LEU 23 HD11 LEU 23 5.501 -8.534 3.928
152 HD12 LEU 23 HD12 LEU 23 4.357 -9.819 3.520
153 HD13 LEU 23 HD13 LEU 23 5.352 -9.988 4.954
154 HD21 LEU 23 HD21 LEU 23 5.012 -7.001 5.957
155 HD22 LEU 23 HD22 LEU 23 5.005 -8.502 6.933
156 HD23 LEU 23 HD23 LEU 23 3.636 -7.407 6.990
157 H ASP 24 H ASP 24 1.197 -10.444 4.842
158 HA ASP 24 HA ASP 24 2.578 -12.190 3.064
159 HB2 ASP 24 HB2 ASP 24 2.121 -12.874 5.314
160 HB3 ASP 24 HB3 ASP 24 0.394 -12.611 5.137
161 H TYR 25 H TYR 25 -0.858 -11.279 3.339
162 HA TYR 25 HA TYR 25 -1.857 -12.895 1.228
163 HB2 TYR 25 HB2 TYR 25 -2.782 -10.107 2.047
164 HB3 TYR 25 HB3 TYR 25 -3.735 -11.293 1.191
165 HD1 TYR 25 HD1 TYR 25 -4.688 -9.856 3.527
166 HD2 TYR 25 HD2 TYR 25 -2.474 -13.571 3.371
167 HE1 TYR 25 HE1 TYR 25 -5.747 -10.570 5.629
168 HE2 TYR 25 HE2 TYR 25 -3.535 -14.279 5.483
169 HH TYR 25 HH TYR 25 -6.295 -12.667 6.751
170 H PHE 26 H PHE 26 -0.670 -9.480 1.226
171 HA PHE 26 HA PHE 26 -0.941 -9.080 -1.536
172 HB2 PHE 26 HB2 PHE 26 0.458 -7.758 0.719
173 HB3 PHE 26 HB3 PHE 26 1.247 -7.559 -0.803
174 HD1 PHE 26 HD1 PHE 26 0.265 -6.014 -2.604
175 HD2 PHE 26 HD2 PHE 26 -1.907 -6.992 1.022
176 HE1 PHE 26 HE1 PHE 26 -1.173 -4.157 -3.015
177 HE2 PHE 26 HE2 PHE 26 -3.417 -5.122 0.577
178 HZ PHE 26 HZ PHE 26 -3.072 -3.655 -1.438
179 H THR 27 H THR 27 2.087 -10.162 0.260
180 HA THR 27 HA THR 27 3.616 -10.257 -2.084
181 HB THR 27 HB THR 27 5.134 -11.828 -0.874
182 HG1 THR 27 HG1 THR 27 4.311 -12.151 1.452
183 HG21 THR 27 HG21 THR 27 5.398 -9.481 -0.358
184 HG22 THR 27 HG22 THR 27 5.674 -10.455 1.094
185 HG23 THR 27 HG23 THR 27 4.169 -9.556 0.913
186 H THR 28 H THR 28 1.433 -12.834 -0.834
187 HA THR 28 HA THR 28 2.209 -14.658 -2.901
188 HB THR 28 HB THR 28 -0.267 -14.454 -1.148
189 HG1 THR 28 HG1 THR 28 0.961 -15.631 0.132
190 HG21 THR 28 HG21 THR 28 0.598 -16.684 -3.061
191 HG22 THR 28 HG22 THR 28 -0.925 -15.773 -3.118
192 HG23 THR 28 HG23 THR 28 -0.609 -16.878 -1.777
193 H GLN 29 H GLN 29 -0.338 -12.004 -2.903
194 HA GLN 29 HA GLN 29 -1.316 -12.809 -5.470
195 HB2 GLN 29 HB2 GLN 29 -1.399 -10.164 -3.982
196 HB3 GLN 29 HB3 GLN 29 -2.332 -10.524 -5.434
197 HG2 GLN 29 HG2 GLN 29 -2.600 -12.200 -2.919
198 HG3 GLN 29 HG3 GLN 29 -3.477 -10.694 -3.144
199 HE21 GLN 29 HE21 GLN 29 -5.251 -12.307 -2.801
200 HE22 GLN 29 HE22 GLN 29 -5.974 -13.123 -4.150
201 H GLY 30 H GLY 30 1.651 -11.333 -4.567
202 HA2 GLY 30 HA2 GLY 30 3.438 -10.544 -5.785
203 HA3 GLY 30 HA3 GLY 30 2.665 -11.247 -7.212
204 H LEU 31 H LEU 31 1.124 -8.762 -5.268
205 HA LEU 31 HA LEU 31 1.616 -6.732 -7.403
206 HB2 LEU 31 HB2 LEU 31 -0.726 -5.964 -7.109
207 HB3 LEU 31 HB3 LEU 31 -0.397 -7.390 -8.081
208 HG LEU 31 HG LEU 31 -1.077 -8.600 -5.764
209 HD11 LEU 31 HD11 LEU 31 -2.904 -7.437 -4.659
210 HD12 LEU 31 HD12 LEU 31 -2.822 -6.108 -5.846
211 HD13 LEU 31 HD13 LEU 31 -1.515 -6.328 -4.687
212 HD21 LEU 31 HD21 LEU 31 -3.359 -8.844 -6.645
213 HD22 LEU 31 HD22 LEU 31 -2.061 -9.212 -7.784
214 HD23 LEU 31 HD23 LEU 31 -2.936 -7.670 -7.929
215 H THR 32 H THR 32 2.803 -7.128 -4.674
216 HA THR 32 HA THR 32 1.808 -4.729 -3.284
217 HB THR 32 HB THR 32 2.372 -6.248 -1.732
218 HG1 THR 32 HG1 THR 32 4.984 -5.306 -1.840
219 HG21 THR 32 HG21 THR 32 4.809 -7.199 -3.277
220 HG22 THR 32 HG22 THR 32 3.291 -8.091 -3.007
221 HG23 THR 32 HG23 THR 32 4.355 -7.738 -1.647
222 H THR 33 H THR 33 2.399 -2.731 -3.924
223 HA THR 33 HA THR 33 5.163 -2.215 -4.437
224 HB THR 33 HB THR 33 4.850 -2.692 -6.594
225 HG1 THR 33 HG1 THR 33 5.011 -0.936 -7.503
226 HG21 THR 33 HG21 THR 33 2.642 -2.620 -7.908
227 HG22 THR 33 HG22 THR 33 1.781 -2.324 -6.365
228 HG23 THR 33 HG23 THR 33 2.713 -3.790 -6.645
229 H ILE 34 H ILE 34 5.583 -0.032 -4.222
230 HA ILE 34 HA ILE 34 3.605 1.412 -2.630
231 HB ILE 34 HB ILE 34 6.232 2.655 -3.468
232 HG12 ILE 34 HG12 ILE 34 5.807 0.422 -1.471
233 HG13 ILE 34 HG13 ILE 34 7.064 0.626 -2.710
234 HG21 ILE 34 HG21 ILE 34 4.680 2.899 -0.860
235 HG22 ILE 34 HG22 ILE 34 5.969 3.936 -1.471
236 HG23 ILE 34 HG23 ILE 34 4.393 3.952 -2.250
237 HD11 ILE 34 HD11 ILE 34 8.047 0.885 -0.524
238 HD12 ILE 34 HD12 ILE 34 8.059 2.463 -1.338
239 HD13 ILE 34 HD13 ILE 34 6.862 2.114 -0.057
240 H TYR 35 H TYR 35 5.336 2.166 -5.633
241 HA TYR 35 HA TYR 35 4.144 4.542 -6.341
242 HB2 TYR 35 HB2 TYR 35 4.903 2.551 -8.451
243 HB3 TYR 35 HB3 TYR 35 5.239 4.262 -8.368
244 HD1 TYR 35 HD1 TYR 35 6.992 1.664 -8.974
245 HD2 TYR 35 HD2 TYR 35 6.624 4.290 -5.554
246 HE1 TYR 35 HE1 TYR 35 9.268 1.054 -8.256
247 HE2 TYR 35 HE2 TYR 35 8.841 3.565 -4.765
248 HH TYR 35 HH TYR 35 11.082 1.800 -6.884
249 H GLN 36 H GLN 36 2.900 1.359 -6.561
250 HA GLN 36 HA GLN 36 0.901 2.038 -8.660
251 HB2 GLN 36 HB2 GLN 36 1.401 -0.419 -6.985
252 HB3 GLN 36 HB3 GLN 36 0.010 -0.273 -8.031
253 HG2 GLN 36 HG2 GLN 36 2.887 -0.385 -8.917
254 HG3 GLN 36 HG3 GLN 36 1.556 -1.480 -9.323
255 HE21 GLN 36 HE21 GLN 36 3.231 1.433 -10.183
256 HE22 GLN 36 HE22 GLN 36 2.301 1.777 -11.613
257 H ILE 37 H ILE 37 0.716 1.150 -5.120
258 HA ILE 37 HA ILE 37 -2.032 1.824 -5.005
259 HB ILE 37 HB ILE 37 -1.791 1.880 -2.596
260 HG12 ILE 37 HG12 ILE 37 1.184 1.466 -3.014
261 HG13 ILE 37 HG13 ILE 37 0.459 3.002 -2.529
262 HG21 ILE 37 HG21 ILE 37 -1.206 -0.438 -2.301
263 HG22 ILE 37 HG22 ILE 37 -2.064 -0.234 -3.823
264 HG23 ILE 37 HG23 ILE 37 -0.302 -0.456 -3.833
265 HD11 ILE 37 HD11 ILE 37 1.287 1.922 -0.601
266 HD12 ILE 37 HD12 ILE 37 -0.486 1.853 -0.511
267 HD13 ILE 37 HD13 ILE 37 0.453 0.409 -0.982
268 H GLU 38 H GLU 38 0.808 3.925 -5.036
269 HA GLU 38 HA GLU 38 -0.372 6.262 -3.946
270 HB2 GLU 38 HB2 GLU 38 1.801 5.741 -6.007
271 HB3 GLU 38 HB3 GLU 38 1.332 7.383 -5.573
272 HG2 GLU 38 HG2 GLU 38 2.021 7.120 -3.307
273 HG3 GLU 38 HG3 GLU 38 2.218 5.378 -3.475
274 H HIS 39 H HIS 39 -0.803 4.715 -7.116
275 HA HIS 39 HA HIS 39 -2.386 7.063 -8.043
276 HB2 HIS 39 HB2 HIS 39 -0.312 6.365 -9.308
277 HB3 HIS 39 HB3 HIS 39 -1.151 4.868 -9.720
278 HD1 HIS 39 HD1 HIS 39 -1.068 5.569 -12.340
279 HD2 HIS 39 HD2 HIS 39 -3.092 8.200 -9.750
280 HE1 HIS 39 HE1 HIS 39 -2.402 7.112 -13.822
281 H TYR 40 H TYR 40 -2.578 3.712 -7.196
282 HA TYR 40 HA TYR 40 -5.090 3.174 -8.566
283 HB2 TYR 40 HB2 TYR 40 -3.496 1.665 -6.457
284 HB3 TYR 40 HB3 TYR 40 -5.102 1.177 -6.945
285 HD1 TYR 40 HD1 TYR 40 -2.024 -0.240 -7.292
286 HD2 TYR 40 HD2 TYR 40 -5.136 1.499 -9.863
287 HE1 TYR 40 HE1 TYR 40 -1.401 -1.687 -9.119
288 HE2 TYR 40 HE2 TYR 40 -4.388 0.056 -11.685
289 HH TYR 40 HH TYR 40 -1.659 -2.249 -11.351
290 H SER 41 H SER 41 -6.973 4.036 -7.928
291 HA SER 41 HA SER 41 -7.281 5.356 -5.379
292 HB2 SER 41 HB2 SER 41 -9.398 4.527 -7.415
293 HB3 SER 41 HB3 SER 41 -9.523 5.824 -6.215
294 HG SER 41 HG SER 41 -7.510 6.641 -7.364
295 H MET 42 H MET 42 -9.110 4.793 -3.861
296 HA MET 42 HA MET 42 -8.808 2.245 -2.792
297 HB2 MET 42 HB2 MET 42 -10.835 2.737 -1.440
298 HB3 MET 42 HB3 MET 42 -9.579 3.966 -1.387
299 HG2 MET 42 HG2 MET 42 -10.869 5.408 -2.841
300 HG3 MET 42 HG3 MET 42 -12.099 4.162 -3.085
301 HE1 MET 42 HE1 MET 42 -14.375 4.650 -1.880
302 HE2 MET 42 HE2 MET 42 -13.600 3.193 -1.232
303 HE3 MET 42 HE3 MET 42 -14.387 4.350 -0.131
304 H ASP 43 H ASP 43 -10.976 3.195 -5.378
305 HA ASP 43 HA ASP 43 -12.847 1.108 -5.356
306 HB2 ASP 43 HB2 ASP 43 -11.569 2.710 -7.630
307 HB3 ASP 43 HB3 ASP 43 -12.926 1.606 -7.844
308 H ASP 44 H ASP 44 -9.618 1.393 -6.884
309 HA ASP 44 HA ASP 44 -9.641 -1.138 -8.216
310 HB2 ASP 44 HB2 ASP 44 -7.734 1.082 -7.820
311 HB3 ASP 44 HB3 ASP 44 -6.944 -0.496 -7.741
312 H LEU 45 H LEU 45 -8.416 -0.014 -5.076
313 HA LEU 45 HA LEU 45 -7.168 -2.481 -4.320
314 HB2 LEU 45 HB2 LEU 45 -8.395 -0.287 -2.609
315 HB3 LEU 45 HB3 LEU 45 -7.620 -1.746 -1.979
316 HG LEU 45 HG LEU 45 -5.483 -1.111 -3.043
317 HD11 LEU 45 HD11 LEU 45 -6.283 0.497 -4.801
318 HD12 LEU 45 HD12 LEU 45 -5.071 1.204 -3.739
319 HD13 LEU 45 HD13 LEU 45 -6.772 1.618 -3.512
320 HD21 LEU 45 HD21 LEU 45 -6.729 0.927 -1.132
321 HD22 LEU 45 HD22 LEU 45 -4.991 0.671 -1.375
322 HD23 LEU 45 HD23 LEU 45 -5.979 -0.634 -0.699
323 H ALA 46 H ALA 46 -10.562 -1.289 -3.971
324 HA ALA 46 HA ALA 46 -11.507 -3.628 -2.594
325 HB1 ALA 46 HB1 ALA 46 -12.768 -1.526 -2.626
326 HB2 ALA 46 HB2 ALA 46 -13.024 -1.663 -4.372
327 HB3 ALA 46 HB3 ALA 46 -13.752 -2.854 -3.274
328 H SER 47 H SER 47 -11.127 -2.822 -6.084
329 HA SER 47 HA SER 47 -12.367 -5.207 -7.066
330 HB2 SER 47 HB2 SER 47 -10.342 -3.311 -8.331
331 HB3 SER 47 HB3 SER 47 -11.152 -4.631 -9.177
332 HG SER 47 HG SER 47 -12.214 -2.557 -9.374
333 H LEU 48 H LEU 48 -9.248 -4.628 -5.634
334 HA LEU 48 HA LEU 48 -8.134 -7.191 -6.600
335 HB2 LEU 48 HB2 LEU 48 -7.037 -4.951 -4.879
336 HB3 LEU 48 HB3 LEU 48 -6.145 -6.430 -5.225
337 HG LEU 48 HG LEU 48 -7.242 -4.720 -7.492
338 HD11 LEU 48 HD11 LEU 48 -4.470 -4.436 -6.268
339 HD12 LEU 48 HD12 LEU 48 -5.828 -3.312 -6.002
340 HD13 LEU 48 HD13 LEU 48 -5.172 -3.532 -7.621
341 HD21 LEU 48 HD21 LEU 48 -6.504 -6.994 -8.095
342 HD22 LEU 48 HD22 LEU 48 -4.938 -6.700 -7.314
343 HD23 LEU 48 HD23 LEU 48 -5.403 -5.780 -8.756
344 H LYS 49 H LYS 49 -10.530 -6.844 -4.761
345 HA LYS 49 HA LYS 49 -11.599 -7.947 -3.171
346 HB2 LYS 49 HB2 LYS 49 -9.275 -9.879 -3.481
347 HB3 LYS 49 HB3 LYS 49 -10.544 -10.178 -2.321
348 HG2 LYS 49 HG2 LYS 49 -11.250 -9.549 -5.203
349 HG3 LYS 49 HG3 LYS 49 -10.763 -11.177 -4.728
350 HD2 LYS 49 HD2 LYS 49 -12.956 -9.712 -3.241
351 HD3 LYS 49 HD3 LYS 49 -13.294 -10.625 -4.728
352 HE2 LYS 49 HE2 LYS 49 -12.544 -12.697 -3.792
353 HE3 LYS 49 HE3 LYS 49 -11.770 -11.889 -2.422
354 HZ1 LYS 49 HZ1 LYS 49 -13.830 -12.893 -1.743
355 HZ2 LYS 49 HZ2 LYS 49 -14.681 -12.078 -2.863
356 HZ3 LYS 49 HZ3 LYS 49 -13.944 -11.256 -1.624
357 H ILE 50 H ILE 50 -9.387 -5.904 -2.439
358 HA ILE 50 HA ILE 50 -8.736 -6.641 0.290
359 HB ILE 50 HB ILE 50 -8.674 -3.857 -0.908
360 HG12 ILE 50 HG12 ILE 50 -7.339 -5.409 -2.374
361 HG13 ILE 50 HG13 ILE 50 -6.349 -4.235 -1.534
362 HG21 ILE 50 HG21 ILE 50 -7.077 -5.187 1.307
363 HG22 ILE 50 HG22 ILE 50 -6.919 -3.494 0.785
364 HG23 ILE 50 HG23 ILE 50 -8.394 -4.096 1.588
365 HD11 ILE 50 HD11 ILE 50 -5.418 -6.574 -1.619
366 HD12 ILE 50 HD12 ILE 50 -5.549 -5.909 0.012
367 HD13 ILE 50 HD13 ILE 50 -6.738 -7.099 -0.562
368 HA PRO 51 HA PRO 51 -12.936 -5.629 1.652
369 HB2 PRO 51 HB2 PRO 51 -12.738 -6.162 4.317
370 HB3 PRO 51 HB3 PRO 51 -12.753 -7.453 3.075
371 HG2 PRO 51 HG2 PRO 51 -10.338 -6.219 4.427
372 HG3 PRO 51 HG3 PRO 51 -10.715 -7.953 4.201
373 HD2 PRO 51 HD2 PRO 51 -9.061 -6.590 2.498
374 HD3 PRO 51 HD3 PRO 51 -10.167 -7.855 1.892
375 H GLU 52 H GLU 52 -13.857 -3.793 2.256
376 HA GLU 52 HA GLU 52 -12.696 -1.386 2.300
377 HB2 GLU 52 HB2 GLU 52 -15.076 -1.437 4.045
378 HB3 GLU 52 HB3 GLU 52 -14.659 -0.443 2.680
379 HG2 GLU 52 HG2 GLU 52 -16.539 -1.643 1.975
380 HG3 GLU 52 HG3 GLU 52 -15.200 -2.480 1.185
381 H GLN 53 H GLN 53 -13.344 -3.214 5.328
382 HA GLN 53 HA GLN 53 -12.634 -1.277 7.164
383 HB2 GLN 53 HB2 GLN 53 -12.085 -3.117 8.702
384 HB3 GLN 53 HB3 GLN 53 -13.650 -3.264 7.916
385 HG2 GLN 53 HG2 GLN 53 -12.865 -5.045 6.472
386 HG3 GLN 53 HG3 GLN 53 -11.211 -4.874 7.079
387 HE21 GLN 53 HE21 GLN 53 -12.467 -7.434 7.233
388 HE22 GLN 53 HE22 GLN 53 -12.672 -7.738 8.941
389 H PHE 54 H PHE 54 -10.396 -3.629 5.635
390 HA PHE 54 HA PHE 54 -8.092 -2.281 6.852
391 HB2 PHE 54 HB2 PHE 54 -7.907 -4.567 6.870
392 HB3 PHE 54 HB3 PHE 54 -8.585 -4.776 5.256
393 HD1 PHE 54 HD1 PHE 54 -7.275 -4.914 3.393
394 HD2 PHE 54 HD2 PHE 54 -5.565 -3.377 7.033
395 HE1 PHE 54 HE1 PHE 54 -4.992 -4.978 2.354
396 HE2 PHE 54 HE2 PHE 54 -3.321 -3.362 5.987
397 HZ PHE 54 HZ PHE 54 -3.045 -4.177 3.642
398 H ARG 55 H ARG 55 -9.515 -2.698 3.597
399 HA ARG 55 HA ARG 55 -7.639 -1.566 1.941
400 HB2 ARG 55 HB2 ARG 55 -9.806 -2.639 1.366
401 HB3 ARG 55 HB3 ARG 55 -10.660 -1.200 1.883
402 HG2 ARG 55 HG2 ARG 55 -8.507 -0.930 -0.178
403 HG3 ARG 55 HG3 ARG 55 -10.022 -1.689 -0.681
404 HD2 ARG 55 HD2 ARG 55 -9.778 1.083 0.550
405 HD3 ARG 55 HD3 ARG 55 -9.899 0.732 -1.163
406 HE ARG 55 HE ARG 55 -12.121 -0.327 -0.703
407 HH11 ARG 55 HH11 ARG 55 -10.959 2.411 1.247
408 HH12 ARG 55 HH12 ARG 55 -12.514 2.915 1.744
409 HH21 ARG 55 HH21 ARG 55 -14.218 0.337 -0.079
410 HH22 ARG 55 HH22 ARG 55 -14.412 1.669 1.018
411 H HIS 56 H HIS 56 -10.012 0.142 4.028
412 HA HIS 56 HA HIS 56 -9.420 2.770 3.086
413 HB2 HIS 56 HB2 HIS 56 -11.418 2.289 4.352
414 HB3 HIS 56 HB3 HIS 56 -10.481 1.630 5.702
415 HD1 HIS 56 HD1 HIS 56 -11.141 5.062 4.025
416 HD2 HIS 56 HD2 HIS 56 -9.758 3.270 7.589
417 HE1 HIS 56 HE1 HIS 56 -10.874 6.943 5.713
418 H ALA 57 H ALA 57 -7.822 0.722 5.624
419 HA ALA 57 HA ALA 57 -6.264 2.850 6.704
420 HB1 ALA 57 HB1 ALA 57 -5.163 1.132 7.919
421 HB2 ALA 57 HB2 ALA 57 -6.864 0.661 7.826
422 HB3 ALA 57 HB3 ALA 57 -5.663 -0.131 6.773
423 H ILE 58 H ILE 58 -5.545 0.337 4.175
424 HA ILE 58 HA ILE 58 -2.798 1.141 3.883
425 HB ILE 58 HB ILE 58 -3.284 -0.966 3.067
426 HG12 ILE 58 HG12 ILE 58 -3.240 0.861 0.604
427 HG13 ILE 58 HG13 ILE 58 -1.837 0.335 1.534
428 HG21 ILE 58 HG21 ILE 58 -5.562 0.004 1.376
429 HG22 ILE 58 HG22 ILE 58 -4.985 -1.660 1.479
430 HG23 ILE 58 HG23 ILE 58 -5.696 -0.931 2.892
431 HD11 ILE 58 HD11 ILE 58 -1.661 -1.191 -0.140
432 HD12 ILE 58 HD12 ILE 58 -2.935 -2.086 0.710
433 HD13 ILE 58 HD13 ILE 58 -3.358 -1.014 -0.617
434 H TRP 59 H TRP 59 -5.765 2.009 2.160
435 HA TRP 59 HA TRP 59 -4.506 3.768 0.346
436 HB2 TRP 59 HB2 TRP 59 -6.904 2.702 0.342
437 HB3 TRP 59 HB3 TRP 59 -7.382 4.171 1.187
438 HD1 TRP 59 HD1 TRP 59 -5.437 3.107 -1.957
439 HE1 TRP 59 HE1 TRP 59 -5.666 4.807 -3.805
440 HE3 TRP 59 HE3 TRP 59 -8.163 6.489 0.594
441 HZ2 TRP 59 HZ2 TRP 59 -6.824 7.493 -4.080
442 HZ3 TRP 59 HZ3 TRP 59 -8.797 8.688 -0.432
443 HH2 TRP 59 HH2 TRP 59 -8.087 9.208 -2.765
444 H LYS 60 H LYS 60 -6.354 4.588 3.337
445 HA LYS 60 HA LYS 60 -5.801 7.333 3.294
446 HB2 LYS 60 HB2 LYS 60 -7.474 6.219 4.733
447 HB3 LYS 60 HB3 LYS 60 -6.164 5.436 5.645
448 HG2 LYS 60 HG2 LYS 60 -5.392 7.646 6.453
449 HG3 LYS 60 HG3 LYS 60 -6.628 8.428 5.447
450 HD2 LYS 60 HD2 LYS 60 -7.390 8.342 7.750
451 HD3 LYS 60 HD3 LYS 60 -8.402 7.309 6.736
452 HE2 LYS 60 HE2 LYS 60 -6.888 5.340 7.495
453 HE3 LYS 60 HE3 LYS 60 -6.175 6.463 8.643
454 HZ1 LYS 60 HZ1 LYS 60 -8.560 6.793 9.424
455 HZ2 LYS 60 HZ2 LYS 60 -7.859 5.350 9.787
456 HZ3 LYS 60 HZ3 LYS 60 -8.957 5.495 8.550
457 H GLY 61 H GLY 61 -3.877 4.646 4.802
458 HA2 GLY 61 HA2 GLY 61 -1.994 6.180 6.139
459 HA3 GLY 61 HA3 GLY 61 -1.696 4.577 5.436
460 H ILE 62 H ILE 62 -1.824 4.979 2.735
461 HA ILE 62 HA ILE 62 0.693 6.350 2.331
462 HB ILE 62 HB ILE 62 -0.312 4.235 1.375
463 HG12 ILE 62 HG12 ILE 62 1.961 4.797 0.980
464 HG13 ILE 62 HG13 ILE 62 1.263 4.250 -0.531
465 HG21 ILE 62 HG21 ILE 62 -1.252 6.038 -0.849
466 HG22 ILE 62 HG22 ILE 62 -1.053 4.290 -0.948
467 HG23 ILE 62 HG23 ILE 62 -2.242 4.952 0.166
468 HD11 ILE 62 HD11 ILE 62 2.643 6.071 -1.076
469 HD12 ILE 62 HD12 ILE 62 0.994 6.720 -1.172
470 HD13 ILE 62 HD13 ILE 62 2.030 7.074 0.236
471 H LEU 63 H LEU 63 -2.718 7.100 1.467
472 HA LEU 63 HA LEU 63 -1.962 9.377 -0.128
473 HB2 LEU 63 HB2 LEU 63 -4.505 8.461 1.190
474 HB3 LEU 63 HB3 LEU 63 -4.381 10.161 0.812
475 HG LEU 63 HG LEU 63 -5.506 8.903 -0.946
476 HD11 LEU 63 HD11 LEU 63 -4.417 9.900 -2.841
477 HD12 LEU 63 HD12 LEU 63 -2.881 10.025 -1.987
478 HD13 LEU 63 HD13 LEU 63 -4.258 11.012 -1.455
479 HD21 LEU 63 HD21 LEU 63 -4.299 7.443 -2.498
480 HD22 LEU 63 HD22 LEU 63 -4.268 6.765 -0.863
481 HD23 LEU 63 HD23 LEU 63 -2.828 7.578 -1.533
482 H ASP 64 H ASP 64 -2.337 8.855 3.299
483 HA ASP 64 HA ASP 64 -2.155 11.736 3.958
484 HB2 ASP 64 HB2 ASP 64 -2.222 9.256 5.672
485 HB3 ASP 64 HB3 ASP 64 -1.596 10.753 6.322
486 H HIS 65 H HIS 65 0.051 9.032 3.637
487 HA HIS 65 HA HIS 65 2.382 10.234 4.774
488 HB2 HIS 65 HB2 HIS 65 2.331 7.813 4.351
489 HB3 HIS 65 HB3 HIS 65 2.122 8.080 2.627
490 HD1 HIS 65 HD1 HIS 65 4.807 9.687 4.930
491 HD2 HIS 65 HD2 HIS 65 4.300 7.316 1.478
492 HE1 HIS 65 HE1 HIS 65 7.149 9.232 4.015
493 H ARG 66 H ARG 66 1.373 9.851 1.338
494 HA ARG 66 HA ARG 66 3.405 11.613 0.378
495 HB2 ARG 66 HB2 ARG 66 2.257 11.555 -1.762
496 HB3 ARG 66 HB3 ARG 66 2.291 9.950 -1.026
497 HG2 ARG 66 HG2 ARG 66 0.113 9.907 -1.629
498 HG3 ARG 66 HG3 ARG 66 -0.080 10.681 -0.096
499 HD2 ARG 66 HD2 ARG 66 -1.398 12.000 -1.414
500 HD3 ARG 66 HD3 ARG 66 0.100 12.944 -1.432
501 HE ARG 66 HE ARG 66 0.474 11.397 -3.600
502 HH11 ARG 66 HH11 ARG 66 -2.287 13.394 -2.661
503 HH12 ARG 66 HH12 ARG 66 -2.977 13.459 -4.259
504 HH21 ARG 66 HH21 ARG 66 -0.458 11.407 -5.696
505 HH22 ARG 66 HH22 ARG 66 -1.860 12.353 -6.028
506 H GLN 67 H GLN 67 0.136 12.288 1.755
507 HA GLN 67 HA GLN 67 0.073 14.966 0.679
508 HB2 GLN 67 HB2 GLN 67 -1.953 13.893 1.436
509 HB3 GLN 67 HB3 GLN 67 -1.266 13.602 3.038
510 HG2 GLN 67 HG2 GLN 67 -2.848 15.334 3.202
511 HG3 GLN 67 HG3 GLN 67 -1.259 16.018 3.489
512 HE21 GLN 67 HE21 GLN 67 -0.387 17.552 1.876
513 HE22 GLN 67 HE22 GLN 67 -1.502 18.296 0.734
514 H LEU 68 H LEU 68 1.633 13.467 3.533
515 HA LEU 68 HA LEU 68 2.449 16.136 4.510
516 HB2 LEU 68 HB2 LEU 68 2.712 13.353 5.669
517 HB3 LEU 68 HB3 LEU 68 3.218 14.840 6.480
518 HG LEU 68 HG LEU 68 0.331 14.259 5.640
519 HD11 LEU 68 HD11 LEU 68 1.090 12.686 7.355
520 HD12 LEU 68 HD12 LEU 68 -0.059 13.850 8.031
521 HD13 LEU 68 HD13 LEU 68 1.682 14.040 8.349
522 HD21 LEU 68 HD21 LEU 68 -0.261 16.096 7.135
523 HD22 LEU 68 HD22 LEU 68 0.774 16.668 5.829
524 HD23 LEU 68 HD23 LEU 68 1.459 16.417 7.456
525 H HIS 69 H HIS 69 3.959 13.498 2.667
526 HA HIS 69 HA HIS 69 6.601 14.780 2.945
527 HB2 HIS 69 HB2 HIS 69 5.679 11.906 3.066
528 HB3 HIS 69 HB3 HIS 69 7.135 12.287 2.211
529 HD1 HIS 69 HD1 HIS 69 6.016 11.568 5.674
530 HD2 HIS 69 HD2 HIS 69 9.105 13.691 3.725
531 HE1 HIS 69 HE1 HIS 69 7.910 11.840 7.358
532 H ASP 70 H ASP 70 6.396 16.062 1.229
533 HA ASP 70 HA ASP 70 5.089 15.589 -1.226
534 HB2 ASP 70 HB2 ASP 70 7.086 17.537 -0.147
535 HB3 ASP 70 HB3 ASP 70 7.087 17.333 -1.888
Start of MODEL 5
1 H1 GLY 1 H GLY 1 19.245 -18.562 5.519
2 HA2 GLY 1 HA2 GLY 1 16.660 -17.192 5.028
3 HA3 GLY 1 HA3 GLY 1 18.200 -16.402 5.374
4 HA PRO 2 HA PRO 2 18.414 -17.882 0.854
5 HB2 PRO 2 HB2 PRO 2 16.200 -18.679 -0.458
6 HB3 PRO 2 HB3 PRO 2 17.054 -19.767 0.671
7 HG2 PRO 2 HG2 PRO 2 14.543 -18.144 1.168
8 HG3 PRO 2 HG3 PRO 2 14.885 -19.839 1.627
9 HD2 PRO 2 HD2 PRO 2 15.186 -17.630 3.323
10 HD3 PRO 2 HD3 PRO 2 16.049 -19.180 3.516
11 H LEU 3 H LEU 3 15.591 -15.956 1.863
12 HA LEU 3 HA LEU 3 15.965 -14.114 -0.467
13 HB2 LEU 3 HB2 LEU 3 13.472 -15.166 0.918
14 HB3 LEU 3 HB3 LEU 3 13.498 -13.539 0.263
15 HG LEU 3 HG LEU 3 14.272 -14.509 -1.952
16 HD11 LEU 3 HD11 LEU 3 14.936 -16.767 -1.367
17 HD12 LEU 3 HD12 LEU 3 13.521 -16.881 -2.396
18 HD13 LEU 3 HD13 LEU 3 13.340 -17.104 -0.652
19 HD21 LEU 3 HD21 LEU 3 11.523 -15.172 -0.872
20 HD22 LEU 3 HD22 LEU 3 11.924 -15.110 -2.591
21 HD23 LEU 3 HD23 LEU 3 12.029 -13.641 -1.620
22 H GLY 4 H GLY 4 15.624 -11.846 0.003
23 HA2 GLY 4 HA2 GLY 4 15.037 -10.663 2.444
24 HA3 GLY 4 HA3 GLY 4 16.767 -11.030 2.511
25 H SER 5 H SER 5 14.616 -9.923 -0.208
26 HA SER 5 HA SER 5 16.666 -8.025 -1.087
27 HB2 SER 5 HB2 SER 5 13.833 -8.684 -2.040
28 HB3 SER 5 HB3 SER 5 14.932 -7.542 -2.846
29 HG SER 5 HG SER 5 16.361 -9.144 -3.240
30 H THR 6 H THR 6 16.712 -5.863 -0.530
31 HA THR 6 HA THR 6 14.599 -4.830 1.243
32 HB THR 6 HB THR 6 16.289 -3.110 1.761
33 HG1 THR 6 HG1 THR 6 18.396 -3.401 0.965
34 HG21 THR 6 HG21 THR 6 16.204 -5.378 2.911
35 HG22 THR 6 HG22 THR 6 17.764 -4.541 3.003
36 HG23 THR 6 HG23 THR 6 17.536 -5.890 1.872
37 H ASP 7 H ASP 7 13.979 -5.129 -1.615
38 HA ASP 7 HA ASP 7 14.213 -2.598 -2.959
39 HB2 ASP 7 HB2 ASP 7 13.806 -4.907 -4.006
40 HB3 ASP 7 HB3 ASP 7 12.135 -4.761 -3.455
41 H CYS 8 H CYS 8 12.416 -1.105 -3.486
42 HA CYS 8 HA CYS 8 10.817 -0.561 -1.135
43 HB2 CYS 8 HB2 CYS 8 9.733 1.125 -2.987
44 HB3 CYS 8 HB3 CYS 8 11.148 1.500 -2.021
45 HG CYS 8 HG CYS 8 11.074 0.157 -5.063
46 H SER 9 H SER 9 8.804 -1.348 -0.672
47 HA SER 9 HA SER 9 6.807 -1.902 -2.658
48 HB2 SER 9 HB2 SER 9 8.422 -4.168 -1.419
49 HB3 SER 9 HB3 SER 9 6.753 -4.401 -1.956
50 HG SER 9 HG SER 9 8.630 -3.302 -3.729
51 H ILE 10 H ILE 10 4.839 -2.753 -1.577
52 HA ILE 10 HA ILE 10 4.081 -1.421 0.707
53 HB ILE 10 HB ILE 10 2.978 -4.058 -0.330
54 HG12 ILE 10 HG12 ILE 10 2.963 -2.243 -1.976
55 HG13 ILE 10 HG13 ILE 10 1.344 -2.767 -1.536
56 HG21 ILE 10 HG21 ILE 10 1.739 -2.188 1.659
57 HG22 ILE 10 HG22 ILE 10 0.808 -3.381 0.715
58 HG23 ILE 10 HG23 ILE 10 2.068 -3.919 1.820
59 HD11 ILE 10 HD11 ILE 10 1.214 -0.769 0.010
60 HD12 ILE 10 HD12 ILE 10 2.789 -0.232 -0.645
61 HD13 ILE 10 HD13 ILE 10 1.384 -0.408 -1.703
62 H VAL 11 H VAL 11 5.754 -4.455 0.532
63 HA VAL 11 HA VAL 11 5.209 -5.543 3.064
64 HB VAL 11 HB VAL 11 7.497 -6.426 3.077
65 HG11 VAL 11 HG11 VAL 11 6.152 -6.695 0.350
66 HG12 VAL 11 HG12 VAL 11 7.181 -7.892 1.153
67 HG13 VAL 11 HG13 VAL 11 5.595 -7.497 1.836
68 HG21 VAL 11 HG21 VAL 11 7.962 -4.753 0.593
69 HG22 VAL 11 HG22 VAL 11 8.952 -4.848 2.070
70 HG23 VAL 11 HG23 VAL 11 8.891 -6.211 0.969
71 H SER 12 H SER 12 7.686 -3.057 2.381
72 HA SER 12 HA SER 12 8.528 -2.813 5.084
73 HB2 SER 12 HB2 SER 12 9.686 -2.129 2.881
74 HB3 SER 12 HB3 SER 12 8.676 -0.675 2.925
75 HG SER 12 HG SER 12 10.511 -1.620 4.876
76 H PHE 13 H PHE 13 6.127 -1.089 3.140
77 HA PHE 13 HA PHE 13 5.530 0.985 5.031
78 HB2 PHE 13 HB2 PHE 13 5.009 1.197 2.681
79 HB3 PHE 13 HB3 PHE 13 4.025 -0.253 2.706
80 HD1 PHE 13 HD1 PHE 13 2.083 0.633 1.755
81 HD2 PHE 13 HD2 PHE 13 3.785 2.546 5.231
82 HE1 PHE 13 HE1 PHE 13 0.033 2.019 2.017
83 HE2 PHE 13 HE2 PHE 13 1.731 3.906 5.477
84 HZ PHE 13 HZ PHE 13 -0.180 3.543 3.911
85 H PHE 14 H PHE 14 3.993 -2.156 4.352
86 HA PHE 14 HA PHE 14 1.982 -2.010 6.354
87 HB2 PHE 14 HB2 PHE 14 3.226 -4.179 4.657
88 HB3 PHE 14 HB3 PHE 14 2.267 -4.633 6.036
89 HD1 PHE 14 HD1 PHE 14 0.779 -5.778 4.516
90 HD2 PHE 14 HD2 PHE 14 1.231 -1.499 4.317
91 HE1 PHE 14 HE1 PHE 14 -1.339 -5.599 3.225
92 HE2 PHE 14 HE2 PHE 14 -0.857 -1.324 3.085
93 HZ PHE 14 HZ PHE 14 -2.194 -3.388 2.552
94 H ALA 15 H ALA 15 5.297 -3.411 6.427
95 HA ALA 15 HA ALA 15 5.132 -4.464 9.036
96 HB1 ALA 15 HB1 ALA 15 7.596 -4.267 9.076
97 HB2 ALA 15 HB2 ALA 15 7.024 -4.921 7.530
98 HB3 ALA 15 HB3 ALA 15 7.550 -3.225 7.638
99 H ARG 16 H ARG 16 5.944 -1.107 7.949
100 HA ARG 16 HA ARG 16 6.437 -0.088 10.595
101 HB2 ARG 16 HB2 ARG 16 5.554 1.310 8.024
102 HB3 ARG 16 HB3 ARG 16 5.796 2.158 9.552
103 HG2 ARG 16 HG2 ARG 16 8.101 1.264 9.663
104 HG3 ARG 16 HG3 ARG 16 7.900 0.558 8.056
105 HD2 ARG 16 HD2 ARG 16 7.560 2.772 7.080
106 HD3 ARG 16 HD3 ARG 16 7.558 3.510 8.706
107 HE ARG 16 HE ARG 16 9.958 2.180 8.597
108 HH11 ARG 16 HH11 ARG 16 8.522 4.862 6.768
109 HH12 ARG 16 HH12 ARG 16 10.024 5.393 6.106
110 HH21 ARG 16 HH21 ARG 16 11.862 2.966 8.036
111 HH22 ARG 16 HH22 ARG 16 12.101 4.383 7.058
112 H LEU 17 H LEU 17 3.460 0.001 8.598
113 HA LEU 17 HA LEU 17 1.831 1.295 10.546
114 HB2 LEU 17 HB2 LEU 17 1.018 -0.769 8.448
115 HB3 LEU 17 HB3 LEU 17 -0.112 0.187 9.383
116 HG LEU 17 HG LEU 17 1.881 1.275 7.394
117 HD11 LEU 17 HD11 LEU 17 -0.235 1.834 6.076
118 HD12 LEU 17 HD12 LEU 17 -1.110 0.781 7.222
119 HD13 LEU 17 HD13 LEU 17 0.174 0.116 6.205
120 HD21 LEU 17 HD21 LEU 17 1.523 2.994 9.037
121 HD22 LEU 17 HD22 LEU 17 -0.206 2.683 9.101
122 HD23 LEU 17 HD23 LEU 17 0.528 3.422 7.652
123 H GLY 18 H GLY 18 2.528 -2.168 10.060
124 HA2 GLY 18 HA2 GLY 18 2.738 -3.612 11.958
125 HA3 GLY 18 HA3 GLY 18 1.328 -2.832 12.708
126 H CYS 19 H CYS 19 1.040 -3.240 9.269
127 HA CYS 19 HA CYS 19 -1.095 -5.231 9.727
128 HB2 CYS 19 HB2 CYS 19 0.009 -4.057 7.126
129 HB3 CYS 19 HB3 CYS 19 -1.533 -4.898 7.335
130 HG CYS 19 HG CYS 19 -0.912 -2.426 9.349
131 H SER 20 H SER 20 -0.102 -7.249 10.297
132 HA SER 20 HA SER 20 2.335 -8.007 8.885
133 HB2 SER 20 HB2 SER 20 2.015 -8.320 11.339
134 HB3 SER 20 HB3 SER 20 0.879 -9.631 10.974
135 HG SER 20 HG SER 20 2.792 -10.597 11.116
136 H SER 21 H SER 21 -0.640 -10.078 9.467
137 HA SER 21 HA SER 21 -0.162 -11.857 7.453
138 HB2 SER 21 HB2 SER 21 -2.967 -10.933 8.119
139 HB3 SER 21 HB3 SER 21 -2.386 -12.570 7.790
140 HG SER 21 HG SER 21 -2.075 -12.784 9.824
141 H CYS 22 H CYS 22 -1.561 -8.644 7.117
142 HA CYS 22 HA CYS 22 -2.685 -8.955 4.556
143 HB2 CYS 22 HB2 CYS 22 -1.457 -6.399 5.643
144 HB3 CYS 22 HB3 CYS 22 -2.873 -6.565 4.582
145 HG CYS 22 HG CYS 22 -4.482 -7.559 6.267
146 H LEU 23 H LEU 23 0.664 -8.440 5.570
147 HA LEU 23 HA LEU 23 1.579 -7.589 2.971
148 HB2 LEU 23 HB2 LEU 23 3.612 -7.295 3.886
149 HB3 LEU 23 HB3 LEU 23 2.634 -7.181 5.324
150 HG LEU 23 HG LEU 23 3.249 -9.788 5.563
151 HD11 LEU 23 HD11 LEU 23 5.618 -8.709 3.971
152 HD12 LEU 23 HD12 LEU 23 4.492 -9.955 3.394
153 HD13 LEU 23 HD13 LEU 23 5.521 -10.277 4.790
154 HD21 LEU 23 HD21 LEU 23 5.185 -9.123 6.930
155 HD22 LEU 23 HD22 LEU 23 3.824 -8.020 7.171
156 HD23 LEU 23 HD23 LEU 23 5.191 -7.521 6.159
157 H ASP 24 H ASP 24 1.254 -10.691 4.728
158 HA ASP 24 HA ASP 24 2.660 -12.324 2.846
159 HB2 ASP 24 HB2 ASP 24 2.099 -13.276 4.973
160 HB3 ASP 24 HB3 ASP 24 0.387 -12.956 4.759
161 H TYR 25 H TYR 25 -0.753 -11.319 3.106
162 HA TYR 25 HA TYR 25 -1.636 -12.682 0.792
163 HB2 TYR 25 HB2 TYR 25 -2.729 -10.028 1.734
164 HB3 TYR 25 HB3 TYR 25 -3.573 -11.253 0.802
165 HD1 TYR 25 HD1 TYR 25 -4.450 -9.857 3.374
166 HD2 TYR 25 HD2 TYR 25 -2.458 -13.638 2.733
167 HE1 TYR 25 HE1 TYR 25 -5.314 -10.684 5.545
168 HE2 TYR 25 HE2 TYR 25 -3.294 -14.447 4.894
169 HH TYR 25 HH TYR 25 -5.655 -12.678 6.803
170 H PHE 26 H PHE 26 -0.464 -9.265 1.123
171 HA PHE 26 HA PHE 26 -0.603 -8.552 -1.582
172 HB2 PHE 26 HB2 PHE 26 0.627 -7.604 0.925
173 HB3 PHE 26 HB3 PHE 26 1.613 -7.234 -0.431
174 HD1 PHE 26 HD1 PHE 26 0.685 -5.885 -2.349
175 HD2 PHE 26 HD2 PHE 26 -1.555 -6.564 1.244
176 HE1 PHE 26 HE1 PHE 26 -0.787 -3.990 -2.939
177 HE2 PHE 26 HE2 PHE 26 -3.097 -4.772 0.641
178 HZ PHE 26 HZ PHE 26 -2.708 -3.416 -1.444
179 H THR 27 H THR 27 2.131 -10.210 0.102
180 HA THR 27 HA THR 27 3.891 -9.982 -2.177
181 HB THR 27 HB THR 27 5.341 -11.535 -0.903
182 HG1 THR 27 HG1 THR 27 4.598 -12.004 1.262
183 HG21 THR 27 HG21 THR 27 4.213 -9.159 0.638
184 HG22 THR 27 HG22 THR 27 5.676 -9.253 -0.371
185 HG23 THR 27 HG23 THR 27 5.593 -10.101 1.181
186 H THR 28 H THR 28 1.699 -12.513 -0.968
187 HA THR 28 HA THR 28 2.581 -14.526 -2.834
188 HB THR 28 HB THR 28 -0.159 -14.338 -1.553
189 HG1 THR 28 HG1 THR 28 1.331 -14.076 0.096
190 HG21 THR 28 HG21 THR 28 1.638 -16.728 -2.244
191 HG22 THR 28 HG22 THR 28 0.247 -16.201 -3.215
192 HG23 THR 28 HG23 THR 28 -0.004 -16.801 -1.563
193 H GLN 29 H GLN 29 0.007 -12.024 -2.961
194 HA GLN 29 HA GLN 29 -0.913 -12.811 -5.557
195 HB2 GLN 29 HB2 GLN 29 -1.189 -10.234 -3.979
196 HB3 GLN 29 HB3 GLN 29 -2.066 -10.589 -5.484
197 HG2 GLN 29 HG2 GLN 29 -3.171 -12.512 -4.495
198 HG3 GLN 29 HG3 GLN 29 -2.231 -12.338 -3.015
199 HE21 GLN 29 HE21 GLN 29 -2.584 -10.583 -1.680
200 HE22 GLN 29 HE22 GLN 29 -4.089 -9.661 -1.611
201 H GLY 30 H GLY 30 1.910 -11.182 -4.640
202 HA2 GLY 30 HA2 GLY 30 3.686 -10.299 -5.793
203 HA3 GLY 30 HA3 GLY 30 2.974 -10.954 -7.267
204 H LEU 31 H LEU 31 1.236 -8.687 -5.282
205 HA LEU 31 HA LEU 31 1.602 -6.517 -7.291
206 HB2 LEU 31 HB2 LEU 31 -0.756 -5.880 -6.701
207 HB3 LEU 31 HB3 LEU 31 -0.490 -7.312 -7.679
208 HG LEU 31 HG LEU 31 -0.771 -8.722 -5.618
209 HD11 LEU 31 HD11 LEU 31 -1.676 -6.119 -4.362
210 HD12 LEU 31 HD12 LEU 31 -0.365 -7.204 -3.825
211 HD13 LEU 31 HD13 LEU 31 -2.046 -7.734 -3.710
212 HD21 LEU 31 HD21 LEU 31 -2.497 -8.560 -7.219
213 HD22 LEU 31 HD22 LEU 31 -3.036 -6.997 -6.554
214 HD23 LEU 31 HD23 LEU 31 -3.232 -8.507 -5.607
215 H THR 32 H THR 32 3.054 -7.063 -4.650
216 HA THR 32 HA THR 32 2.182 -4.677 -3.100
217 HB THR 32 HB THR 32 2.889 -6.434 -1.749
218 HG1 THR 32 HG1 THR 32 5.286 -5.955 -1.353
219 HG21 THR 32 HG21 THR 32 4.901 -7.794 -1.945
220 HG22 THR 32 HG22 THR 32 5.308 -6.983 -3.467
221 HG23 THR 32 HG23 THR 32 3.862 -8.017 -3.341
222 H THR 33 H THR 33 2.661 -2.668 -3.933
223 HA THR 33 HA THR 33 5.386 -2.100 -4.427
224 HB THR 33 HB THR 33 5.157 -2.490 -6.644
225 HG1 THR 33 HG1 THR 33 4.617 -0.804 -7.817
226 HG21 THR 33 HG21 THR 33 3.087 -3.773 -6.663
227 HG22 THR 33 HG22 THR 33 2.945 -2.613 -7.922
228 HG23 THR 33 HG23 THR 33 2.070 -2.343 -6.400
229 H ILE 34 H ILE 34 5.655 0.179 -4.225
230 HA ILE 34 HA ILE 34 3.550 1.431 -2.589
231 HB ILE 34 HB ILE 34 5.982 3.007 -3.402
232 HG12 ILE 34 HG12 ILE 34 6.904 0.805 -2.578
233 HG13 ILE 34 HG13 ILE 34 7.392 2.262 -1.745
234 HG21 ILE 34 HG21 ILE 34 5.577 3.945 -1.124
235 HG22 ILE 34 HG22 ILE 34 4.189 4.131 -2.192
236 HG23 ILE 34 HG23 ILE 34 4.188 2.871 -0.928
237 HD11 ILE 34 HD11 ILE 34 5.287 0.336 -0.701
238 HD12 ILE 34 HD12 ILE 34 6.992 0.458 -0.172
239 HD13 ILE 34 HD13 ILE 34 5.893 1.784 0.145
240 H TYR 35 H TYR 35 5.257 2.394 -5.541
241 HA TYR 35 HA TYR 35 3.875 4.717 -6.184
242 HB2 TYR 35 HB2 TYR 35 5.087 2.751 -8.138
243 HB3 TYR 35 HB3 TYR 35 4.994 4.500 -8.295
244 HD1 TYR 35 HD1 TYR 35 6.977 1.692 -7.176
245 HD2 TYR 35 HD2 TYR 35 6.338 5.906 -6.510
246 HE1 TYR 35 HE1 TYR 35 9.162 1.832 -6.045
247 HE2 TYR 35 HE2 TYR 35 8.532 6.057 -5.389
248 HH TYR 35 HH TYR 35 10.713 3.237 -4.988
249 H GLN 36 H GLN 36 2.834 1.503 -6.425
250 HA GLN 36 HA GLN 36 0.890 2.044 -8.619
251 HB2 GLN 36 HB2 GLN 36 1.655 -0.408 -7.050
252 HB3 GLN 36 HB3 GLN 36 0.203 -0.389 -8.034
253 HG2 GLN 36 HG2 GLN 36 2.930 0.349 -9.148
254 HG3 GLN 36 HG3 GLN 36 2.232 -1.261 -9.272
255 HE21 GLN 36 HE21 GLN 36 2.626 1.484 -11.093
256 HE22 GLN 36 HE22 GLN 36 1.348 1.172 -12.246
257 H ILE 37 H ILE 37 0.757 1.266 -5.047
258 HA ILE 37 HA ILE 37 -2.085 1.581 -4.948
259 HB ILE 37 HB ILE 37 -1.802 1.891 -2.534
260 HG12 ILE 37 HG12 ILE 37 1.154 1.454 -2.866
261 HG13 ILE 37 HG13 ILE 37 0.472 3.073 -2.748
262 HG21 ILE 37 HG21 ILE 37 -2.018 -0.337 -3.589
263 HG22 ILE 37 HG22 ILE 37 -0.249 -0.459 -3.713
264 HG23 ILE 37 HG23 ILE 37 -1.038 -0.413 -2.128
265 HD11 ILE 37 HD11 ILE 37 -0.000 1.004 -0.619
266 HD12 ILE 37 HD12 ILE 37 1.329 2.191 -0.628
267 HD13 ILE 37 HD13 ILE 37 -0.365 2.721 -0.572
268 H GLU 38 H GLU 38 0.481 3.894 -5.118
269 HA GLU 38 HA GLU 38 -0.724 6.174 -3.965
270 HB2 GLU 38 HB2 GLU 38 1.693 5.628 -4.689
271 HB3 GLU 38 HB3 GLU 38 1.186 6.014 -6.336
272 HG2 GLU 38 HG2 GLU 38 0.543 8.311 -5.512
273 HG3 GLU 38 HG3 GLU 38 1.215 7.880 -3.924
274 H HIS 39 H HIS 39 -1.157 4.528 -7.048
275 HA HIS 39 HA HIS 39 -3.003 6.627 -8.100
276 HB2 HIS 39 HB2 HIS 39 -1.069 4.664 -9.343
277 HB3 HIS 39 HB3 HIS 39 -2.466 5.207 -10.250
278 HD1 HIS 39 HD1 HIS 39 -0.797 6.326 -11.987
279 HD2 HIS 39 HD2 HIS 39 -0.813 7.917 -8.081
280 HE1 HIS 39 HE1 HIS 39 0.363 8.613 -12.130
281 H TYR 40 H TYR 40 -2.826 3.263 -7.048
282 HA TYR 40 HA TYR 40 -5.243 2.438 -8.467
283 HB2 TYR 40 HB2 TYR 40 -3.618 1.150 -6.243
284 HB3 TYR 40 HB3 TYR 40 -5.135 0.507 -6.787
285 HD1 TYR 40 HD1 TYR 40 -1.928 -0.575 -6.907
286 HD2 TYR 40 HD2 TYR 40 -5.012 0.693 -9.747
287 HE1 TYR 40 HE1 TYR 40 -1.166 -2.185 -8.525
288 HE2 TYR 40 HE2 TYR 40 -4.078 -0.844 -11.397
289 HH TYR 40 HH TYR 40 -2.513 -2.625 -11.807
290 H SER 41 H SER 41 -6.962 3.724 -7.971
291 HA SER 41 HA SER 41 -7.382 4.828 -5.343
292 HB2 SER 41 HB2 SER 41 -9.384 4.599 -7.651
293 HB3 SER 41 HB3 SER 41 -9.350 5.801 -6.356
294 HG SER 41 HG SER 41 -8.517 6.609 -8.355
295 H MET 42 H MET 42 -9.643 4.489 -4.307
296 HA MET 42 HA MET 42 -9.775 2.037 -3.173
297 HB2 MET 42 HB2 MET 42 -11.840 2.651 -2.223
298 HB3 MET 42 HB3 MET 42 -10.908 4.137 -2.451
299 HG2 MET 42 HG2 MET 42 -12.267 4.589 -4.516
300 HG3 MET 42 HG3 MET 42 -13.241 3.165 -4.127
301 HE1 MET 42 HE1 MET 42 -15.851 5.768 -3.249
302 HE2 MET 42 HE2 MET 42 -14.782 5.568 -4.657
303 HE3 MET 42 HE3 MET 42 -15.532 4.146 -3.903
304 H ASP 43 H ASP 43 -11.431 2.801 -6.229
305 HA ASP 43 HA ASP 43 -13.194 0.640 -6.383
306 HB2 ASP 43 HB2 ASP 43 -11.576 1.997 -8.597
307 HB3 ASP 43 HB3 ASP 43 -13.003 0.991 -8.839
308 H ASP 44 H ASP 44 -9.777 0.857 -7.520
309 HA ASP 44 HA ASP 44 -9.654 -1.856 -8.443
310 HB2 ASP 44 HB2 ASP 44 -7.568 0.275 -7.857
311 HB3 ASP 44 HB3 ASP 44 -7.090 -1.400 -8.187
312 H LEU 45 H LEU 45 -8.694 -0.279 -5.426
313 HA LEU 45 HA LEU 45 -7.411 -2.525 -4.203
314 HB2 LEU 45 HB2 LEU 45 -9.000 -0.451 -2.642
315 HB3 LEU 45 HB3 LEU 45 -7.632 -1.396 -2.077
316 HG LEU 45 HG LEU 45 -7.553 0.794 -4.165
317 HD11 LEU 45 HD11 LEU 45 -8.008 1.612 -1.930
318 HD12 LEU 45 HD12 LEU 45 -6.423 2.094 -2.499
319 HD13 LEU 45 HD13 LEU 45 -6.581 0.767 -1.299
320 HD21 LEU 45 HD21 LEU 45 -5.122 0.656 -4.095
321 HD22 LEU 45 HD22 LEU 45 -5.814 -0.847 -4.674
322 HD23 LEU 45 HD23 LEU 45 -5.219 -0.760 -3.012
323 H ALA 46 H ALA 46 -10.817 -1.394 -4.079
324 HA ALA 46 HA ALA 46 -11.732 -3.498 -2.421
325 HB1 ALA 46 HB1 ALA 46 -13.943 -2.837 -3.103
326 HB2 ALA 46 HB2 ALA 46 -12.961 -1.395 -2.811
327 HB3 ALA 46 HB3 ALA 46 -13.296 -1.905 -4.482
328 H SER 47 H SER 47 -11.581 -3.246 -6.021
329 HA SER 47 HA SER 47 -12.797 -5.753 -6.489
330 HB2 SER 47 HB2 SER 47 -12.144 -3.717 -8.079
331 HB3 SER 47 HB3 SER 47 -10.696 -4.680 -8.341
332 HG SER 47 HG SER 47 -12.121 -5.314 -9.844
333 H LEU 48 H LEU 48 -9.532 -4.951 -5.520
334 HA LEU 48 HA LEU 48 -8.328 -7.524 -6.147
335 HB2 LEU 48 HB2 LEU 48 -7.449 -5.097 -4.575
336 HB3 LEU 48 HB3 LEU 48 -6.477 -6.555 -4.617
337 HG LEU 48 HG LEU 48 -7.406 -5.224 -7.195
338 HD11 LEU 48 HD11 LEU 48 -5.359 -3.980 -7.261
339 HD12 LEU 48 HD12 LEU 48 -4.791 -4.713 -5.745
340 HD13 LEU 48 HD13 LEU 48 -6.172 -3.574 -5.762
341 HD21 LEU 48 HD21 LEU 48 -5.278 -6.343 -8.012
342 HD22 LEU 48 HD22 LEU 48 -6.562 -7.470 -7.503
343 HD23 LEU 48 HD23 LEU 48 -5.195 -7.158 -6.437
344 H LYS 49 H LYS 49 -10.766 -7.034 -4.239
345 HA LYS 49 HA LYS 49 -11.839 -8.138 -2.666
346 HB2 LYS 49 HB2 LYS 49 -9.429 -9.962 -2.510
347 HB3 LYS 49 HB3 LYS 49 -10.955 -10.254 -1.722
348 HG2 LYS 49 HG2 LYS 49 -10.846 -9.796 -4.742
349 HG3 LYS 49 HG3 LYS 49 -10.460 -11.365 -4.086
350 HD2 LYS 49 HD2 LYS 49 -13.004 -10.062 -3.124
351 HD3 LYS 49 HD3 LYS 49 -12.948 -10.640 -4.785
352 HE2 LYS 49 HE2 LYS 49 -13.827 -12.408 -3.371
353 HE3 LYS 49 HE3 LYS 49 -12.295 -12.886 -4.095
354 HZ1 LYS 49 HZ1 LYS 49 -12.433 -13.488 -1.777
355 HZ2 LYS 49 HZ2 LYS 49 -12.598 -11.930 -1.315
356 HZ3 LYS 49 HZ3 LYS 49 -11.193 -12.475 -2.026
357 H ILE 50 H ILE 50 -9.420 -6.194 -2.148
358 HA ILE 50 HA ILE 50 -8.804 -6.396 0.677
359 HB ILE 50 HB ILE 50 -8.852 -3.848 -0.965
360 HG12 ILE 50 HG12 ILE 50 -7.551 -5.607 -2.257
361 HG13 ILE 50 HG13 ILE 50 -6.622 -4.222 -1.749
362 HG21 ILE 50 HG21 ILE 50 -7.091 -3.187 0.576
363 HG22 ILE 50 HG22 ILE 50 -8.533 -3.704 1.475
364 HG23 ILE 50 HG23 ILE 50 -7.142 -4.794 1.328
365 HD11 ILE 50 HD11 ILE 50 -6.649 -6.869 -0.249
366 HD12 ILE 50 HD12 ILE 50 -5.455 -6.423 -1.492
367 HD13 ILE 50 HD13 ILE 50 -5.552 -5.491 0.017
368 HA PRO 51 HA PRO 51 -13.128 -5.211 1.420
369 HB2 PRO 51 HB2 PRO 51 -13.180 -5.320 4.162
370 HB3 PRO 51 HB3 PRO 51 -13.232 -6.748 3.091
371 HG2 PRO 51 HG2 PRO 51 -10.860 -5.600 4.571
372 HG3 PRO 51 HG3 PRO 51 -11.336 -7.318 4.409
373 HD2 PRO 51 HD2 PRO 51 -9.409 -6.119 2.841
374 HD3 PRO 51 HD3 PRO 51 -10.423 -7.476 2.270
375 H GLU 52 H GLU 52 -14.135 -3.266 1.997
376 HA GLU 52 HA GLU 52 -12.680 -0.912 1.987
377 HB2 GLU 52 HB2 GLU 52 -14.757 0.208 2.640
378 HB3 GLU 52 HB3 GLU 52 -14.969 -0.996 1.368
379 HG2 GLU 52 HG2 GLU 52 -15.808 -2.615 3.154
380 HG3 GLU 52 HG3 GLU 52 -15.720 -1.292 4.313
381 H GLN 53 H GLN 53 -13.731 -2.832 4.697
382 HA GLN 53 HA GLN 53 -13.149 -1.207 6.891
383 HB2 GLN 53 HB2 GLN 53 -12.931 -4.233 6.611
384 HB3 GLN 53 HB3 GLN 53 -13.083 -3.364 8.134
385 HG2 GLN 53 HG2 GLN 53 -15.228 -3.329 5.951
386 HG3 GLN 53 HG3 GLN 53 -15.188 -4.467 7.279
387 HE21 GLN 53 HE21 GLN 53 -15.120 -3.482 9.546
388 HE22 GLN 53 HE22 GLN 53 -16.078 -2.029 9.812
389 H PHE 54 H PHE 54 -10.870 -2.598 4.723
390 HA PHE 54 HA PHE 54 -8.616 -2.083 6.624
391 HB2 PHE 54 HB2 PHE 54 -8.788 -4.478 6.357
392 HB3 PHE 54 HB3 PHE 54 -8.906 -4.295 4.592
393 HD1 PHE 54 HD1 PHE 54 -7.068 -4.086 3.235
394 HD2 PHE 54 HD2 PHE 54 -6.564 -3.828 7.490
395 HE1 PHE 54 HE1 PHE 54 -4.582 -4.151 2.939
396 HE2 PHE 54 HE2 PHE 54 -4.110 -3.875 7.214
397 HZ PHE 54 HZ PHE 54 -3.103 -4.014 4.961
398 H ARG 55 H ARG 55 -9.727 -2.090 3.187
399 HA ARG 55 HA ARG 55 -7.437 -1.039 2.064
400 HB2 ARG 55 HB2 ARG 55 -8.613 -0.748 0.165
401 HB3 ARG 55 HB3 ARG 55 -9.629 -1.875 1.025
402 HG2 ARG 55 HG2 ARG 55 -11.230 -0.384 0.263
403 HG3 ARG 55 HG3 ARG 55 -10.886 0.325 1.850
404 HD2 ARG 55 HD2 ARG 55 -9.046 1.678 0.459
405 HD3 ARG 55 HD3 ARG 55 -10.062 1.230 -0.909
406 HE ARG 55 HE ARG 55 -11.906 2.288 0.784
407 HH11 ARG 55 HH11 ARG 55 -8.724 3.574 -0.361
408 HH12 ARG 55 HH12 ARG 55 -9.376 5.176 -0.481
409 HH21 ARG 55 HH21 ARG 55 -12.562 4.464 0.724
410 HH22 ARG 55 HH22 ARG 55 -11.496 5.662 0.048
411 H HIS 56 H HIS 56 -9.860 0.745 4.026
412 HA HIS 56 HA HIS 56 -8.909 3.370 3.355
413 HB2 HIS 56 HB2 HIS 56 -10.246 2.238 5.852
414 HB3 HIS 56 HB3 HIS 56 -9.759 3.916 5.726
415 HD1 HIS 56 HD1 HIS 56 -12.507 1.601 4.600
416 HD2 HIS 56 HD2 HIS 56 -11.251 5.597 4.355
417 HE1 HIS 56 HE1 HIS 56 -14.522 2.941 3.809
418 H ALA 57 H ALA 57 -7.621 0.845 5.566
419 HA ALA 57 HA ALA 57 -5.907 2.618 7.056
420 HB1 ALA 57 HB1 ALA 57 -4.825 0.612 7.851
421 HB2 ALA 57 HB2 ALA 57 -6.570 0.317 7.856
422 HB3 ALA 57 HB3 ALA 57 -5.555 -0.375 6.576
423 H ILE 58 H ILE 58 -5.267 0.346 4.308
424 HA ILE 58 HA ILE 58 -2.535 1.147 4.063
425 HB ILE 58 HB ILE 58 -3.051 -0.877 3.124
426 HG12 ILE 58 HG12 ILE 58 -2.950 1.023 0.723
427 HG13 ILE 58 HG13 ILE 58 -1.581 0.580 1.752
428 HG21 ILE 58 HG21 ILE 58 -5.281 0.186 1.387
429 HG22 ILE 58 HG22 ILE 58 -4.710 -1.481 1.508
430 HG23 ILE 58 HG23 ILE 58 -5.479 -0.759 2.897
431 HD11 ILE 58 HD11 ILE 58 -2.288 -1.903 1.016
432 HD12 ILE 58 HD12 ILE 58 -2.933 -1.010 -0.369
433 HD13 ILE 58 HD13 ILE 58 -1.216 -0.890 0.049
434 H TRP 59 H TRP 59 -5.433 2.170 2.228
435 HA TRP 59 HA TRP 59 -4.073 4.031 0.635
436 HB2 TRP 59 HB2 TRP 59 -6.458 3.016 0.431
437 HB3 TRP 59 HB3 TRP 59 -6.963 4.432 1.338
438 HD1 TRP 59 HD1 TRP 59 -4.881 3.551 -1.821
439 HE1 TRP 59 HE1 TRP 59 -5.295 5.261 -3.642
440 HE3 TRP 59 HE3 TRP 59 -7.763 6.855 0.838
441 HZ2 TRP 59 HZ2 TRP 59 -6.820 7.712 -3.971
442 HZ3 TRP 59 HZ3 TRP 59 -8.665 8.875 -0.262
443 HH2 TRP 59 HH2 TRP 59 -8.196 9.327 -2.669
444 H LYS 60 H LYS 60 -5.865 4.699 3.774
445 HA LYS 60 HA LYS 60 -5.256 7.468 3.662
446 HB2 LYS 60 HB2 LYS 60 -6.861 6.320 5.239
447 HB3 LYS 60 HB3 LYS 60 -5.495 5.809 6.224
448 HG2 LYS 60 HG2 LYS 60 -5.546 8.701 5.517
449 HG3 LYS 60 HG3 LYS 60 -6.930 8.217 6.466
450 HD2 LYS 60 HD2 LYS 60 -4.059 7.666 7.284
451 HD3 LYS 60 HD3 LYS 60 -4.888 9.155 7.694
452 HE2 LYS 60 HE2 LYS 60 -5.721 6.370 8.579
453 HE3 LYS 60 HE3 LYS 60 -4.878 7.569 9.563
454 HZ1 LYS 60 HZ1 LYS 60 -6.921 8.987 9.126
455 HZ2 LYS 60 HZ2 LYS 60 -7.087 7.731 10.169
456 HZ3 LYS 60 HZ3 LYS 60 -7.650 7.575 8.628
457 H GLY 61 H GLY 61 -3.351 4.685 4.854
458 HA2 GLY 61 HA2 GLY 61 -1.391 6.248 6.244
459 HA3 GLY 61 HA3 GLY 61 -1.092 4.655 5.538
460 H ILE 62 H ILE 62 -1.370 5.043 2.864
461 HA ILE 62 HA ILE 62 1.038 6.484 2.267
462 HB ILE 62 HB ILE 62 0.105 4.472 1.185
463 HG12 ILE 62 HG12 ILE 62 1.165 4.994 -1.094
464 HG13 ILE 62 HG13 ILE 62 1.268 6.672 -0.583
465 HG21 ILE 62 HG21 ILE 62 -1.399 6.377 -0.632
466 HG22 ILE 62 HG22 ILE 62 -1.139 4.678 -0.977
467 HG23 ILE 62 HG23 ILE 62 -2.090 5.128 0.441
468 HD11 ILE 62 HD11 ILE 62 2.811 6.023 1.255
469 HD12 ILE 62 HD12 ILE 62 2.608 4.310 0.803
470 HD13 ILE 62 HD13 ILE 62 3.395 5.453 -0.305
471 H LEU 63 H LEU 63 -2.378 7.270 1.576
472 HA LEU 63 HA LEU 63 -1.832 9.635 0.085
473 HB2 LEU 63 HB2 LEU 63 -4.193 8.581 1.624
474 HB3 LEU 63 HB3 LEU 63 -4.152 10.296 1.361
475 HG LEU 63 HG LEU 63 -5.431 9.017 -0.332
476 HD11 LEU 63 HD11 LEU 63 -4.524 11.325 -0.717
477 HD12 LEU 63 HD12 LEU 63 -4.778 10.366 -2.187
478 HD13 LEU 63 HD13 LEU 63 -3.137 10.586 -1.542
479 HD21 LEU 63 HD21 LEU 63 -4.277 7.901 -2.184
480 HD22 LEU 63 HD22 LEU 63 -3.933 7.069 -0.654
481 HD23 LEU 63 HD23 LEU 63 -2.718 8.132 -1.405
482 H ASP 64 H ASP 64 -1.896 8.920 3.505
483 HA ASP 64 HA ASP 64 -1.837 11.748 4.324
484 HB2 ASP 64 HB2 ASP 64 -2.675 9.975 5.822
485 HB3 ASP 64 HB3 ASP 64 -1.041 9.302 5.952
486 H HIS 65 H HIS 65 0.561 9.244 3.770
487 HA HIS 65 HA HIS 65 2.866 10.658 4.700
488 HB2 HIS 65 HB2 HIS 65 2.866 8.240 4.490
489 HB3 HIS 65 HB3 HIS 65 2.563 8.339 2.766
490 HD1 HIS 65 HD1 HIS 65 5.385 10.273 4.707
491 HD2 HIS 65 HD2 HIS 65 4.659 7.592 1.527
492 HE1 HIS 65 HE1 HIS 65 7.554 10.069 3.420
493 H ARG 66 H ARG 66 1.550 10.103 1.453
494 HA ARG 66 HA ARG 66 3.558 11.765 0.200
495 HB2 ARG 66 HB2 ARG 66 2.473 11.409 -1.872
496 HB3 ARG 66 HB3 ARG 66 2.436 9.912 -0.969
497 HG2 ARG 66 HG2 ARG 66 0.312 9.894 -1.809
498 HG3 ARG 66 HG3 ARG 66 0.030 10.660 -0.250
499 HD2 ARG 66 HD2 ARG 66 -1.226 11.812 -1.938
500 HD3 ARG 66 HD3 ARG 66 0.045 12.885 -1.337
501 HE ARG 66 HE ARG 66 1.216 11.676 -3.507
502 HH11 ARG 66 HH11 ARG 66 -1.827 13.515 -3.220
503 HH12 ARG 66 HH12 ARG 66 -1.682 14.213 -4.786
504 HH21 ARG 66 HH21 ARG 66 1.236 12.340 -5.620
505 HH22 ARG 66 HH22 ARG 66 0.068 13.460 -6.256
506 H GLN 67 H GLN 67 0.405 12.434 1.769
507 HA GLN 67 HA GLN 67 0.351 15.099 0.564
508 HB2 GLN 67 HB2 GLN 67 -1.699 13.914 1.133
509 HB3 GLN 67 HB3 GLN 67 -1.189 13.783 2.837
510 HG2 GLN 67 HG2 GLN 67 -2.877 15.488 2.472
511 HG3 GLN 67 HG3 GLN 67 -1.379 16.133 3.141
512 HE21 GLN 67 HE21 GLN 67 -0.382 17.763 2.044
513 HE22 GLN 67 HE22 GLN 67 -0.700 18.172 0.375
514 H LEU 68 H LEU 68 1.864 13.568 3.376
515 HA LEU 68 HA LEU 68 2.334 16.156 4.653
516 HB2 LEU 68 HB2 LEU 68 2.692 15.050 6.590
517 HB3 LEU 68 HB3 LEU 68 1.590 13.985 5.760
518 HG LEU 68 HG LEU 68 3.691 12.601 5.102
519 HD11 LEU 68 HD11 LEU 68 4.746 14.199 7.440
520 HD12 LEU 68 HD12 LEU 68 5.488 14.088 5.835
521 HD13 LEU 68 HD13 LEU 68 5.461 12.668 6.865
522 HD21 LEU 68 HD21 LEU 68 3.538 11.422 7.300
523 HD22 LEU 68 HD22 LEU 68 1.945 11.841 6.652
524 HD23 LEU 68 HD23 LEU 68 2.649 12.820 7.950
525 H HIS 69 H HIS 69 4.159 13.907 2.658
526 HA HIS 69 HA HIS 69 6.498 15.705 2.897
527 HB2 HIS 69 HB2 HIS 69 6.832 13.483 4.112
528 HB3 HIS 69 HB3 HIS 69 6.712 12.694 2.544
529 HD1 HIS 69 HD1 HIS 69 8.586 14.359 0.687
530 HD2 HIS 69 HD2 HIS 69 9.271 13.686 4.807
531 HE1 HIS 69 HE1 HIS 69 11.073 14.629 1.056
532 H ASP 70 H ASP 70 6.744 16.609 1.072
533 HA ASP 70 HA ASP 70 5.381 15.958 -1.359
534 HB2 ASP 70 HB2 ASP 70 7.814 17.768 -1.073
535 HB3 ASP 70 HB3 ASP 70 6.552 17.827 -2.310
Start of MODEL 6
1 H1 GLY 1 H GLY 1 9.685 -24.638 -2.522
2 HA2 GLY 1 HA2 GLY 1 8.098 -22.907 -3.287
3 HA3 GLY 1 HA3 GLY 1 8.751 -22.554 -1.671
4 HA PRO 2 HA PRO 2 9.521 -19.000 -4.690
5 HB2 PRO 2 HB2 PRO 2 8.328 -16.999 -3.195
6 HB3 PRO 2 HB3 PRO 2 7.460 -18.012 -4.380
7 HG2 PRO 2 HG2 PRO 2 7.647 -18.405 -1.378
8 HG3 PRO 2 HG3 PRO 2 6.178 -18.428 -2.412
9 HD2 PRO 2 HD2 PRO 2 7.393 -20.719 -1.666
10 HD3 PRO 2 HD3 PRO 2 6.755 -20.523 -3.328
11 H LEU 3 H LEU 3 10.933 -17.061 -4.276
12 HA LEU 3 HA LEU 3 12.211 -16.761 -1.713
13 HB2 LEU 3 HB2 LEU 3 13.459 -18.753 -2.434
14 HB3 LEU 3 HB3 LEU 3 13.793 -18.001 -4.002
15 HG LEU 3 HG LEU 3 15.081 -16.184 -2.770
16 HD11 LEU 3 HD11 LEU 3 14.618 -18.042 -0.399
17 HD12 LEU 3 HD12 LEU 3 14.106 -16.353 -0.534
18 HD13 LEU 3 HD13 LEU 3 15.823 -16.742 -0.436
19 HD21 LEU 3 HD21 LEU 3 17.057 -17.523 -2.367
20 HD22 LEU 3 HD22 LEU 3 16.219 -18.079 -3.819
21 HD23 LEU 3 HD23 LEU 3 16.089 -19.005 -2.288
22 H GLY 4 H GLY 4 12.347 -14.601 -1.684
23 HA2 GLY 4 HA2 GLY 4 13.918 -12.939 -3.033
24 HA3 GLY 4 HA3 GLY 4 12.563 -13.070 -4.177
25 H SER 5 H SER 5 13.452 -10.767 -2.652
26 HA SER 5 HA SER 5 10.889 -9.919 -1.553
27 HB2 SER 5 HB2 SER 5 12.111 -9.009 0.500
28 HB3 SER 5 HB3 SER 5 11.830 -10.754 0.469
29 HG SER 5 HG SER 5 13.993 -9.909 1.065
30 H THR 6 H THR 6 11.150 -7.468 -1.009
31 HA THR 6 HA THR 6 13.106 -6.134 -2.754
32 HB THR 6 HB THR 6 10.902 -4.648 -3.202
33 HG1 THR 6 HG1 THR 6 9.893 -7.291 -3.435
34 HG21 THR 6 HG21 THR 6 11.635 -7.111 -4.835
35 HG22 THR 6 HG22 THR 6 12.378 -5.500 -4.954
36 HG23 THR 6 HG23 THR 6 10.676 -5.724 -5.398
37 H ASP 7 H ASP 7 13.951 -4.413 -1.769
38 HA ASP 7 HA ASP 7 13.353 -3.948 1.048
39 HB2 ASP 7 HB2 ASP 7 15.372 -2.991 -0.953
40 HB3 ASP 7 HB3 ASP 7 15.009 -1.923 0.406
41 H CYS 8 H CYS 8 13.383 -1.659 -1.791
42 HA CYS 8 HA CYS 8 11.397 0.011 -0.420
43 HB2 CYS 8 HB2 CYS 8 13.202 1.012 -1.846
44 HB3 CYS 8 HB3 CYS 8 12.488 0.242 -3.277
45 HG CYS 8 HG CYS 8 11.933 2.918 -2.983
46 H SER 9 H SER 9 9.557 -1.321 -0.189
47 HA SER 9 HA SER 9 7.834 -1.704 -2.438
48 HB2 SER 9 HB2 SER 9 9.119 -3.672 -2.814
49 HB3 SER 9 HB3 SER 9 9.168 -4.083 -1.103
50 HG SER 9 HG SER 9 7.446 -4.810 -2.980
51 H ILE 10 H ILE 10 5.693 -2.605 -1.508
52 HA ILE 10 HA ILE 10 5.131 -1.106 0.856
53 HB ILE 10 HB ILE 10 3.467 -2.930 -0.855
54 HG12 ILE 10 HG12 ILE 10 3.969 -0.707 -1.609
55 HG13 ILE 10 HG13 ILE 10 2.243 -1.016 -1.375
56 HG21 ILE 10 HG21 ILE 10 2.601 -3.353 1.378
57 HG22 ILE 10 HG22 ILE 10 2.434 -1.625 1.657
58 HG23 ILE 10 HG23 ILE 10 1.446 -2.427 0.405
59 HD11 ILE 10 HD11 ILE 10 2.989 1.280 -0.653
60 HD12 ILE 10 HD12 ILE 10 2.289 0.376 0.691
61 HD13 ILE 10 HD13 ILE 10 4.044 0.595 0.550
62 H VAL 11 H VAL 11 6.409 -4.201 0.534
63 HA VAL 11 HA VAL 11 5.438 -5.405 2.951
64 HB VAL 11 HB VAL 11 7.829 -6.426 3.118
65 HG11 VAL 11 HG11 VAL 11 7.259 -8.023 1.382
66 HG12 VAL 11 HG12 VAL 11 5.812 -7.531 2.254
67 HG13 VAL 11 HG13 VAL 11 6.129 -6.865 0.633
68 HG21 VAL 11 HG21 VAL 11 8.031 -5.273 0.306
69 HG22 VAL 11 HG22 VAL 11 9.096 -4.853 1.673
70 HG23 VAL 11 HG23 VAL 11 9.087 -6.488 1.005
71 H SER 12 H SER 12 8.298 -3.273 2.569
72 HA SER 12 HA SER 12 8.933 -2.965 5.270
73 HB2 SER 12 HB2 SER 12 9.251 -1.024 2.939
74 HB3 SER 12 HB3 SER 12 10.256 -1.087 4.413
75 HG SER 12 HG SER 12 10.875 -2.281 2.257
76 H PHE 13 H PHE 13 6.654 -1.072 3.189
77 HA PHE 13 HA PHE 13 6.068 0.917 5.124
78 HB2 PHE 13 HB2 PHE 13 5.527 0.952 2.651
79 HB3 PHE 13 HB3 PHE 13 4.246 -0.212 2.951
80 HD1 PHE 13 HD1 PHE 13 2.073 0.706 3.064
81 HD2 PHE 13 HD2 PHE 13 5.433 3.058 4.358
82 HE1 PHE 13 HE1 PHE 13 0.562 2.684 3.320
83 HE2 PHE 13 HE2 PHE 13 3.958 5.059 4.519
84 HZ PHE 13 HZ PHE 13 1.539 4.861 4.059
85 H PHE 14 H PHE 14 4.536 -2.252 4.409
86 HA PHE 14 HA PHE 14 2.470 -2.001 6.346
87 HB2 PHE 14 HB2 PHE 14 3.568 -4.247 4.680
88 HB3 PHE 14 HB3 PHE 14 2.587 -4.644 6.079
89 HD1 PHE 14 HD1 PHE 14 0.623 -5.480 4.959
90 HD2 PHE 14 HD2 PHE 14 2.105 -1.539 4.011
91 HE1 PHE 14 HE1 PHE 14 -1.434 -4.988 3.705
92 HE2 PHE 14 HE2 PHE 14 0.094 -1.024 2.852
93 HZ PHE 14 HZ PHE 14 -1.735 -2.725 2.618
94 H ALA 15 H ALA 15 5.754 -3.373 6.542
95 HA ALA 15 HA ALA 15 5.529 -4.463 9.123
96 HB1 ALA 15 HB1 ALA 15 7.457 -4.795 7.581
97 HB2 ALA 15 HB2 ALA 15 7.972 -3.120 7.879
98 HB3 ALA 15 HB3 ALA 15 7.954 -4.301 9.201
99 H ARG 16 H ARG 16 6.327 -1.084 8.050
100 HA ARG 16 HA ARG 16 6.547 -0.108 10.770
101 HB2 ARG 16 HB2 ARG 16 6.137 1.329 8.098
102 HB3 ARG 16 HB3 ARG 16 6.391 2.133 9.651
103 HG2 ARG 16 HG2 ARG 16 8.519 0.695 9.872
104 HG3 ARG 16 HG3 ARG 16 8.318 0.296 8.171
105 HD2 ARG 16 HD2 ARG 16 9.827 2.139 8.231
106 HD3 ARG 16 HD3 ARG 16 8.289 2.770 7.650
107 HE ARG 16 HE ARG 16 7.908 3.862 9.731
108 HH11 ARG 16 HH11 ARG 16 10.984 2.111 9.836
109 HH12 ARG 16 HH12 ARG 16 11.610 3.037 11.173
110 HH21 ARG 16 HH21 ARG 16 8.703 5.058 11.406
111 HH22 ARG 16 HH22 ARG 16 10.348 4.869 11.974
112 H LEU 17 H LEU 17 3.891 -0.332 8.513
113 HA LEU 17 HA LEU 17 2.071 1.402 10.022
114 HB2 LEU 17 HB2 LEU 17 1.464 -0.821 8.019
115 HB3 LEU 17 HB3 LEU 17 0.222 0.126 8.827
116 HG LEU 17 HG LEU 17 2.229 1.164 6.827
117 HD11 LEU 17 HD11 LEU 17 -0.798 0.826 6.764
118 HD12 LEU 17 HD12 LEU 17 0.394 -0.154 5.875
119 HD13 LEU 17 HD13 LEU 17 0.175 1.560 5.485
120 HD21 LEU 17 HD21 LEU 17 0.938 3.313 6.966
121 HD22 LEU 17 HD22 LEU 17 1.855 2.962 8.435
122 HD23 LEU 17 HD23 LEU 17 0.098 2.679 8.398
123 H GLY 18 H GLY 18 2.847 -2.092 10.095
124 HA2 GLY 18 HA2 GLY 18 2.685 -3.316 12.108
125 HA3 GLY 18 HA3 GLY 18 1.233 -2.409 12.555
126 H CYS 19 H CYS 19 1.246 -3.057 9.238
127 HA CYS 19 HA CYS 19 -1.029 -4.803 9.503
128 HB2 CYS 19 HB2 CYS 19 0.590 -3.954 7.077
129 HB3 CYS 19 HB3 CYS 19 -0.965 -4.796 7.001
130 HG CYS 19 HG CYS 19 -0.277 -1.884 8.420
131 H SER 20 H SER 20 -0.673 -6.872 10.166
132 HA SER 20 HA SER 20 1.804 -8.300 9.621
133 HB2 SER 20 HB2 SER 20 -0.719 -9.198 11.074
134 HB3 SER 20 HB3 SER 20 0.905 -9.924 11.168
135 HG SER 20 HG SER 20 -0.068 -7.444 12.110
136 H SER 21 H SER 21 -1.084 -10.286 9.552
137 HA SER 21 HA SER 21 -0.507 -11.757 7.353
138 HB2 SER 21 HB2 SER 21 -2.987 -12.302 7.398
139 HB3 SER 21 HB3 SER 21 -2.136 -12.449 8.929
140 HG SER 21 HG SER 21 -2.954 -10.029 9.073
141 H CYS 22 H CYS 22 -2.019 -8.546 7.189
142 HA CYS 22 HA CYS 22 -3.139 -8.903 4.589
143 HB2 CYS 22 HB2 CYS 22 -2.211 -6.368 5.998
144 HB3 CYS 22 HB3 CYS 22 -3.156 -6.411 4.494
145 HG CYS 22 HG CYS 22 -4.683 -5.877 6.679
146 H LEU 23 H LEU 23 0.196 -8.216 5.650
147 HA LEU 23 HA LEU 23 1.134 -7.408 3.054
148 HB2 LEU 23 HB2 LEU 23 3.165 -7.109 4.049
149 HB3 LEU 23 HB3 LEU 23 2.145 -7.000 5.461
150 HG LEU 23 HG LEU 23 2.715 -9.566 5.776
151 HD11 LEU 23 HD11 LEU 23 5.086 -8.618 4.104
152 HD12 LEU 23 HD12 LEU 23 3.966 -9.903 3.616
153 HD13 LEU 23 HD13 LEU 23 4.992 -10.128 5.014
154 HD21 LEU 23 HD21 LEU 23 4.674 -8.950 7.091
155 HD22 LEU 23 HD22 LEU 23 3.379 -7.779 7.309
156 HD23 LEU 23 HD23 LEU 23 4.765 -7.377 6.270
157 H ASP 24 H ASP 24 0.835 -10.436 4.904
158 HA ASP 24 HA ASP 24 2.347 -12.126 3.251
159 HB2 ASP 24 HB2 ASP 24 1.396 -12.632 5.539
160 HB3 ASP 24 HB3 ASP 24 -0.163 -12.935 4.755
161 H TYR 25 H TYR 25 -1.108 -11.234 3.135
162 HA TYR 25 HA TYR 25 -1.682 -12.799 0.798
163 HB2 TYR 25 HB2 TYR 25 -3.056 -10.266 1.757
164 HB3 TYR 25 HB3 TYR 25 -3.702 -11.393 0.572
165 HD1 TYR 25 HD1 TYR 25 -4.531 -10.385 3.605
166 HD2 TYR 25 HD2 TYR 25 -3.110 -14.062 1.828
167 HE1 TYR 25 HE1 TYR 25 -5.530 -11.668 5.456
168 HE2 TYR 25 HE2 TYR 25 -4.212 -15.338 3.618
169 HH TYR 25 HH TYR 25 -5.682 -13.811 6.457
170 H PHE 26 H PHE 26 -0.827 -9.241 1.082
171 HA PHE 26 HA PHE 26 -0.875 -8.662 -1.641
172 HB2 PHE 26 HB2 PHE 26 0.339 -7.603 0.828
173 HB3 PHE 26 HB3 PHE 26 1.315 -7.265 -0.553
174 HD1 PHE 26 HD1 PHE 26 0.533 -5.699 -2.365
175 HD2 PHE 26 HD2 PHE 26 -1.900 -6.635 1.065
176 HE1 PHE 26 HE1 PHE 26 -0.815 -3.723 -2.810
177 HE2 PHE 26 HE2 PHE 26 -3.342 -4.710 0.541
178 HZ PHE 26 HZ PHE 26 -2.751 -3.187 -1.363
179 H THR 27 H THR 27 1.899 -9.899 0.256
180 HA THR 27 HA THR 27 3.785 -9.910 -1.890
181 HB THR 27 HB THR 27 5.051 -11.468 -0.354
182 HG1 THR 27 HG1 THR 27 2.919 -10.871 1.436
183 HG21 THR 27 HG21 THR 27 5.342 -9.033 -0.198
184 HG22 THR 27 HG22 THR 27 5.418 -9.771 1.405
185 HG23 THR 27 HG23 THR 27 3.960 -8.902 0.922
186 H THR 28 H THR 28 1.704 -12.530 -0.553
187 HA THR 28 HA THR 28 2.609 -14.456 -2.432
188 HB THR 28 HB THR 28 -0.088 -14.431 -1.029
189 HG1 THR 28 HG1 THR 28 1.477 -14.131 0.509
190 HG21 THR 28 HG21 THR 28 0.209 -16.262 -2.700
191 HG22 THR 28 HG22 THR 28 0.220 -16.902 -1.054
192 HG23 THR 28 HG23 THR 28 1.746 -16.705 -1.946
193 H GLN 29 H GLN 29 0.047 -11.899 -2.730
194 HA GLN 29 HA GLN 29 -1.080 -12.958 -5.155
195 HB2 GLN 29 HB2 GLN 29 -1.130 -10.277 -3.750
196 HB3 GLN 29 HB3 GLN 29 -1.989 -10.591 -5.254
197 HG2 GLN 29 HG2 GLN 29 -2.503 -12.482 -2.960
198 HG3 GLN 29 HG3 GLN 29 -3.200 -10.868 -2.914
199 HE21 GLN 29 HE21 GLN 29 -5.412 -11.714 -3.115
200 HE22 GLN 29 HE22 GLN 29 -5.944 -12.363 -4.659
201 H GLY 30 H GLY 30 1.724 -10.963 -4.347
202 HA2 GLY 30 HA2 GLY 30 3.523 -10.393 -5.653
203 HA3 GLY 30 HA3 GLY 30 2.760 -11.176 -7.043
204 H LEU 31 H LEU 31 1.309 -8.586 -5.094
205 HA LEU 31 HA LEU 31 1.653 -6.622 -7.335
206 HB2 LEU 31 HB2 LEU 31 -0.785 -5.957 -6.750
207 HB3 LEU 31 HB3 LEU 31 -0.477 -7.355 -7.757
208 HG LEU 31 HG LEU 31 -0.847 -8.866 -5.896
209 HD11 LEU 31 HD11 LEU 31 -1.863 -7.979 -3.745
210 HD12 LEU 31 HD12 LEU 31 -1.307 -6.370 -4.236
211 HD13 LEU 31 HD13 LEU 31 -0.135 -7.654 -3.931
212 HD21 LEU 31 HD21 LEU 31 -3.192 -8.578 -5.650
213 HD22 LEU 31 HD22 LEU 31 -2.703 -8.169 -7.303
214 HD23 LEU 31 HD23 LEU 31 -3.068 -6.854 -6.181
215 H THR 32 H THR 32 2.959 -6.913 -4.630
216 HA THR 32 HA THR 32 1.956 -4.523 -3.174
217 HB THR 32 HB THR 32 2.578 -6.260 -1.770
218 HG1 THR 32 HG1 THR 32 4.048 -5.498 -0.551
219 HG21 THR 32 HG21 THR 32 3.676 -7.878 -3.159
220 HG22 THR 32 HG22 THR 32 4.691 -7.528 -1.770
221 HG23 THR 32 HG23 THR 32 5.100 -6.820 -3.341
222 H THR 33 H THR 33 2.508 -2.443 -3.891
223 HA THR 33 HA THR 33 5.263 -1.982 -4.372
224 HB THR 33 HB THR 33 5.006 -2.405 -6.610
225 HG1 THR 33 HG1 THR 33 5.259 -0.318 -6.744
226 HG21 THR 33 HG21 THR 33 2.785 -2.358 -7.892
227 HG22 THR 33 HG22 THR 33 1.938 -2.129 -6.361
228 HG23 THR 33 HG23 THR 33 2.905 -3.586 -6.656
229 H ILE 34 H ILE 34 5.639 0.301 -4.269
230 HA ILE 34 HA ILE 34 3.645 1.660 -2.599
231 HB ILE 34 HB ILE 34 5.973 3.268 -3.506
232 HG12 ILE 34 HG12 ILE 34 7.085 1.027 -3.050
233 HG13 ILE 34 HG13 ILE 34 7.686 2.487 -2.303
234 HG21 ILE 34 HG21 ILE 34 4.694 2.841 -0.773
235 HG22 ILE 34 HG22 ILE 34 5.863 4.091 -1.218
236 HG23 ILE 34 HG23 ILE 34 4.264 4.093 -1.953
237 HD11 ILE 34 HD11 ILE 34 5.953 0.457 -0.878
238 HD12 ILE 34 HD12 ILE 34 7.724 0.637 -0.740
239 HD13 ILE 34 HD13 ILE 34 6.672 1.909 -0.146
240 H TYR 35 H TYR 35 5.308 2.479 -5.604
241 HA TYR 35 HA TYR 35 3.991 4.819 -6.260
242 HB2 TYR 35 HB2 TYR 35 4.936 2.853 -8.354
243 HB3 TYR 35 HB3 TYR 35 5.069 4.612 -8.330
244 HD1 TYR 35 HD1 TYR 35 7.056 1.892 -8.479
245 HD2 TYR 35 HD2 TYR 35 6.441 5.240 -5.815
246 HE1 TYR 35 HE1 TYR 35 9.346 1.630 -7.614
247 HE2 TYR 35 HE2 TYR 35 8.713 4.939 -4.907
248 HH TYR 35 HH TYR 35 11.080 2.801 -6.406
249 H GLN 36 H GLN 36 2.883 1.603 -6.491
250 HA GLN 36 HA GLN 36 0.880 2.258 -8.587
251 HB2 GLN 36 HB2 GLN 36 1.554 -0.263 -7.079
252 HB3 GLN 36 HB3 GLN 36 0.125 -0.174 -8.084
253 HG2 GLN 36 HG2 GLN 36 2.953 0.213 -9.070
254 HG3 GLN 36 HG3 GLN 36 1.898 -1.167 -9.404
255 HE21 GLN 36 HE21 GLN 36 3.021 -0.067 -11.561
256 HE22 GLN 36 HE22 GLN 36 1.905 0.941 -12.458
257 H ILE 37 H ILE 37 0.735 1.227 -5.108
258 HA ILE 37 HA ILE 37 -2.077 1.687 -4.979
259 HB ILE 37 HB ILE 37 -1.844 1.712 -2.593
260 HG12 ILE 37 HG12 ILE 37 1.181 1.537 -2.963
261 HG13 ILE 37 HG13 ILE 37 0.329 3.027 -2.551
262 HG21 ILE 37 HG21 ILE 37 -0.952 -0.577 -2.322
263 HG22 ILE 37 HG22 ILE 37 -1.894 -0.432 -3.822
264 HG23 ILE 37 HG23 ILE 37 -0.124 -0.462 -3.878
265 HD11 ILE 37 HD11 ILE 37 1.031 2.187 -0.525
266 HD12 ILE 37 HD12 ILE 37 -0.693 1.798 -0.608
267 HD13 ILE 37 HD13 ILE 37 0.514 0.524 -0.930
268 H GLU 38 H GLU 38 0.628 3.904 -4.995
269 HA GLU 38 HA GLU 38 -0.626 6.100 -3.717
270 HB2 GLU 38 HB2 GLU 38 1.827 5.739 -4.188
271 HB3 GLU 38 HB3 GLU 38 1.525 6.147 -5.883
272 HG2 GLU 38 HG2 GLU 38 0.799 8.399 -5.229
273 HG3 GLU 38 HG3 GLU 38 0.873 7.961 -3.518
274 H HIS 39 H HIS 39 -1.072 4.678 -6.934
275 HA HIS 39 HA HIS 39 -2.750 7.042 -7.638
276 HB2 HIS 39 HB2 HIS 39 -0.709 6.520 -9.091
277 HB3 HIS 39 HB3 HIS 39 -1.557 5.060 -9.610
278 HD1 HIS 39 HD1 HIS 39 -1.929 5.992 -12.196
279 HD2 HIS 39 HD2 HIS 39 -3.390 8.399 -9.063
280 HE1 HIS 39 HE1 HIS 39 -3.269 7.810 -13.280
281 H TYR 40 H TYR 40 -2.728 3.610 -7.167
282 HA TYR 40 HA TYR 40 -5.240 2.986 -8.424
283 HB2 TYR 40 HB2 TYR 40 -3.493 1.544 -6.405
284 HB3 TYR 40 HB3 TYR 40 -5.101 0.967 -6.735
285 HD1 TYR 40 HD1 TYR 40 -1.921 -0.184 -7.440
286 HD2 TYR 40 HD2 TYR 40 -5.507 1.188 -9.558
287 HE1 TYR 40 HE1 TYR 40 -1.340 -1.501 -9.404
288 HE2 TYR 40 HE2 TYR 40 -4.877 -0.148 -11.476
289 HH TYR 40 HH TYR 40 -3.176 -1.382 -12.483
290 H SER 41 H SER 41 -7.073 4.049 -7.814
291 HA SER 41 HA SER 41 -7.472 5.100 -5.164
292 HB2 SER 41 HB2 SER 41 -9.326 4.633 -7.558
293 HB3 SER 41 HB3 SER 41 -9.853 5.433 -6.071
294 HG SER 41 HG SER 41 -9.262 6.956 -7.508
295 H MET 42 H MET 42 -9.528 4.629 -3.946
296 HA MET 42 HA MET 42 -9.470 2.134 -2.762
297 HB2 MET 42 HB2 MET 42 -11.535 2.756 -1.654
298 HB3 MET 42 HB3 MET 42 -10.412 4.111 -1.686
299 HG2 MET 42 HG2 MET 42 -12.776 3.762 -3.587
300 HG3 MET 42 HG3 MET 42 -12.807 4.713 -2.106
301 HE1 MET 42 HE1 MET 42 -13.863 6.601 -3.701
302 HE2 MET 42 HE2 MET 42 -12.993 7.338 -5.065
303 HE3 MET 42 HE3 MET 42 -13.562 5.658 -5.182
304 H ASP 43 H ASP 43 -11.171 3.063 -5.666
305 HA ASP 43 HA ASP 43 -13.139 0.985 -5.840
306 HB2 ASP 43 HB2 ASP 43 -11.615 2.660 -7.875
307 HB3 ASP 43 HB3 ASP 43 -12.736 1.403 -8.380
308 H ASP 44 H ASP 44 -9.793 1.345 -7.100
309 HA ASP 44 HA ASP 44 -9.654 -1.215 -8.327
310 HB2 ASP 44 HB2 ASP 44 -7.590 0.851 -7.553
311 HB3 ASP 44 HB3 ASP 44 -7.086 -0.782 -7.995
312 H LEU 45 H LEU 45 -8.664 0.007 -5.137
313 HA LEU 45 HA LEU 45 -7.567 -2.386 -4.074
314 HB2 LEU 45 HB2 LEU 45 -9.034 -0.045 -2.805
315 HB3 LEU 45 HB3 LEU 45 -8.623 -1.462 -1.859
316 HG LEU 45 HG LEU 45 -6.271 -1.189 -2.323
317 HD11 LEU 45 HD11 LEU 45 -6.947 1.447 -3.670
318 HD12 LEU 45 HD12 LEU 45 -6.326 0.015 -4.516
319 HD13 LEU 45 HD13 LEU 45 -5.331 0.857 -3.340
320 HD21 LEU 45 HD21 LEU 45 -7.626 1.294 -1.226
321 HD22 LEU 45 HD22 LEU 45 -5.938 0.834 -0.926
322 HD23 LEU 45 HD23 LEU 45 -7.236 -0.192 -0.331
323 H ALA 46 H ALA 46 -10.983 -1.251 -4.104
324 HA ALA 46 HA ALA 46 -12.047 -3.526 -2.749
325 HB1 ALA 46 HB1 ALA 46 -14.210 -2.759 -3.583
326 HB2 ALA 46 HB2 ALA 46 -13.249 -1.358 -3.058
327 HB3 ALA 46 HB3 ALA 46 -13.423 -1.721 -4.789
328 H SER 47 H SER 47 -11.632 -2.846 -6.284
329 HA SER 47 HA SER 47 -12.816 -5.276 -7.168
330 HB2 SER 47 HB2 SER 47 -11.872 -4.786 -9.289
331 HB3 SER 47 HB3 SER 47 -12.344 -3.259 -8.546
332 HG SER 47 HG SER 47 -9.961 -3.294 -7.824
333 H LEU 48 H LEU 48 -9.571 -4.562 -6.035
334 HA LEU 48 HA LEU 48 -8.423 -7.085 -6.830
335 HB2 LEU 48 HB2 LEU 48 -7.506 -4.769 -5.107
336 HB3 LEU 48 HB3 LEU 48 -6.535 -6.213 -5.315
337 HG LEU 48 HG LEU 48 -7.529 -4.619 -7.708
338 HD11 LEU 48 HD11 LEU 48 -4.849 -4.341 -6.292
339 HD12 LEU 48 HD12 LEU 48 -6.163 -3.142 -6.269
340 HD13 LEU 48 HD13 LEU 48 -5.350 -3.528 -7.791
341 HD21 LEU 48 HD21 LEU 48 -5.254 -6.630 -7.375
342 HD22 LEU 48 HD22 LEU 48 -5.626 -5.716 -8.853
343 HD23 LEU 48 HD23 LEU 48 -6.782 -6.900 -8.246
344 H LYS 49 H LYS 49 -10.840 -6.743 -4.843
345 HA LYS 49 HA LYS 49 -11.861 -7.983 -3.343
346 HB2 LYS 49 HB2 LYS 49 -9.554 -9.956 -3.278
347 HB3 LYS 49 HB3 LYS 49 -11.225 -10.184 -2.806
348 HG2 LYS 49 HG2 LYS 49 -11.249 -11.263 -4.750
349 HG3 LYS 49 HG3 LYS 49 -11.818 -9.696 -5.292
350 HD2 LYS 49 HD2 LYS 49 -9.700 -9.210 -6.348
351 HD3 LYS 49 HD3 LYS 49 -8.869 -10.501 -5.467
352 HE2 LYS 49 HE2 LYS 49 -10.916 -10.811 -7.700
353 HE3 LYS 49 HE3 LYS 49 -9.176 -11.034 -7.837
354 HZ1 LYS 49 HZ1 LYS 49 -11.050 -12.674 -6.262
355 HZ2 LYS 49 HZ2 LYS 49 -9.396 -12.855 -6.209
356 HZ3 LYS 49 HZ3 LYS 49 -10.205 -13.157 -7.583
357 H ILE 50 H ILE 50 -9.793 -5.862 -2.555
358 HA ILE 50 HA ILE 50 -8.844 -6.807 0.006
359 HB ILE 50 HB ILE 50 -8.954 -3.952 -1.012
360 HG12 ILE 50 HG12 ILE 50 -7.640 -5.435 -2.600
361 HG13 ILE 50 HG13 ILE 50 -6.692 -4.198 -1.812
362 HG21 ILE 50 HG21 ILE 50 -7.304 -5.365 1.086
363 HG22 ILE 50 HG22 ILE 50 -7.111 -3.656 0.633
364 HG23 ILE 50 HG23 ILE 50 -8.584 -4.237 1.433
365 HD11 ILE 50 HD11 ILE 50 -5.705 -5.863 -0.288
366 HD12 ILE 50 HD12 ILE 50 -6.773 -7.130 -0.957
367 HD13 ILE 50 HD13 ILE 50 -5.527 -6.360 -1.945
368 HA PRO 51 HA PRO 51 -12.821 -6.041 1.932
369 HB2 PRO 51 HB2 PRO 51 -12.154 -6.421 4.589
370 HB3 PRO 51 HB3 PRO 51 -12.387 -7.744 3.406
371 HG2 PRO 51 HG2 PRO 51 -9.790 -6.462 4.275
372 HG3 PRO 51 HG3 PRO 51 -10.170 -8.201 4.130
373 HD2 PRO 51 HD2 PRO 51 -8.855 -6.864 2.175
374 HD3 PRO 51 HD3 PRO 51 -10.060 -8.124 1.766
375 H GLU 52 H GLU 52 -13.792 -4.187 2.488
376 HA GLU 52 HA GLU 52 -12.764 -1.748 2.425
377 HB2 GLU 52 HB2 GLU 52 -14.753 -0.846 3.268
378 HB3 GLU 52 HB3 GLU 52 -15.164 -2.334 2.420
379 HG2 GLU 52 HG2 GLU 52 -15.359 -3.512 4.623
380 HG3 GLU 52 HG3 GLU 52 -14.964 -2.011 5.452
381 H GLN 53 H GLN 53 -13.155 -3.313 5.643
382 HA GLN 53 HA GLN 53 -12.367 -1.157 7.226
383 HB2 GLN 53 HB2 GLN 53 -12.162 -4.162 7.565
384 HB3 GLN 53 HB3 GLN 53 -11.591 -3.049 8.819
385 HG2 GLN 53 HG2 GLN 53 -13.879 -2.013 8.879
386 HG3 GLN 53 HG3 GLN 53 -14.435 -3.244 7.743
387 HE21 GLN 53 HE21 GLN 53 -15.523 -4.897 8.817
388 HE22 GLN 53 HE22 GLN 53 -15.089 -5.531 10.384
389 H PHE 54 H PHE 54 -10.281 -3.586 5.619
390 HA PHE 54 HA PHE 54 -7.844 -2.333 6.724
391 HB2 PHE 54 HB2 PHE 54 -7.691 -4.650 6.564
392 HB3 PHE 54 HB3 PHE 54 -8.561 -4.721 5.048
393 HD1 PHE 54 HD1 PHE 54 -7.394 -5.296 3.215
394 HD2 PHE 54 HD2 PHE 54 -5.376 -3.039 6.264
395 HE1 PHE 54 HE1 PHE 54 -5.255 -5.399 1.906
396 HE2 PHE 54 HE2 PHE 54 -3.302 -3.067 4.946
397 HZ PHE 54 HZ PHE 54 -3.264 -4.263 2.727
398 H ARG 55 H ARG 55 -9.406 -2.745 3.489
399 HA ARG 55 HA ARG 55 -7.489 -1.506 1.974
400 HB2 ARG 55 HB2 ARG 55 -8.882 -1.787 0.285
401 HB3 ARG 55 HB3 ARG 55 -9.897 -2.602 1.460
402 HG2 ARG 55 HG2 ARG 55 -11.121 -0.437 1.821
403 HG3 ARG 55 HG3 ARG 55 -10.197 0.278 0.485
404 HD2 ARG 55 HD2 ARG 55 -11.216 -1.189 -1.111
405 HD3 ARG 55 HD3 ARG 55 -11.847 -2.243 0.166
406 HE ARG 55 HE ARG 55 -12.731 0.573 0.204
407 HH11 ARG 55 HH11 ARG 55 -13.673 -2.804 -0.603
408 HH12 ARG 55 HH12 ARG 55 -15.372 -2.377 -0.524
409 HH21 ARG 55 HH21 ARG 55 -14.937 0.967 0.376
410 HH22 ARG 55 HH22 ARG 55 -16.073 -0.307 -0.037
411 H HIS 56 H HIS 56 -10.136 0.292 3.666
412 HA HIS 56 HA HIS 56 -9.180 2.791 2.593
413 HB2 HIS 56 HB2 HIS 56 -11.098 2.117 4.840
414 HB3 HIS 56 HB3 HIS 56 -10.650 3.775 4.420
415 HD1 HIS 56 HD1 HIS 56 -11.265 4.590 1.847
416 HD2 HIS 56 HD2 HIS 56 -12.884 0.936 3.192
417 HE1 HIS 56 HE1 HIS 56 -13.105 3.956 0.200
418 H ALA 57 H ALA 57 -8.026 0.829 5.319
419 HA ALA 57 HA ALA 57 -6.744 3.054 6.640
420 HB1 ALA 57 HB1 ALA 57 -6.277 0.062 6.879
421 HB2 ALA 57 HB2 ALA 57 -5.678 1.315 7.983
422 HB3 ALA 57 HB3 ALA 57 -7.426 1.027 7.834
423 H ILE 58 H ILE 58 -5.609 0.433 4.340
424 HA ILE 58 HA ILE 58 -2.921 1.370 4.378
425 HB ILE 58 HB ILE 58 -3.086 -0.728 3.551
426 HG12 ILE 58 HG12 ILE 58 -2.504 -0.817 1.207
427 HG13 ILE 58 HG13 ILE 58 -3.215 0.754 0.864
428 HG21 ILE 58 HG21 ILE 58 -5.467 -1.014 3.178
429 HG22 ILE 58 HG22 ILE 58 -5.333 -0.146 1.622
430 HG23 ILE 58 HG23 ILE 58 -4.526 -1.690 1.891
431 HD11 ILE 58 HD11 ILE 58 -1.061 0.788 2.941
432 HD12 ILE 58 HD12 ILE 58 -0.555 0.322 1.293
433 HD13 ILE 58 HD13 ILE 58 -1.338 1.873 1.567
434 H TRP 59 H TRP 59 -5.676 1.983 2.205
435 HA TRP 59 HA TRP 59 -4.349 3.759 0.495
436 HB2 TRP 59 HB2 TRP 59 -6.772 2.744 0.402
437 HB3 TRP 59 HB3 TRP 59 -7.238 4.253 1.161
438 HD1 TRP 59 HD1 TRP 59 -5.192 3.002 -1.904
439 HE1 TRP 59 HE1 TRP 59 -5.453 4.617 -3.819
440 HE3 TRP 59 HE3 TRP 59 -7.914 6.616 0.482
441 HZ2 TRP 59 HZ2 TRP 59 -6.757 7.201 -4.317
442 HZ3 TRP 59 HZ3 TRP 59 -8.665 8.637 -0.740
443 HH2 TRP 59 HH2 TRP 59 -8.090 8.936 -3.146
444 H LYS 60 H LYS 60 -6.246 4.602 3.477
445 HA LYS 60 HA LYS 60 -5.641 7.331 3.379
446 HB2 LYS 60 HB2 LYS 60 -7.336 6.242 4.871
447 HB3 LYS 60 HB3 LYS 60 -6.025 5.562 5.838
448 HG2 LYS 60 HG2 LYS 60 -6.966 7.479 6.960
449 HG3 LYS 60 HG3 LYS 60 -5.326 7.889 6.442
450 HD2 LYS 60 HD2 LYS 60 -6.233 9.056 4.477
451 HD3 LYS 60 HD3 LYS 60 -7.887 8.669 4.956
452 HE2 LYS 60 HE2 LYS 60 -5.934 10.217 6.712
453 HE3 LYS 60 HE3 LYS 60 -6.965 11.010 5.521
454 HZ1 LYS 60 HZ1 LYS 60 -7.943 10.935 7.777
455 HZ2 LYS 60 HZ2 LYS 60 -8.014 9.320 7.711
456 HZ3 LYS 60 HZ3 LYS 60 -8.907 10.212 6.652
457 H GLY 61 H GLY 61 -3.680 4.627 4.740
458 HA2 GLY 61 HA2 GLY 61 -1.730 6.209 6.000
459 HA3 GLY 61 HA3 GLY 61 -1.481 4.559 5.367
460 H ILE 62 H ILE 62 -1.669 4.873 2.644
461 HA ILE 62 HA ILE 62 0.879 6.155 2.187
462 HB ILE 62 HB ILE 62 0.201 4.164 1.146
463 HG12 ILE 62 HG12 ILE 62 1.073 4.606 -1.167
464 HG13 ILE 62 HG13 ILE 62 0.827 6.325 -0.919
465 HG21 ILE 62 HG21 ILE 62 -1.249 4.034 -0.863
466 HG22 ILE 62 HG22 ILE 62 -2.142 4.509 0.583
467 HG23 ILE 62 HG23 ILE 62 -1.688 5.717 -0.641
468 HD11 ILE 62 HD11 ILE 62 2.553 6.318 0.854
469 HD12 ILE 62 HD12 ILE 62 2.732 4.554 0.675
470 HD13 ILE 62 HD13 ILE 62 3.181 5.654 -0.649
471 H LEU 63 H LEU 63 -2.462 6.998 1.393
472 HA LEU 63 HA LEU 63 -1.851 9.321 -0.167
473 HB2 LEU 63 HB2 LEU 63 -4.236 8.376 1.421
474 HB3 LEU 63 HB3 LEU 63 -4.174 10.044 0.958
475 HG LEU 63 HG LEU 63 -5.447 8.543 -0.586
476 HD11 LEU 63 HD11 LEU 63 -4.766 9.724 -2.561
477 HD12 LEU 63 HD12 LEU 63 -3.187 10.120 -1.847
478 HD13 LEU 63 HD13 LEU 63 -4.671 10.820 -1.167
479 HD21 LEU 63 HD21 LEU 63 -3.926 6.615 -0.798
480 HD22 LEU 63 HD22 LEU 63 -2.701 7.653 -1.578
481 HD23 LEU 63 HD23 LEU 63 -4.246 7.350 -2.368
482 H ASP 64 H ASP 64 -1.941 8.660 3.237
483 HA ASP 64 HA ASP 64 -1.856 11.474 4.119
484 HB2 ASP 64 HB2 ASP 64 -1.415 8.854 5.592
485 HB3 ASP 64 HB3 ASP 64 -1.007 10.395 6.313
486 H HIS 65 H HIS 65 0.463 8.861 3.614
487 HA HIS 65 HA HIS 65 2.781 10.188 4.579
488 HB2 HIS 65 HB2 HIS 65 2.791 7.767 4.220
489 HB3 HIS 65 HB3 HIS 65 2.465 7.981 2.501
490 HD1 HIS 65 HD1 HIS 65 5.253 9.560 4.732
491 HD2 HIS 65 HD2 HIS 65 4.560 7.574 1.079
492 HE1 HIS 65 HE1 HIS 65 7.497 9.448 3.537
493 H ARG 66 H ARG 66 1.611 9.729 1.207
494 HA ARG 66 HA ARG 66 3.489 11.628 0.142
495 HB2 ARG 66 HB2 ARG 66 2.383 11.369 -1.950
496 HB3 ARG 66 HB3 ARG 66 2.487 9.802 -1.177
497 HG2 ARG 66 HG2 ARG 66 0.332 9.727 -1.969
498 HG3 ARG 66 HG3 ARG 66 0.071 10.303 -0.340
499 HD2 ARG 66 HD2 ARG 66 -1.357 11.532 -1.725
500 HD3 ARG 66 HD3 ARG 66 -0.106 12.666 -1.247
501 HE ARG 66 HE ARG 66 0.938 11.889 -3.565
502 HH11 ARG 66 HH11 ARG 66 -2.161 13.217 -2.634
503 HH12 ARG 66 HH12 ARG 66 -2.742 13.547 -4.215
504 HH21 ARG 66 HH21 ARG 66 0.186 12.123 -5.761
505 HH22 ARG 66 HH22 ARG 66 -1.250 13.044 -6.082
506 H GLN 67 H GLN 67 0.357 12.137 1.784
507 HA GLN 67 HA GLN 67 -0.070 14.735 0.543
508 HB2 GLN 67 HB2 GLN 67 -1.919 13.813 1.577
509 HB3 GLN 67 HB3 GLN 67 -1.045 13.318 3.034
510 HG2 GLN 67 HG2 GLN 67 -0.913 15.628 3.786
511 HG3 GLN 67 HG3 GLN 67 -1.754 16.177 2.339
512 HE21 GLN 67 HE21 GLN 67 -2.631 16.704 4.892
513 HE22 GLN 67 HE22 GLN 67 -4.146 15.925 5.264
514 H LEU 68 H LEU 68 1.680 13.548 3.429
515 HA LEU 68 HA LEU 68 2.464 16.215 4.290
516 HB2 LEU 68 HB2 LEU 68 3.326 13.423 5.102
517 HB3 LEU 68 HB3 LEU 68 3.888 14.891 5.897
518 HG LEU 68 HG LEU 68 0.924 14.200 5.694
519 HD11 LEU 68 HD11 LEU 68 2.912 13.507 7.885
520 HD12 LEU 68 HD12 LEU 68 2.014 12.371 6.840
521 HD13 LEU 68 HD13 LEU 68 1.139 13.368 8.003
522 HD21 LEU 68 HD21 LEU 68 0.712 15.733 7.611
523 HD22 LEU 68 HD22 LEU 68 1.405 16.566 6.220
524 HD23 LEU 68 HD23 LEU 68 2.456 16.066 7.554
525 H HIS 69 H HIS 69 4.350 13.388 3.052
526 HA HIS 69 HA HIS 69 6.719 14.976 2.589
527 HB2 HIS 69 HB2 HIS 69 5.812 12.090 2.152
528 HB3 HIS 69 HB3 HIS 69 7.298 12.662 1.479
529 HD1 HIS 69 HD1 HIS 69 5.809 11.875 4.935
530 HD2 HIS 69 HD2 HIS 69 9.370 13.179 3.074
531 HE1 HIS 69 HE1 HIS 69 7.641 11.756 6.695
532 H ASP 70 H ASP 70 7.776 14.431 0.312
533 HA ASP 70 HA ASP 70 6.162 14.418 -1.998
534 HB2 ASP 70 HB2 ASP 70 6.681 16.540 -2.913
535 HB3 ASP 70 HB3 ASP 70 5.869 16.817 -1.382
Start of MODEL 7
1 H1 GLY 1 H GLY 1 14.659 -18.555 6.101
2 HA2 GLY 1 HA2 GLY 1 16.892 -17.689 6.621
3 HA3 GLY 1 HA3 GLY 1 16.365 -17.206 4.996
4 HA PRO 2 HA PRO 2 17.411 -13.250 6.981
5 HB2 PRO 2 HB2 PRO 2 17.776 -11.744 4.710
6 HB3 PRO 2 HB3 PRO 2 19.005 -12.882 5.338
7 HG2 PRO 2 HG2 PRO 2 16.945 -13.366 3.168
8 HG3 PRO 2 HG3 PRO 2 18.697 -13.724 3.117
9 HD2 PRO 2 HD2 PRO 2 16.846 -15.633 3.723
10 HD3 PRO 2 HD3 PRO 2 18.434 -15.602 4.545
11 H LEU 3 H LEU 3 16.356 -11.070 6.952
12 HA LEU 3 HA LEU 3 13.439 -11.387 6.623
13 HB2 LEU 3 HB2 LEU 3 15.240 -9.259 7.812
14 HB3 LEU 3 HB3 LEU 3 13.543 -8.919 7.507
15 HG LEU 3 HG LEU 3 14.440 -11.302 9.181
16 HD11 LEU 3 HD11 LEU 3 15.242 -9.233 10.238
17 HD12 LEU 3 HD12 LEU 3 13.916 -9.940 11.171
18 HD13 LEU 3 HD13 LEU 3 13.617 -8.525 10.134
19 HD21 LEU 3 HD21 LEU 3 12.107 -11.151 10.075
20 HD22 LEU 3 HD22 LEU 3 12.117 -11.482 8.342
21 HD23 LEU 3 HD23 LEU 3 11.762 -9.846 8.932
22 H GLY 4 H GLY 4 16.083 -9.606 5.015
23 HA2 GLY 4 HA2 GLY 4 16.112 -8.746 2.881
24 HA3 GLY 4 HA3 GLY 4 14.387 -9.157 2.662
25 H SER 5 H SER 5 12.923 -7.501 2.923
26 HA SER 5 HA SER 5 11.997 -5.520 3.368
27 HB2 SER 5 HB2 SER 5 13.874 -5.324 5.753
28 HB3 SER 5 HB3 SER 5 12.271 -4.618 5.581
29 HG SER 5 HG SER 5 12.147 -6.460 6.845
30 H THR 6 H THR 6 15.200 -5.448 2.279
31 HA THR 6 HA THR 6 15.732 -2.640 2.677
32 HB THR 6 HB THR 6 17.529 -3.239 0.929
33 HG1 THR 6 HG1 THR 6 17.822 -5.267 0.424
34 HG21 THR 6 HG21 THR 6 18.912 -4.392 2.577
35 HG22 THR 6 HG22 THR 6 17.469 -4.865 3.507
36 HG23 THR 6 HG23 THR 6 17.943 -3.155 3.380
37 H ASP 7 H ASP 7 13.862 -4.425 0.291
38 HA ASP 7 HA ASP 7 14.262 -2.527 -1.832
39 HB2 ASP 7 HB2 ASP 7 12.723 -3.782 -3.051
40 HB3 ASP 7 HB3 ASP 7 13.673 -4.947 -2.133
41 H CYS 8 H CYS 8 12.328 -1.440 -2.854
42 HA CYS 8 HA CYS 8 10.839 0.101 -0.781
43 HB2 CYS 8 HB2 CYS 8 11.772 0.788 -3.578
44 HB3 CYS 8 HB3 CYS 8 10.738 1.814 -2.573
45 HG CYS 8 HG CYS 8 13.146 2.783 -2.507
46 H SER 9 H SER 9 9.299 -1.671 -0.623
47 HA SER 9 HA SER 9 7.193 -1.418 -2.655
48 HB2 SER 9 HB2 SER 9 8.093 -4.133 -1.681
49 HB3 SER 9 HB3 SER 9 6.818 -3.771 -2.849
50 HG SER 9 HG SER 9 9.571 -3.843 -3.079
51 H ILE 10 H ILE 10 5.180 -2.723 -1.713
52 HA ILE 10 HA ILE 10 4.501 -1.425 0.649
53 HB ILE 10 HB ILE 10 3.139 -3.800 -0.653
54 HG12 ILE 10 HG12 ILE 10 3.406 -1.816 -2.056
55 HG13 ILE 10 HG13 ILE 10 1.740 -2.218 -1.696
56 HG21 ILE 10 HG21 ILE 10 2.106 -1.995 1.505
57 HG22 ILE 10 HG22 ILE 10 1.095 -3.042 0.482
58 HG23 ILE 10 HG23 ILE 10 2.300 -3.763 1.550
59 HD11 ILE 10 HD11 ILE 10 2.220 0.203 -1.683
60 HD12 ILE 10 HD12 ILE 10 1.576 -0.368 -0.135
61 HD13 ILE 10 HD13 ILE 10 3.310 0.012 -0.323
62 H VAL 11 H VAL 11 6.307 -4.372 0.410
63 HA VAL 11 HA VAL 11 5.648 -5.448 2.969
64 HB VAL 11 HB VAL 11 8.058 -6.139 3.093
65 HG11 VAL 11 HG11 VAL 11 6.600 -6.895 0.531
66 HG12 VAL 11 HG12 VAL 11 7.782 -7.883 1.426
67 HG13 VAL 11 HG13 VAL 11 6.217 -7.527 2.158
68 HG21 VAL 11 HG21 VAL 11 8.294 -4.987 0.291
69 HG22 VAL 11 HG22 VAL 11 9.244 -4.509 1.716
70 HG23 VAL 11 HG23 VAL 11 9.430 -6.112 1.031
71 H SER 12 H SER 12 7.919 -2.810 2.150
72 HA SER 12 HA SER 12 8.816 -2.370 4.846
73 HB2 SER 12 HB2 SER 12 10.021 -1.677 2.736
74 HB3 SER 12 HB3 SER 12 8.762 -0.461 2.465
75 HG SER 12 HG SER 12 10.619 -0.676 4.600
76 H PHE 13 H PHE 13 6.257 -0.941 2.784
77 HA PHE 13 HA PHE 13 5.598 1.073 4.689
78 HB2 PHE 13 HB2 PHE 13 5.108 1.253 2.302
79 HB3 PHE 13 HB3 PHE 13 4.021 -0.128 2.398
80 HD1 PHE 13 HD1 PHE 13 2.178 1.098 1.441
81 HD2 PHE 13 HD2 PHE 13 4.026 2.506 5.097
82 HE1 PHE 13 HE1 PHE 13 0.219 2.537 1.914
83 HE2 PHE 13 HE2 PHE 13 2.069 3.904 5.533
84 HZ PHE 13 HZ PHE 13 0.123 3.834 3.997
85 H PHE 14 H PHE 14 3.965 -2.053 3.938
86 HA PHE 14 HA PHE 14 2.027 -1.778 5.948
87 HB2 PHE 14 HB2 PHE 14 3.136 -4.123 4.399
88 HB3 PHE 14 HB3 PHE 14 2.086 -4.431 5.741
89 HD1 PHE 14 HD1 PHE 14 0.750 -5.575 3.933
90 HD2 PHE 14 HD2 PHE 14 1.205 -1.295 4.045
91 HE1 PHE 14 HE1 PHE 14 -1.149 -5.332 2.373
92 HE2 PHE 14 HE2 PHE 14 -0.679 -1.060 2.530
93 HZ PHE 14 HZ PHE 14 -1.855 -3.058 1.613
94 H ALA 15 H ALA 15 5.290 -3.152 6.089
95 HA ALA 15 HA ALA 15 5.093 -4.167 8.745
96 HB1 ALA 15 HB1 ALA 15 7.442 -3.032 7.169
97 HB2 ALA 15 HB2 ALA 15 7.577 -3.813 8.749
98 HB3 ALA 15 HB3 ALA 15 6.983 -4.746 7.371
99 H ARG 16 H ARG 16 6.034 -0.854 7.536
100 HA ARG 16 HA ARG 16 6.420 0.238 10.153
101 HB2 ARG 16 HB2 ARG 16 5.684 1.612 7.521
102 HB3 ARG 16 HB3 ARG 16 5.996 2.456 9.035
103 HG2 ARG 16 HG2 ARG 16 8.254 0.963 8.921
104 HG3 ARG 16 HG3 ARG 16 7.910 1.078 7.200
105 HD2 ARG 16 HD2 ARG 16 9.369 2.855 7.709
106 HD3 ARG 16 HD3 ARG 16 7.775 3.578 7.419
107 HE ARG 16 HE ARG 16 7.922 3.058 10.162
108 HH11 ARG 16 HH11 ARG 16 10.185 4.729 8.024
109 HH12 ARG 16 HH12 ARG 16 10.929 5.609 9.300
110 HH21 ARG 16 HH21 ARG 16 8.435 4.643 11.704
111 HH22 ARG 16 HH22 ARG 16 9.816 5.630 11.497
112 H LEU 17 H LEU 17 3.503 -0.111 8.180
113 HA LEU 17 HA LEU 17 1.811 1.539 9.877
114 HB2 LEU 17 HB2 LEU 17 1.032 -0.847 8.130
115 HB3 LEU 17 HB3 LEU 17 -0.115 0.199 8.952
116 HG LEU 17 HG LEU 17 1.771 1.011 6.758
117 HD11 LEU 17 HD11 LEU 17 -1.262 0.786 6.757
118 HD12 LEU 17 HD12 LEU 17 -0.139 -0.404 6.045
119 HD13 LEU 17 HD13 LEU 17 -0.233 1.235 5.382
120 HD21 LEU 17 HD21 LEU 17 1.450 2.980 8.135
121 HD22 LEU 17 HD22 LEU 17 -0.277 2.623 8.359
122 HD23 LEU 17 HD23 LEU 17 0.320 3.162 6.788
123 H GLY 18 H GLY 18 2.909 -1.821 10.050
124 HA2 GLY 18 HA2 GLY 18 3.097 -2.955 12.067
125 HA3 GLY 18 HA3 GLY 18 1.648 -2.161 12.709
126 H CYS 19 H CYS 19 1.580 -3.219 9.354
127 HA CYS 19 HA CYS 19 -0.600 -5.041 9.996
128 HB2 CYS 19 HB2 CYS 19 0.892 -4.449 7.420
129 HB3 CYS 19 HB3 CYS 19 -0.592 -5.417 7.509
130 HG CYS 19 HG CYS 19 -0.669 -2.566 9.041
131 H SER 20 H SER 20 -0.581 -7.344 9.588
132 HA SER 20 HA SER 20 2.098 -8.610 9.289
133 HB2 SER 20 HB2 SER 20 1.504 -8.814 11.572
134 HB3 SER 20 HB3 SER 20 -0.144 -9.374 11.174
135 HG SER 20 HG SER 20 1.419 -11.081 11.684
136 H SER 21 H SER 21 -0.918 -10.475 9.445
137 HA SER 21 HA SER 21 -0.512 -11.965 7.241
138 HB2 SER 21 HB2 SER 21 -3.281 -11.140 8.118
139 HB3 SER 21 HB3 SER 21 -2.729 -12.728 7.546
140 HG SER 21 HG SER 21 -2.057 -13.194 9.499
141 H CYS 22 H CYS 22 -1.783 -8.685 7.153
142 HA CYS 22 HA CYS 22 -3.073 -8.799 4.639
143 HB2 CYS 22 HB2 CYS 22 -1.618 -6.416 5.861
144 HB3 CYS 22 HB3 CYS 22 -2.973 -6.380 4.717
145 HG CYS 22 HG CYS 22 -3.187 -6.048 7.730
146 H LEU 23 H LEU 23 0.352 -8.157 5.582
147 HA LEU 23 HA LEU 23 1.150 -7.528 2.885
148 HB2 LEU 23 HB2 LEU 23 3.229 -7.104 3.685
149 HB3 LEU 23 HB3 LEU 23 2.255 -6.791 5.101
150 HG LEU 23 HG LEU 23 2.880 -9.308 5.716
151 HD11 LEU 23 HD11 LEU 23 5.179 -9.865 5.056
152 HD12 LEU 23 HD12 LEU 23 5.205 -8.508 3.932
153 HD13 LEU 23 HD13 LEU 23 4.115 -9.890 3.654
154 HD21 LEU 23 HD21 LEU 23 4.806 -6.958 5.940
155 HD22 LEU 23 HD22 LEU 23 4.827 -8.417 6.948
156 HD23 LEU 23 HD23 LEU 23 3.449 -7.318 7.036
157 H ASP 24 H ASP 24 0.887 -10.401 4.933
158 HA ASP 24 HA ASP 24 2.363 -12.214 3.367
159 HB2 ASP 24 HB2 ASP 24 1.311 -12.500 5.731
160 HB3 ASP 24 HB3 ASP 24 -0.172 -12.929 4.888
161 H TYR 25 H TYR 25 -1.091 -11.220 3.189
162 HA TYR 25 HA TYR 25 -1.762 -12.945 0.985
163 HB2 TYR 25 HB2 TYR 25 -2.928 -10.206 1.630
164 HB3 TYR 25 HB3 TYR 25 -3.661 -11.431 0.614
165 HD1 TYR 25 HD1 TYR 25 -4.750 -9.924 3.139
166 HD2 TYR 25 HD2 TYR 25 -3.075 -13.864 2.522
167 HE1 TYR 25 HE1 TYR 25 -6.068 -10.773 5.026
168 HE2 TYR 25 HE2 TYR 25 -4.338 -14.701 4.432
169 HH TYR 25 HH TYR 25 -5.961 -14.222 5.989
170 H PHE 26 H PHE 26 -0.632 -9.519 1.159
171 HA PHE 26 HA PHE 26 -0.633 -9.028 -1.627
172 HB2 PHE 26 HB2 PHE 26 0.515 -7.801 0.810
173 HB3 PHE 26 HB3 PHE 26 1.451 -7.510 -0.618
174 HD1 PHE 26 HD1 PHE 26 0.603 -6.126 -2.438
175 HD2 PHE 26 HD2 PHE 26 -1.864 -7.067 0.928
176 HE1 PHE 26 HE1 PHE 26 -0.921 -4.262 -3.062
177 HE2 PHE 26 HE2 PHE 26 -3.439 -5.247 0.290
178 HZ PHE 26 HZ PHE 26 -2.965 -3.875 -1.728
179 H THR 27 H THR 27 2.013 -10.444 0.407
180 HA THR 27 HA THR 27 3.876 -10.489 -1.778
181 HB THR 27 HB THR 27 5.183 -12.044 -0.354
182 HG1 THR 27 HG1 THR 27 4.493 -12.812 1.449
183 HG21 THR 27 HG21 THR 27 5.458 -9.598 -0.056
184 HG22 THR 27 HG22 THR 27 5.706 -10.488 1.454
185 HG23 THR 27 HG23 THR 27 4.198 -9.624 1.212
186 H THR 28 H THR 28 1.619 -12.905 -0.375
187 HA THR 28 HA THR 28 2.307 -15.010 -2.115
188 HB THR 28 HB THR 28 -0.489 -14.551 -1.009
189 HG1 THR 28 HG1 THR 28 0.866 -14.325 0.705
190 HG21 THR 28 HG21 THR 28 -0.262 -16.494 -2.506
191 HG22 THR 28 HG22 THR 28 -0.421 -17.050 -0.829
192 HG23 THR 28 HG23 THR 28 1.167 -17.051 -1.608
193 H GLN 29 H GLN 29 -0.078 -12.330 -2.612
194 HA GLN 29 HA GLN 29 -0.965 -13.312 -5.169
195 HB2 GLN 29 HB2 GLN 29 -1.043 -10.591 -3.813
196 HB3 GLN 29 HB3 GLN 29 -1.808 -10.951 -5.372
197 HG2 GLN 29 HG2 GLN 29 -2.541 -12.534 -2.900
198 HG3 GLN 29 HG3 GLN 29 -3.325 -11.021 -3.317
199 HE21 GLN 29 HE21 GLN 29 -3.882 -14.239 -3.550
200 HE22 GLN 29 HE22 GLN 29 -4.750 -14.294 -5.075
201 H GLY 30 H GLY 30 1.826 -11.454 -4.138
202 HA2 GLY 30 HA2 GLY 30 3.681 -10.785 -5.273
203 HA3 GLY 30 HA3 GLY 30 3.117 -11.631 -6.712
204 H LEU 31 H LEU 31 1.399 -9.082 -4.961
205 HA LEU 31 HA LEU 31 1.827 -7.156 -7.221
206 HB2 LEU 31 HB2 LEU 31 -0.596 -6.460 -6.870
207 HB3 LEU 31 HB3 LEU 31 -0.268 -7.983 -7.679
208 HG LEU 31 HG LEU 31 -0.722 -9.195 -5.594
209 HD11 LEU 31 HD11 LEU 31 -2.032 -8.083 -3.776
210 HD12 LEU 31 HD12 LEU 31 -1.576 -6.518 -4.486
211 HD13 LEU 31 HD13 LEU 31 -0.330 -7.633 -3.858
212 HD21 LEU 31 HD21 LEU 31 -2.427 -9.046 -7.236
213 HD22 LEU 31 HD22 LEU 31 -2.969 -7.468 -6.606
214 HD23 LEU 31 HD23 LEU 31 -3.168 -8.955 -5.635
215 H THR 32 H THR 32 3.167 -7.333 -4.571
216 HA THR 32 HA THR 32 2.111 -4.960 -3.118
217 HB THR 32 HB THR 32 2.869 -6.581 -1.701
218 HG1 THR 32 HG1 THR 32 4.413 -5.887 -0.617
219 HG21 THR 32 HG21 THR 32 4.979 -7.903 -1.819
220 HG22 THR 32 HG22 THR 32 5.226 -7.280 -3.458
221 HG23 THR 32 HG23 THR 32 3.808 -8.301 -3.053
222 H THR 33 H THR 33 2.453 -2.925 -3.994
223 HA THR 33 HA THR 33 5.202 -2.237 -4.531
224 HB THR 33 HB THR 33 4.960 -2.833 -6.656
225 HG1 THR 33 HG1 THR 33 5.122 -0.699 -6.892
226 HG21 THR 33 HG21 THR 33 1.891 -2.558 -6.646
227 HG22 THR 33 HG22 THR 33 2.840 -4.057 -6.598
228 HG23 THR 33 HG23 THR 33 2.907 -3.084 -8.018
229 H ILE 34 H ILE 34 5.544 0.040 -4.516
230 HA ILE 34 HA ILE 34 3.488 1.545 -3.087
231 HB ILE 34 HB ILE 34 5.903 3.028 -3.995
232 HG12 ILE 34 HG12 ILE 34 6.899 0.834 -3.219
233 HG13 ILE 34 HG13 ILE 34 7.449 2.314 -2.496
234 HG21 ILE 34 HG21 ILE 34 4.167 4.117 -2.657
235 HG22 ILE 34 HG22 ILE 34 4.315 2.876 -1.383
236 HG23 ILE 34 HG23 ILE 34 5.655 3.985 -1.710
237 HD11 ILE 34 HD11 ILE 34 5.465 0.418 -1.174
238 HD12 ILE 34 HD12 ILE 34 7.209 0.596 -0.788
239 HD13 ILE 34 HD13 ILE 34 6.092 1.902 -0.447
240 H TYR 35 H TYR 35 5.231 2.002 -6.166
241 HA TYR 35 HA TYR 35 3.894 4.319 -6.997
242 HB2 TYR 35 HB2 TYR 35 5.297 2.203 -8.648
243 HB3 TYR 35 HB3 TYR 35 4.778 3.786 -9.238
244 HD1 TYR 35 HD1 TYR 35 7.341 1.996 -7.355
245 HD2 TYR 35 HD2 TYR 35 5.668 5.904 -8.126
246 HE1 TYR 35 HE1 TYR 35 9.274 3.041 -6.288
247 HE2 TYR 35 HE2 TYR 35 7.691 6.956 -7.190
248 HH TYR 35 HH TYR 35 9.785 6.591 -6.164
249 H GLN 36 H GLN 36 2.748 1.140 -6.893
250 HA GLN 36 HA GLN 36 0.786 1.542 -9.075
251 HB2 GLN 36 HB2 GLN 36 1.229 -0.644 -7.002
252 HB3 GLN 36 HB3 GLN 36 -0.130 -0.624 -8.100
253 HG2 GLN 36 HG2 GLN 36 2.720 -1.019 -8.872
254 HG3 GLN 36 HG3 GLN 36 1.320 -2.043 -9.200
255 HE21 GLN 36 HE21 GLN 36 3.543 -0.008 -10.504
256 HE22 GLN 36 HE22 GLN 36 2.652 0.603 -11.894
257 H ILE 37 H ILE 37 0.645 1.338 -5.439
258 HA ILE 37 HA ILE 37 -2.110 2.009 -5.441
259 HB ILE 37 HB ILE 37 -1.865 2.490 -3.046
260 HG12 ILE 37 HG12 ILE 37 1.026 1.610 -3.425
261 HG13 ILE 37 HG13 ILE 37 0.526 3.295 -3.151
262 HG21 ILE 37 HG21 ILE 37 -1.674 0.176 -2.493
263 HG22 ILE 37 HG22 ILE 37 -2.388 0.265 -4.093
264 HG23 ILE 37 HG23 ILE 37 -0.678 -0.151 -3.935
265 HD11 ILE 37 HD11 ILE 37 0.036 0.957 -1.287
266 HD12 ILE 37 HD12 ILE 37 1.247 2.247 -1.072
267 HD13 ILE 37 HD13 ILE 37 -0.479 2.647 -1.014
268 H GLU 38 H GLU 38 0.608 4.240 -5.838
269 HA GLU 38 HA GLU 38 -0.924 6.502 -4.910
270 HB2 GLU 38 HB2 GLU 38 0.575 7.911 -6.225
271 HB3 GLU 38 HB3 GLU 38 1.428 6.802 -5.138
272 HG2 GLU 38 HG2 GLU 38 2.047 5.374 -6.932
273 HG3 GLU 38 HG3 GLU 38 0.999 6.196 -8.081
274 H HIS 39 H HIS 39 -1.208 4.486 -7.753
275 HA HIS 39 HA HIS 39 -3.078 6.443 -9.003
276 HB2 HIS 39 HB2 HIS 39 -0.904 5.598 -10.163
277 HB3 HIS 39 HB3 HIS 39 -1.777 4.083 -10.342
278 HD1 HIS 39 HD1 HIS 39 -1.348 7.406 -11.948
279 HD2 HIS 39 HD2 HIS 39 -4.192 4.301 -11.838
280 HE1 HIS 39 HE1 HIS 39 -2.867 7.752 -13.966
281 H TYR 40 H TYR 40 -2.822 3.185 -7.575
282 HA TYR 40 HA TYR 40 -5.344 2.298 -8.677
283 HB2 TYR 40 HB2 TYR 40 -3.568 1.140 -6.497
284 HB3 TYR 40 HB3 TYR 40 -5.170 0.531 -6.799
285 HD1 TYR 40 HD1 TYR 40 -2.028 -0.714 -7.281
286 HD2 TYR 40 HD2 TYR 40 -5.467 0.512 -9.690
287 HE1 TYR 40 HE1 TYR 40 -1.366 -2.185 -9.103
288 HE2 TYR 40 HE2 TYR 40 -4.763 -0.999 -11.459
289 HH TYR 40 HH TYR 40 -2.834 -2.116 -12.278
290 H SER 41 H SER 41 -7.091 3.373 -8.252
291 HA SER 41 HA SER 41 -7.546 4.871 -5.839
292 HB2 SER 41 HB2 SER 41 -9.829 5.100 -7.246
293 HB3 SER 41 HB3 SER 41 -8.346 5.878 -7.833
294 HG SER 41 HG SER 41 -9.429 4.673 -9.495
295 H MET 42 H MET 42 -9.657 4.651 -4.745
296 HA MET 42 HA MET 42 -9.827 2.331 -3.289
297 HB2 MET 42 HB2 MET 42 -11.719 3.274 -2.273
298 HB3 MET 42 HB3 MET 42 -10.703 4.615 -2.769
299 HG2 MET 42 HG2 MET 42 -12.748 5.395 -3.413
300 HG3 MET 42 HG3 MET 42 -12.286 4.588 -4.911
301 HE1 MET 42 HE1 MET 42 -14.589 4.142 -5.948
302 HE2 MET 42 HE2 MET 42 -16.035 3.775 -4.986
303 HE3 MET 42 HE3 MET 42 -15.159 5.299 -4.719
304 H ASP 43 H ASP 43 -11.336 2.784 -6.417
305 HA ASP 43 HA ASP 43 -13.261 0.630 -6.181
306 HB2 ASP 43 HB2 ASP 43 -13.315 2.631 -7.707
307 HB3 ASP 43 HB3 ASP 43 -12.084 1.879 -8.705
308 H ASP 44 H ASP 44 -10.084 1.061 -7.734
309 HA ASP 44 HA ASP 44 -9.783 -1.541 -8.825
310 HB2 ASP 44 HB2 ASP 44 -8.420 0.888 -8.924
311 HB3 ASP 44 HB3 ASP 44 -7.298 -0.107 -8.014
312 H LEU 45 H LEU 45 -8.607 0.017 -5.874
313 HA LEU 45 HA LEU 45 -7.242 -2.135 -4.652
314 HB2 LEU 45 HB2 LEU 45 -8.816 0.118 -3.336
315 HB3 LEU 45 HB3 LEU 45 -7.672 -0.926 -2.491
316 HG LEU 45 HG LEU 45 -6.909 0.916 -4.787
317 HD11 LEU 45 HD11 LEU 45 -5.997 2.396 -3.130
318 HD12 LEU 45 HD12 LEU 45 -6.596 1.403 -1.783
319 HD13 LEU 45 HD13 LEU 45 -7.722 2.261 -2.849
320 HD21 LEU 45 HD21 LEU 45 -4.642 0.660 -4.015
321 HD22 LEU 45 HD22 LEU 45 -5.317 -0.895 -4.497
322 HD23 LEU 45 HD23 LEU 45 -5.163 -0.486 -2.765
323 H ALA 46 H ALA 46 -10.727 -1.149 -4.320
324 HA ALA 46 HA ALA 46 -11.412 -3.318 -2.603
325 HB1 ALA 46 HB1 ALA 46 -13.737 -2.828 -3.297
326 HB2 ALA 46 HB2 ALA 46 -12.841 -1.357 -2.862
327 HB3 ALA 46 HB3 ALA 46 -13.121 -1.746 -4.564
328 H SER 47 H SER 47 -11.348 -3.080 -6.195
329 HA SER 47 HA SER 47 -12.625 -5.591 -6.614
330 HB2 SER 47 HB2 SER 47 -11.980 -3.559 -8.277
331 HB3 SER 47 HB3 SER 47 -10.635 -4.653 -8.635
332 HG SER 47 HG SER 47 -13.411 -5.210 -8.698
333 H LEU 48 H LEU 48 -9.299 -4.755 -5.782
334 HA LEU 48 HA LEU 48 -8.220 -7.401 -6.382
335 HB2 LEU 48 HB2 LEU 48 -7.140 -5.034 -4.818
336 HB3 LEU 48 HB3 LEU 48 -6.233 -6.528 -5.023
337 HG LEU 48 HG LEU 48 -7.248 -4.881 -7.354
338 HD11 LEU 48 HD11 LEU 48 -4.509 -4.856 -6.061
339 HD12 LEU 48 HD12 LEU 48 -5.718 -3.535 -6.046
340 HD13 LEU 48 HD13 LEU 48 -4.967 -4.020 -7.568
341 HD21 LEU 48 HD21 LEU 48 -5.495 -6.133 -8.620
342 HD22 LEU 48 HD22 LEU 48 -6.786 -7.176 -8.019
343 HD23 LEU 48 HD23 LEU 48 -5.221 -7.142 -7.182
344 H LYS 49 H LYS 49 -10.572 -6.913 -4.414
345 HA LYS 49 HA LYS 49 -11.506 -7.868 -2.647
346 HB2 LYS 49 HB2 LYS 49 -9.332 -9.970 -2.847
347 HB3 LYS 49 HB3 LYS 49 -10.789 -10.056 -1.878
348 HG2 LYS 49 HG2 LYS 49 -11.487 -11.250 -3.684
349 HG3 LYS 49 HG3 LYS 49 -12.058 -9.645 -4.141
350 HD2 LYS 49 HD2 LYS 49 -10.020 -9.381 -5.581
351 HD3 LYS 49 HD3 LYS 49 -9.463 -10.974 -5.103
352 HE2 LYS 49 HE2 LYS 49 -12.226 -10.570 -6.318
353 HE3 LYS 49 HE3 LYS 49 -10.798 -10.566 -7.357
354 HZ1 LYS 49 HZ1 LYS 49 -11.443 -12.820 -5.546
355 HZ2 LYS 49 HZ2 LYS 49 -10.220 -12.725 -6.621
356 HZ3 LYS 49 HZ3 LYS 49 -11.770 -12.751 -7.177
357 H ILE 50 H ILE 50 -10.001 -5.668 -2.150
358 HA ILE 50 HA ILE 50 -8.685 -6.144 0.480
359 HB ILE 50 HB ILE 50 -8.754 -3.629 -1.199
360 HG12 ILE 50 HG12 ILE 50 -7.566 -5.357 -2.499
361 HG13 ILE 50 HG13 ILE 50 -6.470 -4.132 -1.903
362 HG21 ILE 50 HG21 ILE 50 -8.283 -3.465 1.283
363 HG22 ILE 50 HG22 ILE 50 -6.843 -4.426 1.007
364 HG23 ILE 50 HG23 ILE 50 -6.997 -2.846 0.218
365 HD11 ILE 50 HD11 ILE 50 -5.553 -6.427 -1.776
366 HD12 ILE 50 HD12 ILE 50 -5.641 -5.683 -0.175
367 HD13 ILE 50 HD13 ILE 50 -6.850 -6.888 -0.654
368 HA PRO 51 HA PRO 51 -13.004 -4.998 1.498
369 HB2 PRO 51 HB2 PRO 51 -13.009 -5.733 4.136
370 HB3 PRO 51 HB3 PRO 51 -13.165 -6.895 2.786
371 HG2 PRO 51 HG2 PRO 51 -10.660 -6.147 4.334
372 HG3 PRO 51 HG3 PRO 51 -11.268 -7.788 3.948
373 HD2 PRO 51 HD2 PRO 51 -9.362 -6.577 2.441
374 HD3 PRO 51 HD3 PRO 51 -10.637 -7.586 1.686
375 H GLU 52 H GLU 52 -13.903 -3.208 2.556
376 HA GLU 52 HA GLU 52 -12.457 -0.920 2.871
377 HB2 GLU 52 HB2 GLU 52 -14.980 -1.421 4.443
378 HB3 GLU 52 HB3 GLU 52 -14.313 0.115 3.891
379 HG2 GLU 52 HG2 GLU 52 -14.490 -0.856 1.517
380 HG3 GLU 52 HG3 GLU 52 -15.547 -2.085 2.213
381 H GLN 53 H GLN 53 -13.206 -3.147 5.536
382 HA GLN 53 HA GLN 53 -12.335 -1.685 7.726
383 HB2 GLN 53 HB2 GLN 53 -12.092 -3.836 8.855
384 HB3 GLN 53 HB3 GLN 53 -13.529 -3.803 7.837
385 HG2 GLN 53 HG2 GLN 53 -12.122 -5.046 6.069
386 HG3 GLN 53 HG3 GLN 53 -10.913 -5.277 7.327
387 HE21 GLN 53 HE21 GLN 53 -11.101 -7.458 8.104
388 HE22 GLN 53 HE22 GLN 53 -12.609 -8.263 8.290
389 H PHE 54 H PHE 54 -10.374 -2.853 5.192
390 HA PHE 54 HA PHE 54 -7.867 -2.303 6.717
391 HB2 PHE 54 HB2 PHE 54 -8.052 -4.705 6.344
392 HB3 PHE 54 HB3 PHE 54 -8.467 -4.455 4.650
393 HD1 PHE 54 HD1 PHE 54 -6.838 -3.928 3.025
394 HD2 PHE 54 HD2 PHE 54 -5.739 -4.135 7.166
395 HE1 PHE 54 HE1 PHE 54 -4.413 -3.743 2.385
396 HE2 PHE 54 HE2 PHE 54 -3.354 -3.953 6.566
397 HZ PHE 54 HZ PHE 54 -2.682 -3.731 4.200
398 H ARG 55 H ARG 55 -9.464 -2.391 3.487
399 HA ARG 55 HA ARG 55 -7.668 -1.095 1.898
400 HB2 ARG 55 HB2 ARG 55 -9.900 -2.113 1.321
401 HB3 ARG 55 HB3 ARG 55 -10.647 -0.601 1.843
402 HG2 ARG 55 HG2 ARG 55 -9.305 0.631 0.144
403 HG3 ARG 55 HG3 ARG 55 -8.545 -0.873 -0.343
404 HD2 ARG 55 HD2 ARG 55 -10.386 -0.152 -1.871
405 HD3 ARG 55 HD3 ARG 55 -10.582 -1.768 -1.203
406 HE ARG 55 HE ARG 55 -12.641 -1.095 -0.576
407 HH11 ARG 55 HH11 ARG 55 -10.620 1.888 -0.306
408 HH12 ARG 55 HH12 ARG 55 -11.978 2.847 0.092
409 HH21 ARG 55 HH21 ARG 55 -14.343 0.251 -0.144
410 HH22 ARG 55 HH22 ARG 55 -14.109 1.945 0.196
411 H HIS 56 H HIS 56 -10.058 0.507 4.091
412 HA HIS 56 HA HIS 56 -9.425 3.133 3.189
413 HB2 HIS 56 HB2 HIS 56 -11.454 2.475 4.526
414 HB3 HIS 56 HB3 HIS 56 -10.430 2.135 5.913
415 HD1 HIS 56 HD1 HIS 56 -12.056 5.051 4.087
416 HD2 HIS 56 HD2 HIS 56 -9.363 4.274 7.237
417 HE1 HIS 56 HE1 HIS 56 -11.855 7.211 5.398
418 H ALA 57 H ALA 57 -7.798 1.020 5.541
419 HA ALA 57 HA ALA 57 -6.219 3.107 6.739
420 HB1 ALA 57 HB1 ALA 57 -5.079 1.296 7.820
421 HB2 ALA 57 HB2 ALA 57 -6.822 0.905 7.782
422 HB3 ALA 57 HB3 ALA 57 -5.694 0.122 6.652
423 H ILE 58 H ILE 58 -5.548 0.609 4.131
424 HA ILE 58 HA ILE 58 -2.833 1.359 3.842
425 HB ILE 58 HB ILE 58 -3.341 -0.657 2.855
426 HG12 ILE 58 HG12 ILE 58 -3.080 -0.560 0.456
427 HG13 ILE 58 HG13 ILE 58 -3.648 1.103 0.358
428 HG21 ILE 58 HG21 ILE 58 -5.667 0.408 1.236
429 HG22 ILE 58 HG22 ILE 58 -5.106 -1.264 1.358
430 HG23 ILE 58 HG23 ILE 58 -5.803 -0.520 2.772
431 HD11 ILE 58 HD11 ILE 58 -0.986 0.211 0.558
432 HD12 ILE 58 HD12 ILE 58 -1.593 1.880 0.686
433 HD13 ILE 58 HD13 ILE 58 -1.343 0.922 2.148
434 H TRP 59 H TRP 59 -5.791 2.388 2.102
435 HA TRP 59 HA TRP 59 -4.437 4.216 0.425
436 HB2 TRP 59 HB2 TRP 59 -6.782 3.188 0.300
437 HB3 TRP 59 HB3 TRP 59 -7.309 4.508 1.338
438 HD1 TRP 59 HD1 TRP 59 -5.454 3.931 -1.961
439 HE1 TRP 59 HE1 TRP 59 -5.936 5.922 -3.604
440 HE3 TRP 59 HE3 TRP 59 -8.050 6.785 1.110
441 HZ2 TRP 59 HZ2 TRP 59 -7.553 8.354 -3.569
442 HZ3 TRP 59 HZ3 TRP 59 -9.205 8.956 0.360
443 HH2 TRP 59 HH2 TRP 59 -8.951 9.684 -2.003
444 H LYS 60 H LYS 60 -6.108 4.837 3.604
445 HA LYS 60 HA LYS 60 -5.433 7.605 3.575
446 HB2 LYS 60 HB2 LYS 60 -7.086 6.394 5.152
447 HB3 LYS 60 HB3 LYS 60 -5.660 5.941 6.107
448 HG2 LYS 60 HG2 LYS 60 -5.133 8.408 6.342
449 HG3 LYS 60 HG3 LYS 60 -6.495 8.768 5.295
450 HD2 LYS 60 HD2 LYS 60 -7.386 9.160 7.389
451 HD3 LYS 60 HD3 LYS 60 -7.967 7.552 7.020
452 HE2 LYS 60 HE2 LYS 60 -7.259 7.700 9.328
453 HE3 LYS 60 HE3 LYS 60 -6.197 6.570 8.474
454 HZ1 LYS 60 HZ1 LYS 60 -4.477 8.133 8.528
455 HZ2 LYS 60 HZ2 LYS 60 -5.155 8.263 10.012
456 HZ3 LYS 60 HZ3 LYS 60 -5.463 9.406 8.888
457 H GLY 61 H GLY 61 -3.567 4.746 4.720
458 HA2 GLY 61 HA2 GLY 61 -1.577 6.111 6.183
459 HA3 GLY 61 HA3 GLY 61 -1.397 4.564 5.371
460 H ILE 62 H ILE 62 -1.609 5.169 2.701
461 HA ILE 62 HA ILE 62 0.912 6.495 2.283
462 HB ILE 62 HB ILE 62 -0.279 4.563 1.110
463 HG12 ILE 62 HG12 ILE 62 2.020 5.014 0.726
464 HG13 ILE 62 HG13 ILE 62 1.251 4.688 -0.810
465 HG21 ILE 62 HG21 ILE 62 -1.062 6.683 -0.871
466 HG22 ILE 62 HG22 ILE 62 -1.084 4.940 -1.134
467 HG23 ILE 62 HG23 ILE 62 -2.157 5.640 0.075
468 HD11 ILE 62 HD11 ILE 62 2.808 6.482 -1.122
469 HD12 ILE 62 HD12 ILE 62 1.186 7.178 -1.259
470 HD13 ILE 62 HD13 ILE 62 2.140 7.401 0.230
471 H LEU 63 H LEU 63 -2.551 7.455 1.562
472 HA LEU 63 HA LEU 63 -1.713 9.890 0.315
473 HB2 LEU 63 HB2 LEU 63 -4.284 8.878 1.486
474 HB3 LEU 63 HB3 LEU 63 -4.083 10.619 1.355
475 HG LEU 63 HG LEU 63 -3.510 10.420 -1.056
476 HD11 LEU 63 HD11 LEU 63 -4.227 7.481 -0.652
477 HD12 LEU 63 HD12 LEU 63 -2.693 8.147 -1.255
478 HD13 LEU 63 HD13 LEU 63 -4.160 8.289 -2.226
479 HD21 LEU 63 HD21 LEU 63 -6.129 9.177 -0.175
480 HD22 LEU 63 HD22 LEU 63 -5.822 9.879 -1.774
481 HD23 LEU 63 HD23 LEU 63 -5.795 10.925 -0.340
482 H ASP 64 H ASP 64 -2.052 8.968 3.675
483 HA ASP 64 HA ASP 64 -1.922 11.717 4.712
484 HB2 ASP 64 HB2 ASP 64 -2.924 9.902 6.019
485 HB3 ASP 64 HB3 ASP 64 -1.370 9.080 6.123
486 H HIS 65 H HIS 65 0.384 9.152 4.074
487 HA HIS 65 HA HIS 65 2.686 10.353 5.271
488 HB2 HIS 65 HB2 HIS 65 2.682 7.979 4.816
489 HB3 HIS 65 HB3 HIS 65 2.317 8.238 3.120
490 HD1 HIS 65 HD1 HIS 65 5.243 9.733 5.239
491 HD2 HIS 65 HD2 HIS 65 4.335 7.588 1.724
492 HE1 HIS 65 HE1 HIS 65 7.452 9.419 4.009
493 H ARG 66 H ARG 66 1.659 10.123 1.825
494 HA ARG 66 HA ARG 66 3.667 11.996 0.980
495 HB2 ARG 66 HB2 ARG 66 2.537 12.043 -1.176
496 HB3 ARG 66 HB3 ARG 66 2.734 10.412 -0.566
497 HG2 ARG 66 HG2 ARG 66 0.576 10.122 -1.129
498 HG3 ARG 66 HG3 ARG 66 0.245 10.928 0.389
499 HD2 ARG 66 HD2 ARG 66 -0.920 12.437 -0.636
500 HD3 ARG 66 HD3 ARG 66 0.535 13.061 -1.387
501 HE ARG 66 HE ARG 66 -1.604 11.664 -2.711
502 HH11 ARG 66 HH11 ARG 66 1.817 12.411 -3.215
503 HH12 ARG 66 HH12 ARG 66 2.023 11.205 -4.460
504 HH21 ARG 66 HH21 ARG 66 -1.383 10.308 -4.603
505 HH22 ARG 66 HH22 ARG 66 0.203 10.265 -5.371
506 H GLN 67 H GLN 67 0.416 12.487 2.331
507 HA GLN 67 HA GLN 67 0.361 15.301 1.521
508 HB2 GLN 67 HB2 GLN 67 -1.238 13.687 3.528
509 HB3 GLN 67 HB3 GLN 67 -1.387 15.438 3.449
510 HG2 GLN 67 HG2 GLN 67 -2.261 15.463 1.281
511 HG3 GLN 67 HG3 GLN 67 -1.688 13.845 0.912
512 HE21 GLN 67 HE21 GLN 67 -3.853 13.391 0.153
513 HE22 GLN 67 HE22 GLN 67 -5.166 13.082 1.277
514 H LEU 68 H LEU 68 1.696 13.541 4.347
515 HA LEU 68 HA LEU 68 2.292 16.102 5.695
516 HB2 LEU 68 HB2 LEU 68 2.463 13.205 6.589
517 HB3 LEU 68 HB3 LEU 68 2.988 14.577 7.554
518 HG LEU 68 HG LEU 68 0.128 14.011 6.708
519 HD11 LEU 68 HD11 LEU 68 -0.237 13.778 9.107
520 HD12 LEU 68 HD12 LEU 68 1.457 14.219 9.453
521 HD13 LEU 68 HD13 LEU 68 1.068 12.706 8.617
522 HD21 LEU 68 HD21 LEU 68 1.371 16.461 8.001
523 HD22 LEU 68 HD22 LEU 68 -0.350 16.049 8.191
524 HD23 LEU 68 HD23 LEU 68 0.297 16.376 6.590
525 H HIS 69 H HIS 69 3.921 14.069 3.536
526 HA HIS 69 HA HIS 69 6.558 15.114 4.408
527 HB2 HIS 69 HB2 HIS 69 6.093 12.625 4.867
528 HB3 HIS 69 HB3 HIS 69 6.036 12.403 3.116
529 HD1 HIS 69 HD1 HIS 69 8.535 13.714 5.802
530 HD2 HIS 69 HD2 HIS 69 8.373 11.941 1.975
531 HE1 HIS 69 HE1 HIS 69 10.943 13.204 5.146
532 H ASP 70 H ASP 70 8.016 14.343 2.199
533 HA ASP 70 HA ASP 70 6.692 15.237 -0.256
534 HB2 ASP 70 HB2 ASP 70 7.440 17.335 0.836
535 HB3 ASP 70 HB3 ASP 70 9.048 16.687 1.044
Start of MODEL 8
1 H1 GLY 1 H GLY 1 8.343 -15.199 -7.658
2 HA2 GLY 1 HA2 GLY 1 9.810 -13.832 -6.175
3 HA3 GLY 1 HA3 GLY 1 10.657 -14.565 -7.548
4 HA PRO 2 HA PRO 2 10.108 -9.848 -8.421
5 HB2 PRO 2 HB2 PRO 2 10.522 -8.213 -6.259
6 HB3 PRO 2 HB3 PRO 2 8.916 -8.846 -6.723
7 HG2 PRO 2 HG2 PRO 2 10.789 -9.882 -4.587
8 HG3 PRO 2 HG3 PRO 2 9.024 -9.650 -4.486
9 HD2 PRO 2 HD2 PRO 2 10.254 -12.075 -5.009
10 HD3 PRO 2 HD3 PRO 2 8.625 -11.658 -5.599
11 H LEU 3 H LEU 3 11.954 -8.373 -8.794
12 HA LEU 3 HA LEU 3 14.517 -9.091 -7.536
13 HB2 LEU 3 HB2 LEU 3 13.934 -10.542 -9.669
14 HB3 LEU 3 HB3 LEU 3 14.274 -9.082 -10.573
15 HG LEU 3 HG LEU 3 16.117 -10.707 -10.482
16 HD11 LEU 3 HD11 LEU 3 17.086 -8.253 -8.987
17 HD12 LEU 3 HD12 LEU 3 16.601 -8.228 -10.705
18 HD13 LEU 3 HD13 LEU 3 17.933 -9.251 -10.161
19 HD21 LEU 3 HD21 LEU 3 15.614 -11.551 -8.167
20 HD22 LEU 3 HD22 LEU 3 16.464 -10.124 -7.522
21 HD23 LEU 3 HD23 LEU 3 17.320 -11.295 -8.534
22 H GLY 4 H GLY 4 15.850 -7.268 -7.418
23 HA2 GLY 4 HA2 GLY 4 16.627 -5.148 -7.875
24 HA3 GLY 4 HA3 GLY 4 15.387 -4.927 -9.128
25 H SER 5 H SER 5 13.072 -4.906 -8.182
26 HA SER 5 HA SER 5 12.841 -2.811 -6.225
27 HB2 SER 5 HB2 SER 5 10.295 -3.463 -6.674
28 HB3 SER 5 HB3 SER 5 11.274 -2.561 -7.823
29 HG SER 5 HG SER 5 10.204 -4.178 -8.886
30 H THR 6 H THR 6 13.927 -5.571 -5.361
31 HA THR 6 HA THR 6 12.060 -6.659 -3.497
32 HB THR 6 HB THR 6 14.286 -7.775 -2.747
33 HG1 THR 6 HG1 THR 6 15.952 -7.562 -4.001
34 HG21 THR 6 HG21 THR 6 14.302 -9.240 -4.773
35 HG22 THR 6 HG22 THR 6 13.241 -8.073 -5.597
36 HG23 THR 6 HG23 THR 6 12.680 -8.932 -4.145
37 H ASP 7 H ASP 7 13.915 -3.807 -3.515
38 HA ASP 7 HA ASP 7 14.409 -3.612 -0.649
39 HB2 ASP 7 HB2 ASP 7 15.584 -1.617 -1.265
40 HB3 ASP 7 HB3 ASP 7 16.026 -2.872 -2.416
41 H CYS 8 H CYS 8 12.418 -2.012 -3.138
42 HA CYS 8 HA CYS 8 10.769 -0.681 -1.036
43 HB2 CYS 8 HB2 CYS 8 11.411 0.092 -3.912
44 HB3 CYS 8 HB3 CYS 8 10.238 0.927 -2.888
45 HG CYS 8 HG CYS 8 13.532 0.623 -2.658
46 H SER 9 H SER 9 9.072 -2.053 -0.689
47 HA SER 9 HA SER 9 7.195 -2.611 -2.847
48 HB2 SER 9 HB2 SER 9 8.831 -4.666 -1.320
49 HB3 SER 9 HB3 SER 9 7.205 -5.049 -1.872
50 HG SER 9 HG SER 9 9.281 -4.095 -3.593
51 H ILE 10 H ILE 10 5.112 -3.291 -1.806
52 HA ILE 10 HA ILE 10 4.249 -1.674 0.272
53 HB ILE 10 HB ILE 10 3.239 -4.357 -0.723
54 HG12 ILE 10 HG12 ILE 10 3.187 -2.269 -2.139
55 HG13 ILE 10 HG13 ILE 10 1.673 -3.146 -1.989
56 HG21 ILE 10 HG21 ILE 10 2.307 -4.357 1.465
57 HG22 ILE 10 HG22 ILE 10 1.816 -2.666 1.339
58 HG23 ILE 10 HG23 ILE 10 1.027 -3.910 0.343
59 HD11 ILE 10 HD11 ILE 10 1.380 -0.732 -1.934
60 HD12 ILE 10 HD12 ILE 10 0.853 -1.439 -0.403
61 HD13 ILE 10 HD13 ILE 10 2.429 -0.602 -0.510
62 H VAL 11 H VAL 11 5.823 -4.748 0.499
63 HA VAL 11 HA VAL 11 5.115 -5.501 3.138
64 HB VAL 11 HB VAL 11 7.402 -6.494 3.359
65 HG11 VAL 11 HG11 VAL 11 5.902 -7.195 0.791
66 HG12 VAL 11 HG12 VAL 11 6.982 -8.269 1.708
67 HG13 VAL 11 HG13 VAL 11 5.453 -7.734 2.421
68 HG21 VAL 11 HG21 VAL 11 8.744 -5.047 1.917
69 HG22 VAL 11 HG22 VAL 11 8.802 -6.704 1.362
70 HG23 VAL 11 HG23 VAL 11 7.796 -5.541 0.492
71 H SER 12 H SER 12 7.802 -3.230 2.278
72 HA SER 12 HA SER 12 8.473 -2.719 4.998
73 HB2 SER 12 HB2 SER 12 9.843 -2.376 2.894
74 HB3 SER 12 HB3 SER 12 8.922 -0.893 2.609
75 HG SER 12 HG SER 12 10.944 -0.655 3.710
76 H PHE 13 H PHE 13 6.155 -1.166 2.771
77 HA PHE 13 HA PHE 13 5.600 1.086 4.502
78 HB2 PHE 13 HB2 PHE 13 4.995 1.228 2.181
79 HB3 PHE 13 HB3 PHE 13 4.004 -0.220 2.277
80 HD1 PHE 13 HD1 PHE 13 2.026 0.756 1.355
81 HD2 PHE 13 HD2 PHE 13 3.872 2.602 4.784
82 HE1 PHE 13 HE1 PHE 13 -0.048 2.127 1.769
83 HE2 PHE 13 HE2 PHE 13 1.820 3.938 5.167
84 HZ PHE 13 HZ PHE 13 -0.162 3.600 3.708
85 H PHE 14 H PHE 14 4.032 -2.075 4.058
86 HA PHE 14 HA PHE 14 2.019 -1.827 6.050
87 HB2 PHE 14 HB2 PHE 14 3.316 -4.061 4.480
88 HB3 PHE 14 HB3 PHE 14 2.341 -4.474 5.857
89 HD1 PHE 14 HD1 PHE 14 0.906 -5.704 4.318
90 HD2 PHE 14 HD2 PHE 14 1.278 -1.422 4.010
91 HE1 PHE 14 HE1 PHE 14 -1.169 -5.606 2.936
92 HE2 PHE 14 HE2 PHE 14 -0.789 -1.319 2.750
93 HZ PHE 14 HZ PHE 14 -2.051 -3.419 2.197
94 H ALA 15 H ALA 15 5.355 -3.092 6.230
95 HA ALA 15 HA ALA 15 5.230 -4.065 8.870
96 HB1 ALA 15 HB1 ALA 15 7.119 -4.490 7.321
97 HB2 ALA 15 HB2 ALA 15 7.589 -2.782 7.419
98 HB3 ALA 15 HB3 ALA 15 7.670 -3.811 8.865
99 H ARG 16 H ARG 16 6.179 -0.823 7.639
100 HA ARG 16 HA ARG 16 6.437 0.396 10.145
101 HB2 ARG 16 HB2 ARG 16 5.760 1.543 7.430
102 HB3 ARG 16 HB3 ARG 16 5.882 2.547 8.868
103 HG2 ARG 16 HG2 ARG 16 8.214 0.990 9.021
104 HG3 ARG 16 HG3 ARG 16 8.021 1.227 7.291
105 HD2 ARG 16 HD2 ARG 16 9.463 2.937 8.356
106 HD3 ARG 16 HD3 ARG 16 8.017 3.668 7.628
107 HE ARG 16 HE ARG 16 7.634 2.953 10.398
108 HH11 ARG 16 HH11 ARG 16 9.395 5.499 8.569
109 HH12 ARG 16 HH12 ARG 16 8.846 6.734 9.663
110 HH21 ARG 16 HH21 ARG 16 6.941 4.620 11.706
111 HH22 ARG 16 HH22 ARG 16 7.507 6.267 11.415
112 H LEU 17 H LEU 17 3.485 0.102 8.156
113 HA LEU 17 HA LEU 17 1.792 1.654 9.893
114 HB2 LEU 17 HB2 LEU 17 1.035 -0.782 8.206
115 HB3 LEU 17 HB3 LEU 17 -0.125 0.247 9.026
116 HG LEU 17 HG LEU 17 1.698 1.072 6.776
117 HD11 LEU 17 HD11 LEU 17 -0.357 1.181 5.431
118 HD12 LEU 17 HD12 LEU 17 -1.314 0.632 6.827
119 HD13 LEU 17 HD13 LEU 17 -0.114 -0.445 6.082
120 HD21 LEU 17 HD21 LEU 17 -0.473 2.626 8.272
121 HD22 LEU 17 HD22 LEU 17 0.248 3.159 6.741
122 HD23 LEU 17 HD23 LEU 17 1.259 3.030 8.182
123 H GLY 18 H GLY 18 2.686 -1.783 9.926
124 HA2 GLY 18 HA2 GLY 18 2.959 -2.893 12.071
125 HA3 GLY 18 HA3 GLY 18 1.480 -2.130 12.641
126 H CYS 19 H CYS 19 1.396 -3.202 9.285
127 HA CYS 19 HA CYS 19 -0.781 -5.016 9.785
128 HB2 CYS 19 HB2 CYS 19 1.005 -4.857 7.363
129 HB3 CYS 19 HB3 CYS 19 -0.627 -5.528 7.441
130 HG CYS 19 HG CYS 19 -1.494 -3.025 8.543
131 H SER 20 H SER 20 -0.836 -7.291 9.094
132 HA SER 20 HA SER 20 1.626 -8.837 9.703
133 HB2 SER 20 HB2 SER 20 0.198 -8.686 11.700
134 HB3 SER 20 HB3 SER 20 -1.177 -9.312 10.803
135 HG SER 20 HG SER 20 1.193 -10.839 10.816
136 H SER 21 H SER 21 -1.190 -10.747 9.153
137 HA SER 21 HA SER 21 -0.347 -11.947 6.873
138 HB2 SER 21 HB2 SER 21 -3.243 -11.478 7.658
139 HB3 SER 21 HB3 SER 21 -2.611 -12.807 6.663
140 HG SER 21 HG SER 21 -1.551 -13.626 8.351
141 H CYS 22 H CYS 22 -1.809 -8.774 6.895
142 HA CYS 22 HA CYS 22 -2.830 -8.845 4.216
143 HB2 CYS 22 HB2 CYS 22 -1.693 -6.435 5.718
144 HB3 CYS 22 HB3 CYS 22 -2.777 -6.397 4.320
145 HG CYS 22 HG CYS 22 -3.472 -7.906 7.220
146 H LEU 23 H LEU 23 0.464 -8.367 5.516
147 HA LEU 23 HA LEU 23 1.596 -7.473 3.050
148 HB2 LEU 23 HB2 LEU 23 3.616 -7.449 4.137
149 HB3 LEU 23 HB3 LEU 23 2.515 -7.278 5.480
150 HG LEU 23 HG LEU 23 2.815 -9.946 5.665
151 HD11 LEU 23 HD11 LEU 23 5.477 -9.087 4.424
152 HD12 LEU 23 HD12 LEU 23 4.298 -10.125 3.597
153 HD13 LEU 23 HD13 LEU 23 5.065 -10.685 5.082
154 HD21 LEU 23 HD21 LEU 23 4.694 -9.583 7.204
155 HD22 LEU 23 HD22 LEU 23 3.403 -8.403 7.417
156 HD23 LEU 23 HD23 LEU 23 4.889 -7.933 6.558
157 H ASP 24 H ASP 24 1.088 -10.586 4.616
158 HA ASP 24 HA ASP 24 2.544 -12.301 2.933
159 HB2 ASP 24 HB2 ASP 24 1.743 -12.939 5.124
160 HB3 ASP 24 HB3 ASP 24 0.071 -12.928 4.559
161 H TYR 25 H TYR 25 -0.916 -11.417 2.943
162 HA TYR 25 HA TYR 25 -1.624 -12.909 0.634
163 HB2 TYR 25 HB2 TYR 25 -2.848 -10.346 1.744
164 HB3 TYR 25 HB3 TYR 25 -3.623 -11.433 0.601
165 HD1 TYR 25 HD1 TYR 25 -4.286 -10.474 3.654
166 HD2 TYR 25 HD2 TYR 25 -2.867 -14.143 1.850
167 HE1 TYR 25 HE1 TYR 25 -5.295 -11.773 5.485
168 HE2 TYR 25 HE2 TYR 25 -3.854 -15.425 3.700
169 HH TYR 25 HH TYR 25 -5.769 -13.977 6.337
170 H PHE 26 H PHE 26 -0.582 -9.426 0.919
171 HA PHE 26 HA PHE 26 -0.788 -8.845 -1.839
172 HB2 PHE 26 HB2 PHE 26 0.638 -7.793 0.554
173 HB3 PHE 26 HB3 PHE 26 1.465 -7.484 -0.951
174 HD1 PHE 26 HD1 PHE 26 0.618 -6.005 -2.625
175 HD2 PHE 26 HD2 PHE 26 -1.657 -6.817 0.924
176 HE1 PHE 26 HE1 PHE 26 -0.592 -3.885 -2.963
177 HE2 PHE 26 HE2 PHE 26 -2.949 -4.808 0.564
178 HZ PHE 26 HZ PHE 26 -2.404 -3.247 -1.359
179 H THR 27 H THR 27 2.001 -10.115 -0.033
180 HA THR 27 HA THR 27 3.769 -10.147 -2.293
181 HB THR 27 HB THR 27 4.415 -9.783 0.050
182 HG1 THR 27 HG1 THR 27 5.836 -11.841 -1.246
183 HG21 THR 27 HG21 THR 27 4.324 -12.801 0.381
184 HG22 THR 27 HG22 THR 27 3.290 -11.602 1.175
185 HG23 THR 27 HG23 THR 27 5.006 -11.601 1.514
186 H THR 28 H THR 28 1.884 -12.792 -0.744
187 HA THR 28 HA THR 28 2.827 -14.797 -2.450
188 HB THR 28 HB THR 28 0.068 -14.471 -1.182
189 HG1 THR 28 HG1 THR 28 1.493 -14.471 0.435
190 HG21 THR 28 HG21 THR 28 1.554 -16.976 -2.109
191 HG22 THR 28 HG22 THR 28 0.079 -16.317 -2.847
192 HG23 THR 28 HG23 THR 28 0.036 -16.943 -1.192
193 H GLN 29 H GLN 29 0.206 -12.337 -2.996
194 HA GLN 29 HA GLN 29 -0.564 -13.485 -5.540
195 HB2 GLN 29 HB2 GLN 29 -0.972 -10.791 -4.206
196 HB3 GLN 29 HB3 GLN 29 -1.719 -11.256 -5.753
197 HG2 GLN 29 HG2 GLN 29 -2.864 -13.139 -4.681
198 HG3 GLN 29 HG3 GLN 29 -2.111 -12.738 -3.127
199 HE21 GLN 29 HE21 GLN 29 -2.671 -10.741 -2.109
200 HE22 GLN 29 HE22 GLN 29 -4.133 -9.825 -2.557
201 H GLY 30 H GLY 30 2.117 -11.442 -4.619
202 HA2 GLY 30 HA2 GLY 30 3.799 -10.542 -5.913
203 HA3 GLY 30 HA3 GLY 30 3.141 -11.420 -7.304
204 H LEU 31 H LEU 31 1.509 -8.967 -5.272
205 HA LEU 31 HA LEU 31 1.521 -7.049 -7.555
206 HB2 LEU 31 HB2 LEU 31 -0.860 -6.475 -6.951
207 HB3 LEU 31 HB3 LEU 31 -0.571 -7.991 -7.781
208 HG LEU 31 HG LEU 31 -0.717 -9.168 -5.583
209 HD11 LEU 31 HD11 LEU 31 -1.970 -8.040 -3.748
210 HD12 LEU 31 HD12 LEU 31 -1.663 -6.482 -4.549
211 HD13 LEU 31 HD13 LEU 31 -0.312 -7.487 -3.960
212 HD21 LEU 31 HD21 LEU 31 -2.501 -9.218 -7.118
213 HD22 LEU 31 HD22 LEU 31 -3.107 -7.629 -6.586
214 HD23 LEU 31 HD23 LEU 31 -3.176 -9.031 -5.490
215 H THR 32 H THR 32 3.019 -7.294 -4.933
216 HA THR 32 HA THR 32 2.085 -4.910 -3.440
217 HB THR 32 HB THR 32 2.935 -6.212 -1.791
218 HG1 THR 32 HG1 THR 32 5.377 -5.505 -3.008
219 HG21 THR 32 HG21 THR 32 4.478 -8.080 -1.999
220 HG22 THR 32 HG22 THR 32 4.734 -7.721 -3.728
221 HG23 THR 32 HG23 THR 32 3.148 -8.247 -3.147
222 H THR 33 H THR 33 2.617 -2.796 -4.113
223 HA THR 33 HA THR 33 5.404 -2.474 -4.499
224 HB THR 33 HB THR 33 5.223 -2.794 -6.788
225 HG1 THR 33 HG1 THR 33 5.002 -1.023 -7.863
226 HG21 THR 33 HG21 THR 33 3.118 -2.775 -8.127
227 HG22 THR 33 HG22 THR 33 2.188 -2.400 -6.633
228 HG23 THR 33 HG23 THR 33 3.059 -3.913 -6.815
229 H ILE 34 H ILE 34 6.053 -0.294 -4.340
230 HA ILE 34 HA ILE 34 4.246 1.342 -2.701
231 HB ILE 34 HB ILE 34 7.049 2.013 -3.703
232 HG12 ILE 34 HG12 ILE 34 7.164 -0.076 -2.420
233 HG13 ILE 34 HG13 ILE 34 7.960 1.254 -1.621
234 HG21 ILE 34 HG21 ILE 34 5.959 4.004 -2.884
235 HG22 ILE 34 HG22 ILE 34 5.337 3.163 -1.450
236 HG23 ILE 34 HG23 ILE 34 7.077 3.474 -1.624
237 HD11 ILE 34 HD11 ILE 34 5.250 0.081 -0.864
238 HD12 ILE 34 HD12 ILE 34 6.763 0.057 0.079
239 HD13 ILE 34 HD13 ILE 34 5.911 1.553 -0.124
240 H TYR 35 H TYR 35 5.880 1.590 -5.803
241 HA TYR 35 HA TYR 35 5.046 4.143 -6.604
242 HB2 TYR 35 HB2 TYR 35 5.691 1.828 -8.459
243 HB3 TYR 35 HB3 TYR 35 6.013 3.539 -8.691
244 HD1 TYR 35 HD1 TYR 35 7.108 0.421 -7.016
245 HD2 TYR 35 HD2 TYR 35 8.007 4.600 -7.592
246 HE1 TYR 35 HE1 TYR 35 9.333 0.094 -5.975
247 HE2 TYR 35 HE2 TYR 35 10.270 4.250 -6.674
248 HH TYR 35 HH TYR 35 11.770 2.667 -5.626
249 H GLN 36 H GLN 36 3.373 1.052 -6.727
250 HA GLN 36 HA GLN 36 1.507 2.017 -8.816
251 HB2 GLN 36 HB2 GLN 36 1.485 -0.492 -7.116
252 HB3 GLN 36 HB3 GLN 36 0.209 -0.047 -8.246
253 HG2 GLN 36 HG2 GLN 36 3.052 -0.632 -9.042
254 HG3 GLN 36 HG3 GLN 36 1.624 -1.651 -9.314
255 HE21 GLN 36 HE21 GLN 36 3.428 -0.821 -11.318
256 HE22 GLN 36 HE22 GLN 36 2.659 0.370 -12.380
257 H ILE 37 H ILE 37 1.317 1.497 -5.239
258 HA ILE 37 HA ILE 37 -1.417 2.192 -5.131
259 HB ILE 37 HB ILE 37 -1.062 2.620 -2.714
260 HG12 ILE 37 HG12 ILE 37 1.770 1.657 -3.210
261 HG13 ILE 37 HG13 ILE 37 1.338 3.354 -2.970
262 HG21 ILE 37 HG21 ILE 37 -0.004 -0.018 -3.819
263 HG22 ILE 37 HG22 ILE 37 -0.788 0.248 -2.246
264 HG23 ILE 37 HG23 ILE 37 -1.717 0.461 -3.713
265 HD11 ILE 37 HD11 ILE 37 2.171 2.248 -0.921
266 HD12 ILE 37 HD12 ILE 37 0.516 2.893 -0.736
267 HD13 ILE 37 HD13 ILE 37 0.763 1.167 -0.947
268 H GLU 38 H GLU 38 1.271 4.273 -5.713
269 HA GLU 38 HA GLU 38 0.193 6.693 -4.707
270 HB2 GLU 38 HB2 GLU 38 2.005 6.097 -7.074
271 HB3 GLU 38 HB3 GLU 38 1.648 7.737 -6.496
272 HG2 GLU 38 HG2 GLU 38 2.663 7.329 -4.367
273 HG3 GLU 38 HG3 GLU 38 2.801 5.602 -4.673
274 H HIS 39 H HIS 39 -0.731 4.723 -7.493
275 HA HIS 39 HA HIS 39 -2.665 6.831 -8.336
276 HB2 HIS 39 HB2 HIS 39 -0.865 6.439 -9.973
277 HB3 HIS 39 HB3 HIS 39 -1.338 4.746 -10.056
278 HD1 HIS 39 HD1 HIS 39 -2.761 8.269 -10.988
279 HD2 HIS 39 HD2 HIS 39 -3.353 4.134 -11.689
280 HE1 HIS 39 HE1 HIS 39 -4.460 8.083 -12.846
281 H TYR 40 H TYR 40 -2.340 3.484 -7.235
282 HA TYR 40 HA TYR 40 -4.893 2.591 -8.238
283 HB2 TYR 40 HB2 TYR 40 -3.131 1.580 -5.982
284 HB3 TYR 40 HB3 TYR 40 -4.701 0.913 -6.310
285 HD1 TYR 40 HD1 TYR 40 -1.626 -0.313 -6.447
286 HD2 TYR 40 HD2 TYR 40 -4.824 0.642 -9.240
287 HE1 TYR 40 HE1 TYR 40 -1.037 -2.235 -7.831
288 HE2 TYR 40 HE2 TYR 40 -4.167 -1.264 -10.624
289 HH TYR 40 HH TYR 40 -2.721 -3.097 -10.867
290 H SER 41 H SER 41 -6.784 3.567 -7.709
291 HA SER 41 HA SER 41 -7.116 5.063 -5.250
292 HB2 SER 41 HB2 SER 41 -9.311 4.189 -7.154
293 HB3 SER 41 HB3 SER 41 -9.267 5.615 -6.106
294 HG SER 41 HG SER 41 -7.778 5.074 -8.452
295 H MET 42 H MET 42 -9.372 4.613 -4.079
296 HA MET 42 HA MET 42 -9.175 2.142 -2.713
297 HB2 MET 42 HB2 MET 42 -11.011 2.848 -1.454
298 HB3 MET 42 HB3 MET 42 -10.135 4.316 -1.839
299 HG2 MET 42 HG2 MET 42 -12.706 3.289 -3.103
300 HG3 MET 42 HG3 MET 42 -12.534 4.669 -2.035
301 HE1 MET 42 HE1 MET 42 -10.941 7.403 -4.287
302 HE2 MET 42 HE2 MET 42 -11.808 7.071 -2.770
303 HE3 MET 42 HE3 MET 42 -10.196 6.376 -3.042
304 H ASP 43 H ASP 43 -10.741 3.023 -5.649
305 HA ASP 43 HA ASP 43 -12.786 1.063 -5.891
306 HB2 ASP 43 HB2 ASP 43 -12.656 3.080 -7.282
307 HB3 ASP 43 HB3 ASP 43 -11.096 2.575 -7.947
308 H ASP 44 H ASP 44 -9.396 1.163 -7.086
309 HA ASP 44 HA ASP 44 -9.414 -1.474 -8.243
310 HB2 ASP 44 HB2 ASP 44 -7.261 0.516 -7.478
311 HB3 ASP 44 HB3 ASP 44 -6.834 -1.159 -7.787
312 H LEU 45 H LEU 45 -8.396 -0.122 -5.094
313 HA LEU 45 HA LEU 45 -7.349 -2.461 -3.913
314 HB2 LEU 45 HB2 LEU 45 -8.846 -0.071 -2.766
315 HB3 LEU 45 HB3 LEU 45 -8.410 -1.403 -1.722
316 HG LEU 45 HG LEU 45 -6.348 0.110 -3.359
317 HD11 LEU 45 HD11 LEU 45 -7.340 0.550 -0.488
318 HD12 LEU 45 HD12 LEU 45 -7.321 1.722 -1.823
319 HD13 LEU 45 HD13 LEU 45 -5.806 1.176 -1.115
320 HD21 LEU 45 HD21 LEU 45 -4.811 -0.882 -1.738
321 HD22 LEU 45 HD22 LEU 45 -5.731 -2.177 -2.500
322 HD23 LEU 45 HD23 LEU 45 -6.186 -1.618 -0.859
323 H ALA 46 H ALA 46 -10.720 -1.246 -3.830
324 HA ALA 46 HA ALA 46 -11.849 -3.395 -2.389
325 HB1 ALA 46 HB1 ALA 46 -12.950 -1.229 -2.857
326 HB2 ALA 46 HB2 ALA 46 -13.090 -1.669 -4.562
327 HB3 ALA 46 HB3 ALA 46 -13.986 -2.596 -3.336
328 H SER 47 H SER 47 -11.280 -3.001 -5.907
329 HA SER 47 HA SER 47 -12.695 -5.343 -6.687
330 HB2 SER 47 HB2 SER 47 -11.728 -3.257 -8.019
331 HB3 SER 47 HB3 SER 47 -10.303 -4.289 -8.201
332 HG SER 47 HG SER 47 -12.995 -5.025 -8.846
333 H LEU 48 H LEU 48 -9.389 -4.851 -5.474
334 HA LEU 48 HA LEU 48 -8.562 -7.604 -6.043
335 HB2 LEU 48 HB2 LEU 48 -7.227 -5.344 -4.511
336 HB3 LEU 48 HB3 LEU 48 -6.494 -6.926 -4.787
337 HG LEU 48 HG LEU 48 -7.230 -4.955 -6.980
338 HD11 LEU 48 HD11 LEU 48 -4.554 -5.850 -5.811
339 HD12 LEU 48 HD12 LEU 48 -5.344 -4.271 -5.573
340 HD13 LEU 48 HD13 LEU 48 -4.782 -4.748 -7.187
341 HD21 LEU 48 HD21 LEU 48 -5.825 -7.662 -7.134
342 HD22 LEU 48 HD22 LEU 48 -5.897 -6.453 -8.436
343 HD23 LEU 48 HD23 LEU 48 -7.383 -7.221 -7.883
344 H LYS 49 H LYS 49 -10.934 -7.481 -4.451
345 HA LYS 49 HA LYS 49 -11.927 -8.425 -2.762
346 HB2 LYS 49 HB2 LYS 49 -9.838 -10.134 -3.451
347 HB3 LYS 49 HB3 LYS 49 -9.560 -9.915 -1.736
348 HG2 LYS 49 HG2 LYS 49 -11.004 -11.728 -1.743
349 HG3 LYS 49 HG3 LYS 49 -12.126 -10.368 -1.534
350 HD2 LYS 49 HD2 LYS 49 -12.384 -10.387 -4.086
351 HD3 LYS 49 HD3 LYS 49 -11.442 -11.874 -4.101
352 HE2 LYS 49 HE2 LYS 49 -13.857 -12.363 -4.157
353 HE3 LYS 49 HE3 LYS 49 -13.114 -13.017 -2.689
354 HZ1 LYS 49 HZ1 LYS 49 -15.247 -11.822 -2.322
355 HZ2 LYS 49 HZ2 LYS 49 -14.541 -10.440 -2.849
356 HZ3 LYS 49 HZ3 LYS 49 -14.010 -11.139 -1.471
357 H ILE 50 H ILE 50 -9.735 -6.192 -2.075
358 HA ILE 50 HA ILE 50 -9.270 -6.442 0.756
359 HB ILE 50 HB ILE 50 -9.281 -3.936 -0.931
360 HG12 ILE 50 HG12 ILE 50 -7.770 -5.567 -2.010
361 HG13 ILE 50 HG13 ILE 50 -6.835 -4.348 -1.217
362 HG21 ILE 50 HG21 ILE 50 -9.170 -3.605 1.535
363 HG22 ILE 50 HG22 ILE 50 -7.724 -4.615 1.527
364 HG23 ILE 50 HG23 ILE 50 -7.704 -3.069 0.671
365 HD11 ILE 50 HD11 ILE 50 -6.334 -5.919 0.659
366 HD12 ILE 50 HD12 ILE 50 -7.349 -7.154 -0.119
367 HD13 ILE 50 HD13 ILE 50 -5.875 -6.581 -0.900
368 HA PRO 51 HA PRO 51 -13.506 -5.239 1.906
369 HB2 PRO 51 HB2 PRO 51 -13.303 -5.428 4.605
370 HB3 PRO 51 HB3 PRO 51 -13.313 -6.881 3.559
371 HG2 PRO 51 HG2 PRO 51 -10.936 -5.475 4.773
372 HG3 PRO 51 HG3 PRO 51 -11.275 -7.223 4.756
373 HD2 PRO 51 HD2 PRO 51 -9.621 -6.012 2.926
374 HD3 PRO 51 HD3 PRO 51 -10.635 -7.429 2.496
375 H GLU 52 H GLU 52 -14.293 -3.083 2.357
376 HA GLU 52 HA GLU 52 -12.376 -1.061 2.308
377 HB2 GLU 52 HB2 GLU 52 -14.060 0.561 2.511
378 HB3 GLU 52 HB3 GLU 52 -14.615 -0.735 1.481
379 HG2 GLU 52 HG2 GLU 52 -15.887 -1.646 3.519
380 HG3 GLU 52 HG3 GLU 52 -15.516 -0.096 4.305
381 H GLN 53 H GLN 53 -13.758 -2.594 5.076
382 HA GLN 53 HA GLN 53 -13.121 -0.863 7.144
383 HB2 GLN 53 HB2 GLN 53 -12.748 -3.885 7.146
384 HB3 GLN 53 HB3 GLN 53 -12.969 -2.851 8.558
385 HG2 GLN 53 HG2 GLN 53 -15.247 -2.260 7.771
386 HG3 GLN 53 HG3 GLN 53 -15.038 -3.340 6.389
387 HE21 GLN 53 HE21 GLN 53 -15.988 -3.212 9.700
388 HE22 GLN 53 HE22 GLN 53 -15.987 -4.930 10.040
389 H PHE 54 H PHE 54 -10.912 -2.832 5.236
390 HA PHE 54 HA PHE 54 -8.576 -1.952 6.890
391 HB2 PHE 54 HB2 PHE 54 -8.537 -4.270 6.976
392 HB3 PHE 54 HB3 PHE 54 -9.090 -4.443 5.302
393 HD1 PHE 54 HD1 PHE 54 -7.698 -4.185 3.455
394 HD2 PHE 54 HD2 PHE 54 -6.125 -3.589 7.403
395 HE1 PHE 54 HE1 PHE 54 -5.354 -4.206 2.522
396 HE2 PHE 54 HE2 PHE 54 -3.822 -3.554 6.502
397 HZ PHE 54 HZ PHE 54 -3.426 -3.878 4.072
398 H ARG 55 H ARG 55 -10.019 -2.012 3.588
399 HA ARG 55 HA ARG 55 -7.737 -1.118 2.205
400 HB2 ARG 55 HB2 ARG 55 -9.080 -0.921 0.435
401 HB3 ARG 55 HB3 ARG 55 -10.265 -1.701 1.452
402 HG2 ARG 55 HG2 ARG 55 -11.109 0.655 2.062
403 HG3 ARG 55 HG3 ARG 55 -10.013 1.290 0.834
404 HD2 ARG 55 HD2 ARG 55 -11.215 0.140 -0.934
405 HD3 ARG 55 HD3 ARG 55 -12.209 -0.742 0.224
406 HE ARG 55 HE ARG 55 -12.427 2.105 0.622
407 HH11 ARG 55 HH11 ARG 55 -13.948 -0.635 -1.072
408 HH12 ARG 55 HH12 ARG 55 -15.070 0.333 -1.940
409 HH21 ARG 55 HH21 ARG 55 -14.206 3.398 -0.349
410 HH22 ARG 55 HH22 ARG 55 -15.218 2.639 -1.488
411 H HIS 56 H HIS 56 -10.013 0.616 4.289
412 HA HIS 56 HA HIS 56 -9.108 3.234 3.764
413 HB2 HIS 56 HB2 HIS 56 -11.154 2.157 5.164
414 HB3 HIS 56 HB3 HIS 56 -10.059 2.368 6.514
415 HD1 HIS 56 HD1 HIS 56 -12.849 3.979 5.135
416 HD2 HIS 56 HD2 HIS 56 -9.008 5.268 6.301
417 HE1 HIS 56 HE1 HIS 56 -13.005 6.488 5.477
418 H ALA 57 H ALA 57 -7.622 0.647 5.732
419 HA ALA 57 HA ALA 57 -5.939 2.401 7.285
420 HB1 ALA 57 HB1 ALA 57 -4.763 0.372 7.918
421 HB2 ALA 57 HB2 ALA 57 -6.511 0.093 8.018
422 HB3 ALA 57 HB3 ALA 57 -5.576 -0.562 6.656
423 H ILE 58 H ILE 58 -5.306 0.224 4.465
424 HA ILE 58 HA ILE 58 -2.662 1.163 4.087
425 HB ILE 58 HB ILE 58 -3.128 -0.872 3.120
426 HG12 ILE 58 HG12 ILE 58 -3.222 1.080 0.783
427 HG13 ILE 58 HG13 ILE 58 -1.778 0.654 1.705
428 HG21 ILE 58 HG21 ILE 58 -5.606 -0.807 3.014
429 HG22 ILE 58 HG22 ILE 58 -5.483 0.141 1.506
430 HG23 ILE 58 HG23 ILE 58 -4.872 -1.514 1.608
431 HD11 ILE 58 HD11 ILE 58 -1.819 -0.506 -0.420
432 HD12 ILE 58 HD12 ILE 58 -1.998 -1.692 0.873
433 HD13 ILE 58 HD13 ILE 58 -3.408 -1.194 -0.071
434 H TRP 59 H TRP 59 -5.680 2.105 2.399
435 HA TRP 59 HA TRP 59 -4.446 4.019 0.754
436 HB2 TRP 59 HB2 TRP 59 -6.826 2.904 0.691
437 HB3 TRP 59 HB3 TRP 59 -7.319 4.365 1.534
438 HD1 TRP 59 HD1 TRP 59 -5.444 3.272 -1.699
439 HE1 TRP 59 HE1 TRP 59 -5.861 4.931 -3.554
440 HE3 TRP 59 HE3 TRP 59 -7.987 6.792 0.977
441 HZ2 TRP 59 HZ2 TRP 59 -7.516 7.298 -3.958
442 HZ3 TRP 59 HZ3 TRP 59 -8.850 8.827 -0.152
443 HH2 TRP 59 HH2 TRP 59 -8.701 9.064 -2.621
444 H LYS 60 H LYS 60 -6.193 4.630 3.918
445 HA LYS 60 HA LYS 60 -5.649 7.418 3.896
446 HB2 LYS 60 HB2 LYS 60 -7.224 6.336 5.417
447 HB3 LYS 60 HB3 LYS 60 -5.885 5.514 6.242
448 HG2 LYS 60 HG2 LYS 60 -5.944 8.529 6.208
449 HG3 LYS 60 HG3 LYS 60 -7.074 7.636 7.233
450 HD2 LYS 60 HD2 LYS 60 -5.044 6.349 8.172
451 HD3 LYS 60 HD3 LYS 60 -4.042 7.556 7.360
452 HE2 LYS 60 HE2 LYS 60 -4.276 8.239 9.605
453 HE3 LYS 60 HE3 LYS 60 -5.228 9.356 8.637
454 HZ1 LYS 60 HZ1 LYS 60 -6.463 7.041 10.038
455 HZ2 LYS 60 HZ2 LYS 60 -7.202 8.396 9.419
456 HZ3 LYS 60 HZ3 LYS 60 -6.279 8.509 10.736
457 H GLY 61 H GLY 61 -3.591 4.644 4.979
458 HA2 GLY 61 HA2 GLY 61 -1.627 6.196 6.273
459 HA3 GLY 61 HA3 GLY 61 -1.353 4.628 5.495
460 H ILE 62 H ILE 62 -1.734 5.138 2.801
461 HA ILE 62 HA ILE 62 0.697 6.597 2.238
462 HB ILE 62 HB ILE 62 0.102 4.656 1.224
463 HG12 ILE 62 HG12 ILE 62 1.592 6.416 0.107
464 HG13 ILE 62 HG13 ILE 62 1.116 5.016 -0.822
465 HG21 ILE 62 HG21 ILE 62 -2.277 4.690 0.891
466 HG22 ILE 62 HG22 ILE 62 -2.120 5.919 -0.367
467 HG23 ILE 62 HG23 ILE 62 -1.450 4.295 -0.613
468 HD11 ILE 62 HD11 ILE 62 -0.203 7.738 -1.124
469 HD12 ILE 62 HD12 ILE 62 1.069 7.070 -2.162
470 HD13 ILE 62 HD13 ILE 62 -0.511 6.285 -2.103
471 H LEU 63 H LEU 63 -2.755 7.248 1.672
472 HA LEU 63 HA LEU 63 -2.287 9.671 0.204
473 HB2 LEU 63 HB2 LEU 63 -4.639 8.614 1.775
474 HB3 LEU 63 HB3 LEU 63 -4.606 10.313 1.385
475 HG LEU 63 HG LEU 63 -5.875 9.030 -0.247
476 HD11 LEU 63 HD11 LEU 63 -4.771 11.159 -0.906
477 HD12 LEU 63 HD12 LEU 63 -4.982 10.021 -2.252
478 HD13 LEU 63 HD13 LEU 63 -3.394 10.220 -1.531
479 HD21 LEU 63 HD21 LEU 63 -4.801 7.613 -1.922
480 HD22 LEU 63 HD22 LEU 63 -4.579 6.918 -0.311
481 HD23 LEU 63 HD23 LEU 63 -3.242 7.779 -1.117
482 H ASP 64 H ASP 64 -2.282 8.882 3.596
483 HA ASP 64 HA ASP 64 -2.197 11.696 4.499
484 HB2 ASP 64 HB2 ASP 64 -1.716 9.078 5.960
485 HB3 ASP 64 HB3 ASP 64 -1.158 10.578 6.623
486 H HIS 65 H HIS 65 0.116 9.202 3.642
487 HA HIS 65 HA HIS 65 2.438 10.545 4.674
488 HB2 HIS 65 HB2 HIS 65 2.572 8.164 4.294
489 HB3 HIS 65 HB3 HIS 65 2.180 8.363 2.584
490 HD1 HIS 65 HD1 HIS 65 4.865 10.265 4.693
491 HD2 HIS 65 HD2 HIS 65 4.328 7.968 1.178
492 HE1 HIS 65 HE1 HIS 65 7.086 10.281 3.470
493 H ARG 66 H ARG 66 1.193 10.109 1.347
494 HA ARG 66 HA ARG 66 3.024 11.959 0.196
495 HB2 ARG 66 HB2 ARG 66 1.780 11.764 -1.827
496 HB3 ARG 66 HB3 ARG 66 1.875 10.191 -1.066
497 HG2 ARG 66 HG2 ARG 66 -0.315 10.147 -1.727
498 HG3 ARG 66 HG3 ARG 66 -0.495 10.778 -0.098
499 HD2 ARG 66 HD2 ARG 66 -1.947 11.978 -1.627
500 HD3 ARG 66 HD3 ARG 66 -0.722 13.062 -0.985
501 HE ARG 66 HE ARG 66 -0.479 11.734 -3.662
502 HH11 ARG 66 HH11 ARG 66 -0.706 14.838 -1.979
503 HH12 ARG 66 HH12 ARG 66 0.517 15.610 -2.961
504 HH21 ARG 66 HH21 ARG 66 0.713 12.791 -5.166
505 HH22 ARG 66 HH22 ARG 66 1.037 14.497 -5.061
506 H GLN 67 H GLN 67 -0.109 12.506 1.862
507 HA GLN 67 HA GLN 67 -0.291 15.186 0.757
508 HB2 GLN 67 HB2 GLN 67 -2.268 14.076 1.537
509 HB3 GLN 67 HB3 GLN 67 -1.581 13.832 3.163
510 HG2 GLN 67 HG2 GLN 67 -1.642 16.149 3.633
511 HG3 GLN 67 HG3 GLN 67 -1.992 16.584 1.963
512 HE21 GLN 67 HE21 GLN 67 -4.127 16.841 1.418
513 HE22 GLN 67 HE22 GLN 67 -5.503 16.297 2.369
514 H LEU 68 H LEU 68 1.086 13.807 3.770
515 HA LEU 68 HA LEU 68 1.928 16.468 4.701
516 HB2 LEU 68 HB2 LEU 68 1.887 13.674 5.814
517 HB3 LEU 68 HB3 LEU 68 2.803 14.904 6.631
518 HG LEU 68 HG LEU 68 -0.140 15.284 6.001
519 HD11 LEU 68 HD11 LEU 68 0.035 13.356 7.459
520 HD12 LEU 68 HD12 LEU 68 -0.490 14.738 8.425
521 HD13 LEU 68 HD13 LEU 68 1.210 14.222 8.509
522 HD21 LEU 68 HD21 LEU 68 -0.010 17.008 7.764
523 HD22 LEU 68 HD22 LEU 68 1.174 17.367 6.510
524 HD23 LEU 68 HD23 LEU 68 1.706 16.641 8.034
525 H HIS 69 H HIS 69 3.402 14.270 2.597
526 HA HIS 69 HA HIS 69 6.075 15.398 3.227
527 HB2 HIS 69 HB2 HIS 69 5.607 13.026 4.146
528 HB3 HIS 69 HB3 HIS 69 5.625 12.500 2.467
529 HD1 HIS 69 HD1 HIS 69 8.121 12.347 1.337
530 HD2 HIS 69 HD2 HIS 69 7.907 13.815 5.295
531 HE1 HIS 69 HE1 HIS 69 10.461 12.301 2.228
532 H ASP 70 H ASP 70 3.842 15.845 1.155
533 HA ASP 70 HA ASP 70 4.407 14.927 -1.395
534 HB2 ASP 70 HB2 ASP 70 2.466 16.426 -0.497
535 HB3 ASP 70 HB3 ASP 70 3.522 17.767 -0.771
Start of MODEL 9
1 H1 GLY 1 H GLY 1 21.131 -13.918 -1.694
2 HA2 GLY 1 HA2 GLY 1 23.714 -13.251 -3.003
3 HA3 GLY 1 HA3 GLY 1 22.125 -12.700 -3.581
4 HA PRO 2 HA PRO 2 23.635 -9.314 -0.884
5 HB2 PRO 2 HB2 PRO 2 21.887 -7.373 -1.834
6 HB3 PRO 2 HB3 PRO 2 23.437 -7.820 -2.605
7 HG2 PRO 2 HG2 PRO 2 20.655 -8.825 -3.273
8 HG3 PRO 2 HG3 PRO 2 21.897 -8.193 -4.392
9 HD2 PRO 2 HD2 PRO 2 21.578 -10.840 -4.046
10 HD3 PRO 2 HD3 PRO 2 23.229 -10.159 -4.147
11 H LEU 3 H LEU 3 22.786 -8.423 1.054
12 HA LEU 3 HA LEU 3 19.963 -8.964 1.800
13 HB2 LEU 3 HB2 LEU 3 21.508 -10.890 2.372
14 HB3 LEU 3 HB3 LEU 3 22.370 -9.816 3.455
15 HG LEU 3 HG LEU 3 19.425 -10.583 3.663
16 HD11 LEU 3 HD11 LEU 3 21.825 -11.541 5.263
17 HD12 LEU 3 HD12 LEU 3 20.988 -12.464 3.999
18 HD13 LEU 3 HD13 LEU 3 20.137 -12.037 5.498
19 HD21 LEU 3 HD21 LEU 3 19.610 -8.529 4.907
20 HD22 LEU 3 HD22 LEU 3 21.186 -9.002 5.590
21 HD23 LEU 3 HD23 LEU 3 19.684 -9.815 6.082
22 H GLY 4 H GLY 4 19.145 -7.211 2.856
23 HA2 GLY 4 HA2 GLY 4 20.189 -5.714 4.830
24 HA3 GLY 4 HA3 GLY 4 20.745 -4.864 3.369
25 H SER 5 H SER 5 18.918 -3.598 5.131
26 HA SER 5 HA SER 5 16.186 -3.919 4.208
27 HB2 SER 5 HB2 SER 5 17.593 -1.731 5.809
28 HB3 SER 5 HB3 SER 5 15.860 -1.758 5.456
29 HG SER 5 HG SER 5 15.637 -3.646 6.559
30 H THR 6 H THR 6 15.808 -3.468 2.015
31 HA THR 6 HA THR 6 17.408 -1.396 0.671
32 HB THR 6 HB THR 6 16.241 -2.253 -1.348
33 HG1 THR 6 HG1 THR 6 14.728 -3.665 -1.205
34 HG21 THR 6 HG21 THR 6 17.392 -4.388 -1.482
35 HG22 THR 6 HG22 THR 6 17.485 -4.518 0.284
36 HG23 THR 6 HG23 THR 6 18.414 -3.279 -0.564
37 H ASP 7 H ASP 7 14.360 -1.818 2.188
38 HA ASP 7 HA ASP 7 12.389 -0.734 2.273
39 HB2 ASP 7 HB2 ASP 7 14.314 1.583 2.618
40 HB3 ASP 7 HB3 ASP 7 12.628 1.542 3.156
41 H CYS 8 H CYS 8 12.477 -1.287 -0.245
42 HA CYS 8 HA CYS 8 11.543 1.173 -1.642
43 HB2 CYS 8 HB2 CYS 8 12.692 0.382 -3.658
44 HB3 CYS 8 HB3 CYS 8 13.827 0.632 -2.328
45 HG CYS 8 HG CYS 8 12.448 -2.156 -3.417
46 H SER 9 H SER 9 9.955 -0.957 -0.217
47 HA SER 9 HA SER 9 8.063 -1.529 -2.343
48 HB2 SER 9 HB2 SER 9 9.737 -3.683 -0.985
49 HB3 SER 9 HB3 SER 9 8.072 -4.017 -1.472
50 HG SER 9 HG SER 9 8.587 -3.313 -3.552
51 H ILE 10 H ILE 10 5.983 -2.401 -1.403
52 HA ILE 10 HA ILE 10 5.276 -1.021 0.935
53 HB ILE 10 HB ILE 10 3.949 -3.378 -0.415
54 HG12 ILE 10 HG12 ILE 10 4.111 -1.298 -1.712
55 HG13 ILE 10 HG13 ILE 10 2.487 -1.929 -1.456
56 HG21 ILE 10 HG21 ILE 10 2.999 -1.697 1.915
57 HG22 ILE 10 HG22 ILE 10 1.843 -2.446 0.834
58 HG23 ILE 10 HG23 ILE 10 2.973 -3.466 1.741
59 HD11 ILE 10 HD11 ILE 10 2.044 -0.228 0.267
60 HD12 ILE 10 HD12 ILE 10 3.711 0.385 0.128
61 HD13 ILE 10 HD13 ILE 10 2.571 0.513 -1.215
62 H VAL 11 H VAL 11 6.752 -4.191 0.652
63 HA VAL 11 HA VAL 11 5.896 -5.302 3.122
64 HB VAL 11 HB VAL 11 8.298 -6.220 3.321
65 HG11 VAL 11 HG11 VAL 11 6.526 -6.856 0.926
66 HG12 VAL 11 HG12 VAL 11 7.747 -7.941 1.634
67 HG13 VAL 11 HG13 VAL 11 6.334 -7.478 2.575
68 HG21 VAL 11 HG21 VAL 11 9.423 -4.610 1.758
69 HG22 VAL 11 HG22 VAL 11 9.645 -6.309 1.323
70 HG23 VAL 11 HG23 VAL 11 8.487 -5.326 0.414
71 H SER 12 H SER 12 8.407 -2.835 2.641
72 HA SER 12 HA SER 12 8.985 -2.694 5.477
73 HB2 SER 12 HB2 SER 12 10.558 -2.041 3.609
74 HB3 SER 12 HB3 SER 12 9.598 -0.560 3.401
75 HG SER 12 HG SER 12 11.546 -0.647 4.966
76 H PHE 13 H PHE 13 6.740 -0.943 3.269
77 HA PHE 13 HA PHE 13 6.030 1.056 5.179
78 HB2 PHE 13 HB2 PHE 13 5.532 1.314 2.793
79 HB3 PHE 13 HB3 PHE 13 4.445 -0.069 2.841
80 HD1 PHE 13 HD1 PHE 13 2.418 0.964 2.132
81 HD2 PHE 13 HD2 PHE 13 4.630 2.713 5.401
82 HE1 PHE 13 HE1 PHE 13 0.554 2.595 2.558
83 HE2 PHE 13 HE2 PHE 13 2.746 4.252 5.832
84 HZ PHE 13 HZ PHE 13 0.768 4.200 4.424
85 H PHE 14 H PHE 14 4.490 -2.097 4.354
86 HA PHE 14 HA PHE 14 2.456 -1.885 6.317
87 HB2 PHE 14 HB2 PHE 14 3.629 -4.217 4.795
88 HB3 PHE 14 HB3 PHE 14 2.500 -4.494 6.104
89 HD1 PHE 14 HD1 PHE 14 1.108 -5.626 4.369
90 HD2 PHE 14 HD2 PHE 14 1.851 -1.392 4.215
91 HE1 PHE 14 HE1 PHE 14 -0.737 -5.358 2.697
92 HE2 PHE 14 HE2 PHE 14 0.081 -1.138 2.594
93 HZ PHE 14 HZ PHE 14 -1.242 -3.093 1.798
94 H ALA 15 H ALA 15 5.758 -3.214 6.519
95 HA ALA 15 HA ALA 15 5.530 -4.221 9.178
96 HB1 ALA 15 HB1 ALA 15 7.453 -4.767 7.787
97 HB2 ALA 15 HB2 ALA 15 7.935 -3.052 7.701
98 HB3 ALA 15 HB3 ALA 15 8.025 -3.920 9.239
99 H ARG 16 H ARG 16 6.528 -0.988 7.958
100 HA ARG 16 HA ARG 16 6.901 0.225 10.513
101 HB2 ARG 16 HB2 ARG 16 6.353 1.326 7.716
102 HB3 ARG 16 HB3 ARG 16 6.582 2.377 9.118
103 HG2 ARG 16 HG2 ARG 16 8.716 1.220 9.601
104 HG3 ARG 16 HG3 ARG 16 8.611 0.341 8.079
105 HD2 ARG 16 HD2 ARG 16 8.348 2.584 6.900
106 HD3 ARG 16 HD3 ARG 16 8.686 3.337 8.473
107 HE ARG 16 HE ARG 16 10.734 1.468 7.492
108 HH11 ARG 16 HH11 ARG 16 9.632 4.868 7.571
109 HH12 ARG 16 HH12 ARG 16 11.189 5.506 7.156
110 HH21 ARG 16 HH21 ARG 16 12.731 2.290 6.982
111 HH22 ARG 16 HH22 ARG 16 13.022 4.012 6.867
112 H LEU 17 H LEU 17 4.089 -0.174 8.570
113 HA LEU 17 HA LEU 17 2.316 1.654 10.056
114 HB2 LEU 17 HB2 LEU 17 1.719 -0.685 8.182
115 HB3 LEU 17 HB3 LEU 17 0.456 0.155 9.052
116 HG LEU 17 HG LEU 17 2.267 1.412 6.990
117 HD11 LEU 17 HD11 LEU 17 0.208 1.521 5.611
118 HD12 LEU 17 HD12 LEU 17 -0.689 0.678 6.894
119 HD13 LEU 17 HD13 LEU 17 0.624 -0.150 6.019
120 HD21 LEU 17 HD21 LEU 17 -0.052 2.549 8.604
121 HD22 LEU 17 HD22 LEU 17 0.611 3.300 7.129
122 HD23 LEU 17 HD23 LEU 17 1.630 3.131 8.557
123 H GLY 18 H GLY 18 2.780 -1.869 9.925
124 HA2 GLY 18 HA2 GLY 18 3.054 -3.057 12.075
125 HA3 GLY 18 HA3 GLY 18 1.568 -2.258 12.606
126 H CYS 19 H CYS 19 1.000 -2.721 9.402
127 HA CYS 19 HA CYS 19 -0.936 -4.750 9.687
128 HB2 CYS 19 HB2 CYS 19 0.449 -3.922 7.108
129 HB3 CYS 19 HB3 CYS 19 -1.190 -4.565 7.320
130 HG CYS 19 HG CYS 19 -1.404 -2.079 6.657
131 H SER 20 H SER 20 -0.351 -6.764 10.391
132 HA SER 20 HA SER 20 2.035 -8.058 9.485
133 HB2 SER 20 HB2 SER 20 0.849 -9.943 10.936
134 HB3 SER 20 HB3 SER 20 1.689 -8.568 11.620
135 HG SER 20 HG SER 20 -1.142 -8.676 11.260
136 H SER 21 H SER 21 -0.980 -9.988 9.515
137 HA SER 21 HA SER 21 -0.232 -11.458 7.282
138 HB2 SER 21 HB2 SER 21 -3.024 -11.005 8.373
139 HB3 SER 21 HB3 SER 21 -2.503 -12.349 7.331
140 HG SER 21 HG SER 21 -2.501 -12.920 9.532
141 H CYS 22 H CYS 22 -1.597 -8.248 7.151
142 HA CYS 22 HA CYS 22 -2.912 -8.505 4.623
143 HB2 CYS 22 HB2 CYS 22 -1.421 -6.065 5.699
144 HB3 CYS 22 HB3 CYS 22 -2.728 -6.084 4.502
145 HG CYS 22 HG CYS 22 -4.498 -7.219 6.122
146 H LEU 23 H LEU 23 0.522 -8.170 5.555
147 HA LEU 23 HA LEU 23 1.439 -7.546 2.892
148 HB2 LEU 23 HB2 LEU 23 3.559 -7.493 3.759
149 HB3 LEU 23 HB3 LEU 23 2.608 -7.063 5.159
150 HG LEU 23 HG LEU 23 2.809 -9.668 5.727
151 HD11 LEU 23 HD11 LEU 23 5.032 -10.542 5.094
152 HD12 LEU 23 HD12 LEU 23 5.275 -9.174 3.996
153 HD13 LEU 23 HD13 LEU 23 4.015 -10.375 3.672
154 HD21 LEU 23 HD21 LEU 23 5.102 -7.696 6.071
155 HD22 LEU 23 HD22 LEU 23 4.790 -9.154 7.052
156 HD23 LEU 23 HD23 LEU 23 3.650 -7.808 7.099
157 H ASP 24 H ASP 24 0.905 -10.458 4.852
158 HA ASP 24 HA ASP 24 2.141 -12.362 3.205
159 HB2 ASP 24 HB2 ASP 24 1.309 -12.866 5.459
160 HB3 ASP 24 HB3 ASP 24 -0.352 -12.792 4.878
161 H TYR 25 H TYR 25 -1.225 -11.147 3.206
162 HA TYR 25 HA TYR 25 -2.098 -12.707 0.987
163 HB2 TYR 25 HB2 TYR 25 -3.082 -9.965 1.830
164 HB3 TYR 25 HB3 TYR 25 -3.972 -11.147 0.893
165 HD1 TYR 25 HD1 TYR 25 -4.849 -9.737 3.451
166 HD2 TYR 25 HD2 TYR 25 -2.953 -13.577 2.873
167 HE1 TYR 25 HE1 TYR 25 -5.755 -10.510 5.607
168 HE2 TYR 25 HE2 TYR 25 -3.827 -14.340 5.015
169 HH TYR 25 HH TYR 25 -5.275 -13.851 6.792
170 H PHE 26 H PHE 26 -0.858 -9.268 1.062
171 HA PHE 26 HA PHE 26 -0.957 -8.903 -1.699
172 HB2 PHE 26 HB2 PHE 26 0.210 -7.610 0.664
173 HB3 PHE 26 HB3 PHE 26 1.210 -7.398 -0.718
174 HD1 PHE 26 HD1 PHE 26 0.273 -6.248 -2.835
175 HD2 PHE 26 HD2 PHE 26 -2.012 -6.691 0.817
176 HE1 PHE 26 HE1 PHE 26 -1.142 -4.372 -3.515
177 HE2 PHE 26 HE2 PHE 26 -3.512 -4.887 0.076
178 HZ PHE 26 HZ PHE 26 -3.066 -3.686 -2.084
179 H THR 27 H THR 27 1.808 -10.242 0.209
180 HA THR 27 HA THR 27 3.496 -10.434 -2.114
181 HB THR 27 HB THR 27 4.292 -10.241 0.223
182 HG1 THR 27 HG1 THR 27 5.924 -10.801 -0.882
183 HG21 THR 27 HG21 THR 27 2.860 -11.890 1.326
184 HG22 THR 27 HG22 THR 27 4.554 -12.132 1.668
185 HG23 THR 27 HG23 THR 27 3.720 -13.207 0.514
186 H THR 28 H THR 28 1.039 -12.595 -0.634
187 HA THR 28 HA THR 28 1.658 -14.868 -2.269
188 HB THR 28 HB THR 28 -0.891 -14.106 -0.783
189 HG1 THR 28 HG1 THR 28 0.665 -14.263 0.677
190 HG21 THR 28 HG21 THR 28 0.119 -16.841 -1.667
191 HG22 THR 28 HG22 THR 28 -1.258 -15.954 -2.375
192 HG23 THR 28 HG23 THR 28 -1.331 -16.504 -0.691
193 H GLN 29 H GLN 29 -0.143 -11.872 -2.902
194 HA GLN 29 HA GLN 29 -1.440 -12.928 -5.317
195 HB2 GLN 29 HB2 GLN 29 -1.246 -10.211 -3.965
196 HB3 GLN 29 HB3 GLN 29 -2.119 -10.510 -5.469
197 HG2 GLN 29 HG2 GLN 29 -2.825 -12.069 -2.971
198 HG3 GLN 29 HG3 GLN 29 -3.467 -10.453 -3.284
199 HE21 GLN 29 HE21 GLN 29 -4.275 -13.633 -3.617
200 HE22 GLN 29 HE22 GLN 29 -5.321 -13.520 -5.019
201 H GLY 30 H GLY 30 1.567 -11.314 -4.433
202 HA2 GLY 30 HA2 GLY 30 3.401 -10.741 -5.648
203 HA3 GLY 30 HA3 GLY 30 2.695 -11.582 -7.025
204 H LEU 31 H LEU 31 1.328 -8.753 -5.336
205 HA LEU 31 HA LEU 31 1.926 -6.945 -7.630
206 HB2 LEU 31 HB2 LEU 31 -0.563 -6.226 -7.363
207 HB3 LEU 31 HB3 LEU 31 -0.174 -7.693 -8.261
208 HG LEU 31 HG LEU 31 -0.756 -9.059 -6.287
209 HD11 LEU 31 HD11 LEU 31 -0.373 -7.619 -4.417
210 HD12 LEU 31 HD12 LEU 31 -2.083 -8.016 -4.437
211 HD13 LEU 31 HD13 LEU 31 -1.559 -6.427 -5.022
212 HD21 LEU 31 HD21 LEU 31 -2.391 -8.752 -7.944
213 HD22 LEU 31 HD22 LEU 31 -2.928 -7.209 -7.214
214 HD23 LEU 31 HD23 LEU 31 -3.151 -8.755 -6.339
215 H THR 32 H THR 32 3.021 -7.101 -4.854
216 HA THR 32 HA THR 32 1.753 -4.821 -3.460
217 HB THR 32 HB THR 32 2.230 -6.795 -2.292
218 HG1 THR 32 HG1 THR 32 2.600 -5.138 -0.992
219 HG21 THR 32 HG21 THR 32 5.103 -6.779 -3.147
220 HG22 THR 32 HG22 THR 32 3.851 -8.008 -3.464
221 HG23 THR 32 HG23 THR 32 4.414 -7.760 -1.824
222 H THR 33 H THR 33 2.325 -2.712 -3.908
223 HA THR 33 HA THR 33 5.058 -2.047 -4.123
224 HB THR 33 HB THR 33 5.108 -2.400 -6.401
225 HG1 THR 33 HG1 THR 33 4.749 -0.596 -7.547
226 HG21 THR 33 HG21 THR 33 3.040 -3.656 -6.664
227 HG22 THR 33 HG22 THR 33 3.108 -2.419 -7.901
228 HG23 THR 33 HG23 THR 33 2.021 -2.248 -6.485
229 H ILE 34 H ILE 34 5.417 0.245 -3.962
230 HA ILE 34 HA ILE 34 3.229 1.656 -2.656
231 HB ILE 34 HB ILE 34 5.849 3.014 -3.054
232 HG12 ILE 34 HG12 ILE 34 5.492 0.518 -1.376
233 HG13 ILE 34 HG13 ILE 34 6.824 0.976 -2.434
234 HG21 ILE 34 HG21 ILE 34 4.022 2.742 -0.620
235 HG22 ILE 34 HG22 ILE 34 5.283 3.952 -0.892
236 HG23 ILE 34 HG23 ILE 34 3.825 3.989 -1.881
237 HD11 ILE 34 HD11 ILE 34 6.201 2.004 0.361
238 HD12 ILE 34 HD12 ILE 34 7.608 1.086 -0.177
239 HD13 ILE 34 HD13 ILE 34 7.405 2.773 -0.691
240 H TYR 35 H TYR 35 5.201 2.161 -5.545
241 HA TYR 35 HA TYR 35 4.061 4.537 -6.435
242 HB2 TYR 35 HB2 TYR 35 5.261 2.213 -8.009
243 HB3 TYR 35 HB3 TYR 35 4.970 3.828 -8.648
244 HD1 TYR 35 HD1 TYR 35 7.038 1.864 -6.210
245 HD2 TYR 35 HD2 TYR 35 6.378 5.705 -8.083
246 HE1 TYR 35 HE1 TYR 35 9.063 2.729 -5.141
247 HE2 TYR 35 HE2 TYR 35 8.480 6.530 -7.121
248 HH TYR 35 HH TYR 35 10.608 4.507 -5.019
249 H GLN 36 H GLN 36 2.862 1.263 -6.628
250 HA GLN 36 HA GLN 36 0.931 1.956 -8.763
251 HB2 GLN 36 HB2 GLN 36 1.290 -0.503 -7.038
252 HB3 GLN 36 HB3 GLN 36 -0.083 -0.285 -8.103
253 HG2 GLN 36 HG2 GLN 36 1.509 0.239 -10.018
254 HG3 GLN 36 HG3 GLN 36 2.767 -0.487 -9.030
255 HE21 GLN 36 HE21 GLN 36 1.360 -1.266 -11.676
256 HE22 GLN 36 HE22 GLN 36 0.801 -2.916 -11.378
257 H ILE 37 H ILE 37 0.627 1.364 -5.190
258 HA ILE 37 HA ILE 37 -2.148 2.030 -5.168
259 HB ILE 37 HB ILE 37 -1.953 2.196 -2.763
260 HG12 ILE 37 HG12 ILE 37 1.007 1.618 -3.173
261 HG13 ILE 37 HG13 ILE 37 0.360 3.202 -2.751
262 HG21 ILE 37 HG21 ILE 37 -1.271 -0.207 -2.475
263 HG22 ILE 37 HG22 ILE 37 -2.329 0.052 -3.884
264 HG23 ILE 37 HG23 ILE 37 -0.595 -0.186 -4.107
265 HD11 ILE 37 HD11 ILE 37 0.242 0.665 -1.121
266 HD12 ILE 37 HD12 ILE 37 1.092 2.184 -0.739
267 HD13 ILE 37 HD13 ILE 37 -0.684 2.131 -0.719
268 H GLU 38 H GLU 38 0.596 4.115 -5.438
269 HA GLU 38 HA GLU 38 -0.600 6.461 -4.331
270 HB2 GLU 38 HB2 GLU 38 1.603 5.874 -6.325
271 HB3 GLU 38 HB3 GLU 38 1.092 7.534 -6.056
272 HG2 GLU 38 HG2 GLU 38 1.752 5.784 -3.660
273 HG3 GLU 38 HG3 GLU 38 3.054 6.488 -4.628
274 H HIS 39 H HIS 39 -1.124 4.693 -7.350
275 HA HIS 39 HA HIS 39 -2.952 6.866 -8.263
276 HB2 HIS 39 HB2 HIS 39 -0.860 6.308 -9.632
277 HB3 HIS 39 HB3 HIS 39 -1.649 4.778 -10.026
278 HD1 HIS 39 HD1 HIS 39 -2.911 8.483 -9.984
279 HD2 HIS 39 HD2 HIS 39 -2.705 5.007 -12.361
280 HE1 HIS 39 HE1 HIS 39 -4.076 9.045 -12.176
281 H TYR 40 H TYR 40 -2.723 3.488 -7.398
282 HA TYR 40 HA TYR 40 -5.260 2.689 -8.544
283 HB2 TYR 40 HB2 TYR 40 -3.396 1.384 -6.511
284 HB3 TYR 40 HB3 TYR 40 -4.992 0.766 -6.804
285 HD1 TYR 40 HD1 TYR 40 -1.962 -0.554 -7.303
286 HD2 TYR 40 HD2 TYR 40 -5.218 1.080 -9.768
287 HE1 TYR 40 HE1 TYR 40 -1.607 -2.250 -9.035
288 HE2 TYR 40 HE2 TYR 40 -4.853 -0.618 -11.380
289 HH TYR 40 HH TYR 40 -4.071 -3.089 -10.929
290 H SER 41 H SER 41 -6.889 3.992 -7.934
291 HA SER 41 HA SER 41 -7.260 5.070 -5.353
292 HB2 SER 41 HB2 SER 41 -9.269 4.597 -7.598
293 HB3 SER 41 HB3 SER 41 -9.486 5.697 -6.230
294 HG SER 41 HG SER 41 -8.199 6.107 -8.560
295 H MET 42 H MET 42 -9.245 4.702 -4.034
296 HA MET 42 HA MET 42 -9.262 2.215 -2.838
297 HB2 MET 42 HB2 MET 42 -11.305 2.968 -1.690
298 HB3 MET 42 HB3 MET 42 -10.032 4.184 -1.708
299 HG2 MET 42 HG2 MET 42 -11.227 5.367 -3.556
300 HG3 MET 42 HG3 MET 42 -12.494 4.137 -3.492
301 HE1 MET 42 HE1 MET 42 -14.443 5.757 -3.160
302 HE2 MET 42 HE2 MET 42 -14.422 7.140 -2.040
303 HE3 MET 42 HE3 MET 42 -13.280 7.079 -3.407
304 H ASP 43 H ASP 43 -11.051 3.056 -5.726
305 HA ASP 43 HA ASP 43 -13.034 0.943 -5.524
306 HB2 ASP 43 HB2 ASP 43 -12.129 2.717 -7.828
307 HB3 ASP 43 HB3 ASP 43 -13.513 1.605 -7.865
308 H ASP 44 H ASP 44 -9.825 1.339 -7.092
309 HA ASP 44 HA ASP 44 -9.880 -1.215 -8.465
310 HB2 ASP 44 HB2 ASP 44 -7.974 1.008 -8.085
311 HB3 ASP 44 HB3 ASP 44 -7.178 -0.552 -7.891
312 H LEU 45 H LEU 45 -8.659 0.045 -5.381
313 HA LEU 45 HA LEU 45 -7.434 -2.319 -4.408
314 HB2 LEU 45 HB2 LEU 45 -8.913 -0.237 -2.757
315 HB3 LEU 45 HB3 LEU 45 -7.837 -1.489 -2.146
316 HG LEU 45 HG LEU 45 -7.151 1.014 -3.701
317 HD11 LEU 45 HD11 LEU 45 -7.257 1.246 -1.315
318 HD12 LEU 45 HD12 LEU 45 -5.554 1.255 -1.774
319 HD13 LEU 45 HD13 LEU 45 -6.253 -0.205 -1.061
320 HD21 LEU 45 HD21 LEU 45 -5.313 -1.384 -3.321
321 HD22 LEU 45 HD22 LEU 45 -4.793 0.265 -3.803
322 HD23 LEU 45 HD23 LEU 45 -5.844 -0.669 -4.856
323 H ALA 46 H ALA 46 -10.852 -1.197 -3.950
324 HA ALA 46 HA ALA 46 -11.712 -3.508 -2.603
325 HB1 ALA 46 HB1 ALA 46 -13.959 -2.837 -3.262
326 HB2 ALA 46 HB2 ALA 46 -13.012 -1.404 -2.818
327 HB3 ALA 46 HB3 ALA 46 -13.312 -1.770 -4.531
328 H SER 47 H SER 47 -11.477 -2.936 -6.124
329 HA SER 47 HA SER 47 -12.726 -5.292 -7.033
330 HB2 SER 47 HB2 SER 47 -11.880 -3.193 -8.312
331 HB3 SER 47 HB3 SER 47 -10.301 -3.986 -8.345
332 HG SER 47 HG SER 47 -11.030 -4.812 -10.063
333 H LEU 48 H LEU 48 -9.423 -4.768 -5.872
334 HA LEU 48 HA LEU 48 -8.360 -7.332 -6.680
335 HB2 LEU 48 HB2 LEU 48 -7.333 -5.138 -4.882
336 HB3 LEU 48 HB3 LEU 48 -6.384 -6.558 -5.297
337 HG LEU 48 HG LEU 48 -7.560 -4.775 -7.473
338 HD11 LEU 48 HD11 LEU 48 -6.254 -3.356 -6.016
339 HD12 LEU 48 HD12 LEU 48 -5.385 -3.636 -7.532
340 HD13 LEU 48 HD13 LEU 48 -4.906 -4.527 -6.032
341 HD21 LEU 48 HD21 LEU 48 -6.774 -6.977 -8.222
342 HD22 LEU 48 HD22 LEU 48 -5.216 -6.726 -7.411
343 HD23 LEU 48 HD23 LEU 48 -5.688 -5.710 -8.791
344 H LYS 49 H LYS 49 -10.735 -7.483 -4.972
345 HA LYS 49 HA LYS 49 -11.601 -8.750 -3.411
346 HB2 LYS 49 HB2 LYS 49 -9.427 -10.289 -4.484
347 HB3 LYS 49 HB3 LYS 49 -9.363 -10.574 -2.777
348 HG2 LYS 49 HG2 LYS 49 -10.776 -12.261 -3.382
349 HG3 LYS 49 HG3 LYS 49 -11.970 -11.018 -3.048
350 HD2 LYS 49 HD2 LYS 49 -12.679 -11.860 -5.085
351 HD3 LYS 49 HD3 LYS 49 -11.759 -10.455 -5.613
352 HE2 LYS 49 HE2 LYS 49 -10.171 -12.969 -5.378
353 HE3 LYS 49 HE3 LYS 49 -11.502 -13.080 -6.526
354 HZ1 LYS 49 HZ1 LYS 49 -9.321 -11.095 -6.622
355 HZ2 LYS 49 HZ2 LYS 49 -10.596 -11.128 -7.670
356 HZ3 LYS 49 HZ3 LYS 49 -9.523 -12.390 -7.590
357 H ILE 50 H ILE 50 -10.403 -6.370 -2.553
358 HA ILE 50 HA ILE 50 -9.284 -6.889 0.160
359 HB ILE 50 HB ILE 50 -9.611 -4.287 -1.356
360 HG12 ILE 50 HG12 ILE 50 -8.133 -5.769 -2.697
361 HG13 ILE 50 HG13 ILE 50 -7.265 -4.435 -1.979
362 HG21 ILE 50 HG21 ILE 50 -9.224 -4.083 1.083
363 HG22 ILE 50 HG22 ILE 50 -7.823 -5.151 0.882
364 HG23 ILE 50 HG23 ILE 50 -7.815 -3.531 0.161
365 HD11 ILE 50 HD11 ILE 50 -7.266 -7.270 -0.887
366 HD12 ILE 50 HD12 ILE 50 -6.067 -6.578 -1.977
367 HD13 ILE 50 HD13 ILE 50 -6.220 -5.921 -0.353
368 HA PRO 51 HA PRO 51 -13.367 -5.734 1.752
369 HB2 PRO 51 HB2 PRO 51 -12.889 -5.751 4.427
370 HB3 PRO 51 HB3 PRO 51 -12.944 -7.262 3.463
371 HG2 PRO 51 HG2 PRO 51 -10.516 -5.708 4.347
372 HG3 PRO 51 HG3 PRO 51 -10.785 -7.477 4.430
373 HD2 PRO 51 HD2 PRO 51 -9.370 -6.260 2.400
374 HD3 PRO 51 HD3 PRO 51 -10.324 -7.746 2.146
375 H GLU 52 H GLU 52 -14.316 -3.731 2.754
376 HA GLU 52 HA GLU 52 -12.767 -1.468 2.037
377 HB2 GLU 52 HB2 GLU 52 -14.557 -0.094 2.652
378 HB3 GLU 52 HB3 GLU 52 -15.143 -1.533 1.837
379 HG2 GLU 52 HG2 GLU 52 -15.283 -2.233 4.562
380 HG3 GLU 52 HG3 GLU 52 -15.716 -0.519 4.553
381 H GLN 53 H GLN 53 -13.269 -2.817 5.324
382 HA GLN 53 HA GLN 53 -12.262 -0.583 6.703
383 HB2 GLN 53 HB2 GLN 53 -13.412 -2.585 7.664
384 HB3 GLN 53 HB3 GLN 53 -11.928 -3.508 7.522
385 HG2 GLN 53 HG2 GLN 53 -11.836 -0.876 9.012
386 HG3 GLN 53 HG3 GLN 53 -12.689 -2.222 9.756
387 HE21 GLN 53 HE21 GLN 53 -11.286 -2.894 11.448
388 HE22 GLN 53 HE22 GLN 53 -9.651 -3.398 11.131
389 H PHE 54 H PHE 54 -10.380 -3.486 5.603
390 HA PHE 54 HA PHE 54 -7.888 -2.321 6.432
391 HB2 PHE 54 HB2 PHE 54 -7.785 -4.634 6.256
392 HB3 PHE 54 HB3 PHE 54 -8.622 -4.664 4.709
393 HD1 PHE 54 HD1 PHE 54 -7.515 -4.645 2.749
394 HD2 PHE 54 HD2 PHE 54 -5.350 -3.544 6.270
395 HE1 PHE 54 HE1 PHE 54 -5.405 -4.491 1.389
396 HE2 PHE 54 HE2 PHE 54 -3.255 -3.428 4.975
397 HZ PHE 54 HZ PHE 54 -3.266 -3.909 2.520
398 H ARG 55 H ARG 55 -9.626 -2.375 3.273
399 HA ARG 55 HA ARG 55 -7.669 -1.144 1.683
400 HB2 ARG 55 HB2 ARG 55 -9.564 -1.908 0.601
401 HB3 ARG 55 HB3 ARG 55 -10.660 -1.182 1.757
402 HG2 ARG 55 HG2 ARG 55 -9.159 0.838 0.182
403 HG3 ARG 55 HG3 ARG 55 -10.132 -0.229 -0.799
404 HD2 ARG 55 HD2 ARG 55 -11.369 1.055 1.659
405 HD3 ARG 55 HD3 ARG 55 -11.207 1.962 0.155
406 HE ARG 55 HE ARG 55 -12.334 -0.677 -0.232
407 HH11 ARG 55 HH11 ARG 55 -13.321 2.646 0.679
408 HH12 ARG 55 HH12 ARG 55 -14.886 2.501 0.011
409 HH21 ARG 55 HH21 ARG 55 -14.427 -0.907 -0.994
410 HH22 ARG 55 HH22 ARG 55 -15.497 0.465 -1.094
411 H HIS 56 H HIS 56 -10.101 0.455 3.875
412 HA HIS 56 HA HIS 56 -9.165 3.067 3.214
413 HB2 HIS 56 HB2 HIS 56 -10.683 1.990 5.622
414 HB3 HIS 56 HB3 HIS 56 -10.270 3.694 5.417
415 HD1 HIS 56 HD1 HIS 56 -13.230 1.815 4.945
416 HD2 HIS 56 HD2 HIS 56 -10.935 4.389 2.499
417 HE1 HIS 56 HE1 HIS 56 -14.750 2.581 3.073
418 H ALA 57 H ALA 57 -7.898 0.648 5.582
419 HA ALA 57 HA ALA 57 -6.310 2.500 7.019
420 HB1 ALA 57 HB1 ALA 57 -5.843 -0.482 6.588
421 HB2 ALA 57 HB2 ALA 57 -5.222 0.522 7.902
422 HB3 ALA 57 HB3 ALA 57 -6.965 0.203 7.795
423 H ILE 58 H ILE 58 -5.454 0.243 4.274
424 HA ILE 58 HA ILE 58 -2.788 1.191 4.145
425 HB ILE 58 HB ILE 58 -3.186 -0.899 3.259
426 HG12 ILE 58 HG12 ILE 58 -2.477 -0.861 0.986
427 HG13 ILE 58 HG13 ILE 58 -3.190 0.733 0.672
428 HG21 ILE 58 HG21 ILE 58 -4.651 -1.504 1.360
429 HG22 ILE 58 HG22 ILE 58 -5.519 -1.056 2.800
430 HG23 ILE 58 HG23 ILE 58 -5.403 0.089 1.438
431 HD11 ILE 58 HD11 ILE 58 -0.547 0.305 1.077
432 HD12 ILE 58 HD12 ILE 58 -1.345 1.829 1.430
433 HD13 ILE 58 HD13 ILE 58 -1.041 0.675 2.741
434 H TRP 59 H TRP 59 -5.685 1.980 2.190
435 HA TRP 59 HA TRP 59 -4.366 3.861 0.564
436 HB2 TRP 59 HB2 TRP 59 -6.729 2.773 0.377
437 HB3 TRP 59 HB3 TRP 59 -7.272 4.215 1.226
438 HD1 TRP 59 HD1 TRP 59 -5.061 3.313 -1.860
439 HE1 TRP 59 HE1 TRP 59 -5.544 4.974 -3.760
440 HE3 TRP 59 HE3 TRP 59 -8.109 6.507 0.643
441 HZ2 TRP 59 HZ2 TRP 59 -7.224 7.271 -4.195
442 HZ3 TRP 59 HZ3 TRP 59 -9.167 8.450 -0.533
443 HH2 TRP 59 HH2 TRP 59 -8.742 8.800 -2.964
444 H LYS 60 H LYS 60 -6.015 4.353 3.739
445 HA LYS 60 HA LYS 60 -5.652 7.181 3.773
446 HB2 LYS 60 HB2 LYS 60 -7.095 5.933 5.378
447 HB3 LYS 60 HB3 LYS 60 -5.668 5.225 6.133
448 HG2 LYS 60 HG2 LYS 60 -5.647 8.198 5.955
449 HG3 LYS 60 HG3 LYS 60 -7.063 7.525 6.776
450 HD2 LYS 60 HD2 LYS 60 -5.569 6.257 8.323
451 HD3 LYS 60 HD3 LYS 60 -4.159 6.988 7.527
452 HE2 LYS 60 HE2 LYS 60 -4.801 8.164 9.626
453 HE3 LYS 60 HE3 LYS 60 -4.844 9.214 8.204
454 HZ1 LYS 60 HZ1 LYS 60 -6.754 9.429 9.716
455 HZ2 LYS 60 HZ2 LYS 60 -7.249 7.917 9.357
456 HZ3 LYS 60 HZ3 LYS 60 -7.218 9.057 8.168
457 H GLY 61 H GLY 61 -3.504 4.460 4.751
458 HA2 GLY 61 HA2 GLY 61 -1.542 6.101 5.986
459 HA3 GLY 61 HA3 GLY 61 -1.241 4.495 5.278
460 H ILE 62 H ILE 62 -1.593 4.798 2.642
461 HA ILE 62 HA ILE 62 0.798 6.205 1.970
462 HB ILE 62 HB ILE 62 0.088 4.322 0.847
463 HG12 ILE 62 HG12 ILE 62 0.565 4.985 -1.535
464 HG13 ILE 62 HG13 ILE 62 0.271 6.663 -1.109
465 HG21 ILE 62 HG21 ILE 62 -2.314 4.534 0.656
466 HG22 ILE 62 HG22 ILE 62 -2.131 5.836 -0.534
467 HG23 ILE 62 HG23 ILE 62 -1.620 4.205 -0.937
468 HD11 ILE 62 HD11 ILE 62 2.242 6.657 0.362
469 HD12 ILE 62 HD12 ILE 62 2.465 4.913 0.085
470 HD13 ILE 62 HD13 ILE 62 2.685 6.075 -1.243
471 H LEU 63 H LEU 63 -2.641 7.065 1.458
472 HA LEU 63 HA LEU 63 -2.020 9.508 0.089
473 HB2 LEU 63 HB2 LEU 63 -4.453 8.512 1.547
474 HB3 LEU 63 HB3 LEU 63 -4.334 10.216 1.197
475 HG LEU 63 HG LEU 63 -5.622 9.016 -0.515
476 HD11 LEU 63 HD11 LEU 63 -4.640 10.073 -2.437
477 HD12 LEU 63 HD12 LEU 63 -3.052 10.159 -1.656
478 HD13 LEU 63 HD13 LEU 63 -4.404 11.132 -1.027
479 HD21 LEU 63 HD21 LEU 63 -3.008 7.723 -1.371
480 HD22 LEU 63 HD22 LEU 63 -4.557 7.641 -2.215
481 HD23 LEU 63 HD23 LEU 63 -4.385 6.873 -0.639
482 H ASP 64 H ASP 64 -1.994 8.599 3.406
483 HA ASP 64 HA ASP 64 -1.892 11.356 4.467
484 HB2 ASP 64 HB2 ASP 64 -2.809 9.585 5.857
485 HB3 ASP 64 HB3 ASP 64 -1.266 8.715 5.837
486 H HIS 65 H HIS 65 0.402 8.869 3.624
487 HA HIS 65 HA HIS 65 2.784 10.126 4.633
488 HB2 HIS 65 HB2 HIS 65 2.843 7.753 4.171
489 HB3 HIS 65 HB3 HIS 65 2.239 7.986 2.542
490 HD1 HIS 65 HD1 HIS 65 5.513 8.718 4.490
491 HD2 HIS 65 HD2 HIS 65 3.942 8.287 0.591
492 HE1 HIS 65 HE1 HIS 65 7.512 8.646 2.890
493 H ARG 66 H ARG 66 1.447 9.821 1.287
494 HA ARG 66 HA ARG 66 3.233 11.779 0.234
495 HB2 ARG 66 HB2 ARG 66 1.919 11.629 -1.793
496 HB3 ARG 66 HB3 ARG 66 2.107 10.029 -1.097
497 HG2 ARG 66 HG2 ARG 66 -0.147 9.888 -1.448
498 HG3 ARG 66 HG3 ARG 66 -0.211 10.687 0.098
499 HD2 ARG 66 HD2 ARG 66 -1.717 11.874 -1.272
500 HD3 ARG 66 HD3 ARG 66 -0.298 12.899 -1.116
501 HE ARG 66 HE ARG 66 -0.562 11.002 -3.378
502 HH11 ARG 66 HH11 ARG 66 -0.447 14.432 -2.405
503 HH12 ARG 66 HH12 ARG 66 0.191 14.951 -3.947
504 HH21 ARG 66 HH21 ARG 66 0.160 11.759 -5.426
505 HH22 ARG 66 HH22 ARG 66 0.777 13.386 -5.506
506 H GLN 67 H GLN 67 0.130 12.256 2.013
507 HA GLN 67 HA GLN 67 -0.065 14.966 0.954
508 HB2 GLN 67 HB2 GLN 67 -2.078 13.819 1.699
509 HB3 GLN 67 HB3 GLN 67 -1.425 13.654 3.349
510 HG2 GLN 67 HG2 GLN 67 -1.350 16.048 3.595
511 HG3 GLN 67 HG3 GLN 67 -1.814 16.284 1.902
512 HE21 GLN 67 HE21 GLN 67 -3.159 17.731 3.541
513 HE22 GLN 67 HE22 GLN 67 -4.669 17.035 4.161
514 H LEU 68 H LEU 68 1.558 13.386 3.707
515 HA LEU 68 HA LEU 68 2.280 16.003 4.871
516 HB2 LEU 68 HB2 LEU 68 2.665 13.135 5.789
517 HB3 LEU 68 HB3 LEU 68 3.138 14.539 6.729
518 HG LEU 68 HG LEU 68 0.251 14.002 5.871
519 HD11 LEU 68 HD11 LEU 68 1.059 12.222 7.360
520 HD12 LEU 68 HD12 LEU 68 -0.105 13.262 8.185
521 HD13 LEU 68 HD13 LEU 68 1.639 13.438 8.510
522 HD21 LEU 68 HD21 LEU 68 1.384 15.913 7.942
523 HD22 LEU 68 HD22 LEU 68 -0.326 15.613 7.571
524 HD23 LEU 68 HD23 LEU 68 0.707 16.358 6.355
525 H HIS 69 H HIS 69 3.797 13.683 2.764
526 HA HIS 69 HA HIS 69 6.439 14.943 3.137
527 HB2 HIS 69 HB2 HIS 69 5.598 12.123 3.616
528 HB3 HIS 69 HB3 HIS 69 6.893 12.258 2.463
529 HD1 HIS 69 HD1 HIS 69 9.211 12.112 3.654
530 HD2 HIS 69 HD2 HIS 69 6.128 13.834 5.972
531 HE1 HIS 69 HE1 HIS 69 10.240 12.706 5.873
532 H ASP 70 H ASP 70 7.871 14.055 1.293
533 HA ASP 70 HA ASP 70 6.489 13.858 -1.309
534 HB2 ASP 70 HB2 ASP 70 6.983 16.283 -0.764
535 HB3 ASP 70 HB3 ASP 70 8.694 15.863 -0.674
Start of MODEL 10
1 H1 GLY 1 H GLY 1 24.279 -2.786 5.291
2 HA2 GLY 1 HA2 GLY 1 21.866 -1.274 6.121
3 HA3 GLY 1 HA3 GLY 1 22.130 -1.984 4.520
4 HA PRO 2 HA PRO 2 21.384 -5.589 7.622
5 HB2 PRO 2 HB2 PRO 2 19.874 -5.045 9.853
6 HB3 PRO 2 HB3 PRO 2 21.650 -4.888 9.813
7 HG2 PRO 2 HG2 PRO 2 19.592 -2.708 9.558
8 HG3 PRO 2 HG3 PRO 2 21.111 -2.697 10.486
9 HD2 PRO 2 HD2 PRO 2 20.817 -1.576 7.983
10 HD3 PRO 2 HD3 PRO 2 22.375 -2.210 8.583
11 H LEU 3 H LEU 3 18.984 -3.022 7.156
12 HA LEU 3 HA LEU 3 16.649 -4.647 7.123
13 HB2 LEU 3 HB2 LEU 3 17.357 -1.917 6.037
14 HB3 LEU 3 HB3 LEU 3 15.807 -2.639 5.649
15 HG LEU 3 HG LEU 3 15.662 -1.039 7.494
16 HD11 LEU 3 HD11 LEU 3 14.397 -2.403 9.100
17 HD12 LEU 3 HD12 LEU 3 15.052 -3.885 8.397
18 HD13 LEU 3 HD13 LEU 3 14.009 -2.813 7.431
19 HD21 LEU 3 HD21 LEU 3 17.881 -1.382 8.523
20 HD22 LEU 3 HD22 LEU 3 17.324 -2.973 9.142
21 HD23 LEU 3 HD23 LEU 3 16.564 -1.481 9.698
22 H GLY 4 H GLY 4 18.560 -3.290 4.336
23 HA2 GLY 4 HA2 GLY 4 18.871 -5.537 2.838
24 HA3 GLY 4 HA3 GLY 4 17.236 -4.966 2.426
25 H SER 5 H SER 5 18.249 -4.631 0.256
26 HA SER 5 HA SER 5 20.227 -2.556 -0.154
27 HB2 SER 5 HB2 SER 5 18.309 -3.936 -2.084
28 HB3 SER 5 HB3 SER 5 19.755 -3.032 -2.515
29 HG SER 5 HG SER 5 20.806 -4.675 -0.969
30 H THR 6 H THR 6 19.390 -0.837 -2.081
31 HA THR 6 HA THR 6 17.353 0.723 -0.703
32 HB THR 6 HB THR 6 17.889 2.297 -2.713
33 HG1 THR 6 HG1 THR 6 20.052 2.003 -3.379
34 HG21 THR 6 HG21 THR 6 18.523 2.597 -0.317
35 HG22 THR 6 HG22 THR 6 19.728 3.214 -1.442
36 HG23 THR 6 HG23 THR 6 20.010 1.671 -0.628
37 H ASP 7 H ASP 7 15.729 -0.821 -0.882
38 HA ASP 7 HA ASP 7 14.227 -0.823 -3.442
39 HB2 ASP 7 HB2 ASP 7 13.314 -2.970 -2.880
40 HB3 ASP 7 HB3 ASP 7 15.066 -3.084 -2.925
41 H CYS 8 H CYS 8 11.795 -1.089 -2.939
42 HA CYS 8 HA CYS 8 10.882 -0.070 -0.406
43 HB2 CYS 8 HB2 CYS 8 11.765 1.942 -1.883
44 HB3 CYS 8 HB3 CYS 8 10.298 1.671 -2.838
45 HG CYS 8 HG CYS 8 10.686 2.273 0.401
46 H SER 9 H SER 9 9.008 -1.311 -0.215
47 HA SER 9 HA SER 9 7.197 -1.673 -2.469
48 HB2 SER 9 HB2 SER 9 8.833 -3.489 -2.760
49 HB3 SER 9 HB3 SER 9 8.579 -4.025 -1.105
50 HG SER 9 HG SER 9 7.296 -4.737 -3.270
51 H ILE 10 H ILE 10 5.107 -2.515 -1.610
52 HA ILE 10 HA ILE 10 4.219 -1.153 0.639
53 HB ILE 10 HB ILE 10 2.894 -3.678 -0.388
54 HG12 ILE 10 HG12 ILE 10 2.535 -0.842 -1.439
55 HG13 ILE 10 HG13 ILE 10 3.429 -2.123 -2.223
56 HG21 ILE 10 HG21 ILE 10 0.843 -2.657 0.409
57 HG22 ILE 10 HG22 ILE 10 1.989 -2.623 1.735
58 HG23 ILE 10 HG23 ILE 10 1.685 -1.150 0.802
59 HD11 ILE 10 HD11 ILE 10 1.276 -2.196 -3.247
60 HD12 ILE 10 HD12 ILE 10 1.351 -3.556 -2.126
61 HD13 ILE 10 HD13 ILE 10 0.444 -2.095 -1.691
62 H VAL 11 H VAL 11 5.713 -4.264 0.507
63 HA VAL 11 HA VAL 11 4.958 -5.322 3.037
64 HB VAL 11 HB VAL 11 7.339 -6.247 3.120
65 HG11 VAL 11 HG11 VAL 11 6.804 -7.895 1.348
66 HG12 VAL 11 HG12 VAL 11 5.357 -7.481 2.278
67 HG13 VAL 11 HG13 VAL 11 5.595 -6.781 0.666
68 HG21 VAL 11 HG21 VAL 11 8.644 -6.285 1.080
69 HG22 VAL 11 HG22 VAL 11 7.475 -5.271 0.238
70 HG23 VAL 11 HG23 VAL 11 8.466 -4.605 1.567
71 H SER 12 H SER 12 7.559 -2.953 2.372
72 HA SER 12 HA SER 12 8.382 -2.624 5.071
73 HB2 SER 12 HB2 SER 12 9.596 -2.085 2.923
74 HB3 SER 12 HB3 SER 12 8.548 -0.675 2.722
75 HG SER 12 HG SER 12 10.642 -0.387 3.632
76 H PHE 13 H PHE 13 6.011 -0.903 3.004
77 HA PHE 13 HA PHE 13 5.386 1.157 4.886
78 HB2 PHE 13 HB2 PHE 13 4.710 1.366 2.584
79 HB3 PHE 13 HB3 PHE 13 3.768 -0.116 2.647
80 HD1 PHE 13 HD1 PHE 13 1.574 0.541 2.122
81 HD2 PHE 13 HD2 PHE 13 3.809 2.817 4.999
82 HE1 PHE 13 HE1 PHE 13 -0.467 1.862 2.689
83 HE2 PHE 13 HE2 PHE 13 1.776 4.156 5.520
84 HZ PHE 13 HZ PHE 13 -0.372 3.592 4.396
85 H PHE 14 H PHE 14 3.959 -2.082 4.352
86 HA PHE 14 HA PHE 14 2.046 -1.909 6.433
87 HB2 PHE 14 HB2 PHE 14 3.359 -4.271 5.056
88 HB3 PHE 14 HB3 PHE 14 2.103 -4.441 6.258
89 HD1 PHE 14 HD1 PHE 14 2.075 -5.457 3.404
90 HD2 PHE 14 HD2 PHE 14 0.457 -1.856 5.124
91 HE1 PHE 14 HE1 PHE 14 0.262 -5.452 1.710
92 HE2 PHE 14 HE2 PHE 14 -1.232 -1.759 3.360
93 HZ PHE 14 HZ PHE 14 -1.374 -3.617 1.677
94 H ALA 15 H ALA 15 5.404 -3.222 6.465
95 HA ALA 15 HA ALA 15 5.356 -4.157 9.132
96 HB1 ALA 15 HB1 ALA 15 7.697 -2.953 7.583
97 HB2 ALA 15 HB2 ALA 15 7.810 -3.983 9.023
98 HB3 ALA 15 HB3 ALA 15 7.162 -4.647 7.510
99 H ARG 16 H ARG 16 5.757 -0.847 7.854
100 HA ARG 16 HA ARG 16 6.527 0.272 10.426
101 HB2 ARG 16 HB2 ARG 16 5.482 1.538 7.858
102 HB3 ARG 16 HB3 ARG 16 5.960 2.469 9.277
103 HG2 ARG 16 HG2 ARG 16 7.831 0.534 7.834
104 HG3 ARG 16 HG3 ARG 16 7.710 2.254 7.464
105 HD2 ARG 16 HD2 ARG 16 8.399 2.835 9.727
106 HD3 ARG 16 HD3 ARG 16 8.371 1.128 10.212
107 HE ARG 16 HE ARG 16 10.135 1.080 8.168
108 HH11 ARG 16 HH11 ARG 16 9.857 2.692 11.313
109 HH12 ARG 16 HH12 ARG 16 11.534 3.063 11.485
110 HH21 ARG 16 HH21 ARG 16 12.457 1.306 8.549
111 HH22 ARG 16 HH22 ARG 16 13.032 2.229 9.900
112 H LEU 17 H LEU 17 3.458 0.199 8.587
113 HA LEU 17 HA LEU 17 1.855 1.456 10.574
114 HB2 LEU 17 HB2 LEU 17 1.074 -0.707 8.575
115 HB3 LEU 17 HB3 LEU 17 -0.070 0.289 9.462
116 HG LEU 17 HG LEU 17 1.965 1.404 7.550
117 HD11 LEU 17 HD11 LEU 17 -0.744 0.248 7.123
118 HD12 LEU 17 HD12 LEU 17 0.715 0.152 6.097
119 HD13 LEU 17 HD13 LEU 17 -0.275 1.622 6.113
120 HD21 LEU 17 HD21 LEU 17 0.487 3.398 7.488
121 HD22 LEU 17 HD22 LEU 17 1.016 3.076 9.150
122 HD23 LEU 17 HD23 LEU 17 -0.613 2.615 8.634
123 H GLY 18 H GLY 18 2.783 -1.967 10.201
124 HA2 GLY 18 HA2 GLY 18 2.946 -3.406 12.068
125 HA3 GLY 18 HA3 GLY 18 1.539 -2.629 12.813
126 H CYS 19 H CYS 19 1.491 -3.215 9.328
127 HA CYS 19 HA CYS 19 -0.731 -5.150 9.747
128 HB2 CYS 19 HB2 CYS 19 -0.962 -3.046 8.325
129 HB3 CYS 19 HB3 CYS 19 -0.034 -3.954 7.098
130 HG CYS 19 HG CYS 19 -1.575 -5.841 6.783
131 H SER 20 H SER 20 -0.766 -7.200 9.216
132 HA SER 20 HA SER 20 1.769 -8.392 8.240
133 HB2 SER 20 HB2 SER 20 -0.062 -9.867 10.098
134 HB3 SER 20 HB3 SER 20 1.674 -10.044 9.803
135 HG SER 20 HG SER 20 2.043 -8.166 10.910
136 H SER 21 H SER 21 -1.697 -9.547 8.666
137 HA SER 21 HA SER 21 -1.565 -11.444 6.741
138 HB2 SER 21 HB2 SER 21 -4.108 -9.877 6.902
139 HB3 SER 21 HB3 SER 21 -3.847 -11.613 6.905
140 HG SER 21 HG SER 21 -4.456 -11.132 8.897
141 H CYS 22 H CYS 22 -2.203 -7.918 6.099
142 HA CYS 22 HA CYS 22 -2.902 -8.546 3.403
143 HB2 CYS 22 HB2 CYS 22 -3.393 -6.339 4.841
144 HB3 CYS 22 HB3 CYS 22 -1.931 -5.784 3.985
145 HG CYS 22 HG CYS 22 -3.902 -4.988 2.550
146 H LEU 23 H LEU 23 0.211 -7.886 4.977
147 HA LEU 23 HA LEU 23 1.606 -7.446 2.507
148 HB2 LEU 23 HB2 LEU 23 3.524 -7.364 3.685
149 HB3 LEU 23 HB3 LEU 23 2.411 -7.114 4.988
150 HG LEU 23 HG LEU 23 2.672 -9.733 5.364
151 HD11 LEU 23 HD11 LEU 23 4.068 -10.173 3.318
152 HD12 LEU 23 HD12 LEU 23 4.890 -10.574 4.814
153 HD13 LEU 23 HD13 LEU 23 5.298 -9.073 3.959
154 HD21 LEU 23 HD21 LEU 23 4.521 -9.255 6.881
155 HD22 LEU 23 HD22 LEU 23 3.339 -7.941 6.907
156 HD23 LEU 23 HD23 LEU 23 4.861 -7.729 6.029
157 H ASP 24 H ASP 24 0.841 -10.379 4.365
158 HA ASP 24 HA ASP 24 2.187 -12.216 2.689
159 HB2 ASP 24 HB2 ASP 24 1.220 -12.665 4.958
160 HB3 ASP 24 HB3 ASP 24 -0.394 -12.622 4.265
161 H TYR 25 H TYR 25 -1.133 -10.901 2.486
162 HA TYR 25 HA TYR 25 -1.931 -12.508 0.236
163 HB2 TYR 25 HB2 TYR 25 -2.912 -9.751 1.038
164 HB3 TYR 25 HB3 TYR 25 -3.726 -10.882 -0.035
165 HD1 TYR 25 HD1 TYR 25 -4.661 -9.489 2.640
166 HD2 TYR 25 HD2 TYR 25 -3.214 -13.448 1.730
167 HE1 TYR 25 HE1 TYR 25 -6.007 -10.409 4.499
168 HE2 TYR 25 HE2 TYR 25 -4.524 -14.370 3.571
169 HH TYR 25 HH TYR 25 -6.875 -12.391 5.412
170 H PHE 26 H PHE 26 -0.722 -9.119 0.414
171 HA PHE 26 HA PHE 26 -0.527 -8.620 -2.318
172 HB2 PHE 26 HB2 PHE 26 0.577 -7.517 0.229
173 HB3 PHE 26 HB3 PHE 26 1.559 -7.219 -1.137
174 HD1 PHE 26 HD1 PHE 26 0.672 -6.037 -3.154
175 HD2 PHE 26 HD2 PHE 26 -1.612 -6.374 0.470
176 HE1 PHE 26 HE1 PHE 26 -0.738 -4.154 -3.885
177 HE2 PHE 26 HE2 PHE 26 -3.034 -4.497 -0.256
178 HZ PHE 26 HZ PHE 26 -2.621 -3.377 -2.465
179 H THR 27 H THR 27 2.025 -10.135 -0.206
180 HA THR 27 HA THR 27 3.937 -10.133 -2.350
181 HB THR 27 HB THR 27 5.283 -11.557 -0.891
182 HG1 THR 27 HG1 THR 27 4.528 -11.900 1.239
183 HG21 THR 27 HG21 THR 27 5.516 -9.198 -0.591
184 HG22 THR 27 HG22 THR 27 5.491 -9.931 1.017
185 HG23 THR 27 HG23 THR 27 4.063 -9.086 0.421
186 H THR 28 H THR 28 1.606 -12.620 -1.155
187 HA THR 28 HA THR 28 2.579 -14.626 -2.933
188 HB THR 28 HB THR 28 0.660 -14.458 -0.909
189 HG1 THR 28 HG1 THR 28 2.039 -16.166 -1.283
190 HG21 THR 28 HG21 THR 28 -0.754 -15.432 -3.420
191 HG22 THR 28 HG22 THR 28 -1.208 -14.017 -2.431
192 HG23 THR 28 HG23 THR 28 -1.306 -15.647 -1.754
193 H GLN 29 H GLN 29 0.287 -11.926 -3.436
194 HA GLN 29 HA GLN 29 -0.588 -12.872 -6.028
195 HB2 GLN 29 HB2 GLN 29 -0.725 -10.157 -4.653
196 HB3 GLN 29 HB3 GLN 29 -1.546 -10.581 -6.170
197 HG2 GLN 29 HG2 GLN 29 -2.132 -12.142 -3.667
198 HG3 GLN 29 HG3 GLN 29 -2.931 -10.612 -4.014
199 HE21 GLN 29 HE21 GLN 29 -4.909 -10.842 -5.183
200 HE22 GLN 29 HE22 GLN 29 -5.270 -12.295 -6.059
201 H GLY 30 H GLY 30 2.254 -11.231 -4.988
202 HA2 GLY 30 HA2 GLY 30 4.112 -10.474 -6.182
203 HA3 GLY 30 HA3 GLY 30 3.427 -11.248 -7.601
204 H LEU 31 H LEU 31 1.855 -8.692 -5.722
205 HA LEU 31 HA LEU 31 2.354 -6.701 -7.877
206 HB2 LEU 31 HB2 LEU 31 -0.098 -6.071 -7.692
207 HB3 LEU 31 HB3 LEU 31 0.306 -7.557 -8.508
208 HG LEU 31 HG LEU 31 -0.256 -8.844 -6.474
209 HD11 LEU 31 HD11 LEU 31 -1.290 -6.185 -5.447
210 HD12 LEU 31 HD12 LEU 31 -0.114 -7.303 -4.698
211 HD13 LEU 31 HD13 LEU 31 -1.811 -7.764 -4.812
212 HD21 LEU 31 HD21 LEU 31 -2.654 -8.736 -6.807
213 HD22 LEU 31 HD22 LEU 31 -1.752 -8.698 -8.317
214 HD23 LEU 31 HD23 LEU 31 -2.471 -7.193 -7.676
215 H THR 32 H THR 32 3.506 -6.989 -5.141
216 HA THR 32 HA THR 32 2.286 -4.707 -3.710
217 HB THR 32 HB THR 32 2.898 -6.293 -2.218
218 HG1 THR 32 HG1 THR 32 5.354 -4.925 -2.140
219 HG21 THR 32 HG21 THR 32 5.065 -7.484 -2.055
220 HG22 THR 32 HG22 THR 32 5.495 -6.854 -3.656
221 HG23 THR 32 HG23 THR 32 4.085 -7.934 -3.453
222 H THR 33 H THR 33 2.787 -2.649 -4.159
223 HA THR 33 HA THR 33 5.520 -1.946 -4.480
224 HB THR 33 HB THR 33 5.525 -2.147 -6.764
225 HG1 THR 33 HG1 THR 33 5.288 -0.296 -7.611
226 HG21 THR 33 HG21 THR 33 3.513 -3.560 -6.979
227 HG22 THR 33 HG22 THR 33 3.558 -2.368 -8.252
228 HG23 THR 33 HG23 THR 33 2.445 -2.137 -6.874
229 H ILE 34 H ILE 34 5.821 0.287 -4.092
230 HA ILE 34 HA ILE 34 3.661 1.595 -2.646
231 HB ILE 34 HB ILE 34 6.400 2.753 -3.253
232 HG12 ILE 34 HG12 ILE 34 6.678 0.574 -2.089
233 HG13 ILE 34 HG13 ILE 34 7.210 1.960 -1.184
234 HG21 ILE 34 HG21 ILE 34 4.175 3.369 -1.253
235 HG22 ILE 34 HG22 ILE 34 5.835 3.879 -0.972
236 HG23 ILE 34 HG23 ILE 34 4.955 4.469 -2.405
237 HD11 ILE 34 HD11 ILE 34 4.561 0.537 -0.708
238 HD12 ILE 34 HD12 ILE 34 6.022 0.442 0.316
239 HD13 ILE 34 HD13 ILE 34 5.148 1.934 0.217
240 H TYR 35 H TYR 35 5.529 2.227 -5.570
241 HA TYR 35 HA TYR 35 4.435 4.675 -6.364
242 HB2 TYR 35 HB2 TYR 35 5.479 2.440 -8.150
243 HB3 TYR 35 HB3 TYR 35 5.406 4.151 -8.542
244 HD1 TYR 35 HD1 TYR 35 7.101 1.612 -6.375
245 HD2 TYR 35 HD2 TYR 35 7.144 5.697 -7.794
246 HE1 TYR 35 HE1 TYR 35 9.219 1.989 -5.185
247 HE2 TYR 35 HE2 TYR 35 9.335 6.028 -6.734
248 HH TYR 35 HH TYR 35 10.848 5.187 -5.160
249 H GLN 36 H GLN 36 3.150 1.427 -6.623
250 HA GLN 36 HA GLN 36 1.101 2.241 -8.611
251 HB2 GLN 36 HB2 GLN 36 1.632 -0.271 -7.083
252 HB3 GLN 36 HB3 GLN 36 0.204 -0.071 -8.087
253 HG2 GLN 36 HG2 GLN 36 3.019 0.072 -9.183
254 HG3 GLN 36 HG3 GLN 36 1.951 -1.344 -9.207
255 HE21 GLN 36 HE21 GLN 36 2.772 1.526 -10.942
256 HE22 GLN 36 HE22 GLN 36 1.465 1.339 -12.103
257 H ILE 37 H ILE 37 1.170 1.400 -5.021
258 HA ILE 37 HA ILE 37 -1.620 1.870 -4.760
259 HB ILE 37 HB ILE 37 -1.227 2.210 -2.321
260 HG12 ILE 37 HG12 ILE 37 1.624 1.514 -2.998
261 HG13 ILE 37 HG13 ILE 37 1.079 3.109 -2.481
262 HG21 ILE 37 HG21 ILE 37 -0.833 -0.159 -1.958
263 HG22 ILE 37 HG22 ILE 37 -1.779 0.047 -3.422
264 HG23 ILE 37 HG23 ILE 37 -0.041 -0.305 -3.537
265 HD11 ILE 37 HD11 ILE 37 0.371 2.166 -0.309
266 HD12 ILE 37 HD12 ILE 37 0.933 0.563 -0.830
267 HD13 ILE 37 HD13 ILE 37 2.100 1.881 -0.641
268 H GLU 38 H GLU 38 0.941 4.116 -5.209
269 HA GLU 38 HA GLU 38 -0.172 6.408 -4.018
270 HB2 GLU 38 HB2 GLU 38 2.161 5.940 -5.115
271 HB3 GLU 38 HB3 GLU 38 1.409 6.377 -6.636
272 HG2 GLU 38 HG2 GLU 38 1.417 8.209 -4.191
273 HG3 GLU 38 HG3 GLU 38 2.750 8.149 -5.338
274 H HIS 39 H HIS 39 -0.901 4.746 -7.107
275 HA HIS 39 HA HIS 39 -3.009 6.801 -7.619
276 HB2 HIS 39 HB2 HIS 39 -2.845 6.349 -9.907
277 HB3 HIS 39 HB3 HIS 39 -1.212 6.627 -9.321
278 HD1 HIS 39 HD1 HIS 39 -3.519 3.665 -10.360
279 HD2 HIS 39 HD2 HIS 39 0.533 4.731 -9.839
280 HE1 HIS 39 HE1 HIS 39 -2.122 1.673 -11.181
281 H TYR 40 H TYR 40 -2.511 3.365 -6.967
282 HA TYR 40 HA TYR 40 -4.942 2.483 -8.121
283 HB2 TYR 40 HB2 TYR 40 -3.065 1.339 -6.078
284 HB3 TYR 40 HB3 TYR 40 -4.680 0.690 -6.127
285 HD1 TYR 40 HD1 TYR 40 -1.577 -0.457 -7.111
286 HD2 TYR 40 HD2 TYR 40 -5.442 0.582 -8.895
287 HE1 TYR 40 HE1 TYR 40 -1.172 -1.910 -8.988
288 HE2 TYR 40 HE2 TYR 40 -4.946 -0.916 -10.769
289 HH TYR 40 HH TYR 40 -1.707 -2.353 -11.168
290 H SER 41 H SER 41 -6.895 3.259 -7.745
291 HA SER 41 HA SER 41 -7.567 4.615 -5.305
292 HB2 SER 41 HB2 SER 41 -9.354 3.730 -7.626
293 HB3 SER 41 HB3 SER 41 -9.692 5.019 -6.456
294 HG SER 41 HG SER 41 -8.896 5.834 -8.419
295 H MET 42 H MET 42 -9.772 4.145 -4.357
296 HA MET 42 HA MET 42 -9.695 1.881 -2.768
297 HB2 MET 42 HB2 MET 42 -12.036 3.620 -3.617
298 HB3 MET 42 HB3 MET 42 -12.126 2.452 -2.308
299 HG2 MET 42 HG2 MET 42 -10.312 4.889 -2.376
300 HG3 MET 42 HG3 MET 42 -11.804 4.712 -1.471
301 HE1 MET 42 HE1 MET 42 -9.958 5.855 0.112
302 HE2 MET 42 HE2 MET 42 -11.202 5.009 1.040
303 HE3 MET 42 HE3 MET 42 -9.502 4.857 1.508
304 H ASP 43 H ASP 43 -11.399 2.244 -5.905
305 HA ASP 43 HA ASP 43 -12.981 -0.117 -5.745
306 HB2 ASP 43 HB2 ASP 43 -13.298 1.709 -7.411
307 HB3 ASP 43 HB3 ASP 43 -11.796 1.229 -8.215
308 H ASP 44 H ASP 44 -9.684 0.428 -7.033
309 HA ASP 44 HA ASP 44 -9.407 -2.261 -8.040
310 HB2 ASP 44 HB2 ASP 44 -7.802 0.185 -8.003
311 HB3 ASP 44 HB3 ASP 44 -6.815 -1.195 -7.531
312 H LEU 45 H LEU 45 -8.357 -0.561 -5.089
313 HA LEU 45 HA LEU 45 -7.031 -2.729 -3.827
314 HB2 LEU 45 HB2 LEU 45 -8.694 -0.464 -2.637
315 HB3 LEU 45 HB3 LEU 45 -7.786 -1.612 -1.655
316 HG LEU 45 HG LEU 45 -6.516 0.289 -3.672
317 HD11 LEU 45 HD11 LEU 45 -6.881 0.437 -0.640
318 HD12 LEU 45 HD12 LEU 45 -7.459 1.599 -1.855
319 HD13 LEU 45 HD13 LEU 45 -5.732 1.422 -1.540
320 HD21 LEU 45 HD21 LEU 45 -5.142 -1.717 -3.288
321 HD22 LEU 45 HD22 LEU 45 -5.301 -1.513 -1.525
322 HD23 LEU 45 HD23 LEU 45 -4.416 -0.316 -2.504
323 H ALA 46 H ALA 46 -10.491 -1.815 -3.889
324 HA ALA 46 HA ALA 46 -11.419 -3.867 -2.155
325 HB1 ALA 46 HB1 ALA 46 -13.606 -3.475 -3.248
326 HB2 ALA 46 HB2 ALA 46 -12.822 -1.966 -2.719
327 HB3 ALA 46 HB3 ALA 46 -12.827 -2.415 -4.429
328 H SER 47 H SER 47 -10.845 -3.849 -5.685
329 HA SER 47 HA SER 47 -11.954 -6.431 -6.182
330 HB2 SER 47 HB2 SER 47 -11.476 -4.590 -7.845
331 HB3 SER 47 HB3 SER 47 -9.763 -5.010 -7.732
332 HG SER 47 HG SER 47 -10.694 -6.106 -9.449
333 H LEU 48 H LEU 48 -8.779 -5.351 -4.987
334 HA LEU 48 HA LEU 48 -7.523 -7.970 -5.210
335 HB2 LEU 48 HB2 LEU 48 -6.722 -5.541 -3.559
336 HB3 LEU 48 HB3 LEU 48 -5.753 -6.986 -3.779
337 HG LEU 48 HG LEU 48 -6.496 -5.017 -5.961
338 HD11 LEU 48 HD11 LEU 48 -4.071 -4.564 -5.895
339 HD12 LEU 48 HD12 LEU 48 -3.875 -5.653 -4.521
340 HD13 LEU 48 HD13 LEU 48 -4.847 -4.165 -4.364
341 HD21 LEU 48 HD21 LEU 48 -4.866 -6.245 -7.352
342 HD22 LEU 48 HD22 LEU 48 -6.269 -7.243 -6.969
343 HD23 LEU 48 HD23 LEU 48 -4.734 -7.504 -6.106
344 H LYS 49 H LYS 49 -10.171 -7.782 -3.706
345 HA LYS 49 HA LYS 49 -11.207 -8.758 -2.006
346 HB2 LYS 49 HB2 LYS 49 -9.532 -10.504 -2.780
347 HB3 LYS 49 HB3 LYS 49 -8.587 -10.161 -1.345
348 HG2 LYS 49 HG2 LYS 49 -11.499 -11.020 -1.195
349 HG3 LYS 49 HG3 LYS 49 -10.189 -12.155 -1.495
350 HD2 LYS 49 HD2 LYS 49 -9.139 -10.974 0.664
351 HD3 LYS 49 HD3 LYS 49 -10.853 -10.711 1.039
352 HE2 LYS 49 HE2 LYS 49 -11.277 -13.094 0.971
353 HE3 LYS 49 HE3 LYS 49 -9.675 -13.415 0.291
354 HZ1 LYS 49 HZ1 LYS 49 -9.721 -13.885 2.636
355 HZ2 LYS 49 HZ2 LYS 49 -10.170 -12.341 2.999
356 HZ3 LYS 49 HZ3 LYS 49 -8.694 -12.649 2.331
357 H ILE 50 H ILE 50 -9.699 -6.135 -1.559
358 HA ILE 50 HA ILE 50 -9.230 -6.282 1.347
359 HB ILE 50 HB ILE 50 -8.727 -3.895 -0.424
360 HG12 ILE 50 HG12 ILE 50 -6.926 -6.287 0.247
361 HG13 ILE 50 HG13 ILE 50 -7.451 -5.814 -1.362
362 HG21 ILE 50 HG21 ILE 50 -8.811 -3.800 2.161
363 HG22 ILE 50 HG22 ILE 50 -7.357 -4.822 2.104
364 HG23 ILE 50 HG23 ILE 50 -7.337 -3.199 1.380
365 HD11 ILE 50 HD11 ILE 50 -5.556 -4.263 0.388
366 HD12 ILE 50 HD12 ILE 50 -5.155 -5.202 -1.054
367 HD13 ILE 50 HD13 ILE 50 -6.160 -3.722 -1.196
368 HA PRO 51 HA PRO 51 -13.572 -4.847 1.560
369 HB2 PRO 51 HB2 PRO 51 -13.935 -5.084 4.280
370 HB3 PRO 51 HB3 PRO 51 -13.951 -6.500 3.178
371 HG2 PRO 51 HG2 PRO 51 -11.628 -5.457 4.820
372 HG3 PRO 51 HG3 PRO 51 -12.213 -7.143 4.671
373 HD2 PRO 51 HD2 PRO 51 -10.132 -6.271 3.229
374 HD3 PRO 51 HD3 PRO 51 -11.356 -7.381 2.514
375 H GLU 52 H GLU 52 -14.483 -2.851 2.076
376 HA GLU 52 HA GLU 52 -13.090 -0.561 2.144
377 HB2 GLU 52 HB2 GLU 52 -15.080 0.567 2.710
378 HB3 GLU 52 HB3 GLU 52 -15.490 -0.838 1.748
379 HG2 GLU 52 HG2 GLU 52 -15.985 -2.043 3.999
380 HG3 GLU 52 HG3 GLU 52 -15.843 -0.466 4.752
381 H GLN 53 H GLN 53 -14.173 -2.178 5.133
382 HA GLN 53 HA GLN 53 -13.427 -0.290 6.987
383 HB2 GLN 53 HB2 GLN 53 -14.752 -2.450 7.244
384 HB3 GLN 53 HB3 GLN 53 -13.212 -3.304 7.375
385 HG2 GLN 53 HG2 GLN 53 -12.657 -2.128 9.411
386 HG3 GLN 53 HG3 GLN 53 -13.966 -0.968 9.174
387 HE21 GLN 53 HE21 GLN 53 -15.780 -1.349 10.405
388 HE22 GLN 53 HE22 GLN 53 -16.251 -2.923 11.038
389 H PHE 54 H PHE 54 -11.293 -2.644 5.413
390 HA PHE 54 HA PHE 54 -9.007 -1.574 7.021
391 HB2 PHE 54 HB2 PHE 54 -9.257 -3.912 7.276
392 HB3 PHE 54 HB3 PHE 54 -9.446 -4.160 5.530
393 HD1 PHE 54 HD1 PHE 54 -7.685 -4.015 4.038
394 HD2 PHE 54 HD2 PHE 54 -6.987 -3.386 8.225
395 HE1 PHE 54 HE1 PHE 54 -5.237 -4.162 3.645
396 HE2 PHE 54 HE2 PHE 54 -4.517 -3.365 7.807
397 HZ PHE 54 HZ PHE 54 -3.642 -3.736 5.512
398 H ARG 55 H ARG 55 -10.280 -1.938 3.712
399 HA ARG 55 HA ARG 55 -8.047 -1.158 2.196
400 HB2 ARG 55 HB2 ARG 55 -10.030 -2.189 1.380
401 HB3 ARG 55 HB3 ARG 55 -11.047 -0.874 1.937
402 HG2 ARG 55 HG2 ARG 55 -9.109 0.170 0.061
403 HG3 ARG 55 HG3 ARG 55 -9.911 -1.239 -0.640
404 HD2 ARG 55 HD2 ARG 55 -11.403 1.100 0.625
405 HD3 ARG 55 HD3 ARG 55 -10.991 0.983 -1.089
406 HE ARG 55 HE ARG 55 -12.296 -1.346 -0.720
407 HH11 ARG 55 HH11 ARG 55 -13.264 2.050 0.082
408 HH12 ARG 55 HH12 ARG 55 -14.804 1.850 -0.684
409 HH21 ARG 55 HH21 ARG 55 -14.611 -1.536 -1.423
410 HH22 ARG 55 HH22 ARG 55 -15.544 -0.085 -1.380
411 H HIS 56 H HIS 56 -10.511 0.837 3.954
412 HA HIS 56 HA HIS 56 -9.475 3.337 3.061
413 HB2 HIS 56 HB2 HIS 56 -11.727 2.879 4.079
414 HB3 HIS 56 HB3 HIS 56 -10.953 2.667 5.639
415 HD1 HIS 56 HD1 HIS 56 -12.880 4.712 6.091
416 HD2 HIS 56 HD2 HIS 56 -9.404 5.677 3.900
417 HE1 HIS 56 HE1 HIS 56 -12.720 7.219 6.073
418 H ALA 57 H ALA 57 -8.311 1.023 5.522
419 HA ALA 57 HA ALA 57 -6.745 2.902 7.031
420 HB1 ALA 57 HB1 ALA 57 -6.215 -0.081 6.805
421 HB2 ALA 57 HB2 ALA 57 -5.746 1.030 8.080
422 HB3 ALA 57 HB3 ALA 57 -7.467 0.612 7.866
423 H ILE 58 H ILE 58 -5.808 0.429 4.459
424 HA ILE 58 HA ILE 58 -3.145 1.280 4.315
425 HB ILE 58 HB ILE 58 -3.663 -0.781 3.323
426 HG12 ILE 58 HG12 ILE 58 -3.241 1.204 1.040
427 HG13 ILE 58 HG13 ILE 58 -2.001 0.574 2.136
428 HG21 ILE 58 HG21 ILE 58 -5.686 0.490 1.449
429 HG22 ILE 58 HG22 ILE 58 -5.256 -1.208 1.504
430 HG23 ILE 58 HG23 ILE 58 -6.061 -0.516 2.883
431 HD11 ILE 58 HD11 ILE 58 -3.538 -1.093 0.146
432 HD12 ILE 58 HD12 ILE 58 -1.931 -0.394 -0.090
433 HD13 ILE 58 HD13 ILE 58 -2.161 -1.594 1.174
434 H TRP 59 H TRP 59 -5.933 2.345 2.392
435 HA TRP 59 HA TRP 59 -4.440 4.118 0.779
436 HB2 TRP 59 HB2 TRP 59 -6.880 3.154 0.525
437 HB3 TRP 59 HB3 TRP 59 -7.324 4.683 1.257
438 HD1 TRP 59 HD1 TRP 59 -5.145 3.409 -1.713
439 HE1 TRP 59 HE1 TRP 59 -5.381 4.949 -3.689
440 HE3 TRP 59 HE3 TRP 59 -8.010 6.930 0.474
441 HZ2 TRP 59 HZ2 TRP 59 -6.792 7.414 -4.329
442 HZ3 TRP 59 HZ3 TRP 59 -8.892 8.879 -0.900
443 HH2 TRP 59 HH2 TRP 59 -8.266 9.118 -3.258
444 H LYS 60 H LYS 60 -6.410 4.902 3.768
445 HA LYS 60 HA LYS 60 -5.727 7.646 3.738
446 HB2 LYS 60 HB2 LYS 60 -7.421 6.526 5.204
447 HB3 LYS 60 HB3 LYS 60 -6.122 5.888 6.212
448 HG2 LYS 60 HG2 LYS 60 -6.661 8.837 5.694
449 HG3 LYS 60 HG3 LYS 60 -7.397 7.941 7.007
450 HD2 LYS 60 HD2 LYS 60 -4.421 8.470 6.738
451 HD3 LYS 60 HD3 LYS 60 -5.516 9.378 7.727
452 HE2 LYS 60 HE2 LYS 60 -5.420 6.390 8.159
453 HE3 LYS 60 HE3 LYS 60 -4.021 7.347 8.644
454 HZ1 LYS 60 HZ1 LYS 60 -6.768 7.841 9.574
455 HZ2 LYS 60 HZ2 LYS 60 -5.430 8.720 9.976
456 HZ3 LYS 60 HZ3 LYS 60 -5.562 7.153 10.451
457 H GLY 61 H GLY 61 -3.946 4.848 5.100
458 HA2 GLY 61 HA2 GLY 61 -1.904 6.332 6.388
459 HA3 GLY 61 HA3 GLY 61 -1.718 4.691 5.778
460 H ILE 62 H ILE 62 -1.847 4.970 3.066
461 HA ILE 62 HA ILE 62 0.698 6.210 2.557
462 HB ILE 62 HB ILE 62 -0.168 4.181 1.573
463 HG12 ILE 62 HG12 ILE 62 0.897 4.587 -0.731
464 HG13 ILE 62 HG13 ILE 62 1.058 6.267 -0.253
465 HG21 ILE 62 HG21 ILE 62 -1.620 5.873 -0.470
466 HG22 ILE 62 HG22 ILE 62 -1.439 4.114 -0.500
467 HG23 ILE 62 HG23 ILE 62 -2.384 4.877 0.786
468 HD11 ILE 62 HD11 ILE 62 3.132 4.965 0.131
469 HD12 ILE 62 HD12 ILE 62 2.494 5.578 1.654
470 HD13 ILE 62 HD13 ILE 62 2.256 3.867 1.218
471 H LEU 63 H LEU 63 -2.645 7.200 1.849
472 HA LEU 63 HA LEU 63 -1.926 9.436 0.218
473 HB2 LEU 63 HB2 LEU 63 -4.339 8.687 1.857
474 HB3 LEU 63 HB3 LEU 63 -4.170 10.347 1.379
475 HG LEU 63 HG LEU 63 -5.545 8.913 -0.164
476 HD11 LEU 63 HD11 LEU 63 -3.172 10.284 -1.451
477 HD12 LEU 63 HD12 LEU 63 -4.591 11.121 -0.780
478 HD13 LEU 63 HD13 LEU 63 -4.765 10.012 -2.166
479 HD21 LEU 63 HD21 LEU 63 -2.853 7.836 -1.135
480 HD22 LEU 63 HD22 LEU 63 -4.400 7.648 -1.945
481 HD23 LEU 63 HD23 LEU 63 -4.148 6.878 -0.377
482 H ASP 64 H ASP 64 -1.936 8.846 3.636
483 HA ASP 64 HA ASP 64 -1.519 11.663 4.457
484 HB2 ASP 64 HB2 ASP 64 -1.422 9.010 5.883
485 HB3 ASP 64 HB3 ASP 64 -0.414 10.272 6.538
486 H HIS 65 H HIS 65 0.506 8.909 3.709
487 HA HIS 65 HA HIS 65 3.040 10.020 4.492
488 HB2 HIS 65 HB2 HIS 65 2.642 7.580 4.121
489 HB3 HIS 65 HB3 HIS 65 2.415 7.874 2.416
490 HD1 HIS 65 HD1 HIS 65 5.241 8.709 4.920
491 HD2 HIS 65 HD2 HIS 65 4.471 7.200 1.058
492 HE1 HIS 65 HE1 HIS 65 7.541 8.140 3.885
493 H ARG 66 H ARG 66 1.553 9.644 1.243
494 HA ARG 66 HA ARG 66 3.488 11.309 -0.040
495 HB2 ARG 66 HB2 ARG 66 2.081 11.182 -2.012
496 HB3 ARG 66 HB3 ARG 66 2.144 9.613 -1.221
497 HG2 ARG 66 HG2 ARG 66 -0.108 9.683 -1.565
498 HG3 ARG 66 HG3 ARG 66 -0.051 10.469 -0.012
499 HD2 ARG 66 HD2 ARG 66 -1.518 11.791 -1.294
500 HD3 ARG 66 HD3 ARG 66 -0.020 12.717 -1.249
501 HE ARG 66 HE ARG 66 -0.682 10.853 -3.473
502 HH11 ARG 66 HH11 ARG 66 -0.182 14.272 -2.560
503 HH12 ARG 66 HH12 ARG 66 0.135 14.745 -4.206
504 HH21 ARG 66 HH21 ARG 66 -0.089 11.505 -5.553
505 HH22 ARG 66 HH22 ARG 66 0.122 13.211 -5.913
506 H GLN 67 H GLN 67 0.567 12.178 1.858
507 HA GLN 67 HA GLN 67 0.508 14.843 0.665
508 HB2 GLN 67 HB2 GLN 67 -1.490 13.699 1.378
509 HB3 GLN 67 HB3 GLN 67 -0.883 13.564 3.044
510 HG2 GLN 67 HG2 GLN 67 -1.053 15.975 3.286
511 HG3 GLN 67 HG3 GLN 67 -1.499 16.133 1.564
512 HE21 GLN 67 HE21 GLN 67 -2.590 14.565 4.641
513 HE22 GLN 67 HE22 GLN 67 -4.288 14.530 4.218
514 H LEU 68 H LEU 68 2.205 13.239 3.342
515 HA LEU 68 HA LEU 68 3.096 15.863 4.391
516 HB2 LEU 68 HB2 LEU 68 3.057 13.085 5.579
517 HB3 LEU 68 HB3 LEU 68 3.801 14.475 6.374
518 HG LEU 68 HG LEU 68 0.853 14.349 5.574
519 HD11 LEU 68 HD11 LEU 68 2.228 13.899 8.258
520 HD12 LEU 68 HD12 LEU 68 1.233 12.747 7.313
521 HD13 LEU 68 HD13 LEU 68 0.484 14.168 8.044
522 HD21 LEU 68 HD21 LEU 68 2.460 16.401 7.162
523 HD22 LEU 68 HD22 LEU 68 0.683 16.326 7.103
524 HD23 LEU 68 HD23 LEU 68 1.574 16.654 5.642
525 H HIS 69 H HIS 69 4.290 13.555 2.262
526 HA HIS 69 HA HIS 69 7.056 14.496 2.745
527 HB2 HIS 69 HB2 HIS 69 6.415 12.091 3.622
528 HB3 HIS 69 HB3 HIS 69 6.389 11.649 1.922
529 HD1 HIS 69 HD1 HIS 69 9.147 13.970 3.484
530 HD2 HIS 69 HD2 HIS 69 8.473 10.046 2.060
531 HE1 HIS 69 HE1 HIS 69 11.354 12.779 3.631
532 H ASP 70 H ASP 70 8.370 14.065 0.589
533 HA ASP 70 HA ASP 70 6.855 13.826 -1.873
534 HB2 ASP 70 HB2 ASP 70 6.241 16.128 -1.505
535 HB3 ASP 70 HB3 ASP 70 7.873 16.546 -0.955
Start of MODEL 11
1 H1 GLY 1 H GLY 1 15.681 -21.286 -5.287
2 HA2 GLY 1 HA2 GLY 1 17.262 -19.712 -6.315
3 HA3 GLY 1 HA3 GLY 1 15.888 -18.609 -6.555
4 HA PRO 2 HA PRO 2 17.757 -18.283 -2.188
5 HB2 PRO 2 HB2 PRO 2 19.519 -16.201 -2.356
6 HB3 PRO 2 HB3 PRO 2 19.970 -17.894 -2.730
7 HG2 PRO 2 HG2 PRO 2 19.166 -15.702 -4.668
8 HG3 PRO 2 HG3 PRO 2 20.573 -16.810 -4.776
9 HD2 PRO 2 HD2 PRO 2 18.208 -17.247 -6.083
10 HD3 PRO 2 HD3 PRO 2 19.204 -18.605 -5.466
11 H LEU 3 H LEU 3 16.477 -15.975 -4.506
12 HA LEU 3 HA LEU 3 15.280 -14.046 -4.346
13 HB2 LEU 3 HB2 LEU 3 14.107 -15.725 -2.114
14 HB3 LEU 3 HB3 LEU 3 13.494 -14.128 -2.497
15 HG LEU 3 HG LEU 3 13.087 -14.854 -4.862
16 HD11 LEU 3 HD11 LEU 3 14.494 -16.831 -5.090
17 HD12 LEU 3 HD12 LEU 3 12.807 -17.287 -5.291
18 HD13 LEU 3 HD13 LEU 3 13.615 -17.631 -3.752
19 HD21 LEU 3 HD21 LEU 3 11.033 -16.081 -4.275
20 HD22 LEU 3 HD22 LEU 3 11.329 -14.684 -3.247
21 HD23 LEU 3 HD23 LEU 3 11.662 -16.320 -2.627
22 H GLY 4 H GLY 4 17.822 -13.858 -3.376
23 HA2 GLY 4 HA2 GLY 4 17.869 -12.271 -0.915
24 HA3 GLY 4 HA3 GLY 4 19.231 -12.878 -1.851
25 H SER 5 H SER 5 16.840 -10.334 -1.539
26 HA SER 5 HA SER 5 18.508 -8.345 -2.611
27 HB2 SER 5 HB2 SER 5 17.498 -9.375 -4.778
28 HB3 SER 5 HB3 SER 5 15.966 -8.677 -4.207
29 HG SER 5 HG SER 5 16.770 -6.928 -5.195
30 H THR 6 H THR 6 17.397 -6.265 -2.310
31 HA THR 6 HA THR 6 15.062 -6.293 -0.483
32 HB THR 6 HB THR 6 17.021 -5.959 0.924
33 HG1 THR 6 HG1 THR 6 15.484 -4.577 1.564
34 HG21 THR 6 HG21 THR 6 18.759 -5.325 -0.626
35 HG22 THR 6 HG22 THR 6 18.551 -4.001 0.543
36 HG23 THR 6 HG23 THR 6 17.905 -3.840 -1.093
37 H ASP 7 H ASP 7 13.719 -4.424 -0.808
38 HA ASP 7 HA ASP 7 14.367 -2.406 -2.759
39 HB2 ASP 7 HB2 ASP 7 12.868 -2.965 -4.450
40 HB3 ASP 7 HB3 ASP 7 13.663 -4.507 -4.137
41 H CYS 8 H CYS 8 12.270 -1.027 -3.060
42 HA CYS 8 HA CYS 8 10.940 -0.763 -0.408
43 HB2 CYS 8 HB2 CYS 8 11.354 1.174 -2.731
44 HB3 CYS 8 HB3 CYS 8 10.351 1.501 -1.322
45 HG CYS 8 HG CYS 8 12.123 1.393 0.507
46 H SER 9 H SER 9 9.000 -1.764 -0.390
47 HA SER 9 HA SER 9 7.077 -1.437 -2.537
48 HB2 SER 9 HB2 SER 9 8.281 -4.124 -1.814
49 HB3 SER 9 HB3 SER 9 6.626 -3.968 -2.433
50 HG SER 9 HG SER 9 9.046 -3.298 -3.767
51 H ILE 10 H ILE 10 4.985 -2.743 -1.599
52 HA ILE 10 HA ILE 10 4.190 -1.387 0.693
53 HB ILE 10 HB ILE 10 3.103 -3.950 -0.480
54 HG12 ILE 10 HG12 ILE 10 3.084 -1.929 -1.895
55 HG13 ILE 10 HG13 ILE 10 1.477 -2.589 -1.583
56 HG21 ILE 10 HG21 ILE 10 2.236 -4.026 1.699
57 HG22 ILE 10 HG22 ILE 10 1.840 -2.298 1.666
58 HG23 ILE 10 HG23 ILE 10 0.949 -3.454 0.640
59 HD11 ILE 10 HD11 ILE 10 1.527 -0.161 -1.515
60 HD12 ILE 10 HD12 ILE 10 1.090 -0.793 0.077
61 HD13 ILE 10 HD13 ILE 10 2.723 -0.144 -0.227
62 H VAL 11 H VAL 11 6.049 -4.302 0.554
63 HA VAL 11 HA VAL 11 5.504 -5.330 3.137
64 HB VAL 11 HB VAL 11 7.909 -6.117 3.059
65 HG11 VAL 11 HG11 VAL 11 5.975 -7.462 2.321
66 HG12 VAL 11 HG12 VAL 11 6.063 -6.731 0.699
67 HG13 VAL 11 HG13 VAL 11 7.361 -7.779 1.282
68 HG21 VAL 11 HG21 VAL 11 7.901 -5.001 0.223
69 HG22 VAL 11 HG22 VAL 11 8.968 -4.473 1.553
70 HG23 VAL 11 HG23 VAL 11 9.093 -6.105 0.910
71 H SER 12 H SER 12 7.992 -2.888 2.254
72 HA SER 12 HA SER 12 8.868 -2.334 4.879
73 HB2 SER 12 HB2 SER 12 8.747 -0.624 2.360
74 HB3 SER 12 HB3 SER 12 9.828 -0.327 3.751
75 HG SER 12 HG SER 12 11.020 -1.453 2.257
76 H PHE 13 H PHE 13 6.262 -0.866 2.877
77 HA PHE 13 HA PHE 13 5.620 1.250 4.686
78 HB2 PHE 13 HB2 PHE 13 4.966 1.235 2.334
79 HB3 PHE 13 HB3 PHE 13 4.023 -0.224 2.567
80 HD1 PHE 13 HD1 PHE 13 1.844 0.318 2.027
81 HD2 PHE 13 HD2 PHE 13 4.066 2.968 4.617
82 HE1 PHE 13 HE1 PHE 13 -0.194 1.703 2.396
83 HE2 PHE 13 HE2 PHE 13 2.018 4.310 4.987
84 HZ PHE 13 HZ PHE 13 -0.125 3.593 3.934
85 H PHE 14 H PHE 14 4.267 -2.049 4.291
86 HA PHE 14 HA PHE 14 2.361 -1.791 6.392
87 HB2 PHE 14 HB2 PHE 14 3.488 -4.080 4.788
88 HB3 PHE 14 HB3 PHE 14 2.501 -4.392 6.186
89 HD1 PHE 14 HD1 PHE 14 1.053 -5.553 4.534
90 HD2 PHE 14 HD2 PHE 14 1.531 -1.273 4.429
91 HE1 PHE 14 HE1 PHE 14 -0.961 -5.356 3.109
92 HE2 PHE 14 HE2 PHE 14 -0.494 -1.075 3.067
93 HZ PHE 14 HZ PHE 14 -1.730 -3.102 2.370
94 H ALA 15 H ALA 15 5.729 -2.921 6.318
95 HA ALA 15 HA ALA 15 5.821 -3.959 8.950
96 HB1 ALA 15 HB1 ALA 15 7.667 -4.234 7.328
97 HB2 ALA 15 HB2 ALA 15 8.015 -2.494 7.401
98 HB3 ALA 15 HB3 ALA 15 8.254 -3.514 8.834
99 H ARG 16 H ARG 16 6.153 -0.599 7.687
100 HA ARG 16 HA ARG 16 6.516 0.569 10.328
101 HB2 ARG 16 HB2 ARG 16 5.704 1.721 7.605
102 HB3 ARG 16 HB3 ARG 16 5.761 2.707 9.082
103 HG2 ARG 16 HG2 ARG 16 8.048 2.007 9.472
104 HG3 ARG 16 HG3 ARG 16 8.079 1.105 7.963
105 HD2 ARG 16 HD2 ARG 16 8.087 3.021 6.621
106 HD3 ARG 16 HD3 ARG 16 7.235 3.994 7.821
107 HE ARG 16 HE ARG 16 10.105 3.627 7.589
108 HH11 ARG 16 HH11 ARG 16 7.480 4.463 9.846
109 HH12 ARG 16 HH12 ARG 16 8.519 5.168 11.025
110 HH21 ARG 16 HH21 ARG 16 11.460 4.637 9.077
111 HH22 ARG 16 HH22 ARG 16 10.852 5.254 10.593
112 H LEU 17 H LEU 17 3.681 0.001 8.339
113 HA LEU 17 HA LEU 17 1.820 1.459 10.072
114 HB2 LEU 17 HB2 LEU 17 1.273 -0.724 8.039
115 HB3 LEU 17 HB3 LEU 17 0.022 0.142 8.922
116 HG LEU 17 HG LEU 17 1.864 1.283 6.824
117 HD11 LEU 17 HD11 LEU 17 -0.302 1.602 5.622
118 HD12 LEU 17 HD12 LEU 17 -1.151 0.823 6.960
119 HD13 LEU 17 HD13 LEU 17 0.007 -0.099 5.986
120 HD21 LEU 17 HD21 LEU 17 -0.283 2.720 8.431
121 HD22 LEU 17 HD22 LEU 17 0.606 3.398 7.055
122 HD23 LEU 17 HD23 LEU 17 1.450 3.024 8.563
123 H GLY 18 H GLY 18 3.106 -1.843 10.163
124 HA2 GLY 18 HA2 GLY 18 3.151 -3.146 12.054
125 HA3 GLY 18 HA3 GLY 18 1.659 -2.391 12.653
126 H CYS 19 H CYS 19 1.470 -2.989 9.296
127 HA CYS 19 HA CYS 19 -0.570 -4.870 9.782
128 HB2 CYS 19 HB2 CYS 19 0.589 -4.165 7.077
129 HB3 CYS 19 HB3 CYS 19 -1.012 -4.838 7.420
130 HG CYS 19 HG CYS 19 -1.343 -2.321 6.747
131 H SER 20 H SER 20 -0.241 -6.961 10.276
132 HA SER 20 HA SER 20 2.248 -8.334 9.580
133 HB2 SER 20 HB2 SER 20 -0.084 -9.069 11.375
134 HB3 SER 20 HB3 SER 20 1.454 -9.952 11.254
135 HG SER 20 HG SER 20 0.865 -7.886 12.783
136 H SER 21 H SER 21 -0.829 -10.177 9.787
137 HA SER 21 HA SER 21 -0.293 -11.824 7.660
138 HB2 SER 21 HB2 SER 21 -3.077 -10.867 8.417
139 HB3 SER 21 HB3 SER 21 -2.648 -12.397 7.643
140 HG SER 21 HG SER 21 -3.048 -12.739 9.770
141 H CYS 22 H CYS 22 -1.672 -8.580 7.416
142 HA CYS 22 HA CYS 22 -2.774 -8.836 4.833
143 HB2 CYS 22 HB2 CYS 22 -1.600 -6.314 6.075
144 HB3 CYS 22 HB3 CYS 22 -2.869 -6.422 4.858
145 HG CYS 22 HG CYS 22 -2.907 -7.003 8.120
146 H LEU 23 H LEU 23 0.572 -8.260 5.918
147 HA LEU 23 HA LEU 23 1.496 -7.359 3.338
148 HB2 LEU 23 HB2 LEU 23 3.532 -7.075 4.302
149 HB3 LEU 23 HB3 LEU 23 2.528 -6.988 5.729
150 HG LEU 23 HG LEU 23 3.135 -9.579 5.982
151 HD11 LEU 23 HD11 LEU 23 5.487 -8.539 4.337
152 HD12 LEU 23 HD12 LEU 23 4.360 -9.803 3.803
153 HD13 LEU 23 HD13 LEU 23 5.405 -10.090 5.187
154 HD21 LEU 23 HD21 LEU 23 5.084 -7.308 6.539
155 HD22 LEU 23 HD22 LEU 23 5.148 -8.925 7.273
156 HD23 LEU 23 HD23 LEU 23 3.765 -7.882 7.584
157 H ASP 24 H ASP 24 1.240 -10.385 5.146
158 HA ASP 24 HA ASP 24 2.611 -12.106 3.421
159 HB2 ASP 24 HB2 ASP 24 1.646 -12.563 5.752
160 HB3 ASP 24 HB3 ASP 24 0.103 -12.883 4.959
161 H TYR 25 H TYR 25 -0.864 -11.328 3.548
162 HA TYR 25 HA TYR 25 -1.720 -12.721 1.288
163 HB2 TYR 25 HB2 TYR 25 -2.714 -10.050 2.337
164 HB3 TYR 25 HB3 TYR 25 -3.594 -11.104 1.245
165 HD1 TYR 25 HD1 TYR 25 -4.921 -10.148 3.578
166 HD2 TYR 25 HD2 TYR 25 -2.276 -13.548 3.333
167 HE1 TYR 25 HE1 TYR 25 -6.264 -11.309 5.284
168 HE2 TYR 25 HE2 TYR 25 -3.460 -14.610 5.173
169 HH TYR 25 HH TYR 25 -6.614 -13.533 6.342
170 H PHE 26 H PHE 26 -0.648 -9.220 1.364
171 HA PHE 26 HA PHE 26 -0.777 -8.826 -1.394
172 HB2 PHE 26 HB2 PHE 26 0.564 -7.567 0.935
173 HB3 PHE 26 HB3 PHE 26 1.452 -7.370 -0.553
174 HD1 PHE 26 HD1 PHE 26 0.459 -6.242 -2.545
175 HD2 PHE 26 HD2 PHE 26 -1.636 -6.541 1.211
176 HE1 PHE 26 HE1 PHE 26 -0.908 -4.264 -3.146
177 HE2 PHE 26 HE2 PHE 26 -3.137 -4.715 0.512
178 HZ PHE 26 HZ PHE 26 -2.657 -3.477 -1.630
179 H THR 27 H THR 27 2.006 -10.143 0.492
180 HA THR 27 HA THR 27 3.825 -10.148 -1.683
181 HB THR 27 HB THR 27 5.086 -11.868 -0.458
182 HG1 THR 27 HG1 THR 27 2.778 -12.004 1.100
183 HG21 THR 27 HG21 THR 27 5.419 -9.464 0.038
184 HG22 THR 27 HG22 THR 27 5.749 -10.517 1.425
185 HG23 THR 27 HG23 THR 27 4.257 -9.594 1.378
186 H THR 28 H THR 28 1.630 -12.810 -0.574
187 HA THR 28 HA THR 28 2.324 -14.602 -2.618
188 HB THR 28 HB THR 28 -0.362 -14.336 -1.243
189 HG1 THR 28 HG1 THR 28 2.030 -15.503 -0.230
190 HG21 THR 28 HG21 THR 28 -0.396 -16.766 -1.298
191 HG22 THR 28 HG22 THR 28 1.238 -16.805 -2.008
192 HG23 THR 28 HG23 THR 28 -0.120 -16.170 -2.945
193 H GLN 29 H GLN 29 -0.134 -11.935 -2.557
194 HA GLN 29 HA GLN 29 -1.343 -12.768 -5.018
195 HB2 GLN 29 HB2 GLN 29 -1.253 -10.085 -3.581
196 HB3 GLN 29 HB3 GLN 29 -2.191 -10.421 -5.044
197 HG2 GLN 29 HG2 GLN 29 -3.490 -12.142 -3.942
198 HG3 GLN 29 HG3 GLN 29 -2.591 -11.937 -2.455
199 HE21 GLN 29 HE21 GLN 29 -5.294 -10.747 -4.331
200 HE22 GLN 29 HE22 GLN 29 -5.669 -9.390 -3.288
201 H GLY 30 H GLY 30 1.670 -11.190 -4.243
202 HA2 GLY 30 HA2 GLY 30 3.439 -10.603 -5.586
203 HA3 GLY 30 HA3 GLY 30 2.631 -11.394 -6.937
204 H LEU 31 H LEU 31 1.407 -8.725 -4.919
205 HA LEU 31 HA LEU 31 1.778 -6.846 -7.206
206 HB2 LEU 31 HB2 LEU 31 -0.608 -6.137 -7.068
207 HB3 LEU 31 HB3 LEU 31 -0.268 -7.693 -7.766
208 HG LEU 31 HG LEU 31 -0.906 -8.577 -5.350
209 HD11 LEU 31 HD11 LEU 31 -1.198 -6.336 -4.338
210 HD12 LEU 31 HD12 LEU 31 -2.665 -7.317 -4.258
211 HD13 LEU 31 HD13 LEU 31 -2.525 -6.017 -5.464
212 HD21 LEU 31 HD21 LEU 31 -2.057 -9.187 -7.376
213 HD22 LEU 31 HD22 LEU 31 -2.869 -7.610 -7.451
214 HD23 LEU 31 HD23 LEU 31 -3.273 -8.759 -6.152
215 H THR 32 H THR 32 3.021 -7.037 -4.512
216 HA THR 32 HA THR 32 1.944 -4.686 -3.104
217 HB THR 32 HB THR 32 2.766 -5.904 -1.437
218 HG1 THR 32 HG1 THR 32 5.427 -5.868 -1.837
219 HG21 THR 32 HG21 THR 32 4.673 -7.464 -3.200
220 HG22 THR 32 HG22 THR 32 3.045 -7.980 -2.707
221 HG23 THR 32 HG23 THR 32 4.302 -7.777 -1.493
222 H THR 33 H THR 33 2.438 -2.581 -3.804
223 HA THR 33 HA THR 33 5.158 -1.992 -4.355
224 HB THR 33 HB THR 33 5.006 -2.450 -6.551
225 HG1 THR 33 HG1 THR 33 5.067 -0.291 -6.637
226 HG21 THR 33 HG21 THR 33 1.929 -2.301 -6.482
227 HG22 THR 33 HG22 THR 33 2.952 -3.753 -6.587
228 HG23 THR 33 HG23 THR 33 2.923 -2.642 -7.918
229 H ILE 34 H ILE 34 5.455 0.296 -4.217
230 HA ILE 34 HA ILE 34 3.444 1.608 -2.559
231 HB ILE 34 HB ILE 34 5.979 2.918 -3.586
232 HG12 ILE 34 HG12 ILE 34 6.644 0.738 -2.538
233 HG13 ILE 34 HG13 ILE 34 7.294 2.187 -1.826
234 HG21 ILE 34 HG21 ILE 34 5.817 4.091 -1.382
235 HG22 ILE 34 HG22 ILE 34 4.425 4.413 -2.435
236 HG23 ILE 34 HG23 ILE 34 4.279 3.259 -1.082
237 HD11 ILE 34 HD11 ILE 34 6.670 0.599 -0.103
238 HD12 ILE 34 HD12 ILE 34 5.664 2.005 0.065
239 HD13 ILE 34 HD13 ILE 34 4.988 0.538 -0.690
240 H TYR 35 H TYR 35 5.053 2.540 -5.614
241 HA TYR 35 HA TYR 35 3.489 4.823 -6.116
242 HB2 TYR 35 HB2 TYR 35 5.013 3.102 -8.091
243 HB3 TYR 35 HB3 TYR 35 4.504 4.765 -8.326
244 HD1 TYR 35 HD1 TYR 35 6.975 2.551 -6.880
245 HD2 TYR 35 HD2 TYR 35 5.502 6.606 -6.746
246 HE1 TYR 35 HE1 TYR 35 8.948 3.223 -5.599
247 HE2 TYR 35 HE2 TYR 35 7.516 7.292 -5.504
248 HH TYR 35 HH TYR 35 9.581 6.540 -4.489
249 H GLN 36 H GLN 36 2.598 1.637 -6.378
250 HA GLN 36 HA GLN 36 0.681 2.049 -8.613
251 HB2 GLN 36 HB2 GLN 36 1.484 -0.322 -6.931
252 HB3 GLN 36 HB3 GLN 36 0.077 -0.371 -7.981
253 HG2 GLN 36 HG2 GLN 36 2.912 0.189 -8.918
254 HG3 GLN 36 HG3 GLN 36 1.992 -1.294 -9.193
255 HE21 GLN 36 HE21 GLN 36 0.079 -1.243 -10.689
256 HE22 GLN 36 HE22 GLN 36 0.134 -0.028 -11.925
257 H ILE 37 H ILE 37 0.537 1.283 -5.032
258 HA ILE 37 HA ILE 37 -2.285 1.616 -4.971
259 HB ILE 37 HB ILE 37 -2.096 1.845 -2.571
260 HG12 ILE 37 HG12 ILE 37 0.914 1.596 -2.849
261 HG13 ILE 37 HG13 ILE 37 0.143 3.172 -2.694
262 HG21 ILE 37 HG21 ILE 37 -0.315 -0.349 -3.763
263 HG22 ILE 37 HG22 ILE 37 -1.120 -0.409 -2.197
264 HG23 ILE 37 HG23 ILE 37 -2.088 -0.377 -3.671
265 HD11 ILE 37 HD11 ILE 37 -0.807 2.576 -0.542
266 HD12 ILE 37 HD12 ILE 37 -0.195 0.944 -0.682
267 HD13 ILE 37 HD13 ILE 37 0.961 2.291 -0.562
268 H GLU 38 H GLU 38 0.236 3.943 -5.209
269 HA GLU 38 HA GLU 38 -1.071 6.297 -4.248
270 HB2 GLU 38 HB2 GLU 38 1.180 5.597 -6.153
271 HB3 GLU 38 HB3 GLU 38 0.612 7.245 -6.132
272 HG2 GLU 38 HG2 GLU 38 1.314 5.978 -3.483
273 HG3 GLU 38 HG3 GLU 38 2.615 6.432 -4.594
274 H HIS 39 H HIS 39 -1.414 4.386 -7.204
275 HA HIS 39 HA HIS 39 -3.142 6.474 -8.472
276 HB2 HIS 39 HB2 HIS 39 -1.332 4.307 -9.602
277 HB3 HIS 39 HB3 HIS 39 -2.648 4.991 -10.534
278 HD1 HIS 39 HD1 HIS 39 -1.642 6.633 -12.191
279 HD2 HIS 39 HD2 HIS 39 0.061 6.828 -8.349
280 HE1 HIS 39 HE1 HIS 39 0.034 8.581 -12.234
281 H TYR 40 H TYR 40 -3.013 3.204 -7.161
282 HA TYR 40 HA TYR 40 -5.473 2.351 -8.443
283 HB2 TYR 40 HB2 TYR 40 -3.781 1.141 -6.229
284 HB3 TYR 40 HB3 TYR 40 -5.282 0.450 -6.778
285 HD1 TYR 40 HD1 TYR 40 -2.108 -0.661 -6.900
286 HD2 TYR 40 HD2 TYR 40 -5.092 0.778 -9.762
287 HE1 TYR 40 HE1 TYR 40 -1.221 -2.073 -8.635
288 HE2 TYR 40 HE2 TYR 40 -4.102 -0.622 -11.461
289 HH TYR 40 HH TYR 40 -2.429 -2.235 -11.981
290 H SER 41 H SER 41 -7.011 3.746 -8.029
291 HA SER 41 HA SER 41 -7.543 4.997 -5.503
292 HB2 SER 41 HB2 SER 41 -9.232 4.612 -8.035
293 HB3 SER 41 HB3 SER 41 -9.549 5.808 -6.791
294 HG SER 41 HG SER 41 -7.330 6.584 -7.225
295 H MET 42 H MET 42 -10.086 4.808 -4.859
296 HA MET 42 HA MET 42 -10.416 2.611 -3.239
297 HB2 MET 42 HB2 MET 42 -11.878 4.890 -3.983
298 HB3 MET 42 HB3 MET 42 -12.989 3.586 -4.320
299 HG2 MET 42 HG2 MET 42 -11.598 4.218 -1.731
300 HG3 MET 42 HG3 MET 42 -13.304 4.437 -2.105
301 HE1 MET 42 HE1 MET 42 -13.281 3.372 0.381
302 HE2 MET 42 HE2 MET 42 -14.765 2.902 -0.476
303 HE3 MET 42 HE3 MET 42 -13.884 1.698 0.470
304 H ASP 43 H ASP 43 -11.785 2.985 -6.528
305 HA ASP 43 HA ASP 43 -13.205 0.537 -6.559
306 HB2 ASP 43 HB2 ASP 43 -12.064 2.202 -8.828
307 HB3 ASP 43 HB3 ASP 43 -13.187 0.841 -9.040
308 H ASP 44 H ASP 44 -9.747 1.189 -7.384
309 HA ASP 44 HA ASP 44 -9.462 -1.436 -8.630
310 HB2 ASP 44 HB2 ASP 44 -7.662 0.841 -8.169
311 HB3 ASP 44 HB3 ASP 44 -6.893 -0.726 -7.882
312 H LEU 45 H LEU 45 -8.750 -0.065 -5.415
313 HA LEU 45 HA LEU 45 -7.635 -2.489 -4.350
314 HB2 LEU 45 HB2 LEU 45 -8.659 0.070 -3.135
315 HB3 LEU 45 HB3 LEU 45 -8.595 -1.359 -2.108
316 HG LEU 45 HG LEU 45 -6.252 -1.747 -2.713
317 HD11 LEU 45 HD11 LEU 45 -4.941 0.178 -3.737
318 HD12 LEU 45 HD12 LEU 45 -6.502 0.869 -4.202
319 HD13 LEU 45 HD13 LEU 45 -6.009 -0.695 -4.855
320 HD21 LEU 45 HD21 LEU 45 -6.698 -0.584 -0.645
321 HD22 LEU 45 HD22 LEU 45 -6.796 0.975 -1.480
322 HD23 LEU 45 HD23 LEU 45 -5.259 0.104 -1.392
323 H ALA 46 H ALA 46 -11.010 -1.237 -4.363
324 HA ALA 46 HA ALA 46 -12.098 -3.432 -2.910
325 HB1 ALA 46 HB1 ALA 46 -13.340 -1.374 -3.285
326 HB2 ALA 46 HB2 ALA 46 -13.324 -1.650 -5.046
327 HB3 ALA 46 HB3 ALA 46 -14.244 -2.739 -3.977
328 H SER 47 H SER 47 -11.590 -2.930 -6.445
329 HA SER 47 HA SER 47 -12.669 -5.404 -7.293
330 HB2 SER 47 HB2 SER 47 -12.371 -3.458 -8.711
331 HB3 SER 47 HB3 SER 47 -10.619 -3.532 -8.534
332 HG SER 47 HG SER 47 -10.535 -4.947 -10.026
333 H LEU 48 H LEU 48 -9.574 -4.639 -5.799
334 HA LEU 48 HA LEU 48 -8.281 -7.159 -6.580
335 HB2 LEU 48 HB2 LEU 48 -7.514 -4.817 -4.831
336 HB3 LEU 48 HB3 LEU 48 -6.569 -6.293 -4.806
337 HG LEU 48 HG LEU 48 -7.169 -4.866 -7.419
338 HD11 LEU 48 HD11 LEU 48 -6.099 -3.237 -5.913
339 HD12 LEU 48 HD12 LEU 48 -5.008 -3.726 -7.205
340 HD13 LEU 48 HD13 LEU 48 -4.794 -4.398 -5.573
341 HD21 LEU 48 HD21 LEU 48 -4.943 -6.757 -6.542
342 HD22 LEU 48 HD22 LEU 48 -5.099 -6.011 -8.143
343 HD23 LEU 48 HD23 LEU 48 -6.308 -7.180 -7.601
344 H LYS 49 H LYS 49 -10.888 -6.794 -4.859
345 HA LYS 49 HA LYS 49 -12.060 -7.952 -3.396
346 HB2 LYS 49 HB2 LYS 49 -9.808 -10.001 -3.298
347 HB3 LYS 49 HB3 LYS 49 -11.418 -10.169 -2.619
348 HG2 LYS 49 HG2 LYS 49 -11.822 -11.235 -4.575
349 HG3 LYS 49 HG3 LYS 49 -12.234 -9.601 -5.064
350 HD2 LYS 49 HD2 LYS 49 -9.616 -9.587 -5.776
351 HD3 LYS 49 HD3 LYS 49 -9.876 -11.321 -5.836
352 HE2 LYS 49 HE2 LYS 49 -11.611 -9.227 -7.231
353 HE3 LYS 49 HE3 LYS 49 -10.257 -10.049 -8.015
354 HZ1 LYS 49 HZ1 LYS 49 -12.492 -11.009 -8.421
355 HZ2 LYS 49 HZ2 LYS 49 -12.549 -11.521 -6.871
356 HZ3 LYS 49 HZ3 LYS 49 -11.381 -12.099 -7.856
357 H ILE 50 H ILE 50 -9.792 -5.973 -2.597
358 HA ILE 50 HA ILE 50 -9.237 -6.675 0.134
359 HB ILE 50 HB ILE 50 -8.967 -3.946 -1.150
360 HG12 ILE 50 HG12 ILE 50 -7.829 -5.600 -2.648
361 HG13 ILE 50 HG13 ILE 50 -6.725 -4.501 -1.883
362 HG21 ILE 50 HG21 ILE 50 -7.158 -3.695 0.488
363 HG22 ILE 50 HG22 ILE 50 -8.656 -4.173 1.319
364 HG23 ILE 50 HG23 ILE 50 -7.420 -5.376 1.018
365 HD11 ILE 50 HD11 ILE 50 -7.213 -7.338 -0.897
366 HD12 ILE 50 HD12 ILE 50 -5.905 -6.851 -1.996
367 HD13 ILE 50 HD13 ILE 50 -5.948 -6.210 -0.348
368 HA PRO 51 HA PRO 51 -13.305 -5.152 1.469
369 HB2 PRO 51 HB2 PRO 51 -13.150 -5.655 4.133
370 HB3 PRO 51 HB3 PRO 51 -13.253 -6.984 2.935
371 HG2 PRO 51 HG2 PRO 51 -10.750 -5.826 4.205
372 HG3 PRO 51 HG3 PRO 51 -11.235 -7.547 4.135
373 HD2 PRO 51 HD2 PRO 51 -9.524 -6.456 2.326
374 HD3 PRO 51 HD3 PRO 51 -10.738 -7.666 1.811
375 H GLU 52 H GLU 52 -14.091 -3.220 2.537
376 HA GLU 52 HA GLU 52 -12.288 -1.087 2.528
377 HB2 GLU 52 HB2 GLU 52 -14.028 0.333 3.139
378 HB3 GLU 52 HB3 GLU 52 -14.703 -0.907 2.111
379 HG2 GLU 52 HG2 GLU 52 -15.015 -0.527 5.094
380 HG3 GLU 52 HG3 GLU 52 -16.282 -0.492 3.869
381 H GLN 53 H GLN 53 -13.201 -3.158 5.237
382 HA GLN 53 HA GLN 53 -12.326 -1.586 7.376
383 HB2 GLN 53 HB2 GLN 53 -13.708 -3.635 7.488
384 HB3 GLN 53 HB3 GLN 53 -12.298 -4.623 7.117
385 HG2 GLN 53 HG2 GLN 53 -11.346 -4.291 9.206
386 HG3 GLN 53 HG3 GLN 53 -12.098 -2.705 9.433
387 HE21 GLN 53 HE21 GLN 53 -14.058 -2.551 10.625
388 HE22 GLN 53 HE22 GLN 53 -14.921 -3.985 11.137
389 H PHE 54 H PHE 54 -10.365 -2.944 4.940
390 HA PHE 54 HA PHE 54 -7.886 -2.336 6.522
391 HB2 PHE 54 HB2 PHE 54 -7.835 -4.611 6.533
392 HB3 PHE 54 HB3 PHE 54 -8.596 -4.760 4.937
393 HD1 PHE 54 HD1 PHE 54 -7.389 -5.010 3.060
394 HD2 PHE 54 HD2 PHE 54 -5.453 -3.598 6.606
395 HE1 PHE 54 HE1 PHE 54 -5.178 -5.136 1.880
396 HE2 PHE 54 HE2 PHE 54 -3.227 -3.775 5.467
397 HZ PHE 54 HZ PHE 54 -3.128 -4.569 3.094
398 H ARG 55 H ARG 55 -9.414 -2.539 3.246
399 HA ARG 55 HA ARG 55 -7.299 -1.437 1.823
400 HB2 ARG 55 HB2 ARG 55 -8.593 -1.544 0.060
401 HB3 ARG 55 HB3 ARG 55 -9.722 -2.335 1.099
402 HG2 ARG 55 HG2 ARG 55 -11.024 -0.841 -0.096
403 HG3 ARG 55 HG3 ARG 55 -10.834 -0.085 1.478
404 HD2 ARG 55 HD2 ARG 55 -8.713 0.939 -0.147
405 HD3 ARG 55 HD3 ARG 55 -10.159 0.926 -1.165
406 HE ARG 55 HE ARG 55 -10.998 1.918 1.292
407 HH11 ARG 55 HH11 ARG 55 -8.852 3.152 -1.331
408 HH12 ARG 55 HH12 ARG 55 -9.041 4.770 -0.785
409 HH21 ARG 55 HH21 ARG 55 -11.139 3.935 1.960
410 HH22 ARG 55 HH22 ARG 55 -10.340 5.263 1.186
411 H HIS 56 H HIS 56 -9.674 0.190 3.907
412 HA HIS 56 HA HIS 56 -9.032 2.822 3.063
413 HB2 HIS 56 HB2 HIS 56 -10.210 3.543 4.985
414 HB3 HIS 56 HB3 HIS 56 -10.934 1.956 4.712
415 HD1 HIS 56 HD1 HIS 56 -9.510 3.925 7.510
416 HD2 HIS 56 HD2 HIS 56 -9.592 -0.106 6.278
417 HE1 HIS 56 HE1 HIS 56 -8.698 2.559 9.459
418 H ALA 57 H ALA 57 -7.512 0.701 5.412
419 HA ALA 57 HA ALA 57 -5.845 2.740 6.530
420 HB1 ALA 57 HB1 ALA 57 -6.325 0.715 7.768
421 HB2 ALA 57 HB2 ALA 57 -5.531 -0.271 6.530
422 HB3 ALA 57 HB3 ALA 57 -4.570 0.854 7.519
423 H ILE 58 H ILE 58 -5.096 0.189 4.090
424 HA ILE 58 HA ILE 58 -2.419 0.991 3.707
425 HB ILE 58 HB ILE 58 -3.017 -1.052 2.821
426 HG12 ILE 58 HG12 ILE 58 -3.067 0.762 0.314
427 HG13 ILE 58 HG13 ILE 58 -1.607 0.404 1.264
428 HG21 ILE 58 HG21 ILE 58 -4.754 -1.618 1.240
429 HG22 ILE 58 HG22 ILE 58 -5.433 -0.863 2.656
430 HG23 ILE 58 HG23 ILE 58 -5.256 0.071 1.136
431 HD11 ILE 58 HD11 ILE 58 -2.928 -1.192 -0.788
432 HD12 ILE 58 HD12 ILE 58 -1.273 -1.311 -0.148
433 HD13 ILE 58 HD13 ILE 58 -2.599 -2.142 0.664
434 H TRP 59 H TRP 59 -5.418 1.993 1.960
435 HA TRP 59 HA TRP 59 -3.972 3.770 0.277
436 HB2 TRP 59 HB2 TRP 59 -6.208 2.594 -0.020
437 HB3 TRP 59 HB3 TRP 59 -6.910 3.872 0.964
438 HD1 TRP 59 HD1 TRP 59 -4.873 3.363 -2.269
439 HE1 TRP 59 HE1 TRP 59 -5.546 5.261 -3.942
440 HE3 TRP 59 HE3 TRP 59 -7.743 6.144 0.823
441 HZ2 TRP 59 HZ2 TRP 59 -7.199 7.656 -3.883
442 HZ3 TRP 59 HZ3 TRP 59 -8.898 8.222 0.032
443 HH2 TRP 59 HH2 TRP 59 -8.583 8.990 -2.290
444 H LYS 60 H LYS 60 -6.025 4.529 3.178
445 HA LYS 60 HA LYS 60 -5.618 7.312 3.162
446 HB2 LYS 60 HB2 LYS 60 -7.265 6.108 4.586
447 HB3 LYS 60 HB3 LYS 60 -5.908 5.371 5.482
448 HG2 LYS 60 HG2 LYS 60 -5.255 7.702 6.204
449 HG3 LYS 60 HG3 LYS 60 -6.800 8.260 5.537
450 HD2 LYS 60 HD2 LYS 60 -8.019 6.713 7.003
451 HD3 LYS 60 HD3 LYS 60 -6.512 6.003 7.603
452 HE2 LYS 60 HE2 LYS 60 -7.279 8.924 7.929
453 HE3 LYS 60 HE3 LYS 60 -7.595 7.670 9.142
454 HZ1 LYS 60 HZ1 LYS 60 -5.221 7.334 9.362
455 HZ2 LYS 60 HZ2 LYS 60 -5.615 8.903 9.612
456 HZ3 LYS 60 HZ3 LYS 60 -4.907 8.469 8.195
457 H GLY 61 H GLY 61 -3.633 4.679 4.569
458 HA2 GLY 61 HA2 GLY 61 -1.771 6.286 5.959
459 HA3 GLY 61 HA3 GLY 61 -1.504 4.638 5.389
460 H ILE 62 H ILE 62 -1.564 4.962 2.568
461 HA ILE 62 HA ILE 62 0.987 6.243 2.311
462 HB ILE 62 HB ILE 62 0.057 4.289 1.060
463 HG12 ILE 62 HG12 ILE 62 1.498 4.833 -1.017
464 HG13 ILE 62 HG13 ILE 62 1.689 6.448 -0.332
465 HG21 ILE 62 HG21 ILE 62 -0.844 4.663 -1.241
466 HG22 ILE 62 HG22 ILE 62 -1.947 5.278 -0.013
467 HG23 ILE 62 HG23 ILE 62 -0.883 6.376 -0.934
468 HD11 ILE 62 HD11 ILE 62 2.776 5.415 1.688
469 HD12 ILE 62 HD12 ILE 62 2.536 3.811 0.958
470 HD13 ILE 62 HD13 ILE 62 3.595 5.014 0.192
471 H LEU 63 H LEU 63 -2.310 7.139 1.310
472 HA LEU 63 HA LEU 63 -1.500 9.552 0.007
473 HB2 LEU 63 HB2 LEU 63 -4.100 8.526 1.082
474 HB3 LEU 63 HB3 LEU 63 -3.934 10.269 0.890
475 HG LEU 63 HG LEU 63 -3.285 10.028 -1.472
476 HD11 LEU 63 HD11 LEU 63 -3.800 7.050 -1.011
477 HD12 LEU 63 HD12 LEU 63 -2.310 7.836 -1.615
478 HD13 LEU 63 HD13 LEU 63 -3.753 7.817 -2.610
479 HD21 LEU 63 HD21 LEU 63 -5.613 10.390 -0.862
480 HD22 LEU 63 HD22 LEU 63 -5.841 8.628 -0.657
481 HD23 LEU 63 HD23 LEU 63 -5.523 9.303 -2.268
482 H ASP 64 H ASP 64 -1.961 8.730 3.372
483 HA ASP 64 HA ASP 64 -1.951 11.511 4.353
484 HB2 ASP 64 HB2 ASP 64 -1.508 8.833 5.738
485 HB3 ASP 64 HB3 ASP 64 -1.131 10.331 6.545
486 H HIS 65 H HIS 65 0.397 8.956 3.994
487 HA HIS 65 HA HIS 65 2.663 10.187 5.158
488 HB2 HIS 65 HB2 HIS 65 2.620 7.787 4.856
489 HB3 HIS 65 HB3 HIS 65 2.457 7.954 3.108
490 HD1 HIS 65 HD1 HIS 65 5.083 9.592 5.493
491 HD2 HIS 65 HD2 HIS 65 4.647 7.286 1.992
492 HE1 HIS 65 HE1 HIS 65 7.403 9.412 4.475
493 H ARG 66 H ARG 66 1.784 9.815 1.700
494 HA ARG 66 HA ARG 66 3.891 11.568 0.810
495 HB2 ARG 66 HB2 ARG 66 2.748 11.490 -1.363
496 HB3 ARG 66 HB3 ARG 66 2.944 9.898 -0.654
497 HG2 ARG 66 HG2 ARG 66 0.753 9.545 -1.040
498 HG3 ARG 66 HG3 ARG 66 0.443 10.634 0.300
499 HD2 ARG 66 HD2 ARG 66 -0.891 11.398 -1.446
500 HD3 ARG 66 HD3 ARG 66 0.440 12.536 -1.239
501 HE ARG 66 HE ARG 66 0.561 10.240 -3.175
502 HH11 ARG 66 HH11 ARG 66 0.790 13.787 -2.801
503 HH12 ARG 66 HH12 ARG 66 1.584 13.996 -4.311
504 HH21 ARG 66 HH21 ARG 66 1.935 10.508 -4.849
505 HH22 ARG 66 HH22 ARG 66 2.351 12.059 -5.524
506 H GLN 67 H GLN 67 0.558 12.135 1.986
507 HA GLN 67 HA GLN 67 0.726 14.944 1.133
508 HB2 GLN 67 HB2 GLN 67 -1.327 13.491 2.789
509 HB3 GLN 67 HB3 GLN 67 -1.353 15.239 2.548
510 HG2 GLN 67 HG2 GLN 67 -1.495 15.073 0.162
511 HG3 GLN 67 HG3 GLN 67 -1.195 13.349 0.179
512 HE21 GLN 67 HE21 GLN 67 -3.118 13.061 -1.146
513 HE22 GLN 67 HE22 GLN 67 -4.711 13.185 -0.483
514 H LEU 68 H LEU 68 2.083 13.202 3.770
515 HA LEU 68 HA LEU 68 2.504 15.712 5.296
516 HB2 LEU 68 HB2 LEU 68 2.465 12.806 6.047
517 HB3 LEU 68 HB3 LEU 68 3.240 13.982 7.097
518 HG LEU 68 HG LEU 68 0.361 14.351 6.169
519 HD11 LEU 68 HD11 LEU 68 -0.324 13.363 8.309
520 HD12 LEU 68 HD12 LEU 68 1.383 12.988 8.680
521 HD13 LEU 68 HD13 LEU 68 0.555 12.184 7.331
522 HD21 LEU 68 HD21 LEU 68 1.989 15.467 8.511
523 HD22 LEU 68 HD22 LEU 68 0.268 15.767 8.231
524 HD23 LEU 68 HD23 LEU 68 1.456 16.374 7.081
525 H HIS 69 H HIS 69 4.184 13.730 3.090
526 HA HIS 69 HA HIS 69 6.748 14.947 3.853
527 HB2 HIS 69 HB2 HIS 69 6.353 12.590 4.911
528 HB3 HIS 69 HB3 HIS 69 6.473 11.967 3.268
529 HD1 HIS 69 HD1 HIS 69 8.609 14.081 5.732
530 HD2 HIS 69 HD2 HIS 69 8.905 11.258 2.618
531 HE1 HIS 69 HE1 HIS 69 11.053 13.321 5.673
532 H ASP 70 H ASP 70 7.313 15.934 2.003
533 HA ASP 70 HA ASP 70 6.159 15.252 -0.613
534 HB2 ASP 70 HB2 ASP 70 6.389 17.606 0.028
535 HB3 ASP 70 HB3 ASP 70 8.129 17.417 0.263
Start of MODEL 12
1 H1 GLY 1 H GLY 1 26.699 -7.355 3.293
2 HA2 GLY 1 HA2 GLY 1 24.838 -7.897 1.825
3 HA3 GLY 1 HA3 GLY 1 23.778 -7.771 3.242
4 HA PRO 2 HA PRO 2 24.329 -3.528 1.175
5 HB2 PRO 2 HB2 PRO 2 22.171 -3.338 -0.463
6 HB3 PRO 2 HB3 PRO 2 23.688 -4.136 -0.968
7 HG2 PRO 2 HG2 PRO 2 21.178 -5.437 0.145
8 HG3 PRO 2 HG3 PRO 2 22.079 -5.877 -1.343
9 HD2 PRO 2 HD2 PRO 2 22.489 -7.175 1.027
10 HD3 PRO 2 HD3 PRO 2 23.837 -6.848 -0.105
11 H LEU 3 H LEU 3 22.510 -5.115 3.268
12 HA LEU 3 HA LEU 3 20.658 -4.892 4.559
13 HB2 LEU 3 HB2 LEU 3 22.970 -4.345 5.501
14 HB3 LEU 3 HB3 LEU 3 22.466 -2.678 5.516
15 HG LEU 3 HG LEU 3 21.366 -5.030 7.083
16 HD11 LEU 3 HD11 LEU 3 23.377 -3.976 7.978
17 HD12 LEU 3 HD12 LEU 3 22.006 -3.616 9.025
18 HD13 LEU 3 HD13 LEU 3 22.605 -2.374 7.915
19 HD21 LEU 3 HD21 LEU 3 19.762 -3.536 8.192
20 HD22 LEU 3 HD22 LEU 3 19.355 -3.827 6.519
21 HD23 LEU 3 HD23 LEU 3 20.103 -2.277 6.984
22 H GLY 4 H GLY 4 18.783 -4.256 3.561
23 HA2 GLY 4 HA2 GLY 4 16.936 -2.934 3.256
24 HA3 GLY 4 HA3 GLY 4 17.611 -1.852 4.471
25 H SER 5 H SER 5 18.694 -2.687 1.104
26 HA SER 5 HA SER 5 19.157 0.144 0.545
27 HB2 SER 5 HB2 SER 5 19.884 -0.815 -1.670
28 HB3 SER 5 HB3 SER 5 20.761 -1.413 -0.252
29 HG SER 5 HG SER 5 20.140 -3.045 -1.781
30 H THR 6 H THR 6 17.749 -1.868 -1.959
31 HA THR 6 HA THR 6 15.610 0.005 -2.433
32 HB THR 6 HB THR 6 15.869 -2.761 -3.680
33 HG1 THR 6 HG1 THR 6 17.407 -2.042 -5.014
34 HG21 THR 6 HG21 THR 6 15.049 -0.031 -4.794
35 HG22 THR 6 HG22 THR 6 13.949 -1.360 -4.369
36 HG23 THR 6 HG23 THR 6 15.090 -1.554 -5.707
37 H ASP 7 H ASP 7 13.754 -0.035 -1.289
38 HA ASP 7 HA ASP 7 12.539 -2.572 -0.308
39 HB2 ASP 7 HB2 ASP 7 13.146 -0.033 1.229
40 HB3 ASP 7 HB3 ASP 7 11.792 -1.059 1.681
41 H CYS 8 H CYS 8 12.217 -0.979 -2.689
42 HA CYS 8 HA CYS 8 9.836 0.616 -2.634
43 HB2 CYS 8 HB2 CYS 8 11.373 -0.759 -4.885
44 HB3 CYS 8 HB3 CYS 8 10.049 0.383 -5.134
45 HG CYS 8 HG CYS 8 12.515 1.247 -3.110
46 H SER 9 H SER 9 8.817 -1.439 -1.253
47 HA SER 9 HA SER 9 6.741 -2.475 -2.962
48 HB2 SER 9 HB2 SER 9 8.450 -4.169 -3.359
49 HB3 SER 9 HB3 SER 9 8.693 -4.389 -1.630
50 HG SER 9 HG SER 9 6.387 -5.029 -3.206
51 H ILE 10 H ILE 10 4.931 -3.012 -1.629
52 HA ILE 10 HA ILE 10 4.520 -1.414 0.614
53 HB ILE 10 HB ILE 10 2.936 -3.836 -0.296
54 HG12 ILE 10 HG12 ILE 10 2.482 -0.881 -0.817
55 HG13 ILE 10 HG13 ILE 10 3.239 -2.010 -1.932
56 HG21 ILE 10 HG21 ILE 10 1.018 -2.877 0.930
57 HG22 ILE 10 HG22 ILE 10 2.297 -3.378 1.989
58 HG23 ILE 10 HG23 ILE 10 2.101 -1.643 1.617
59 HD11 ILE 10 HD11 ILE 10 1.190 -3.465 -1.763
60 HD12 ILE 10 HD12 ILE 10 0.363 -2.093 -0.997
61 HD13 ILE 10 HD13 ILE 10 0.982 -1.958 -2.644
62 H VAL 11 H VAL 11 6.071 -4.466 0.498
63 HA VAL 11 HA VAL 11 5.516 -5.498 3.053
64 HB VAL 11 HB VAL 11 7.844 -6.363 3.005
65 HG11 VAL 11 HG11 VAL 11 6.271 -6.769 0.403
66 HG12 VAL 11 HG12 VAL 11 7.394 -7.923 1.136
67 HG13 VAL 11 HG13 VAL 11 5.867 -7.530 1.951
68 HG21 VAL 11 HG21 VAL 11 8.041 -5.034 0.273
69 HG22 VAL 11 HG22 VAL 11 9.060 -4.674 1.678
70 HG23 VAL 11 HG23 VAL 11 9.160 -6.248 0.904
71 H SER 12 H SER 12 7.950 -2.997 2.236
72 HA SER 12 HA SER 12 8.755 -2.671 5.005
73 HB2 SER 12 HB2 SER 12 10.268 -2.133 3.180
74 HB3 SER 12 HB3 SER 12 9.155 -0.898 2.559
75 HG SER 12 HG SER 12 11.091 -0.401 4.147
76 H PHE 13 H PHE 13 6.381 -1.050 2.901
77 HA PHE 13 HA PHE 13 5.840 1.086 4.719
78 HB2 PHE 13 HB2 PHE 13 5.173 1.144 2.348
79 HB3 PHE 13 HB3 PHE 13 3.996 -0.140 2.624
80 HD1 PHE 13 HD1 PHE 13 1.807 0.785 2.438
81 HD2 PHE 13 HD2 PHE 13 4.880 3.052 4.469
82 HE1 PHE 13 HE1 PHE 13 0.131 2.544 3.073
83 HE2 PHE 13 HE2 PHE 13 3.192 4.746 5.103
84 HZ PHE 13 HZ PHE 13 0.865 4.483 4.437
85 H PHE 14 H PHE 14 4.204 -2.058 4.227
86 HA PHE 14 HA PHE 14 2.330 -1.693 6.321
87 HB2 PHE 14 HB2 PHE 14 3.368 -4.077 4.783
88 HB3 PHE 14 HB3 PHE 14 2.417 -4.339 6.228
89 HD1 PHE 14 HD1 PHE 14 0.825 -5.534 4.760
90 HD2 PHE 14 HD2 PHE 14 1.518 -1.300 4.287
91 HE1 PHE 14 HE1 PHE 14 -1.244 -5.342 3.442
92 HE2 PHE 14 HE2 PHE 14 -0.580 -1.104 3.032
93 HZ PHE 14 HZ PHE 14 -1.988 -3.118 2.629
94 H ALA 15 H ALA 15 5.616 -3.095 6.320
95 HA ALA 15 HA ALA 15 5.543 -4.001 9.003
96 HB1 ALA 15 HB1 ALA 15 7.932 -2.935 7.433
97 HB2 ALA 15 HB2 ALA 15 7.993 -3.934 8.903
98 HB3 ALA 15 HB3 ALA 15 7.325 -4.608 7.411
99 H ARG 16 H ARG 16 6.083 -0.719 7.634
100 HA ARG 16 HA ARG 16 6.874 0.417 10.227
101 HB2 ARG 16 HB2 ARG 16 6.078 1.631 7.548
102 HB3 ARG 16 HB3 ARG 16 6.511 2.604 8.948
103 HG2 ARG 16 HG2 ARG 16 8.419 0.466 7.946
104 HG3 ARG 16 HG3 ARG 16 8.258 2.009 7.142
105 HD2 ARG 16 HD2 ARG 16 10.072 2.283 8.674
106 HD3 ARG 16 HD3 ARG 16 8.705 3.139 9.399
107 HE ARG 16 HE ARG 16 9.127 0.318 10.159
108 HH11 ARG 16 HH11 ARG 16 9.837 3.740 11.163
109 HH12 ARG 16 HH12 ARG 16 10.287 3.195 12.742
110 HH21 ARG 16 HH21 ARG 16 9.318 -0.113 12.456
111 HH22 ARG 16 HH22 ARG 16 9.983 1.159 13.449
112 H LEU 17 H LEU 17 3.901 0.071 8.414
113 HA LEU 17 HA LEU 17 2.395 1.925 10.138
114 HB2 LEU 17 HB2 LEU 17 1.398 -0.360 8.383
115 HB3 LEU 17 HB3 LEU 17 0.355 0.764 9.264
116 HG LEU 17 HG LEU 17 2.247 1.461 7.037
117 HD11 LEU 17 HD11 LEU 17 0.137 1.899 5.753
118 HD12 LEU 17 HD12 LEU 17 -0.775 1.184 7.098
119 HD13 LEU 17 HD13 LEU 17 0.393 0.207 6.186
120 HD21 LEU 17 HD21 LEU 17 0.223 3.208 8.540
121 HD22 LEU 17 HD22 LEU 17 1.063 3.703 7.051
122 HD23 LEU 17 HD23 LEU 17 1.983 3.420 8.518
123 H GLY 18 H GLY 18 2.591 -1.665 9.908
124 HA2 GLY 18 HA2 GLY 18 2.977 -2.627 12.292
125 HA3 GLY 18 HA3 GLY 18 1.382 -1.941 12.599
126 H CYS 19 H CYS 19 1.346 -2.849 9.341
127 HA CYS 19 HA CYS 19 -0.459 -5.026 9.881
128 HB2 CYS 19 HB2 CYS 19 0.426 -3.539 7.576
129 HB3 CYS 19 HB3 CYS 19 0.547 -5.269 7.210
130 HG CYS 19 HG CYS 19 -1.780 -3.752 6.659
131 H SER 20 H SER 20 -0.274 -7.256 9.200
132 HA SER 20 HA SER 20 2.444 -8.366 8.953
133 HB2 SER 20 HB2 SER 20 1.869 -10.080 10.697
134 HB3 SER 20 HB3 SER 20 2.191 -8.436 11.257
135 HG SER 20 HG SER 20 0.524 -9.063 12.357
136 H SER 21 H SER 21 -0.580 -10.151 9.555
137 HA SER 21 HA SER 21 -0.192 -11.861 7.406
138 HB2 SER 21 HB2 SER 21 -2.985 -11.137 8.306
139 HB3 SER 21 HB3 SER 21 -2.346 -12.701 7.773
140 HG SER 21 HG SER 21 -2.082 -11.332 10.215
141 H CYS 22 H CYS 22 -1.707 -8.605 7.252
142 HA CYS 22 HA CYS 22 -2.805 -9.100 4.637
143 HB2 CYS 22 HB2 CYS 22 -1.974 -6.369 5.654
144 HB3 CYS 22 HB3 CYS 22 -3.167 -6.770 4.416
145 HG CYS 22 HG CYS 22 -3.190 -7.290 7.648
146 H LEU 23 H LEU 23 0.491 -8.315 5.686
147 HA LEU 23 HA LEU 23 1.299 -7.335 3.083
148 HB2 LEU 23 HB2 LEU 23 3.328 -6.911 3.972
149 HB3 LEU 23 HB3 LEU 23 2.379 -6.881 5.437
150 HG LEU 23 HG LEU 23 3.184 -9.399 5.699
151 HD11 LEU 23 HD11 LEU 23 4.311 -9.505 3.436
152 HD12 LEU 23 HD12 LEU 23 5.353 -9.866 4.807
153 HD13 LEU 23 HD13 LEU 23 5.447 -8.270 4.029
154 HD21 LEU 23 HD21 LEU 23 5.134 -8.557 6.941
155 HD22 LEU 23 HD22 LEU 23 3.734 -7.517 7.202
156 HD23 LEU 23 HD23 LEU 23 5.027 -7.001 6.097
157 H ASP 24 H ASP 24 1.295 -10.364 4.941
158 HA ASP 24 HA ASP 24 2.642 -12.021 3.109
159 HB2 ASP 24 HB2 ASP 24 2.280 -12.640 5.404
160 HB3 ASP 24 HB3 ASP 24 0.535 -12.602 5.203
161 H TYR 25 H TYR 25 -0.713 -10.958 3.242
162 HA TYR 25 HA TYR 25 -1.687 -12.697 1.127
163 HB2 TYR 25 HB2 TYR 25 -2.776 -10.027 2.090
164 HB3 TYR 25 HB3 TYR 25 -3.625 -11.173 1.076
165 HD1 TYR 25 HD1 TYR 25 -4.724 -10.002 3.608
166 HD2 TYR 25 HD2 TYR 25 -2.514 -13.651 2.925
167 HE1 TYR 25 HE1 TYR 25 -5.575 -10.919 5.738
168 HE2 TYR 25 HE2 TYR 25 -3.399 -14.574 4.992
169 HH TYR 25 HH TYR 25 -5.478 -12.681 7.236
170 H PHE 26 H PHE 26 -0.744 -9.163 1.203
171 HA PHE 26 HA PHE 26 -0.888 -8.610 -1.466
172 HB2 PHE 26 HB2 PHE 26 0.321 -7.555 0.998
173 HB3 PHE 26 HB3 PHE 26 1.362 -7.244 -0.332
174 HD1 PHE 26 HD1 PHE 26 0.408 -6.074 -2.404
175 HD2 PHE 26 HD2 PHE 26 -1.799 -6.424 1.262
176 HE1 PHE 26 HE1 PHE 26 -0.945 -4.120 -3.063
177 HE2 PHE 26 HE2 PHE 26 -3.272 -4.616 0.549
178 HZ PHE 26 HZ PHE 26 -2.744 -3.307 -1.550
179 H THR 27 H THR 27 1.933 -10.092 0.265
180 HA THR 27 HA THR 27 3.701 -9.960 -1.986
181 HB THR 27 HB THR 27 5.020 -11.605 -0.557
182 HG1 THR 27 HG1 THR 27 3.804 -12.549 0.958
183 HG21 THR 27 HG21 THR 27 4.071 -9.023 0.791
184 HG22 THR 27 HG22 THR 27 5.465 -9.215 -0.312
185 HG23 THR 27 HG23 THR 27 5.466 -9.983 1.283
186 H THR 28 H THR 28 1.765 -12.670 -0.558
187 HA THR 28 HA THR 28 2.484 -14.469 -2.657
188 HB THR 28 HB THR 28 0.303 -14.404 -0.559
189 HG1 THR 28 HG1 THR 28 2.956 -15.181 -0.871
190 HG21 THR 28 HG21 THR 28 1.157 -16.790 -2.244
191 HG22 THR 28 HG22 THR 28 -0.447 -16.006 -2.237
192 HG23 THR 28 HG23 THR 28 0.123 -16.847 -0.798
193 H GLN 29 H GLN 29 0.054 -11.960 -2.605
194 HA GLN 29 HA GLN 29 -1.327 -12.996 -4.953
195 HB2 GLN 29 HB2 GLN 29 -1.401 -10.386 -3.401
196 HB3 GLN 29 HB3 GLN 29 -2.442 -10.731 -4.801
197 HG2 GLN 29 HG2 GLN 29 -3.501 -12.570 -3.840
198 HG3 GLN 29 HG3 GLN 29 -2.354 -12.732 -2.529
199 HE21 GLN 29 HE21 GLN 29 -4.118 -12.847 -1.091
200 HE22 GLN 29 HE22 GLN 29 -5.068 -11.449 -0.635
201 H GLY 30 H GLY 30 1.648 -11.575 -4.536
202 HA2 GLY 30 HA2 GLY 30 3.230 -10.684 -5.874
203 HA3 GLY 30 HA3 GLY 30 2.351 -11.427 -7.221
204 H LEU 31 H LEU 31 0.977 -8.929 -5.128
205 HA LEU 31 HA LEU 31 1.212 -6.907 -7.328
206 HB2 LEU 31 HB2 LEU 31 -1.135 -6.232 -6.744
207 HB3 LEU 31 HB3 LEU 31 -0.893 -7.744 -7.590
208 HG LEU 31 HG LEU 31 -1.126 -8.925 -5.325
209 HD11 LEU 31 HD11 LEU 31 -0.860 -7.129 -3.820
210 HD12 LEU 31 HD12 LEU 31 -2.500 -7.728 -3.665
211 HD13 LEU 31 HD13 LEU 31 -2.200 -6.203 -4.540
212 HD21 LEU 31 HD21 LEU 31 -3.425 -7.515 -6.673
213 HD22 LEU 31 HD22 LEU 31 -3.612 -8.799 -5.443
214 HD23 LEU 31 HD23 LEU 31 -2.785 -9.155 -6.963
215 H THR 32 H THR 32 2.747 -7.272 -4.684
216 HA THR 32 HA THR 32 1.889 -4.857 -3.228
217 HB THR 32 HB THR 32 2.520 -6.675 -1.897
218 HG1 THR 32 HG1 THR 32 4.540 -6.067 -0.964
219 HG21 THR 32 HG21 THR 32 3.625 -8.205 -3.361
220 HG22 THR 32 HG22 THR 32 4.662 -7.892 -1.977
221 HG23 THR 32 HG23 THR 32 5.031 -7.129 -3.531
222 H THR 33 H THR 33 2.429 -2.838 -4.041
223 HA THR 33 HA THR 33 5.234 -2.374 -4.515
224 HB THR 33 HB THR 33 4.990 -2.599 -6.751
225 HG1 THR 33 HG1 THR 33 4.704 -0.731 -7.550
226 HG21 THR 33 HG21 THR 33 2.939 -3.981 -6.709
227 HG22 THR 33 HG22 THR 33 2.942 -2.844 -8.011
228 HG23 THR 33 HG23 THR 33 1.901 -2.541 -6.581
229 H ILE 34 H ILE 34 5.666 -0.093 -4.228
230 HA ILE 34 HA ILE 34 3.658 1.287 -2.619
231 HB ILE 34 HB ILE 34 6.370 2.326 -3.511
232 HG12 ILE 34 HG12 ILE 34 6.592 0.127 -2.277
233 HG13 ILE 34 HG13 ILE 34 7.404 1.501 -1.588
234 HG21 ILE 34 HG21 ILE 34 6.144 3.646 -1.385
235 HG22 ILE 34 HG22 ILE 34 4.965 4.085 -2.638
236 HG23 ILE 34 HG23 ILE 34 4.465 3.088 -1.255
237 HD11 ILE 34 HD11 ILE 34 6.306 0.138 0.156
238 HD12 ILE 34 HD12 ILE 34 5.663 1.757 0.137
239 HD13 ILE 34 HD13 ILE 34 4.722 0.439 -0.604
240 H TYR 35 H TYR 35 5.379 1.942 -5.611
241 HA TYR 35 HA TYR 35 4.280 4.367 -6.384
242 HB2 TYR 35 HB2 TYR 35 5.411 2.067 -8.030
243 HB3 TYR 35 HB3 TYR 35 5.109 3.674 -8.645
244 HD1 TYR 35 HD1 TYR 35 7.035 2.075 -5.736
245 HD2 TYR 35 HD2 TYR 35 6.902 5.138 -8.774
246 HE1 TYR 35 HE1 TYR 35 9.229 2.826 -5.026
247 HE2 TYR 35 HE2 TYR 35 9.141 5.873 -8.099
248 HH TYR 35 HH TYR 35 11.079 5.254 -6.879
249 H GLN 36 H GLN 36 3.025 1.105 -6.699
250 HA GLN 36 HA GLN 36 0.998 1.930 -8.681
251 HB2 GLN 36 HB2 GLN 36 1.407 -0.670 -7.191
252 HB3 GLN 36 HB3 GLN 36 0.048 -0.361 -8.262
253 HG2 GLN 36 HG2 GLN 36 1.653 0.257 -10.100
254 HG3 GLN 36 HG3 GLN 36 2.943 -0.424 -9.129
255 HE21 GLN 36 HE21 GLN 36 0.473 -2.620 -8.392
256 HE22 GLN 36 HE22 GLN 36 0.792 -3.693 -9.722
257 H ILE 37 H ILE 37 0.933 1.044 -5.121
258 HA ILE 37 HA ILE 37 -1.866 1.551 -4.955
259 HB ILE 37 HB ILE 37 -1.552 1.822 -2.520
260 HG12 ILE 37 HG12 ILE 37 1.359 1.260 -3.098
261 HG13 ILE 37 HG13 ILE 37 0.729 2.833 -2.623
262 HG21 ILE 37 HG21 ILE 37 -0.371 -0.615 -3.895
263 HG22 ILE 37 HG22 ILE 37 -1.000 -0.567 -2.236
264 HG23 ILE 37 HG23 ILE 37 -2.090 -0.273 -3.581
265 HD11 ILE 37 HD11 ILE 37 0.617 0.334 -0.932
266 HD12 ILE 37 HD12 ILE 37 1.781 1.661 -0.784
267 HD13 ILE 37 HD13 ILE 37 0.050 1.951 -0.459
268 H GLU 38 H GLU 38 0.882 3.780 -4.932
269 HA GLU 38 HA GLU 38 -0.442 6.067 -3.944
270 HB2 GLU 38 HB2 GLU 38 1.817 5.590 -5.916
271 HB3 GLU 38 HB3 GLU 38 1.183 7.209 -5.653
272 HG2 GLU 38 HG2 GLU 38 1.626 7.012 -3.218
273 HG3 GLU 38 HG3 GLU 38 2.265 5.383 -3.456
274 H HIS 39 H HIS 39 -0.471 4.619 -7.268
275 HA HIS 39 HA HIS 39 -2.308 6.758 -8.159
276 HB2 HIS 39 HB2 HIS 39 -0.841 4.516 -9.568
277 HB3 HIS 39 HB3 HIS 39 -2.097 5.490 -10.319
278 HD1 HIS 39 HD1 HIS 39 -0.464 6.495 -12.099
279 HD2 HIS 39 HD2 HIS 39 0.466 7.358 -8.075
280 HE1 HIS 39 HE1 HIS 39 1.314 8.314 -12.141
281 H TYR 40 H TYR 40 -2.449 3.369 -7.151
282 HA TYR 40 HA TYR 40 -5.016 2.884 -8.345
283 HB2 TYR 40 HB2 TYR 40 -3.306 1.388 -6.331
284 HB3 TYR 40 HB3 TYR 40 -4.963 0.914 -6.595
285 HD1 TYR 40 HD1 TYR 40 -1.890 -0.476 -7.396
286 HD2 TYR 40 HD2 TYR 40 -5.412 1.191 -9.434
287 HE1 TYR 40 HE1 TYR 40 -1.545 -1.892 -9.325
288 HE2 TYR 40 HE2 TYR 40 -4.982 -0.267 -11.321
289 HH TYR 40 HH TYR 40 -2.142 -2.411 -11.516
290 H SER 41 H SER 41 -6.762 3.995 -7.777
291 HA SER 41 HA SER 41 -7.020 5.215 -5.204
292 HB2 SER 41 HB2 SER 41 -9.277 4.817 -7.152
293 HB3 SER 41 HB3 SER 41 -9.045 6.120 -5.988
294 HG SER 41 HG SER 41 -7.199 6.781 -7.204
295 H MET 42 H MET 42 -9.193 4.830 -3.915
296 HA MET 42 HA MET 42 -9.105 2.400 -2.621
297 HB2 MET 42 HB2 MET 42 -11.508 4.231 -3.011
298 HB3 MET 42 HB3 MET 42 -11.428 2.912 -1.839
299 HG2 MET 42 HG2 MET 42 -9.497 4.063 -0.736
300 HG3 MET 42 HG3 MET 42 -9.718 5.397 -1.883
301 HE1 MET 42 HE1 MET 42 -12.335 3.167 0.253
302 HE2 MET 42 HE2 MET 42 -10.966 3.605 1.310
303 HE3 MET 42 HE3 MET 42 -12.573 4.306 1.591
304 H ASP 43 H ASP 43 -11.099 3.158 -5.520
305 HA ASP 43 HA ASP 43 -12.710 0.801 -5.306
306 HB2 ASP 43 HB2 ASP 43 -13.311 2.853 -6.596
307 HB3 ASP 43 HB3 ASP 43 -12.092 2.407 -7.804
308 H ASP 44 H ASP 44 -9.546 1.419 -6.895
309 HA ASP 44 HA ASP 44 -9.571 -1.068 -8.346
310 HB2 ASP 44 HB2 ASP 44 -7.626 1.092 -7.845
311 HB3 ASP 44 HB3 ASP 44 -6.876 -0.496 -7.811
312 H LEU 45 H LEU 45 -8.640 -0.111 -5.099
313 HA LEU 45 HA LEU 45 -7.430 -2.616 -4.309
314 HB2 LEU 45 HB2 LEU 45 -8.915 -0.698 -2.466
315 HB3 LEU 45 HB3 LEU 45 -7.744 -1.927 -2.022
316 HG LEU 45 HG LEU 45 -7.216 0.698 -3.463
317 HD11 LEU 45 HD11 LEU 45 -5.761 0.992 -1.344
318 HD12 LEU 45 HD12 LEU 45 -6.640 -0.377 -0.677
319 HD13 LEU 45 HD13 LEU 45 -7.507 1.110 -1.145
320 HD21 LEU 45 HD21 LEU 45 -5.712 -0.917 -4.449
321 HD22 LEU 45 HD22 LEU 45 -5.254 -1.547 -2.853
322 HD23 LEU 45 HD23 LEU 45 -4.807 0.111 -3.336
323 H ALA 46 H ALA 46 -10.772 -1.311 -4.290
324 HA ALA 46 HA ALA 46 -12.002 -3.526 -2.972
325 HB1 ALA 46 HB1 ALA 46 -14.071 -2.715 -3.793
326 HB2 ALA 46 HB2 ALA 46 -13.082 -1.246 -3.601
327 HB3 ALA 46 HB3 ALA 46 -13.346 -1.940 -5.201
328 H SER 47 H SER 47 -11.203 -2.923 -6.423
329 HA SER 47 HA SER 47 -12.495 -5.224 -7.414
330 HB2 SER 47 HB2 SER 47 -11.541 -3.195 -8.711
331 HB3 SER 47 HB3 SER 47 -9.987 -4.059 -8.652
332 HG SER 47 HG SER 47 -11.219 -4.519 -10.540
333 H LEU 48 H LEU 48 -9.218 -4.770 -6.125
334 HA LEU 48 HA LEU 48 -8.398 -7.507 -6.556
335 HB2 LEU 48 HB2 LEU 48 -7.365 -5.414 -4.607
336 HB3 LEU 48 HB3 LEU 48 -6.582 -6.960 -4.918
337 HG LEU 48 HG LEU 48 -7.005 -4.735 -6.936
338 HD11 LEU 48 HD11 LEU 48 -4.502 -5.741 -5.534
339 HD12 LEU 48 HD12 LEU 48 -5.334 -4.192 -5.239
340 HD13 LEU 48 HD13 LEU 48 -4.554 -4.496 -6.798
341 HD21 LEU 48 HD21 LEU 48 -7.034 -6.786 -8.174
342 HD22 LEU 48 HD22 LEU 48 -5.662 -7.439 -7.252
343 HD23 LEU 48 HD23 LEU 48 -5.435 -6.077 -8.375
344 H LYS 49 H LYS 49 -10.996 -6.850 -4.961
345 HA LYS 49 HA LYS 49 -12.358 -7.844 -3.518
346 HB2 LYS 49 HB2 LYS 49 -10.267 -10.000 -3.079
347 HB3 LYS 49 HB3 LYS 49 -11.991 -10.097 -2.770
348 HG2 LYS 49 HG2 LYS 49 -10.725 -9.816 -5.530
349 HG3 LYS 49 HG3 LYS 49 -11.294 -11.321 -4.813
350 HD2 LYS 49 HD2 LYS 49 -13.578 -10.473 -4.705
351 HD3 LYS 49 HD3 LYS 49 -13.086 -8.914 -5.381
352 HE2 LYS 49 HE2 LYS 49 -12.833 -11.592 -6.812
353 HE3 LYS 49 HE3 LYS 49 -14.171 -10.456 -7.021
354 HZ1 LYS 49 HZ1 LYS 49 -12.584 -8.817 -7.853
355 HZ2 LYS 49 HZ2 LYS 49 -12.520 -10.207 -8.741
356 HZ3 LYS 49 HZ3 LYS 49 -11.343 -9.869 -7.646
357 H ILE 50 H ILE 50 -9.864 -6.196 -2.603
358 HA ILE 50 HA ILE 50 -9.417 -6.855 0.131
359 HB ILE 50 HB ILE 50 -9.158 -4.107 -1.089
360 HG12 ILE 50 HG12 ILE 50 -8.004 -5.781 -2.545
361 HG13 ILE 50 HG13 ILE 50 -6.896 -4.713 -1.732
362 HG21 ILE 50 HG21 ILE 50 -8.879 -4.320 1.394
363 HG22 ILE 50 HG22 ILE 50 -7.661 -5.563 1.101
364 HG23 ILE 50 HG23 ILE 50 -7.355 -3.898 0.581
365 HD11 ILE 50 HD11 ILE 50 -7.508 -7.503 -0.666
366 HD12 ILE 50 HD12 ILE 50 -6.297 -7.189 -1.906
367 HD13 ILE 50 HD13 ILE 50 -6.119 -6.442 -0.301
368 HA PRO 51 HA PRO 51 -13.415 -5.520 1.741
369 HB2 PRO 51 HB2 PRO 51 -12.918 -5.822 4.415
370 HB3 PRO 51 HB3 PRO 51 -13.212 -7.200 3.304
371 HG2 PRO 51 HG2 PRO 51 -10.565 -6.132 4.299
372 HG3 PRO 51 HG3 PRO 51 -11.105 -7.836 4.203
373 HD2 PRO 51 HD2 PRO 51 -9.532 -6.691 2.292
374 HD3 PRO 51 HD3 PRO 51 -10.776 -7.906 1.874
375 H GLU 52 H GLU 52 -14.125 -3.462 2.169
376 HA GLU 52 HA GLU 52 -12.413 -1.314 2.130
377 HB2 GLU 52 HB2 GLU 52 -14.285 0.110 2.796
378 HB3 GLU 52 HB3 GLU 52 -14.642 -1.024 1.509
379 HG2 GLU 52 HG2 GLU 52 -15.853 -2.493 3.083
380 HG3 GLU 52 HG3 GLU 52 -15.517 -1.338 4.385
381 H GLN 53 H GLN 53 -13.329 -3.038 5.076
382 HA GLN 53 HA GLN 53 -12.665 -1.134 7.007
383 HB2 GLN 53 HB2 GLN 53 -13.611 -3.415 7.410
384 HB3 GLN 53 HB3 GLN 53 -12.075 -4.151 7.017
385 HG2 GLN 53 HG2 GLN 53 -12.057 -2.064 9.181
386 HG3 GLN 53 HG3 GLN 53 -12.913 -3.562 9.524
387 HE21 GLN 53 HE21 GLN 53 -11.743 -5.484 9.925
388 HE22 GLN 53 HE22 GLN 53 -10.018 -5.399 10.236
389 H PHE 54 H PHE 54 -10.525 -3.524 5.455
390 HA PHE 54 HA PHE 54 -8.092 -2.323 6.567
391 HB2 PHE 54 HB2 PHE 54 -8.076 -4.623 6.582
392 HB3 PHE 54 HB3 PHE 54 -8.852 -4.773 5.010
393 HD1 PHE 54 HD1 PHE 54 -7.632 -5.248 3.144
394 HD2 PHE 54 HD2 PHE 54 -5.629 -3.494 6.545
395 HE1 PHE 54 HE1 PHE 54 -5.435 -5.454 1.976
396 HE2 PHE 54 HE2 PHE 54 -3.471 -3.705 5.402
397 HZ PHE 54 HZ PHE 54 -3.383 -4.702 3.077
398 H ARG 55 H ARG 55 -9.609 -2.664 3.279
399 HA ARG 55 HA ARG 55 -7.488 -1.479 1.891
400 HB2 ARG 55 HB2 ARG 55 -8.734 -1.949 0.175
401 HB3 ARG 55 HB3 ARG 55 -10.014 -2.440 1.255
402 HG2 ARG 55 HG2 ARG 55 -10.903 -0.046 1.138
403 HG3 ARG 55 HG3 ARG 55 -9.691 0.248 -0.129
404 HD2 ARG 55 HD2 ARG 55 -10.653 -1.649 -1.444
405 HD3 ARG 55 HD3 ARG 55 -11.838 -1.920 -0.174
406 HE ARG 55 HE ARG 55 -11.612 0.543 -1.862
407 HH11 ARG 55 HH11 ARG 55 -13.723 -2.074 -0.726
408 HH12 ARG 55 HH12 ARG 55 -15.156 -1.151 -0.923
409 HH21 ARG 55 HH21 ARG 55 -13.693 1.840 -2.036
410 HH22 ARG 55 HH22 ARG 55 -15.097 1.053 -1.429
411 H HIS 56 H HIS 56 -10.123 0.207 3.666
412 HA HIS 56 HA HIS 56 -9.352 2.830 2.784
413 HB2 HIS 56 HB2 HIS 56 -11.569 2.106 3.703
414 HB3 HIS 56 HB3 HIS 56 -10.826 1.905 5.289
415 HD1 HIS 56 HD1 HIS 56 -9.293 4.783 5.256
416 HD2 HIS 56 HD2 HIS 56 -13.273 3.971 4.206
417 HE1 HIS 56 HE1 HIS 56 -10.648 6.897 5.858
418 H ALA 57 H ALA 57 -8.001 0.605 5.248
419 HA ALA 57 HA ALA 57 -6.711 2.687 6.770
420 HB1 ALA 57 HB1 ALA 57 -6.350 -0.332 6.708
421 HB2 ALA 57 HB2 ALA 57 -5.563 0.768 7.823
422 HB3 ALA 57 HB3 ALA 57 -7.339 0.611 7.840
423 H ILE 58 H ILE 58 -5.571 0.260 4.275
424 HA ILE 58 HA ILE 58 -2.899 1.188 4.273
425 HB ILE 58 HB ILE 58 -3.108 -0.844 3.275
426 HG12 ILE 58 HG12 ILE 58 -3.171 1.041 0.840
427 HG13 ILE 58 HG13 ILE 58 -1.751 0.726 1.854
428 HG21 ILE 58 HG21 ILE 58 -5.516 -1.009 2.951
429 HG22 ILE 58 HG22 ILE 58 -5.383 -0.047 1.448
430 HG23 ILE 58 HG23 ILE 58 -4.640 -1.647 1.601
431 HD11 ILE 58 HD11 ILE 58 -1.519 -0.505 -0.140
432 HD12 ILE 58 HD12 ILE 58 -1.932 -1.701 1.081
433 HD13 ILE 58 HD13 ILE 58 -3.169 -1.146 -0.065
434 H TRP 59 H TRP 59 -5.675 2.005 2.230
435 HA TRP 59 HA TRP 59 -4.390 3.847 0.561
436 HB2 TRP 59 HB2 TRP 59 -6.754 2.728 0.480
437 HB3 TRP 59 HB3 TRP 59 -7.292 4.180 1.312
438 HD1 TRP 59 HD1 TRP 59 -5.492 2.991 -1.862
439 HE1 TRP 59 HE1 TRP 59 -5.792 4.648 -3.742
440 HE3 TRP 59 HE3 TRP 59 -7.947 6.527 0.728
441 HZ2 TRP 59 HZ2 TRP 59 -7.485 7.091 -4.176
442 HZ3 TRP 59 HZ3 TRP 59 -8.955 8.535 -0.398
443 HH2 TRP 59 HH2 TRP 59 -8.784 8.770 -2.864
444 H LYS 60 H LYS 60 -6.286 4.520 3.577
445 HA LYS 60 HA LYS 60 -5.825 7.272 3.668
446 HB2 LYS 60 HB2 LYS 60 -7.367 6.050 5.132
447 HB3 LYS 60 HB3 LYS 60 -6.020 5.264 5.963
448 HG2 LYS 60 HG2 LYS 60 -5.373 7.352 7.005
449 HG3 LYS 60 HG3 LYS 60 -6.443 8.273 5.945
450 HD2 LYS 60 HD2 LYS 60 -7.500 8.109 8.105
451 HD3 LYS 60 HD3 LYS 60 -8.426 7.154 6.944
452 HE2 LYS 60 HE2 LYS 60 -7.205 5.087 7.810
453 HE3 LYS 60 HE3 LYS 60 -6.467 6.121 9.035
454 HZ1 LYS 60 HZ1 LYS 60 -8.331 5.060 9.972
455 HZ2 LYS 60 HZ2 LYS 60 -9.344 5.449 8.781
456 HZ3 LYS 60 HZ3 LYS 60 -8.765 6.631 9.804
457 H GLY 61 H GLY 61 -3.696 4.622 4.824
458 HA2 GLY 61 HA2 GLY 61 -1.754 6.253 6.091
459 HA3 GLY 61 HA3 GLY 61 -1.471 4.637 5.410
460 H ILE 62 H ILE 62 -1.692 4.945 2.696
461 HA ILE 62 HA ILE 62 0.823 6.296 2.237
462 HB ILE 62 HB ILE 62 0.235 4.320 1.241
463 HG12 ILE 62 HG12 ILE 62 0.874 4.715 -1.171
464 HG13 ILE 62 HG13 ILE 62 0.635 6.443 -0.909
465 HG21 ILE 62 HG21 ILE 62 -1.282 3.928 -0.579
466 HG22 ILE 62 HG22 ILE 62 -2.184 4.555 0.789
467 HG23 ILE 62 HG23 ILE 62 -1.802 5.620 -0.576
468 HD11 ILE 62 HD11 ILE 62 2.621 4.691 0.600
469 HD12 ILE 62 HD12 ILE 62 3.014 5.721 -0.798
470 HD13 ILE 62 HD13 ILE 62 2.480 6.464 0.718
471 H LEU 63 H LEU 63 -2.551 7.072 1.492
472 HA LEU 63 HA LEU 63 -1.949 9.402 -0.062
473 HB2 LEU 63 HB2 LEU 63 -4.366 8.463 1.495
474 HB3 LEU 63 HB3 LEU 63 -4.299 10.127 0.983
475 HG LEU 63 HG LEU 63 -5.548 8.606 -0.561
476 HD11 LEU 63 HD11 LEU 63 -4.575 9.626 -2.630
477 HD12 LEU 63 HD12 LEU 63 -3.206 10.188 -1.671
478 HD13 LEU 63 HD13 LEU 63 -4.835 10.768 -1.302
479 HD21 LEU 63 HD21 LEU 63 -4.055 6.637 -0.606
480 HD22 LEU 63 HD22 LEU 63 -2.811 7.600 -1.442
481 HD23 LEU 63 HD23 LEU 63 -4.367 7.273 -2.221
482 H ASP 64 H ASP 64 -2.063 8.739 3.324
483 HA ASP 64 HA ASP 64 -1.931 11.483 4.344
484 HB2 ASP 64 HB2 ASP 64 -2.867 9.966 5.826
485 HB3 ASP 64 HB3 ASP 64 -1.640 8.745 5.529
486 H HIS 65 H HIS 65 0.328 9.019 3.433
487 HA HIS 65 HA HIS 65 2.635 10.074 4.718
488 HB2 HIS 65 HB2 HIS 65 2.508 7.730 4.058
489 HB3 HIS 65 HB3 HIS 65 2.414 8.182 2.356
490 HD1 HIS 65 HD1 HIS 65 5.000 9.131 5.133
491 HD2 HIS 65 HD2 HIS 65 4.623 7.728 1.173
492 HE1 HIS 65 HE1 HIS 65 7.382 8.842 4.239
493 H ARG 66 H ARG 66 1.502 10.175 1.321
494 HA ARG 66 HA ARG 66 3.586 12.100 0.645
495 HB2 ARG 66 HB2 ARG 66 2.709 12.211 -1.505
496 HB3 ARG 66 HB3 ARG 66 2.407 10.582 -0.933
497 HG2 ARG 66 HG2 ARG 66 0.041 12.090 -0.306
498 HG3 ARG 66 HG3 ARG 66 0.505 12.554 -1.961
499 HD2 ARG 66 HD2 ARG 66 0.093 9.967 -0.588
500 HD3 ARG 66 HD3 ARG 66 -1.068 10.688 -1.706
501 HE ARG 66 HE ARG 66 1.538 9.425 -2.479
502 HH11 ARG 66 HH11 ARG 66 -1.148 11.415 -3.654
503 HH12 ARG 66 HH12 ARG 66 -0.635 11.333 -5.299
504 HH21 ARG 66 HH21 ARG 66 2.127 9.200 -4.638
505 HH22 ARG 66 HH22 ARG 66 1.188 9.938 -5.879
506 H GLN 67 H GLN 67 0.221 12.313 1.632
507 HA GLN 67 HA GLN 67 -0.241 15.077 1.200
508 HB2 GLN 67 HB2 GLN 67 -2.061 13.718 1.820
509 HB3 GLN 67 HB3 GLN 67 -1.220 13.103 3.258
510 HG2 GLN 67 HG2 GLN 67 -1.510 15.127 4.420
511 HG3 GLN 67 HG3 GLN 67 -2.179 15.921 2.972
512 HE21 GLN 67 HE21 GLN 67 -2.892 13.733 5.692
513 HE22 GLN 67 HE22 GLN 67 -4.601 13.572 5.282
514 H LEU 68 H LEU 68 1.567 13.492 3.833
515 HA LEU 68 HA LEU 68 2.030 16.145 5.060
516 HB2 LEU 68 HB2 LEU 68 2.442 13.299 5.948
517 HB3 LEU 68 HB3 LEU 68 3.092 14.673 6.870
518 HG LEU 68 HG LEU 68 0.135 14.292 6.167
519 HD11 LEU 68 HD11 LEU 68 -0.182 13.554 8.429
520 HD12 LEU 68 HD12 LEU 68 1.513 13.896 8.836
521 HD13 LEU 68 HD13 LEU 68 1.089 12.570 7.720
522 HD21 LEU 68 HD21 LEU 68 0.665 16.668 6.550
523 HD22 LEU 68 HD22 LEU 68 1.547 16.260 8.029
524 HD23 LEU 68 HD23 LEU 68 -0.212 16.036 7.936
525 H HIS 69 H HIS 69 3.836 13.914 2.912
526 HA HIS 69 HA HIS 69 6.122 15.683 3.314
527 HB2 HIS 69 HB2 HIS 69 5.955 12.739 3.685
528 HB3 HIS 69 HB3 HIS 69 7.188 13.264 2.579
529 HD1 HIS 69 HD1 HIS 69 7.224 12.355 5.965
530 HD2 HIS 69 HD2 HIS 69 8.320 15.882 3.925
531 HE1 HIS 69 HE1 HIS 69 8.689 13.673 7.546
532 H ASP 70 H ASP 70 6.048 16.836 1.645
533 HA ASP 70 HA ASP 70 5.886 15.706 -1.105
534 HB2 ASP 70 HB2 ASP 70 3.839 16.985 -0.651
535 HB3 ASP 70 HB3 ASP 70 4.770 18.303 0.029
Start of MODEL 13
1 H1 GLY 1 H GLY 1 10.523 -19.738 0.159
2 HA2 GLY 1 HA2 GLY 1 12.072 -17.889 0.379
3 HA3 GLY 1 HA3 GLY 1 12.698 -19.061 -0.800
4 HA PRO 2 HA PRO 2 11.104 -14.984 -2.879
5 HB2 PRO 2 HB2 PRO 2 12.601 -12.838 -2.037
6 HB3 PRO 2 HB3 PRO 2 11.099 -13.381 -1.252
7 HG2 PRO 2 HG2 PRO 2 13.943 -14.034 -0.436
8 HG3 PRO 2 HG3 PRO 2 12.606 -13.439 0.600
9 HD2 PRO 2 HD2 PRO 2 13.204 -16.075 0.439
10 HD3 PRO 2 HD3 PRO 2 11.506 -15.520 0.562
11 H LEU 3 H LEU 3 14.474 -15.824 -2.097
12 HA LEU 3 HA LEU 3 16.414 -15.491 -3.146
13 HB2 LEU 3 HB2 LEU 3 16.702 -16.712 -5.076
14 HB3 LEU 3 HB3 LEU 3 15.545 -17.563 -4.083
15 HG LEU 3 HG LEU 3 14.432 -15.772 -6.268
16 HD11 LEU 3 HD11 LEU 3 15.790 -18.435 -6.729
17 HD12 LEU 3 HD12 LEU 3 16.347 -16.870 -7.350
18 HD13 LEU 3 HD13 LEU 3 14.825 -17.550 -7.946
19 HD21 LEU 3 HD21 LEU 3 12.889 -17.699 -6.565
20 HD22 LEU 3 HD22 LEU 3 12.833 -17.045 -4.940
21 HD23 LEU 3 HD23 LEU 3 13.715 -18.552 -5.230
22 H GLY 4 H GLY 4 15.028 -13.010 -3.116
23 HA2 GLY 4 HA2 GLY 4 16.437 -11.569 -5.229
24 HA3 GLY 4 HA3 GLY 4 14.672 -11.414 -5.176
25 H SER 5 H SER 5 15.481 -9.072 -4.754
26 HA SER 5 HA SER 5 15.687 -8.594 -1.818
27 HB2 SER 5 HB2 SER 5 17.191 -7.114 -4.003
28 HB3 SER 5 HB3 SER 5 17.320 -6.828 -2.265
29 HG SER 5 HG SER 5 18.742 -8.452 -3.747
30 H THR 6 H THR 6 14.695 -6.606 -1.142
31 HA THR 6 HA THR 6 13.349 -4.907 -3.141
32 HB THR 6 HB THR 6 11.209 -5.204 -1.547
33 HG1 THR 6 HG1 THR 6 12.196 -6.915 -0.335
34 HG21 THR 6 HG21 THR 6 10.169 -6.539 -3.214
35 HG22 THR 6 HG22 THR 6 11.727 -7.156 -3.811
36 HG23 THR 6 HG23 THR 6 11.287 -5.446 -4.026
37 H ASP 7 H ASP 7 15.184 -3.689 -2.237
38 HA ASP 7 HA ASP 7 15.478 -2.855 0.423
39 HB2 ASP 7 HB2 ASP 7 16.221 -1.782 -2.275
40 HB3 ASP 7 HB3 ASP 7 16.231 -0.628 -0.957
41 H CYS 8 H CYS 8 13.265 -1.638 -2.048
42 HA CYS 8 HA CYS 8 11.712 -0.178 -0.008
43 HB2 CYS 8 HB2 CYS 8 12.965 1.089 -2.475
44 HB3 CYS 8 HB3 CYS 8 11.519 1.747 -1.697
45 HG CYS 8 HG CYS 8 14.035 0.846 0.154
46 H SER 9 H SER 9 9.817 -1.237 -0.215
47 HA SER 9 HA SER 9 8.326 -1.263 -2.634
48 HB2 SER 9 HB2 SER 9 9.762 -3.229 -3.064
49 HB3 SER 9 HB3 SER 9 9.302 -3.925 -1.512
50 HG SER 9 HG SER 9 8.129 -4.100 -3.877
51 H ILE 10 H ILE 10 6.156 -2.493 -1.969
52 HA ILE 10 HA ILE 10 5.109 -1.140 0.260
53 HB ILE 10 HB ILE 10 4.123 -3.106 -1.611
54 HG12 ILE 10 HG12 ILE 10 3.662 -0.684 -1.568
55 HG13 ILE 10 HG13 ILE 10 2.208 -1.672 -1.653
56 HG21 ILE 10 HG21 ILE 10 3.577 -4.552 0.280
57 HG22 ILE 10 HG22 ILE 10 2.719 -3.234 1.075
58 HG23 ILE 10 HG23 ILE 10 2.109 -3.872 -0.454
59 HD11 ILE 10 HD11 ILE 10 1.406 -0.843 0.282
60 HD12 ILE 10 HD12 ILE 10 2.949 -0.984 1.124
61 HD13 ILE 10 HD13 ILE 10 2.636 0.425 0.107
62 H VAL 11 H VAL 11 6.798 -4.193 0.303
63 HA VAL 11 HA VAL 11 5.894 -5.190 2.753
64 HB VAL 11 HB VAL 11 8.358 -5.911 3.017
65 HG11 VAL 11 HG11 VAL 11 6.470 -7.264 2.182
66 HG12 VAL 11 HG12 VAL 11 6.751 -6.689 0.529
67 HG13 VAL 11 HG13 VAL 11 7.959 -7.708 1.358
68 HG21 VAL 11 HG21 VAL 11 8.553 -5.069 0.097
69 HG22 VAL 11 HG22 VAL 11 9.437 -4.279 1.436
70 HG23 VAL 11 HG23 VAL 11 9.750 -5.965 1.029
71 H SER 12 H SER 12 8.391 -2.707 2.202
72 HA SER 12 HA SER 12 9.035 -2.262 4.919
73 HB2 SER 12 HB2 SER 12 10.263 -1.594 2.747
74 HB3 SER 12 HB3 SER 12 9.130 -0.236 2.643
75 HG SER 12 HG SER 12 10.972 0.424 3.651
76 H PHE 13 H PHE 13 6.593 -0.700 2.740
77 HA PHE 13 HA PHE 13 5.818 1.168 4.787
78 HB2 PHE 13 HB2 PHE 13 5.408 1.509 2.378
79 HB3 PHE 13 HB3 PHE 13 4.215 0.218 2.400
80 HD1 PHE 13 HD1 PHE 13 1.932 0.917 2.605
81 HD2 PHE 13 HD2 PHE 13 5.062 3.386 4.265
82 HE1 PHE 13 HE1 PHE 13 0.243 2.619 3.296
83 HE2 PHE 13 HE2 PHE 13 3.364 5.063 4.954
84 HZ PHE 13 HZ PHE 13 0.993 4.661 4.508
85 H PHE 14 H PHE 14 4.476 -2.040 3.837
86 HA PHE 14 HA PHE 14 2.333 -1.959 5.699
87 HB2 PHE 14 HB2 PHE 14 3.709 -4.087 4.099
88 HB3 PHE 14 HB3 PHE 14 2.622 -4.580 5.356
89 HD1 PHE 14 HD1 PHE 14 1.010 -5.574 3.794
90 HD2 PHE 14 HD2 PHE 14 1.986 -1.376 3.507
91 HE1 PHE 14 HE1 PHE 14 -0.939 -5.192 2.315
92 HE2 PHE 14 HE2 PHE 14 0.095 -0.982 2.165
93 HZ PHE 14 HZ PHE 14 -1.425 -2.899 1.455
94 H ALA 15 H ALA 15 5.685 -3.132 6.080
95 HA ALA 15 HA ALA 15 5.312 -4.227 8.676
96 HB1 ALA 15 HB1 ALA 15 7.780 -2.898 7.456
97 HB2 ALA 15 HB2 ALA 15 7.752 -3.912 8.918
98 HB3 ALA 15 HB3 ALA 15 7.350 -4.621 7.345
99 H ARG 16 H ARG 16 6.064 -0.897 7.525
100 HA ARG 16 HA ARG 16 6.239 0.270 10.134
101 HB2 ARG 16 HB2 ARG 16 5.492 1.513 7.445
102 HB3 ARG 16 HB3 ARG 16 5.815 2.433 8.883
103 HG2 ARG 16 HG2 ARG 16 7.915 0.522 7.764
104 HG3 ARG 16 HG3 ARG 16 7.662 2.120 7.069
105 HD2 ARG 16 HD2 ARG 16 9.439 2.328 8.599
106 HD3 ARG 16 HD3 ARG 16 8.037 3.049 9.392
107 HE ARG 16 HE ARG 16 9.065 0.278 9.857
108 HH11 ARG 16 HH11 ARG 16 7.646 3.254 11.241
109 HH12 ARG 16 HH12 ARG 16 7.393 2.579 12.806
110 HH21 ARG 16 HH21 ARG 16 8.758 -0.612 11.939
111 HH22 ARG 16 HH22 ARG 16 8.077 0.292 13.217
112 H LEU 17 H LEU 17 3.476 -0.293 8.000
113 HA LEU 17 HA LEU 17 1.590 1.274 9.554
114 HB2 LEU 17 HB2 LEU 17 1.083 -1.150 7.754
115 HB3 LEU 17 HB3 LEU 17 -0.171 -0.173 8.501
116 HG LEU 17 HG LEU 17 1.781 0.750 6.381
117 HD11 LEU 17 HD11 LEU 17 -1.216 0.275 6.349
118 HD12 LEU 17 HD12 LEU 17 0.031 -0.699 5.536
119 HD13 LEU 17 HD13 LEU 17 -0.259 0.975 5.035
120 HD21 LEU 17 HD21 LEU 17 0.355 2.854 6.381
121 HD22 LEU 17 HD22 LEU 17 1.424 2.670 7.766
122 HD23 LEU 17 HD23 LEU 17 -0.303 2.310 7.943
123 H GLY 18 H GLY 18 2.798 -2.078 9.752
124 HA2 GLY 18 HA2 GLY 18 2.953 -3.296 11.700
125 HA3 GLY 18 HA3 GLY 18 1.615 -2.376 12.422
126 H CYS 19 H CYS 19 1.214 -3.409 9.015
127 HA CYS 19 HA CYS 19 -0.975 -4.992 10.005
128 HB2 CYS 19 HB2 CYS 19 -1.702 -5.211 7.724
129 HB3 CYS 19 HB3 CYS 19 -1.344 -3.520 8.159
130 HG CYS 19 HG CYS 19 -0.630 -3.943 5.689
131 H SER 20 H SER 20 -1.412 -7.241 9.276
132 HA SER 20 HA SER 20 1.113 -8.841 9.179
133 HB2 SER 20 HB2 SER 20 -1.354 -9.344 10.858
134 HB3 SER 20 HB3 SER 20 0.003 -10.459 10.678
135 HG SER 20 HG SER 20 1.308 -9.095 11.750
136 H SER 21 H SER 21 -2.244 -10.166 9.083
137 HA SER 21 HA SER 21 -1.720 -11.854 6.970
138 HB2 SER 21 HB2 SER 21 -4.247 -11.834 6.614
139 HB3 SER 21 HB3 SER 21 -3.678 -12.204 8.249
140 HG SER 21 HG SER 21 -5.462 -10.553 7.949
141 H CYS 22 H CYS 22 -2.506 -8.419 6.706
142 HA CYS 22 HA CYS 22 -3.269 -8.455 3.992
143 HB2 CYS 22 HB2 CYS 22 -1.757 -6.144 5.262
144 HB3 CYS 22 HB3 CYS 22 -3.123 -6.079 4.136
145 HG CYS 22 HG CYS 22 -4.963 -6.743 5.762
146 H LEU 23 H LEU 23 -0.047 -8.231 5.572
147 HA LEU 23 HA LEU 23 1.298 -7.610 3.130
148 HB2 LEU 23 HB2 LEU 23 3.176 -7.479 4.394
149 HB3 LEU 23 HB3 LEU 23 1.976 -7.169 5.608
150 HG LEU 23 HG LEU 23 2.255 -9.834 6.054
151 HD11 LEU 23 HD11 LEU 23 3.870 -10.263 4.249
152 HD12 LEU 23 HD12 LEU 23 4.609 -10.473 5.835
153 HD13 LEU 23 HD13 LEU 23 4.923 -8.988 4.925
154 HD21 LEU 23 HD21 LEU 23 2.651 -8.067 7.696
155 HD22 LEU 23 HD22 LEU 23 4.239 -7.723 6.989
156 HD23 LEU 23 HD23 LEU 23 3.917 -9.288 7.776
157 H ASP 24 H ASP 24 0.412 -10.521 4.892
158 HA ASP 24 HA ASP 24 1.963 -12.438 3.490
159 HB2 ASP 24 HB2 ASP 24 0.708 -12.783 5.617
160 HB3 ASP 24 HB3 ASP 24 -0.793 -12.851 4.707
161 H TYR 25 H TYR 25 -1.425 -11.408 3.015
162 HA TYR 25 HA TYR 25 -1.929 -12.929 0.683
163 HB2 TYR 25 HB2 TYR 25 -3.006 -10.185 1.437
164 HB3 TYR 25 HB3 TYR 25 -3.715 -11.259 0.242
165 HD1 TYR 25 HD1 TYR 25 -4.857 -9.920 2.872
166 HD2 TYR 25 HD2 TYR 25 -3.456 -13.898 1.942
167 HE1 TYR 25 HE1 TYR 25 -6.358 -10.847 4.577
168 HE2 TYR 25 HE2 TYR 25 -4.955 -14.828 3.663
169 HH TYR 25 HH TYR 25 -7.210 -12.759 5.530
170 H PHE 26 H PHE 26 -0.683 -9.555 1.027
171 HA PHE 26 HA PHE 26 -0.485 -9.010 -1.714
172 HB2 PHE 26 HB2 PHE 26 0.572 -7.858 0.796
173 HB3 PHE 26 HB3 PHE 26 1.627 -7.598 -0.558
174 HD1 PHE 26 HD1 PHE 26 0.848 -6.392 -2.610
175 HD2 PHE 26 HD2 PHE 26 -1.709 -6.854 0.823
176 HE1 PHE 26 HE1 PHE 26 -0.650 -4.629 -3.476
177 HE2 PHE 26 HE2 PHE 26 -3.185 -5.125 -0.032
178 HZ PHE 26 HZ PHE 26 -2.634 -3.962 -2.195
179 H THR 27 H THR 27 2.139 -10.386 0.390
180 HA THR 27 HA THR 27 3.914 -10.562 -1.851
181 HB THR 27 HB THR 27 4.819 -10.441 0.334
182 HG1 THR 27 HG1 THR 27 5.858 -11.718 -1.339
183 HG21 THR 27 HG21 THR 27 3.655 -13.178 1.036
184 HG22 THR 27 HG22 THR 27 3.146 -11.645 1.742
185 HG23 THR 27 HG23 THR 27 4.760 -12.202 2.033
186 H THR 28 H THR 28 1.560 -12.936 -0.495
187 HA THR 28 HA THR 28 2.436 -15.047 -2.171
188 HB THR 28 HB THR 28 -0.406 -14.667 -1.160
189 HG1 THR 28 HG1 THR 28 0.905 -14.411 0.644
190 HG21 THR 28 HG21 THR 28 1.347 -17.151 -1.480
191 HG22 THR 28 HG22 THR 28 0.122 -16.659 -2.657
192 HG23 THR 28 HG23 THR 28 -0.360 -17.112 -1.007
193 H GLN 29 H GLN 29 0.362 -12.220 -2.850
194 HA GLN 29 HA GLN 29 -0.554 -13.276 -5.423
195 HB2 GLN 29 HB2 GLN 29 -0.689 -10.537 -4.112
196 HB3 GLN 29 HB3 GLN 29 -1.484 -10.983 -5.633
197 HG2 GLN 29 HG2 GLN 29 -2.115 -12.588 -3.150
198 HG3 GLN 29 HG3 GLN 29 -2.865 -11.024 -3.432
199 HE21 GLN 29 HE21 GLN 29 -2.988 -14.405 -4.153
200 HE22 GLN 29 HE22 GLN 29 -4.316 -14.268 -5.310
201 H GLY 30 H GLY 30 2.115 -11.313 -4.233
202 HA2 GLY 30 HA2 GLY 30 4.028 -10.559 -5.264
203 HA3 GLY 30 HA3 GLY 30 3.556 -11.462 -6.710
204 H LEU 31 H LEU 31 1.701 -8.866 -5.116
205 HA LEU 31 HA LEU 31 2.165 -7.012 -7.424
206 HB2 LEU 31 HB2 LEU 31 -0.328 -6.386 -7.066
207 HB3 LEU 31 HB3 LEU 31 0.085 -7.814 -7.975
208 HG LEU 31 HG LEU 31 -0.357 -9.237 -6.059
209 HD11 LEU 31 HD11 LEU 31 0.029 -7.829 -4.147
210 HD12 LEU 31 HD12 LEU 31 -1.662 -8.323 -4.109
211 HD13 LEU 31 HD13 LEU 31 -1.248 -6.695 -4.681
212 HD21 LEU 31 HD21 LEU 31 -2.087 -8.876 -7.669
213 HD22 LEU 31 HD22 LEU 31 -2.661 -7.433 -6.781
214 HD23 LEU 31 HD23 LEU 31 -2.776 -9.059 -6.046
215 H THR 32 H THR 32 3.387 -7.123 -4.705
216 HA THR 32 HA THR 32 2.156 -4.813 -3.338
217 HB THR 32 HB THR 32 3.103 -5.631 -1.543
218 HG1 THR 32 HG1 THR 32 5.456 -5.247 -2.925
219 HG21 THR 32 HG21 THR 32 2.683 -7.837 -2.534
220 HG22 THR 32 HG22 THR 32 3.953 -7.813 -1.300
221 HG23 THR 32 HG23 THR 32 4.379 -7.932 -3.004
222 H THR 33 H THR 33 2.595 -2.720 -4.000
223 HA THR 33 HA THR 33 5.340 -1.995 -4.511
224 HB THR 33 HB THR 33 5.194 -2.382 -6.694
225 HG1 THR 33 HG1 THR 33 4.508 -0.771 -7.922
226 HG21 THR 33 HG21 THR 33 3.138 -2.693 -8.059
227 HG22 THR 33 HG22 THR 33 2.116 -2.382 -6.645
228 HG23 THR 33 HG23 THR 33 3.192 -3.804 -6.725
229 H ILE 34 H ILE 34 5.583 0.255 -4.234
230 HA ILE 34 HA ILE 34 3.465 1.556 -2.696
231 HB ILE 34 HB ILE 34 6.050 2.876 -3.575
232 HG12 ILE 34 HG12 ILE 34 6.566 0.651 -2.370
233 HG13 ILE 34 HG13 ILE 34 7.325 2.122 -1.839
234 HG21 ILE 34 HG21 ILE 34 5.668 4.141 -1.433
235 HG22 ILE 34 HG22 ILE 34 4.367 4.360 -2.604
236 HG23 ILE 34 HG23 ILE 34 4.156 3.270 -1.209
237 HD11 ILE 34 HD11 ILE 34 5.869 2.281 0.101
238 HD12 ILE 34 HD12 ILE 34 4.882 0.934 -0.480
239 HD13 ILE 34 HD13 ILE 34 6.567 0.678 0.039
240 H TYR 35 H TYR 35 5.228 2.228 -5.678
241 HA TYR 35 HA TYR 35 4.026 4.572 -6.520
242 HB2 TYR 35 HB2 TYR 35 5.071 2.320 -8.281
243 HB3 TYR 35 HB3 TYR 35 4.983 4.030 -8.674
244 HD1 TYR 35 HD1 TYR 35 6.807 1.456 -6.739
245 HD2 TYR 35 HD2 TYR 35 6.623 5.626 -7.831
246 HE1 TYR 35 HE1 TYR 35 9.046 1.801 -5.805
247 HE2 TYR 35 HE2 TYR 35 8.939 5.949 -7.012
248 HH TYR 35 HH TYR 35 10.767 4.967 -5.947
249 H GLN 36 H GLN 36 2.912 1.277 -6.766
250 HA GLN 36 HA GLN 36 0.909 1.901 -8.828
251 HB2 GLN 36 HB2 GLN 36 1.399 -0.489 -7.044
252 HB3 GLN 36 HB3 GLN 36 -0.093 -0.306 -7.960
253 HG2 GLN 36 HG2 GLN 36 1.260 0.093 -10.055
254 HG3 GLN 36 HG3 GLN 36 2.660 -0.477 -9.151
255 HE21 GLN 36 HE21 GLN 36 1.514 -1.731 -11.536
256 HE22 GLN 36 HE22 GLN 36 0.843 -3.276 -11.044
257 H ILE 37 H ILE 37 0.682 1.344 -5.231
258 HA ILE 37 HA ILE 37 -2.114 1.901 -5.222
259 HB ILE 37 HB ILE 37 -1.887 2.084 -2.783
260 HG12 ILE 37 HG12 ILE 37 1.042 1.413 -3.278
261 HG13 ILE 37 HG13 ILE 37 0.460 3.017 -2.840
262 HG21 ILE 37 HG21 ILE 37 -0.568 -0.310 -4.160
263 HG22 ILE 37 HG22 ILE 37 -1.331 -0.332 -2.567
264 HG23 ILE 37 HG23 ILE 37 -2.302 -0.048 -4.002
265 HD11 ILE 37 HD11 ILE 37 0.227 0.495 -1.185
266 HD12 ILE 37 HD12 ILE 37 1.305 1.873 -0.908
267 HD13 ILE 37 HD13 ILE 37 -0.451 2.082 -0.734
268 H GLU 38 H GLU 38 0.528 4.090 -5.493
269 HA GLU 38 HA GLU 38 -0.846 6.402 -4.458
270 HB2 GLU 38 HB2 GLU 38 1.577 6.352 -4.703
271 HB3 GLU 38 HB3 GLU 38 1.455 5.995 -6.410
272 HG2 GLU 38 HG2 GLU 38 2.141 8.239 -6.193
273 HG3 GLU 38 HG3 GLU 38 0.520 8.262 -6.819
274 H HIS 39 H HIS 39 -1.144 4.456 -7.380
275 HA HIS 39 HA HIS 39 -2.988 6.465 -8.588
276 HB2 HIS 39 HB2 HIS 39 -0.977 5.993 -9.927
277 HB3 HIS 39 HB3 HIS 39 -1.370 4.274 -9.926
278 HD1 HIS 39 HD1 HIS 39 -3.765 7.262 -10.711
279 HD2 HIS 39 HD2 HIS 39 -1.999 3.834 -12.430
280 HE1 HIS 39 HE1 HIS 39 -4.656 7.096 -13.077
281 H TYR 40 H TYR 40 -2.731 3.107 -7.362
282 HA TYR 40 HA TYR 40 -5.301 2.321 -8.474
283 HB2 TYR 40 HB2 TYR 40 -3.340 0.989 -6.543
284 HB3 TYR 40 HB3 TYR 40 -4.957 0.380 -6.769
285 HD1 TYR 40 HD1 TYR 40 -1.978 -0.975 -7.447
286 HD2 TYR 40 HD2 TYR 40 -5.283 0.764 -9.735
287 HE1 TYR 40 HE1 TYR 40 -1.557 -2.448 -9.353
288 HE2 TYR 40 HE2 TYR 40 -4.638 -0.540 -11.652
289 HH TYR 40 HH TYR 40 -3.166 -2.102 -12.536
290 H SER 41 H SER 41 -6.744 3.827 -7.821
291 HA SER 41 HA SER 41 -6.896 4.753 -5.101
292 HB2 SER 41 HB2 SER 41 -8.911 4.934 -7.395
293 HB3 SER 41 HB3 SER 41 -8.915 5.907 -5.909
294 HG SER 41 HG SER 41 -7.929 7.044 -7.576
295 H MET 42 H MET 42 -9.202 4.635 -4.082
296 HA MET 42 HA MET 42 -9.536 2.165 -2.955
297 HB2 MET 42 HB2 MET 42 -11.485 2.973 -1.912
298 HB3 MET 42 HB3 MET 42 -10.344 4.296 -2.061
299 HG2 MET 42 HG2 MET 42 -11.631 5.128 -4.036
300 HG3 MET 42 HG3 MET 42 -12.787 3.814 -3.804
301 HE1 MET 42 HE1 MET 42 -10.951 6.521 -1.442
302 HE2 MET 42 HE2 MET 42 -11.607 7.305 -2.895
303 HE3 MET 42 HE3 MET 42 -12.308 7.658 -1.305
304 H ASP 43 H ASP 43 -10.950 3.041 -6.078
305 HA ASP 43 HA ASP 43 -12.942 0.966 -6.119
306 HB2 ASP 43 HB2 ASP 43 -11.525 2.621 -8.243
307 HB3 ASP 43 HB3 ASP 43 -12.598 1.292 -8.694
308 H ASP 44 H ASP 44 -9.597 1.127 -7.515
309 HA ASP 44 HA ASP 44 -9.701 -1.570 -8.506
310 HB2 ASP 44 HB2 ASP 44 -7.471 0.430 -8.048
311 HB3 ASP 44 HB3 ASP 44 -7.085 -1.261 -8.400
312 H LEU 45 H LEU 45 -8.525 -0.100 -5.540
313 HA LEU 45 HA LEU 45 -7.439 -2.468 -4.374
314 HB2 LEU 45 HB2 LEU 45 -8.705 -0.105 -2.952
315 HB3 LEU 45 HB3 LEU 45 -7.581 -1.276 -2.243
316 HG LEU 45 HG LEU 45 -6.835 0.527 -4.571
317 HD11 LEU 45 HD11 LEU 45 -5.719 1.943 -2.925
318 HD12 LEU 45 HD12 LEU 45 -6.497 1.058 -1.595
319 HD13 LEU 45 HD13 LEU 45 -7.452 1.969 -2.763
320 HD21 LEU 45 HD21 LEU 45 -5.092 -1.071 -2.697
321 HD22 LEU 45 HD22 LEU 45 -4.560 0.055 -3.979
322 HD23 LEU 45 HD23 LEU 45 -5.433 -1.419 -4.396
323 H ALA 46 H ALA 46 -10.786 -1.184 -4.471
324 HA ALA 46 HA ALA 46 -11.900 -3.125 -2.670
325 HB1 ALA 46 HB1 ALA 46 -14.071 -2.687 -3.791
326 HB2 ALA 46 HB2 ALA 46 -13.243 -1.180 -3.395
327 HB3 ALA 46 HB3 ALA 46 -13.257 -1.774 -5.058
328 H SER 47 H SER 47 -11.595 -3.077 -6.250
329 HA SER 47 HA SER 47 -12.635 -5.633 -6.776
330 HB2 SER 47 HB2 SER 47 -12.032 -3.631 -8.309
331 HB3 SER 47 HB3 SER 47 -10.427 -4.375 -8.410
332 HG SER 47 HG SER 47 -12.106 -4.963 -10.024
333 H LEU 48 H LEU 48 -9.474 -4.762 -5.517
334 HA LEU 48 HA LEU 48 -8.306 -7.375 -6.130
335 HB2 LEU 48 HB2 LEU 48 -7.331 -4.908 -4.679
336 HB3 LEU 48 HB3 LEU 48 -6.391 -6.395 -4.700
337 HG LEU 48 HG LEU 48 -7.372 -5.091 -7.276
338 HD11 LEU 48 HD11 LEU 48 -5.942 -3.486 -6.037
339 HD12 LEU 48 HD12 LEU 48 -5.198 -4.056 -7.535
340 HD13 LEU 48 HD13 LEU 48 -4.652 -4.719 -5.973
341 HD21 LEU 48 HD21 LEU 48 -6.674 -7.430 -7.522
342 HD22 LEU 48 HD22 LEU 48 -5.139 -7.082 -6.683
343 HD23 LEU 48 HD23 LEU 48 -5.495 -6.363 -8.277
344 H LYS 49 H LYS 49 -10.762 -7.062 -4.386
345 HA LYS 49 HA LYS 49 -11.783 -8.103 -2.708
346 HB2 LYS 49 HB2 LYS 49 -9.466 -10.046 -2.522
347 HB3 LYS 49 HB3 LYS 49 -11.096 -10.251 -1.940
348 HG2 LYS 49 HG2 LYS 49 -10.895 -11.603 -3.827
349 HG3 LYS 49 HG3 LYS 49 -11.913 -10.257 -4.324
350 HD2 LYS 49 HD2 LYS 49 -10.383 -9.481 -5.825
351 HD3 LYS 49 HD3 LYS 49 -8.984 -9.914 -4.849
352 HE2 LYS 49 HE2 LYS 49 -10.608 -11.913 -6.426
353 HE3 LYS 49 HE3 LYS 49 -9.180 -11.074 -7.042
354 HZ1 LYS 49 HZ1 LYS 49 -8.540 -13.176 -6.168
355 HZ2 LYS 49 HZ2 LYS 49 -9.239 -12.885 -4.717
356 HZ3 LYS 49 HZ3 LYS 49 -7.918 -11.985 -5.212
357 H ILE 50 H ILE 50 -9.878 -5.879 -2.102
358 HA ILE 50 HA ILE 50 -8.876 -6.444 0.609
359 HB ILE 50 HB ILE 50 -9.001 -3.794 -0.838
360 HG12 ILE 50 HG12 ILE 50 -7.838 -5.399 -2.355
361 HG13 ILE 50 HG13 ILE 50 -6.800 -4.168 -1.732
362 HG21 ILE 50 HG21 ILE 50 -7.162 -3.216 0.620
363 HG22 ILE 50 HG22 ILE 50 -8.484 -3.867 1.611
364 HG23 ILE 50 HG23 ILE 50 -7.090 -4.876 1.245
365 HD11 ILE 50 HD11 ILE 50 -5.779 -6.453 -1.826
366 HD12 ILE 50 HD12 ILE 50 -5.766 -5.812 -0.182
367 HD13 ILE 50 HD13 ILE 50 -6.982 -7.021 -0.661
368 HA PRO 51 HA PRO 51 -13.092 -5.262 1.910
369 HB2 PRO 51 HB2 PRO 51 -12.874 -5.674 4.603
370 HB3 PRO 51 HB3 PRO 51 -12.997 -7.024 3.433
371 HG2 PRO 51 HG2 PRO 51 -10.483 -5.877 4.688
372 HG3 PRO 51 HG3 PRO 51 -10.966 -7.598 4.557
373 HD2 PRO 51 HD2 PRO 51 -9.265 -6.447 2.768
374 HD3 PRO 51 HD3 PRO 51 -10.481 -7.661 2.259
375 H GLU 52 H GLU 52 -13.940 -3.299 2.808
376 HA GLU 52 HA GLU 52 -12.276 -1.070 2.833
377 HB2 GLU 52 HB2 GLU 52 -14.110 0.172 3.731
378 HB3 GLU 52 HB3 GLU 52 -14.609 -0.869 2.404
379 HG2 GLU 52 HG2 GLU 52 -15.901 -2.235 3.748
380 HG3 GLU 52 HG3 GLU 52 -14.922 -1.990 5.194
381 H GLN 53 H GLN 53 -13.102 -3.151 5.471
382 HA GLN 53 HA GLN 53 -12.452 -1.729 7.757
383 HB2 GLN 53 HB2 GLN 53 -11.974 -4.687 7.205
384 HB3 GLN 53 HB3 GLN 53 -12.159 -3.947 8.797
385 HG2 GLN 53 HG2 GLN 53 -14.484 -3.302 8.252
386 HG3 GLN 53 HG3 GLN 53 -14.313 -4.003 6.646
387 HE21 GLN 53 HE21 GLN 53 -16.330 -4.795 8.534
388 HE22 GLN 53 HE22 GLN 53 -16.036 -6.443 9.002
389 H PHE 54 H PHE 54 -10.310 -2.848 5.314
390 HA PHE 54 HA PHE 54 -7.925 -2.070 6.920
391 HB2 PHE 54 HB2 PHE 54 -7.654 -4.399 6.804
392 HB3 PHE 54 HB3 PHE 54 -8.346 -4.505 5.187
393 HD1 PHE 54 HD1 PHE 54 -7.048 -4.355 3.281
394 HD2 PHE 54 HD2 PHE 54 -5.352 -3.167 7.047
395 HE1 PHE 54 HE1 PHE 54 -4.808 -4.040 2.175
396 HE2 PHE 54 HE2 PHE 54 -3.144 -2.833 5.964
397 HZ PHE 54 HZ PHE 54 -2.871 -3.277 3.533
398 H ARG 55 H ARG 55 -9.354 -2.437 3.596
399 HA ARG 55 HA ARG 55 -7.536 -1.115 2.068
400 HB2 ARG 55 HB2 ARG 55 -9.731 -2.159 1.379
401 HB3 ARG 55 HB3 ARG 55 -10.523 -0.683 1.929
402 HG2 ARG 55 HG2 ARG 55 -8.869 0.521 0.241
403 HG3 ARG 55 HG3 ARG 55 -8.706 -1.103 -0.414
404 HD2 ARG 55 HD2 ARG 55 -10.393 0.132 -1.653
405 HD3 ARG 55 HD3 ARG 55 -11.159 -1.204 -0.788
406 HE ARG 55 HE ARG 55 -11.229 1.260 0.735
407 HH11 ARG 55 HH11 ARG 55 -12.422 0.408 -2.469
408 HH12 ARG 55 HH12 ARG 55 -14.050 0.928 -2.127
409 HH21 ARG 55 HH21 ARG 55 -13.587 2.009 1.129
410 HH22 ARG 55 HH22 ARG 55 -14.626 1.832 -0.255
411 H HIS 56 H HIS 56 -10.167 0.616 3.921
412 HA HIS 56 HA HIS 56 -9.314 3.196 3.016
413 HB2 HIS 56 HB2 HIS 56 -11.544 2.695 4.028
414 HB3 HIS 56 HB3 HIS 56 -10.769 2.430 5.585
415 HD1 HIS 56 HD1 HIS 56 -9.141 5.443 4.225
416 HD2 HIS 56 HD2 HIS 56 -12.893 4.501 5.895
417 HE1 HIS 56 HE1 HIS 56 -10.141 7.635 5.026
418 H ALA 57 H ALA 57 -8.111 1.089 5.693
419 HA ALA 57 HA ALA 57 -6.712 3.137 7.035
420 HB1 ALA 57 HB1 ALA 57 -6.027 0.168 6.980
421 HB2 ALA 57 HB2 ALA 57 -5.644 1.340 8.231
422 HB3 ALA 57 HB3 ALA 57 -7.338 0.860 7.974
423 H ILE 58 H ILE 58 -5.602 0.659 4.648
424 HA ILE 58 HA ILE 58 -2.910 1.606 4.623
425 HB ILE 58 HB ILE 58 -3.195 -0.544 3.915
426 HG12 ILE 58 HG12 ILE 58 -2.420 -0.795 1.700
427 HG13 ILE 58 HG13 ILE 58 -3.230 0.660 1.131
428 HG21 ILE 58 HG21 ILE 58 -5.519 -0.768 3.438
429 HG22 ILE 58 HG22 ILE 58 -5.353 0.233 1.962
430 HG23 ILE 58 HG23 ILE 58 -4.621 -1.370 2.074
431 HD11 ILE 58 HD11 ILE 58 -1.516 2.071 1.879
432 HD12 ILE 58 HD12 ILE 58 -0.866 0.804 2.960
433 HD13 ILE 58 HD13 ILE 58 -0.724 0.695 1.187
434 H TRP 59 H TRP 59 -5.674 2.154 2.347
435 HA TRP 59 HA TRP 59 -4.185 3.947 0.776
436 HB2 TRP 59 HB2 TRP 59 -6.555 2.916 0.378
437 HB3 TRP 59 HB3 TRP 59 -7.127 4.434 1.071
438 HD1 TRP 59 HD1 TRP 59 -4.499 3.347 -1.572
439 HE1 TRP 59 HE1 TRP 59 -4.599 4.891 -3.609
440 HE3 TRP 59 HE3 TRP 59 -7.924 6.623 0.150
441 HZ2 TRP 59 HZ2 TRP 59 -6.277 7.090 -4.523
442 HZ3 TRP 59 HZ3 TRP 59 -8.885 8.397 -1.355
443 HH2 TRP 59 HH2 TRP 59 -8.047 8.609 -3.705
444 H LYS 60 H LYS 60 -6.173 4.697 3.699
445 HA LYS 60 HA LYS 60 -5.692 7.520 3.694
446 HB2 LYS 60 HB2 LYS 60 -7.342 6.499 5.162
447 HB3 LYS 60 HB3 LYS 60 -6.120 5.524 5.974
448 HG2 LYS 60 HG2 LYS 60 -6.111 8.543 6.110
449 HG3 LYS 60 HG3 LYS 60 -7.128 7.564 7.146
450 HD2 LYS 60 HD2 LYS 60 -4.891 6.300 7.758
451 HD3 LYS 60 HD3 LYS 60 -4.118 7.790 7.184
452 HE2 LYS 60 HE2 LYS 60 -5.545 9.095 8.745
453 HE3 LYS 60 HE3 LYS 60 -6.271 7.598 9.341
454 HZ1 LYS 60 HZ1 LYS 60 -3.375 8.199 9.517
455 HZ2 LYS 60 HZ2 LYS 60 -4.160 6.960 10.251
456 HZ3 LYS 60 HZ3 LYS 60 -4.468 8.522 10.695
457 H GLY 61 H GLY 61 -3.717 4.763 4.919
458 HA2 GLY 61 HA2 GLY 61 -1.817 6.232 6.285
459 HA3 GLY 61 HA3 GLY 61 -1.549 4.632 5.519
460 H ILE 62 H ILE 62 -1.740 5.135 2.847
461 HA ILE 62 HA ILE 62 0.807 6.461 2.464
462 HB ILE 62 HB ILE 62 0.223 4.515 1.324
463 HG12 ILE 62 HG12 ILE 62 0.770 6.940 -0.477
464 HG13 ILE 62 HG13 ILE 62 1.959 6.117 0.531
465 HG21 ILE 62 HG21 ILE 62 -1.701 6.031 -0.460
466 HG22 ILE 62 HG22 ILE 62 -1.222 4.343 -0.638
467 HG23 ILE 62 HG23 ILE 62 -2.151 4.831 0.775
468 HD11 ILE 62 HD11 ILE 62 0.603 5.032 -1.953
469 HD12 ILE 62 HD12 ILE 62 2.288 5.529 -1.774
470 HD13 ILE 62 HD13 ILE 62 1.715 4.098 -0.901
471 H LEU 63 H LEU 63 -2.597 7.220 1.623
472 HA LEU 63 HA LEU 63 -1.987 9.626 0.239
473 HB2 LEU 63 HB2 LEU 63 -4.405 8.611 1.723
474 HB3 LEU 63 HB3 LEU 63 -4.340 10.298 1.339
475 HG LEU 63 HG LEU 63 -5.553 8.890 -0.340
476 HD11 LEU 63 HD11 LEU 63 -4.695 11.162 -0.851
477 HD12 LEU 63 HD12 LEU 63 -4.702 10.083 -2.264
478 HD13 LEU 63 HD13 LEU 63 -3.179 10.427 -1.446
479 HD21 LEU 63 HD21 LEU 63 -4.044 6.937 -0.539
480 HD22 LEU 63 HD22 LEU 63 -2.764 7.982 -1.210
481 HD23 LEU 63 HD23 LEU 63 -4.259 7.741 -2.095
482 H ASP 64 H ASP 64 -2.032 8.860 3.595
483 HA ASP 64 HA ASP 64 -1.878 11.617 4.641
484 HB2 ASP 64 HB2 ASP 64 -2.797 9.870 6.064
485 HB3 ASP 64 HB3 ASP 64 -1.305 8.938 5.971
486 H HIS 65 H HIS 65 0.390 9.051 3.834
487 HA HIS 65 HA HIS 65 2.731 10.331 4.938
488 HB2 HIS 65 HB2 HIS 65 2.759 7.914 4.558
489 HB3 HIS 65 HB3 HIS 65 2.414 8.141 2.849
490 HD1 HIS 65 HD1 HIS 65 5.263 9.573 5.151
491 HD2 HIS 65 HD2 HIS 65 4.409 8.147 1.270
492 HE1 HIS 65 HE1 HIS 65 7.367 9.914 3.780
493 H ARG 66 H ARG 66 1.553 9.901 1.555
494 HA ARG 66 HA ARG 66 3.459 11.719 0.466
495 HB2 ARG 66 HB2 ARG 66 2.170 11.613 -1.583
496 HB3 ARG 66 HB3 ARG 66 2.361 10.013 -0.873
497 HG2 ARG 66 HG2 ARG 66 0.136 9.792 -1.253
498 HG3 ARG 66 HG3 ARG 66 -0.027 10.723 0.229
499 HD2 ARG 66 HD2 ARG 66 -1.433 11.860 -1.157
500 HD3 ARG 66 HD3 ARG 66 0.045 12.827 -1.301
501 HE ARG 66 HE ARG 66 0.259 10.907 -3.318
502 HH11 ARG 66 HH11 ARG 66 -2.257 13.328 -2.589
503 HH12 ARG 66 HH12 ARG 66 -2.952 13.147 -4.182
504 HH21 ARG 66 HH21 ARG 66 -0.330 11.114 -5.368
505 HH22 ARG 66 HH22 ARG 66 -1.767 11.985 -5.865
506 H GLN 67 H GLN 67 0.228 12.306 1.963
507 HA GLN 67 HA GLN 67 0.135 15.034 0.999
508 HB2 GLN 67 HB2 GLN 67 -1.900 14.032 1.685
509 HB3 GLN 67 HB3 GLN 67 -1.249 13.561 3.271
510 HG2 GLN 67 HG2 GLN 67 -1.366 15.681 4.137
511 HG3 GLN 67 HG3 GLN 67 -1.399 16.475 2.550
512 HE21 GLN 67 HE21 GLN 67 -3.304 16.790 1.492
513 HE22 GLN 67 HE22 GLN 67 -4.869 16.162 1.981
514 H LEU 68 H LEU 68 1.641 13.453 3.822
515 HA LEU 68 HA LEU 68 2.390 16.071 4.941
516 HB2 LEU 68 HB2 LEU 68 2.646 13.246 5.941
517 HB3 LEU 68 HB3 LEU 68 3.308 14.636 6.797
518 HG LEU 68 HG LEU 68 0.338 14.315 6.167
519 HD11 LEU 68 HD11 LEU 68 0.887 12.582 7.668
520 HD12 LEU 68 HD12 LEU 68 0.291 13.878 8.697
521 HD13 LEU 68 HD13 LEU 68 2.037 13.577 8.576
522 HD21 LEU 68 HD21 LEU 68 0.949 16.662 6.517
523 HD22 LEU 68 HD22 LEU 68 1.798 16.254 8.014
524 HD23 LEU 68 HD23 LEU 68 0.039 16.059 7.889
525 H HIS 69 H HIS 69 3.715 14.009 2.629
526 HA HIS 69 HA HIS 69 6.381 15.200 3.038
527 HB2 HIS 69 HB2 HIS 69 6.304 12.808 3.946
528 HB3 HIS 69 HB3 HIS 69 6.065 12.270 2.289
529 HD1 HIS 69 HD1 HIS 69 8.357 12.399 0.694
530 HD2 HIS 69 HD2 HIS 69 8.635 14.095 4.562
531 HE1 HIS 69 HE1 HIS 69 10.775 12.964 1.051
532 H ASP 70 H ASP 70 6.852 13.191 0.607
533 HA ASP 70 HA ASP 70 5.475 14.303 -1.624
534 HB2 ASP 70 HB2 ASP 70 6.969 15.811 -2.326
535 HB3 ASP 70 HB3 ASP 70 7.682 15.809 -0.738
Start of MODEL 14
1 H1 GLY 1 H GLY 1 17.705 -22.327 1.325
2 HA2 GLY 1 HA2 GLY 1 15.211 -22.836 2.841
3 HA3 GLY 1 HA3 GLY 1 16.448 -21.666 3.357
4 HA PRO 2 HA PRO 2 13.999 -20.101 -0.556
5 HB2 PRO 2 HB2 PRO 2 11.320 -19.840 0.083
6 HB3 PRO 2 HB3 PRO 2 12.018 -21.236 -0.784
7 HG2 PRO 2 HG2 PRO 2 11.372 -20.973 2.153
8 HG3 PRO 2 HG3 PRO 2 11.052 -22.364 1.071
9 HD2 PRO 2 HD2 PRO 2 13.184 -22.292 2.778
10 HD3 PRO 2 HD3 PRO 2 13.304 -23.068 1.173
11 H LEU 3 H LEU 3 14.487 -17.992 -0.503
12 HA LEU 3 HA LEU 3 13.300 -16.069 1.234
13 HB2 LEU 3 HB2 LEU 3 15.272 -15.221 2.305
14 HB3 LEU 3 HB3 LEU 3 14.894 -16.831 2.853
15 HG LEU 3 HG LEU 3 16.729 -17.506 0.980
16 HD11 LEU 3 HD11 LEU 3 18.587 -15.878 1.007
17 HD12 LEU 3 HD12 LEU 3 17.598 -14.733 1.926
18 HD13 LEU 3 HD13 LEU 3 17.176 -15.143 0.262
19 HD21 LEU 3 HD21 LEU 3 18.400 -17.578 2.774
20 HD22 LEU 3 HD22 LEU 3 16.825 -18.113 3.355
21 HD23 LEU 3 HD23 LEU 3 17.422 -16.491 3.773
22 H GLY 4 H GLY 4 13.811 -13.910 0.459
23 HA2 GLY 4 HA2 GLY 4 15.667 -13.429 -1.655
24 HA3 GLY 4 HA3 GLY 4 13.978 -13.521 -2.218
25 H SER 5 H SER 5 15.027 -11.083 -2.521
26 HA SER 5 HA SER 5 13.703 -9.452 -0.459
27 HB2 SER 5 HB2 SER 5 16.144 -9.758 0.073
28 HB3 SER 5 HB3 SER 5 16.539 -8.969 -1.466
29 HG SER 5 HG SER 5 16.501 -7.533 0.362
30 H THR 6 H THR 6 14.112 -7.043 -1.366
31 HA THR 6 HA THR 6 14.040 -6.652 -4.183
32 HB THR 6 HB THR 6 11.799 -7.630 -3.807
33 HG1 THR 6 HG1 THR 6 10.909 -6.359 -5.123
34 HG21 THR 6 HG21 THR 6 11.189 -5.130 -2.167
35 HG22 THR 6 HG22 THR 6 11.242 -6.805 -1.556
36 HG23 THR 6 HG23 THR 6 10.017 -6.331 -2.737
37 H ASP 7 H ASP 7 14.038 -4.372 -4.606
38 HA ASP 7 HA ASP 7 15.456 -2.778 -2.741
39 HB2 ASP 7 HB2 ASP 7 13.855 -1.950 -5.215
40 HB3 ASP 7 HB3 ASP 7 14.952 -0.901 -4.320
41 H CYS 8 H CYS 8 12.151 -2.455 -4.047
42 HA CYS 8 HA CYS 8 11.130 -1.305 -1.524
43 HB2 CYS 8 HB2 CYS 8 11.874 0.423 -3.268
44 HB3 CYS 8 HB3 CYS 8 10.612 -0.243 -4.323
45 HG CYS 8 HG CYS 8 10.480 1.313 -1.397
46 H SER 9 H SER 9 8.845 -1.614 -1.252
47 HA SER 9 HA SER 9 6.977 -2.712 -2.977
48 HB2 SER 9 HB2 SER 9 8.234 -4.734 -3.119
49 HB3 SER 9 HB3 SER 9 8.636 -4.711 -1.404
50 HG SER 9 HG SER 9 7.090 -6.263 -2.023
51 H ILE 10 H ILE 10 4.989 -3.184 -1.612
52 HA ILE 10 HA ILE 10 4.621 -1.273 0.439
53 HB ILE 10 HB ILE 10 2.916 -3.700 -0.284
54 HG12 ILE 10 HG12 ILE 10 2.489 -0.841 -1.153
55 HG13 ILE 10 HG13 ILE 10 3.274 -2.102 -2.092
56 HG21 ILE 10 HG21 ILE 10 1.036 -2.503 0.806
57 HG22 ILE 10 HG22 ILE 10 2.278 -2.975 1.920
58 HG23 ILE 10 HG23 ILE 10 2.192 -1.277 1.382
59 HD11 ILE 10 HD11 ILE 10 1.031 -2.156 -2.839
60 HD12 ILE 10 HD12 ILE 10 1.184 -3.535 -1.756
61 HD13 ILE 10 HD13 ILE 10 0.379 -2.055 -1.205
62 H VAL 11 H VAL 11 5.885 -4.507 0.515
63 HA VAL 11 HA VAL 11 5.178 -5.352 3.099
64 HB VAL 11 HB VAL 11 7.330 -6.506 3.207
65 HG11 VAL 11 HG11 VAL 11 6.816 -8.082 1.383
66 HG12 VAL 11 HG12 VAL 11 5.311 -7.462 2.070
67 HG13 VAL 11 HG13 VAL 11 5.894 -6.824 0.521
68 HG21 VAL 11 HG21 VAL 11 7.976 -5.197 0.564
69 HG22 VAL 11 HG22 VAL 11 8.927 -5.160 2.052
70 HG23 VAL 11 HG23 VAL 11 8.778 -6.667 1.164
71 H SER 12 H SER 12 7.935 -3.208 2.297
72 HA SER 12 HA SER 12 8.716 -2.875 5.037
73 HB2 SER 12 HB2 SER 12 10.062 -2.412 2.913
74 HB3 SER 12 HB3 SER 12 9.147 -0.901 2.777
75 HG SER 12 HG SER 12 10.951 -0.398 3.892
76 H PHE 13 H PHE 13 6.417 -1.082 2.904
77 HA PHE 13 HA PHE 13 6.003 1.067 4.763
78 HB2 PHE 13 HB2 PHE 13 5.281 1.134 2.412
79 HB3 PHE 13 HB3 PHE 13 4.088 -0.122 2.714
80 HD1 PHE 13 HD1 PHE 13 1.952 0.829 2.470
81 HD2 PHE 13 HD2 PHE 13 4.985 3.042 4.611
82 HE1 PHE 13 HE1 PHE 13 0.329 2.685 2.880
83 HE2 PHE 13 HE2 PHE 13 3.389 4.868 4.968
84 HZ PHE 13 HZ PHE 13 1.083 4.709 4.134
85 H PHE 14 H PHE 14 4.409 -2.075 4.312
86 HA PHE 14 HA PHE 14 2.468 -1.777 6.382
87 HB2 PHE 14 HB2 PHE 14 3.602 -4.059 4.776
88 HB3 PHE 14 HB3 PHE 14 2.641 -4.418 6.187
89 HD1 PHE 14 HD1 PHE 14 1.124 -5.557 4.520
90 HD2 PHE 14 HD2 PHE 14 1.707 -1.276 4.414
91 HE1 PHE 14 HE1 PHE 14 -0.884 -5.294 3.091
92 HE2 PHE 14 HE2 PHE 14 -0.280 -1.020 3.035
93 HZ PHE 14 HZ PHE 14 -1.610 -3.039 2.381
94 H ALA 15 H ALA 15 5.827 -2.906 6.432
95 HA ALA 15 HA ALA 15 5.776 -3.822 9.131
96 HB1 ALA 15 HB1 ALA 15 7.649 -4.294 7.552
97 HB2 ALA 15 HB2 ALA 15 8.144 -2.583 7.656
98 HB3 ALA 15 HB3 ALA 15 8.202 -3.616 9.092
99 H ARG 16 H ARG 16 6.223 -0.570 7.708
100 HA ARG 16 HA ARG 16 6.697 0.704 10.310
101 HB2 ARG 16 HB2 ARG 16 5.943 1.885 7.580
102 HB3 ARG 16 HB3 ARG 16 6.260 2.818 9.040
103 HG2 ARG 16 HG2 ARG 16 8.519 1.532 9.144
104 HG3 ARG 16 HG3 ARG 16 8.195 1.065 7.483
105 HD2 ARG 16 HD2 ARG 16 9.650 3.018 7.555
106 HD3 ARG 16 HD3 ARG 16 8.094 3.427 6.797
107 HE ARG 16 HE ARG 16 8.035 3.975 9.601
108 HH11 ARG 16 HH11 ARG 16 9.639 5.280 6.714
109 HH12 ARG 16 HH12 ARG 16 9.485 6.944 7.197
110 HH21 ARG 16 HH21 ARG 16 7.806 6.170 10.246
111 HH22 ARG 16 HH22 ARG 16 8.449 7.451 9.281
112 H LEU 17 H LEU 17 3.872 0.112 8.311
113 HA LEU 17 HA LEU 17 2.065 1.814 9.868
114 HB2 LEU 17 HB2 LEU 17 1.462 -0.541 8.018
115 HB3 LEU 17 HB3 LEU 17 0.234 0.424 8.816
116 HG LEU 17 HG LEU 17 2.123 1.361 6.642
117 HD11 LEU 17 HD11 LEU 17 0.007 1.698 5.410
118 HD12 LEU 17 HD12 LEU 17 -0.910 1.084 6.801
119 HD13 LEU 17 HD13 LEU 17 0.194 0.012 5.913
120 HD21 LEU 17 HD21 LEU 17 0.142 2.944 8.320
121 HD22 LEU 17 HD22 LEU 17 0.821 3.514 6.763
122 HD23 LEU 17 HD23 LEU 17 1.888 3.239 8.140
123 H GLY 18 H GLY 18 2.885 -1.672 9.940
124 HA2 GLY 18 HA2 GLY 18 2.965 -2.781 12.044
125 HA3 GLY 18 HA3 GLY 18 1.476 -1.964 12.533
126 H CYS 19 H CYS 19 1.339 -2.800 9.205
127 HA CYS 19 HA CYS 19 -0.781 -4.700 9.686
128 HB2 CYS 19 HB2 CYS 19 0.788 -4.317 7.121
129 HB3 CYS 19 HB3 CYS 19 -0.838 -4.981 7.265
130 HG CYS 19 HG CYS 19 -0.680 -2.553 6.108
131 H SER 20 H SER 20 -0.693 -6.962 9.652
132 HA SER 20 HA SER 20 2.020 -8.192 9.379
133 HB2 SER 20 HB2 SER 20 1.239 -9.795 11.096
134 HB3 SER 20 HB3 SER 20 1.407 -8.115 11.624
135 HG SER 20 HG SER 20 -0.975 -7.978 11.255
136 H SER 21 H SER 21 -1.137 -9.834 9.640
137 HA SER 21 HA SER 21 -0.606 -11.753 7.732
138 HB2 SER 21 HB2 SER 21 -3.448 -10.875 8.063
139 HB3 SER 21 HB3 SER 21 -2.734 -12.490 8.185
140 HG SER 21 HG SER 21 -1.786 -11.748 10.208
141 H CYS 22 H CYS 22 -1.799 -8.469 7.172
142 HA CYS 22 HA CYS 22 -2.825 -9.033 4.551
143 HB2 CYS 22 HB2 CYS 22 -1.937 -6.329 5.635
144 HB3 CYS 22 HB3 CYS 22 -3.030 -6.662 4.277
145 HG CYS 22 HG CYS 22 -4.533 -5.828 6.167
146 H LEU 23 H LEU 23 0.482 -8.353 5.705
147 HA LEU 23 HA LEU 23 1.381 -7.522 3.086
148 HB2 LEU 23 HB2 LEU 23 3.447 -7.254 3.973
149 HB3 LEU 23 HB3 LEU 23 2.469 -7.068 5.408
150 HG LEU 23 HG LEU 23 3.009 -9.658 5.750
151 HD11 LEU 23 HD11 LEU 23 4.258 -9.920 3.569
152 HD12 LEU 23 HD12 LEU 23 5.250 -10.257 4.984
153 HD13 LEU 23 HD13 LEU 23 5.427 -8.710 4.140
154 HD21 LEU 23 HD21 LEU 23 4.964 -8.981 7.092
155 HD22 LEU 23 HD22 LEU 23 3.629 -7.845 7.289
156 HD23 LEU 23 HD23 LEU 23 5.009 -7.415 6.255
157 H ASP 24 H ASP 24 1.187 -10.534 4.940
158 HA ASP 24 HA ASP 24 2.420 -12.329 3.166
159 HB2 ASP 24 HB2 ASP 24 1.825 -12.681 5.539
160 HB3 ASP 24 HB3 ASP 24 0.127 -12.713 5.115
161 H TYR 25 H TYR 25 -0.999 -11.255 3.398
162 HA TYR 25 HA TYR 25 -2.006 -12.848 1.274
163 HB2 TYR 25 HB2 TYR 25 -2.902 -10.039 2.036
164 HB3 TYR 25 HB3 TYR 25 -3.815 -11.191 1.085
165 HD1 TYR 25 HD1 TYR 25 -4.870 -9.723 3.431
166 HD2 TYR 25 HD2 TYR 25 -2.946 -13.589 3.211
167 HE1 TYR 25 HE1 TYR 25 -6.045 -10.427 5.489
168 HE2 TYR 25 HE2 TYR 25 -4.147 -14.299 5.240
169 HH TYR 25 HH TYR 25 -5.537 -13.616 7.039
170 H PHE 26 H PHE 26 -0.714 -9.458 1.201
171 HA PHE 26 HA PHE 26 -0.903 -9.023 -1.574
172 HB2 PHE 26 HB2 PHE 26 0.444 -7.833 0.792
173 HB3 PHE 26 HB3 PHE 26 1.305 -7.599 -0.686
174 HD1 PHE 26 HD1 PHE 26 0.333 -6.244 -2.554
175 HD2 PHE 26 HD2 PHE 26 -1.784 -6.817 1.156
176 HE1 PHE 26 HE1 PHE 26 -1.028 -4.281 -3.069
177 HE2 PHE 26 HE2 PHE 26 -3.227 -4.926 0.616
178 HZ PHE 26 HZ PHE 26 -2.858 -3.602 -1.485
179 H THR 27 H THR 27 1.974 -10.292 0.296
180 HA THR 27 HA THR 27 3.669 -10.409 -1.983
181 HB THR 27 HB THR 27 5.030 -11.943 -0.568
182 HG1 THR 27 HG1 THR 27 4.327 -12.676 1.282
183 HG21 THR 27 HG21 THR 27 4.026 -9.454 0.910
184 HG22 THR 27 HG22 THR 27 5.342 -9.523 -0.282
185 HG23 THR 27 HG23 THR 27 5.491 -10.351 1.278
186 H THR 28 H THR 28 1.377 -12.759 -0.566
187 HA THR 28 HA THR 28 2.078 -14.917 -2.301
188 HB THR 28 HB THR 28 -0.612 -14.397 -0.979
189 HG1 THR 28 HG1 THR 28 1.006 -14.328 0.591
190 HG21 THR 28 HG21 THR 28 -0.691 -16.879 -0.904
191 HG22 THR 28 HG22 THR 28 0.839 -16.957 -1.788
192 HG23 THR 28 HG23 THR 28 -0.602 -16.301 -2.583
193 H GLN 29 H GLN 29 -0.219 -12.152 -2.704
194 HA GLN 29 HA GLN 29 -1.303 -13.209 -5.184
195 HB2 GLN 29 HB2 GLN 29 -1.379 -10.459 -3.895
196 HB3 GLN 29 HB3 GLN 29 -2.254 -10.896 -5.377
197 HG2 GLN 29 HG2 GLN 29 -2.656 -12.384 -2.786
198 HG3 GLN 29 HG3 GLN 29 -3.617 -10.975 -3.253
199 HE21 GLN 29 HE21 GLN 29 -3.266 -14.447 -3.616
200 HE22 GLN 29 HE22 GLN 29 -4.406 -14.591 -4.946
201 H GLY 30 H GLY 30 1.596 -11.482 -4.443
202 HA2 GLY 30 HA2 GLY 30 3.346 -10.821 -5.794
203 HA3 GLY 30 HA3 GLY 30 2.563 -11.644 -7.152
204 H LEU 31 H LEU 31 1.233 -9.000 -5.189
205 HA LEU 31 HA LEU 31 1.574 -7.087 -7.450
206 HB2 LEU 31 HB2 LEU 31 -0.860 -6.419 -6.985
207 HB3 LEU 31 HB3 LEU 31 -0.544 -7.910 -7.854
208 HG LEU 31 HG LEU 31 -0.962 -9.222 -5.850
209 HD11 LEU 31 HD11 LEU 31 -2.111 -8.088 -3.874
210 HD12 LEU 31 HD12 LEU 31 -1.442 -6.563 -4.496
211 HD13 LEU 31 HD13 LEU 31 -0.362 -7.882 -4.002
212 HD21 LEU 31 HD21 LEU 31 -3.364 -8.848 -5.716
213 HD22 LEU 31 HD22 LEU 31 -2.714 -8.833 -7.372
214 HD23 LEU 31 HD23 LEU 31 -3.143 -7.297 -6.587
215 H THR 32 H THR 32 2.866 -7.325 -4.671
216 HA THR 32 HA THR 32 1.788 -4.861 -3.404
217 HB THR 32 HB THR 32 2.310 -6.168 -1.686
218 HG1 THR 32 HG1 THR 32 4.983 -5.413 -1.978
219 HG21 THR 32 HG21 THR 32 3.119 -8.190 -2.846
220 HG22 THR 32 HG22 THR 32 4.089 -7.815 -1.421
221 HG23 THR 32 HG23 THR 32 4.711 -7.419 -3.035
222 H THR 33 H THR 33 2.416 -2.832 -4.072
223 HA THR 33 HA THR 33 5.217 -2.404 -4.519
224 HB THR 33 HB THR 33 4.954 -2.940 -6.671
225 HG1 THR 33 HG1 THR 33 4.534 -1.331 -8.006
226 HG21 THR 33 HG21 THR 33 1.895 -2.458 -6.524
227 HG22 THR 33 HG22 THR 33 2.755 -4.003 -6.684
228 HG23 THR 33 HG23 THR 33 2.781 -2.877 -8.005
229 H ILE 34 H ILE 34 5.650 -0.264 -4.303
230 HA ILE 34 HA ILE 34 3.650 1.239 -2.753
231 HB ILE 34 HB ILE 34 6.442 2.195 -3.468
232 HG12 ILE 34 HG12 ILE 34 5.441 0.183 -1.475
233 HG13 ILE 34 HG13 ILE 34 6.956 0.261 -2.369
234 HG21 ILE 34 HG21 ILE 34 4.852 3.961 -2.669
235 HG22 ILE 34 HG22 ILE 34 4.565 2.999 -1.205
236 HG23 ILE 34 HG23 ILE 34 6.161 3.673 -1.531
237 HD11 ILE 34 HD11 ILE 34 7.423 0.534 -0.021
238 HD12 ILE 34 HD12 ILE 34 7.678 2.112 -0.778
239 HD13 ILE 34 HD13 ILE 34 6.197 1.788 0.152
240 H TYR 35 H TYR 35 5.500 1.910 -5.613
241 HA TYR 35 HA TYR 35 4.428 4.355 -6.387
242 HB2 TYR 35 HB2 TYR 35 5.683 2.195 -8.116
243 HB3 TYR 35 HB3 TYR 35 5.705 3.943 -8.363
244 HD1 TYR 35 HD1 TYR 35 7.439 1.154 -6.808
245 HD2 TYR 35 HD2 TYR 35 6.694 5.385 -6.372
246 HE1 TYR 35 HE1 TYR 35 9.389 1.348 -5.327
247 HE2 TYR 35 HE2 TYR 35 8.732 5.595 -4.977
248 HH TYR 35 HH TYR 35 10.594 2.854 -3.795
249 H GLN 36 H GLN 36 3.026 1.313 -6.593
250 HA GLN 36 HA GLN 36 1.147 2.041 -8.788
251 HB2 GLN 36 HB2 GLN 36 1.644 -0.510 -7.208
252 HB3 GLN 36 HB3 GLN 36 0.211 -0.280 -8.202
253 HG2 GLN 36 HG2 GLN 36 1.893 0.512 -10.080
254 HG3 GLN 36 HG3 GLN 36 3.068 -0.357 -9.105
255 HE21 GLN 36 HE21 GLN 36 2.145 -0.985 -11.953
256 HE22 GLN 36 HE22 GLN 36 1.500 -2.595 -11.821
257 H ILE 37 H ILE 37 0.963 1.145 -5.247
258 HA ILE 37 HA ILE 37 -1.809 1.701 -5.064
259 HB ILE 37 HB ILE 37 -1.467 1.945 -2.673
260 HG12 ILE 37 HG12 ILE 37 1.465 1.383 -3.025
261 HG13 ILE 37 HG13 ILE 37 0.812 3.003 -2.748
262 HG21 ILE 37 HG21 ILE 37 -0.042 -0.451 -3.881
263 HG22 ILE 37 HG22 ILE 37 -0.779 -0.394 -2.274
264 HG23 ILE 37 HG23 ILE 37 -1.795 -0.276 -3.716
265 HD11 ILE 37 HD11 ILE 37 1.489 2.238 -0.661
266 HD12 ILE 37 HD12 ILE 37 -0.274 2.094 -0.643
267 HD13 ILE 37 HD13 ILE 37 0.732 0.641 -0.878
268 H GLU 38 H GLU 38 0.939 3.860 -5.123
269 HA GLU 38 HA GLU 38 -0.190 6.155 -3.943
270 HB2 GLU 38 HB2 GLU 38 1.944 5.605 -6.023
271 HB3 GLU 38 HB3 GLU 38 1.417 7.261 -5.759
272 HG2 GLU 38 HG2 GLU 38 1.868 7.016 -3.308
273 HG3 GLU 38 HG3 GLU 38 2.466 5.382 -3.589
274 H HIS 39 H HIS 39 -0.841 4.692 -7.097
275 HA HIS 39 HA HIS 39 -2.684 6.955 -7.736
276 HB2 HIS 39 HB2 HIS 39 -0.773 6.663 -9.251
277 HB3 HIS 39 HB3 HIS 39 -1.257 4.998 -9.559
278 HD1 HIS 39 HD1 HIS 39 -2.386 8.614 -10.356
279 HD2 HIS 39 HD2 HIS 39 -3.219 4.581 -11.283
280 HE1 HIS 39 HE1 HIS 39 -3.869 8.629 -12.432
281 H TYR 40 H TYR 40 -2.583 3.477 -7.061
282 HA TYR 40 HA TYR 40 -5.146 2.940 -8.327
283 HB2 TYR 40 HB2 TYR 40 -3.449 1.359 -6.353
284 HB3 TYR 40 HB3 TYR 40 -5.016 0.818 -6.896
285 HD1 TYR 40 HD1 TYR 40 -1.954 -0.453 -7.309
286 HD2 TYR 40 HD2 TYR 40 -4.937 1.549 -9.842
287 HE1 TYR 40 HE1 TYR 40 -1.248 -1.692 -9.247
288 HE2 TYR 40 HE2 TYR 40 -4.021 0.399 -11.781
289 HH TYR 40 HH TYR 40 -1.273 -1.891 -11.564
290 H SER 41 H SER 41 -6.889 3.995 -7.663
291 HA SER 41 HA SER 41 -7.257 5.016 -5.018
292 HB2 SER 41 HB2 SER 41 -9.225 4.806 -7.318
293 HB3 SER 41 HB3 SER 41 -9.290 5.926 -5.938
294 HG SER 41 HG SER 41 -6.969 6.389 -6.822
295 H MET 42 H MET 42 -9.632 4.655 -3.988
296 HA MET 42 HA MET 42 -9.637 2.124 -2.781
297 HB2 MET 42 HB2 MET 42 -11.982 4.018 -3.142
298 HB3 MET 42 HB3 MET 42 -11.953 2.650 -2.045
299 HG2 MET 42 HG2 MET 42 -9.987 4.958 -1.842
300 HG3 MET 42 HG3 MET 42 -11.537 4.878 -1.021
301 HE1 MET 42 HE1 MET 42 -9.394 4.525 2.009
302 HE2 MET 42 HE2 MET 42 -10.033 5.642 0.791
303 HE3 MET 42 HE3 MET 42 -11.140 4.595 1.687
304 H ASP 43 H ASP 43 -11.276 3.149 -5.750
305 HA ASP 43 HA ASP 43 -13.116 1.002 -6.055
306 HB2 ASP 43 HB2 ASP 43 -11.740 2.955 -7.922
307 HB3 ASP 43 HB3 ASP 43 -12.584 1.567 -8.607
308 H ASP 44 H ASP 44 -9.734 1.403 -7.144
309 HA ASP 44 HA ASP 44 -9.532 -1.148 -8.447
310 HB2 ASP 44 HB2 ASP 44 -7.494 0.854 -7.398
311 HB3 ASP 44 HB3 ASP 44 -6.995 -0.748 -7.940
312 H LEU 45 H LEU 45 -8.841 0.019 -5.153
313 HA LEU 45 HA LEU 45 -7.718 -2.427 -4.199
314 HB2 LEU 45 HB2 LEU 45 -9.313 -0.468 -2.506
315 HB3 LEU 45 HB3 LEU 45 -8.161 -1.681 -1.982
316 HG LEU 45 HG LEU 45 -7.714 1.052 -3.090
317 HD11 LEU 45 HD11 LEU 45 -6.328 -0.660 -0.985
318 HD12 LEU 45 HD12 LEU 45 -7.587 0.577 -0.712
319 HD13 LEU 45 HD13 LEU 45 -6.018 1.050 -1.325
320 HD21 LEU 45 HD21 LEU 45 -6.436 0.006 -4.778
321 HD22 LEU 45 HD22 LEU 45 -5.788 -1.220 -3.683
322 HD23 LEU 45 HD23 LEU 45 -5.292 0.511 -3.568
323 H ALA 46 H ALA 46 -11.096 -1.256 -4.250
324 HA ALA 46 HA ALA 46 -12.261 -3.468 -2.878
325 HB1 ALA 46 HB1 ALA 46 -13.434 -1.294 -3.372
326 HB2 ALA 46 HB2 ALA 46 -13.492 -1.737 -5.082
327 HB3 ALA 46 HB3 ALA 46 -14.370 -2.715 -3.893
328 H SER 47 H SER 47 -11.566 -2.858 -6.348
329 HA SER 47 HA SER 47 -12.668 -5.303 -7.249
330 HB2 SER 47 HB2 SER 47 -12.165 -3.294 -8.669
331 HB3 SER 47 HB3 SER 47 -10.434 -3.672 -8.547
332 HG SER 47 HG SER 47 -11.736 -4.565 -10.424
333 H LEU 48 H LEU 48 -9.415 -4.459 -6.117
334 HA LEU 48 HA LEU 48 -8.239 -7.030 -6.694
335 HB2 LEU 48 HB2 LEU 48 -7.399 -4.622 -5.049
336 HB3 LEU 48 HB3 LEU 48 -6.376 -6.038 -5.233
337 HG LEU 48 HG LEU 48 -7.422 -4.514 -7.648
338 HD11 LEU 48 HD11 LEU 48 -6.121 -2.972 -6.238
339 HD12 LEU 48 HD12 LEU 48 -5.267 -3.368 -7.735
340 HD13 LEU 48 HD13 LEU 48 -4.789 -4.144 -6.204
341 HD21 LEU 48 HD21 LEU 48 -5.123 -6.466 -7.281
342 HD22 LEU 48 HD22 LEU 48 -5.472 -5.577 -8.768
343 HD23 LEU 48 HD23 LEU 48 -6.629 -6.770 -8.166
344 H LYS 49 H LYS 49 -10.745 -6.942 -4.933
345 HA LYS 49 HA LYS 49 -11.649 -8.123 -3.313
346 HB2 LYS 49 HB2 LYS 49 -9.490 -9.728 -4.279
347 HB3 LYS 49 HB3 LYS 49 -9.343 -9.783 -2.538
348 HG2 LYS 49 HG2 LYS 49 -10.724 -11.558 -3.053
349 HG3 LYS 49 HG3 LYS 49 -11.876 -10.314 -2.529
350 HD2 LYS 49 HD2 LYS 49 -12.385 -9.793 -4.884
351 HD3 LYS 49 HD3 LYS 49 -11.170 -10.946 -5.443
352 HE2 LYS 49 HE2 LYS 49 -13.555 -11.707 -3.702
353 HE3 LYS 49 HE3 LYS 49 -13.562 -11.801 -5.467
354 HZ1 LYS 49 HZ1 LYS 49 -12.990 -13.921 -4.405
355 HZ2 LYS 49 HZ2 LYS 49 -11.629 -13.279 -3.755
356 HZ3 LYS 49 HZ3 LYS 49 -11.806 -13.379 -5.399
357 H ILE 50 H ILE 50 -9.565 -5.781 -2.651
358 HA ILE 50 HA ILE 50 -8.873 -6.500 0.076
359 HB ILE 50 HB ILE 50 -8.825 -3.689 -1.002
360 HG12 ILE 50 HG12 ILE 50 -7.572 -5.056 -2.656
361 HG13 ILE 50 HG13 ILE 50 -6.551 -3.959 -1.756
362 HG21 ILE 50 HG21 ILE 50 -8.424 -4.134 1.461
363 HG22 ILE 50 HG22 ILE 50 -7.139 -5.230 1.042
364 HG23 ILE 50 HG23 ILE 50 -6.967 -3.505 0.658
365 HD11 ILE 50 HD11 ILE 50 -6.809 -6.941 -1.175
366 HD12 ILE 50 HD12 ILE 50 -5.527 -6.166 -2.128
367 HD13 ILE 50 HD13 ILE 50 -5.659 -5.807 -0.416
368 HA PRO 51 HA PRO 51 -13.005 -5.415 1.555
369 HB2 PRO 51 HB2 PRO 51 -12.698 -5.936 4.238
370 HB3 PRO 51 HB3 PRO 51 -12.824 -7.244 3.025
371 HG2 PRO 51 HG2 PRO 51 -10.316 -6.083 4.254
372 HG3 PRO 51 HG3 PRO 51 -10.743 -7.807 4.026
373 HD2 PRO 51 HD2 PRO 51 -9.125 -6.452 2.286
374 HD3 PRO 51 HD3 PRO 51 -10.251 -7.720 1.728
375 H GLU 52 H GLU 52 -13.915 -3.536 2.397
376 HA GLU 52 HA GLU 52 -12.452 -1.198 2.479
377 HB2 GLU 52 HB2 GLU 52 -14.391 -0.108 3.323
378 HB3 GLU 52 HB3 GLU 52 -14.878 -1.363 2.182
379 HG2 GLU 52 HG2 GLU 52 -15.404 -2.875 4.137
380 HG3 GLU 52 HG3 GLU 52 -15.032 -1.531 5.228
381 H GLN 53 H GLN 53 -13.259 -3.245 5.229
382 HA GLN 53 HA GLN 53 -12.526 -1.712 7.382
383 HB2 GLN 53 HB2 GLN 53 -13.737 -3.832 7.410
384 HB3 GLN 53 HB3 GLN 53 -12.296 -4.714 6.893
385 HG2 GLN 53 HG2 GLN 53 -11.194 -4.297 8.997
386 HG3 GLN 53 HG3 GLN 53 -12.442 -3.142 9.489
387 HE21 GLN 53 HE21 GLN 53 -14.182 -3.921 10.615
388 HE22 GLN 53 HE22 GLN 53 -14.658 -5.595 10.747
389 H PHE 54 H PHE 54 -10.361 -3.260 5.095
390 HA PHE 54 HA PHE 54 -8.009 -2.393 6.739
391 HB2 PHE 54 HB2 PHE 54 -7.821 -4.665 6.746
392 HB3 PHE 54 HB3 PHE 54 -8.542 -4.865 5.147
393 HD1 PHE 54 HD1 PHE 54 -7.265 -5.076 3.251
394 HD2 PHE 54 HD2 PHE 54 -5.469 -3.451 6.820
395 HE1 PHE 54 HE1 PHE 54 -5.036 -5.119 2.149
396 HE2 PHE 54 HE2 PHE 54 -3.265 -3.413 5.688
397 HZ PHE 54 HZ PHE 54 -3.058 -4.285 3.356
398 H ARG 55 H ARG 55 -9.359 -2.658 3.391
399 HA ARG 55 HA ARG 55 -7.214 -1.492 2.060
400 HB2 ARG 55 HB2 ARG 55 -8.512 -1.515 0.252
401 HB3 ARG 55 HB3 ARG 55 -9.602 -2.432 1.273
402 HG2 ARG 55 HG2 ARG 55 -10.728 -0.206 1.833
403 HG3 ARG 55 HG3 ARG 55 -9.808 0.484 0.489
404 HD2 ARG 55 HD2 ARG 55 -10.880 -1.068 -1.079
405 HD3 ARG 55 HD3 ARG 55 -11.637 -1.935 0.270
406 HE ARG 55 HE ARG 55 -12.231 0.895 0.239
407 HH11 ARG 55 HH11 ARG 55 -13.327 -2.297 -0.815
408 HH12 ARG 55 HH12 ARG 55 -15.003 -1.873 -0.908
409 HH21 ARG 55 HH21 ARG 55 -14.395 1.574 -0.128
410 HH22 ARG 55 HH22 ARG 55 -15.616 0.421 -0.562
411 H HIS 56 H HIS 56 -9.812 0.156 3.923
412 HA HIS 56 HA HIS 56 -9.077 2.750 3.127
413 HB2 HIS 56 HB2 HIS 56 -11.169 1.923 4.388
414 HB3 HIS 56 HB3 HIS 56 -10.207 1.975 5.851
415 HD1 HIS 56 HD1 HIS 56 -12.539 4.050 3.932
416 HD2 HIS 56 HD2 HIS 56 -9.053 4.687 6.249
417 HE1 HIS 56 HE1 HIS 56 -12.506 6.514 4.544
418 H ALA 57 H ALA 57 -7.556 0.566 5.544
419 HA ALA 57 HA ALA 57 -6.087 2.661 6.875
420 HB1 ALA 57 HB1 ALA 57 -5.511 -0.330 6.727
421 HB2 ALA 57 HB2 ALA 57 -4.852 0.826 7.890
422 HB3 ALA 57 HB3 ALA 57 -6.582 0.435 7.924
423 H ILE 58 H ILE 58 -5.207 0.201 4.326
424 HA ILE 58 HA ILE 58 -2.532 1.178 4.103
425 HB ILE 58 HB ILE 58 -2.806 -0.927 3.277
426 HG12 ILE 58 HG12 ILE 58 -3.068 0.764 0.751
427 HG13 ILE 58 HG13 ILE 58 -1.583 0.702 1.695
428 HG21 ILE 58 HG21 ILE 58 -4.454 -1.823 1.754
429 HG22 ILE 58 HG22 ILE 58 -5.260 -1.071 3.092
430 HG23 ILE 58 HG23 ILE 58 -5.165 -0.227 1.516
431 HD11 ILE 58 HD11 ILE 58 -1.090 -1.472 0.976
432 HD12 ILE 58 HD12 ILE 58 -2.764 -1.809 0.476
433 HD13 ILE 58 HD13 ILE 58 -1.755 -0.680 -0.427
434 H TRP 59 H TRP 59 -5.470 1.815 2.151
435 HA TRP 59 HA TRP 59 -4.263 3.641 0.418
436 HB2 TRP 59 HB2 TRP 59 -6.602 2.516 0.337
437 HB3 TRP 59 HB3 TRP 59 -7.159 3.941 1.206
438 HD1 TRP 59 HD1 TRP 59 -5.169 2.996 -1.938
439 HE1 TRP 59 HE1 TRP 59 -5.510 4.709 -3.777
440 HE3 TRP 59 HE3 TRP 59 -7.914 6.363 0.692
441 HZ2 TRP 59 HZ2 TRP 59 -7.042 7.180 -4.142
442 HZ3 TRP 59 HZ3 TRP 59 -8.790 8.389 -0.412
443 HH2 TRP 59 HH2 TRP 59 -8.410 8.777 -2.845
444 H LYS 60 H LYS 60 -6.202 4.461 3.384
445 HA LYS 60 HA LYS 60 -5.779 7.232 3.197
446 HB2 LYS 60 HB2 LYS 60 -7.383 6.130 4.727
447 HB3 LYS 60 HB3 LYS 60 -6.034 5.528 5.717
448 HG2 LYS 60 HG2 LYS 60 -5.403 7.801 6.315
449 HG3 LYS 60 HG3 LYS 60 -6.634 8.455 5.201
450 HD2 LYS 60 HD2 LYS 60 -8.438 7.522 6.517
451 HD3 LYS 60 HD3 LYS 60 -7.302 6.660 7.564
452 HE2 LYS 60 HE2 LYS 60 -8.149 8.682 8.653
453 HE3 LYS 60 HE3 LYS 60 -6.400 8.763 8.413
454 HZ1 LYS 60 HZ1 LYS 60 -7.536 10.819 7.857
455 HZ2 LYS 60 HZ2 LYS 60 -8.382 10.083 6.654
456 HZ3 LYS 60 HZ3 LYS 60 -6.711 10.224 6.598
457 H GLY 61 H GLY 61 -3.672 4.678 4.569
458 HA2 GLY 61 HA2 GLY 61 -1.756 6.304 5.831
459 HA3 GLY 61 HA3 GLY 61 -1.462 4.681 5.139
460 H ILE 62 H ILE 62 -1.701 4.983 2.441
461 HA ILE 62 HA ILE 62 0.786 6.353 1.969
462 HB ILE 62 HB ILE 62 0.078 4.356 0.903
463 HG12 ILE 62 HG12 ILE 62 0.940 4.878 -1.419
464 HG13 ILE 62 HG13 ILE 62 0.876 6.593 -1.000
465 HG21 ILE 62 HG21 ILE 62 -1.301 4.274 -1.142
466 HG22 ILE 62 HG22 ILE 62 -2.227 4.717 0.281
467 HG23 ILE 62 HG23 ILE 62 -1.749 5.963 -0.899
468 HD11 ILE 62 HD11 ILE 62 2.506 4.468 0.456
469 HD12 ILE 62 HD12 ILE 62 3.144 5.569 -0.782
470 HD13 ILE 62 HD13 ILE 62 2.572 6.223 0.760
471 H LEU 63 H LEU 63 -2.597 7.144 1.219
472 HA LEU 63 HA LEU 63 -2.114 9.562 -0.191
473 HB2 LEU 63 HB2 LEU 63 -4.401 8.442 1.406
474 HB3 LEU 63 HB3 LEU 63 -4.440 10.141 1.008
475 HG LEU 63 HG LEU 63 -5.679 8.635 -0.550
476 HD11 LEU 63 HD11 LEU 63 -5.074 9.854 -2.548
477 HD12 LEU 63 HD12 LEU 63 -3.524 10.335 -1.841
478 HD13 LEU 63 HD13 LEU 63 -5.047 10.939 -1.144
479 HD21 LEU 63 HD21 LEU 63 -2.931 7.879 -1.633
480 HD22 LEU 63 HD22 LEU 63 -4.490 7.506 -2.367
481 HD23 LEU 63 HD23 LEU 63 -4.076 6.779 -0.816
482 H ASP 64 H ASP 64 -2.091 8.767 3.135
483 HA ASP 64 HA ASP 64 -2.057 11.476 4.264
484 HB2 ASP 64 HB2 ASP 64 -2.988 9.702 5.547
485 HB3 ASP 64 HB3 ASP 64 -1.510 8.744 5.472
486 H HIS 65 H HIS 65 0.292 9.108 3.188
487 HA HIS 65 HA HIS 65 2.578 10.256 4.508
488 HB2 HIS 65 HB2 HIS 65 2.694 7.957 3.878
489 HB3 HIS 65 HB3 HIS 65 2.260 8.282 2.213
490 HD1 HIS 65 HD1 HIS 65 5.196 9.506 4.433
491 HD2 HIS 65 HD2 HIS 65 4.189 8.061 0.610
492 HE1 HIS 65 HE1 HIS 65 7.405 9.337 3.085
493 H ARG 66 H ARG 66 1.352 10.403 1.104
494 HA ARG 66 HA ARG 66 3.325 12.506 0.577
495 HB2 ARG 66 HB2 ARG 66 2.242 13.076 -1.463
496 HB3 ARG 66 HB3 ARG 66 2.465 11.348 -1.336
497 HG2 ARG 66 HG2 ARG 66 -0.196 12.382 -0.382
498 HG3 ARG 66 HG3 ARG 66 0.139 12.575 -2.127
499 HD2 ARG 66 HD2 ARG 66 0.131 10.228 -0.348
500 HD3 ARG 66 HD3 ARG 66 -1.089 10.574 -1.571
501 HE ARG 66 HE ARG 66 1.574 9.377 -2.059
502 HH11 ARG 66 HH11 ARG 66 -1.161 11.139 -3.487
503 HH12 ARG 66 HH12 ARG 66 -0.609 10.944 -5.110
504 HH21 ARG 66 HH21 ARG 66 2.284 9.078 -4.281
505 HH22 ARG 66 HH22 ARG 66 1.368 9.830 -5.550
506 H GLN 67 H GLN 67 -0.029 12.553 1.828
507 HA GLN 67 HA GLN 67 -0.517 15.305 1.454
508 HB2 GLN 67 HB2 GLN 67 -2.286 13.943 2.192
509 HB3 GLN 67 HB3 GLN 67 -1.371 13.321 3.566
510 HG2 GLN 67 HG2 GLN 67 -3.148 14.882 4.213
511 HG3 GLN 67 HG3 GLN 67 -1.534 15.339 4.748
512 HE21 GLN 67 HE21 GLN 67 -1.719 17.602 4.874
513 HE22 GLN 67 HE22 GLN 67 -1.995 18.579 3.439
514 H LEU 68 H LEU 68 1.269 13.660 4.185
515 HA LEU 68 HA LEU 68 1.948 16.223 5.330
516 HB2 LEU 68 HB2 LEU 68 2.626 13.327 5.903
517 HB3 LEU 68 HB3 LEU 68 3.638 14.612 6.556
518 HG LEU 68 HG LEU 68 1.258 15.671 7.222
519 HD11 LEU 68 HD11 LEU 68 -0.298 14.001 8.073
520 HD12 LEU 68 HD12 LEU 68 0.717 12.689 7.392
521 HD13 LEU 68 HD13 LEU 68 -0.098 13.849 6.335
522 HD21 LEU 68 HD21 LEU 68 2.698 13.561 8.871
523 HD22 LEU 68 HD22 LEU 68 1.612 14.840 9.494
524 HD23 LEU 68 HD23 LEU 68 3.154 15.263 8.738
525 H HIS 69 H HIS 69 3.890 13.704 3.599
526 HA HIS 69 HA HIS 69 5.902 13.646 2.808
527 HB2 HIS 69 HB2 HIS 69 4.551 14.546 1.021
528 HB3 HIS 69 HB3 HIS 69 5.005 16.171 1.489
529 HD1 HIS 69 HD1 HIS 69 6.910 12.810 0.529
530 HD2 HIS 69 HD2 HIS 69 6.939 16.992 -0.183
531 HE1 HIS 69 HE1 HIS 69 8.696 13.229 -1.122
532 H ASP 70 H ASP 70 5.710 14.781 5.329
533 HA ASP 70 HA ASP 70 7.592 16.871 5.861
534 HB2 ASP 70 HB2 ASP 70 7.140 16.446 8.116
535 HB3 ASP 70 HB3 ASP 70 5.617 16.074 7.327
Start of MODEL 15
1 H1 GLY 1 H GLY 1 24.413 -3.536 -3.837
2 HA2 GLY 1 HA2 GLY 1 23.845 -1.188 -4.520
3 HA3 GLY 1 HA3 GLY 1 22.885 -1.132 -3.031
4 HA PRO 2 HA PRO 2 27.191 0.301 -1.946
5 HB2 PRO 2 HB2 PRO 2 26.511 2.591 -0.639
6 HB3 PRO 2 HB3 PRO 2 26.440 2.497 -2.426
7 HG2 PRO 2 HG2 PRO 2 24.156 2.116 -0.458
8 HG3 PRO 2 HG3 PRO 2 24.218 3.208 -1.883
9 HD2 PRO 2 HD2 PRO 2 23.124 0.709 -1.995
10 HD3 PRO 2 HD3 PRO 2 24.005 1.409 -3.388
11 H LEU 3 H LEU 3 27.729 1.221 0.576
12 HA LEU 3 HA LEU 3 27.175 -1.052 2.226
13 HB2 LEU 3 HB2 LEU 3 28.405 -0.063 3.903
14 HB3 LEU 3 HB3 LEU 3 29.196 0.503 2.449
15 HG LEU 3 HG LEU 3 27.236 2.129 4.164
16 HD11 LEU 3 HD11 LEU 3 29.199 3.310 4.983
17 HD12 LEU 3 HD12 LEU 3 30.270 2.257 4.018
18 HD13 LEU 3 HD13 LEU 3 29.310 1.590 5.358
19 HD21 LEU 3 HD21 LEU 3 28.153 4.084 2.910
20 HD22 LEU 3 HD22 LEU 3 27.262 2.981 1.863
21 HD23 LEU 3 HD23 LEU 3 29.041 2.980 1.853
22 H GLY 4 H GLY 4 25.890 -1.142 4.162
23 HA2 GLY 4 HA2 GLY 4 24.187 -0.464 5.623
24 HA3 GLY 4 HA3 GLY 4 23.870 0.958 4.637
25 H SER 5 H SER 5 21.947 -1.111 5.576
26 HA SER 5 HA SER 5 20.938 -2.060 2.920
27 HB2 SER 5 HB2 SER 5 20.420 -3.460 5.542
28 HB3 SER 5 HB3 SER 5 20.078 -3.983 3.878
29 HG SER 5 HG SER 5 22.398 -3.984 3.546
30 H THR 6 H THR 6 19.409 -0.741 2.325
31 HA THR 6 HA THR 6 17.104 -0.183 4.077
32 HB THR 6 HB THR 6 17.142 2.126 2.822
33 HG1 THR 6 HG1 THR 6 19.913 1.949 3.082
34 HG21 THR 6 HG21 THR 6 19.056 1.536 5.126
35 HG22 THR 6 HG22 THR 6 17.327 1.897 5.254
36 HG23 THR 6 HG23 THR 6 18.443 3.133 4.673
37 H ASP 7 H ASP 7 15.148 0.121 2.732
38 HA ASP 7 HA ASP 7 15.213 -0.365 -0.124
39 HB2 ASP 7 HB2 ASP 7 14.363 -2.549 1.836
40 HB3 ASP 7 HB3 ASP 7 13.662 -2.419 0.225
41 H CYS 8 H CYS 8 13.097 0.142 -0.962
42 HA CYS 8 HA CYS 8 11.044 0.906 1.058
43 HB2 CYS 8 HB2 CYS 8 11.939 2.612 -1.303
44 HB3 CYS 8 HB3 CYS 8 10.646 2.976 -0.149
45 HG CYS 8 HG CYS 8 13.909 2.714 0.337
46 H SER 9 H SER 9 10.078 -1.139 0.489
47 HA SER 9 HA SER 9 8.571 -1.170 -2.073
48 HB2 SER 9 HB2 SER 9 9.822 -3.413 -0.435
49 HB3 SER 9 HB3 SER 9 8.712 -3.684 -1.768
50 HG SER 9 HG SER 9 10.948 -3.846 -2.265
51 H ILE 10 H ILE 10 6.406 -2.474 -1.692
52 HA ILE 10 HA ILE 10 4.990 -1.252 0.391
53 HB ILE 10 HB ILE 10 4.475 -3.434 -1.478
54 HG12 ILE 10 HG12 ILE 10 3.955 -1.028 -1.716
55 HG13 ILE 10 HG13 ILE 10 2.569 -2.101 -2.030
56 HG21 ILE 10 HG21 ILE 10 2.222 -4.050 -0.536
57 HG22 ILE 10 HG22 ILE 10 3.617 -4.765 0.304
58 HG23 ILE 10 HG23 ILE 10 2.756 -3.386 1.006
59 HD11 ILE 10 HD11 ILE 10 1.393 -1.314 -0.267
60 HD12 ILE 10 HD12 ILE 10 2.829 -1.007 0.739
61 HD13 ILE 10 HD13 ILE 10 2.413 0.115 -0.567
62 H VAL 11 H VAL 11 6.837 -4.127 0.537
63 HA VAL 11 HA VAL 11 5.778 -5.252 2.923
64 HB VAL 11 HB VAL 11 8.204 -5.971 3.334
65 HG11 VAL 11 HG11 VAL 11 6.736 -6.668 0.730
66 HG12 VAL 11 HG12 VAL 11 7.965 -7.679 1.509
67 HG13 VAL 11 HG13 VAL 11 6.426 -7.375 2.324
68 HG21 VAL 11 HG21 VAL 11 8.619 -5.096 0.450
69 HG22 VAL 11 HG22 VAL 11 9.336 -4.274 1.863
70 HG23 VAL 11 HG23 VAL 11 9.753 -5.946 1.505
71 H SER 12 H SER 12 8.341 -2.722 2.669
72 HA SER 12 HA SER 12 8.608 -2.316 5.468
73 HB2 SER 12 HB2 SER 12 9.055 -0.539 3.035
74 HB3 SER 12 HB3 SER 12 9.619 -0.140 4.689
75 HG SER 12 HG SER 12 10.835 -2.047 4.661
76 H PHE 13 H PHE 13 6.420 -0.771 2.981
77 HA PHE 13 HA PHE 13 5.445 1.147 4.891
78 HB2 PHE 13 HB2 PHE 13 5.180 1.471 2.505
79 HB3 PHE 13 HB3 PHE 13 4.186 0.040 2.364
80 HD1 PHE 13 HD1 PHE 13 1.947 0.704 1.859
81 HD2 PHE 13 HD2 PHE 13 4.148 2.963 4.804
82 HE1 PHE 13 HE1 PHE 13 -0.061 2.094 2.329
83 HE2 PHE 13 HE2 PHE 13 2.119 4.278 5.301
84 HZ PHE 13 HZ PHE 13 0.008 3.809 4.080
85 H PHE 14 H PHE 14 4.274 -2.118 3.927
86 HA PHE 14 HA PHE 14 2.005 -2.121 5.633
87 HB2 PHE 14 HB2 PHE 14 3.643 -4.195 4.203
88 HB3 PHE 14 HB3 PHE 14 2.489 -4.719 5.370
89 HD1 PHE 14 HD1 PHE 14 1.046 -5.820 3.836
90 HD2 PHE 14 HD2 PHE 14 1.852 -1.635 3.249
91 HE1 PHE 14 HE1 PHE 14 -0.685 -5.735 2.082
92 HE2 PHE 14 HE2 PHE 14 0.108 -1.528 1.575
93 HZ PHE 14 HZ PHE 14 -1.141 -3.595 0.904
94 H ALA 15 H ALA 15 5.394 -3.021 6.250
95 HA ALA 15 HA ALA 15 4.994 -4.151 8.843
96 HB1 ALA 15 HB1 ALA 15 7.098 -4.423 7.566
97 HB2 ALA 15 HB2 ALA 15 7.418 -2.679 7.683
98 HB3 ALA 15 HB3 ALA 15 7.413 -3.677 9.144
99 H ARG 16 H ARG 16 5.683 -0.807 7.679
100 HA ARG 16 HA ARG 16 5.670 0.471 10.231
101 HB2 ARG 16 HB2 ARG 16 5.007 1.518 7.447
102 HB3 ARG 16 HB3 ARG 16 5.049 2.545 8.851
103 HG2 ARG 16 HG2 ARG 16 7.489 0.852 8.308
104 HG3 ARG 16 HG3 ARG 16 7.149 2.175 7.198
105 HD2 ARG 16 HD2 ARG 16 7.425 2.485 10.210
106 HD3 ARG 16 HD3 ARG 16 8.703 2.809 9.031
107 HE ARG 16 HE ARG 16 6.554 4.346 8.177
108 HH11 ARG 16 HH11 ARG 16 8.609 4.223 11.121
109 HH12 ARG 16 HH12 ARG 16 8.356 5.889 11.475
110 HH21 ARG 16 HH21 ARG 16 6.202 6.629 8.813
111 HH22 ARG 16 HH22 ARG 16 6.895 7.125 10.319
112 H LEU 17 H LEU 17 2.978 -0.305 7.980
113 HA LEU 17 HA LEU 17 0.938 1.112 9.446
114 HB2 LEU 17 HB2 LEU 17 0.677 -1.440 7.772
115 HB3 LEU 17 HB3 LEU 17 -0.676 -0.551 8.428
116 HG LEU 17 HG LEU 17 1.265 0.465 6.359
117 HD11 LEU 17 HD11 LEU 17 -0.281 -1.300 5.562
118 HD12 LEU 17 HD12 LEU 17 -0.575 0.265 4.796
119 HD13 LEU 17 HD13 LEU 17 -1.661 -0.313 6.091
120 HD21 LEU 17 HD21 LEU 17 0.449 2.376 7.657
121 HD22 LEU 17 HD22 LEU 17 -1.222 1.775 7.559
122 HD23 LEU 17 HD23 LEU 17 -0.389 2.358 6.107
123 H GLY 18 H GLY 18 2.198 -2.218 9.656
124 HA2 GLY 18 HA2 GLY 18 2.464 -3.390 11.666
125 HA3 GLY 18 HA3 GLY 18 1.070 -2.539 12.363
126 H CYS 19 H CYS 19 0.886 -3.723 8.998
127 HA CYS 19 HA CYS 19 -1.353 -5.391 9.865
128 HB2 CYS 19 HB2 CYS 19 -1.921 -5.655 7.594
129 HB3 CYS 19 HB3 CYS 19 -1.452 -3.960 7.837
130 HG CYS 19 HG CYS 19 1.129 -4.467 7.135
131 H SER 20 H SER 20 -1.548 -7.682 8.787
132 HA SER 20 HA SER 20 1.026 -9.153 8.938
133 HB2 SER 20 HB2 SER 20 -0.187 -10.904 10.278
134 HB3 SER 20 HB3 SER 20 0.188 -9.406 11.131
135 HG SER 20 HG SER 20 -1.887 -8.822 11.176
136 H SER 21 H SER 21 -2.250 -10.511 8.766
137 HA SER 21 HA SER 21 -1.800 -12.140 6.602
138 HB2 SER 21 HB2 SER 21 -4.426 -11.955 6.422
139 HB3 SER 21 HB3 SER 21 -3.627 -12.690 7.810
140 HG SER 21 HG SER 21 -5.161 -11.364 8.579
141 H CYS 22 H CYS 22 -2.617 -8.711 6.507
142 HA CYS 22 HA CYS 22 -3.432 -8.693 3.769
143 HB2 CYS 22 HB2 CYS 22 -2.139 -6.351 5.232
144 HB3 CYS 22 HB3 CYS 22 -3.345 -6.300 3.944
145 HG CYS 22 HG CYS 22 -5.225 -7.561 5.386
146 H LEU 23 H LEU 23 -0.205 -8.423 5.340
147 HA LEU 23 HA LEU 23 1.097 -7.690 2.874
148 HB2 LEU 23 HB2 LEU 23 2.981 -7.484 4.090
149 HB3 LEU 23 HB3 LEU 23 1.832 -7.354 5.389
150 HG LEU 23 HG LEU 23 2.297 -9.950 5.730
151 HD11 LEU 23 HD11 LEU 23 4.730 -9.038 4.145
152 HD12 LEU 23 HD12 LEU 23 3.682 -10.418 3.781
153 HD13 LEU 23 HD13 LEU 23 4.708 -10.466 5.205
154 HD21 LEU 23 HD21 LEU 23 4.145 -9.359 7.237
155 HD22 LEU 23 HD22 LEU 23 2.851 -8.162 7.332
156 HD23 LEU 23 HD23 LEU 23 4.334 -7.789 6.421
157 H ASP 24 H ASP 24 0.326 -10.640 4.583
158 HA ASP 24 HA ASP 24 1.826 -12.543 3.121
159 HB2 ASP 24 HB2 ASP 24 -0.590 -12.586 4.872
160 HB3 ASP 24 HB3 ASP 24 -0.433 -13.934 3.782
161 H TYR 25 H TYR 25 -1.552 -11.408 2.675
162 HA TYR 25 HA TYR 25 -1.956 -12.935 0.288
163 HB2 TYR 25 HB2 TYR 25 -3.326 -10.356 1.099
164 HB3 TYR 25 HB3 TYR 25 -3.901 -11.523 -0.087
165 HD1 TYR 25 HD1 TYR 25 -5.263 -10.404 2.475
166 HD2 TYR 25 HD2 TYR 25 -3.133 -14.093 1.712
167 HE1 TYR 25 HE1 TYR 25 -6.546 -11.521 4.240
168 HE2 TYR 25 HE2 TYR 25 -4.432 -15.206 3.455
169 HH TYR 25 HH TYR 25 -6.239 -15.000 5.029
170 H PHE 26 H PHE 26 -0.901 -9.444 0.696
171 HA PHE 26 HA PHE 26 -0.750 -8.926 -2.041
172 HB2 PHE 26 HB2 PHE 26 0.339 -7.760 0.437
173 HB3 PHE 26 HB3 PHE 26 1.378 -7.502 -0.917
174 HD1 PHE 26 HD1 PHE 26 0.619 -6.154 -2.918
175 HD2 PHE 26 HD2 PHE 26 -1.974 -6.850 0.447
176 HE1 PHE 26 HE1 PHE 26 -0.689 -4.175 -3.550
177 HE2 PHE 26 HE2 PHE 26 -3.332 -4.942 -0.212
178 HZ PHE 26 HZ PHE 26 -2.700 -3.547 -2.229
179 H THR 27 H THR 27 1.896 -10.342 0.009
180 HA THR 27 HA THR 27 3.696 -10.520 -2.196
181 HB THR 27 HB THR 27 4.529 -10.584 0.059
182 HG1 THR 27 HG1 THR 27 5.897 -12.356 0.002
183 HG21 THR 27 HG21 THR 27 3.162 -13.250 0.501
184 HG22 THR 27 HG22 THR 27 2.828 -11.740 1.315
185 HG23 THR 27 HG23 THR 27 4.353 -12.504 1.582
186 H THR 28 H THR 28 1.230 -12.783 -0.997
187 HA THR 28 HA THR 28 1.862 -14.966 -2.715
188 HB THR 28 HB THR 28 -0.752 -14.067 -1.411
189 HG1 THR 28 HG1 THR 28 0.807 -14.413 0.087
190 HG21 THR 28 HG21 THR 28 0.006 -16.770 -2.570
191 HG22 THR 28 HG22 THR 28 -1.294 -15.678 -3.093
192 HG23 THR 28 HG23 THR 28 -1.403 -16.455 -1.506
193 H GLN 29 H GLN 29 0.183 -11.904 -3.314
194 HA GLN 29 HA GLN 29 -0.907 -12.829 -5.891
195 HB2 GLN 29 HB2 GLN 29 -1.069 -10.181 -4.400
196 HB3 GLN 29 HB3 GLN 29 -1.864 -10.571 -5.945
197 HG2 GLN 29 HG2 GLN 29 -3.109 -12.388 -4.959
198 HG3 GLN 29 HG3 GLN 29 -2.377 -12.163 -3.405
199 HE21 GLN 29 HE21 GLN 29 -4.931 -12.226 -3.165
200 HE22 GLN 29 HE22 GLN 29 -5.706 -10.649 -3.155
201 H GLY 30 H GLY 30 1.865 -11.013 -4.621
202 HA2 GLY 30 HA2 GLY 30 3.820 -10.392 -5.720
203 HA3 GLY 30 HA3 GLY 30 3.234 -11.217 -7.176
204 H LEU 31 H LEU 31 1.562 -8.643 -5.430
205 HA LEU 31 HA LEU 31 2.058 -6.718 -7.666
206 HB2 LEU 31 HB2 LEU 31 -0.367 -6.073 -7.443
207 HB3 LEU 31 HB3 LEU 31 0.046 -7.546 -8.298
208 HG LEU 31 HG LEU 31 -0.539 -8.841 -6.229
209 HD11 LEU 31 HD11 LEU 31 -0.414 -7.221 -4.506
210 HD12 LEU 31 HD12 LEU 31 -2.095 -7.714 -4.608
211 HD13 LEU 31 HD13 LEU 31 -1.604 -6.158 -5.299
212 HD21 LEU 31 HD21 LEU 31 -1.993 -8.771 -8.099
213 HD22 LEU 31 HD22 LEU 31 -2.657 -7.204 -7.596
214 HD23 LEU 31 HD23 LEU 31 -2.962 -8.670 -6.621
215 H THR 32 H THR 32 3.192 -6.997 -4.971
216 HA THR 32 HA THR 32 2.058 -4.711 -3.485
217 HB THR 32 HB THR 32 2.927 -5.709 -1.723
218 HG1 THR 32 HG1 THR 32 5.413 -6.269 -2.921
219 HG21 THR 32 HG21 THR 32 3.532 -7.984 -1.689
220 HG22 THR 32 HG22 THR 32 4.023 -7.981 -3.398
221 HG23 THR 32 HG23 THR 32 2.318 -7.768 -2.953
222 H THR 33 H THR 33 2.602 -2.618 -3.997
223 HA THR 33 HA THR 33 5.323 -2.005 -4.309
224 HB THR 33 HB THR 33 5.358 -2.531 -6.494
225 HG1 THR 33 HG1 THR 33 5.404 -0.877 -7.644
226 HG21 THR 33 HG21 THR 33 3.439 -2.455 -8.137
227 HG22 THR 33 HG22 THR 33 2.335 -2.147 -6.764
228 HG23 THR 33 HG23 THR 33 3.277 -3.625 -6.867
229 H ILE 34 H ILE 34 5.743 0.198 -4.139
230 HA ILE 34 HA ILE 34 3.703 1.556 -2.530
231 HB ILE 34 HB ILE 34 6.397 2.669 -3.409
232 HG12 ILE 34 HG12 ILE 34 6.668 0.497 -2.116
233 HG13 ILE 34 HG13 ILE 34 7.451 1.928 -1.475
234 HG21 ILE 34 HG21 ILE 34 4.481 3.385 -1.146
235 HG22 ILE 34 HG22 ILE 34 6.129 4.003 -1.266
236 HG23 ILE 34 HG23 ILE 34 4.941 4.415 -2.523
237 HD11 ILE 34 HD11 ILE 34 5.744 2.190 0.264
238 HD12 ILE 34 HD12 ILE 34 4.791 0.858 -0.430
239 HD13 ILE 34 HD13 ILE 34 6.379 0.579 0.314
240 H TYR 35 H TYR 35 5.449 2.392 -5.483
241 HA TYR 35 HA TYR 35 4.188 4.769 -6.189
242 HB2 TYR 35 HB2 TYR 35 5.417 2.743 -8.068
243 HB3 TYR 35 HB3 TYR 35 5.286 4.475 -8.290
244 HD1 TYR 35 HD1 TYR 35 7.832 2.763 -8.516
245 HD2 TYR 35 HD2 TYR 35 6.213 5.052 -5.216
246 HE1 TYR 35 HE1 TYR 35 10.051 2.734 -7.377
247 HE2 TYR 35 HE2 TYR 35 8.351 4.907 -4.059
248 HH TYR 35 HH TYR 35 10.278 3.710 -3.989
249 H GLN 36 H GLN 36 2.915 1.743 -6.247
250 HA GLN 36 HA GLN 36 0.984 2.323 -8.477
251 HB2 GLN 36 HB2 GLN 36 1.621 -0.205 -6.947
252 HB3 GLN 36 HB3 GLN 36 0.334 -0.069 -8.138
253 HG2 GLN 36 HG2 GLN 36 3.294 0.250 -8.713
254 HG3 GLN 36 HG3 GLN 36 2.217 -1.049 -9.251
255 HE21 GLN 36 HE21 GLN 36 3.662 1.839 -10.265
256 HE22 GLN 36 HE22 GLN 36 2.568 2.154 -11.582
257 H ILE 37 H ILE 37 0.906 1.496 -4.913
258 HA ILE 37 HA ILE 37 -1.945 1.603 -4.885
259 HB ILE 37 HB ILE 37 -1.779 1.777 -2.454
260 HG12 ILE 37 HG12 ILE 37 1.239 1.584 -2.751
261 HG13 ILE 37 HG13 ILE 37 0.420 3.125 -2.485
262 HG21 ILE 37 HG21 ILE 37 -1.774 -0.379 -3.644
263 HG22 ILE 37 HG22 ILE 37 -0.006 -0.359 -3.730
264 HG23 ILE 37 HG23 ILE 37 -0.825 -0.490 -2.168
265 HD11 ILE 37 HD11 ILE 37 0.252 0.710 -0.651
266 HD12 ILE 37 HD12 ILE 37 1.220 2.175 -0.383
267 HD13 ILE 37 HD13 ILE 37 -0.560 2.249 -0.381
268 H GLU 38 H GLU 38 0.255 4.182 -5.263
269 HA GLU 38 HA GLU 38 -1.441 6.231 -4.051
270 HB2 GLU 38 HB2 GLU 38 0.086 7.792 -5.303
271 HB3 GLU 38 HB3 GLU 38 0.905 6.694 -4.187
272 HG2 GLU 38 HG2 GLU 38 1.746 5.326 -5.905
273 HG3 GLU 38 HG3 GLU 38 0.688 6.026 -7.139
274 H HIS 39 H HIS 39 -1.277 4.548 -7.157
275 HA HIS 39 HA HIS 39 -3.211 6.473 -8.358
276 HB2 HIS 39 HB2 HIS 39 -1.060 6.093 -9.535
277 HB3 HIS 39 HB3 HIS 39 -1.448 4.371 -9.653
278 HD1 HIS 39 HD1 HIS 39 -2.792 7.792 -10.957
279 HD2 HIS 39 HD2 HIS 39 -3.088 3.631 -11.597
280 HE1 HIS 39 HE1 HIS 39 -4.086 7.479 -13.124
281 H TYR 40 H TYR 40 -2.852 3.182 -7.163
282 HA TYR 40 HA TYR 40 -5.295 2.237 -8.492
283 HB2 TYR 40 HB2 TYR 40 -3.406 1.063 -6.391
284 HB3 TYR 40 HB3 TYR 40 -4.926 0.306 -6.803
285 HD1 TYR 40 HD1 TYR 40 -1.662 -0.472 -7.269
286 HD2 TYR 40 HD2 TYR 40 -5.110 0.541 -9.758
287 HE1 TYR 40 HE1 TYR 40 -0.775 -1.785 -9.120
288 HE2 TYR 40 HE2 TYR 40 -4.104 -0.675 -11.611
289 HH TYR 40 HH TYR 40 -2.268 -1.984 -12.336
290 H SER 41 H SER 41 -7.023 3.415 -7.889
291 HA SER 41 HA SER 41 -7.186 4.677 -5.305
292 HB2 SER 41 HB2 SER 41 -9.323 4.378 -7.438
293 HB3 SER 41 HB3 SER 41 -9.270 5.565 -6.110
294 HG SER 41 HG SER 41 -6.996 5.902 -7.240
295 H MET 42 H MET 42 -9.473 4.457 -4.130
296 HA MET 42 HA MET 42 -9.374 2.096 -2.675
297 HB2 MET 42 HB2 MET 42 -11.830 3.850 -3.062
298 HB3 MET 42 HB3 MET 42 -11.565 2.681 -1.776
299 HG2 MET 42 HG2 MET 42 -9.526 4.074 -1.088
300 HG3 MET 42 HG3 MET 42 -10.122 5.309 -2.209
301 HE1 MET 42 HE1 MET 42 -11.524 7.227 0.788
302 HE2 MET 42 HE2 MET 42 -9.903 6.521 0.689
303 HE3 MET 42 HE3 MET 42 -10.650 7.253 -0.752
304 H ASP 43 H ASP 43 -11.344 2.682 -5.648
305 HA ASP 43 HA ASP 43 -12.820 0.241 -5.255
306 HB2 ASP 43 HB2 ASP 43 -13.534 2.201 -6.732
307 HB3 ASP 43 HB3 ASP 43 -12.406 1.565 -7.948
308 H ASP 44 H ASP 44 -9.712 0.968 -6.817
309 HA ASP 44 HA ASP 44 -9.494 -1.591 -8.131
310 HB2 ASP 44 HB2 ASP 44 -7.842 0.781 -7.875
311 HB3 ASP 44 HB3 ASP 44 -6.880 -0.628 -7.416
312 H LEU 45 H LEU 45 -8.522 -0.241 -5.004
313 HA LEU 45 HA LEU 45 -7.275 -2.644 -4.024
314 HB2 LEU 45 HB2 LEU 45 -8.426 -0.225 -2.613
315 HB3 LEU 45 HB3 LEU 45 -7.974 -1.695 -1.733
316 HG LEU 45 HG LEU 45 -5.673 -1.553 -2.523
317 HD11 LEU 45 HD11 LEU 45 -4.808 0.482 -3.612
318 HD12 LEU 45 HD12 LEU 45 -6.444 1.128 -3.725
319 HD13 LEU 45 HD13 LEU 45 -5.989 -0.309 -4.654
320 HD21 LEU 45 HD21 LEU 45 -6.269 -0.507 -0.378
321 HD22 LEU 45 HD22 LEU 45 -6.724 0.999 -1.211
322 HD23 LEU 45 HD23 LEU 45 -5.031 0.466 -1.191
323 H ALA 46 H ALA 46 -10.689 -1.634 -4.303
324 HA ALA 46 HA ALA 46 -11.717 -3.699 -2.589
325 HB1 ALA 46 HB1 ALA 46 -13.102 -1.768 -3.502
326 HB2 ALA 46 HB2 ALA 46 -13.169 -2.630 -5.052
327 HB3 ALA 46 HB3 ALA 46 -13.848 -3.374 -3.606
328 H SER 47 H SER 47 -11.085 -3.555 -6.151
329 HA SER 47 HA SER 47 -11.810 -6.170 -6.805
330 HB2 SER 47 HB2 SER 47 -9.582 -4.523 -8.047
331 HB3 SER 47 HB3 SER 47 -10.445 -5.873 -8.789
332 HG SER 47 HG SER 47 -11.028 -3.504 -9.150
333 H LEU 48 H LEU 48 -8.882 -4.965 -5.271
334 HA LEU 48 HA LEU 48 -7.336 -7.431 -5.661
335 HB2 LEU 48 HB2 LEU 48 -6.908 -4.946 -3.962
336 HB3 LEU 48 HB3 LEU 48 -5.773 -6.292 -3.986
337 HG LEU 48 HG LEU 48 -6.555 -4.677 -6.439
338 HD11 LEU 48 HD11 LEU 48 -5.314 -3.318 -4.828
339 HD12 LEU 48 HD12 LEU 48 -4.301 -3.755 -6.229
340 HD13 LEU 48 HD13 LEU 48 -4.067 -4.599 -4.672
341 HD21 LEU 48 HD21 LEU 48 -4.517 -5.753 -7.403
342 HD22 LEU 48 HD22 LEU 48 -5.815 -6.892 -7.100
343 HD23 LEU 48 HD23 LEU 48 -4.433 -6.811 -5.974
344 H LYS 49 H LYS 49 -10.054 -7.221 -4.061
345 HA LYS 49 HA LYS 49 -11.049 -8.207 -2.337
346 HB2 LYS 49 HB2 LYS 49 -8.753 -10.191 -2.601
347 HB3 LYS 49 HB3 LYS 49 -10.092 -10.381 -1.482
348 HG2 LYS 49 HG2 LYS 49 -10.982 -11.542 -3.199
349 HG3 LYS 49 HG3 LYS 49 -11.611 -9.948 -3.594
350 HD2 LYS 49 HD2 LYS 49 -9.412 -9.763 -5.074
351 HD3 LYS 49 HD3 LYS 49 -9.359 -11.504 -4.897
352 HE2 LYS 49 HE2 LYS 49 -11.591 -9.811 -6.089
353 HE3 LYS 49 HE3 LYS 49 -10.529 -10.912 -6.959
354 HZ1 LYS 49 HZ1 LYS 49 -12.633 -11.950 -6.603
355 HZ2 LYS 49 HZ2 LYS 49 -12.636 -11.624 -5.025
356 HZ3 LYS 49 HZ3 LYS 49 -11.539 -12.722 -5.606
357 H ILE 50 H ILE 50 -9.941 -5.946 -1.649
358 HA ILE 50 HA ILE 50 -8.648 -6.441 0.994
359 HB ILE 50 HB ILE 50 -8.840 -3.829 -0.503
360 HG12 ILE 50 HG12 ILE 50 -7.513 -5.511 -1.854
361 HG13 ILE 50 HG13 ILE 50 -6.628 -4.109 -1.353
362 HG21 ILE 50 HG21 ILE 50 -8.445 -3.793 1.967
363 HG22 ILE 50 HG22 ILE 50 -7.022 -4.774 1.714
364 HG23 ILE 50 HG23 ILE 50 -7.084 -3.134 1.028
365 HD11 ILE 50 HD11 ILE 50 -6.503 -6.864 -0.039
366 HD12 ILE 50 HD12 ILE 50 -5.328 -6.193 -1.192
367 HD13 ILE 50 HD13 ILE 50 -5.495 -5.464 0.405
368 HA PRO 51 HA PRO 51 -12.876 -5.458 2.369
369 HB2 PRO 51 HB2 PRO 51 -12.493 -5.627 5.094
370 HB3 PRO 51 HB3 PRO 51 -12.664 -7.063 4.042
371 HG2 PRO 51 HG2 PRO 51 -10.122 -5.800 5.085
372 HG3 PRO 51 HG3 PRO 51 -10.555 -7.536 5.016
373 HD2 PRO 51 HD2 PRO 51 -8.959 -6.342 3.148
374 HD3 PRO 51 HD3 PRO 51 -10.095 -7.658 2.711
375 H GLU 52 H GLU 52 -13.787 -3.475 2.912
376 HA GLU 52 HA GLU 52 -12.448 -1.137 2.648
377 HB2 GLU 52 HB2 GLU 52 -14.397 -0.021 3.238
378 HB3 GLU 52 HB3 GLU 52 -14.911 -1.574 2.591
379 HG2 GLU 52 HG2 GLU 52 -14.967 -2.329 5.130
380 HG3 GLU 52 HG3 GLU 52 -14.910 -0.608 5.477
381 H GLN 53 H GLN 53 -13.029 -2.737 5.742
382 HA GLN 53 HA GLN 53 -12.339 -0.747 7.539
383 HB2 GLN 53 HB2 GLN 53 -11.738 -3.732 7.818
384 HB3 GLN 53 HB3 GLN 53 -11.899 -2.554 9.127
385 HG2 GLN 53 HG2 GLN 53 -14.277 -2.151 8.409
386 HG3 GLN 53 HG3 GLN 53 -14.102 -3.417 7.187
387 HE21 GLN 53 HE21 GLN 53 -15.205 -5.261 7.870
388 HE22 GLN 53 HE22 GLN 53 -15.224 -5.808 9.529
389 H PHE 54 H PHE 54 -10.149 -3.206 6.141
390 HA PHE 54 HA PHE 54 -7.775 -1.877 7.248
391 HB2 PHE 54 HB2 PHE 54 -7.587 -4.221 7.238
392 HB3 PHE 54 HB3 PHE 54 -8.287 -4.374 5.628
393 HD1 PHE 54 HD1 PHE 54 -7.020 -4.273 3.709
394 HD2 PHE 54 HD2 PHE 54 -5.266 -2.991 7.382
395 HE1 PHE 54 HE1 PHE 54 -4.772 -4.115 2.567
396 HE2 PHE 54 HE2 PHE 54 -3.029 -2.819 6.282
397 HZ PHE 54 HZ PHE 54 -2.785 -3.401 3.877
398 H ARG 55 H ARG 55 -9.351 -2.277 4.012
399 HA ARG 55 HA ARG 55 -7.429 -1.204 2.333
400 HB2 ARG 55 HB2 ARG 55 -9.645 -2.105 1.653
401 HB3 ARG 55 HB3 ARG 55 -10.430 -0.689 2.359
402 HG2 ARG 55 HG2 ARG 55 -9.175 0.782 0.729
403 HG3 ARG 55 HG3 ARG 55 -8.501 -0.682 0.047
404 HD2 ARG 55 HD2 ARG 55 -10.283 -0.012 -1.351
405 HD3 ARG 55 HD3 ARG 55 -10.886 -1.430 -0.483
406 HE ARG 55 HE ARG 55 -11.519 0.983 0.929
407 HH11 ARG 55 HH11 ARG 55 -12.339 -0.200 -2.289
408 HH12 ARG 55 HH12 ARG 55 -14.008 0.193 -2.208
409 HH21 ARG 55 HH21 ARG 55 -13.706 1.683 1.037
410 HH22 ARG 55 HH22 ARG 55 -14.857 1.167 -0.132
411 H HIS 56 H HIS 56 -9.879 0.602 4.259
412 HA HIS 56 HA HIS 56 -9.032 3.122 3.366
413 HB2 HIS 56 HB2 HIS 56 -11.201 2.363 4.526
414 HB3 HIS 56 HB3 HIS 56 -10.332 2.546 6.050
415 HD1 HIS 56 HD1 HIS 56 -11.729 4.614 6.885
416 HD2 HIS 56 HD2 HIS 56 -10.265 4.954 2.943
417 HE1 HIS 56 HE1 HIS 56 -12.336 6.951 6.079
418 H ALA 57 H ALA 57 -7.531 0.991 5.759
419 HA ALA 57 HA ALA 57 -6.082 3.084 7.143
420 HB1 ALA 57 HB1 ALA 57 -6.582 0.838 8.165
421 HB2 ALA 57 HB2 ALA 57 -5.424 0.111 7.027
422 HB3 ALA 57 HB3 ALA 57 -4.862 1.306 8.191
423 H ILE 58 H ILE 58 -5.093 0.531 4.716
424 HA ILE 58 HA ILE 58 -2.487 1.488 4.343
425 HB ILE 58 HB ILE 58 -2.887 -0.677 3.565
426 HG12 ILE 58 HG12 ILE 58 -2.791 1.146 1.112
427 HG13 ILE 58 HG13 ILE 58 -1.443 0.479 2.059
428 HG21 ILE 58 HG21 ILE 58 -5.177 0.153 1.752
429 HG22 ILE 58 HG22 ILE 58 -4.575 -1.476 2.057
430 HG23 ILE 58 HG23 ILE 58 -5.370 -0.617 3.339
431 HD11 ILE 58 HD11 ILE 58 -1.491 -0.794 0.096
432 HD12 ILE 58 HD12 ILE 58 -2.417 -1.817 1.235
433 HD13 ILE 58 HD13 ILE 58 -3.248 -0.807 0.029
434 H TRP 59 H TRP 59 -5.442 2.132 2.412
435 HA TRP 59 HA TRP 59 -4.135 3.879 0.627
436 HB2 TRP 59 HB2 TRP 59 -6.470 2.655 0.557
437 HB3 TRP 59 HB3 TRP 59 -7.069 4.173 1.221
438 HD1 TRP 59 HD1 TRP 59 -5.041 2.825 -1.822
439 HE1 TRP 59 HE1 TRP 59 -5.422 4.295 -3.827
440 HE3 TRP 59 HE3 TRP 59 -7.682 6.493 0.489
441 HZ2 TRP 59 HZ2 TRP 59 -6.917 6.797 -4.415
442 HZ3 TRP 59 HZ3 TRP 59 -8.540 8.460 -0.808
443 HH2 TRP 59 HH2 TRP 59 -8.193 8.574 -3.246
444 H LYS 60 H LYS 60 -6.086 4.742 3.608
445 HA LYS 60 HA LYS 60 -5.643 7.505 3.339
446 HB2 LYS 60 HB2 LYS 60 -7.195 6.462 4.974
447 HB3 LYS 60 HB3 LYS 60 -5.823 5.947 5.963
448 HG2 LYS 60 HG2 LYS 60 -6.089 8.850 5.226
449 HG3 LYS 60 HG3 LYS 60 -7.263 8.204 6.347
450 HD2 LYS 60 HD2 LYS 60 -4.293 7.906 6.923
451 HD3 LYS 60 HD3 LYS 60 -5.175 9.386 7.246
452 HE2 LYS 60 HE2 LYS 60 -5.355 8.381 9.290
453 HE3 LYS 60 HE3 LYS 60 -6.885 7.944 8.545
454 HZ1 LYS 60 HZ1 LYS 60 -4.490 6.221 8.872
455 HZ2 LYS 60 HZ2 LYS 60 -5.840 5.774 8.013
456 HZ3 LYS 60 HZ3 LYS 60 -5.953 6.065 9.608
457 H GLY 61 H GLY 61 -3.561 4.983 4.808
458 HA2 GLY 61 HA2 GLY 61 -1.642 6.642 5.986
459 HA3 GLY 61 HA3 GLY 61 -1.390 4.990 5.431
460 H ILE 62 H ILE 62 -1.545 5.160 2.652
461 HA ILE 62 HA ILE 62 0.945 6.509 2.162
462 HB ILE 62 HB ILE 62 0.047 4.350 1.228
463 HG12 ILE 62 HG12 ILE 62 1.354 4.715 -0.993
464 HG13 ILE 62 HG13 ILE 62 1.538 6.383 -0.464
465 HG21 ILE 62 HG21 ILE 62 -2.055 5.147 0.227
466 HG22 ILE 62 HG22 ILE 62 -1.108 6.091 -0.956
467 HG23 ILE 62 HG23 ILE 62 -1.033 4.342 -0.968
468 HD11 ILE 62 HD11 ILE 62 3.518 5.072 0.097
469 HD12 ILE 62 HD12 ILE 62 2.731 5.553 1.600
470 HD13 ILE 62 HD13 ILE 62 2.538 3.893 0.991
471 H LEU 63 H LEU 63 -2.424 7.220 1.328
472 HA LEU 63 HA LEU 63 -1.800 9.427 -0.406
473 HB2 LEU 63 HB2 LEU 63 -4.237 8.546 1.159
474 HB3 LEU 63 HB3 LEU 63 -4.195 10.163 0.531
475 HG LEU 63 HG LEU 63 -5.381 8.513 -0.906
476 HD11 LEU 63 HD11 LEU 63 -4.665 10.660 -1.759
477 HD12 LEU 63 HD12 LEU 63 -4.494 9.424 -3.013
478 HD13 LEU 63 HD13 LEU 63 -3.053 10.015 -2.151
479 HD21 LEU 63 HD21 LEU 63 -2.608 7.553 -1.717
480 HD22 LEU 63 HD22 LEU 63 -4.149 7.097 -2.453
481 HD23 LEU 63 HD23 LEU 63 -3.801 6.593 -0.801
482 H ASP 64 H ASP 64 -1.997 9.009 3.024
483 HA ASP 64 HA ASP 64 -1.927 11.855 3.790
484 HB2 ASP 64 HB2 ASP 64 -2.860 10.271 5.328
485 HB3 ASP 64 HB3 ASP 64 -1.390 9.293 5.317
486 H HIS 65 H HIS 65 0.421 9.290 3.400
487 HA HIS 65 HA HIS 65 2.733 10.616 4.383
488 HB2 HIS 65 HB2 HIS 65 2.816 8.230 4.154
489 HB3 HIS 65 HB3 HIS 65 2.332 8.302 2.465
490 HD1 HIS 65 HD1 HIS 65 5.393 10.159 4.120
491 HD2 HIS 65 HD2 HIS 65 4.243 7.584 0.973
492 HE1 HIS 65 HE1 HIS 65 7.499 9.602 2.830
493 H ARG 66 H ARG 66 1.578 10.146 0.948
494 HA ARG 66 HA ARG 66 3.582 11.959 0.031
495 HB2 ARG 66 HB2 ARG 66 2.475 11.924 -2.119
496 HB3 ARG 66 HB3 ARG 66 2.591 10.315 -1.438
497 HG2 ARG 66 HG2 ARG 66 0.429 10.303 -2.319
498 HG3 ARG 66 HG3 ARG 66 0.142 10.693 -0.629
499 HD2 ARG 66 HD2 ARG 66 0.404 13.207 -1.618
500 HD3 ARG 66 HD3 ARG 66 -0.113 12.386 -3.090
501 HE ARG 66 HE ARG 66 -1.662 11.961 -0.605
502 HH11 ARG 66 HH11 ARG 66 -1.395 13.957 -3.528
503 HH12 ARG 66 HH12 ARG 66 -3.086 14.348 -3.577
504 HH21 ARG 66 HH21 ARG 66 -3.922 12.646 -0.574
505 HH22 ARG 66 HH22 ARG 66 -4.410 13.832 -1.718
506 H GLN 67 H GLN 67 0.290 12.477 1.401
507 HA GLN 67 HA GLN 67 0.131 15.181 0.398
508 HB2 GLN 67 HB2 GLN 67 -1.806 13.817 0.932
509 HB3 GLN 67 HB3 GLN 67 -1.331 13.740 2.645
510 HG2 GLN 67 HG2 GLN 67 -1.697 16.140 2.805
511 HG3 GLN 67 HG3 GLN 67 -2.086 16.216 1.075
512 HE21 GLN 67 HE21 GLN 67 -3.281 15.497 4.255
513 HE22 GLN 67 HE22 GLN 67 -4.887 14.938 3.857
514 H LEU 68 H LEU 68 1.848 13.794 3.140
515 HA LEU 68 HA LEU 68 2.219 16.495 4.314
516 HB2 LEU 68 HB2 LEU 68 2.525 13.667 5.372
517 HB3 LEU 68 HB3 LEU 68 3.131 15.067 6.255
518 HG LEU 68 HG LEU 68 0.204 14.764 5.424
519 HD11 LEU 68 HD11 LEU 68 1.491 14.247 8.119
520 HD12 LEU 68 HD12 LEU 68 0.907 12.990 7.011
521 HD13 LEU 68 HD13 LEU 68 -0.235 14.135 7.738
522 HD21 LEU 68 HD21 LEU 68 0.751 17.097 5.821
523 HD22 LEU 68 HD22 LEU 68 1.670 16.689 7.288
524 HD23 LEU 68 HD23 LEU 68 -0.085 16.484 7.256
525 H HIS 69 H HIS 69 3.992 13.780 2.958
526 HA HIS 69 HA HIS 69 6.117 13.237 2.723
527 HB2 HIS 69 HB2 HIS 69 5.299 14.594 0.799
528 HB3 HIS 69 HB3 HIS 69 6.158 15.977 1.480
529 HD1 HIS 69 HD1 HIS 69 6.878 12.363 0.189
530 HD2 HIS 69 HD2 HIS 69 8.758 16.095 0.814
531 HE1 HIS 69 HE1 HIS 69 9.225 12.124 -0.695
532 H ASP 70 H ASP 70 5.934 14.069 5.317
533 HA ASP 70 HA ASP 70 8.113 15.913 5.973
534 HB2 ASP 70 HB2 ASP 70 7.511 15.716 8.193
535 HB3 ASP 70 HB3 ASP 70 5.963 15.643 7.331
Start of MODEL 16
1 H1 GLY 1 H GLY 1 21.161 -6.070 -14.664
2 HA2 GLY 1 HA2 GLY 1 22.577 -7.189 -12.985
3 HA3 GLY 1 HA3 GLY 1 21.168 -6.385 -12.258
4 HA PRO 2 HA PRO 2 20.825 -11.228 -12.140
5 HB2 PRO 2 HB2 PRO 2 22.807 -12.232 -10.520
6 HB3 PRO 2 HB3 PRO 2 22.989 -12.035 -12.283
7 HG2 PRO 2 HG2 PRO 2 23.934 -10.169 -10.089
8 HG3 PRO 2 HG3 PRO 2 24.844 -10.753 -11.518
9 HD2 PRO 2 HD2 PRO 2 23.603 -8.321 -11.439
10 HD3 PRO 2 HD3 PRO 2 23.710 -9.276 -12.950
11 H LEU 3 H LEU 3 21.518 -8.811 -9.728
12 HA LEU 3 HA LEU 3 20.376 -10.234 -7.474
13 HB2 LEU 3 HB2 LEU 3 20.939 -8.366 -6.212
14 HB3 LEU 3 HB3 LEU 3 22.268 -8.595 -7.332
15 HG LEU 3 HG LEU 3 20.090 -6.477 -7.496
16 HD11 LEU 3 HD11 LEU 3 21.833 -4.908 -6.921
17 HD12 LEU 3 HD12 LEU 3 23.043 -6.202 -6.873
18 HD13 LEU 3 HD13 LEU 3 21.724 -6.158 -5.685
19 HD21 LEU 3 HD21 LEU 3 20.651 -6.910 -9.765
20 HD22 LEU 3 HD22 LEU 3 22.394 -7.041 -9.387
21 HD23 LEU 3 HD23 LEU 3 21.563 -5.481 -9.306
22 H GLY 4 H GLY 4 18.695 -8.797 -6.157
23 HA2 GLY 4 HA2 GLY 4 16.286 -8.683 -7.778
24 HA3 GLY 4 HA3 GLY 4 16.434 -8.433 -6.038
25 H SER 5 H SER 5 14.730 -6.821 -7.218
26 HA SER 5 HA SER 5 15.970 -4.180 -6.925
27 HB2 SER 5 HB2 SER 5 16.108 -4.650 -9.368
28 HB3 SER 5 HB3 SER 5 14.344 -4.855 -9.407
29 HG SER 5 HG SER 5 15.331 -2.711 -9.897
30 H THR 6 H THR 6 14.919 -4.726 -4.945
31 HA THR 6 HA THR 6 12.082 -3.950 -4.865
32 HB THR 6 HB THR 6 13.221 -6.391 -3.443
33 HG1 THR 6 HG1 THR 6 11.223 -6.335 -5.447
34 HG21 THR 6 HG21 THR 6 10.890 -6.853 -2.788
35 HG22 THR 6 HG22 THR 6 10.362 -5.323 -3.535
36 HG23 THR 6 HG23 THR 6 11.448 -5.311 -2.127
37 H ASP 7 H ASP 7 13.183 -1.995 -4.339
38 HA ASP 7 HA ASP 7 14.762 -1.873 -1.808
39 HB2 ASP 7 HB2 ASP 7 14.281 0.072 -4.104
40 HB3 ASP 7 HB3 ASP 7 14.978 0.558 -2.564
41 H CYS 8 H CYS 8 11.751 -1.111 -3.415
42 HA CYS 8 HA CYS 8 10.487 -0.205 -0.920
43 HB2 CYS 8 HB2 CYS 8 11.151 1.538 -3.046
44 HB3 CYS 8 HB3 CYS 8 9.482 1.067 -3.398
45 HG CYS 8 HG CYS 8 10.822 2.419 -0.685
46 H SER 9 H SER 9 8.356 -0.978 -0.844
47 HA SER 9 HA SER 9 6.752 -2.031 -2.823
48 HB2 SER 9 HB2 SER 9 8.277 -3.860 -3.174
49 HB3 SER 9 HB3 SER 9 8.524 -4.082 -1.444
50 HG SER 9 HG SER 9 6.584 -5.016 -3.112
51 H ILE 10 H ILE 10 4.754 -2.826 -1.671
52 HA ILE 10 HA ILE 10 4.196 -1.255 0.601
53 HB ILE 10 HB ILE 10 2.588 -3.658 -0.275
54 HG12 ILE 10 HG12 ILE 10 2.208 -0.779 -1.141
55 HG13 ILE 10 HG13 ILE 10 3.058 -1.982 -2.077
56 HG21 ILE 10 HG21 ILE 10 1.930 -2.963 1.882
57 HG22 ILE 10 HG22 ILE 10 1.871 -1.245 1.391
58 HG23 ILE 10 HG23 ILE 10 0.707 -2.429 0.757
59 HD11 ILE 10 HD11 ILE 10 0.130 -2.010 -1.387
60 HD12 ILE 10 HD12 ILE 10 0.890 -2.044 -2.981
61 HD13 ILE 10 HD13 ILE 10 1.003 -3.459 -1.935
62 H VAL 11 H VAL 11 5.661 -4.367 0.455
63 HA VAL 11 HA VAL 11 5.064 -5.436 2.971
64 HB VAL 11 HB VAL 11 7.414 -6.274 2.987
65 HG11 VAL 11 HG11 VAL 11 5.904 -6.738 0.373
66 HG12 VAL 11 HG12 VAL 11 7.022 -7.873 1.159
67 HG13 VAL 11 HG13 VAL 11 5.476 -7.474 1.922
68 HG21 VAL 11 HG21 VAL 11 8.727 -6.210 0.852
69 HG22 VAL 11 HG22 VAL 11 7.659 -4.916 0.290
70 HG23 VAL 11 HG23 VAL 11 8.710 -4.676 1.705
71 H SER 12 H SER 12 7.593 -3.023 2.215
72 HA SER 12 HA SER 12 8.503 -2.678 4.848
73 HB2 SER 12 HB2 SER 12 8.572 -0.918 2.369
74 HB3 SER 12 HB3 SER 12 9.594 -0.670 3.821
75 HG SER 12 HG SER 12 10.718 -1.903 2.274
76 H PHE 13 H PHE 13 6.050 -0.933 2.915
77 HA PHE 13 HA PHE 13 5.529 1.104 4.861
78 HB2 PHE 13 HB2 PHE 13 4.851 1.240 2.490
79 HB3 PHE 13 HB3 PHE 13 3.694 -0.066 2.718
80 HD1 PHE 13 HD1 PHE 13 1.434 0.655 2.895
81 HD2 PHE 13 HD2 PHE 13 4.594 3.208 4.321
82 HE1 PHE 13 HE1 PHE 13 -0.249 2.351 3.632
83 HE2 PHE 13 HE2 PHE 13 2.899 4.874 5.084
84 HZ PHE 13 HZ PHE 13 0.510 4.400 4.804
85 H PHE 14 H PHE 14 3.960 -2.038 4.232
86 HA PHE 14 HA PHE 14 2.041 -1.931 6.290
87 HB2 PHE 14 HB2 PHE 14 3.277 -4.084 4.578
88 HB3 PHE 14 HB3 PHE 14 2.373 -4.576 5.975
89 HD1 PHE 14 HD1 PHE 14 0.954 -5.745 4.304
90 HD2 PHE 14 HD2 PHE 14 1.116 -1.443 4.441
91 HE1 PHE 14 HE1 PHE 14 -1.149 -5.618 2.991
92 HE2 PHE 14 HE2 PHE 14 -0.992 -1.318 3.236
93 HZ PHE 14 HZ PHE 14 -2.156 -3.407 2.504
94 H ALA 15 H ALA 15 5.358 -3.260 6.318
95 HA ALA 15 HA ALA 15 5.262 -4.295 8.954
96 HB1 ALA 15 HB1 ALA 15 7.747 -3.969 8.931
97 HB2 ALA 15 HB2 ALA 15 7.155 -4.733 7.432
98 HB3 ALA 15 HB3 ALA 15 7.587 -3.012 7.453
99 H ARG 16 H ARG 16 5.994 -0.937 7.768
100 HA ARG 16 HA ARG 16 6.409 0.046 10.427
101 HB2 ARG 16 HB2 ARG 16 5.727 1.515 7.841
102 HB3 ARG 16 HB3 ARG 16 5.965 2.314 9.400
103 HG2 ARG 16 HG2 ARG 16 8.179 0.899 9.506
104 HG3 ARG 16 HG3 ARG 16 7.978 0.735 7.765
105 HD2 ARG 16 HD2 ARG 16 9.486 2.549 8.265
106 HD3 ARG 16 HD3 ARG 16 8.035 3.219 7.566
107 HE ARG 16 HE ARG 16 8.759 3.179 10.475
108 HH11 ARG 16 HH11 ARG 16 6.896 4.731 7.817
109 HH12 ARG 16 HH12 ARG 16 6.430 6.085 8.818
110 HH21 ARG 16 HH21 ARG 16 7.891 5.025 11.777
111 HH22 ARG 16 HH22 ARG 16 6.982 6.227 10.923
112 H LEU 17 H LEU 17 3.473 -0.026 8.397
113 HA LEU 17 HA LEU 17 1.777 1.299 10.297
114 HB2 LEU 17 HB2 LEU 17 1.026 -0.878 8.297
115 HB3 LEU 17 HB3 LEU 17 -0.124 0.085 9.211
116 HG LEU 17 HG LEU 17 1.748 1.098 7.056
117 HD11 LEU 17 HD11 LEU 17 -1.271 0.784 7.204
118 HD12 LEU 17 HD12 LEU 17 -0.167 -0.212 6.232
119 HD13 LEU 17 HD13 LEU 17 -0.398 1.505 5.854
120 HD21 LEU 17 HD21 LEU 17 -0.300 2.633 8.727
121 HD22 LEU 17 HD22 LEU 17 0.467 3.251 7.254
122 HD23 LEU 17 HD23 LEU 17 1.461 2.901 8.668
123 H GLY 18 H GLY 18 2.979 -2.050 10.227
124 HA2 GLY 18 HA2 GLY 18 3.128 -3.299 12.203
125 HA3 GLY 18 HA3 GLY 18 1.616 -2.608 12.793
126 H CYS 19 H CYS 19 1.454 -3.238 9.439
127 HA CYS 19 HA CYS 19 -0.548 -5.241 9.867
128 HB2 CYS 19 HB2 CYS 19 0.784 -4.257 7.322
129 HB3 CYS 19 HB3 CYS 19 -0.625 -5.329 7.350
130 HG CYS 19 HG CYS 19 -0.343 -2.336 8.771
131 H SER 20 H SER 20 -0.458 -7.522 9.256
132 HA SER 20 HA SER 20 2.278 -8.607 8.802
133 HB2 SER 20 HB2 SER 20 0.302 -9.539 10.883
134 HB3 SER 20 HB3 SER 20 1.811 -10.362 10.443
135 HG SER 20 HG SER 20 1.508 -7.746 11.545
136 H SER 21 H SER 21 -0.762 -10.532 9.229
137 HA SER 21 HA SER 21 -0.272 -12.033 6.976
138 HB2 SER 21 HB2 SER 21 -3.015 -11.359 8.081
139 HB3 SER 21 HB3 SER 21 -2.581 -12.768 7.093
140 HG SER 21 HG SER 21 -2.463 -13.498 9.121
141 H CYS 22 H CYS 22 -1.759 -8.812 6.924
142 HA CYS 22 HA CYS 22 -2.891 -9.121 4.313
143 HB2 CYS 22 HB2 CYS 22 -3.350 -7.275 6.078
144 HB3 CYS 22 HB3 CYS 22 -1.905 -6.474 5.441
145 HG CYS 22 HG CYS 22 -4.138 -5.408 4.504
146 H LEU 23 H LEU 23 0.426 -8.385 5.422
147 HA LEU 23 HA LEU 23 1.360 -7.508 2.884
148 HB2 LEU 23 HB2 LEU 23 3.359 -7.174 3.885
149 HB3 LEU 23 HB3 LEU 23 2.352 -7.185 5.308
150 HG LEU 23 HG LEU 23 3.071 -9.741 5.483
151 HD11 LEU 23 HD11 LEU 23 4.289 -9.853 3.299
152 HD12 LEU 23 HD12 LEU 23 5.323 -10.171 4.682
153 HD13 LEU 23 HD13 LEU 23 5.377 -8.572 3.881
154 HD21 LEU 23 HD21 LEU 23 4.994 -7.439 6.053
155 HD22 LEU 23 HD22 LEU 23 5.002 -9.042 6.830
156 HD23 LEU 23 HD23 LEU 23 3.645 -7.947 7.087
157 H ASP 24 H ASP 24 1.131 -10.606 4.595
158 HA ASP 24 HA ASP 24 2.593 -12.181 2.780
159 HB2 ASP 24 HB2 ASP 24 1.984 -12.915 5.036
160 HB3 ASP 24 HB3 ASP 24 0.286 -13.051 4.546
161 H TYR 25 H TYR 25 -0.877 -11.299 2.829
162 HA TYR 25 HA TYR 25 -1.592 -13.006 0.602
163 HB2 TYR 25 HB2 TYR 25 -2.869 -10.382 1.475
164 HB3 TYR 25 HB3 TYR 25 -3.583 -11.570 0.399
165 HD1 TYR 25 HD1 TYR 25 -4.363 -10.305 3.268
166 HD2 TYR 25 HD2 TYR 25 -3.056 -14.158 1.859
167 HE1 TYR 25 HE1 TYR 25 -5.476 -11.375 5.193
168 HE2 TYR 25 HE2 TYR 25 -4.212 -15.242 3.744
169 HH TYR 25 HH TYR 25 -5.387 -14.943 5.702
170 H PHE 26 H PHE 26 -0.671 -9.512 0.861
171 HA PHE 26 HA PHE 26 -0.708 -8.929 -1.876
172 HB2 PHE 26 HB2 PHE 26 0.400 -7.813 0.632
173 HB3 PHE 26 HB3 PHE 26 1.365 -7.441 -0.746
174 HD1 PHE 26 HD1 PHE 26 0.412 -6.143 -2.704
175 HD2 PHE 26 HD2 PHE 26 -1.839 -6.903 0.912
176 HE1 PHE 26 HE1 PHE 26 -1.055 -4.227 -3.221
177 HE2 PHE 26 HE2 PHE 26 -3.378 -5.089 0.333
178 HZ PHE 26 HZ PHE 26 -3.037 -3.765 -1.766
179 H THR 27 H THR 27 2.076 -10.291 0.044
180 HA THR 27 HA THR 27 3.947 -10.110 -2.119
181 HB THR 27 HB THR 27 5.231 -11.733 -0.666
182 HG1 THR 27 HG1 THR 27 4.292 -12.564 1.056
183 HG21 THR 27 HG21 THR 27 5.573 -9.326 -0.384
184 HG22 THR 27 HG22 THR 27 5.593 -10.129 1.196
185 HG23 THR 27 HG23 THR 27 4.173 -9.214 0.703
186 H THR 28 H THR 28 1.851 -12.811 -0.909
187 HA THR 28 HA THR 28 2.888 -14.645 -2.829
188 HB THR 28 HB THR 28 1.422 -14.832 -0.647
189 HG1 THR 28 HG1 THR 28 1.229 -16.808 -2.662
190 HG21 THR 28 HG21 THR 28 -0.698 -15.436 -2.704
191 HG22 THR 28 HG22 THR 28 -0.739 -14.167 -1.462
192 HG23 THR 28 HG23 THR 28 -0.742 -15.866 -0.984
193 H GLN 29 H GLN 29 0.356 -12.255 -2.994
194 HA GLN 29 HA GLN 29 -0.693 -13.158 -5.585
195 HB2 GLN 29 HB2 GLN 29 -0.949 -10.546 -4.056
196 HB3 GLN 29 HB3 GLN 29 -1.785 -10.892 -5.576
197 HG2 GLN 29 HG2 GLN 29 -2.199 -12.800 -3.257
198 HG3 GLN 29 HG3 GLN 29 -3.109 -11.293 -3.377
199 HE21 GLN 29 HE21 GLN 29 -2.444 -14.428 -5.120
200 HE22 GLN 29 HE22 GLN 29 -3.615 -14.107 -6.359
201 H GLY 30 H GLY 30 2.043 -11.430 -4.594
202 HA2 GLY 30 HA2 GLY 30 3.824 -10.477 -5.593
203 HA3 GLY 30 HA3 GLY 30 3.372 -11.351 -7.071
204 H LEU 31 H LEU 31 1.562 -8.891 -5.336
205 HA LEU 31 HA LEU 31 1.923 -6.929 -7.590
206 HB2 LEU 31 HB2 LEU 31 -0.545 -6.411 -7.209
207 HB3 LEU 31 HB3 LEU 31 -0.131 -7.886 -8.034
208 HG LEU 31 HG LEU 31 -0.547 -9.203 -6.056
209 HD11 LEU 31 HD11 LEU 31 -1.646 -8.256 -4.044
210 HD12 LEU 31 HD12 LEU 31 -1.287 -6.625 -4.644
211 HD13 LEU 31 HD13 LEU 31 0.026 -7.759 -4.219
212 HD21 LEU 31 HD21 LEU 31 -2.950 -8.941 -5.859
213 HD22 LEU 31 HD22 LEU 31 -2.402 -8.826 -7.531
214 HD23 LEU 31 HD23 LEU 31 -2.847 -7.338 -6.644
215 H THR 32 H THR 32 3.114 -7.121 -4.861
216 HA THR 32 HA THR 32 1.934 -4.790 -3.464
217 HB THR 32 HB THR 32 2.453 -6.570 -2.112
218 HG1 THR 32 HG1 THR 32 3.690 -5.753 -0.628
219 HG21 THR 32 HG21 THR 32 5.246 -6.823 -3.182
220 HG22 THR 32 HG22 THR 32 3.910 -7.998 -3.302
221 HG23 THR 32 HG23 THR 32 4.624 -7.636 -1.734
222 H THR 33 H THR 33 2.467 -2.717 -4.065
223 HA THR 33 HA THR 33 5.266 -2.097 -4.524
224 HB THR 33 HB THR 33 4.987 -2.487 -6.698
225 HG1 THR 33 HG1 THR 33 4.989 -0.678 -7.539
226 HG21 THR 33 HG21 THR 33 1.903 -2.233 -6.477
227 HG22 THR 33 HG22 THR 33 2.855 -3.705 -6.708
228 HG23 THR 33 HG23 THR 33 2.786 -2.536 -7.996
229 H ILE 34 H ILE 34 5.628 0.078 -4.198
230 HA ILE 34 HA ILE 34 3.532 1.513 -2.696
231 HB ILE 34 HB ILE 34 6.298 2.584 -3.326
232 HG12 ILE 34 HG12 ILE 34 6.497 0.447 -2.084
233 HG13 ILE 34 HG13 ILE 34 7.027 1.843 -1.182
234 HG21 ILE 34 HG21 ILE 34 4.147 3.325 -1.292
235 HG22 ILE 34 HG22 ILE 34 5.820 3.845 -1.133
236 HG23 ILE 34 HG23 ILE 34 4.858 4.370 -2.540
237 HD11 ILE 34 HD11 ILE 34 4.920 1.871 0.141
238 HD12 ILE 34 HD12 ILE 34 4.347 0.462 -0.777
239 HD13 ILE 34 HD13 ILE 34 5.771 0.368 0.295
240 H TYR 35 H TYR 35 5.353 1.962 -5.607
241 HA TYR 35 HA TYR 35 4.435 4.395 -6.578
242 HB2 TYR 35 HB2 TYR 35 5.641 1.979 -7.971
243 HB3 TYR 35 HB3 TYR 35 5.390 3.543 -8.729
244 HD1 TYR 35 HD1 TYR 35 7.051 2.149 -5.582
245 HD2 TYR 35 HD2 TYR 35 7.151 5.087 -8.756
246 HE1 TYR 35 HE1 TYR 35 9.103 3.047 -4.651
247 HE2 TYR 35 HE2 TYR 35 9.322 5.889 -7.900
248 HH TYR 35 HH TYR 35 11.155 5.198 -6.539
249 H GLN 36 H GLN 36 2.792 1.441 -6.388
250 HA GLN 36 HA GLN 36 0.828 2.246 -8.497
251 HB2 GLN 36 HB2 GLN 36 1.201 -0.348 -6.964
252 HB3 GLN 36 HB3 GLN 36 -0.170 0.018 -8.028
253 HG2 GLN 36 HG2 GLN 36 1.872 0.770 -9.672
254 HG3 GLN 36 HG3 GLN 36 2.646 -0.510 -8.800
255 HE21 GLN 36 HE21 GLN 36 0.399 0.373 -11.250
256 HE22 GLN 36 HE22 GLN 36 -0.061 -1.240 -11.766
257 H ILE 37 H ILE 37 0.920 1.438 -4.913
258 HA ILE 37 HA ILE 37 -1.821 2.071 -4.672
259 HB ILE 37 HB ILE 37 -1.442 2.340 -2.237
260 HG12 ILE 37 HG12 ILE 37 1.391 1.447 -2.824
261 HG13 ILE 37 HG13 ILE 37 0.960 3.086 -2.363
262 HG21 ILE 37 HG21 ILE 37 -2.058 0.228 -3.425
263 HG22 ILE 37 HG22 ILE 37 -0.338 -0.195 -3.490
264 HG23 ILE 37 HG23 ILE 37 -1.174 -0.060 -1.928
265 HD11 ILE 37 HD11 ILE 37 0.508 0.582 -0.664
266 HD12 ILE 37 HD12 ILE 37 1.769 1.804 -0.422
267 HD13 ILE 37 HD13 ILE 37 0.061 2.233 -0.201
268 H GLU 38 H GLU 38 0.829 4.315 -5.079
269 HA GLU 38 HA GLU 38 -0.566 6.531 -3.853
270 HB2 GLU 38 HB2 GLU 38 0.998 7.947 -5.147
271 HB3 GLU 38 HB3 GLU 38 1.800 6.701 -4.186
272 HG2 GLU 38 HG2 GLU 38 2.263 5.363 -6.128
273 HG3 GLU 38 HG3 GLU 38 1.232 6.360 -7.161
274 H HIS 39 H HIS 39 -0.837 4.923 -7.018
275 HA HIS 39 HA HIS 39 -2.698 7.074 -7.915
276 HB2 HIS 39 HB2 HIS 39 -0.712 6.571 -9.319
277 HB3 HIS 39 HB3 HIS 39 -1.363 4.947 -9.590
278 HD1 HIS 39 HD1 HIS 39 -2.972 8.530 -9.860
279 HD2 HIS 39 HD2 HIS 39 -2.499 4.893 -11.951
280 HE1 HIS 39 HE1 HIS 39 -4.282 8.766 -12.010
281 H TYR 40 H TYR 40 -2.619 3.619 -7.071
282 HA TYR 40 HA TYR 40 -5.031 2.921 -8.389
283 HB2 TYR 40 HB2 TYR 40 -3.391 1.721 -6.138
284 HB3 TYR 40 HB3 TYR 40 -5.016 1.134 -6.386
285 HD1 TYR 40 HD1 TYR 40 -2.079 -0.398 -6.767
286 HD2 TYR 40 HD2 TYR 40 -5.147 1.229 -9.460
287 HE1 TYR 40 HE1 TYR 40 -1.724 -2.193 -8.366
288 HE2 TYR 40 HE2 TYR 40 -4.576 -0.456 -11.070
289 HH TYR 40 HH TYR 40 -3.703 -2.534 -11.311
290 H SER 41 H SER 41 -7.150 3.361 -7.977
291 HA SER 41 HA SER 41 -7.730 4.869 -5.497
292 HB2 SER 41 HB2 SER 41 -9.418 4.411 -7.999
293 HB3 SER 41 HB3 SER 41 -9.770 5.554 -6.704
294 HG SER 41 HG SER 41 -7.827 6.707 -7.321
295 H MET 42 H MET 42 -10.130 4.447 -4.818
296 HA MET 42 HA MET 42 -10.194 2.098 -3.368
297 HB2 MET 42 HB2 MET 42 -12.517 2.626 -2.882
298 HB3 MET 42 HB3 MET 42 -11.524 4.066 -2.851
299 HG2 MET 42 HG2 MET 42 -12.315 4.594 -5.189
300 HG3 MET 42 HG3 MET 42 -13.406 3.228 -5.082
301 HE1 MET 42 HE1 MET 42 -13.944 6.593 -5.517
302 HE2 MET 42 HE2 MET 42 -15.067 5.269 -5.885
303 HE3 MET 42 HE3 MET 42 -15.568 6.582 -4.801
304 H ASP 43 H ASP 43 -11.265 2.321 -6.742
305 HA ASP 43 HA ASP 43 -12.935 -0.018 -6.705
306 HB2 ASP 43 HB2 ASP 43 -13.169 1.439 -8.577
307 HB3 ASP 43 HB3 ASP 43 -11.440 1.443 -8.898
308 H ASP 44 H ASP 44 -9.454 0.449 -7.635
309 HA ASP 44 HA ASP 44 -9.066 -2.319 -8.248
310 HB2 ASP 44 HB2 ASP 44 -7.221 -0.022 -7.662
311 HB3 ASP 44 HB3 ASP 44 -6.587 -1.655 -7.436
312 H LEU 45 H LEU 45 -8.732 -0.493 -5.262
313 HA LEU 45 HA LEU 45 -7.534 -2.587 -3.732
314 HB2 LEU 45 HB2 LEU 45 -9.380 -0.453 -2.623
315 HB3 LEU 45 HB3 LEU 45 -8.079 -1.304 -1.769
316 HG LEU 45 HG LEU 45 -7.767 0.692 -4.009
317 HD11 LEU 45 HD11 LEU 45 -6.839 0.967 -1.154
318 HD12 LEU 45 HD12 LEU 45 -8.377 1.632 -1.777
319 HD13 LEU 45 HD13 LEU 45 -6.851 2.158 -2.470
320 HD21 LEU 45 HD21 LEU 45 -5.317 0.496 -3.545
321 HD22 LEU 45 HD22 LEU 45 -6.023 -0.928 -4.298
322 HD23 LEU 45 HD23 LEU 45 -5.703 -0.941 -2.552
323 H ALA 46 H ALA 46 -11.004 -1.705 -4.074
324 HA ALA 46 HA ALA 46 -11.956 -3.867 -2.460
325 HB1 ALA 46 HB1 ALA 46 -13.320 -2.409 -4.763
326 HB2 ALA 46 HB2 ALA 46 -14.117 -3.558 -3.666
327 HB3 ALA 46 HB3 ALA 46 -13.444 -2.066 -3.017
328 H SER 47 H SER 47 -11.437 -3.634 -5.981
329 HA SER 47 HA SER 47 -12.279 -6.176 -6.763
330 HB2 SER 47 HB2 SER 47 -11.739 -4.149 -8.158
331 HB3 SER 47 HB3 SER 47 -10.018 -4.436 -7.865
332 HG SER 47 HG SER 47 -11.723 -5.533 -9.647
333 H LEU 48 H LEU 48 -9.096 -5.130 -5.528
334 HA LEU 48 HA LEU 48 -7.914 -7.765 -5.809
335 HB2 LEU 48 HB2 LEU 48 -6.901 -5.140 -4.681
336 HB3 LEU 48 HB3 LEU 48 -5.908 -6.587 -4.797
337 HG LEU 48 HG LEU 48 -7.279 -5.355 -7.236
338 HD11 LEU 48 HD11 LEU 48 -5.562 -3.841 -6.092
339 HD12 LEU 48 HD12 LEU 48 -5.333 -4.199 -7.805
340 HD13 LEU 48 HD13 LEU 48 -4.353 -5.052 -6.609
341 HD21 LEU 48 HD21 LEU 48 -6.782 -7.628 -7.648
342 HD22 LEU 48 HD22 LEU 48 -5.163 -7.497 -6.899
343 HD23 LEU 48 HD23 LEU 48 -5.515 -6.676 -8.431
344 H LYS 49 H LYS 49 -10.236 -7.376 -3.959
345 HA LYS 49 HA LYS 49 -11.007 -8.308 -2.073
346 HB2 LYS 49 HB2 LYS 49 -8.400 -9.842 -1.841
347 HB3 LYS 49 HB3 LYS 49 -9.872 -10.128 -0.958
348 HG2 LYS 49 HG2 LYS 49 -9.943 -11.748 -2.564
349 HG3 LYS 49 HG3 LYS 49 -11.083 -10.544 -3.131
350 HD2 LYS 49 HD2 LYS 49 -9.804 -11.519 -4.967
351 HD3 LYS 49 HD3 LYS 49 -9.461 -9.803 -4.853
352 HE2 LYS 49 HE2 LYS 49 -7.349 -10.383 -3.557
353 HE3 LYS 49 HE3 LYS 49 -7.715 -12.087 -3.815
354 HZ1 LYS 49 HZ1 LYS 49 -7.083 -10.092 -5.893
355 HZ2 LYS 49 HZ2 LYS 49 -7.596 -11.591 -6.252
356 HZ3 LYS 49 HZ3 LYS 49 -6.182 -11.391 -5.459
357 H ILE 50 H ILE 50 -9.603 -5.689 -1.923
358 HA ILE 50 HA ILE 50 -8.792 -5.737 0.952
359 HB ILE 50 HB ILE 50 -8.404 -3.428 -0.943
360 HG12 ILE 50 HG12 ILE 50 -7.148 -5.236 -2.012
361 HG13 ILE 50 HG13 ILE 50 -6.073 -4.068 -1.278
362 HG21 ILE 50 HG21 ILE 50 -8.258 -3.064 1.506
363 HG22 ILE 50 HG22 ILE 50 -6.956 -4.227 1.574
364 HG23 ILE 50 HG23 ILE 50 -6.740 -2.726 0.646
365 HD11 ILE 50 HD11 ILE 50 -5.699 -5.618 0.655
366 HD12 ILE 50 HD12 ILE 50 -6.804 -6.783 -0.101
367 HD13 ILE 50 HD13 ILE 50 -5.283 -6.336 -0.893
368 HA PRO 51 HA PRO 51 -13.137 -4.151 0.814
369 HB2 PRO 51 HB2 PRO 51 -14.050 -5.075 3.187
370 HB3 PRO 51 HB3 PRO 51 -13.804 -6.180 1.797
371 HG2 PRO 51 HG2 PRO 51 -11.887 -5.660 4.105
372 HG3 PRO 51 HG3 PRO 51 -12.476 -7.241 3.494
373 HD2 PRO 51 HD2 PRO 51 -10.102 -6.189 2.667
374 HD3 PRO 51 HD3 PRO 51 -11.186 -7.091 1.553
375 H GLU 52 H GLU 52 -14.267 -2.499 2.136
376 HA GLU 52 HA GLU 52 -12.752 -0.394 2.999
377 HB2 GLU 52 HB2 GLU 52 -14.776 0.492 4.103
378 HB3 GLU 52 HB3 GLU 52 -14.964 0.005 2.411
379 HG2 GLU 52 HG2 GLU 52 -16.155 -2.013 3.059
380 HG3 GLU 52 HG3 GLU 52 -15.781 -1.735 4.776
381 H GLN 53 H GLN 53 -13.609 -3.146 4.949
382 HA GLN 53 HA GLN 53 -13.310 -2.257 7.552
383 HB2 GLN 53 HB2 GLN 53 -13.950 -4.583 6.638
384 HB3 GLN 53 HB3 GLN 53 -12.228 -4.864 6.402
385 HG2 GLN 53 HG2 GLN 53 -11.978 -4.348 8.934
386 HG3 GLN 53 HG3 GLN 53 -13.737 -4.440 9.008
387 HE21 GLN 53 HE21 GLN 53 -14.075 -6.387 10.102
388 HE22 GLN 53 HE22 GLN 53 -13.288 -7.903 9.689
389 H PHE 54 H PHE 54 -10.807 -2.894 5.119
390 HA PHE 54 HA PHE 54 -8.667 -1.906 6.993
391 HB2 PHE 54 HB2 PHE 54 -8.404 -4.255 6.765
392 HB3 PHE 54 HB3 PHE 54 -8.680 -4.200 5.024
393 HD1 PHE 54 HD1 PHE 54 -7.006 -3.489 3.499
394 HD2 PHE 54 HD2 PHE 54 -6.235 -3.383 7.707
395 HE1 PHE 54 HE1 PHE 54 -4.543 -3.257 3.036
396 HE2 PHE 54 HE2 PHE 54 -3.818 -3.142 7.283
397 HZ PHE 54 HZ PHE 54 -2.953 -3.086 4.961
398 H ARG 55 H ARG 55 -9.829 -2.098 3.638
399 HA ARG 55 HA ARG 55 -7.935 -0.810 2.178
400 HB2 ARG 55 HB2 ARG 55 -9.997 -1.886 1.470
401 HB3 ARG 55 HB3 ARG 55 -10.939 -0.504 1.973
402 HG2 ARG 55 HG2 ARG 55 -8.726 0.123 0.078
403 HG3 ARG 55 HG3 ARG 55 -9.945 -1.017 -0.508
404 HD2 ARG 55 HD2 ARG 55 -10.793 0.995 -1.247
405 HD3 ARG 55 HD3 ARG 55 -11.719 0.594 0.196
406 HE ARG 55 HE ARG 55 -9.462 2.354 0.734
407 HH11 ARG 55 HH11 ARG 55 -12.921 2.200 -0.205
408 HH12 ARG 55 HH12 ARG 55 -13.191 3.878 -0.059
409 HH21 ARG 55 HH21 ARG 55 -9.969 4.666 1.229
410 HH22 ARG 55 HH22 ARG 55 -11.499 5.268 0.759
411 H HIS 56 H HIS 56 -10.337 0.825 4.287
412 HA HIS 56 HA HIS 56 -9.686 3.430 3.182
413 HB2 HIS 56 HB2 HIS 56 -11.047 2.619 5.786
414 HB3 HIS 56 HB3 HIS 56 -10.820 4.275 5.276
415 HD1 HIS 56 HD1 HIS 56 -13.430 4.727 5.188
416 HD2 HIS 56 HD2 HIS 56 -12.051 1.653 2.659
417 HE1 HIS 56 HE1 HIS 56 -15.308 4.229 3.554
418 H ALA 57 H ALA 57 -8.321 1.366 5.760
419 HA ALA 57 HA ALA 57 -6.816 3.478 6.985
420 HB1 ALA 57 HB1 ALA 57 -5.789 1.700 8.238
421 HB2 ALA 57 HB2 ALA 57 -7.510 1.305 8.075
422 HB3 ALA 57 HB3 ALA 57 -6.298 0.482 7.059
423 H ILE 58 H ILE 58 -5.928 0.830 4.640
424 HA ILE 58 HA ILE 58 -3.215 1.586 4.437
425 HB ILE 58 HB ILE 58 -3.669 -0.508 3.574
426 HG12 ILE 58 HG12 ILE 58 -3.278 -0.522 1.169
427 HG13 ILE 58 HG13 ILE 58 -3.744 1.155 1.005
428 HG21 ILE 58 HG21 ILE 58 -5.315 -1.160 1.922
429 HG22 ILE 58 HG22 ILE 58 -6.084 -0.453 3.327
430 HG23 ILE 58 HG23 ILE 58 -5.919 0.492 1.805
431 HD11 ILE 58 HD11 ILE 58 -1.665 1.898 1.587
432 HD12 ILE 58 HD12 ILE 58 -1.495 0.710 2.889
433 HD13 ILE 58 HD13 ILE 58 -1.156 0.252 1.207
434 H TRP 59 H TRP 59 -6.042 2.440 2.392
435 HA TRP 59 HA TRP 59 -4.517 4.088 0.689
436 HB2 TRP 59 HB2 TRP 59 -6.878 3.137 0.386
437 HB3 TRP 59 HB3 TRP 59 -7.449 4.558 1.282
438 HD1 TRP 59 HD1 TRP 59 -5.476 3.547 -1.826
439 HE1 TRP 59 HE1 TRP 59 -5.716 5.334 -3.661
440 HE3 TRP 59 HE3 TRP 59 -7.771 7.065 0.966
441 HZ2 TRP 59 HZ2 TRP 59 -6.569 8.154 -3.742
442 HZ3 TRP 59 HZ3 TRP 59 -8.216 9.370 0.042
443 HH2 TRP 59 HH2 TRP 59 -7.623 9.890 -2.301
444 H LYS 60 H LYS 60 -6.369 4.987 3.665
445 HA LYS 60 HA LYS 60 -5.768 7.753 3.493
446 HB2 LYS 60 HB2 LYS 60 -7.453 6.768 5.030
447 HB3 LYS 60 HB3 LYS 60 -6.155 6.016 5.982
448 HG2 LYS 60 HG2 LYS 60 -5.296 8.337 6.504
449 HG3 LYS 60 HG3 LYS 60 -6.649 8.991 5.556
450 HD2 LYS 60 HD2 LYS 60 -7.474 9.119 7.727
451 HD3 LYS 60 HD3 LYS 60 -8.179 7.641 7.126
452 HE2 LYS 60 HE2 LYS 60 -7.461 7.126 9.298
453 HE3 LYS 60 HE3 LYS 60 -6.270 6.355 8.251
454 HZ1 LYS 60 HZ1 LYS 60 -5.451 7.590 10.254
455 HZ2 LYS 60 HZ2 LYS 60 -5.842 8.999 9.542
456 HZ3 LYS 60 HZ3 LYS 60 -4.683 8.019 8.879
457 H GLY 61 H GLY 61 -3.873 5.002 4.890
458 HA2 GLY 61 HA2 GLY 61 -1.922 6.551 6.186
459 HA3 GLY 61 HA3 GLY 61 -1.710 4.912 5.577
460 H ILE 62 H ILE 62 -1.695 5.025 2.908
461 HA ILE 62 HA ILE 62 0.840 6.264 2.481
462 HB ILE 62 HB ILE 62 -0.072 4.211 1.506
463 HG12 ILE 62 HG12 ILE 62 1.192 4.546 -0.730
464 HG13 ILE 62 HG13 ILE 62 1.387 6.223 -0.254
465 HG21 ILE 62 HG21 ILE 62 -2.207 5.048 0.560
466 HG22 ILE 62 HG22 ILE 62 -1.275 5.925 -0.678
467 HG23 ILE 62 HG23 ILE 62 -1.233 4.165 -0.628
468 HD11 ILE 62 HD11 ILE 62 2.396 3.786 1.290
469 HD12 ILE 62 HD12 ILE 62 3.375 4.871 0.283
470 HD13 ILE 62 HD13 ILE 62 2.660 5.478 1.772
471 H LEU 63 H LEU 63 -2.432 7.258 1.611
472 HA LEU 63 HA LEU 63 -1.516 9.458 -0.004
473 HB2 LEU 63 HB2 LEU 63 -4.159 8.756 1.250
474 HB3 LEU 63 HB3 LEU 63 -3.874 10.430 0.864
475 HG LEU 63 HG LEU 63 -5.026 9.295 -0.941
476 HD11 LEU 63 HD11 LEU 63 -3.435 11.214 -1.365
477 HD12 LEU 63 HD12 LEU 63 -3.812 10.184 -2.767
478 HD13 LEU 63 HD13 LEU 63 -2.249 9.998 -1.930
479 HD21 LEU 63 HD21 LEU 63 -3.936 7.663 -2.403
480 HD22 LEU 63 HD22 LEU 63 -4.017 7.027 -0.753
481 HD23 LEU 63 HD23 LEU 63 -2.491 7.670 -1.394
482 H ASP 64 H ASP 64 -1.852 8.930 3.428
483 HA ASP 64 HA ASP 64 -1.661 11.759 4.067
484 HB2 ASP 64 HB2 ASP 64 -1.857 11.313 6.202
485 HB3 ASP 64 HB3 ASP 64 -2.485 9.819 5.623
486 H HIS 65 H HIS 65 0.562 9.152 3.784
487 HA HIS 65 HA HIS 65 2.945 10.389 4.706
488 HB2 HIS 65 HB2 HIS 65 2.780 7.955 4.401
489 HB3 HIS 65 HB3 HIS 65 2.444 8.153 2.699
490 HD1 HIS 65 HD1 HIS 65 5.466 9.492 4.814
491 HD2 HIS 65 HD2 HIS 65 4.415 7.422 1.278
492 HE1 HIS 65 HE1 HIS 65 7.650 8.947 3.617
493 H ARG 66 H ARG 66 1.599 9.983 1.380
494 HA ARG 66 HA ARG 66 3.664 11.762 0.351
495 HB2 ARG 66 HB2 ARG 66 2.784 11.547 -1.779
496 HB3 ARG 66 HB3 ARG 66 2.587 9.986 -1.008
497 HG2 ARG 66 HG2 ARG 66 0.637 10.288 -2.223
498 HG3 ARG 66 HG3 ARG 66 0.145 10.653 -0.569
499 HD2 ARG 66 HD2 ARG 66 -0.031 12.984 -1.025
500 HD3 ARG 66 HD3 ARG 66 1.032 12.853 -2.428
501 HE ARG 66 HE ARG 66 -1.759 11.829 -2.268
502 HH11 ARG 66 HH11 ARG 66 0.607 13.742 -4.094
503 HH12 ARG 66 HH12 ARG 66 -0.221 13.600 -5.606
504 HH21 ARG 66 HH21 ARG 66 -2.845 11.592 -4.278
505 HH22 ARG 66 HH22 ARG 66 -2.200 12.302 -5.705
506 H GLN 67 H GLN 67 0.573 12.412 1.905
507 HA GLN 67 HA GLN 67 0.441 15.108 0.770
508 HB2 GLN 67 HB2 GLN 67 -1.596 13.952 1.304
509 HB3 GLN 67 HB3 GLN 67 -1.071 13.651 2.964
510 HG2 GLN 67 HG2 GLN 67 -1.261 15.982 3.518
511 HG3 GLN 67 HG3 GLN 67 -1.536 16.409 1.826
512 HE21 GLN 67 HE21 GLN 67 -2.983 13.947 4.065
513 HE22 GLN 67 HE22 GLN 67 -4.648 14.376 3.685
514 H LEU 68 H LEU 68 2.172 13.553 3.393
515 HA LEU 68 HA LEU 68 2.850 16.209 4.542
516 HB2 LEU 68 HB2 LEU 68 2.797 13.447 5.790
517 HB3 LEU 68 HB3 LEU 68 3.357 14.889 6.627
518 HG LEU 68 HG LEU 68 0.555 14.642 5.507
519 HD11 LEU 68 HD11 LEU 68 -0.133 14.142 7.877
520 HD12 LEU 68 HD12 LEU 68 1.582 13.951 8.273
521 HD13 LEU 68 HD13 LEU 68 0.830 12.853 7.111
522 HD21 LEU 68 HD21 LEU 68 -0.049 16.445 6.982
523 HD22 LEU 68 HD22 LEU 68 1.320 16.957 5.991
524 HD23 LEU 68 HD23 LEU 68 1.579 16.477 7.683
525 H HIS 69 H HIS 69 4.228 13.920 2.481
526 HA HIS 69 HA HIS 69 6.944 14.743 3.343
527 HB2 HIS 69 HB2 HIS 69 5.902 12.212 3.849
528 HB3 HIS 69 HB3 HIS 69 6.686 11.961 2.303
529 HD1 HIS 69 HD1 HIS 69 9.535 12.418 2.418
530 HD2 HIS 69 HD2 HIS 69 7.249 12.306 5.986
531 HE1 HIS 69 HE1 HIS 69 11.149 12.026 4.322
532 H ASP 70 H ASP 70 8.499 13.743 1.590
533 HA ASP 70 HA ASP 70 7.707 13.950 -1.164
534 HB2 ASP 70 HB2 ASP 70 9.193 15.687 -1.742
535 HB3 ASP 70 HB3 ASP 70 8.232 16.338 -0.412
Start of MODEL 17
1 H1 GLY 1 H GLY 1 27.933 6.942 -4.295
2 HA2 GLY 1 HA2 GLY 1 26.267 8.003 -5.727
3 HA3 GLY 1 HA3 GLY 1 26.408 6.611 -6.822
4 HA PRO 2 HA PRO 2 23.061 5.849 -3.654
5 HB2 PRO 2 HB2 PRO 2 21.013 5.191 -5.350
6 HB3 PRO 2 HB3 PRO 2 21.427 6.876 -4.907
7 HG2 PRO 2 HG2 PRO 2 22.247 5.355 -7.396
8 HG3 PRO 2 HG3 PRO 2 21.578 7.008 -7.279
9 HD2 PRO 2 HD2 PRO 2 24.268 6.545 -7.489
10 HD3 PRO 2 HD3 PRO 2 23.629 7.886 -6.499
11 H LEU 3 H LEU 3 24.017 4.016 -2.844
12 HA LEU 3 HA LEU 3 24.719 1.696 -4.359
13 HB2 LEU 3 HB2 LEU 3 25.748 2.232 -2.196
14 HB3 LEU 3 HB3 LEU 3 24.191 2.079 -1.380
15 HG LEU 3 HG LEU 3 24.122 -0.339 -1.868
16 HD11 LEU 3 HD11 LEU 3 26.127 -1.483 -2.771
17 HD12 LEU 3 HD12 LEU 3 26.873 0.093 -3.125
18 HD13 LEU 3 HD13 LEU 3 25.406 -0.429 -3.981
19 HD21 LEU 3 HD21 LEU 3 25.185 0.441 0.205
20 HD22 LEU 3 HD22 LEU 3 26.755 0.526 -0.621
21 HD23 LEU 3 HD23 LEU 3 25.943 -1.042 -0.392
22 H GLY 4 H GLY 4 21.712 2.782 -2.921
23 HA2 GLY 4 HA2 GLY 4 20.296 0.295 -2.794
24 HA3 GLY 4 HA3 GLY 4 19.606 1.922 -2.825
25 H SER 5 H SER 5 20.703 -0.779 -4.834
26 HA SER 5 HA SER 5 19.939 0.445 -7.367
27 HB2 SER 5 HB2 SER 5 21.874 -1.105 -7.090
28 HB3 SER 5 HB3 SER 5 20.759 -2.405 -6.640
29 HG SER 5 HG SER 5 19.741 -2.059 -8.697
30 H THR 6 H THR 6 17.931 0.038 -5.113
31 HA THR 6 HA THR 6 15.698 -1.145 -6.567
32 HB THR 6 HB THR 6 15.056 -1.959 -4.122
33 HG1 THR 6 HG1 THR 6 16.873 -1.287 -3.035
34 HG21 THR 6 HG21 THR 6 15.255 -3.471 -6.044
35 HG22 THR 6 HG22 THR 6 15.881 -4.203 -4.554
36 HG23 THR 6 HG23 THR 6 17.007 -3.559 -5.764
37 H ASP 7 H ASP 7 13.663 -0.112 -5.668
38 HA ASP 7 HA ASP 7 14.277 2.550 -4.454
39 HB2 ASP 7 HB2 ASP 7 11.791 1.588 -5.912
40 HB3 ASP 7 HB3 ASP 7 12.012 3.153 -5.129
41 H CYS 8 H CYS 8 11.162 0.965 -4.187
42 HA CYS 8 HA CYS 8 11.620 0.021 -1.426
43 HB2 CYS 8 HB2 CYS 8 9.393 1.896 -2.277
44 HB3 CYS 8 HB3 CYS 8 9.649 1.287 -0.654
45 HG CYS 8 HG CYS 8 10.290 3.951 -1.647
46 H SER 9 H SER 9 9.182 -0.726 -0.720
47 HA SER 9 HA SER 9 7.547 -1.914 -2.733
48 HB2 SER 9 HB2 SER 9 9.086 -3.706 -2.825
49 HB3 SER 9 HB3 SER 9 9.462 -3.621 -1.099
50 HG SER 9 HG SER 9 7.915 -5.333 -1.979
51 H ILE 10 H ILE 10 5.606 -2.639 -1.657
52 HA ILE 10 HA ILE 10 4.814 -1.021 0.517
53 HB ILE 10 HB ILE 10 3.671 -2.919 -1.311
54 HG12 ILE 10 HG12 ILE 10 3.003 -0.632 -1.325
55 HG13 ILE 10 HG13 ILE 10 1.606 -1.668 -1.022
56 HG21 ILE 10 HG21 ILE 10 2.350 -3.204 1.386
57 HG22 ILE 10 HG22 ILE 10 1.809 -3.883 -0.157
58 HG23 ILE 10 HG23 ILE 10 3.300 -4.440 0.608
59 HD11 ILE 10 HD11 ILE 10 2.872 0.406 0.687
60 HD12 ILE 10 HD12 ILE 10 1.192 -0.166 0.678
61 HD13 ILE 10 HD13 ILE 10 2.403 -1.064 1.562
62 H VAL 11 H VAL 11 6.546 -3.997 0.516
63 HA VAL 11 HA VAL 11 5.715 -5.187 2.923
64 HB VAL 11 HB VAL 11 8.032 -5.994 3.165
65 HG11 VAL 11 HG11 VAL 11 8.008 -7.394 1.112
66 HG12 VAL 11 HG12 VAL 11 6.392 -7.221 1.800
67 HG13 VAL 11 HG13 VAL 11 6.856 -6.281 0.358
68 HG21 VAL 11 HG21 VAL 11 9.517 -4.363 2.391
69 HG22 VAL 11 HG22 VAL 11 9.622 -5.647 1.204
70 HG23 VAL 11 HG23 VAL 11 8.683 -4.194 0.840
71 H SER 12 H SER 12 8.140 -2.594 2.512
72 HA SER 12 HA SER 12 8.778 -2.222 5.248
73 HB2 SER 12 HB2 SER 12 8.741 -0.293 2.871
74 HB3 SER 12 HB3 SER 12 9.699 -0.100 4.362
75 HG SER 12 HG SER 12 10.659 -2.177 3.783
76 H PHE 13 H PHE 13 6.293 -0.768 3.101
77 HA PHE 13 HA PHE 13 5.480 1.197 5.025
78 HB2 PHE 13 HB2 PHE 13 5.078 1.276 2.567
79 HB3 PHE 13 HB3 PHE 13 3.923 -0.042 2.749
80 HD1 PHE 13 HD1 PHE 13 1.635 0.528 3.066
81 HD2 PHE 13 HD2 PHE 13 4.723 3.381 4.067
82 HE1 PHE 13 HE1 PHE 13 -0.091 2.275 3.374
83 HE2 PHE 13 HE2 PHE 13 2.967 5.111 4.451
84 HZ PHE 13 HZ PHE 13 0.597 4.508 4.224
85 H PHE 14 H PHE 14 4.128 -2.022 4.155
86 HA PHE 14 HA PHE 14 2.064 -2.036 6.084
87 HB2 PHE 14 HB2 PHE 14 3.591 -4.197 4.597
88 HB3 PHE 14 HB3 PHE 14 2.371 -4.608 5.776
89 HD1 PHE 14 HD1 PHE 14 1.508 -5.804 3.680
90 HD2 PHE 14 HD2 PHE 14 1.362 -1.521 4.123
91 HE1 PHE 14 HE1 PHE 14 -0.223 -5.668 1.908
92 HE2 PHE 14 HE2 PHE 14 -0.319 -1.360 2.417
93 HZ PHE 14 HZ PHE 14 -1.106 -3.489 1.220
94 H ALA 15 H ALA 15 5.476 -3.046 6.345
95 HA ALA 15 HA ALA 15 5.310 -4.184 8.922
96 HB1 ALA 15 HB1 ALA 15 7.634 -2.577 7.763
97 HB2 ALA 15 HB2 ALA 15 7.690 -3.750 9.093
98 HB3 ALA 15 HB3 ALA 15 7.325 -4.300 7.449
99 H ARG 16 H ARG 16 5.770 -0.713 7.893
100 HA ARG 16 HA ARG 16 5.901 0.230 10.619
101 HB2 ARG 16 HB2 ARG 16 5.061 1.691 8.077
102 HB3 ARG 16 HB3 ARG 16 5.253 2.439 9.664
103 HG2 ARG 16 HG2 ARG 16 7.677 1.306 9.514
104 HG3 ARG 16 HG3 ARG 16 7.360 1.407 7.783
105 HD2 ARG 16 HD2 ARG 16 7.378 3.636 9.839
106 HD3 ARG 16 HD3 ARG 16 8.543 3.394 8.520
107 HE ARG 16 HE ARG 16 5.730 3.868 7.735
108 HH11 ARG 16 HH11 ARG 16 8.779 5.586 8.538
109 HH12 ARG 16 HH12 ARG 16 8.353 6.949 7.564
110 HH21 ARG 16 HH21 ARG 16 5.179 5.677 6.655
111 HH22 ARG 16 HH22 ARG 16 6.191 7.099 6.663
112 H LEU 17 H LEU 17 3.127 -0.123 8.324
113 HA LEU 17 HA LEU 17 1.236 1.099 10.052
114 HB2 LEU 17 HB2 LEU 17 0.754 -1.093 8.001
115 HB3 LEU 17 HB3 LEU 17 -0.473 -0.125 8.798
116 HG LEU 17 HG LEU 17 1.535 0.782 6.726
117 HD11 LEU 17 HD11 LEU 17 -0.513 -0.323 5.917
118 HD12 LEU 17 HD12 LEU 17 -0.470 1.392 5.469
119 HD13 LEU 17 HD13 LEU 17 -1.502 0.886 6.797
120 HD21 LEU 17 HD21 LEU 17 0.565 3.062 6.873
121 HD22 LEU 17 HD22 LEU 17 1.458 2.623 8.334
122 HD23 LEU 17 HD23 LEU 17 -0.315 2.583 8.340
123 H GLY 18 H GLY 18 2.606 -2.195 10.127
124 HA2 GLY 18 HA2 GLY 18 2.723 -3.435 12.036
125 HA3 GLY 18 HA3 GLY 18 1.273 -2.657 12.703
126 H CYS 19 H CYS 19 0.933 -3.340 9.380
127 HA CYS 19 HA CYS 19 -0.930 -5.406 10.046
128 HB2 CYS 19 HB2 CYS 19 -1.801 -5.072 7.782
129 HB3 CYS 19 HB3 CYS 19 -1.607 -3.540 8.666
130 HG CYS 19 HG CYS 19 0.887 -4.607 6.951
131 H SER 20 H SER 20 -0.699 -7.601 9.649
132 HA SER 20 HA SER 20 1.761 -8.426 8.201
133 HB2 SER 20 HB2 SER 20 0.624 -9.790 10.609
134 HB3 SER 20 HB3 SER 20 2.088 -10.241 9.726
135 HG SER 20 HG SER 20 2.326 -8.906 11.698
136 H SER 21 H SER 21 -1.618 -9.678 9.071
137 HA SER 21 HA SER 21 -1.411 -11.881 7.333
138 HB2 SER 21 HB2 SER 21 -3.933 -10.220 7.622
139 HB3 SER 21 HB3 SER 21 -3.792 -11.961 7.371
140 HG SER 21 HG SER 21 -2.894 -12.102 9.489
141 H CYS 22 H CYS 22 -2.148 -8.466 6.634
142 HA CYS 22 HA CYS 22 -2.935 -8.983 3.917
143 HB2 CYS 22 HB2 CYS 22 -2.109 -6.399 5.315
144 HB3 CYS 22 HB3 CYS 22 -2.805 -6.515 3.678
145 HG CYS 22 HG CYS 22 -5.043 -7.349 4.182
146 H LEU 23 H LEU 23 0.238 -8.336 5.468
147 HA LEU 23 HA LEU 23 1.523 -7.847 2.937
148 HB2 LEU 23 HB2 LEU 23 3.390 -7.472 4.139
149 HB3 LEU 23 HB3 LEU 23 2.272 -7.384 5.470
150 HG LEU 23 HG LEU 23 2.827 -9.973 5.749
151 HD11 LEU 23 HD11 LEU 23 4.178 -10.321 3.731
152 HD12 LEU 23 HD12 LEU 23 5.223 -10.419 5.126
153 HD13 LEU 23 HD13 LEU 23 5.211 -8.939 4.144
154 HD21 LEU 23 HD21 LEU 23 5.065 -8.142 6.532
155 HD22 LEU 23 HD22 LEU 23 4.335 -9.500 7.398
156 HD23 LEU 23 HD23 LEU 23 3.472 -7.958 7.247
157 H ASP 24 H ASP 24 0.863 -10.739 4.938
158 HA ASP 24 HA ASP 24 2.322 -12.640 3.437
159 HB2 ASP 24 HB2 ASP 24 1.414 -13.087 5.641
160 HB3 ASP 24 HB3 ASP 24 -0.232 -12.898 5.070
161 H TYR 25 H TYR 25 -1.145 -11.693 3.178
162 HA TYR 25 HA TYR 25 -1.645 -13.238 0.864
163 HB2 TYR 25 HB2 TYR 25 -3.007 -10.627 1.577
164 HB3 TYR 25 HB3 TYR 25 -3.655 -11.918 0.582
165 HD1 TYR 25 HD1 TYR 25 -4.653 -10.472 3.270
166 HD2 TYR 25 HD2 TYR 25 -2.878 -14.319 2.409
167 HE1 TYR 25 HE1 TYR 25 -5.632 -11.396 5.343
168 HE2 TYR 25 HE2 TYR 25 -3.836 -15.228 4.469
169 HH TYR 25 HH TYR 25 -5.793 -14.665 6.156
170 H PHE 26 H PHE 26 -0.698 -9.726 1.066
171 HA PHE 26 HA PHE 26 -0.729 -9.262 -1.713
172 HB2 PHE 26 HB2 PHE 26 0.442 -7.930 0.688
173 HB3 PHE 26 HB3 PHE 26 1.275 -7.631 -0.772
174 HD1 PHE 26 HD1 PHE 26 0.385 -6.287 -2.586
175 HD2 PHE 26 HD2 PHE 26 -2.079 -7.311 0.815
176 HE1 PHE 26 HE1 PHE 26 -1.204 -4.570 -3.238
177 HE2 PHE 26 HE2 PHE 26 -3.690 -5.580 0.144
178 HZ PHE 26 HZ PHE 26 -3.266 -4.193 -1.868
179 H THR 27 H THR 27 1.981 -10.425 0.335
180 HA THR 27 HA THR 27 3.858 -10.333 -1.839
181 HB THR 27 HB THR 27 5.243 -11.867 -0.356
182 HG1 THR 27 HG1 THR 27 3.106 -11.447 1.478
183 HG21 THR 27 HG21 THR 27 5.737 -10.222 1.367
184 HG22 THR 27 HG22 THR 27 4.204 -9.397 1.082
185 HG23 THR 27 HG23 THR 27 5.467 -9.400 -0.174
186 H THR 28 H THR 28 1.787 -12.991 -0.500
187 HA THR 28 HA THR 28 2.710 -14.905 -2.353
188 HB THR 28 HB THR 28 0.121 -14.569 -0.801
189 HG1 THR 28 HG1 THR 28 2.330 -16.339 -0.569
190 HG21 THR 28 HG21 THR 28 0.970 -16.849 -2.614
191 HG22 THR 28 HG22 THR 28 -0.563 -15.960 -2.600
192 HG23 THR 28 HG23 THR 28 -0.178 -17.077 -1.281
193 H GLN 29 H GLN 29 0.018 -12.407 -2.714
194 HA GLN 29 HA GLN 29 -0.827 -13.457 -5.215
195 HB2 GLN 29 HB2 GLN 29 -0.934 -10.670 -4.025
196 HB3 GLN 29 HB3 GLN 29 -1.826 -11.190 -5.461
197 HG2 GLN 29 HG2 GLN 29 -2.299 -12.696 -2.900
198 HG3 GLN 29 HG3 GLN 29 -3.005 -11.093 -3.103
199 HE21 GLN 29 HE21 GLN 29 -4.835 -10.846 -4.562
200 HE22 GLN 29 HE22 GLN 29 -5.455 -12.222 -5.455
201 H GLY 30 H GLY 30 1.829 -11.325 -4.233
202 HA2 GLY 30 HA2 GLY 30 3.778 -10.834 -5.384
203 HA3 GLY 30 HA3 GLY 30 3.131 -11.641 -6.816
204 H LEU 31 H LEU 31 1.357 -9.158 -5.136
205 HA LEU 31 HA LEU 31 1.851 -7.216 -7.388
206 HB2 LEU 31 HB2 LEU 31 -0.625 -6.624 -7.059
207 HB3 LEU 31 HB3 LEU 31 -0.193 -8.091 -7.927
208 HG LEU 31 HG LEU 31 -0.695 -9.450 -6.007
209 HD11 LEU 31 HD11 LEU 31 -0.210 -8.047 -4.103
210 HD12 LEU 31 HD12 LEU 31 -1.924 -8.468 -4.026
211 HD13 LEU 31 HD13 LEU 31 -1.439 -6.866 -4.619
212 HD21 LEU 31 HD21 LEU 31 -2.481 -8.992 -7.595
213 HD22 LEU 31 HD22 LEU 31 -3.001 -7.597 -6.619
214 HD23 LEU 31 HD23 LEU 31 -3.097 -9.251 -5.954
215 H THR 32 H THR 32 3.106 -7.282 -4.739
216 HA THR 32 HA THR 32 1.918 -4.974 -3.294
217 HB THR 32 HB THR 32 2.582 -6.625 -1.874
218 HG1 THR 32 HG1 THR 32 4.037 -5.850 -0.648
219 HG21 THR 32 HG21 THR 32 3.745 -8.242 -3.216
220 HG22 THR 32 HG22 THR 32 4.725 -7.853 -1.807
221 HG23 THR 32 HG23 THR 32 5.151 -7.146 -3.374
222 H THR 33 H THR 33 2.357 -2.860 -4.021
223 HA THR 33 HA THR 33 5.136 -2.226 -4.489
224 HB THR 33 HB THR 33 4.848 -2.702 -6.674
225 HG1 THR 33 HG1 THR 33 4.970 -0.846 -7.406
226 HG21 THR 33 HG21 THR 33 2.752 -3.922 -6.657
227 HG22 THR 33 HG22 THR 33 2.655 -2.772 -7.961
228 HG23 THR 33 HG23 THR 33 1.777 -2.476 -6.438
229 H ILE 34 H ILE 34 5.436 0.023 -4.346
230 HA ILE 34 HA ILE 34 3.380 1.401 -2.763
231 HB ILE 34 HB ILE 34 6.023 2.657 -3.489
232 HG12 ILE 34 HG12 ILE 34 5.458 0.433 -1.549
233 HG13 ILE 34 HG13 ILE 34 6.907 0.784 -2.514
234 HG21 ILE 34 HG21 ILE 34 4.145 4.034 -2.503
235 HG22 ILE 34 HG22 ILE 34 4.174 2.955 -1.090
236 HG23 ILE 34 HG23 ILE 34 5.576 3.975 -1.484
237 HD11 ILE 34 HD11 ILE 34 7.426 1.045 -0.164
238 HD12 ILE 34 HD12 ILE 34 7.405 2.659 -0.873
239 HD13 ILE 34 HD13 ILE 34 6.035 2.087 0.113
240 H TYR 35 H TYR 35 5.158 2.068 -5.772
241 HA TYR 35 HA TYR 35 3.922 4.452 -6.518
242 HB2 TYR 35 HB2 TYR 35 5.050 2.240 -8.283
243 HB3 TYR 35 HB3 TYR 35 4.831 3.934 -8.735
244 HD1 TYR 35 HD1 TYR 35 6.886 1.556 -6.775
245 HD2 TYR 35 HD2 TYR 35 6.269 5.711 -7.805
246 HE1 TYR 35 HE1 TYR 35 8.962 2.161 -5.583
247 HE2 TYR 35 HE2 TYR 35 8.391 6.301 -6.712
248 HH TYR 35 HH TYR 35 10.120 5.567 -5.386
249 H GLN 36 H GLN 36 2.842 1.133 -6.856
250 HA GLN 36 HA GLN 36 0.810 1.824 -8.842
251 HB2 GLN 36 HB2 GLN 36 1.268 -0.626 -7.116
252 HB3 GLN 36 HB3 GLN 36 -0.099 -0.472 -8.196
253 HG2 GLN 36 HG2 GLN 36 2.773 -0.755 -8.990
254 HG3 GLN 36 HG3 GLN 36 1.373 -1.678 -9.523
255 HE21 GLN 36 HE21 GLN 36 3.653 0.344 -10.632
256 HE22 GLN 36 HE22 GLN 36 2.734 1.276 -11.803
257 H ILE 37 H ILE 37 0.620 1.097 -5.282
258 HA ILE 37 HA ILE 37 -2.141 1.779 -5.186
259 HB ILE 37 HB ILE 37 -1.897 1.820 -2.780
260 HG12 ILE 37 HG12 ILE 37 1.081 1.462 -3.282
261 HG13 ILE 37 HG13 ILE 37 0.346 2.985 -2.767
262 HG21 ILE 37 HG21 ILE 37 -0.237 -0.453 -3.965
263 HG22 ILE 37 HG22 ILE 37 -1.300 -0.519 -2.558
264 HG23 ILE 37 HG23 ILE 37 -1.984 -0.318 -4.188
265 HD11 ILE 37 HD11 ILE 37 -0.424 1.878 -0.693
266 HD12 ILE 37 HD12 ILE 37 0.367 0.382 -1.274
267 HD13 ILE 37 HD13 ILE 37 1.348 1.811 -0.915
268 H GLU 38 H GLU 38 0.576 3.878 -5.539
269 HA GLU 38 HA GLU 38 -0.548 6.169 -4.231
270 HB2 GLU 38 HB2 GLU 38 1.884 5.627 -5.189
271 HB3 GLU 38 HB3 GLU 38 1.276 6.377 -6.644
272 HG2 GLU 38 HG2 GLU 38 1.421 7.623 -3.861
273 HG3 GLU 38 HG3 GLU 38 2.568 7.894 -5.160
274 H HIS 39 H HIS 39 -1.125 4.560 -7.334
275 HA HIS 39 HA HIS 39 -3.012 6.747 -8.065
276 HB2 HIS 39 HB2 HIS 39 -2.556 6.592 -10.232
277 HB3 HIS 39 HB3 HIS 39 -0.975 6.172 -9.611
278 HD1 HIS 39 HD1 HIS 39 -1.143 3.039 -9.263
279 HD2 HIS 39 HD2 HIS 39 -3.294 5.193 -12.161
280 HE1 HIS 39 HE1 HIS 39 -1.752 1.378 -11.064
281 H TYR 40 H TYR 40 -2.787 3.295 -7.364
282 HA TYR 40 HA TYR 40 -5.339 2.648 -8.537
283 HB2 TYR 40 HB2 TYR 40 -3.589 1.189 -6.512
284 HB3 TYR 40 HB3 TYR 40 -5.212 0.651 -6.882
285 HD1 TYR 40 HD1 TYR 40 -2.116 -0.630 -7.508
286 HD2 TYR 40 HD2 TYR 40 -5.518 0.956 -9.748
287 HE1 TYR 40 HE1 TYR 40 -1.443 -1.854 -9.519
288 HE2 TYR 40 HE2 TYR 40 -4.779 -0.238 -11.717
289 HH TYR 40 HH TYR 40 -2.961 -1.376 -12.700
290 H SER 41 H SER 41 -7.075 3.759 -7.927
291 HA SER 41 HA SER 41 -7.213 5.081 -5.373
292 HB2 SER 41 HB2 SER 41 -9.508 4.637 -7.320
293 HB3 SER 41 HB3 SER 41 -9.308 5.950 -6.154
294 HG SER 41 HG SER 41 -7.322 6.460 -7.421
295 H MET 42 H MET 42 -9.365 4.940 -4.158
296 HA MET 42 HA MET 42 -9.409 2.679 -2.607
297 HB2 MET 42 HB2 MET 42 -11.475 3.564 -1.683
298 HB3 MET 42 HB3 MET 42 -10.305 4.842 -1.950
299 HG2 MET 42 HG2 MET 42 -11.543 5.626 -3.890
300 HG3 MET 42 HG3 MET 42 -12.629 4.230 -3.820
301 HE1 MET 42 HE1 MET 42 -13.564 7.308 -3.987
302 HE2 MET 42 HE2 MET 42 -14.642 5.892 -4.038
303 HE3 MET 42 HE3 MET 42 -14.967 7.224 -2.903
304 H ASP 43 H ASP 43 -11.194 3.157 -5.612
305 HA ASP 43 HA ASP 43 -13.041 0.971 -5.353
306 HB2 ASP 43 HB2 ASP 43 -13.551 2.783 -6.852
307 HB3 ASP 43 HB3 ASP 43 -11.998 2.633 -7.677
308 H ASP 44 H ASP 44 -9.934 1.358 -7.194
309 HA ASP 44 HA ASP 44 -9.898 -1.299 -8.217
310 HB2 ASP 44 HB2 ASP 44 -7.992 0.940 -8.045
311 HB3 ASP 44 HB3 ASP 44 -7.198 -0.614 -7.831
312 H LEU 45 H LEU 45 -8.751 0.144 -5.214
313 HA LEU 45 HA LEU 45 -7.415 -2.131 -4.130
314 HB2 LEU 45 HB2 LEU 45 -8.567 0.423 -3.075
315 HB3 LEU 45 HB3 LEU 45 -8.506 -0.905 -1.930
316 HG LEU 45 HG LEU 45 -6.116 -1.224 -2.356
317 HD11 LEU 45 HD11 LEU 45 -4.836 0.606 -3.558
318 HD12 LEU 45 HD12 LEU 45 -6.377 1.260 -4.096
319 HD13 LEU 45 HD13 LEU 45 -5.870 -0.345 -4.641
320 HD21 LEU 45 HD21 LEU 45 -6.809 0.187 -0.490
321 HD22 LEU 45 HD22 LEU 45 -6.915 1.598 -1.568
322 HD23 LEU 45 HD23 LEU 45 -5.342 0.849 -1.213
323 H ALA 46 H ALA 46 -10.854 -1.063 -3.749
324 HA ALA 46 HA ALA 46 -11.646 -3.325 -2.214
325 HB1 ALA 46 HB1 ALA 46 -13.315 -1.589 -4.088
326 HB2 ALA 46 HB2 ALA 46 -13.952 -2.702 -2.864
327 HB3 ALA 46 HB3 ALA 46 -13.014 -1.279 -2.364
328 H SER 47 H SER 47 -11.567 -2.775 -5.720
329 HA SER 47 HA SER 47 -12.855 -5.115 -6.564
330 HB2 SER 47 HB2 SER 47 -12.339 -3.053 -7.904
331 HB3 SER 47 HB3 SER 47 -10.631 -3.502 -7.919
332 HG SER 47 HG SER 47 -11.625 -4.097 -9.813
333 H LEU 48 H LEU 48 -9.486 -4.547 -5.716
334 HA LEU 48 HA LEU 48 -8.506 -7.133 -6.565
335 HB2 LEU 48 HB2 LEU 48 -7.400 -4.830 -4.928
336 HB3 LEU 48 HB3 LEU 48 -6.445 -6.283 -5.222
337 HG LEU 48 HG LEU 48 -7.682 -4.770 -7.543
338 HD11 LEU 48 HD11 LEU 48 -5.703 -3.485 -7.838
339 HD12 LEU 48 HD12 LEU 48 -4.868 -4.287 -6.492
340 HD13 LEU 48 HD13 LEU 48 -6.251 -3.185 -6.204
341 HD21 LEU 48 HD21 LEU 48 -5.937 -5.852 -8.813
342 HD22 LEU 48 HD22 LEU 48 -6.795 -7.103 -7.889
343 HD23 LEU 48 HD23 LEU 48 -5.213 -6.536 -7.344
344 H LYS 49 H LYS 49 -10.778 -7.154 -4.741
345 HA LYS 49 HA LYS 49 -11.685 -8.439 -3.170
346 HB2 LYS 49 HB2 LYS 49 -9.049 -9.859 -2.774
347 HB3 LYS 49 HB3 LYS 49 -10.662 -10.453 -2.417
348 HG2 LYS 49 HG2 LYS 49 -9.349 -10.103 -5.138
349 HG3 LYS 49 HG3 LYS 49 -9.797 -11.597 -4.321
350 HD2 LYS 49 HD2 LYS 49 -12.232 -10.886 -4.508
351 HD3 LYS 49 HD3 LYS 49 -11.677 -9.492 -5.438
352 HE2 LYS 49 HE2 LYS 49 -12.427 -11.126 -6.982
353 HE3 LYS 49 HE3 LYS 49 -10.669 -11.012 -7.136
354 HZ1 LYS 49 HZ1 LYS 49 -10.444 -13.085 -6.031
355 HZ2 LYS 49 HZ2 LYS 49 -11.720 -13.298 -7.056
356 HZ3 LYS 49 HZ3 LYS 49 -12.004 -13.053 -5.472
357 H ILE 50 H ILE 50 -9.293 -6.262 -2.447
358 HA ILE 50 HA ILE 50 -8.796 -6.723 0.312
359 HB ILE 50 HB ILE 50 -8.762 -4.011 -0.981
360 HG12 ILE 50 HG12 ILE 50 -7.496 -5.479 -2.511
361 HG13 ILE 50 HG13 ILE 50 -6.392 -4.496 -1.581
362 HG21 ILE 50 HG21 ILE 50 -8.407 -4.221 1.487
363 HG22 ILE 50 HG22 ILE 50 -7.073 -5.308 1.145
364 HG23 ILE 50 HG23 ILE 50 -6.982 -3.614 0.619
365 HD11 ILE 50 HD11 ILE 50 -7.033 -7.425 -0.969
366 HD12 ILE 50 HD12 ILE 50 -5.614 -6.837 -1.838
367 HD13 ILE 50 HD13 ILE 50 -5.827 -6.423 -0.138
368 HA PRO 51 HA PRO 51 -12.860 -5.599 1.856
369 HB2 PRO 51 HB2 PRO 51 -12.372 -5.693 4.528
370 HB3 PRO 51 HB3 PRO 51 -12.545 -7.169 3.515
371 HG2 PRO 51 HG2 PRO 51 -10.007 -5.780 4.400
372 HG3 PRO 51 HG3 PRO 51 -10.375 -7.521 4.484
373 HD2 PRO 51 HD2 PRO 51 -8.913 -6.475 2.458
374 HD3 PRO 51 HD3 PRO 51 -10.092 -7.787 2.145
375 H GLU 52 H GLU 52 -13.769 -3.642 2.483
376 HA GLU 52 HA GLU 52 -12.424 -1.290 2.131
377 HB2 GLU 52 HB2 GLU 52 -15.045 -2.048 3.228
378 HB3 GLU 52 HB3 GLU 52 -14.451 -0.538 3.886
379 HG2 GLU 52 HG2 GLU 52 -13.913 0.030 1.354
380 HG3 GLU 52 HG3 GLU 52 -15.154 -1.179 1.035
381 H GLN 53 H GLN 53 -12.886 -2.880 5.283
382 HA GLN 53 HA GLN 53 -12.013 -0.711 6.872
383 HB2 GLN 53 HB2 GLN 53 -11.685 -3.664 7.494
384 HB3 GLN 53 HB3 GLN 53 -11.765 -2.342 8.653
385 HG2 GLN 53 HG2 GLN 53 -14.034 -3.302 6.854
386 HG3 GLN 53 HG3 GLN 53 -13.852 -3.666 8.552
387 HE21 GLN 53 HE21 GLN 53 -16.167 -2.754 8.076
388 HE22 GLN 53 HE22 GLN 53 -16.365 -1.019 8.372
389 H PHE 54 H PHE 54 -10.094 -3.393 5.412
390 HA PHE 54 HA PHE 54 -7.650 -2.287 6.639
391 HB2 PHE 54 HB2 PHE 54 -7.590 -4.623 6.516
392 HB3 PHE 54 HB3 PHE 54 -8.231 -4.646 4.875
393 HD1 PHE 54 HD1 PHE 54 -6.852 -4.890 3.096
394 HD2 PHE 54 HD2 PHE 54 -5.224 -3.321 6.753
395 HE1 PHE 54 HE1 PHE 54 -4.611 -4.675 2.007
396 HE2 PHE 54 HE2 PHE 54 -2.992 -3.116 5.691
397 HZ PHE 54 HZ PHE 54 -2.682 -3.770 3.314
398 H ARG 55 H ARG 55 -9.108 -2.531 3.325
399 HA ARG 55 HA ARG 55 -7.049 -1.315 1.935
400 HB2 ARG 55 HB2 ARG 55 -8.395 -1.378 0.169
401 HB3 ARG 55 HB3 ARG 55 -9.362 -2.343 1.225
402 HG2 ARG 55 HG2 ARG 55 -10.950 -0.976 0.283
403 HG3 ARG 55 HG3 ARG 55 -10.632 -0.195 1.827
404 HD2 ARG 55 HD2 ARG 55 -8.948 1.282 0.353
405 HD3 ARG 55 HD3 ARG 55 -9.980 0.728 -0.968
406 HE ARG 55 HE ARG 55 -10.643 2.601 1.193
407 HH11 ARG 55 HH11 ARG 55 -12.097 0.787 -1.565
408 HH12 ARG 55 HH12 ARG 55 -13.685 1.328 -1.105
409 HH21 ARG 55 HH21 ARG 55 -12.690 3.435 1.474
410 HH22 ARG 55 HH22 ARG 55 -14.027 2.798 0.528
411 H HIS 56 H HIS 56 -9.569 0.260 3.907
412 HA HIS 56 HA HIS 56 -8.993 2.949 3.171
413 HB2 HIS 56 HB2 HIS 56 -11.020 2.332 4.271
414 HB3 HIS 56 HB3 HIS 56 -10.173 1.574 5.622
415 HD1 HIS 56 HD1 HIS 56 -11.332 3.038 7.465
416 HD2 HIS 56 HD2 HIS 56 -9.371 5.182 4.392
417 HE1 HIS 56 HE1 HIS 56 -11.173 5.471 8.240
418 H ALA 57 H ALA 57 -7.484 0.745 5.623
419 HA ALA 57 HA ALA 57 -6.006 2.768 6.961
420 HB1 ALA 57 HB1 ALA 57 -4.844 0.943 7.983
421 HB2 ALA 57 HB2 ALA 57 -6.529 0.427 7.794
422 HB3 ALA 57 HB3 ALA 57 -5.285 -0.174 6.678
423 H ILE 58 H ILE 58 -5.062 0.454 4.344
424 HA ILE 58 HA ILE 58 -2.411 1.436 4.096
425 HB ILE 58 HB ILE 58 -2.768 -0.667 3.234
426 HG12 ILE 58 HG12 ILE 58 -2.758 1.213 0.800
427 HG13 ILE 58 HG13 ILE 58 -1.347 0.707 1.750
428 HG21 ILE 58 HG21 ILE 58 -5.240 -0.605 2.949
429 HG22 ILE 58 HG22 ILE 58 -4.983 0.120 1.340
430 HG23 ILE 58 HG23 ILE 58 -4.387 -1.497 1.750
431 HD11 ILE 58 HD11 ILE 58 -2.230 -1.717 0.950
432 HD12 ILE 58 HD12 ILE 58 -2.935 -0.733 -0.340
433 HD13 ILE 58 HD13 ILE 58 -1.186 -0.716 -0.076
434 H TRP 59 H TRP 59 -5.369 2.131 2.196
435 HA TRP 59 HA TRP 59 -4.135 4.006 0.496
436 HB2 TRP 59 HB2 TRP 59 -6.478 2.833 0.398
437 HB3 TRP 59 HB3 TRP 59 -7.046 4.290 1.190
438 HD1 TRP 59 HD1 TRP 59 -4.996 3.211 -1.935
439 HE1 TRP 59 HE1 TRP 59 -5.425 4.788 -3.848
440 HE3 TRP 59 HE3 TRP 59 -7.878 6.634 0.544
441 HZ2 TRP 59 HZ2 TRP 59 -7.000 7.211 -4.328
442 HZ3 TRP 59 HZ3 TRP 59 -8.799 8.608 -0.682
443 HH2 TRP 59 HH2 TRP 59 -8.384 8.876 -3.118
444 H LYS 60 H LYS 60 -6.147 4.757 3.469
445 HA LYS 60 HA LYS 60 -5.590 7.507 3.351
446 HB2 LYS 60 HB2 LYS 60 -7.298 6.438 4.831
447 HB3 LYS 60 HB3 LYS 60 -5.988 5.783 5.830
448 HG2 LYS 60 HG2 LYS 60 -7.035 7.783 6.813
449 HG3 LYS 60 HG3 LYS 60 -5.313 8.015 6.507
450 HD2 LYS 60 HD2 LYS 60 -5.764 9.431 4.566
451 HD3 LYS 60 HD3 LYS 60 -7.474 8.972 4.588
452 HE2 LYS 60 HE2 LYS 60 -7.351 11.157 5.523
453 HE3 LYS 60 HE3 LYS 60 -7.696 10.028 6.843
454 HZ1 LYS 60 HZ1 LYS 60 -5.188 11.464 6.271
455 HZ2 LYS 60 HZ2 LYS 60 -5.204 10.113 7.251
456 HZ3 LYS 60 HZ3 LYS 60 -6.090 11.421 7.648
457 H GLY 61 H GLY 61 -3.621 4.844 4.736
458 HA2 GLY 61 HA2 GLY 61 -1.751 6.428 6.111
459 HA3 GLY 61 HA3 GLY 61 -1.442 4.823 5.419
460 H ILE 62 H ILE 62 -1.580 5.192 2.700
461 HA ILE 62 HA ILE 62 0.896 6.631 2.267
462 HB ILE 62 HB ILE 62 0.346 4.664 1.174
463 HG12 ILE 62 HG12 ILE 62 0.834 7.060 -0.684
464 HG13 ILE 62 HG13 ILE 62 2.048 6.209 0.262
465 HG21 ILE 62 HG21 ILE 62 -1.089 4.378 -0.775
466 HG22 ILE 62 HG22 ILE 62 -2.026 4.879 0.618
467 HG23 ILE 62 HG23 ILE 62 -1.627 6.058 -0.650
468 HD11 ILE 62 HD11 ILE 62 0.579 5.217 -2.204
469 HD12 ILE 62 HD12 ILE 62 2.285 5.640 -2.059
470 HD13 ILE 62 HD13 ILE 62 1.669 4.201 -1.224
471 H LEU 63 H LEU 63 -2.470 7.281 1.520
472 HA LEU 63 HA LEU 63 -2.049 9.656 -0.043
473 HB2 LEU 63 HB2 LEU 63 -4.335 8.615 1.656
474 HB3 LEU 63 HB3 LEU 63 -4.352 10.298 1.210
475 HG LEU 63 HG LEU 63 -5.696 8.912 -0.286
476 HD11 LEU 63 HD11 LEU 63 -5.014 9.901 -2.334
477 HD12 LEU 63 HD12 LEU 63 -3.359 10.186 -1.758
478 HD13 LEU 63 HD13 LEU 63 -4.725 11.076 -1.031
479 HD21 LEU 63 HD21 LEU 63 -4.471 6.842 -0.517
480 HD22 LEU 63 HD22 LEU 63 -3.063 7.687 -1.179
481 HD23 LEU 63 HD23 LEU 63 -4.558 7.600 -2.100
482 H ASP 64 H ASP 64 -2.032 8.986 3.374
483 HA ASP 64 HA ASP 64 -1.972 11.812 4.233
484 HB2 ASP 64 HB2 ASP 64 -2.864 10.067 5.694
485 HB3 ASP 64 HB3 ASP 64 -1.288 9.256 5.734
486 H HIS 65 H HIS 65 0.345 9.293 3.628
487 HA HIS 65 HA HIS 65 2.653 10.599 4.687
488 HB2 HIS 65 HB2 HIS 65 2.639 8.168 4.249
489 HB3 HIS 65 HB3 HIS 65 2.482 8.464 2.520
490 HD1 HIS 65 HD1 HIS 65 4.998 10.121 5.026
491 HD2 HIS 65 HD2 HIS 65 4.752 7.966 1.416
492 HE1 HIS 65 HE1 HIS 65 7.370 9.958 4.131
493 H ARG 66 H ARG 66 1.441 10.236 1.317
494 HA ARG 66 HA ARG 66 3.352 12.126 0.318
495 HB2 ARG 66 HB2 ARG 66 2.190 12.025 -1.798
496 HB3 ARG 66 HB3 ARG 66 2.368 10.428 -1.109
497 HG2 ARG 66 HG2 ARG 66 0.209 10.234 -1.783
498 HG3 ARG 66 HG3 ARG 66 -0.082 10.891 -0.188
499 HD2 ARG 66 HD2 ARG 66 -1.420 12.316 -1.311
500 HD3 ARG 66 HD3 ARG 66 0.080 13.219 -1.506
501 HE ARG 66 HE ARG 66 -0.372 11.260 -3.653
502 HH11 ARG 66 HH11 ARG 66 -0.810 14.649 -2.675
503 HH12 ARG 66 HH12 ARG 66 -1.467 15.157 -4.182
504 HH21 ARG 66 HH21 ARG 66 -1.345 11.920 -5.654
505 HH22 ARG 66 HH22 ARG 66 -1.838 13.574 -5.867
506 H GLN 67 H GLN 67 0.104 12.580 1.814
507 HA GLN 67 HA GLN 67 -0.088 15.308 0.952
508 HB2 GLN 67 HB2 GLN 67 -1.973 13.918 1.532
509 HB3 GLN 67 HB3 GLN 67 -1.429 13.782 3.217
510 HG2 GLN 67 HG2 GLN 67 -1.778 16.532 2.133
511 HG3 GLN 67 HG3 GLN 67 -3.223 15.536 2.160
512 HE21 GLN 67 HE21 GLN 67 -1.130 17.468 4.146
513 HE22 GLN 67 HE22 GLN 67 -2.031 17.182 5.628
514 H LEU 68 H LEU 68 1.732 13.759 3.547
515 HA LEU 68 HA LEU 68 2.298 16.432 4.717
516 HB2 LEU 68 HB2 LEU 68 2.409 13.628 5.856
517 HB3 LEU 68 HB3 LEU 68 3.018 15.046 6.715
518 HG LEU 68 HG LEU 68 0.115 14.660 5.838
519 HD11 LEU 68 HD11 LEU 68 1.397 14.473 8.604
520 HD12 LEU 68 HD12 LEU 68 0.800 13.113 7.630
521 HD13 LEU 68 HD13 LEU 68 -0.344 14.310 8.217
522 HD21 LEU 68 HD21 LEU 68 0.672 17.048 5.948
523 HD22 LEU 68 HD22 LEU 68 1.439 16.821 7.529
524 HD23 LEU 68 HD23 LEU 68 -0.329 16.612 7.321
525 H HIS 69 H HIS 69 3.861 14.015 2.798
526 HA HIS 69 HA HIS 69 6.494 15.256 3.338
527 HB2 HIS 69 HB2 HIS 69 5.639 12.462 3.784
528 HB3 HIS 69 HB3 HIS 69 6.940 12.574 2.622
529 HD1 HIS 69 HD1 HIS 69 9.167 12.198 3.831
530 HD2 HIS 69 HD2 HIS 69 6.355 14.437 6.056
531 HE1 HIS 69 HE1 HIS 69 10.302 12.819 6.002
532 H ASP 70 H ASP 70 7.986 15.013 1.541
533 HA ASP 70 HA ASP 70 7.116 14.215 -1.074
534 HB2 ASP 70 HB2 ASP 70 7.422 16.480 -2.042
535 HB3 ASP 70 HB3 ASP 70 6.016 16.420 -0.990
Start of MODEL 18
1 H1 GLY 1 H GLY 1 16.669 -8.991 2.908
2 HA2 GLY 1 HA2 GLY 1 17.132 -9.024 0.553
3 HA3 GLY 1 HA3 GLY 1 16.481 -7.380 0.436
4 HA PRO 2 HA PRO 2 21.145 -7.461 1.768
5 HB2 PRO 2 HB2 PRO 2 22.532 -7.663 -0.614
6 HB3 PRO 2 HB3 PRO 2 22.155 -9.038 0.455
7 HG2 PRO 2 HG2 PRO 2 20.666 -8.169 -2.029
8 HG3 PRO 2 HG3 PRO 2 21.134 -9.824 -1.527
9 HD2 PRO 2 HD2 PRO 2 18.626 -8.837 -1.113
10 HD3 PRO 2 HD3 PRO 2 19.398 -9.937 0.069
11 H LEU 3 H LEU 3 20.130 -6.292 -1.512
12 HA LEU 3 HA LEU 3 20.934 -3.525 -0.734
13 HB2 LEU 3 HB2 LEU 3 19.973 -4.673 -3.387
14 HB3 LEU 3 HB3 LEU 3 20.378 -2.999 -3.088
15 HG LEU 3 HG LEU 3 22.135 -3.938 -4.318
16 HD11 LEU 3 HD11 LEU 3 24.060 -3.457 -2.989
17 HD12 LEU 3 HD12 LEU 3 23.209 -3.820 -1.482
18 HD13 LEU 3 HD13 LEU 3 22.767 -2.385 -2.445
19 HD21 LEU 3 HD21 LEU 3 21.731 -6.349 -3.739
20 HD22 LEU 3 HD22 LEU 3 22.645 -6.075 -2.231
21 HD23 LEU 3 HD23 LEU 3 23.424 -5.859 -3.793
22 H GLY 4 H GLY 4 19.336 -1.904 -0.806
23 HA2 GLY 4 HA2 GLY 4 16.817 -1.636 -1.537
24 HA3 GLY 4 HA3 GLY 4 16.579 -2.846 -0.282
25 H SER 5 H SER 5 18.963 -0.122 -0.189
26 HA SER 5 HA SER 5 18.263 0.594 2.452
27 HB2 SER 5 HB2 SER 5 19.567 2.368 0.348
28 HB3 SER 5 HB3 SER 5 19.712 2.490 2.109
29 HG SER 5 HG SER 5 21.498 1.513 1.211
30 H THR 6 H THR 6 16.593 1.472 -0.530
31 HA THR 6 HA THR 6 15.234 3.708 0.860
32 HB THR 6 HB THR 6 14.700 4.523 -1.354
33 HG1 THR 6 HG1 THR 6 14.732 3.209 -2.903
34 HG21 THR 6 HG21 THR 6 16.894 5.226 -2.084
35 HG22 THR 6 HG22 THR 6 17.686 3.943 -1.161
36 HG23 THR 6 HG23 THR 6 16.828 5.246 -0.319
37 H ASP 7 H ASP 7 12.896 3.975 0.045
38 HA ASP 7 HA ASP 7 11.498 1.419 0.484
39 HB2 ASP 7 HB2 ASP 7 10.681 4.338 0.631
40 HB3 ASP 7 HB3 ASP 7 9.558 3.042 0.813
41 H CYS 8 H CYS 8 10.600 0.370 -1.190
42 HA CYS 8 HA CYS 8 9.668 1.879 -3.553
43 HB2 CYS 8 HB2 CYS 8 10.874 0.356 -5.085
44 HB3 CYS 8 HB3 CYS 8 11.990 1.309 -4.098
45 HG CYS 8 HG CYS 8 10.911 -1.780 -3.528
46 H SER 9 H SER 9 9.076 -0.685 -1.276
47 HA SER 9 HA SER 9 6.912 -1.668 -3.045
48 HB2 SER 9 HB2 SER 9 8.939 -3.415 -1.606
49 HB3 SER 9 HB3 SER 9 7.493 -3.987 -2.470
50 HG SER 9 HG SER 9 8.386 -3.489 -4.371
51 H ILE 10 H ILE 10 5.129 -2.488 -1.905
52 HA ILE 10 HA ILE 10 4.329 -1.126 0.346
53 HB ILE 10 HB ILE 10 3.302 -3.787 -0.672
54 HG12 ILE 10 HG12 ILE 10 2.408 -0.906 -1.121
55 HG13 ILE 10 HG13 ILE 10 3.240 -1.925 -2.262
56 HG21 ILE 10 HG21 ILE 10 1.196 -3.298 0.485
57 HG22 ILE 10 HG22 ILE 10 2.512 -3.470 1.608
58 HG23 ILE 10 HG23 ILE 10 1.934 -1.838 1.198
59 HD11 ILE 10 HD11 ILE 10 1.001 -2.104 -2.982
60 HD12 ILE 10 HD12 ILE 10 1.223 -3.558 -2.007
61 HD13 ILE 10 HD13 ILE 10 0.376 -2.160 -1.327
62 H VAL 11 H VAL 11 6.238 -4.044 0.279
63 HA VAL 11 HA VAL 11 5.735 -5.036 2.847
64 HB VAL 11 HB VAL 11 8.258 -5.594 2.847
65 HG11 VAL 11 HG11 VAL 11 6.344 -6.488 0.648
66 HG12 VAL 11 HG12 VAL 11 7.787 -7.402 1.162
67 HG13 VAL 11 HG13 VAL 11 6.449 -7.143 2.297
68 HG21 VAL 11 HG21 VAL 11 8.982 -3.893 1.124
69 HG22 VAL 11 HG22 VAL 11 9.422 -5.559 0.731
70 HG23 VAL 11 HG23 VAL 11 8.051 -4.805 -0.087
71 H SER 12 H SER 12 7.965 -2.324 2.086
72 HA SER 12 HA SER 12 8.721 -1.962 4.846
73 HB2 SER 12 HB2 SER 12 9.901 -1.204 2.676
74 HB3 SER 12 HB3 SER 12 8.753 0.145 2.660
75 HG SER 12 HG SER 12 10.518 0.879 3.674
76 H PHE 13 H PHE 13 6.207 -0.488 2.720
77 HA PHE 13 HA PHE 13 5.385 1.477 4.601
78 HB2 PHE 13 HB2 PHE 13 4.871 1.640 2.246
79 HB3 PHE 13 HB3 PHE 13 4.015 0.115 2.257
80 HD1 PHE 13 HD1 PHE 13 1.778 0.603 1.694
81 HD2 PHE 13 HD2 PHE 13 3.776 3.084 4.629
82 HE1 PHE 13 HE1 PHE 13 -0.366 1.764 2.243
83 HE2 PHE 13 HE2 PHE 13 1.617 4.151 5.175
84 HZ PHE 13 HZ PHE 13 -0.460 3.412 4.057
85 H PHE 14 H PHE 14 4.195 -1.826 3.962
86 HA PHE 14 HA PHE 14 2.146 -1.847 5.911
87 HB2 PHE 14 HB2 PHE 14 3.658 -3.917 4.320
88 HB3 PHE 14 HB3 PHE 14 2.728 -4.450 5.684
89 HD1 PHE 14 HD1 PHE 14 1.426 -5.786 4.054
90 HD2 PHE 14 HD2 PHE 14 1.330 -1.496 3.942
91 HE1 PHE 14 HE1 PHE 14 -0.580 -5.876 2.594
92 HE2 PHE 14 HE2 PHE 14 -0.691 -1.575 2.579
93 HZ PHE 14 HZ PHE 14 -1.653 -3.792 1.858
94 H ALA 15 H ALA 15 5.585 -2.614 6.119
95 HA ALA 15 HA ALA 15 5.571 -3.723 8.734
96 HB1 ALA 15 HB1 ALA 15 7.583 -3.783 7.277
97 HB2 ALA 15 HB2 ALA 15 7.756 -2.021 7.423
98 HB3 ALA 15 HB3 ALA 15 7.951 -3.047 8.845
99 H ARG 16 H ARG 16 5.826 -0.292 7.592
100 HA ARG 16 HA ARG 16 5.922 0.813 10.241
101 HB2 ARG 16 HB2 ARG 16 4.869 2.023 7.652
102 HB3 ARG 16 HB3 ARG 16 5.113 2.934 9.134
103 HG2 ARG 16 HG2 ARG 16 7.362 1.503 7.646
104 HG3 ARG 16 HG3 ARG 16 6.861 3.164 7.384
105 HD2 ARG 16 HD2 ARG 16 8.735 3.286 8.874
106 HD3 ARG 16 HD3 ARG 16 7.310 3.640 9.832
107 HE ARG 16 HE ARG 16 7.668 1.797 11.104
108 HH11 ARG 16 HH11 ARG 16 9.925 1.591 8.351
109 HH12 ARG 16 HH12 ARG 16 10.540 0.037 8.816
110 HH21 ARG 16 HH21 ARG 16 8.379 -0.317 11.575
111 HH22 ARG 16 HH22 ARG 16 9.775 -0.992 10.747
112 H LEU 17 H LEU 17 3.109 0.059 8.172
113 HA LEU 17 HA LEU 17 1.192 1.214 9.990
114 HB2 LEU 17 HB2 LEU 17 0.692 -1.224 8.219
115 HB3 LEU 17 HB3 LEU 17 -0.522 -0.175 8.956
116 HG LEU 17 HG LEU 17 1.472 0.559 6.836
117 HD11 LEU 17 HD11 LEU 17 -1.526 0.206 6.660
118 HD12 LEU 17 HD12 LEU 17 -0.234 -0.777 5.912
119 HD13 LEU 17 HD13 LEU 17 -0.499 0.875 5.370
120 HD21 LEU 17 HD21 LEU 17 -0.687 2.274 8.178
121 HD22 LEU 17 HD22 LEU 17 0.155 2.750 6.688
122 HD23 LEU 17 HD23 LEU 17 1.067 2.573 8.177
123 H GLY 18 H GLY 18 2.480 -2.123 9.728
124 HA2 GLY 18 HA2 GLY 18 3.025 -3.434 11.604
125 HA3 GLY 18 HA3 GLY 18 1.796 -2.624 12.573
126 H CYS 19 H CYS 19 1.357 -3.819 9.189
127 HA CYS 19 HA CYS 19 -0.957 -5.384 10.174
128 HB2 CYS 19 HB2 CYS 19 -1.647 -5.589 7.968
129 HB3 CYS 19 HB3 CYS 19 -1.030 -3.930 8.140
130 HG CYS 19 HG CYS 19 -0.205 -4.437 5.939
131 H SER 20 H SER 20 -1.161 -7.743 9.322
132 HA SER 20 HA SER 20 1.529 -9.059 9.375
133 HB2 SER 20 HB2 SER 20 -0.919 -9.869 10.973
134 HB3 SER 20 HB3 SER 20 0.653 -10.697 10.952
135 HG SER 20 HG SER 20 -0.099 -8.729 12.516
136 H SER 21 H SER 21 -1.932 -10.024 9.095
137 HA SER 21 HA SER 21 -1.374 -12.142 7.265
138 HB2 SER 21 HB2 SER 21 -3.918 -10.581 7.937
139 HB3 SER 21 HB3 SER 21 -3.880 -12.055 6.966
140 HG SER 21 HG SER 21 -3.084 -11.807 9.720
141 H CYS 22 H CYS 22 -2.196 -8.708 6.796
142 HA CYS 22 HA CYS 22 -2.945 -8.861 4.125
143 HB2 CYS 22 HB2 CYS 22 -1.590 -6.426 5.357
144 HB3 CYS 22 HB3 CYS 22 -2.901 -6.468 4.185
145 HG CYS 22 HG CYS 22 -4.464 -7.892 6.027
146 H LEU 23 H LEU 23 0.225 -8.343 5.609
147 HA LEU 23 HA LEU 23 1.533 -7.727 3.118
148 HB2 LEU 23 HB2 LEU 23 3.471 -7.505 4.303
149 HB3 LEU 23 HB3 LEU 23 2.295 -7.211 5.553
150 HG LEU 23 HG LEU 23 2.665 -9.876 5.968
151 HD11 LEU 23 HD11 LEU 23 5.351 -8.878 4.932
152 HD12 LEU 23 HD12 LEU 23 4.351 -10.111 4.136
153 HD13 LEU 23 HD13 LEU 23 5.034 -10.434 5.729
154 HD21 LEU 23 HD21 LEU 23 4.353 -7.572 6.949
155 HD22 LEU 23 HD22 LEU 23 4.339 -9.183 7.695
156 HD23 LEU 23 HD23 LEU 23 2.871 -8.194 7.676
157 H ASP 24 H ASP 24 0.850 -10.767 4.857
158 HA ASP 24 HA ASP 24 2.581 -12.388 3.246
159 HB2 ASP 24 HB2 ASP 24 1.633 -13.234 5.328
160 HB3 ASP 24 HB3 ASP 24 0.002 -13.087 4.668
161 H TYR 25 H TYR 25 -0.909 -11.610 3.001
162 HA TYR 25 HA TYR 25 -1.385 -12.954 0.579
163 HB2 TYR 25 HB2 TYR 25 -2.607 -10.302 1.422
164 HB3 TYR 25 HB3 TYR 25 -3.270 -11.439 0.267
165 HD1 TYR 25 HD1 TYR 25 -4.749 -10.237 2.556
166 HD2 TYR 25 HD2 TYR 25 -2.503 -13.925 2.330
167 HE1 TYR 25 HE1 TYR 25 -6.313 -11.278 4.132
168 HE2 TYR 25 HE2 TYR 25 -4.014 -14.934 3.993
169 HH TYR 25 HH TYR 25 -6.280 -14.682 4.850
170 H PHE 26 H PHE 26 -0.501 -9.459 0.970
171 HA PHE 26 HA PHE 26 -0.323 -8.881 -1.754
172 HB2 PHE 26 HB2 PHE 26 0.711 -7.653 0.749
173 HB3 PHE 26 HB3 PHE 26 1.687 -7.294 -0.661
174 HD1 PHE 26 HD1 PHE 26 0.793 -6.115 -2.611
175 HD2 PHE 26 HD2 PHE 26 -1.600 -6.859 0.857
176 HE1 PHE 26 HE1 PHE 26 -0.908 -4.569 -3.509
177 HE2 PHE 26 HE2 PHE 26 -3.388 -5.374 -0.056
178 HZ PHE 26 HZ PHE 26 -3.095 -4.362 -2.306
179 H THR 27 H THR 27 2.368 -9.950 0.336
180 HA THR 27 HA THR 27 4.302 -9.857 -1.740
181 HB THR 27 HB THR 27 5.682 -11.219 -0.158
182 HG1 THR 27 HG1 THR 27 3.432 -11.036 1.553
183 HG21 THR 27 HG21 THR 27 5.727 -9.552 1.688
184 HG22 THR 27 HG22 THR 27 4.253 -8.812 1.063
185 HG23 THR 27 HG23 THR 27 5.727 -8.818 0.073
186 H THR 28 H THR 28 2.434 -12.746 -0.515
187 HA THR 28 HA THR 28 3.651 -14.484 -2.405
188 HB THR 28 HB THR 28 1.054 -14.603 -0.828
189 HG1 THR 28 HG1 THR 28 2.378 -15.927 0.449
190 HG21 THR 28 HG21 THR 28 2.402 -16.753 -2.533
191 HG22 THR 28 HG22 THR 28 0.739 -16.152 -2.677
192 HG23 THR 28 HG23 THR 28 1.217 -17.097 -1.259
193 H GLN 29 H GLN 29 0.782 -12.316 -2.741
194 HA GLN 29 HA GLN 29 0.004 -13.448 -5.271
195 HB2 GLN 29 HB2 GLN 29 -0.468 -10.732 -4.006
196 HB3 GLN 29 HB3 GLN 29 -1.247 -11.292 -5.498
197 HG2 GLN 29 HG2 GLN 29 -1.578 -12.874 -2.947
198 HG3 GLN 29 HG3 GLN 29 -2.551 -11.446 -3.264
199 HE21 GLN 29 HE21 GLN 29 -2.680 -14.660 -3.340
200 HE22 GLN 29 HE22 GLN 29 -3.783 -14.952 -4.681
201 H GLY 30 H GLY 30 2.625 -11.388 -4.383
202 HA2 GLY 30 HA2 GLY 30 4.373 -10.476 -5.578
203 HA3 GLY 30 HA3 GLY 30 3.784 -11.351 -6.998
204 H LEU 31 H LEU 31 1.887 -9.024 -5.200
205 HA LEU 31 HA LEU 31 2.024 -7.059 -7.467
206 HB2 LEU 31 HB2 LEU 31 -0.444 -6.648 -6.996
207 HB3 LEU 31 HB3 LEU 31 0.028 -8.116 -7.826
208 HG LEU 31 HG LEU 31 -0.190 -9.398 -5.761
209 HD11 LEU 31 HD11 LEU 31 -1.240 -6.830 -4.559
210 HD12 LEU 31 HD12 LEU 31 0.166 -7.792 -4.017
211 HD13 LEU 31 HD13 LEU 31 -1.465 -8.429 -3.826
212 HD21 LEU 31 HD21 LEU 31 -2.705 -7.876 -6.440
213 HD22 LEU 31 HD22 LEU 31 -2.611 -9.446 -5.621
214 HD23 LEU 31 HD23 LEU 31 -2.059 -9.308 -7.296
215 H THR 32 H THR 32 3.403 -7.130 -4.785
216 HA THR 32 HA THR 32 2.221 -4.804 -3.411
217 HB THR 32 HB THR 32 3.132 -5.976 -1.722
218 HG1 THR 32 HG1 THR 32 5.758 -5.628 -2.071
219 HG21 THR 32 HG21 THR 32 5.191 -7.276 -3.544
220 HG22 THR 32 HG22 THR 32 3.667 -7.999 -2.980
221 HG23 THR 32 HG23 THR 32 4.935 -7.631 -1.818
222 H THR 33 H THR 33 2.577 -2.675 -4.148
223 HA THR 33 HA THR 33 5.287 -1.984 -4.730
224 HB THR 33 HB THR 33 5.066 -2.357 -6.942
225 HG1 THR 33 HG1 THR 33 4.833 -0.517 -7.736
226 HG21 THR 33 HG21 THR 33 3.098 -3.854 -6.855
227 HG22 THR 33 HG22 THR 33 2.979 -2.788 -8.224
228 HG23 THR 33 HG23 THR 33 1.991 -2.470 -6.771
229 H ILE 34 H ILE 34 5.540 0.271 -4.479
230 HA ILE 34 HA ILE 34 3.439 1.571 -2.903
231 HB ILE 34 HB ILE 34 6.097 2.783 -3.738
232 HG12 ILE 34 HG12 ILE 34 6.407 0.675 -2.448
233 HG13 ILE 34 HG13 ILE 34 7.054 2.118 -1.704
234 HG21 ILE 34 HG21 ILE 34 4.078 3.492 -1.562
235 HG22 ILE 34 HG22 ILE 34 5.728 4.116 -1.598
236 HG23 ILE 34 HG23 ILE 34 4.604 4.518 -2.917
237 HD11 ILE 34 HD11 ILE 34 4.367 0.822 -0.945
238 HD12 ILE 34 HD12 ILE 34 5.876 0.613 -0.045
239 HD13 ILE 34 HD13 ILE 34 5.139 2.188 -0.106
240 H TYR 35 H TYR 35 5.081 2.246 -5.936
241 HA TYR 35 HA TYR 35 3.753 4.610 -6.642
242 HB2 TYR 35 HB2 TYR 35 5.192 2.486 -8.281
243 HB3 TYR 35 HB3 TYR 35 4.658 4.034 -8.917
244 HD1 TYR 35 HD1 TYR 35 6.821 2.620 -6.095
245 HD2 TYR 35 HD2 TYR 35 6.053 5.906 -8.807
246 HE1 TYR 35 HE1 TYR 35 8.663 3.837 -5.090
247 HE2 TYR 35 HE2 TYR 35 8.019 7.075 -7.927
248 HH TYR 35 HH TYR 35 9.778 6.019 -5.059
249 H GLN 36 H GLN 36 2.782 1.237 -6.979
250 HA GLN 36 HA GLN 36 0.647 1.901 -8.885
251 HB2 GLN 36 HB2 GLN 36 1.305 -0.558 -7.245
252 HB3 GLN 36 HB3 GLN 36 -0.139 -0.451 -8.237
253 HG2 GLN 36 HG2 GLN 36 2.657 -0.162 -9.374
254 HG3 GLN 36 HG3 GLN 36 1.681 -1.631 -9.404
255 HE21 GLN 36 HE21 GLN 36 2.011 1.613 -10.888
256 HE22 GLN 36 HE22 GLN 36 0.815 1.304 -12.100
257 H ILE 37 H ILE 37 0.788 1.324 -5.278
258 HA ILE 37 HA ILE 37 -2.050 1.666 -5.041
259 HB ILE 37 HB ILE 37 -1.662 1.982 -2.632
260 HG12 ILE 37 HG12 ILE 37 1.250 1.532 -3.302
261 HG13 ILE 37 HG13 ILE 37 0.575 3.040 -2.665
262 HG21 ILE 37 HG21 ILE 37 -1.107 -0.345 -2.318
263 HG22 ILE 37 HG22 ILE 37 -1.956 -0.215 -3.865
264 HG23 ILE 37 HG23 ILE 37 -0.189 -0.391 -3.836
265 HD11 ILE 37 HD11 ILE 37 0.632 0.346 -1.242
266 HD12 ILE 37 HD12 ILE 37 1.732 1.693 -0.964
267 HD13 ILE 37 HD13 ILE 37 -0.005 1.861 -0.569
268 H GLU 38 H GLU 38 0.425 3.983 -5.612
269 HA GLU 38 HA GLU 38 -1.013 6.187 -4.430
270 HB2 GLU 38 HB2 GLU 38 1.509 6.007 -5.028
271 HB3 GLU 38 HB3 GLU 38 1.009 6.393 -6.682
272 HG2 GLU 38 HG2 GLU 38 -0.091 8.487 -5.788
273 HG3 GLU 38 HG3 GLU 38 0.490 8.067 -4.171
274 H HIS 39 H HIS 39 -1.456 4.282 -7.336
275 HA HIS 39 HA HIS 39 -3.291 6.364 -8.479
276 HB2 HIS 39 HB2 HIS 39 -1.177 5.508 -9.733
277 HB3 HIS 39 HB3 HIS 39 -2.065 4.011 -9.947
278 HD1 HIS 39 HD1 HIS 39 -1.045 6.090 -12.243
279 HD2 HIS 39 HD2 HIS 39 -4.980 5.588 -10.806
280 HE1 HIS 39 HE1 HIS 39 -2.606 6.812 -14.116
281 H TYR 40 H TYR 40 -2.966 2.980 -7.318
282 HA TYR 40 HA TYR 40 -5.535 2.142 -8.270
283 HB2 TYR 40 HB2 TYR 40 -3.591 0.981 -6.233
284 HB3 TYR 40 HB3 TYR 40 -5.172 0.286 -6.496
285 HD1 TYR 40 HD1 TYR 40 -2.069 -0.876 -7.082
286 HD2 TYR 40 HD2 TYR 40 -5.443 0.528 -9.503
287 HE1 TYR 40 HE1 TYR 40 -1.469 -2.367 -8.906
288 HE2 TYR 40 HE2 TYR 40 -4.762 -0.936 -11.287
289 HH TYR 40 HH TYR 40 -2.498 -3.525 -10.912
290 H SER 41 H SER 41 -7.184 3.357 -7.734
291 HA SER 41 HA SER 41 -7.496 4.643 -5.198
292 HB2 SER 41 HB2 SER 41 -9.574 5.450 -6.191
293 HB3 SER 41 HB3 SER 41 -8.347 5.462 -7.464
294 HG SER 41 HG SER 41 -9.575 4.187 -8.562
295 H MET 42 H MET 42 -9.803 4.485 -4.202
296 HA MET 42 HA MET 42 -10.001 2.154 -2.703
297 HB2 MET 42 HB2 MET 42 -12.292 2.930 -2.120
298 HB3 MET 42 HB3 MET 42 -11.084 4.200 -1.971
299 HG2 MET 42 HG2 MET 42 -11.854 5.302 -3.923
300 HG3 MET 42 HG3 MET 42 -12.785 3.918 -4.482
301 HE1 MET 42 HE1 MET 42 -14.668 2.852 -2.394
302 HE2 MET 42 HE2 MET 42 -16.045 3.961 -2.511
303 HE3 MET 42 HE3 MET 42 -15.211 3.434 -3.988
304 H ASP 43 H ASP 43 -11.291 2.674 -5.917
305 HA ASP 43 HA ASP 43 -13.233 0.515 -5.842
306 HB2 ASP 43 HB2 ASP 43 -13.493 2.467 -7.295
307 HB3 ASP 43 HB3 ASP 43 -11.964 2.079 -8.102
308 H ASP 44 H ASP 44 -10.009 1.016 -7.349
309 HA ASP 44 HA ASP 44 -9.850 -1.638 -8.386
310 HB2 ASP 44 HB2 ASP 44 -8.068 0.692 -8.176
311 HB3 ASP 44 HB3 ASP 44 -7.191 -0.806 -7.909
312 H LEU 45 H LEU 45 -9.015 -0.233 -5.300
313 HA LEU 45 HA LEU 45 -7.628 -2.545 -4.239
314 HB2 LEU 45 HB2 LEU 45 -9.041 -0.222 -2.845
315 HB3 LEU 45 HB3 LEU 45 -8.025 -1.398 -2.007
316 HG LEU 45 HG LEU 45 -7.001 0.320 -4.314
317 HD11 LEU 45 HD11 LEU 45 -7.748 1.706 -2.369
318 HD12 LEU 45 HD12 LEU 45 -6.032 1.757 -2.692
319 HD13 LEU 45 HD13 LEU 45 -6.630 0.785 -1.327
320 HD21 LEU 45 HD21 LEU 45 -4.823 -0.300 -3.551
321 HD22 LEU 45 HD22 LEU 45 -5.717 -1.750 -3.913
322 HD23 LEU 45 HD23 LEU 45 -5.525 -1.261 -2.215
323 H ALA 46 H ALA 46 -11.019 -1.368 -3.955
324 HA ALA 46 HA ALA 46 -11.925 -3.548 -2.366
325 HB1 ALA 46 HB1 ALA 46 -13.184 -1.469 -2.680
326 HB2 ALA 46 HB2 ALA 46 -13.431 -1.869 -4.402
327 HB3 ALA 46 HB3 ALA 46 -14.167 -2.863 -3.125
328 H SER 47 H SER 47 -11.559 -3.182 -5.874
329 HA SER 47 HA SER 47 -12.757 -5.603 -6.719
330 HB2 SER 47 HB2 SER 47 -12.283 -3.685 -8.170
331 HB3 SER 47 HB3 SER 47 -10.559 -3.844 -7.886
332 HG SER 47 HG SER 47 -11.155 -4.608 -9.848
333 H LEU 48 H LEU 48 -9.433 -4.846 -5.630
334 HA LEU 48 HA LEU 48 -8.367 -7.477 -6.049
335 HB2 LEU 48 HB2 LEU 48 -7.443 -5.086 -4.430
336 HB3 LEU 48 HB3 LEU 48 -6.521 -6.578 -4.458
337 HG LEU 48 HG LEU 48 -7.284 -5.136 -6.991
338 HD11 LEU 48 HD11 LEU 48 -6.005 -3.589 -5.561
339 HD12 LEU 48 HD12 LEU 48 -5.094 -4.080 -6.982
340 HD13 LEU 48 HD13 LEU 48 -4.717 -4.810 -5.396
341 HD21 LEU 48 HD21 LEU 48 -5.063 -7.131 -6.389
342 HD22 LEU 48 HD22 LEU 48 -5.394 -6.352 -7.956
343 HD23 LEU 48 HD23 LEU 48 -6.559 -7.478 -7.286
344 H LYS 49 H LYS 49 -10.860 -6.989 -4.169
345 HA LYS 49 HA LYS 49 -11.917 -8.120 -2.582
346 HB2 LYS 49 HB2 LYS 49 -9.504 -9.930 -2.243
347 HB3 LYS 49 HB3 LYS 49 -11.058 -10.127 -1.494
348 HG2 LYS 49 HG2 LYS 49 -11.106 -11.658 -3.207
349 HG3 LYS 49 HG3 LYS 49 -12.138 -10.339 -3.726
350 HD2 LYS 49 HD2 LYS 49 -10.796 -11.281 -5.562
351 HD3 LYS 49 HD3 LYS 49 -10.423 -9.584 -5.304
352 HE2 LYS 49 HE2 LYS 49 -8.427 -10.310 -3.929
353 HE3 LYS 49 HE3 LYS 49 -8.771 -11.977 -4.375
354 HZ1 LYS 49 HZ1 LYS 49 -7.091 -10.709 -5.776
355 HZ2 LYS 49 HZ2 LYS 49 -8.364 -9.908 -6.448
356 HZ3 LYS 49 HZ3 LYS 49 -8.245 -11.525 -6.589
357 H ILE 50 H ILE 50 -9.684 -5.959 -2.101
358 HA ILE 50 HA ILE 50 -9.000 -6.244 0.684
359 HB ILE 50 HB ILE 50 -9.081 -3.765 -1.055
360 HG12 ILE 50 HG12 ILE 50 -7.695 -5.510 -2.159
361 HG13 ILE 50 HG13 ILE 50 -6.731 -4.175 -1.614
362 HG21 ILE 50 HG21 ILE 50 -7.567 -2.722 0.379
363 HG22 ILE 50 HG22 ILE 50 -8.813 -3.436 1.435
364 HG23 ILE 50 HG23 ILE 50 -7.244 -4.220 1.249
365 HD11 ILE 50 HD11 ILE 50 -7.016 -6.862 -0.174
366 HD12 ILE 50 HD12 ILE 50 -5.654 -6.391 -1.204
367 HD13 ILE 50 HD13 ILE 50 -5.929 -5.562 0.328
368 HA PRO 51 HA PRO 51 -13.258 -5.138 1.734
369 HB2 PRO 51 HB2 PRO 51 -13.153 -5.321 4.475
370 HB3 PRO 51 HB3 PRO 51 -13.235 -6.734 3.376
371 HG2 PRO 51 HG2 PRO 51 -10.785 -5.532 4.681
372 HG3 PRO 51 HG3 PRO 51 -11.246 -7.256 4.586
373 HD2 PRO 51 HD2 PRO 51 -9.472 -6.113 2.846
374 HD3 PRO 51 HD3 PRO 51 -10.589 -7.410 2.336
375 H GLU 52 H GLU 52 -14.203 -3.164 2.254
376 HA GLU 52 HA GLU 52 -12.750 -0.853 2.081
377 HB2 GLU 52 HB2 GLU 52 -15.411 -1.133 3.470
378 HB3 GLU 52 HB3 GLU 52 -14.624 0.365 2.987
379 HG2 GLU 52 HG2 GLU 52 -14.499 -0.777 0.608
380 HG3 GLU 52 HG3 GLU 52 -15.838 -1.756 1.236
381 H GLN 53 H GLN 53 -13.521 -2.503 5.086
382 HA GLN 53 HA GLN 53 -12.901 -0.488 6.957
383 HB2 GLN 53 HB2 GLN 53 -12.602 -3.529 7.116
384 HB3 GLN 53 HB3 GLN 53 -12.392 -2.431 8.480
385 HG2 GLN 53 HG2 GLN 53 -14.581 -3.306 8.666
386 HG3 GLN 53 HG3 GLN 53 -14.726 -1.628 8.178
387 HE21 GLN 53 HE21 GLN 53 -15.328 -4.976 7.259
388 HE22 GLN 53 HE22 GLN 53 -16.184 -4.652 5.782
389 H PHE 54 H PHE 54 -10.766 -3.075 5.636
390 HA PHE 54 HA PHE 54 -8.379 -1.940 6.839
391 HB2 PHE 54 HB2 PHE 54 -8.499 -4.302 6.626
392 HB3 PHE 54 HB3 PHE 54 -8.970 -4.209 4.929
393 HD1 PHE 54 HD1 PHE 54 -7.450 -3.833 3.227
394 HD2 PHE 54 HD2 PHE 54 -6.075 -3.819 7.264
395 HE1 PHE 54 HE1 PHE 54 -5.069 -3.888 2.389
396 HE2 PHE 54 HE2 PHE 54 -3.748 -3.872 6.494
397 HZ PHE 54 HZ PHE 54 -3.214 -3.901 4.058
398 H ARG 55 H ARG 55 -9.809 -2.007 3.575
399 HA ARG 55 HA ARG 55 -7.859 -0.898 1.983
400 HB2 ARG 55 HB2 ARG 55 -10.056 -1.681 1.173
401 HB3 ARG 55 HB3 ARG 55 -10.828 -0.311 1.954
402 HG2 ARG 55 HG2 ARG 55 -8.701 0.272 -0.075
403 HG3 ARG 55 HG3 ARG 55 -10.247 -0.343 -0.657
404 HD2 ARG 55 HD2 ARG 55 -10.043 2.108 1.146
405 HD3 ARG 55 HD3 ARG 55 -10.010 2.188 -0.598
406 HE ARG 55 HE ARG 55 -12.262 0.776 -0.261
407 HH11 ARG 55 HH11 ARG 55 -11.224 3.910 1.242
408 HH12 ARG 55 HH12 ARG 55 -12.847 4.268 1.723
409 HH21 ARG 55 HH21 ARG 55 -14.497 1.645 0.068
410 HH22 ARG 55 HH22 ARG 55 -14.593 3.192 0.753
411 H HIS 56 H HIS 56 -10.173 0.933 4.089
412 HA HIS 56 HA HIS 56 -9.223 3.475 3.178
413 HB2 HIS 56 HB2 HIS 56 -11.366 3.158 4.373
414 HB3 HIS 56 HB3 HIS 56 -10.484 2.752 5.850
415 HD1 HIS 56 HD1 HIS 56 -9.287 4.881 7.148
416 HD2 HIS 56 HD2 HIS 56 -11.409 5.730 3.587
417 HE1 HIS 56 HE1 HIS 56 -9.579 7.383 7.064
418 H ALA 57 H ALA 57 -8.073 1.280 5.809
419 HA ALA 57 HA ALA 57 -6.322 3.184 6.988
420 HB1 ALA 57 HB1 ALA 57 -6.997 0.997 8.006
421 HB2 ALA 57 HB2 ALA 57 -5.924 0.176 6.831
422 HB3 ALA 57 HB3 ALA 57 -5.240 1.287 8.034
423 H ILE 58 H ILE 58 -5.650 0.695 4.483
424 HA ILE 58 HA ILE 58 -2.892 1.358 4.236
425 HB ILE 58 HB ILE 58 -3.552 -0.753 3.502
426 HG12 ILE 58 HG12 ILE 58 -3.086 0.986 0.999
427 HG13 ILE 58 HG13 ILE 58 -1.859 0.364 2.137
428 HG21 ILE 58 HG21 ILE 58 -5.151 -1.374 1.822
429 HG22 ILE 58 HG22 ILE 58 -5.951 -0.409 3.028
430 HG23 ILE 58 HG23 ILE 58 -5.524 0.312 1.451
431 HD11 ILE 58 HD11 ILE 58 -1.752 -1.062 0.271
432 HD12 ILE 58 HD12 ILE 58 -2.723 -1.974 1.467
433 HD13 ILE 58 HD13 ILE 58 -3.522 -1.107 0.154
434 H TRP 59 H TRP 59 -5.721 2.234 2.216
435 HA TRP 59 HA TRP 59 -4.185 3.869 0.483
436 HB2 TRP 59 HB2 TRP 59 -6.569 2.895 0.204
437 HB3 TRP 59 HB3 TRP 59 -7.118 4.377 0.988
438 HD1 TRP 59 HD1 TRP 59 -4.756 3.334 -1.875
439 HE1 TRP 59 HE1 TRP 59 -5.191 4.777 -3.929
440 HE3 TRP 59 HE3 TRP 59 -7.799 6.791 0.265
441 HZ2 TRP 59 HZ2 TRP 59 -6.933 7.041 -4.625
442 HZ3 TRP 59 HZ3 TRP 59 -8.893 8.563 -1.117
443 HH2 TRP 59 HH2 TRP 59 -8.499 8.664 -3.554
444 H LYS 60 H LYS 60 -6.209 4.854 3.308
445 HA LYS 60 HA LYS 60 -5.657 7.613 3.069
446 HB2 LYS 60 HB2 LYS 60 -7.396 6.621 4.602
447 HB3 LYS 60 HB3 LYS 60 -6.102 5.946 5.600
448 HG2 LYS 60 HG2 LYS 60 -7.028 7.915 6.639
449 HG3 LYS 60 HG3 LYS 60 -5.331 8.141 6.250
450 HD2 LYS 60 HD2 LYS 60 -6.599 10.154 5.770
451 HD3 LYS 60 HD3 LYS 60 -5.926 9.500 4.278
452 HE2 LYS 60 HE2 LYS 60 -8.092 8.467 3.702
453 HE3 LYS 60 HE3 LYS 60 -8.768 8.961 5.262
454 HZ1 LYS 60 HZ1 LYS 60 -9.414 10.408 3.457
455 HZ2 LYS 60 HZ2 LYS 60 -7.823 10.850 3.206
456 HZ3 LYS 60 HZ3 LYS 60 -8.545 11.220 4.620
457 H GLY 61 H GLY 61 -3.830 4.972 4.714
458 HA2 GLY 61 HA2 GLY 61 -1.991 6.631 6.035
459 HA3 GLY 61 HA3 GLY 61 -1.730 4.940 5.577
460 H ILE 62 H ILE 62 -1.662 4.963 2.825
461 HA ILE 62 HA ILE 62 0.915 6.131 2.458
462 HB ILE 62 HB ILE 62 -0.319 4.111 1.482
463 HG12 ILE 62 HG12 ILE 62 2.050 4.357 1.320
464 HG13 ILE 62 HG13 ILE 62 1.447 3.853 -0.246
465 HG21 ILE 62 HG21 ILE 62 -0.681 5.827 -0.934
466 HG22 ILE 62 HG22 ILE 62 -0.962 4.087 -0.799
467 HG23 ILE 62 HG23 ILE 62 -1.976 5.197 0.122
468 HD11 ILE 62 HD11 ILE 62 2.436 6.613 0.523
469 HD12 ILE 62 HD12 ILE 62 3.145 5.486 -0.623
470 HD13 ILE 62 HD13 ILE 62 1.606 6.268 -1.018
471 H LEU 63 H LEU 63 -2.359 7.147 1.302
472 HA LEU 63 HA LEU 63 -1.218 9.281 -0.291
473 HB2 LEU 63 HB2 LEU 63 -3.985 8.640 0.722
474 HB3 LEU 63 HB3 LEU 63 -3.627 10.283 0.230
475 HG LEU 63 HG LEU 63 -2.866 9.534 -1.991
476 HD11 LEU 63 HD11 LEU 63 -3.494 7.247 -2.778
477 HD12 LEU 63 HD12 LEU 63 -3.861 6.792 -1.103
478 HD13 LEU 63 HD13 LEU 63 -2.203 7.240 -1.580
479 HD21 LEU 63 HD21 LEU 63 -5.666 8.690 -1.168
480 HD22 LEU 63 HD22 LEU 63 -5.141 8.946 -2.839
481 HD23 LEU 63 HD23 LEU 63 -5.145 10.305 -1.701
482 H ASP 64 H ASP 64 -2.104 8.941 3.102
483 HA ASP 64 HA ASP 64 -1.887 11.807 3.724
484 HB2 ASP 64 HB2 ASP 64 -3.218 10.294 5.084
485 HB3 ASP 64 HB3 ASP 64 -1.765 9.341 5.501
486 H HIS 65 H HIS 65 0.249 9.060 3.882
487 HA HIS 65 HA HIS 65 2.466 10.201 5.227
488 HB2 HIS 65 HB2 HIS 65 2.088 7.781 5.056
489 HB3 HIS 65 HB3 HIS 65 2.235 7.847 3.304
490 HD1 HIS 65 HD1 HIS 65 4.622 9.148 6.120
491 HD2 HIS 65 HD2 HIS 65 4.430 6.723 2.662
492 HE1 HIS 65 HE1 HIS 65 6.961 8.170 5.776
493 H ARG 66 H ARG 66 1.923 9.504 1.691
494 HA ARG 66 HA ARG 66 4.315 10.925 0.998
495 HB2 ARG 66 HB2 ARG 66 3.677 10.666 -1.288
496 HB3 ARG 66 HB3 ARG 66 3.330 9.189 -0.417
497 HG2 ARG 66 HG2 ARG 66 1.403 9.291 -1.631
498 HG3 ARG 66 HG3 ARG 66 0.879 10.242 -0.243
499 HD2 ARG 66 HD2 ARG 66 0.166 11.401 -2.179
500 HD3 ARG 66 HD3 ARG 66 1.509 12.319 -1.483
501 HE ARG 66 HE ARG 66 2.299 10.392 -3.554
502 HH11 ARG 66 HH11 ARG 66 1.328 13.824 -2.974
503 HH12 ARG 66 HH12 ARG 66 2.224 14.344 -4.382
504 HH21 ARG 66 HH21 ARG 66 3.428 11.234 -5.335
505 HH22 ARG 66 HH22 ARG 66 3.343 12.940 -5.669
506 H GLN 67 H GLN 67 0.935 11.989 1.616
507 HA GLN 67 HA GLN 67 1.522 14.589 0.401
508 HB2 GLN 67 HB2 GLN 67 -0.737 13.631 2.148
509 HB3 GLN 67 HB3 GLN 67 -0.624 15.280 1.538
510 HG2 GLN 67 HG2 GLN 67 -0.510 12.917 -0.377
511 HG3 GLN 67 HG3 GLN 67 -2.038 13.564 0.191
512 HE21 GLN 67 HE21 GLN 67 -2.553 15.787 -0.335
513 HE22 GLN 67 HE22 GLN 67 -1.925 16.526 -1.787
514 H LEU 68 H LEU 68 1.957 13.261 3.695
515 HA LEU 68 HA LEU 68 2.534 15.921 4.815
516 HB2 LEU 68 HB2 LEU 68 2.557 13.093 5.933
517 HB3 LEU 68 HB3 LEU 68 3.151 14.465 6.859
518 HG LEU 68 HG LEU 68 0.310 14.310 5.778
519 HD11 LEU 68 HD11 LEU 68 -0.329 13.659 8.054
520 HD12 LEU 68 HD12 LEU 68 1.368 13.738 8.590
521 HD13 LEU 68 HD13 LEU 68 0.832 12.511 7.422
522 HD21 LEU 68 HD21 LEU 68 1.073 16.629 6.208
523 HD22 LEU 68 HD22 LEU 68 1.599 16.161 7.833
524 HD23 LEU 68 HD23 LEU 68 -0.116 16.133 7.399
525 H HIS 69 H HIS 69 4.409 12.939 4.104
526 HA HIS 69 HA HIS 69 6.550 12.403 4.273
527 HB2 HIS 69 HB2 HIS 69 6.198 13.523 2.098
528 HB3 HIS 69 HB3 HIS 69 6.800 15.016 2.802
529 HD1 HIS 69 HD1 HIS 69 8.473 11.498 3.248
530 HD2 HIS 69 HD2 HIS 69 9.005 15.223 1.355
531 HE1 HIS 69 HE1 HIS 69 10.749 11.423 2.158
532 H ASP 70 H ASP 70 5.784 13.276 6.615
533 HA ASP 70 HA ASP 70 7.368 15.360 7.841
534 HB2 ASP 70 HB2 ASP 70 6.251 14.780 9.785
535 HB3 ASP 70 HB3 ASP 70 5.031 14.532 8.529
Start of MODEL 19
1 H1 GLY 1 H GLY 1 12.928 -19.194 2.900
2 HA2 GLY 1 HA2 GLY 1 12.778 -19.975 0.560
3 HA3 GLY 1 HA3 GLY 1 11.316 -18.975 0.416
4 HA PRO 2 HA PRO 2 14.974 -16.395 -0.905
5 HB2 PRO 2 HB2 PRO 2 13.783 -15.233 -3.108
6 HB3 PRO 2 HB3 PRO 2 14.626 -16.797 -3.142
7 HG2 PRO 2 HG2 PRO 2 11.679 -16.297 -3.021
8 HG3 PRO 2 HG3 PRO 2 12.570 -17.551 -3.922
9 HD2 PRO 2 HD2 PRO 2 11.260 -17.960 -1.512
10 HD3 PRO 2 HD3 PRO 2 12.658 -18.926 -2.060
11 H LEU 3 H LEU 3 14.894 -15.007 0.858
12 HA LEU 3 HA LEU 3 13.013 -12.725 0.702
13 HB2 LEU 3 HB2 LEU 3 12.258 -14.584 2.301
14 HB3 LEU 3 HB3 LEU 3 13.667 -14.238 3.274
15 HG LEU 3 HG LEU 3 11.696 -13.223 4.189
16 HD11 LEU 3 HD11 LEU 3 13.290 -10.908 3.048
17 HD12 LEU 3 HD12 LEU 3 13.803 -11.913 4.432
18 HD13 LEU 3 HD13 LEU 3 12.323 -10.951 4.535
19 HD21 LEU 3 HD21 LEU 3 10.321 -11.594 3.102
20 HD22 LEU 3 HD22 LEU 3 10.399 -13.079 2.125
21 HD23 LEU 3 HD23 LEU 3 11.334 -11.627 1.641
22 H GLY 4 H GLY 4 14.766 -11.488 -0.145
23 HA2 GLY 4 HA2 GLY 4 16.306 -10.056 1.657
24 HA3 GLY 4 HA3 GLY 4 17.340 -11.401 1.152
25 H SER 5 H SER 5 15.971 -8.336 0.220
26 HA SER 5 HA SER 5 17.666 -8.174 -2.118
27 HB2 SER 5 HB2 SER 5 14.636 -7.972 -2.356
28 HB3 SER 5 HB3 SER 5 15.781 -7.410 -3.590
29 HG SER 5 HG SER 5 15.708 -10.051 -2.552
30 H THR 6 H THR 6 17.364 -5.770 -2.950
31 HA THR 6 HA THR 6 16.729 -3.982 -0.665
32 HB THR 6 HB THR 6 19.041 -2.945 -1.994
33 HG1 THR 6 HG1 THR 6 19.428 -5.235 -2.507
34 HG21 THR 6 HG21 THR 6 18.713 -4.205 0.760
35 HG22 THR 6 HG22 THR 6 18.339 -2.521 0.330
36 HG23 THR 6 HG23 THR 6 20.007 -3.103 0.255
37 H ASP 7 H ASP 7 14.842 -3.415 -1.588
38 HA ASP 7 HA ASP 7 14.857 -1.343 -3.572
39 HB2 ASP 7 HB2 ASP 7 14.831 -3.237 -5.145
40 HB3 ASP 7 HB3 ASP 7 13.532 -4.009 -4.225
41 H CYS 8 H CYS 8 13.075 -0.053 -3.124
42 HA CYS 8 HA CYS 8 11.576 -0.557 -0.693
43 HB2 CYS 8 HB2 CYS 8 11.384 1.532 -2.910
44 HB3 CYS 8 HB3 CYS 8 10.307 1.526 -1.513
45 HG CYS 8 HG CYS 8 13.519 1.159 -0.993
46 H SER 9 H SER 9 9.568 -1.512 -0.462
47 HA SER 9 HA SER 9 7.714 -1.779 -2.688
48 HB2 SER 9 HB2 SER 9 9.057 -4.190 -1.397
49 HB3 SER 9 HB3 SER 9 7.558 -4.273 -2.354
50 HG SER 9 HG SER 9 9.529 -2.827 -3.591
51 H ILE 10 H ILE 10 5.623 -2.750 -1.796
52 HA ILE 10 HA ILE 10 4.879 -1.335 0.478
53 HB ILE 10 HB ILE 10 3.650 -3.143 -1.366
54 HG12 ILE 10 HG12 ILE 10 3.350 -0.706 -1.159
55 HG13 ILE 10 HG13 ILE 10 1.853 -1.622 -1.293
56 HG21 ILE 10 HG21 ILE 10 3.152 -4.671 0.512
57 HG22 ILE 10 HG22 ILE 10 2.333 -3.366 1.354
58 HG23 ILE 10 HG23 ILE 10 1.704 -3.951 -0.200
59 HD11 ILE 10 HD11 ILE 10 2.322 0.308 0.602
60 HD12 ILE 10 HD12 ILE 10 1.149 -1.019 0.780
61 HD13 ILE 10 HD13 ILE 10 2.746 -1.141 1.513
62 H VAL 11 H VAL 11 6.448 -4.479 0.482
63 HA VAL 11 HA VAL 11 5.527 -5.353 3.015
64 HB VAL 11 HB VAL 11 7.849 -6.405 3.151
65 HG11 VAL 11 HG11 VAL 11 7.222 -8.137 1.500
66 HG12 VAL 11 HG12 VAL 11 5.810 -7.581 2.402
67 HG13 VAL 11 HG13 VAL 11 6.076 -7.014 0.738
68 HG21 VAL 11 HG21 VAL 11 9.168 -6.614 1.125
69 HG22 VAL 11 HG22 VAL 11 8.071 -5.568 0.218
70 HG23 VAL 11 HG23 VAL 11 9.072 -4.911 1.543
71 H SER 12 H SER 12 8.242 -3.117 2.234
72 HA SER 12 HA SER 12 9.003 -2.691 4.943
73 HB2 SER 12 HB2 SER 12 10.258 -2.252 2.740
74 HB3 SER 12 HB3 SER 12 9.317 -0.765 2.603
75 HG SER 12 HG SER 12 11.381 -0.533 3.565
76 H PHE 13 H PHE 13 6.705 -1.037 2.762
77 HA PHE 13 HA PHE 13 6.157 1.160 4.555
78 HB2 PHE 13 HB2 PHE 13 5.546 1.162 2.132
79 HB3 PHE 13 HB3 PHE 13 4.295 -0.025 2.468
80 HD1 PHE 13 HD1 PHE 13 2.061 0.813 2.903
81 HD2 PHE 13 HD2 PHE 13 5.463 3.372 3.559
82 HE1 PHE 13 HE1 PHE 13 0.528 2.739 3.311
83 HE2 PHE 13 HE2 PHE 13 3.941 5.269 4.001
84 HZ PHE 13 HZ PHE 13 1.493 4.954 3.931
85 H PHE 14 H PHE 14 4.526 -1.987 4.011
86 HA PHE 14 HA PHE 14 2.590 -1.717 6.071
87 HB2 PHE 14 HB2 PHE 14 3.784 -4.028 4.524
88 HB3 PHE 14 HB3 PHE 14 2.726 -4.335 5.862
89 HD1 PHE 14 HD1 PHE 14 1.352 -5.517 4.061
90 HD2 PHE 14 HD2 PHE 14 1.850 -1.226 4.123
91 HE1 PHE 14 HE1 PHE 14 -0.668 -5.229 2.632
92 HE2 PHE 14 HE2 PHE 14 -0.145 -0.940 2.849
93 HZ PHE 14 HZ PHE 14 -1.453 -2.923 2.045
94 H ALA 15 H ALA 15 5.924 -2.977 6.186
95 HA ALA 15 HA ALA 15 5.798 -3.892 8.851
96 HB1 ALA 15 HB1 ALA 15 7.662 -4.388 7.259
97 HB2 ALA 15 HB2 ALA 15 8.224 -2.703 7.420
98 HB3 ALA 15 HB3 ALA 15 8.220 -3.788 8.822
99 H ARG 16 H ARG 16 6.349 -0.616 7.533
100 HA ARG 16 HA ARG 16 6.905 0.526 10.181
101 HB2 ARG 16 HB2 ARG 16 6.231 1.819 7.490
102 HB3 ARG 16 HB3 ARG 16 6.620 2.703 8.972
103 HG2 ARG 16 HG2 ARG 16 8.775 1.352 9.092
104 HG3 ARG 16 HG3 ARG 16 8.451 0.782 7.460
105 HD2 ARG 16 HD2 ARG 16 8.817 3.656 8.343
106 HD3 ARG 16 HD3 ARG 16 9.989 2.675 7.473
107 HE ARG 16 HE ARG 16 8.726 2.786 5.506
108 HH11 ARG 16 HH11 ARG 16 7.416 4.920 8.045
109 HH12 ARG 16 HH12 ARG 16 6.725 6.057 6.938
110 HH21 ARG 16 HH21 ARG 16 7.904 4.301 4.065
111 HH22 ARG 16 HH22 ARG 16 7.177 5.764 4.591
112 H LEU 17 H LEU 17 4.097 0.152 8.127
113 HA LEU 17 HA LEU 17 2.287 1.823 9.705
114 HB2 LEU 17 HB2 LEU 17 1.644 -0.595 7.955
115 HB3 LEU 17 HB3 LEU 17 0.432 0.384 8.752
116 HG LEU 17 HG LEU 17 2.309 1.332 6.586
117 HD11 LEU 17 HD11 LEU 17 -0.680 0.766 6.576
118 HD12 LEU 17 HD12 LEU 17 0.569 -0.217 5.801
119 HD13 LEU 17 HD13 LEU 17 0.240 1.427 5.222
120 HD21 LEU 17 HD21 LEU 17 0.040 2.801 8.008
121 HD22 LEU 17 HD22 LEU 17 0.869 3.385 6.548
122 HD23 LEU 17 HD23 LEU 17 1.753 3.226 8.067
123 H GLY 18 H GLY 18 3.166 -1.637 9.804
124 HA2 GLY 18 HA2 GLY 18 3.365 -2.703 11.925
125 HA3 GLY 18 HA3 GLY 18 1.880 -1.917 12.463
126 H CYS 19 H CYS 19 1.594 -2.843 9.170
127 HA CYS 19 HA CYS 19 -0.491 -4.683 9.730
128 HB2 CYS 19 HB2 CYS 19 1.242 -4.637 7.245
129 HB3 CYS 19 HB3 CYS 19 -0.405 -5.247 7.348
130 HG CYS 19 HG CYS 19 -0.070 -2.957 5.949
131 H SER 20 H SER 20 -0.583 -7.012 9.291
132 HA SER 20 HA SER 20 2.030 -8.449 9.409
133 HB2 SER 20 HB2 SER 20 1.247 -8.386 11.691
134 HB3 SER 20 HB3 SER 20 -0.361 -8.971 11.216
135 HG SER 20 HG SER 20 1.319 -10.609 11.965
136 H SER 21 H SER 21 -1.181 -9.934 9.602
137 HA SER 21 HA SER 21 -0.860 -11.732 7.608
138 HB2 SER 21 HB2 SER 21 -3.595 -10.585 8.137
139 HB3 SER 21 HB3 SER 21 -3.074 -12.271 8.028
140 HG SER 21 HG SER 21 -1.980 -11.957 10.053
141 H CYS 22 H CYS 22 -1.932 -8.367 7.162
142 HA CYS 22 HA CYS 22 -2.905 -8.853 4.496
143 HB2 CYS 22 HB2 CYS 22 -1.940 -6.210 5.704
144 HB3 CYS 22 HB3 CYS 22 -2.891 -6.440 4.214
145 HG CYS 22 HG CYS 22 -4.645 -5.654 5.848
146 H LEU 23 H LEU 23 0.372 -8.416 5.736
147 HA LEU 23 HA LEU 23 1.475 -7.625 3.172
148 HB2 LEU 23 HB2 LEU 23 3.488 -7.513 4.212
149 HB3 LEU 23 HB3 LEU 23 2.470 -7.376 5.618
150 HG LEU 23 HG LEU 23 2.844 -10.011 5.806
151 HD11 LEU 23 HD11 LEU 23 5.058 -10.730 5.027
152 HD12 LEU 23 HD12 LEU 23 5.323 -9.165 4.235
153 HD13 LEU 23 HD13 LEU 23 4.087 -10.282 3.633
154 HD21 LEU 23 HD21 LEU 23 5.053 -8.050 6.463
155 HD22 LEU 23 HD22 LEU 23 4.801 -9.662 7.188
156 HD23 LEU 23 HD23 LEU 23 3.613 -8.385 7.450
157 H ASP 24 H ASP 24 0.983 -10.625 4.997
158 HA ASP 24 HA ASP 24 2.222 -12.487 3.306
159 HB2 ASP 24 HB2 ASP 24 1.328 -12.813 5.632
160 HB3 ASP 24 HB3 ASP 24 -0.309 -12.878 4.985
161 H TYR 25 H TYR 25 -1.135 -11.318 3.336
162 HA TYR 25 HA TYR 25 -2.071 -12.871 1.151
163 HB2 TYR 25 HB2 TYR 25 -2.968 -10.104 2.031
164 HB3 TYR 25 HB3 TYR 25 -3.900 -11.205 1.033
165 HD1 TYR 25 HD1 TYR 25 -4.887 -9.897 3.558
166 HD2 TYR 25 HD2 TYR 25 -2.934 -13.722 2.979
167 HE1 TYR 25 HE1 TYR 25 -5.824 -10.729 5.710
168 HE2 TYR 25 HE2 TYR 25 -3.854 -14.519 5.078
169 HH TYR 25 HH TYR 25 -4.775 -13.831 7.090
170 H PHE 26 H PHE 26 -0.875 -9.477 1.223
171 HA PHE 26 HA PHE 26 -0.955 -9.015 -1.516
172 HB2 PHE 26 HB2 PHE 26 0.344 -7.812 0.869
173 HB3 PHE 26 HB3 PHE 26 1.245 -7.574 -0.597
174 HD1 PHE 26 HD1 PHE 26 0.401 -6.264 -2.445
175 HD2 PHE 26 HD2 PHE 26 -2.042 -6.904 1.031
176 HE1 PHE 26 HE1 PHE 26 -1.124 -4.505 -3.232
177 HE2 PHE 26 HE2 PHE 26 -3.619 -5.186 0.200
178 HZ PHE 26 HZ PHE 26 -3.215 -4.036 -1.954
179 H THR 27 H THR 27 1.831 -10.352 0.353
180 HA THR 27 HA THR 27 3.589 -10.420 -1.895
181 HB THR 27 HB THR 27 4.976 -11.904 -0.461
182 HG1 THR 27 HG1 THR 27 4.302 -12.474 1.507
183 HG21 THR 27 HG21 THR 27 5.359 -10.246 1.383
184 HG22 THR 27 HG22 THR 27 3.921 -9.358 0.875
185 HG23 THR 27 HG23 THR 27 5.305 -9.511 -0.230
186 H THR 28 H THR 28 1.328 -12.819 -0.527
187 HA THR 28 HA THR 28 2.190 -14.948 -2.262
188 HB THR 28 HB THR 28 -0.539 -14.580 -0.950
189 HG1 THR 28 HG1 THR 28 1.090 -14.416 0.597
190 HG21 THR 28 HG21 THR 28 -0.578 -17.043 -0.943
191 HG22 THR 28 HG22 THR 28 1.023 -17.104 -1.705
192 HG23 THR 28 HG23 THR 28 -0.364 -16.476 -2.611
193 H GLN 29 H GLN 29 -0.242 -12.279 -2.607
194 HA GLN 29 HA GLN 29 -1.211 -13.252 -5.157
195 HB2 GLN 29 HB2 GLN 29 -1.483 -10.578 -3.716
196 HB3 GLN 29 HB3 GLN 29 -2.305 -11.022 -5.231
197 HG2 GLN 29 HG2 GLN 29 -3.382 -12.955 -4.134
198 HG3 GLN 29 HG3 GLN 29 -2.628 -12.524 -2.600
199 HE21 GLN 29 HE21 GLN 29 -4.612 -12.133 -1.402
200 HE22 GLN 29 HE22 GLN 29 -5.723 -10.879 -1.901
201 H GLY 30 H GLY 30 1.520 -11.468 -4.120
202 HA2 GLY 30 HA2 GLY 30 3.384 -10.665 -5.148
203 HA3 GLY 30 HA3 GLY 30 2.891 -11.525 -6.612
204 H LEU 31 H LEU 31 1.059 -9.004 -4.988
205 HA LEU 31 HA LEU 31 1.549 -7.107 -7.250
206 HB2 LEU 31 HB2 LEU 31 -0.904 -6.427 -6.846
207 HB3 LEU 31 HB3 LEU 31 -0.537 -7.886 -7.731
208 HG LEU 31 HG LEU 31 -0.988 -9.258 -5.734
209 HD11 LEU 31 HD11 LEU 31 -2.224 -8.209 -3.805
210 HD12 LEU 31 HD12 LEU 31 -1.728 -6.622 -4.440
211 HD13 LEU 31 HD13 LEU 31 -0.511 -7.806 -3.896
212 HD21 LEU 31 HD21 LEU 31 -3.401 -8.998 -5.703
213 HD22 LEU 31 HD22 LEU 31 -2.723 -8.944 -7.327
214 HD23 LEU 31 HD23 LEU 31 -3.244 -7.428 -6.550
215 H THR 32 H THR 32 2.708 -7.331 -4.439
216 HA THR 32 HA THR 32 1.798 -4.809 -3.195
217 HB THR 32 HB THR 32 2.422 -6.024 -1.410
218 HG1 THR 32 HG1 THR 32 4.582 -6.027 -0.815
219 HG21 THR 32 HG21 THR 32 2.673 -8.146 -2.605
220 HG22 THR 32 HG22 THR 32 3.917 -7.986 -1.374
221 HG23 THR 32 HG23 THR 32 4.308 -7.698 -3.085
222 H THR 33 H THR 33 2.496 -2.833 -3.931
223 HA THR 33 HA THR 33 5.269 -2.475 -4.478
224 HB THR 33 HB THR 33 5.007 -2.914 -6.640
225 HG1 THR 33 HG1 THR 33 4.672 -1.217 -7.810
226 HG21 THR 33 HG21 THR 33 1.948 -2.622 -6.422
227 HG22 THR 33 HG22 THR 33 2.908 -4.108 -6.619
228 HG23 THR 33 HG23 THR 33 2.806 -2.971 -7.922
229 H ILE 34 H ILE 34 5.654 -0.180 -4.340
230 HA ILE 34 HA ILE 34 3.682 1.175 -2.604
231 HB ILE 34 HB ILE 34 6.349 2.315 -3.529
232 HG12 ILE 34 HG12 ILE 34 5.696 0.343 -1.329
233 HG13 ILE 34 HG13 ILE 34 6.976 0.299 -2.555
234 HG21 ILE 34 HG21 ILE 34 4.684 3.917 -2.543
235 HG22 ILE 34 HG22 ILE 34 4.631 2.925 -1.073
236 HG23 ILE 34 HG23 ILE 34 6.126 3.758 -1.574
237 HD11 ILE 34 HD11 ILE 34 8.050 2.254 -1.335
238 HD12 ILE 34 HD12 ILE 34 6.857 1.969 -0.034
239 HD13 ILE 34 HD13 ILE 34 8.023 0.715 -0.457
240 H TYR 35 H TYR 35 5.343 2.043 -5.615
241 HA TYR 35 HA TYR 35 3.972 4.408 -6.167
242 HB2 TYR 35 HB2 TYR 35 5.131 2.613 -8.300
243 HB3 TYR 35 HB3 TYR 35 5.177 4.367 -8.176
244 HD1 TYR 35 HD1 TYR 35 6.812 1.212 -7.304
245 HD2 TYR 35 HD2 TYR 35 6.667 5.417 -6.337
246 HE1 TYR 35 HE1 TYR 35 8.876 0.976 -5.995
247 HE2 TYR 35 HE2 TYR 35 8.803 5.188 -5.084
248 HH TYR 35 HH TYR 35 10.644 2.138 -5.001
249 H GLN 36 H GLN 36 3.033 1.135 -6.729
250 HA GLN 36 HA GLN 36 1.069 1.768 -8.826
251 HB2 GLN 36 HB2 GLN 36 1.718 -0.689 -7.188
252 HB3 GLN 36 HB3 GLN 36 0.357 -0.668 -8.298
253 HG2 GLN 36 HG2 GLN 36 3.229 -0.070 -9.145
254 HG3 GLN 36 HG3 GLN 36 2.385 -1.600 -9.406
255 HE21 GLN 36 HE21 GLN 36 3.551 0.105 -11.477
256 HE22 GLN 36 HE22 GLN 36 2.212 0.429 -12.555
257 H ILE 37 H ILE 37 0.766 0.763 -5.332
258 HA ILE 37 HA ILE 37 -2.032 1.227 -5.246
259 HB ILE 37 HB ILE 37 -1.786 1.242 -2.847
260 HG12 ILE 37 HG12 ILE 37 1.200 0.982 -3.244
261 HG13 ILE 37 HG13 ILE 37 0.444 2.523 -2.915
262 HG21 ILE 37 HG21 ILE 37 -1.981 -0.851 -3.984
263 HG22 ILE 37 HG22 ILE 37 -0.211 -0.979 -4.158
264 HG23 ILE 37 HG23 ILE 37 -0.964 -1.013 -2.549
265 HD11 ILE 37 HD11 ILE 37 0.247 0.168 -1.069
266 HD12 ILE 37 HD12 ILE 37 1.392 1.530 -0.948
267 HD13 ILE 37 HD13 ILE 37 -0.349 1.827 -0.798
268 H GLU 38 H GLU 38 0.479 3.523 -5.506
269 HA GLU 38 HA GLU 38 -0.831 5.648 -4.029
270 HB2 GLU 38 HB2 GLU 38 1.692 5.224 -4.406
271 HB3 GLU 38 HB3 GLU 38 1.462 5.925 -6.013
272 HG2 GLU 38 HG2 GLU 38 0.813 8.030 -5.056
273 HG3 GLU 38 HG3 GLU 38 0.582 7.318 -3.451
274 H HIS 39 H HIS 39 -1.110 4.220 -7.176
275 HA HIS 39 HA HIS 39 -2.747 6.503 -8.187
276 HB2 HIS 39 HB2 HIS 39 -0.699 6.091 -9.495
277 HB3 HIS 39 HB3 HIS 39 -1.184 4.405 -9.721
278 HD1 HIS 39 HD1 HIS 39 -3.625 7.407 -10.220
279 HD2 HIS 39 HD2 HIS 39 -1.623 4.340 -12.279
280 HE1 HIS 39 HE1 HIS 39 -4.385 7.549 -12.639
281 H TYR 40 H TYR 40 -2.675 3.098 -7.357
282 HA TYR 40 HA TYR 40 -5.209 2.451 -8.678
283 HB2 TYR 40 HB2 TYR 40 -3.434 1.000 -6.680
284 HB3 TYR 40 HB3 TYR 40 -5.032 0.424 -7.065
285 HD1 TYR 40 HD1 TYR 40 -1.796 -0.588 -7.694
286 HD2 TYR 40 HD2 TYR 40 -5.354 0.640 -9.908
287 HE1 TYR 40 HE1 TYR 40 -1.118 -1.916 -9.610
288 HE2 TYR 40 HE2 TYR 40 -4.623 -0.705 -11.808
289 HH TYR 40 HH TYR 40 -1.456 -2.265 -11.947
290 H SER 41 H SER 41 -6.839 3.760 -7.948
291 HA SER 41 HA SER 41 -6.992 4.905 -5.369
292 HB2 SER 41 HB2 SER 41 -9.144 4.493 -7.470
293 HB3 SER 41 HB3 SER 41 -9.199 5.650 -6.122
294 HG SER 41 HG SER 41 -8.374 6.196 -8.425
295 H MET 42 H MET 42 -9.182 4.641 -4.057
296 HA MET 42 HA MET 42 -9.132 2.026 -2.939
297 HB2 MET 42 HB2 MET 42 -11.093 4.337 -2.653
298 HB3 MET 42 HB3 MET 42 -11.374 2.773 -1.872
299 HG2 MET 42 HG2 MET 42 -9.024 2.896 -0.938
300 HG3 MET 42 HG3 MET 42 -8.996 4.573 -1.473
301 HE1 MET 42 HE1 MET 42 -11.313 6.425 0.906
302 HE2 MET 42 HE2 MET 42 -10.070 6.506 -0.345
303 HE3 MET 42 HE3 MET 42 -11.695 5.925 -0.757
304 H ASP 43 H ASP 43 -10.986 3.307 -5.638
305 HA ASP 43 HA ASP 43 -13.019 1.310 -5.809
306 HB2 ASP 43 HB2 ASP 43 -13.158 3.333 -7.125
307 HB3 ASP 43 HB3 ASP 43 -11.603 3.008 -7.907
308 H ASP 44 H ASP 44 -9.669 1.468 -7.094
309 HA ASP 44 HA ASP 44 -9.700 -0.986 -8.539
310 HB2 ASP 44 HB2 ASP 44 -7.438 0.656 -7.302
311 HB3 ASP 44 HB3 ASP 44 -7.156 -0.872 -8.111
312 H LEU 45 H LEU 45 -8.510 -0.109 -5.310
313 HA LEU 45 HA LEU 45 -7.656 -2.678 -4.471
314 HB2 LEU 45 HB2 LEU 45 -8.785 -0.400 -2.814
315 HB3 LEU 45 HB3 LEU 45 -7.937 -1.817 -2.169
316 HG LEU 45 HG LEU 45 -6.695 0.270 -4.007
317 HD11 LEU 45 HD11 LEU 45 -5.413 0.840 -1.926
318 HD12 LEU 45 HD12 LEU 45 -6.454 -0.239 -1.001
319 HD13 LEU 45 HD13 LEU 45 -7.139 1.201 -1.802
320 HD21 LEU 45 HD21 LEU 45 -4.574 -0.845 -3.441
321 HD22 LEU 45 HD22 LEU 45 -5.643 -1.937 -4.304
322 HD23 LEU 45 HD23 LEU 45 -5.461 -2.109 -2.543
323 H ALA 46 H ALA 46 -10.893 -1.168 -4.121
324 HA ALA 46 HA ALA 46 -12.055 -3.369 -2.698
325 HB1 ALA 46 HB1 ALA 46 -13.149 -1.184 -2.809
326 HB2 ALA 46 HB2 ALA 46 -13.345 -1.340 -4.571
327 HB3 ALA 46 HB3 ALA 46 -14.217 -2.433 -3.475
328 H SER 47 H SER 47 -11.733 -2.651 -6.222
329 HA SER 47 HA SER 47 -13.159 -4.954 -7.045
330 HB2 SER 47 HB2 SER 47 -12.410 -2.815 -8.393
331 HB3 SER 47 HB3 SER 47 -10.923 -3.733 -8.707
332 HG SER 47 HG SER 47 -12.211 -4.414 -10.319
333 H LEU 48 H LEU 48 -9.854 -4.500 -6.001
334 HA LEU 48 HA LEU 48 -8.859 -7.109 -6.841
335 HB2 LEU 48 HB2 LEU 48 -7.732 -4.875 -5.112
336 HB3 LEU 48 HB3 LEU 48 -6.860 -6.352 -5.448
337 HG LEU 48 HG LEU 48 -7.908 -4.625 -7.717
338 HD11 LEU 48 HD11 LEU 48 -5.197 -4.407 -6.373
339 HD12 LEU 48 HD12 LEU 48 -6.475 -3.177 -6.333
340 HD13 LEU 48 HD13 LEU 48 -5.695 -3.577 -7.865
341 HD21 LEU 48 HD21 LEU 48 -7.220 -6.927 -8.257
342 HD22 LEU 48 HD22 LEU 48 -5.641 -6.622 -7.516
343 HD23 LEU 48 HD23 LEU 48 -6.134 -5.736 -8.982
344 H LYS 49 H LYS 49 -11.179 -6.592 -4.757
345 HA LYS 49 HA LYS 49 -12.141 -7.725 -3.102
346 HB2 LYS 49 HB2 LYS 49 -9.932 -9.817 -3.298
347 HB3 LYS 49 HB3 LYS 49 -11.445 -9.937 -2.429
348 HG2 LYS 49 HG2 LYS 49 -12.053 -11.069 -4.279
349 HG3 LYS 49 HG3 LYS 49 -12.571 -9.456 -4.758
350 HD2 LYS 49 HD2 LYS 49 -10.478 -9.232 -6.127
351 HD3 LYS 49 HD3 LYS 49 -9.933 -10.805 -5.524
352 HE2 LYS 49 HE2 LYS 49 -10.860 -11.115 -7.723
353 HE3 LYS 49 HE3 LYS 49 -11.948 -11.862 -6.543
354 HZ1 LYS 49 HZ1 LYS 49 -13.375 -9.922 -6.722
355 HZ2 LYS 49 HZ2 LYS 49 -13.155 -10.595 -8.175
356 HZ3 LYS 49 HZ3 LYS 49 -12.349 -9.217 -7.815
357 H ILE 50 H ILE 50 -9.859 -5.715 -2.633
358 HA ILE 50 HA ILE 50 -8.832 -6.570 -0.049
359 HB ILE 50 HB ILE 50 -8.783 -3.792 -1.252
360 HG12 ILE 50 HG12 ILE 50 -7.629 -5.439 -2.758
361 HG13 ILE 50 HG13 ILE 50 -6.508 -4.312 -2.025
362 HG21 ILE 50 HG21 ILE 50 -7.093 -5.112 0.886
363 HG22 ILE 50 HG22 ILE 50 -6.888 -3.446 0.292
364 HG23 ILE 50 HG23 ILE 50 -8.323 -3.947 1.221
365 HD11 ILE 50 HD11 ILE 50 -5.713 -6.000 -0.464
366 HD12 ILE 50 HD12 ILE 50 -6.989 -7.130 -0.951
367 HD13 ILE 50 HD13 ILE 50 -5.707 -6.702 -2.081
368 HA PRO 51 HA PRO 51 -12.772 -5.666 1.823
369 HB2 PRO 51 HB2 PRO 51 -12.120 -6.064 4.483
370 HB3 PRO 51 HB3 PRO 51 -12.387 -7.380 3.304
371 HG2 PRO 51 HG2 PRO 51 -9.785 -6.198 4.248
372 HG3 PRO 51 HG3 PRO 51 -10.209 -7.922 4.011
373 HD2 PRO 51 HD2 PRO 51 -8.810 -6.456 2.162
374 HD3 PRO 51 HD3 PRO 51 -9.927 -7.744 1.667
375 H GLU 52 H GLU 52 -13.734 -3.814 2.351
376 HA GLU 52 HA GLU 52 -12.695 -1.383 2.263
377 HB2 GLU 52 HB2 GLU 52 -14.650 -0.492 3.354
378 HB3 GLU 52 HB3 GLU 52 -15.034 -1.748 2.184
379 HG2 GLU 52 HG2 GLU 52 -15.543 -3.352 3.909
380 HG3 GLU 52 HG3 GLU 52 -14.932 -2.285 5.179
381 H GLN 53 H GLN 53 -12.973 -3.044 5.434
382 HA GLN 53 HA GLN 53 -12.131 -0.941 7.057
383 HB2 GLN 53 HB2 GLN 53 -11.299 -2.795 8.588
384 HB3 GLN 53 HB3 GLN 53 -12.991 -2.839 8.134
385 HG2 GLN 53 HG2 GLN 53 -11.223 -4.485 6.358
386 HG3 GLN 53 HG3 GLN 53 -11.235 -4.967 8.033
387 HE21 GLN 53 HE21 GLN 53 -12.985 -6.096 8.783
388 HE22 GLN 53 HE22 GLN 53 -14.558 -6.208 7.997
389 H PHE 54 H PHE 54 -10.058 -3.412 5.508
390 HA PHE 54 HA PHE 54 -7.600 -2.151 6.471
391 HB2 PHE 54 HB2 PHE 54 -7.534 -4.487 6.464
392 HB3 PHE 54 HB3 PHE 54 -8.355 -4.607 4.916
393 HD1 PHE 54 HD1 PHE 54 -7.213 -4.916 2.999
394 HD2 PHE 54 HD2 PHE 54 -5.140 -3.269 6.369
395 HE1 PHE 54 HE1 PHE 54 -5.052 -5.086 1.758
396 HE2 PHE 54 HE2 PHE 54 -2.982 -3.397 5.135
397 HZ PHE 54 HZ PHE 54 -2.963 -4.314 2.807
398 H ARG 55 H ARG 55 -9.313 -2.619 3.344
399 HA ARG 55 HA ARG 55 -7.599 -1.481 1.530
400 HB2 ARG 55 HB2 ARG 55 -9.823 -2.580 1.146
401 HB3 ARG 55 HB3 ARG 55 -10.629 -1.174 1.779
402 HG2 ARG 55 HG2 ARG 55 -8.751 -0.590 -0.430
403 HG3 ARG 55 HG3 ARG 55 -10.072 -1.683 -0.884
404 HD2 ARG 55 HD2 ARG 55 -10.418 1.052 0.387
405 HD3 ARG 55 HD3 ARG 55 -10.562 0.696 -1.336
406 HE ARG 55 HE ARG 55 -12.383 -0.999 -0.531
407 HH11 ARG 55 HH11 ARG 55 -11.946 2.403 0.568
408 HH12 ARG 55 HH12 ARG 55 -13.618 2.500 1.041
409 HH21 ARG 55 HH21 ARG 55 -14.586 -0.676 0.003
410 HH22 ARG 55 HH22 ARG 55 -15.069 0.900 0.617
411 H HIS 56 H HIS 56 -10.079 0.301 3.485
412 HA HIS 56 HA HIS 56 -9.253 2.888 2.554
413 HB2 HIS 56 HB2 HIS 56 -11.468 2.339 3.587
414 HB3 HIS 56 HB3 HIS 56 -10.662 2.045 5.132
415 HD1 HIS 56 HD1 HIS 56 -9.869 4.286 6.501
416 HD2 HIS 56 HD2 HIS 56 -11.748 4.881 2.768
417 HE1 HIS 56 HE1 HIS 56 -10.267 6.789 6.281
418 H ALA 57 H ALA 57 -7.996 0.740 5.171
419 HA ALA 57 HA ALA 57 -6.668 2.826 6.559
420 HB1 ALA 57 HB1 ALA 57 -5.878 -0.112 6.497
421 HB2 ALA 57 HB2 ALA 57 -5.509 1.082 7.739
422 HB3 ALA 57 HB3 ALA 57 -7.183 0.539 7.513
423 H ILE 58 H ILE 58 -5.473 0.425 4.075
424 HA ILE 58 HA ILE 58 -2.840 1.472 4.135
425 HB ILE 58 HB ILE 58 -3.035 -0.665 3.332
426 HG12 ILE 58 HG12 ILE 58 -2.138 -0.699 1.144
427 HG13 ILE 58 HG13 ILE 58 -2.960 0.782 0.655
428 HG21 ILE 58 HG21 ILE 58 -5.144 0.059 1.277
429 HG22 ILE 58 HG22 ILE 58 -4.337 -1.502 1.430
430 HG23 ILE 58 HG23 ILE 58 -5.357 -0.951 2.726
431 HD11 ILE 58 HD11 ILE 58 -0.973 1.090 2.871
432 HD12 ILE 58 HD12 ILE 58 -0.319 0.635 1.289
433 HD13 ILE 58 HD13 ILE 58 -1.254 2.105 1.433
434 H TRP 59 H TRP 59 -5.594 1.999 1.904
435 HA TRP 59 HA TRP 59 -4.236 3.868 0.324
436 HB2 TRP 59 HB2 TRP 59 -6.578 2.704 0.035
437 HB3 TRP 59 HB3 TRP 59 -7.185 4.212 0.720
438 HD1 TRP 59 HD1 TRP 59 -4.960 2.908 -2.185
439 HE1 TRP 59 HE1 TRP 59 -4.994 4.557 -4.107
440 HE3 TRP 59 HE3 TRP 59 -7.797 6.516 -0.015
441 HZ2 TRP 59 HZ2 TRP 59 -6.341 7.087 -4.752
442 HZ3 TRP 59 HZ3 TRP 59 -8.555 8.504 -1.338
443 HH2 TRP 59 HH2 TRP 59 -7.836 8.775 -3.707
444 H LYS 60 H LYS 60 -6.319 4.590 3.205
445 HA LYS 60 HA LYS 60 -5.831 7.351 3.185
446 HB2 LYS 60 HB2 LYS 60 -7.488 6.313 4.672
447 HB3 LYS 60 HB3 LYS 60 -6.208 5.431 5.524
448 HG2 LYS 60 HG2 LYS 60 -6.986 7.253 6.881
449 HG3 LYS 60 HG3 LYS 60 -5.308 7.527 6.433
450 HD2 LYS 60 HD2 LYS 60 -6.063 9.154 4.673
451 HD3 LYS 60 HD3 LYS 60 -7.742 8.807 5.109
452 HE2 LYS 60 HE2 LYS 60 -7.160 10.841 6.206
453 HE3 LYS 60 HE3 LYS 60 -7.250 9.591 7.451
454 HZ1 LYS 60 HZ1 LYS 60 -5.298 11.047 7.671
455 HZ2 LYS 60 HZ2 LYS 60 -4.759 10.590 6.207
456 HZ3 LYS 60 HZ3 LYS 60 -4.819 9.499 7.451
457 H GLY 61 H GLY 61 -3.783 4.682 4.476
458 HA2 GLY 61 HA2 GLY 61 -1.933 6.268 5.858
459 HA3 GLY 61 HA3 GLY 61 -1.615 4.646 5.196
460 H ILE 62 H ILE 62 -1.652 4.989 2.471
461 HA ILE 62 HA ILE 62 0.891 6.364 2.187
462 HB ILE 62 HB ILE 62 0.270 4.393 1.032
463 HG12 ILE 62 HG12 ILE 62 1.038 6.678 -0.862
464 HG13 ILE 62 HG13 ILE 62 2.117 5.976 0.341
465 HG21 ILE 62 HG21 ILE 62 -2.037 4.873 0.282
466 HG22 ILE 62 HG22 ILE 62 -1.387 6.031 -0.906
467 HG23 ILE 62 HG23 ILE 62 -1.010 4.317 -1.036
468 HD11 ILE 62 HD11 ILE 62 0.972 4.546 -2.081
469 HD12 ILE 62 HD12 ILE 62 2.636 5.065 -1.847
470 HD13 ILE 62 HD13 ILE 62 1.977 3.776 -0.820
471 H LEU 63 H LEU 63 -2.426 7.096 1.239
472 HA LEU 63 HA LEU 63 -1.872 9.522 -0.152
473 HB2 LEU 63 HB2 LEU 63 -4.287 8.470 1.346
474 HB3 LEU 63 HB3 LEU 63 -4.268 10.130 0.830
475 HG LEU 63 HG LEU 63 -5.431 8.525 -0.705
476 HD11 LEU 63 HD11 LEU 63 -4.822 10.794 -1.371
477 HD12 LEU 63 HD12 LEU 63 -4.650 9.657 -2.732
478 HD13 LEU 63 HD13 LEU 63 -3.214 10.235 -1.867
479 HD21 LEU 63 HD21 LEU 63 -2.608 7.782 -1.588
480 HD22 LEU 63 HD22 LEU 63 -4.092 7.387 -2.442
481 HD23 LEU 63 HD23 LEU 63 -3.805 6.672 -0.862
482 H ASP 64 H ASP 64 -2.128 8.721 3.189
483 HA ASP 64 HA ASP 64 -2.067 11.441 4.311
484 HB2 ASP 64 HB2 ASP 64 -3.084 9.763 5.634
485 HB3 ASP 64 HB3 ASP 64 -1.702 8.689 5.493
486 H HIS 65 H HIS 65 0.295 9.057 3.393
487 HA HIS 65 HA HIS 65 2.501 10.165 4.899
488 HB2 HIS 65 HB2 HIS 65 2.723 7.878 4.271
489 HB3 HIS 65 HB3 HIS 65 2.396 8.228 2.572
490 HD1 HIS 65 HD1 HIS 65 5.160 9.837 4.895
491 HD2 HIS 65 HD2 HIS 65 4.482 7.972 1.168
492 HE1 HIS 65 HE1 HIS 65 7.324 9.967 3.637
493 H ARG 66 H ARG 66 1.439 10.412 1.502
494 HA ARG 66 HA ARG 66 3.541 12.392 0.987
495 HB2 ARG 66 HB2 ARG 66 2.572 12.955 -1.081
496 HB3 ARG 66 HB3 ARG 66 2.574 11.211 -0.934
497 HG2 ARG 66 HG2 ARG 66 -0.006 12.465 -0.052
498 HG3 ARG 66 HG3 ARG 66 0.444 12.899 -1.700
499 HD2 ARG 66 HD2 ARG 66 0.268 10.243 -0.374
500 HD3 ARG 66 HD3 ARG 66 -0.995 10.924 -1.410
501 HE ARG 66 HE ARG 66 1.451 9.613 -2.377
502 HH11 ARG 66 HH11 ARG 66 -1.094 11.955 -3.212
503 HH12 ARG 66 HH12 ARG 66 -0.610 12.134 -4.848
504 HH21 ARG 66 HH21 ARG 66 2.245 10.011 -4.456
505 HH22 ARG 66 HH22 ARG 66 1.322 10.932 -5.623
506 H GLN 67 H GLN 67 0.101 12.523 1.932
507 HA GLN 67 HA GLN 67 -0.008 15.384 1.789
508 HB2 GLN 67 HB2 GLN 67 -1.945 13.965 1.688
509 HB3 GLN 67 HB3 GLN 67 -1.633 13.358 3.326
510 HG2 GLN 67 HG2 GLN 67 -3.465 14.866 3.310
511 HG3 GLN 67 HG3 GLN 67 -2.126 15.487 4.268
512 HE21 GLN 67 HE21 GLN 67 -0.910 17.369 3.418
513 HE22 GLN 67 HE22 GLN 67 -1.685 18.472 2.311
514 H LEU 68 H LEU 68 1.570 13.366 4.180
515 HA LEU 68 HA LEU 68 1.607 15.612 6.101
516 HB2 LEU 68 HB2 LEU 68 2.024 14.161 7.735
517 HB3 LEU 68 HB3 LEU 68 1.209 13.100 6.619
518 HG LEU 68 HG LEU 68 3.640 12.417 5.844
519 HD11 LEU 68 HD11 LEU 68 4.133 13.740 8.530
520 HD12 LEU 68 HD12 LEU 68 5.047 13.963 7.031
521 HD13 LEU 68 HD13 LEU 68 5.173 12.452 7.939
522 HD21 LEU 68 HD21 LEU 68 1.991 10.968 6.971
523 HD22 LEU 68 HD22 LEU 68 2.502 11.609 8.539
524 HD23 LEU 68 HD23 LEU 68 3.643 10.680 7.533
525 H HIS 69 H HIS 69 3.623 13.918 3.747
526 HA HIS 69 HA HIS 69 6.075 15.312 4.502
527 HB2 HIS 69 HB2 HIS 69 5.689 12.914 3.390
528 HB3 HIS 69 HB3 HIS 69 5.656 13.837 1.891
529 HD1 HIS 69 HD1 HIS 69 8.172 14.961 1.210
530 HD2 HIS 69 HD2 HIS 69 7.888 12.687 4.776
531 HE1 HIS 69 HE1 HIS 69 10.536 14.461 1.942
532 H ASP 70 H ASP 70 7.184 16.330 2.286
533 HA ASP 70 HA ASP 70 5.412 17.797 0.552
534 HB2 ASP 70 HB2 ASP 70 6.875 19.182 2.834
535 HB3 ASP 70 HB3 ASP 70 6.633 19.995 1.294
Start of MODEL 20
1 H1 GLY 1 H GLY 1 17.679 -13.125 15.691
2 HA2 GLY 1 HA2 GLY 1 19.902 -12.258 15.564
3 HA3 GLY 1 HA3 GLY 1 19.564 -13.102 14.037
4 HA PRO 2 HA PRO 2 20.726 -8.817 12.833
5 HB2 PRO 2 HB2 PRO 2 21.916 -9.376 10.447
6 HB3 PRO 2 HB3 PRO 2 22.747 -9.620 12.014
7 HG2 PRO 2 HG2 PRO 2 21.412 -11.685 10.261
8 HG3 PRO 2 HG3 PRO 2 22.948 -11.815 11.165
9 HD2 PRO 2 HD2 PRO 2 20.473 -12.775 12.016
10 HD3 PRO 2 HD3 PRO 2 21.826 -12.382 13.127
11 H LEU 3 H LEU 3 18.959 -7.717 12.170
12 HA LEU 3 HA LEU 3 17.114 -8.863 10.118
13 HB2 LEU 3 HB2 LEU 3 16.763 -7.068 12.518
14 HB3 LEU 3 HB3 LEU 3 15.740 -6.781 11.120
15 HG LEU 3 HG LEU 3 14.971 -9.127 11.147
16 HD11 LEU 3 HD11 LEU 3 15.304 -10.512 13.184
17 HD12 LEU 3 HD12 LEU 3 16.488 -9.326 13.777
18 HD13 LEU 3 HD13 LEU 3 16.810 -10.269 12.295
19 HD21 LEU 3 HD21 LEU 3 13.683 -7.354 12.293
20 HD22 LEU 3 HD22 LEU 3 14.563 -7.694 13.798
21 HD23 LEU 3 HD23 LEU 3 13.508 -8.941 13.061
22 H GLY 4 H GLY 4 16.055 -6.692 8.947
23 HA2 GLY 4 HA2 GLY 4 18.061 -4.690 8.300
24 HA3 GLY 4 HA3 GLY 4 17.832 -5.875 7.008
25 H SER 5 H SER 5 15.621 -6.115 6.100
26 HA SER 5 HA SER 5 13.784 -5.207 5.128
27 HB2 SER 5 HB2 SER 5 13.341 -4.136 7.937
28 HB3 SER 5 HB3 SER 5 12.118 -4.210 6.674
29 HG SER 5 HG SER 5 12.529 -5.996 8.375
30 H THR 6 H THR 6 15.817 -3.870 4.209
31 HA THR 6 HA THR 6 15.250 -0.957 4.516
32 HB THR 6 HB THR 6 17.672 -1.960 3.070
33 HG1 THR 6 HG1 THR 6 17.750 -3.239 4.873
34 HG21 THR 6 HG21 THR 6 18.700 0.026 4.108
35 HG22 THR 6 HG22 THR 6 17.250 0.292 5.096
36 HG23 THR 6 HG23 THR 6 17.188 0.478 3.332
37 H ASP 7 H ASP 7 14.296 -3.494 2.597
38 HA ASP 7 HA ASP 7 14.727 -2.526 -0.019
39 HB2 ASP 7 HB2 ASP 7 13.398 -4.319 -0.700
40 HB3 ASP 7 HB3 ASP 7 14.326 -4.886 0.683
41 H CYS 8 H CYS 8 13.661 -1.191 -1.291
42 HA CYS 8 HA CYS 8 11.468 0.424 -0.234
43 HB2 CYS 8 HB2 CYS 8 12.882 0.402 -2.939
44 HB3 CYS 8 HB3 CYS 8 11.587 1.522 -2.479
45 HG CYS 8 HG CYS 8 13.297 3.054 -2.077
46 H SER 9 H SER 9 9.642 -0.830 -0.067
47 HA SER 9 HA SER 9 8.103 -1.494 -2.424
48 HB2 SER 9 HB2 SER 9 9.252 -3.694 -0.657
49 HB3 SER 9 HB3 SER 9 7.853 -3.951 -1.724
50 HG SER 9 HG SER 9 10.008 -2.800 -2.952
51 H ILE 10 H ILE 10 5.933 -2.555 -1.655
52 HA ILE 10 HA ILE 10 4.859 -1.000 0.434
53 HB ILE 10 HB ILE 10 3.977 -3.157 -1.338
54 HG12 ILE 10 HG12 ILE 10 3.525 -0.766 -1.560
55 HG13 ILE 10 HG13 ILE 10 2.085 -1.788 -1.676
56 HG21 ILE 10 HG21 ILE 10 2.424 -2.954 1.264
57 HG22 ILE 10 HG22 ILE 10 1.873 -3.756 -0.214
58 HG23 ILE 10 HG23 ILE 10 3.284 -4.372 0.646
59 HD11 ILE 10 HD11 ILE 10 2.809 -0.579 0.992
60 HD12 ILE 10 HD12 ILE 10 2.177 0.483 -0.240
61 HD13 ILE 10 HD13 ILE 10 1.213 -0.909 0.311
62 H VAL 11 H VAL 11 6.495 -4.108 0.592
63 HA VAL 11 HA VAL 11 5.487 -4.985 3.057
64 HB VAL 11 HB VAL 11 7.843 -5.931 3.412
65 HG11 VAL 11 HG11 VAL 11 6.227 -6.648 0.921
66 HG12 VAL 11 HG12 VAL 11 7.395 -7.719 1.731
67 HG13 VAL 11 HG13 VAL 11 5.915 -7.232 2.577
68 HG21 VAL 11 HG21 VAL 11 9.032 -4.384 1.813
69 HG22 VAL 11 HG22 VAL 11 9.289 -6.105 1.509
70 HG23 VAL 11 HG23 VAL 11 8.174 -5.208 0.481
71 H SER 12 H SER 12 8.076 -2.592 2.499
72 HA SER 12 HA SER 12 8.701 -2.218 5.234
73 HB2 SER 12 HB2 SER 12 9.994 -1.470 3.142
74 HB3 SER 12 HB3 SER 12 8.841 -0.134 3.031
75 HG SER 12 HG SER 12 10.577 -0.728 5.205
76 H PHE 13 H PHE 13 6.260 -0.671 3.086
77 HA PHE 13 HA PHE 13 5.436 1.280 5.056
78 HB2 PHE 13 HB2 PHE 13 5.065 1.696 2.722
79 HB3 PHE 13 HB3 PHE 13 4.119 0.234 2.548
80 HD1 PHE 13 HD1 PHE 13 1.754 0.423 2.573
81 HD2 PHE 13 HD2 PHE 13 4.124 3.468 4.502
82 HE1 PHE 13 HE1 PHE 13 -0.293 1.737 3.022
83 HE2 PHE 13 HE2 PHE 13 2.038 4.748 4.982
84 HZ PHE 13 HZ PHE 13 -0.164 3.805 4.311
85 H PHE 14 H PHE 14 4.022 -1.928 4.066
86 HA PHE 14 HA PHE 14 1.891 -1.881 5.896
87 HB2 PHE 14 HB2 PHE 14 3.393 -3.933 4.323
88 HB3 PHE 14 HB3 PHE 14 2.418 -4.520 5.656
89 HD1 PHE 14 HD1 PHE 14 0.796 -5.729 4.469
90 HD2 PHE 14 HD2 PHE 14 1.519 -1.604 3.450
91 HE1 PHE 14 HE1 PHE 14 -1.179 -5.736 2.966
92 HE2 PHE 14 HE2 PHE 14 -0.436 -1.622 1.966
93 HZ PHE 14 HZ PHE 14 -1.794 -3.709 1.714
94 H ALA 15 H ALA 15 5.291 -2.943 6.240
95 HA ALA 15 HA ALA 15 5.025 -4.065 8.841
96 HB1 ALA 15 HB1 ALA 15 6.969 -4.576 7.532
97 HB2 ALA 15 HB2 ALA 15 7.395 -2.869 7.362
98 HB3 ALA 15 HB3 ALA 15 7.510 -3.658 8.949
99 H ARG 16 H ARG 16 5.554 -0.663 7.702
100 HA ARG 16 HA ARG 16 5.991 0.396 10.365
101 HB2 ARG 16 HB2 ARG 16 4.894 1.720 7.826
102 HB3 ARG 16 HB3 ARG 16 5.139 2.586 9.319
103 HG2 ARG 16 HG2 ARG 16 7.458 1.059 8.141
104 HG3 ARG 16 HG3 ARG 16 6.967 2.596 7.422
105 HD2 ARG 16 HD2 ARG 16 7.343 3.795 9.484
106 HD3 ARG 16 HD3 ARG 16 7.524 2.284 10.396
107 HE ARG 16 HE ARG 16 9.666 2.126 9.812
108 HH11 ARG 16 HH11 ARG 16 8.232 4.546 7.581
109 HH12 ARG 16 HH12 ARG 16 9.703 4.813 6.723
110 HH21 ARG 16 HH21 ARG 16 11.609 2.549 8.693
111 HH22 ARG 16 HH22 ARG 16 11.667 3.723 7.421
112 H LEU 17 H LEU 17 3.019 -0.071 8.374
113 HA LEU 17 HA LEU 17 1.260 1.072 10.367
114 HB2 LEU 17 HB2 LEU 17 0.467 -1.085 8.390
115 HB3 LEU 17 HB3 LEU 17 -0.574 0.096 9.178
116 HG LEU 17 HG LEU 17 1.432 0.566 6.971
117 HD11 LEU 17 HD11 LEU 17 -0.585 -0.404 6.145
118 HD12 LEU 17 HD12 LEU 17 -0.567 1.301 5.686
119 HD13 LEU 17 HD13 LEU 17 -1.591 0.761 7.039
120 HD21 LEU 17 HD21 LEU 17 -0.183 2.594 8.563
121 HD22 LEU 17 HD22 LEU 17 0.558 2.961 6.974
122 HD23 LEU 17 HD23 LEU 17 1.562 2.518 8.368
123 H GLY 18 H GLY 18 2.795 -2.077 10.091
124 HA2 GLY 18 HA2 GLY 18 3.037 -3.650 11.740
125 HA3 GLY 18 HA3 GLY 18 1.725 -2.911 12.678
126 H CYS 19 H CYS 19 1.738 -3.856 9.199
127 HA CYS 19 HA CYS 19 -0.808 -5.158 9.559
128 HB2 CYS 19 HB2 CYS 19 1.088 -5.279 7.177
129 HB3 CYS 19 HB3 CYS 19 -0.607 -5.780 7.166
130 HG CYS 19 HG CYS 19 0.607 -2.799 7.839
131 H SER 20 H SER 20 -1.196 -7.508 8.977
132 HA SER 20 HA SER 20 1.159 -9.284 9.375
133 HB2 SER 20 HB2 SER 20 -0.012 -9.128 11.472
134 HB3 SER 20 HB3 SER 20 -1.556 -9.481 10.698
135 HG SER 20 HG SER 20 -0.633 -11.317 11.689
136 H SER 21 H SER 21 -2.020 -10.671 8.926
137 HA SER 21 HA SER 21 -1.392 -12.184 6.752
138 HB2 SER 21 HB2 SER 21 -4.189 -11.108 7.246
139 HB3 SER 21 HB3 SER 21 -3.708 -12.680 6.584
140 HG SER 21 HG SER 21 -2.671 -13.052 8.683
141 H CYS 22 H CYS 22 -2.480 -8.804 6.615
142 HA CYS 22 HA CYS 22 -3.253 -8.765 3.884
143 HB2 CYS 22 HB2 CYS 22 -1.907 -6.484 5.397
144 HB3 CYS 22 HB3 CYS 22 -3.071 -6.364 4.075
145 HG CYS 22 HG CYS 22 -5.115 -7.250 5.251
146 H LEU 23 H LEU 23 -0.060 -8.585 5.424
147 HA LEU 23 HA LEU 23 1.333 -7.662 3.097
148 HB2 LEU 23 HB2 LEU 23 3.108 -7.531 4.457
149 HB3 LEU 23 HB3 LEU 23 1.902 -7.590 5.694
150 HG LEU 23 HG LEU 23 2.505 -10.209 5.710
151 HD11 LEU 23 HD11 LEU 23 4.955 -10.512 5.218
152 HD12 LEU 23 HD12 LEU 23 4.999 -8.893 4.505
153 HD13 LEU 23 HD13 LEU 23 4.042 -10.175 3.742
154 HD21 LEU 23 HD21 LEU 23 2.840 -8.623 7.551
155 HD22 LEU 23 HD22 LEU 23 4.325 -8.018 6.785
156 HD23 LEU 23 HD23 LEU 23 4.241 -9.694 7.387
157 H ASP 24 H ASP 24 0.508 -10.748 4.539
158 HA ASP 24 HA ASP 24 2.073 -12.500 2.928
159 HB2 ASP 24 HB2 ASP 24 1.184 -13.255 4.974
160 HB3 ASP 24 HB3 ASP 24 -0.466 -12.932 4.486
161 H TYR 25 H TYR 25 -1.389 -11.460 2.696
162 HA TYR 25 HA TYR 25 -1.976 -12.803 0.294
163 HB2 TYR 25 HB2 TYR 25 -2.992 -10.103 1.237
164 HB3 TYR 25 HB3 TYR 25 -3.791 -11.130 0.025
165 HD1 TYR 25 HD1 TYR 25 -4.807 -9.915 2.765
166 HD2 TYR 25 HD2 TYR 25 -3.475 -13.846 1.557
167 HE1 TYR 25 HE1 TYR 25 -5.989 -10.901 4.693
168 HE2 TYR 25 HE2 TYR 25 -4.707 -14.848 3.439
169 HH TYR 25 HH TYR 25 -5.548 -14.304 5.622
170 H PHE 26 H PHE 26 -0.738 -9.405 0.726
171 HA PHE 26 HA PHE 26 -0.590 -8.825 -1.999
172 HB2 PHE 26 HB2 PHE 26 0.425 -7.726 0.557
173 HB3 PHE 26 HB3 PHE 26 1.462 -7.369 -0.758
174 HD1 PHE 26 HD1 PHE 26 0.380 -6.389 -2.978
175 HD2 PHE 26 HD2 PHE 26 -1.570 -6.489 0.876
176 HE1 PHE 26 HE1 PHE 26 -1.318 -4.796 -3.787
177 HE2 PHE 26 HE2 PHE 26 -3.223 -4.838 0.085
178 HZ PHE 26 HZ PHE 26 -3.129 -4.009 -2.250
179 H THR 27 H THR 27 1.917 -10.355 0.045
180 HA THR 27 HA THR 27 3.835 -10.391 -2.146
181 HB THR 27 HB THR 27 4.513 -10.176 0.188
182 HG1 THR 27 HG1 THR 27 6.170 -11.880 0.042
183 HG21 THR 27 HG21 THR 27 4.681 -11.993 1.724
184 HG22 THR 27 HG22 THR 27 3.941 -13.137 0.561
185 HG23 THR 27 HG23 THR 27 3.014 -11.789 1.251
186 H THR 28 H THR 28 1.396 -12.712 -0.900
187 HA THR 28 HA THR 28 2.355 -14.897 -2.441
188 HB THR 28 HB THR 28 0.413 -14.530 -0.499
189 HG1 THR 28 HG1 THR 28 0.175 -16.676 -0.593
190 HG21 THR 28 HG21 THR 28 -1.670 -15.509 -1.254
191 HG22 THR 28 HG22 THR 28 -1.120 -15.475 -2.940
192 HG23 THR 28 HG23 THR 28 -1.405 -13.955 -2.042
193 H GLN 29 H GLN 29 0.135 -12.152 -3.200
194 HA GLN 29 HA GLN 29 -0.667 -13.245 -5.735
195 HB2 GLN 29 HB2 GLN 29 -0.827 -10.575 -4.284
196 HB3 GLN 29 HB3 GLN 29 -1.472 -10.825 -5.915
197 HG2 GLN 29 HG2 GLN 29 -2.336 -12.691 -3.694
198 HG3 GLN 29 HG3 GLN 29 -3.077 -11.101 -3.889
199 HE21 GLN 29 HE21 GLN 29 -3.820 -14.248 -4.719
200 HE22 GLN 29 HE22 GLN 29 -4.569 -13.870 -6.274
201 H GLY 30 H GLY 30 2.011 -11.251 -4.608
202 HA2 GLY 30 HA2 GLY 30 3.946 -10.668 -5.688
203 HA3 GLY 30 HA3 GLY 30 3.395 -11.521 -7.136
204 H LEU 31 H LEU 31 1.684 -8.876 -5.470
205 HA LEU 31 HA LEU 31 2.279 -6.973 -7.724
206 HB2 LEU 31 HB2 LEU 31 -0.246 -6.390 -7.535
207 HB3 LEU 31 HB3 LEU 31 0.234 -7.829 -8.418
208 HG LEU 31 HG LEU 31 -0.371 -9.232 -6.576
209 HD11 LEU 31 HD11 LEU 31 -1.164 -6.733 -5.069
210 HD12 LEU 31 HD12 LEU 31 0.050 -7.941 -4.566
211 HD13 LEU 31 HD13 LEU 31 -1.662 -8.364 -4.587
212 HD21 LEU 31 HD21 LEU 31 -2.054 -8.549 -8.192
213 HD22 LEU 31 HD22 LEU 31 -2.579 -7.262 -7.092
214 HD23 LEU 31 HD23 LEU 31 -2.735 -8.984 -6.606
215 H THR 32 H THR 32 3.261 -7.109 -4.931
216 HA THR 32 HA THR 32 1.855 -4.958 -3.481
217 HB THR 32 HB THR 32 2.448 -6.897 -2.387
218 HG1 THR 32 HG1 THR 32 3.674 -6.310 -0.743
219 HG21 THR 32 HG21 THR 32 4.680 -7.861 -2.048
220 HG22 THR 32 HG22 THR 32 5.248 -6.882 -3.416
221 HG23 THR 32 HG23 THR 32 3.959 -8.105 -3.610
222 H THR 33 H THR 33 2.199 -2.802 -4.052
223 HA THR 33 HA THR 33 4.941 -1.939 -4.207
224 HB THR 33 HB THR 33 4.932 -2.364 -6.444
225 HG1 THR 33 HG1 THR 33 5.077 -0.288 -6.572
226 HG21 THR 33 HG21 THR 33 2.872 -2.417 -7.937
227 HG22 THR 33 HG22 THR 33 1.860 -2.314 -6.468
228 HG23 THR 33 HG23 THR 33 2.960 -3.679 -6.727
229 H ILE 34 H ILE 34 5.182 0.254 -3.944
230 HA ILE 34 HA ILE 34 2.953 1.554 -2.559
231 HB ILE 34 HB ILE 34 5.612 2.909 -3.095
232 HG12 ILE 34 HG12 ILE 34 5.027 0.722 -1.109
233 HG13 ILE 34 HG13 ILE 34 6.444 0.976 -2.140
234 HG21 ILE 34 HG21 ILE 34 3.664 3.123 -0.767
235 HG22 ILE 34 HG22 ILE 34 5.020 4.210 -1.169
236 HG23 ILE 34 HG23 ILE 34 3.592 4.174 -2.198
237 HD11 ILE 34 HD11 ILE 34 7.122 2.867 -0.651
238 HD12 ILE 34 HD12 ILE 34 5.708 2.513 0.388
239 HD13 ILE 34 HD13 ILE 34 6.963 1.309 0.209
240 H TYR 35 H TYR 35 4.990 2.179 -5.351
241 HA TYR 35 HA TYR 35 3.922 4.557 -6.270
242 HB2 TYR 35 HB2 TYR 35 5.017 2.443 -8.101
243 HB3 TYR 35 HB3 TYR 35 5.215 4.184 -8.202
244 HD1 TYR 35 HD1 TYR 35 7.307 1.828 -8.303
245 HD2 TYR 35 HD2 TYR 35 6.124 4.557 -5.162
246 HE1 TYR 35 HE1 TYR 35 9.450 1.449 -7.164
247 HE2 TYR 35 HE2 TYR 35 8.221 4.086 -3.961
248 HH TYR 35 HH TYR 35 10.805 2.017 -5.365
249 H GLN 36 H GLN 36 2.703 1.323 -6.563
250 HA GLN 36 HA GLN 36 0.847 2.052 -8.742
251 HB2 GLN 36 HB2 GLN 36 1.374 -0.445 -7.144
252 HB3 GLN 36 HB3 GLN 36 -0.057 -0.306 -8.130
253 HG2 GLN 36 HG2 GLN 36 2.777 -0.071 -9.161
254 HG3 GLN 36 HG3 GLN 36 1.646 -1.401 -9.475
255 HE21 GLN 36 HE21 GLN 36 -0.545 -0.675 -10.574
256 HE22 GLN 36 HE22 GLN 36 -0.431 0.602 -11.759
257 H ILE 37 H ILE 37 0.467 1.183 -5.215
258 HA ILE 37 HA ILE 37 -2.312 1.750 -5.292
259 HB ILE 37 HB ILE 37 -2.273 1.822 -2.901
260 HG12 ILE 37 HG12 ILE 37 0.748 1.606 -3.111
261 HG13 ILE 37 HG13 ILE 37 -0.109 3.084 -2.657
262 HG21 ILE 37 HG21 ILE 37 -2.293 -0.308 -4.166
263 HG22 ILE 37 HG22 ILE 37 -0.522 -0.416 -3.977
264 HG23 ILE 37 HG23 ILE 37 -1.587 -0.475 -2.562
265 HD11 ILE 37 HD11 ILE 37 -0.032 0.463 -1.169
266 HD12 ILE 37 HD12 ILE 37 0.670 2.030 -0.688
267 HD13 ILE 37 HD13 ILE 37 -1.094 1.830 -0.721
268 H GLU 38 H GLU 38 0.405 3.888 -5.264
269 HA GLU 38 HA GLU 38 -0.743 6.240 -4.240
270 HB2 GLU 38 HB2 GLU 38 1.659 5.405 -5.501
271 HB3 GLU 38 HB3 GLU 38 1.037 6.624 -6.571
272 HG2 GLU 38 HG2 GLU 38 1.512 6.924 -3.565
273 HG3 GLU 38 HG3 GLU 38 2.607 7.465 -4.833
274 H HIS 39 H HIS 39 -1.221 4.586 -7.348
275 HA HIS 39 HA HIS 39 -3.064 6.771 -8.226
276 HB2 HIS 39 HB2 HIS 39 -1.086 6.513 -9.613
277 HB3 HIS 39 HB3 HIS 39 -1.431 4.797 -9.831
278 HD1 HIS 39 HD1 HIS 39 -4.129 7.572 -10.215
279 HD2 HIS 39 HD2 HIS 39 -1.855 4.751 -12.338
280 HE1 HIS 39 HE1 HIS 39 -5.115 7.500 -12.547
281 H TYR 40 H TYR 40 -2.835 3.329 -7.451
282 HA TYR 40 HA TYR 40 -5.370 2.612 -8.691
283 HB2 TYR 40 HB2 TYR 40 -3.749 1.255 -6.488
284 HB3 TYR 40 HB3 TYR 40 -5.272 0.672 -7.042
285 HD1 TYR 40 HD1 TYR 40 -2.086 -0.482 -7.131
286 HD2 TYR 40 HD2 TYR 40 -5.152 0.823 -9.970
287 HE1 TYR 40 HE1 TYR 40 -1.350 -2.131 -8.740
288 HE2 TYR 40 HE2 TYR 40 -4.287 -0.794 -11.606
289 HH TYR 40 HH TYR 40 -2.702 -2.549 -12.011
290 H SER 41 H SER 41 -7.168 3.754 -8.036
291 HA SER 41 HA SER 41 -7.382 4.834 -5.359
292 HB2 SER 41 HB2 SER 41 -9.412 4.632 -7.602
293 HB3 SER 41 HB3 SER 41 -9.546 5.648 -6.153
294 HG SER 41 HG SER 41 -8.648 6.520 -8.274
295 H MET 42 H MET 42 -9.662 4.406 -4.257
296 HA MET 42 HA MET 42 -9.581 1.918 -3.122
297 HB2 MET 42 HB2 MET 42 -11.686 2.374 -2.117
298 HB3 MET 42 HB3 MET 42 -10.684 3.828 -2.105
299 HG2 MET 42 HG2 MET 42 -12.030 4.842 -3.831
300 HG3 MET 42 HG3 MET 42 -12.844 3.316 -4.181
301 HE1 MET 42 HE1 MET 42 -15.988 4.881 -2.811
302 HE2 MET 42 HE2 MET 42 -14.848 5.299 -4.109
303 HE3 MET 42 HE3 MET 42 -15.318 3.606 -3.849
304 H ASP 43 H ASP 43 -10.998 2.472 -6.251
305 HA ASP 43 HA ASP 43 -12.919 0.279 -6.150
306 HB2 ASP 43 HB2 ASP 43 -11.606 1.682 -8.507
307 HB3 ASP 43 HB3 ASP 43 -12.807 0.413 -8.665
308 H ASP 44 H ASP 44 -9.572 0.667 -7.439
309 HA ASP 44 HA ASP 44 -9.314 -2.027 -8.312
310 HB2 ASP 44 HB2 ASP 44 -7.698 0.259 -8.418
311 HB3 ASP 44 HB3 ASP 44 -6.791 -0.829 -7.387
312 H LEU 45 H LEU 45 -8.411 -0.369 -5.290
313 HA LEU 45 HA LEU 45 -7.295 -2.606 -3.948
314 HB2 LEU 45 HB2 LEU 45 -8.570 -0.055 -2.948
315 HB3 LEU 45 HB3 LEU 45 -8.130 -1.340 -1.830
316 HG LEU 45 HG LEU 45 -5.810 -1.229 -2.422
317 HD11 LEU 45 HD11 LEU 45 -5.885 -0.564 -4.794
318 HD12 LEU 45 HD12 LEU 45 -4.893 0.565 -3.875
319 HD13 LEU 45 HD13 LEU 45 -6.549 1.019 -4.340
320 HD21 LEU 45 HD21 LEU 45 -6.991 1.511 -1.786
321 HD22 LEU 45 HD22 LEU 45 -5.290 1.063 -1.598
322 HD23 LEU 45 HD23 LEU 45 -6.500 0.252 -0.638
323 H ALA 46 H ALA 46 -10.760 -1.552 -4.205
324 HA ALA 46 HA ALA 46 -11.764 -3.624 -2.500
325 HB1 ALA 46 HB1 ALA 46 -13.160 -2.242 -4.854
326 HB2 ALA 46 HB2 ALA 46 -13.932 -3.207 -3.577
327 HB3 ALA 46 HB3 ALA 46 -13.135 -1.686 -3.168
328 H SER 47 H SER 47 -11.306 -3.579 -6.126
329 HA SER 47 HA SER 47 -12.230 -6.261 -6.512
330 HB2 SER 47 HB2 SER 47 -10.421 -4.434 -8.114
331 HB3 SER 47 HB3 SER 47 -11.017 -6.006 -8.717
332 HG SER 47 HG SER 47 -12.175 -3.790 -9.008
333 H LEU 48 H LEU 48 -9.201 -5.031 -5.301
334 HA LEU 48 HA LEU 48 -7.760 -7.536 -5.823
335 HB2 LEU 48 HB2 LEU 48 -6.983 -4.845 -4.688
336 HB3 LEU 48 HB3 LEU 48 -5.888 -6.221 -4.599
337 HG LEU 48 HG LEU 48 -7.095 -5.279 -7.254
338 HD11 LEU 48 HD11 LEU 48 -5.779 -3.451 -6.343
339 HD12 LEU 48 HD12 LEU 48 -4.928 -4.196 -7.679
340 HD13 LEU 48 HD13 LEU 48 -4.404 -4.571 -6.031
341 HD21 LEU 48 HD21 LEU 48 -6.308 -7.549 -7.425
342 HD22 LEU 48 HD22 LEU 48 -4.834 -7.177 -6.516
343 HD23 LEU 48 HD23 LEU 48 -5.072 -6.524 -8.149
344 H LYS 49 H LYS 49 -10.122 -7.147 -3.876
345 HA LYS 49 HA LYS 49 -10.898 -8.243 -2.084
346 HB2 LYS 49 HB2 LYS 49 -8.240 -9.685 -1.782
347 HB3 LYS 49 HB3 LYS 49 -9.743 -10.069 -0.999
348 HG2 LYS 49 HG2 LYS 49 -9.424 -11.675 -2.648
349 HG3 LYS 49 HG3 LYS 49 -10.780 -10.668 -3.167
350 HD2 LYS 49 HD2 LYS 49 -9.478 -9.666 -4.910
351 HD3 LYS 49 HD3 LYS 49 -7.951 -10.152 -4.155
352 HE2 LYS 49 HE2 LYS 49 -8.326 -11.452 -6.120
353 HE3 LYS 49 HE3 LYS 49 -8.372 -12.487 -4.685
354 HZ1 LYS 49 HZ1 LYS 49 -10.819 -11.381 -5.895
355 HZ2 LYS 49 HZ2 LYS 49 -10.716 -12.606 -4.838
356 HZ3 LYS 49 HZ3 LYS 49 -10.175 -12.811 -6.385
357 H ILE 50 H ILE 50 -9.459 -5.610 -1.863
358 HA ILE 50 HA ILE 50 -8.590 -5.787 0.966
359 HB ILE 50 HB ILE 50 -8.377 -3.329 -0.743
360 HG12 ILE 50 HG12 ILE 50 -7.186 -5.004 -2.112
361 HG13 ILE 50 HG13 ILE 50 -6.084 -3.876 -1.371
362 HG21 ILE 50 HG21 ILE 50 -8.022 -3.330 1.754
363 HG22 ILE 50 HG22 ILE 50 -6.656 -4.387 1.514
364 HG23 ILE 50 HG23 ILE 50 -6.625 -2.763 0.799
365 HD11 ILE 50 HD11 ILE 50 -5.404 -5.557 0.263
366 HD12 ILE 50 HD12 ILE 50 -6.656 -6.673 -0.303
367 HD13 ILE 50 HD13 ILE 50 -5.307 -6.235 -1.376
368 HA PRO 51 HA PRO 51 -12.983 -4.378 1.270
369 HB2 PRO 51 HB2 PRO 51 -13.532 -5.178 3.797
370 HB3 PRO 51 HB3 PRO 51 -13.362 -6.363 2.470
371 HG2 PRO 51 HG2 PRO 51 -11.229 -5.510 4.466
372 HG3 PRO 51 HG3 PRO 51 -11.751 -7.171 4.060
373 HD2 PRO 51 HD2 PRO 51 -9.599 -6.060 2.864
374 HD3 PRO 51 HD3 PRO 51 -10.739 -7.116 1.967
375 H GLU 52 H GLU 52 -13.999 -2.638 2.516
376 HA GLU 52 HA GLU 52 -12.480 -0.394 3.026
377 HB2 GLU 52 HB2 GLU 52 -14.358 0.616 4.074
378 HB3 GLU 52 HB3 GLU 52 -14.903 -0.330 2.713
379 HG2 GLU 52 HG2 GLU 52 -15.159 -1.135 5.646
380 HG3 GLU 52 HG3 GLU 52 -16.442 -0.474 4.625
381 H GLN 53 H GLN 53 -13.367 -2.849 5.394
382 HA GLN 53 HA GLN 53 -12.670 -1.723 7.777
383 HB2 GLN 53 HB2 GLN 53 -13.723 -4.000 7.149
384 HB3 GLN 53 HB3 GLN 53 -12.078 -4.597 6.982
385 HG2 GLN 53 HG2 GLN 53 -12.655 -5.260 9.096
386 HG3 GLN 53 HG3 GLN 53 -11.800 -3.777 9.482
387 HE21 GLN 53 HE21 GLN 53 -14.489 -5.514 10.319
388 HE22 GLN 53 HE22 GLN 53 -15.596 -4.241 10.739
389 H PHE 54 H PHE 54 -10.443 -2.722 5.292
390 HA PHE 54 HA PHE 54 -8.140 -2.023 7.058
391 HB2 PHE 54 HB2 PHE 54 -8.006 -4.402 6.886
392 HB3 PHE 54 HB3 PHE 54 -8.345 -4.366 5.148
393 HD1 PHE 54 HD1 PHE 54 -6.707 -3.693 3.548
394 HD2 PHE 54 HD2 PHE 54 -5.750 -3.617 7.729
395 HE1 PHE 54 HE1 PHE 54 -4.265 -3.509 2.981
396 HE2 PHE 54 HE2 PHE 54 -3.351 -3.313 7.190
397 HZ PHE 54 HZ PHE 54 -2.593 -3.282 4.821
398 H ARG 55 H ARG 55 -9.424 -2.229 3.730
399 HA ARG 55 HA ARG 55 -7.509 -1.007 2.206
400 HB2 ARG 55 HB2 ARG 55 -9.546 -1.940 1.365
401 HB3 ARG 55 HB3 ARG 55 -10.529 -0.696 2.163
402 HG2 ARG 55 HG2 ARG 55 -9.571 1.051 0.700
403 HG3 ARG 55 HG3 ARG 55 -8.520 -0.158 -0.032
404 HD2 ARG 55 HD2 ARG 55 -10.328 0.239 -1.536
405 HD3 ARG 55 HD3 ARG 55 -10.563 -1.371 -0.873
406 HE ARG 55 HE ARG 55 -11.954 1.138 -0.023
407 HH11 ARG 55 HH11 ARG 55 -12.162 -2.432 -0.419
408 HH12 ARG 55 HH12 ARG 55 -13.880 -2.447 -0.181
409 HH21 ARG 55 HH21 ARG 55 -14.212 1.022 0.416
410 HH22 ARG 55 HH22 ARG 55 -15.020 -0.513 0.317
411 H HIS 56 H HIS 56 -9.867 0.630 4.376
412 HA HIS 56 HA HIS 56 -9.154 3.241 3.461
413 HB2 HIS 56 HB2 HIS 56 -10.489 2.181 5.996
414 HB3 HIS 56 HB3 HIS 56 -10.228 3.895 5.703
415 HD1 HIS 56 HD1 HIS 56 -12.901 4.446 5.464
416 HD2 HIS 56 HD2 HIS 56 -11.337 1.589 2.777
417 HE1 HIS 56 HE1 HIS 56 -14.542 4.244 3.531
418 H ALA 57 H ALA 57 -7.608 1.080 5.840
419 HA ALA 57 HA ALA 57 -6.003 3.153 7.025
420 HB1 ALA 57 HB1 ALA 57 -4.827 1.323 8.079
421 HB2 ALA 57 HB2 ALA 57 -6.566 0.941 8.073
422 HB3 ALA 57 HB3 ALA 57 -5.466 0.151 6.920
423 H ILE 58 H ILE 58 -5.337 0.632 4.475
424 HA ILE 58 HA ILE 58 -2.623 1.379 4.099
425 HB ILE 58 HB ILE 58 -3.132 -0.703 3.281
426 HG12 ILE 58 HG12 ILE 58 -3.180 1.096 0.809
427 HG13 ILE 58 HG13 ILE 58 -1.748 0.504 1.679
428 HG21 ILE 58 HG21 ILE 58 -5.581 -0.608 3.223
429 HG22 ILE 58 HG22 ILE 58 -5.484 0.236 1.645
430 HG23 ILE 58 HG23 ILE 58 -4.909 -1.428 1.839
431 HD11 ILE 58 HD11 ILE 58 -3.669 -0.989 -0.132
432 HD12 ILE 58 HD12 ILE 58 -1.919 -0.820 -0.267
433 HD13 ILE 58 HD13 ILE 58 -2.613 -1.856 0.990
434 H TRP 59 H TRP 59 -5.601 2.273 2.325
435 HA TRP 59 HA TRP 59 -4.256 4.005 0.538
436 HB2 TRP 59 HB2 TRP 59 -6.633 2.935 0.416
437 HB3 TRP 59 HB3 TRP 59 -7.172 4.391 1.239
438 HD1 TRP 59 HD1 TRP 59 -5.214 3.299 -1.901
439 HE1 TRP 59 HE1 TRP 59 -5.494 4.982 -3.788
440 HE3 TRP 59 HE3 TRP 59 -7.867 6.740 0.641
441 HZ2 TRP 59 HZ2 TRP 59 -6.737 7.620 -4.125
442 HZ3 TRP 59 HZ3 TRP 59 -8.583 8.893 -0.456
443 HH2 TRP 59 HH2 TRP 59 -8.010 9.322 -2.833
444 H LYS 60 H LYS 60 -6.216 4.894 3.502
445 HA LYS 60 HA LYS 60 -5.583 7.640 3.358
446 HB2 LYS 60 HB2 LYS 60 -7.318 6.534 4.809
447 HB3 LYS 60 HB3 LYS 60 -5.998 5.939 5.843
448 HG2 LYS 60 HG2 LYS 60 -6.984 7.773 6.929
449 HG3 LYS 60 HG3 LYS 60 -5.426 8.351 6.336
450 HD2 LYS 60 HD2 LYS 60 -6.452 9.572 4.555
451 HD3 LYS 60 HD3 LYS 60 -8.035 8.791 4.837
452 HE2 LYS 60 HE2 LYS 60 -8.161 9.807 7.085
453 HE3 LYS 60 HE3 LYS 60 -6.571 10.555 6.845
454 HZ1 LYS 60 HZ1 LYS 60 -8.340 12.112 6.334
455 HZ2 LYS 60 HZ2 LYS 60 -8.953 11.088 5.172
456 HZ3 LYS 60 HZ3 LYS 60 -7.443 11.772 5.027
457 H GLY 61 H GLY 61 -3.727 4.966 4.926
458 HA2 GLY 61 HA2 GLY 61 -1.832 6.585 6.221
459 HA3 GLY 61 HA3 GLY 61 -1.524 4.940 5.666
460 H ILE 62 H ILE 62 -1.612 5.163 2.915
461 HA ILE 62 HA ILE 62 0.955 6.407 2.456
462 HB ILE 62 HB ILE 62 -0.167 4.332 1.475
463 HG12 ILE 62 HG12 ILE 62 2.107 4.848 1.065
464 HG13 ILE 62 HG13 ILE 62 1.383 4.307 -0.430
465 HG21 ILE 62 HG21 ILE 62 -2.071 5.171 0.311
466 HG22 ILE 62 HG22 ILE 62 -1.049 6.235 -0.691
467 HG23 ILE 62 HG23 ILE 62 -0.921 4.477 -0.826
468 HD11 ILE 62 HD11 ILE 62 2.837 6.120 -0.978
469 HD12 ILE 62 HD12 ILE 62 1.193 6.762 -1.127
470 HD13 ILE 62 HD13 ILE 62 2.188 7.145 0.299
471 H LEU 63 H LEU 63 -2.436 7.268 1.623
472 HA LEU 63 HA LEU 63 -1.770 9.592 0.086
473 HB2 LEU 63 HB2 LEU 63 -4.214 8.651 1.583
474 HB3 LEU 63 HB3 LEU 63 -4.128 10.326 1.152
475 HG LEU 63 HG LEU 63 -5.367 8.919 -0.470
476 HD11 LEU 63 HD11 LEU 63 -2.956 10.324 -1.667
477 HD12 LEU 63 HD12 LEU 63 -4.411 11.139 -1.051
478 HD13 LEU 63 HD13 LEU 63 -4.525 10.028 -2.445
479 HD21 LEU 63 HD21 LEU 63 -3.964 6.901 -0.618
480 HD22 LEU 63 HD22 LEU 63 -2.640 7.862 -1.325
481 HD23 LEU 63 HD23 LEU 63 -4.157 7.654 -2.202
482 H ASP 64 H ASP 64 -1.981 8.981 3.518
483 HA ASP 64 HA ASP 64 -1.837 11.753 4.414
484 HB2 ASP 64 HB2 ASP 64 -1.144 9.135 5.838
485 HB3 ASP 64 HB3 ASP 64 -0.956 10.699 6.582
486 H HIS 65 H HIS 65 0.478 9.232 3.675
487 HA HIS 65 HA HIS 65 2.856 10.493 4.745
488 HB2 HIS 65 HB2 HIS 65 2.888 8.067 4.398
489 HB3 HIS 65 HB3 HIS 65 2.427 8.255 2.729
490 HD1 HIS 65 HD1 HIS 65 5.494 10.076 4.443
491 HD2 HIS 65 HD2 HIS 65 4.386 7.395 1.362
492 HE1 HIS 65 HE1 HIS 65 7.543 9.645 3.132
493 H ARG 66 H ARG 66 1.669 10.000 1.431
494 HA ARG 66 HA ARG 66 3.628 11.708 0.247
495 HB2 ARG 66 HB2 ARG 66 2.327 11.548 -1.818
496 HB3 ARG 66 HB3 ARG 66 2.472 9.982 -1.020
497 HG2 ARG 66 HG2 ARG 66 0.242 9.808 -1.382
498 HG3 ARG 66 HG3 ARG 66 0.121 10.782 0.055
499 HD2 ARG 66 HD2 ARG 66 -1.262 11.952 -1.354
500 HD3 ARG 66 HD3 ARG 66 0.255 12.829 -1.556
501 HE ARG 66 HE ARG 66 -0.321 10.528 -3.346
502 HH11 ARG 66 HH11 ARG 66 -0.022 14.077 -3.164
503 HH12 ARG 66 HH12 ARG 66 -0.085 14.265 -4.897
504 HH21 ARG 66 HH21 ARG 66 -0.108 10.789 -5.493
505 HH22 ARG 66 HH22 ARG 66 -0.134 12.333 -6.271
506 H GLN 67 H GLN 67 0.438 12.461 1.739
507 HA GLN 67 HA GLN 67 0.362 15.110 0.612
508 HB2 GLN 67 HB2 GLN 67 -1.597 13.883 1.424
509 HB3 GLN 67 HB3 GLN 67 -0.935 13.862 3.076
510 HG2 GLN 67 HG2 GLN 67 -2.536 15.552 3.044
511 HG3 GLN 67 HG3 GLN 67 -1.014 16.389 2.998
512 HE21 GLN 67 HE21 GLN 67 -3.395 14.950 0.737
513 HE22 GLN 67 HE22 GLN 67 -3.455 16.280 -0.415
514 H LEU 68 H LEU 68 1.707 13.692 3.656
515 HA LEU 68 HA LEU 68 2.569 16.371 4.546
516 HB2 LEU 68 HB2 LEU 68 2.577 13.614 5.806
517 HB3 LEU 68 HB3 LEU 68 3.186 15.071 6.618
518 HG LEU 68 HG LEU 68 0.303 14.629 5.687
519 HD11 LEU 68 HD11 LEU 68 -0.228 14.571 8.059
520 HD12 LEU 68 HD12 LEU 68 1.486 14.815 8.484
521 HD13 LEU 68 HD13 LEU 68 0.966 13.324 7.667
522 HD21 LEU 68 HD21 LEU 68 0.784 17.019 5.521
523 HD22 LEU 68 HD22 LEU 68 1.514 17.017 7.141
524 HD23 LEU 68 HD23 LEU 68 -0.228 16.713 6.920
525 H HIS 69 H HIS 69 4.010 14.073 2.534
526 HA HIS 69 HA HIS 69 6.553 15.388 2.839
527 HB2 HIS 69 HB2 HIS 69 6.521 13.515 4.608
528 HB3 HIS 69 HB3 HIS 69 6.490 12.378 3.266
529 HD1 HIS 69 HD1 HIS 69 8.774 12.567 1.561
530 HD2 HIS 69 HD2 HIS 69 8.778 14.754 5.183
531 HE1 HIS 69 HE1 HIS 69 11.187 13.129 2.054
532 H ASP 70 H ASP 70 7.078 15.761 0.772
533 HA ASP 70 HA ASP 70 6.666 13.686 -1.313
534 HB2 ASP 70 HB2 ASP 70 4.861 15.226 -1.698
535 HB3 ASP 70 HB3 ASP 70 5.912 16.631 -1.454