Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
612518 | 2nbf RC | 25974 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 H ALA 1 1.807 -0.001 0.855
2 HA ALA 1 HA ALA 1 2.000 -0.980 -1.690
3 HB1 ALA 1 1HB ALA 1 0.735 0.561 -2.795
4 HB2 ALA 1 2HB ALA 1 1.120 1.857 -1.662
5 HB3 ALA 1 3HB ALA 1 2.303 1.365 -2.874
6 H LYS 2 H LYS 2 4.104 -1.175 -2.236
7 HA LYS 2 HA LYS 2 6.370 -1.009 -2.126
8 HB2 LYS 2 2HB LYS 2 5.414 1.653 -2.180
9 HB3 LYS 2 3HB LYS 2 6.702 1.603 -0.984
10 HG2 LYS 2 2HG LYS 2 7.485 0.167 -3.343
11 HG3 LYS 2 3HG LYS 2 6.953 1.797 -3.760
12 HD2 LYS 2 2HD LYS 2 8.916 1.224 -1.550
13 HD3 LYS 2 3HD LYS 2 9.408 1.539 -3.216
14 HE2 LYS 2 2HE LYS 2 7.590 3.569 -2.523
15 HE3 LYS 2 3HE LYS 2 8.683 3.394 -1.151
16 HZ1 LYS 2 3HZ LYS 2 9.734 3.571 -3.902
17 HZ2 LYS 2 1HZ LYS 2 10.517 3.915 -2.442
18 HZ3 LYS 2 2HZ LYS 2 9.338 4.971 -3.039
19 H TYR 3 H TYR 3 7.082 -2.356 -0.587
20 HA TYR 3 HA TYR 3 6.644 -1.823 2.216
21 HB2 TYR 3 2HB TYR 3 8.322 -3.999 0.954
22 HB3 TYR 3 3HB TYR 3 7.712 -3.958 2.604
23 HD1 TYR 3 HD1 TYR 3 5.135 -3.912 2.883
24 HD2 TYR 3 HD2 TYR 3 7.100 -5.081 -0.705
25 HE1 TYR 3 HE1 TYR 3 3.107 -5.106 2.169
26 HE2 TYR 3 HE2 TYR 3 5.077 -6.277 -1.430
27 HH TYR 3 HH TYR 3 2.676 -6.258 -1.007
28 H THR 4 H THR 4 8.141 -1.220 3.724
29 HA THR 4 HA THR 4 10.757 -0.347 2.681
30 HB THR 4 HB THR 4 9.363 0.836 5.081
31 HG1 THR 4 HG1 THR 4 8.103 1.789 3.679
32 HG21 THR 4 3HG2 THR 4 11.943 1.168 3.844
33 HG22 THR 4 1HG2 THR 4 11.326 1.860 5.344
34 HG23 THR 4 2HG2 THR 4 11.043 2.685 3.811
35 H GLY 5 H GLY 5 12.576 -1.001 3.701
36 HA2 GLY 5 2HA GLY 5 12.543 -1.998 6.402
37 HA3 GLY 5 3HA GLY 5 12.731 -3.268 5.202
38 H LYS 6 H LYS 6 14.798 -3.666 6.223
39 HA LYS 6 HA LYS 6 16.882 -1.961 5.069
40 HB2 LYS 6 2HB LYS 6 17.162 -3.028 7.867
41 HB3 LYS 6 3HB LYS 6 18.120 -1.789 7.068
42 HG2 LYS 6 2HG LYS 6 16.857 -0.427 8.345
43 HG3 LYS 6 3HG LYS 6 15.732 -0.591 6.994
44 HD2 LYS 6 2HD LYS 6 14.539 -2.348 8.161
45 HD3 LYS 6 3HD LYS 6 15.708 -2.299 9.483
46 HE2 LYS 6 2HE LYS 6 14.718 -0.530 10.431
47 HE3 LYS 6 3HE LYS 6 14.537 0.303 8.888
48 HZ1 LYS 6 3HZ LYS 6 12.516 -0.755 10.342
49 HZ2 LYS 6 1HZ LYS 6 12.785 -1.956 9.181
50 HZ3 LYS 6 2HZ LYS 6 12.436 -0.374 8.695
51 H CYS 7 H CYS 7 18.906 -3.021 4.748
52 HA CYS 7 HA CYS 7 18.655 -5.954 4.656
53 HB2 CYS 7 2HB CYS 7 20.768 -4.739 3.020
54 HB3 CYS 7 3HB CYS 7 19.569 -5.955 2.592
55 H THR 8 H THR 8 21.248 -6.665 4.209
56 HA THR 8 HA THR 8 22.816 -5.548 6.418
57 HB THR 8 HB THR 8 22.902 -8.498 6.194
58 HG1 THR 8 HG1 THR 8 20.651 -7.068 7.172
59 HG21 THR 8 3HG2 THR 8 22.827 -8.126 8.754
60 HG22 THR 8 1HG2 THR 8 23.074 -6.427 8.356
61 HG23 THR 8 2HG2 THR 8 24.269 -7.629 7.870
62 H LYS 9 H LYS 9 24.836 -5.166 5.803
63 HA LYS 9 HA LYS 9 25.799 -5.779 3.237
64 HB2 LYS 9 2HB LYS 9 27.852 -4.781 3.918
65 HB3 LYS 9 3HB LYS 9 26.564 -3.893 4.722
66 HG2 LYS 9 2HG LYS 9 27.870 -4.151 6.527
67 HG3 LYS 9 3HG LYS 9 27.111 -5.743 6.602
68 HD2 LYS 9 2HD LYS 9 28.980 -6.819 5.821
69 HD3 LYS 9 3HD LYS 9 29.548 -5.410 4.922
70 HE2 LYS 9 2HE LYS 9 30.706 -4.610 6.675
71 HE3 LYS 9 3HE LYS 9 29.445 -5.039 7.829
72 HZ1 LYS 9 3HZ LYS 9 31.770 -6.251 7.789
73 HZ2 LYS 9 1HZ LYS 9 30.985 -7.221 6.647
74 HZ3 LYS 9 2HZ LYS 9 30.349 -7.068 8.207
75 H SER 10 H SER 10 25.639 -7.672 6.050
76 HA SER 10 HA SER 10 27.874 -9.257 6.028
77 HB2 SER 10 2HB SER 10 26.256 -9.615 7.736
78 HB3 SER 10 3HB SER 10 24.990 -9.976 6.563
79 HG SER 10 HG SER 10 27.278 -11.548 7.154
80 H LYS 11 H LYS 11 24.860 -10.023 4.276
81 HA LYS 11 HA LYS 11 26.462 -11.191 2.125
82 HB2 LYS 11 2HB LYS 11 24.871 -12.690 4.018
83 HB3 LYS 11 3HB LYS 11 24.256 -12.904 2.385
84 HG2 LYS 11 2HG LYS 11 26.936 -13.198 2.006
85 HG3 LYS 11 3HG LYS 11 26.718 -13.889 3.616
86 HD2 LYS 11 2HD LYS 11 24.802 -15.226 2.624
87 HD3 LYS 11 3HD LYS 11 25.387 -14.706 1.042
88 HE2 LYS 11 2HE LYS 11 27.178 -16.049 3.046
89 HE3 LYS 11 3HE LYS 11 26.191 -16.969 1.912
90 HZ1 LYS 11 3HZ LYS 11 27.916 -16.747 0.540
91 HZ2 LYS 11 1HZ LYS 11 28.623 -15.512 1.455
92 HZ3 LYS 11 2HZ LYS 11 27.416 -15.145 0.330
93 H ASN 12 H ASN 12 24.453 -8.893 2.805
94 HA ASN 12 HA ASN 12 22.957 -7.643 1.633
95 HB2 ASN 12 2HB ASN 12 23.939 -7.538 -0.398
96 HB3 ASN 12 3HB ASN 12 24.303 -9.261 -0.412
97 HD21 ASN 12 2HD2 ASN 12 20.917 -7.821 -2.145
98 HD22 ASN 12 1HD2 ASN 12 21.866 -6.846 -1.080
99 H GLU 13 H GLU 13 20.910 -7.795 2.251
100 HA GLU 13 HA GLU 13 19.067 -9.545 1.022
101 HB2 GLU 13 2HB GLU 13 20.461 -10.777 3.075
102 HB3 GLU 13 3HB GLU 13 18.971 -10.258 3.849
103 HG2 GLU 13 2HG GLU 13 17.735 -11.376 1.964
104 HG3 GLU 13 3HG GLU 13 19.279 -12.070 1.474
105 H CYS 14 H CYS 14 17.801 -7.761 0.736
106 HA CYS 14 HA CYS 14 17.186 -5.928 2.837
107 HB2 CYS 14 2HB CYS 14 17.174 -5.284 0.448
108 HB3 CYS 14 3HB CYS 14 15.791 -6.341 0.184
109 H LYS 15 H LYS 15 15.775 -6.189 4.424
110 HA LYS 15 HA LYS 15 13.886 -8.397 4.330
111 HB2 LYS 15 2HB LYS 15 15.164 -8.139 6.365
112 HB3 LYS 15 3HB LYS 15 14.642 -6.468 6.530
113 HG2 LYS 15 2HG LYS 15 12.496 -8.484 6.406
114 HG3 LYS 15 3HG LYS 15 13.518 -8.517 7.844
115 HD2 LYS 15 2HD LYS 15 12.159 -6.038 6.796
116 HD3 LYS 15 3HD LYS 15 11.481 -7.080 8.049
117 HE2 LYS 15 2HE LYS 15 13.901 -6.678 9.102
118 HE3 LYS 15 3HE LYS 15 13.763 -5.191 8.165
119 HZ1 LYS 15 3HZ LYS 15 12.539 -4.378 9.803
120 HZ2 LYS 15 1HZ LYS 15 12.534 -5.860 10.620
121 HZ3 LYS 15 2HZ LYS 15 11.344 -5.526 9.465
122 H TYR 16 H TYR 16 11.649 -8.179 4.625
123 HA TYR 16 HA TYR 16 10.337 -5.682 4.892
124 HB2 TYR 16 2HB TYR 16 9.500 -5.316 2.700
125 HB3 TYR 16 3HB TYR 16 11.234 -5.558 2.519
126 HD1 TYR 16 HD1 TYR 16 8.182 -6.325 1.110
127 HD2 TYR 16 HD2 TYR 16 11.841 -8.196 2.213
128 HE1 TYR 16 HE1 TYR 16 7.756 -8.111 -0.527
129 HE2 TYR 16 HE2 TYR 16 11.426 -9.986 0.578
130 HH TYR 16 HH TYR 16 9.379 -11.010 -0.548
131 H LYS 17 H LYS 17 7.932 -6.132 3.731
132 HA LYS 17 HA LYS 17 7.091 -8.738 4.821
133 HB2 LYS 17 2HB LYS 17 4.934 -7.606 5.420
134 HB3 LYS 17 3HB LYS 17 6.328 -7.056 6.340
135 HG2 LYS 17 2HG LYS 17 6.183 -5.369 4.114
136 HG3 LYS 17 3HG LYS 17 4.525 -5.556 4.689
137 HD2 LYS 17 2HD LYS 17 5.719 -5.177 7.038
138 HD3 LYS 17 3HD LYS 17 6.875 -4.320 6.015
139 HE2 LYS 17 2HE LYS 17 4.097 -3.688 5.394
140 HE3 LYS 17 3HE LYS 17 4.546 -3.280 7.049
141 HZ1 LYS 17 3HZ LYS 17 6.465 -2.503 5.024
142 HZ2 LYS 17 1HZ LYS 17 5.897 -1.644 6.367
143 HZ3 LYS 17 2HZ LYS 17 4.981 -1.694 4.946
144 H ASN 18 H ASN 18 5.640 -9.926 3.656
145 HA ASN 18 HA ASN 18 5.068 -8.942 0.951
146 HB2 ASN 18 2HB ASN 18 4.571 -11.387 0.492
147 HB3 ASN 18 3HB ASN 18 6.246 -11.010 0.885
148 HD21 ASN 18 2HD2 ASN 18 6.278 -12.770 3.915
149 HD22 ASN 18 1HD2 ASN 18 7.026 -11.525 2.978
150 H ASP 19 H ASP 19 3.505 -10.757 3.587
151 HA ASP 19 HA ASP 19 0.886 -10.331 2.430
152 HB2 ASP 19 2HB ASP 19 1.977 -11.860 4.747
153 HB3 ASP 19 3HB ASP 19 0.275 -11.406 4.782
154 H ALA 20 H ALA 20 2.750 -9.176 5.197
155 HA ALA 20 HA ALA 20 1.509 -6.668 5.270
156 HB1 ALA 20 1HB ALA 20 -0.483 -7.429 6.105
157 HB2 ALA 20 2HB ALA 20 0.266 -8.764 6.980
158 HB3 ALA 20 3HB ALA 20 0.392 -7.120 7.604
159 H GLY 21 H GLY 21 2.626 -9.064 7.678
160 HA2 GLY 21 2HA GLY 21 4.806 -7.199 8.360
161 HA3 GLY 21 3HA GLY 21 3.821 -7.917 9.626
162 H LYS 22 H LYS 22 4.443 -9.898 6.903
163 HA LYS 22 HA LYS 22 5.872 -11.792 8.498
164 HB2 LYS 22 2HB LYS 22 4.643 -11.705 5.857
165 HB3 LYS 22 3HB LYS 22 6.166 -12.584 5.852
166 HG2 LYS 22 2HG LYS 22 4.981 -13.617 8.060
167 HG3 LYS 22 3HG LYS 22 3.580 -13.291 7.038
168 HD2 LYS 22 2HD LYS 22 4.070 -15.340 6.213
169 HD3 LYS 22 3HD LYS 22 5.212 -14.424 5.227
170 HE2 LYS 22 2HE LYS 22 6.574 -14.902 7.598
171 HE3 LYS 22 3HE LYS 22 5.704 -16.403 7.288
172 HZ1 LYS 22 3HZ LYS 22 8.002 -16.158 6.276
173 HZ2 LYS 22 1HZ LYS 22 7.300 -15.072 5.185
174 HZ3 LYS 22 2HZ LYS 22 6.766 -16.676 5.243
175 H ASP 23 H ASP 23 7.898 -11.330 9.094
176 HA ASP 23 HA ASP 23 9.700 -9.690 7.720
177 HB2 ASP 23 2HB ASP 23 10.563 -11.944 9.522
178 HB3 ASP 23 3HB ASP 23 11.327 -10.375 9.289
179 H THR 24 H THR 24 10.018 -10.163 5.595
180 HA THR 24 HA THR 24 11.251 -12.775 5.000
181 HB THR 24 HB THR 24 9.490 -11.117 3.183
182 HG1 THR 24 HG1 THR 24 8.973 -13.777 3.941
183 HG21 THR 24 3HG2 THR 24 9.710 -13.194 1.712
184 HG22 THR 24 1HG2 THR 24 11.108 -13.607 2.703
185 HG23 THR 24 2HG2 THR 24 11.097 -12.107 1.775
186 H PHE 25 H PHE 25 13.148 -12.777 3.919
187 HA PHE 25 HA PHE 25 14.353 -10.166 3.362
188 HB2 PHE 25 2HB PHE 25 15.773 -12.826 3.392
189 HB3 PHE 25 3HB PHE 25 16.475 -11.220 3.553
190 HD1 PHE 25 HD1 PHE 25 14.779 -9.975 5.564
191 HD2 PHE 25 HD2 PHE 25 16.279 -13.952 5.342
192 HE1 PHE 25 HE1 PHE 25 14.641 -10.160 8.013
193 HE2 PHE 25 HE2 PHE 25 16.143 -14.143 7.791
194 HZ PHE 25 HZ PHE 25 15.323 -12.246 9.130
195 H ILE 26 H ILE 26 15.487 -9.770 1.411
196 HA ILE 26 HA ILE 26 15.265 -11.642 -0.778
197 HB ILE 26 HB ILE 26 13.044 -10.517 -0.765
198 HG12 ILE 26 2HG1 ILE 26 13.269 -9.668 -3.208
199 HG13 ILE 26 3HG1 ILE 26 14.950 -10.170 -3.065
200 HG21 ILE 26 1HG2 ILE 26 12.778 -8.298 -0.679
201 HG22 ILE 26 2HG2 ILE 26 14.459 -8.256 -0.149
202 HG23 ILE 26 3HG2 ILE 26 14.064 -8.006 -1.850
203 HD11 ILE 26 3HD1 ILE 26 14.391 -12.412 -2.872
204 HD12 ILE 26 1HD1 ILE 26 12.723 -12.058 -2.422
205 HD13 ILE 26 2HD1 ILE 26 13.262 -11.804 -4.083
206 H LYS 27 H LYS 27 16.853 -11.354 -2.240
207 HA LYS 27 HA LYS 27 18.965 -9.564 -1.689
208 HB2 LYS 27 2HB LYS 27 18.475 -10.993 -4.303
209 HB3 LYS 27 3HB LYS 27 20.015 -10.434 -3.664
210 HG2 LYS 27 2HG LYS 27 19.800 -12.060 -1.819
211 HG3 LYS 27 3HG LYS 27 18.312 -12.657 -2.557
212 HD2 LYS 27 2HD LYS 27 19.461 -13.472 -4.451
213 HD3 LYS 27 3HD LYS 27 20.924 -12.570 -4.047
214 HE2 LYS 27 2HE LYS 27 20.013 -14.454 -1.984
215 HE3 LYS 27 3HE LYS 27 20.525 -15.200 -3.497
216 HZ1 LYS 27 3HZ LYS 27 22.217 -13.157 -2.221
217 HZ2 LYS 27 1HZ LYS 27 22.661 -14.413 -3.265
218 HZ3 LYS 27 2HZ LYS 27 22.256 -14.752 -1.658
219 H CYS 28 H CYS 28 19.891 -8.238 -3.667
220 HA CYS 28 HA CYS 28 17.711 -6.488 -4.603
221 HB2 CYS 28 2HB CYS 28 20.566 -5.601 -4.244
222 HB3 CYS 28 3HB CYS 28 19.117 -4.608 -4.363
223 HA PRO 29 HA PRO 29 19.634 -8.336 -8.374
224 HB2 PRO 29 2HB PRO 29 17.283 -8.609 -9.703
225 HB3 PRO 29 3HB PRO 29 17.894 -9.823 -8.573
226 HG2 PRO 29 2HG PRO 29 15.844 -7.687 -8.132
227 HG3 PRO 29 3HG PRO 29 15.823 -9.382 -7.613
228 HD2 PRO 29 2HD PRO 29 16.484 -7.356 -5.943
229 HD3 PRO 29 3HD PRO 29 17.193 -8.977 -5.804
230 H LYS 30 H LYS 30 17.626 -5.614 -7.691
231 HA LYS 30 HA LYS 30 17.428 -4.449 -10.233
232 HB2 LYS 30 2HB LYS 30 16.754 -3.748 -7.584
233 HB3 LYS 30 3HB LYS 30 17.747 -2.435 -8.203
234 HG2 LYS 30 2HG LYS 30 15.286 -3.528 -9.552
235 HG3 LYS 30 3HG LYS 30 15.347 -2.066 -8.565
236 HD2 LYS 30 2HD LYS 30 16.960 -1.085 -10.127
237 HD3 LYS 30 3HD LYS 30 16.891 -2.547 -11.114
238 HE2 LYS 30 2HE LYS 30 14.712 -2.121 -11.809
239 HE3 LYS 30 3HE LYS 30 14.397 -1.020 -10.469
240 HZ1 LYS 30 3HZ LYS 30 16.119 0.467 -11.529
241 HZ2 LYS 30 1HZ LYS 30 14.650 0.324 -12.354
242 HZ3 LYS 30 2HZ LYS 30 16.011 -0.520 -12.898
243 H PHE 31 H PHE 31 19.654 -3.458 -7.624
244 HA PHE 31 HA PHE 31 21.512 -2.505 -9.692
245 HB2 PHE 31 2HB PHE 31 21.968 -1.811 -6.843
246 HB3 PHE 31 3HB PHE 31 22.159 -0.823 -8.288
247 HD1 PHE 31 HD1 PHE 31 20.359 0.503 -9.134
248 HD2 PHE 31 HD2 PHE 31 19.782 -2.053 -5.780
249 HE1 PHE 31 HE1 PHE 31 18.221 1.622 -8.653
250 HE2 PHE 31 HE2 PHE 31 17.643 -0.939 -5.294
251 HZ PHE 31 HZ PHE 31 16.859 0.901 -6.732
252 H ASP 32 H ASP 32 22.572 -4.413 -10.177
253 HA ASP 32 HA ASP 32 23.601 -6.188 -8.215
254 HB2 ASP 32 2HB ASP 32 24.992 -7.039 -10.181
255 HB3 ASP 32 3HB ASP 32 23.241 -7.109 -10.362
256 H ASN 33 H ASN 33 24.589 -3.133 -9.221
257 HA ASN 33 HA ASN 33 27.345 -3.612 -8.301
258 HB2 ASN 33 2HB ASN 33 26.315 -2.194 -10.563
259 HB3 ASN 33 3HB ASN 33 27.127 -1.047 -9.502
260 HD21 ASN 33 2HD2 ASN 33 29.393 -4.195 -10.805
261 HD22 ASN 33 1HD2 ASN 33 27.777 -4.448 -10.247
262 H LYS 34 H LYS 34 24.406 -1.909 -7.715
263 HA LYS 34 HA LYS 34 25.697 -0.457 -5.497
264 HB2 LYS 34 2HB LYS 34 23.344 0.362 -7.206
265 HB3 LYS 34 3HB LYS 34 23.804 1.186 -5.722
266 HG2 LYS 34 2HG LYS 34 25.568 0.882 -8.143
267 HG3 LYS 34 3HG LYS 34 24.623 2.318 -7.745
268 HD2 LYS 34 2HD LYS 34 26.046 1.749 -5.424
269 HD3 LYS 34 3HD LYS 34 27.195 1.458 -6.732
270 HE2 LYS 34 2HE LYS 34 25.543 3.922 -6.860
271 HE3 LYS 34 3HE LYS 34 26.836 3.864 -5.663
272 HZ1 LYS 34 3HZ LYS 34 27.505 4.812 -7.836
273 HZ2 LYS 34 1HZ LYS 34 27.228 3.304 -8.551
274 HZ3 LYS 34 2HZ LYS 34 28.429 3.474 -7.373
275 H LYS 35 H LYS 35 24.674 -3.139 -5.392
276 HA LYS 35 HA LYS 35 22.082 -3.196 -4.238
277 HB2 LYS 35 2HB LYS 35 22.717 -5.480 -3.496
278 HB3 LYS 35 3HB LYS 35 23.011 -5.201 -5.208
279 HG2 LYS 35 2HG LYS 35 25.417 -4.540 -4.256
280 HG3 LYS 35 3HG LYS 35 24.919 -5.682 -3.005
281 HD2 LYS 35 2HD LYS 35 24.748 -7.449 -4.517
282 HD3 LYS 35 3HD LYS 35 24.653 -6.370 -5.911
283 HE2 LYS 35 2HE LYS 35 26.854 -6.472 -6.182
284 HE3 LYS 35 3HE LYS 35 27.113 -5.912 -4.531
285 HZ1 LYS 35 3HZ LYS 35 27.324 -8.564 -5.617
286 HZ2 LYS 35 1HZ LYS 35 26.409 -8.502 -4.196
287 HZ3 LYS 35 2HZ LYS 35 27.996 -7.918 -4.206
288 H CYS 36 H CYS 36 21.844 -4.207 -1.943
289 HA CYS 36 HA CYS 36 22.608 -2.278 -0.069
290 HB2 CYS 36 2HB CYS 36 21.415 -5.014 0.104
291 HB3 CYS 36 3HB CYS 36 21.979 -4.240 1.581
292 H THR 37 H THR 37 24.544 -1.886 0.750
293 HA THR 37 HA THR 37 26.340 -4.159 1.282
294 HB THR 37 HB THR 37 28.264 -2.672 0.761
295 HG1 THR 37 HG1 THR 37 26.151 -0.914 0.119
296 HG21 THR 37 3HG2 THR 37 28.240 -3.126 -1.506
297 HG22 THR 37 1HG2 THR 37 26.533 -2.720 -1.677
298 HG23 THR 37 2HG2 THR 37 27.007 -4.238 -0.914
299 H LYS 38 H LYS 38 24.435 -2.293 2.859
300 HA LYS 38 HA LYS 38 26.367 -1.697 5.000
301 HB2 LYS 38 2HB LYS 38 24.732 0.150 3.601
302 HB3 LYS 38 3HB LYS 38 24.065 -0.005 5.221
303 HG2 LYS 38 2HG LYS 38 25.664 1.809 5.123
304 HG3 LYS 38 3HG LYS 38 26.257 0.519 6.172
305 HD2 LYS 38 2HD LYS 38 28.118 1.132 4.888
306 HD3 LYS 38 3HD LYS 38 27.511 -0.332 4.110
307 HE2 LYS 38 2HE LYS 38 27.348 0.780 2.196
308 HE3 LYS 38 3HE LYS 38 26.159 1.850 2.937
309 HZ1 LYS 38 3HZ LYS 38 27.722 3.446 3.360
310 HZ2 LYS 38 1HZ LYS 38 28.344 2.802 1.924
311 HZ3 LYS 38 2HZ LYS 38 29.012 2.353 3.412
312 H ASP 39 H ASP 39 25.423 -1.688 7.172
313 HA ASP 39 HA ASP 39 23.466 -3.832 7.432
314 HB2 ASP 39 2HB ASP 39 25.339 -2.493 9.379
315 HB3 ASP 39 3HB ASP 39 24.094 -3.625 9.901
316 H ASN 40 H ASN 40 21.395 -3.474 7.858
317 HA ASN 40 HA ASN 40 19.451 -2.459 8.459
318 HB2 ASN 40 2HB ASN 40 21.016 -0.616 10.250
319 HB3 ASN 40 3HB ASN 40 19.391 -1.254 10.479
320 HD21 ASN 40 2HD2 ASN 40 22.435 -3.067 12.190
321 HD22 ASN 40 1HD2 ASN 40 22.430 -1.451 11.581
322 H ASN 41 H ASN 41 20.760 -1.514 6.158
323 HA ASN 41 HA ASN 41 20.751 1.356 6.137
324 HB2 ASN 41 2HB ASN 41 21.122 1.123 3.718
325 HB3 ASN 41 3HB ASN 41 22.220 0.094 4.633
326 HD21 ASN 41 2HD2 ASN 41 21.156 -2.850 3.179
327 HD22 ASN 41 1HD2 ASN 41 22.238 -2.030 4.247
328 H LYS 42 H LYS 42 19.479 2.081 3.853
329 HA LYS 42 HA LYS 42 16.660 1.619 4.544
330 HB2 LYS 42 2HB LYS 42 17.726 3.858 2.832
331 HB3 LYS 42 3HB LYS 42 16.163 3.755 3.632
332 HG2 LYS 42 2HG LYS 42 17.385 3.822 5.820
333 HG3 LYS 42 3HG LYS 42 18.854 4.175 4.907
334 HD2 LYS 42 2HD LYS 42 16.571 5.869 4.203
335 HD3 LYS 42 3HD LYS 42 17.110 6.045 5.875
336 HE2 LYS 42 2HE LYS 42 18.340 7.628 4.632
337 HE3 LYS 42 3HE LYS 42 19.453 6.298 4.948
338 HZ1 LYS 42 3HZ LYS 42 19.326 5.572 2.759
339 HZ2 LYS 42 1HZ LYS 42 19.366 7.256 2.601
340 HZ3 LYS 42 2HZ LYS 42 17.901 6.426 2.439
341 H CYS 43 H CYS 43 15.731 0.126 3.309
342 HA CYS 43 HA CYS 43 15.990 0.349 0.408
343 HB2 CYS 43 2HB CYS 43 16.454 -1.983 0.083
344 HB3 CYS 43 3HB CYS 43 17.652 -1.353 1.208
345 H THR 44 H THR 44 14.161 -0.189 -0.703
346 HA THR 44 HA THR 44 11.890 -1.199 0.882
347 HB THR 44 HB THR 44 10.390 0.224 -0.468
348 HG1 THR 44 HG1 THR 44 11.234 0.996 -2.246
349 HG21 THR 44 3HG2 THR 44 12.245 1.102 1.532
350 HG22 THR 44 1HG2 THR 44 10.582 1.619 1.258
351 HG23 THR 44 2HG2 THR 44 11.906 2.429 0.422
352 H VAL 45 H VAL 45 10.616 -2.733 -0.043
353 HA VAL 45 HA VAL 45 11.573 -3.866 -2.565
354 HB VAL 45 HB VAL 45 9.678 -5.011 -0.508
355 HG11 VAL 45 1HG1 VAL 45 9.027 -6.080 -2.444
356 HG12 VAL 45 2HG1 VAL 45 10.640 -6.007 -3.154
357 HG13 VAL 45 3HG1 VAL 45 10.297 -7.153 -1.858
358 HG21 VAL 45 3HG2 VAL 45 11.715 -6.644 -0.339
359 HG22 VAL 45 1HG2 VAL 45 12.611 -5.271 -0.990
360 HG23 VAL 45 2HG2 VAL 45 11.731 -5.109 0.530
361 H ASP 46 H ASP 46 10.413 -3.867 -4.397
362 HA ASP 46 HA ASP 46 7.660 -2.819 -4.273
363 HB2 ASP 46 2HB ASP 46 9.944 -1.928 -5.792
364 HB3 ASP 46 3HB ASP 46 8.650 -2.424 -6.879
365 H THR 47 H THR 47 6.735 -4.883 -4.153
366 HA THR 47 HA THR 47 7.341 -7.017 -5.890
367 HB THR 47 HB THR 47 5.240 -8.018 -5.167
368 HG1 THR 47 HG1 THR 47 3.814 -6.327 -5.132
369 HG21 THR 47 3HG2 THR 47 5.638 -8.070 -2.781
370 HG22 THR 47 1HG2 THR 47 6.551 -6.564 -2.867
371 HG23 THR 47 2HG2 THR 47 7.184 -8.024 -3.627
372 H TYR 48 H TYR 48 5.690 -4.098 -6.431
373 HA TYR 48 HA TYR 48 3.715 -4.725 -8.251
374 HB2 TYR 48 2HB TYR 48 4.336 -2.436 -7.329
375 HB3 TYR 48 3HB TYR 48 5.574 -2.370 -8.579
376 HD1 TYR 48 HD1 TYR 48 1.906 -2.954 -8.185
377 HD2 TYR 48 HD2 TYR 48 5.040 -1.434 -10.629
378 HE1 TYR 48 HE1 TYR 48 0.240 -2.096 -9.778
379 HE2 TYR 48 HE2 TYR 48 3.383 -0.571 -12.228
380 HH TYR 48 HH TYR 48 0.700 0.151 -11.889
381 H ASN 49 H ASN 49 7.194 -4.504 -8.753
382 HA ASN 49 HA ASN 49 6.914 -5.998 -11.230
383 HB2 ASN 49 2HB ASN 49 8.065 -4.464 -12.619
384 HB3 ASN 49 3HB ASN 49 6.856 -3.505 -11.771
385 HD21 ASN 49 2HD2 ASN 49 9.278 -1.895 -9.669
386 HD22 ASN 49 1HD2 ASN 49 7.719 -2.636 -9.596
387 H ASN 50 H ASN 50 8.065 -6.265 -8.458
388 HA ASN 50 HA ASN 50 9.913 -7.107 -7.424
389 HB2 ASN 50 2HB ASN 50 9.389 -8.893 -9.117
390 HB3 ASN 50 3HB ASN 50 10.599 -8.168 -10.171
391 HD21 ASN 50 2HD2 ASN 50 13.059 -10.138 -8.793
392 HD22 ASN 50 1HD2 ASN 50 12.300 -9.445 -10.182
393 H ALA 51 H ALA 51 10.924 -5.137 -6.951
394 HA ALA 51 HA ALA 51 13.536 -4.837 -8.021
395 HB1 ALA 51 1HB ALA 51 11.582 -2.649 -8.720
396 HB2 ALA 51 2HB ALA 51 13.321 -2.628 -9.014
397 HB3 ALA 51 3HB ALA 51 12.298 -3.790 -9.858
398 H VAL 52 H VAL 52 14.425 -4.687 -6.044
399 HA VAL 52 HA VAL 52 13.230 -3.121 -3.942
400 HB VAL 52 HB VAL 52 14.564 -5.277 -3.627
401 HG11 VAL 52 1HG1 VAL 52 16.890 -3.370 -3.850
402 HG12 VAL 52 2HG1 VAL 52 16.964 -5.080 -3.420
403 HG13 VAL 52 3HG1 VAL 52 16.470 -4.598 -5.043
404 HG21 VAL 52 3HG2 VAL 52 15.442 -2.937 -1.943
405 HG22 VAL 52 1HG2 VAL 52 13.853 -3.692 -1.823
406 HG23 VAL 52 2HG2 VAL 52 15.302 -4.625 -1.451
407 H ASP 53 H ASP 53 14.419 -1.438 -2.780
408 HA ASP 53 HA ASP 53 16.003 0.221 -4.629
409 HB2 ASP 53 2HB ASP 53 13.959 0.903 -2.550
410 HB3 ASP 53 3HB ASP 53 15.221 2.072 -2.933
411 H CYS 54 H CYS 54 17.523 -1.577 -3.461
412 HA CYS 54 HA CYS 54 18.468 -1.043 -0.873
413 HB2 CYS 54 2HB CYS 54 19.610 -2.445 -3.266
414 HB3 CYS 54 3HB CYS 54 20.619 -2.169 -1.849
415 H ASP 55 H ASP 55 20.043 0.267 -0.072
416 HA ASP 55 HA ASP 55 20.568 2.713 -1.237
417 HB2 ASP 55 2HB ASP 55 21.590 1.205 1.055
418 HB3 ASP 55 3HB ASP 55 22.769 2.326 0.379
Start of MODEL 2
1 H1 ALA 1 H ALA 1 1.962 -1.060 -0.790
2 HA ALA 1 HA ALA 1 2.487 -2.512 -3.302
3 HB1 ALA 1 1HB ALA 1 1.615 -0.778 -4.380
4 HB2 ALA 1 2HB ALA 1 1.460 0.146 -2.885
5 HB3 ALA 1 3HB ALA 1 2.968 0.192 -3.797
6 H LYS 2 H LYS 2 3.848 0.315 -1.605
7 HA LYS 2 HA LYS 2 6.530 -0.743 -2.138
8 HB2 LYS 2 2HB LYS 2 5.367 1.899 -2.073
9 HB3 LYS 2 3HB LYS 2 6.740 1.808 -0.977
10 HG2 LYS 2 2HG LYS 2 7.076 0.689 -3.703
11 HG3 LYS 2 3HG LYS 2 7.011 2.445 -3.528
12 HD2 LYS 2 2HD LYS 2 8.824 0.731 -1.849
13 HD3 LYS 2 3HD LYS 2 9.312 1.351 -3.428
14 HE2 LYS 2 2HE LYS 2 8.152 3.394 -1.704
15 HE3 LYS 2 3HE LYS 2 9.594 2.650 -1.016
16 HZ1 LYS 2 3HZ LYS 2 10.582 3.067 -3.338
17 HZ2 LYS 2 1HZ LYS 2 10.441 4.372 -2.271
18 HZ3 LYS 2 2HZ LYS 2 9.318 4.176 -3.520
19 H TYR 3 H TYR 3 7.610 -1.723 -0.569
20 HA TYR 3 HA TYR 3 6.765 -1.288 2.211
21 HB2 TYR 3 2HB TYR 3 8.403 -3.557 1.064
22 HB3 TYR 3 3HB TYR 3 7.793 -3.439 2.710
23 HD1 TYR 3 HD1 TYR 3 5.173 -3.160 2.897
24 HD2 TYR 3 HD2 TYR 3 7.194 -4.782 -0.478
25 HE1 TYR 3 HE1 TYR 3 3.105 -4.305 2.217
26 HE2 TYR 3 HE2 TYR 3 5.131 -5.931 -1.168
27 HH TYR 3 HH TYR 3 2.189 -5.768 0.804
28 H THR 4 H THR 4 8.390 -1.156 3.869
29 HA THR 4 HA THR 4 10.932 -0.029 2.887
30 HB THR 4 HB THR 4 9.919 0.689 5.597
31 HG1 THR 4 HG1 THR 4 8.591 2.288 4.727
32 HG21 THR 4 3HG2 THR 4 12.080 1.424 4.062
33 HG22 THR 4 1HG2 THR 4 11.460 2.313 5.451
34 HG23 THR 4 2HG2 THR 4 10.958 2.762 3.821
35 H GLY 5 H GLY 5 12.803 -0.824 3.681
36 HA2 GLY 5 2HA GLY 5 12.918 -2.264 6.172
37 HA3 GLY 5 3HA GLY 5 13.057 -3.308 4.765
38 H LYS 6 H LYS 6 15.174 -3.747 5.839
39 HA LYS 6 HA LYS 6 17.196 -1.983 4.677
40 HB2 LYS 6 2HB LYS 6 17.557 -3.025 7.476
41 HB3 LYS 6 3HB LYS 6 18.463 -1.763 6.651
42 HG2 LYS 6 2HG LYS 6 17.183 -0.461 7.990
43 HG3 LYS 6 3HG LYS 6 16.081 -0.598 6.618
44 HD2 LYS 6 2HD LYS 6 14.655 -2.000 7.728
45 HD3 LYS 6 3HD LYS 6 15.934 -2.677 8.739
46 HE2 LYS 6 2HE LYS 6 16.029 -0.506 9.954
47 HE3 LYS 6 3HE LYS 6 14.636 0.032 9.016
48 HZ1 LYS 6 3HZ LYS 6 14.771 -1.869 11.214
49 HZ2 LYS 6 1HZ LYS 6 13.709 -2.262 9.957
50 HZ3 LYS 6 2HZ LYS 6 13.536 -0.796 10.783
51 H CYS 7 H CYS 7 19.193 -3.001 4.240
52 HA CYS 7 HA CYS 7 19.018 -5.938 4.195
53 HB2 CYS 7 2HB CYS 7 21.065 -4.632 2.525
54 HB3 CYS 7 3HB CYS 7 19.951 -5.936 2.130
55 H THR 8 H THR 8 21.613 -6.606 3.712
56 HA THR 8 HA THR 8 23.180 -5.468 5.914
57 HB THR 8 HB THR 8 23.594 -8.326 5.766
58 HG1 THR 8 HG1 THR 8 21.568 -8.914 5.611
59 HG21 THR 8 3HG2 THR 8 23.131 -6.219 7.789
60 HG22 THR 8 1HG2 THR 8 24.349 -7.492 7.737
61 HG23 THR 8 2HG2 THR 8 22.707 -7.864 8.262
62 H LYS 9 H LYS 9 25.195 -5.031 5.309
63 HA LYS 9 HA LYS 9 26.151 -5.491 2.719
64 HB2 LYS 9 2HB LYS 9 28.369 -4.783 3.665
65 HB3 LYS 9 3HB LYS 9 27.045 -3.668 3.977
66 HG2 LYS 9 2HG LYS 9 27.212 -3.910 6.189
67 HG3 LYS 9 3HG LYS 9 27.408 -5.660 6.078
68 HD2 LYS 9 2HD LYS 9 29.783 -5.088 5.207
69 HD3 LYS 9 3HD LYS 9 29.487 -3.508 5.937
70 HE2 LYS 9 2HE LYS 9 29.342 -4.396 8.087
71 HE3 LYS 9 3HE LYS 9 29.044 -6.029 7.495
72 HZ1 LYS 9 3HZ LYS 9 31.612 -4.549 7.298
73 HZ2 LYS 9 1HZ LYS 9 31.331 -6.103 6.691
74 HZ3 LYS 9 2HZ LYS 9 31.278 -5.825 8.358
75 H SER 10 H SER 10 26.067 -7.541 5.442
76 HA SER 10 HA SER 10 28.304 -9.122 5.224
77 HB2 SER 10 2HB SER 10 25.464 -9.760 5.981
78 HB3 SER 10 3HB SER 10 26.694 -11.024 5.952
79 HG SER 10 HG SER 10 26.266 -9.669 7.979
80 H LYS 11 H LYS 11 25.203 -10.244 3.900
81 HA LYS 11 HA LYS 11 26.655 -11.208 1.524
82 HB2 LYS 11 2HB LYS 11 24.738 -12.633 3.319
83 HB3 LYS 11 3HB LYS 11 24.750 -13.036 1.607
84 HG2 LYS 11 2HG LYS 11 27.426 -13.052 2.328
85 HG3 LYS 11 3HG LYS 11 26.595 -13.792 3.698
86 HD2 LYS 11 2HD LYS 11 25.361 -14.955 1.535
87 HD3 LYS 11 3HD LYS 11 27.035 -14.809 0.996
88 HE2 LYS 11 2HE LYS 11 26.799 -16.929 2.066
89 HE3 LYS 11 3HE LYS 11 27.733 -15.889 3.140
90 HZ1 LYS 11 3HZ LYS 11 25.368 -17.253 3.703
91 HZ2 LYS 11 1HZ LYS 11 25.007 -15.601 3.743
92 HZ3 LYS 11 2HZ LYS 11 26.240 -16.220 4.720
93 H ASN 12 H ASN 12 24.718 -8.892 2.355
94 HA ASN 12 HA ASN 12 23.166 -7.606 1.301
95 HB2 ASN 12 2HB ASN 12 24.154 -7.470 -0.742
96 HB3 ASN 12 3HB ASN 12 24.350 -9.214 -0.879
97 HD21 ASN 12 2HD2 ASN 12 20.929 -7.412 -2.199
98 HD22 ASN 12 1HD2 ASN 12 21.945 -6.637 -1.035
99 H GLU 13 H GLU 13 21.189 -7.845 2.115
100 HA GLU 13 HA GLU 13 19.272 -9.523 0.864
101 HB2 GLU 13 2HB GLU 13 20.753 -10.884 2.718
102 HB3 GLU 13 3HB GLU 13 19.401 -10.322 3.690
103 HG2 GLU 13 2HG GLU 13 17.897 -11.292 1.892
104 HG3 GLU 13 3HG GLU 13 19.341 -12.089 1.269
105 H CYS 14 H CYS 14 18.015 -7.710 0.707
106 HA CYS 14 HA CYS 14 17.439 -6.079 3.016
107 HB2 CYS 14 2HB CYS 14 16.980 -5.938 0.126
108 HB3 CYS 14 3HB CYS 14 15.626 -5.337 1.078
109 H LYS 15 H LYS 15 16.081 -6.763 4.527
110 HA LYS 15 HA LYS 15 14.004 -8.686 3.915
111 HB2 LYS 15 2HB LYS 15 15.254 -8.973 5.971
112 HB3 LYS 15 3HB LYS 15 14.822 -7.353 6.501
113 HG2 LYS 15 2HG LYS 15 12.572 -9.155 5.891
114 HG3 LYS 15 3HG LYS 15 13.549 -9.572 7.301
115 HD2 LYS 15 2HD LYS 15 12.359 -6.843 6.817
116 HD3 LYS 15 3HD LYS 15 11.590 -8.097 7.794
117 HE2 LYS 15 2HE LYS 15 12.833 -7.543 9.550
118 HE3 LYS 15 3HE LYS 15 14.312 -7.778 8.619
119 HZ1 LYS 15 3HZ LYS 15 14.211 -5.531 7.860
120 HZ2 LYS 15 1HZ LYS 15 14.059 -5.516 9.545
121 HZ3 LYS 15 2HZ LYS 15 12.695 -5.290 8.571
122 H TYR 16 H TYR 16 11.776 -8.363 4.297
123 HA TYR 16 HA TYR 16 10.727 -5.792 4.982
124 HB2 TYR 16 2HB TYR 16 9.813 -5.129 2.897
125 HB3 TYR 16 3HB TYR 16 11.496 -5.527 2.571
126 HD1 TYR 16 HD1 TYR 16 8.285 -5.853 1.339
127 HD2 TYR 16 HD2 TYR 16 11.808 -8.155 1.964
128 HE1 TYR 16 HE1 TYR 16 7.567 -7.416 -0.419
129 HE2 TYR 16 HE2 TYR 16 11.101 -9.724 0.207
130 HH TYR 16 HH TYR 16 8.823 -9.075 -2.031
131 H LYS 17 H LYS 17 8.227 -5.893 3.975
132 HA LYS 17 HA LYS 17 7.197 -8.536 4.770
133 HB2 LYS 17 2HB LYS 17 5.525 -7.588 6.110
134 HB3 LYS 17 3HB LYS 17 6.962 -6.651 6.502
135 HG2 LYS 17 2HG LYS 17 4.869 -5.779 4.524
136 HG3 LYS 17 3HG LYS 17 4.896 -5.299 6.222
137 HD2 LYS 17 2HD LYS 17 7.380 -4.612 5.600
138 HD3 LYS 17 3HD LYS 17 6.680 -4.495 3.983
139 HE2 LYS 17 2HE LYS 17 6.402 -2.352 4.835
140 HE3 LYS 17 3HE LYS 17 4.835 -3.104 5.128
141 HZ1 LYS 17 3HZ LYS 17 6.893 -2.295 7.032
142 HZ2 LYS 17 1HZ LYS 17 6.022 -3.699 7.396
143 HZ3 LYS 17 2HZ LYS 17 5.208 -2.234 7.169
144 H ASN 18 H ASN 18 5.438 -9.312 3.652
145 HA ASN 18 HA ASN 18 4.713 -7.794 1.241
146 HB2 ASN 18 2HB ASN 18 3.905 -10.090 0.441
147 HB3 ASN 18 3HB ASN 18 5.645 -9.860 0.582
148 HD21 ASN 18 2HD2 ASN 18 6.050 -12.104 3.260
149 HD22 ASN 18 1HD2 ASN 18 6.701 -10.710 2.473
150 H ASP 19 H ASP 19 3.264 -10.053 3.589
151 HA ASP 19 HA ASP 19 0.592 -9.267 2.890
152 HB2 ASP 19 2HB ASP 19 1.849 -11.200 4.750
153 HB3 ASP 19 3HB ASP 19 0.257 -10.602 5.211
154 H ALA 20 H ALA 20 2.724 -8.744 5.681
155 HA ALA 20 HA ALA 20 1.839 -6.141 6.185
156 HB1 ALA 20 1HB ALA 20 0.433 -8.274 7.766
157 HB2 ALA 20 2HB ALA 20 0.598 -6.618 8.350
158 HB3 ALA 20 3HB ALA 20 -0.271 -6.941 6.850
159 H GLY 21 H GLY 21 2.967 -9.135 7.711
160 HA2 GLY 21 2HA GLY 21 5.199 -7.616 8.859
161 HA3 GLY 21 3HA GLY 21 4.206 -8.582 9.941
162 H LYS 22 H LYS 22 4.454 -9.959 6.870
163 HA LYS 22 HA LYS 22 5.868 -12.219 7.839
164 HB2 LYS 22 2HB LYS 22 4.697 -11.357 5.261
165 HB3 LYS 22 3HB LYS 22 5.998 -12.537 5.157
166 HG2 LYS 22 2HG LYS 22 4.496 -13.648 7.100
167 HG3 LYS 22 3HG LYS 22 3.248 -12.830 6.156
168 HD2 LYS 22 2HD LYS 22 4.381 -13.922 4.116
169 HD3 LYS 22 3HD LYS 22 5.163 -14.976 5.297
170 HE2 LYS 22 2HE LYS 22 3.262 -16.105 5.735
171 HE3 LYS 22 3HE LYS 22 2.259 -14.659 5.631
172 HZ1 LYS 22 3HZ LYS 22 2.000 -14.890 3.378
173 HZ2 LYS 22 1HZ LYS 22 2.053 -16.514 3.851
174 HZ3 LYS 22 2HZ LYS 22 3.422 -15.785 3.178
175 H ASP 23 H ASP 23 7.937 -11.966 8.449
176 HA ASP 23 HA ASP 23 9.783 -10.181 7.317
177 HB2 ASP 23 2HB ASP 23 11.500 -11.548 8.513
178 HB3 ASP 23 3HB ASP 23 10.150 -11.057 9.533
179 H THR 24 H THR 24 9.912 -10.334 5.106
180 HA THR 24 HA THR 24 10.892 -12.888 4.012
181 HB THR 24 HB THR 24 9.469 -10.630 2.589
182 HG1 THR 24 HG1 THR 24 8.628 -13.317 3.016
183 HG21 THR 24 3HG2 THR 24 9.455 -12.222 0.662
184 HG22 THR 24 1HG2 THR 24 10.583 -13.238 1.557
185 HG23 THR 24 2HG2 THR 24 11.056 -11.609 1.075
186 H PHE 25 H PHE 25 12.873 -12.972 3.156
187 HA PHE 25 HA PHE 25 14.431 -10.500 3.056
188 HB2 PHE 25 2HB PHE 25 15.500 -13.294 2.683
189 HB3 PHE 25 3HB PHE 25 16.377 -11.848 3.173
190 HD1 PHE 25 HD1 PHE 25 14.694 -10.766 5.290
191 HD2 PHE 25 HD2 PHE 25 15.728 -14.801 4.415
192 HE1 PHE 25 HE1 PHE 25 14.355 -11.362 7.653
193 HE2 PHE 25 HE2 PHE 25 15.390 -15.403 6.777
194 HZ PHE 25 HZ PHE 25 14.702 -13.683 8.399
195 H ILE 26 H ILE 26 15.008 -9.560 1.207
196 HA ILE 26 HA ILE 26 15.000 -11.136 -1.267
197 HB ILE 26 HB ILE 26 12.872 -10.082 -1.362
198 HG12 ILE 26 2HG1 ILE 26 13.094 -8.630 -3.309
199 HG13 ILE 26 3HG1 ILE 26 14.795 -8.360 -2.943
200 HG21 ILE 26 1HG2 ILE 26 14.236 -7.476 -0.698
201 HG22 ILE 26 2HG2 ILE 26 12.517 -7.707 -1.009
202 HG23 ILE 26 3HG2 ILE 26 13.259 -8.433 0.416
203 HD11 ILE 26 3HD1 ILE 26 15.431 -10.364 -3.773
204 HD12 ILE 26 1HD1 ILE 26 13.927 -11.161 -3.311
205 HD13 ILE 26 2HD1 ILE 26 13.975 -10.129 -4.740
206 H LYS 27 H LYS 27 16.912 -10.939 -2.204
207 HA LYS 27 HA LYS 27 18.873 -9.082 -1.433
208 HB2 LYS 27 2HB LYS 27 18.809 -10.526 -4.080
209 HB3 LYS 27 3HB LYS 27 20.220 -9.985 -3.180
210 HG2 LYS 27 2HG LYS 27 19.565 -11.614 -1.381
211 HG3 LYS 27 3HG LYS 27 18.363 -12.250 -2.506
212 HD2 LYS 27 2HD LYS 27 19.912 -13.471 -3.532
213 HD3 LYS 27 3HD LYS 27 20.897 -12.036 -3.827
214 HE2 LYS 27 2HE LYS 27 22.151 -12.344 -1.914
215 HE3 LYS 27 3HE LYS 27 20.893 -13.286 -1.115
216 HZ1 LYS 27 3HZ LYS 27 21.477 -14.852 -3.197
217 HZ2 LYS 27 1HZ LYS 27 22.204 -14.998 -1.677
218 HZ3 LYS 27 2HZ LYS 27 22.990 -14.153 -2.913
219 H CYS 28 H CYS 28 20.002 -8.118 -3.765
220 HA CYS 28 HA CYS 28 18.032 -6.081 -4.565
221 HB2 CYS 28 2HB CYS 28 20.363 -5.611 -3.323
222 HB3 CYS 28 3HB CYS 28 20.935 -5.609 -4.988
223 HA PRO 29 HA PRO 29 18.836 -8.535 -8.392
224 HB2 PRO 29 2HB PRO 29 16.276 -8.386 -9.283
225 HB3 PRO 29 3HB PRO 29 16.828 -9.624 -8.149
226 HG2 PRO 29 2HG PRO 29 15.361 -7.073 -7.602
227 HG3 PRO 29 3HG PRO 29 15.096 -8.685 -6.914
228 HD2 PRO 29 2HD PRO 29 16.439 -6.741 -5.593
229 HD3 PRO 29 3HD PRO 29 16.824 -8.463 -5.405
230 H LYS 30 H LYS 30 17.575 -5.405 -7.674
231 HA LYS 30 HA LYS 30 17.133 -4.386 -10.240
232 HB2 LYS 30 2HB LYS 30 17.914 -3.123 -7.629
233 HB3 LYS 30 3HB LYS 30 17.791 -2.153 -9.090
234 HG2 LYS 30 2HG LYS 30 15.544 -3.889 -8.113
235 HG3 LYS 30 3HG LYS 30 15.757 -2.217 -7.590
236 HD2 LYS 30 2HD LYS 30 15.972 -2.325 -10.432
237 HD3 LYS 30 3HD LYS 30 14.506 -3.177 -9.942
238 HE2 LYS 30 2HE LYS 30 14.227 -1.053 -8.391
239 HE3 LYS 30 3HE LYS 30 15.245 -0.312 -9.625
240 HZ1 LYS 30 3HZ LYS 30 13.549 -1.355 -11.241
241 HZ2 LYS 30 1HZ LYS 30 13.130 0.061 -10.416
242 HZ3 LYS 30 2HZ LYS 30 12.535 -1.431 -9.889
243 H PHE 31 H PHE 31 20.003 -3.753 -8.215
244 HA PHE 31 HA PHE 31 21.553 -3.361 -10.677
245 HB2 PHE 31 2HB PHE 31 22.704 -2.693 -8.016
246 HB3 PHE 31 3HB PHE 31 22.871 -1.856 -9.555
247 HD1 PHE 31 HD1 PHE 31 20.744 -2.324 -6.602
248 HD2 PHE 31 HD2 PHE 31 21.331 -0.150 -10.215
249 HE1 PHE 31 HE1 PHE 31 19.062 -0.678 -5.882
250 HE2 PHE 31 HE2 PHE 31 19.651 1.499 -9.500
251 HZ PHE 31 HZ PHE 31 18.514 1.236 -7.330
252 H ASP 32 H ASP 32 23.871 -4.067 -10.563
253 HA ASP 32 HA ASP 32 24.051 -6.690 -9.230
254 HB2 ASP 32 2HB ASP 32 25.557 -5.901 -11.722
255 HB3 ASP 32 3HB ASP 32 25.322 -7.516 -11.060
256 H ASN 33 H ASN 33 25.553 -3.622 -9.773
257 HA ASN 33 HA ASN 33 27.790 -4.446 -8.043
258 HB2 ASN 33 2HB ASN 33 27.913 -3.422 -10.693
259 HB3 ASN 33 3HB ASN 33 28.534 -2.176 -9.615
260 HD21 ASN 33 2HD2 ASN 33 31.095 -4.462 -8.337
261 HD22 ASN 33 1HD2 ASN 33 29.797 -3.523 -7.690
262 H LYS 34 H LYS 34 25.068 -2.995 -7.757
263 HA LYS 34 HA LYS 34 26.127 -0.823 -6.086
264 HB2 LYS 34 2HB LYS 34 23.567 -0.550 -7.651
265 HB3 LYS 34 3HB LYS 34 24.455 0.705 -6.796
266 HG2 LYS 34 2HG LYS 34 25.449 -0.737 -9.246
267 HG3 LYS 34 3HG LYS 34 24.676 0.850 -9.246
268 HD2 LYS 34 2HD LYS 34 26.880 0.658 -7.349
269 HD3 LYS 34 3HD LYS 34 27.379 0.362 -9.016
270 HE2 LYS 34 2HE LYS 34 26.709 2.473 -9.721
271 HE3 LYS 34 3HE LYS 34 25.633 2.699 -8.344
272 HZ1 LYS 34 3HZ LYS 34 27.274 3.848 -7.422
273 HZ2 LYS 34 1HZ LYS 34 28.385 3.378 -8.610
274 HZ3 LYS 34 2HZ LYS 34 28.131 2.399 -7.254
275 H LYS 35 H LYS 35 24.675 -3.669 -6.033
276 HA LYS 35 HA LYS 35 22.296 -3.478 -4.656
277 HB2 LYS 35 2HB LYS 35 22.999 -5.671 -3.577
278 HB3 LYS 35 3HB LYS 35 22.999 -5.629 -5.335
279 HG2 LYS 35 2HG LYS 35 24.965 -6.757 -4.694
280 HG3 LYS 35 3HG LYS 35 25.467 -5.146 -5.212
281 HD2 LYS 35 2HD LYS 35 25.875 -4.439 -3.025
282 HD3 LYS 35 3HD LYS 35 24.896 -5.732 -2.327
283 HE2 LYS 35 2HE LYS 35 26.982 -6.561 -1.910
284 HE3 LYS 35 3HE LYS 35 26.703 -7.255 -3.506
285 HZ1 LYS 35 3HZ LYS 35 28.888 -5.914 -2.903
286 HZ2 LYS 35 1HZ LYS 35 27.933 -4.614 -3.413
287 HZ3 LYS 35 2HZ LYS 35 28.227 -5.908 -4.461
288 H CYS 36 H CYS 36 21.984 -4.084 -2.286
289 HA CYS 36 HA CYS 36 22.809 -2.030 -0.645
290 HB2 CYS 36 2HB CYS 36 21.743 -4.777 -0.103
291 HB3 CYS 36 3HB CYS 36 22.278 -3.776 1.243
292 H THR 37 H THR 37 24.735 -1.492 0.111
293 HA THR 37 HA THR 37 26.661 -3.638 0.725
294 HB THR 37 HB THR 37 28.452 -1.911 0.205
295 HG1 THR 37 HG1 THR 37 26.237 -0.645 -1.071
296 HG21 THR 37 3HG2 THR 37 27.155 -2.279 -2.379
297 HG22 THR 37 1HG2 THR 37 27.174 -3.749 -1.405
298 HG23 THR 37 2HG2 THR 37 28.685 -2.921 -1.782
299 H LYS 38 H LYS 38 24.774 -2.488 2.548
300 HA LYS 38 HA LYS 38 26.641 -1.580 4.578
301 HB2 LYS 38 2HB LYS 38 24.952 0.251 3.195
302 HB3 LYS 38 3HB LYS 38 24.345 0.092 4.839
303 HG2 LYS 38 2HG LYS 38 27.261 0.448 4.543
304 HG3 LYS 38 3HG LYS 38 26.245 1.832 4.134
305 HD2 LYS 38 2HD LYS 38 25.827 0.331 6.693
306 HD3 LYS 38 3HD LYS 38 27.084 1.565 6.568
307 HE2 LYS 38 2HE LYS 38 24.839 2.753 5.451
308 HE3 LYS 38 3HE LYS 38 24.210 1.856 6.833
309 HZ1 LYS 38 3HZ LYS 38 26.623 3.330 7.390
310 HZ2 LYS 38 1HZ LYS 38 25.178 3.247 8.266
311 HZ3 LYS 38 2HZ LYS 38 25.313 4.310 6.958
312 H ASP 39 H ASP 39 25.768 -1.703 6.737
313 HA ASP 39 HA ASP 39 23.799 -3.830 6.966
314 HB2 ASP 39 2HB ASP 39 25.686 -2.523 8.919
315 HB3 ASP 39 3HB ASP 39 24.436 -3.648 9.443
316 H ASN 40 H ASN 40 21.730 -3.506 7.436
317 HA ASN 40 HA ASN 40 19.779 -2.500 8.028
318 HB2 ASN 40 2HB ASN 40 21.575 -1.011 9.957
319 HB3 ASN 40 3HB ASN 40 19.815 -1.047 10.032
320 HD21 ASN 40 2HD2 ASN 40 19.843 -3.834 12.042
321 HD22 ASN 40 1HD2 ASN 40 19.157 -2.311 11.599
322 H ASN 41 H ASN 41 21.039 -1.470 5.769
323 HA ASN 41 HA ASN 41 21.108 1.394 5.860
324 HB2 ASN 41 2HB ASN 41 21.367 1.241 3.412
325 HB3 ASN 41 3HB ASN 41 22.486 0.172 4.254
326 HD21 ASN 41 2HD2 ASN 41 21.309 -2.725 2.785
327 HD22 ASN 41 1HD2 ASN 41 22.432 -1.956 3.850
328 H LYS 42 H LYS 42 19.781 2.281 3.687
329 HA LYS 42 HA LYS 42 16.973 1.862 4.447
330 HB2 LYS 42 2HB LYS 42 18.057 4.150 2.811
331 HB3 LYS 42 3HB LYS 42 16.514 4.054 3.649
332 HG2 LYS 42 2HG LYS 42 18.225 3.733 5.717
333 HG3 LYS 42 3HG LYS 42 19.173 4.779 4.658
334 HD2 LYS 42 2HD LYS 42 18.024 6.471 5.562
335 HD3 LYS 42 3HD LYS 42 16.670 5.919 4.575
336 HE2 LYS 42 2HE LYS 42 16.600 4.272 6.801
337 HE3 LYS 42 3HE LYS 42 17.023 5.853 7.455
338 HZ1 LYS 42 3HZ LYS 42 15.026 6.719 6.901
339 HZ2 LYS 42 1HZ LYS 42 14.531 5.106 7.028
340 HZ3 LYS 42 2HZ LYS 42 14.856 5.774 5.509
341 H CYS 43 H CYS 43 15.931 0.486 3.171
342 HA CYS 43 HA CYS 43 16.078 0.846 0.283
343 HB2 CYS 43 2HB CYS 43 16.536 -1.443 -0.211
344 HB3 CYS 43 3HB CYS 43 17.761 -0.918 0.940
345 H THR 44 H THR 44 14.205 0.325 -0.784
346 HA THR 44 HA THR 44 11.982 -0.647 0.891
347 HB THR 44 HB THR 44 10.565 0.711 -0.842
348 HG1 THR 44 HG1 THR 44 11.658 2.064 -2.046
349 HG21 THR 44 3HG2 THR 44 10.164 1.750 1.091
350 HG22 THR 44 1HG2 THR 44 11.516 2.820 0.725
351 HG23 THR 44 2HG2 THR 44 11.777 1.370 1.694
352 H VAL 45 H VAL 45 11.044 -2.456 0.212
353 HA VAL 45 HA VAL 45 11.738 -3.531 -2.401
354 HB VAL 45 HB VAL 45 10.167 -4.766 -0.135
355 HG11 VAL 45 1HG1 VAL 45 9.434 -5.880 -2.051
356 HG12 VAL 45 2HG1 VAL 45 11.025 -5.815 -2.811
357 HG13 VAL 45 3HG1 VAL 45 10.742 -6.896 -1.446
358 HG21 VAL 45 3HG2 VAL 45 12.124 -5.936 0.460
359 HG22 VAL 45 1HG2 VAL 45 12.949 -5.472 -1.028
360 HG23 VAL 45 2HG2 VAL 45 12.636 -4.265 0.219
361 H ASP 46 H ASP 46 10.285 -4.033 -4.013
362 HA ASP 46 HA ASP 46 7.546 -3.004 -3.663
363 HB2 ASP 46 2HB ASP 46 9.570 -2.197 -5.547
364 HB3 ASP 46 3HB ASP 46 8.187 -2.871 -6.404
365 H THR 47 H THR 47 6.360 -4.810 -3.476
366 HA THR 47 HA THR 47 6.962 -7.248 -4.823
367 HB THR 47 HB THR 47 5.725 -7.125 -2.655
368 HG1 THR 47 HG1 THR 47 4.505 -8.901 -3.163
369 HG21 THR 47 3HG2 THR 47 3.324 -6.654 -2.700
370 HG22 THR 47 1HG2 THR 47 3.433 -6.227 -4.407
371 HG23 THR 47 2HG2 THR 47 4.254 -5.241 -3.197
372 H TYR 48 H TYR 48 5.418 -4.395 -5.794
373 HA TYR 48 HA TYR 48 3.382 -5.207 -7.467
374 HB2 TYR 48 2HB TYR 48 3.949 -2.847 -6.985
375 HB3 TYR 48 3HB TYR 48 5.372 -2.993 -8.010
376 HD1 TYR 48 HD1 TYR 48 1.737 -3.841 -8.320
377 HD2 TYR 48 HD2 TYR 48 5.143 -1.977 -10.059
378 HE1 TYR 48 HE1 TYR 48 0.385 -3.209 -10.275
379 HE2 TYR 48 HE2 TYR 48 3.801 -1.339 -12.018
380 HH TYR 48 HH TYR 48 0.368 -2.227 -12.262
381 H ASN 49 H ASN 49 6.855 -5.262 -8.024
382 HA ASN 49 HA ASN 49 6.509 -7.172 -10.159
383 HB2 ASN 49 2HB ASN 49 7.571 -5.932 -11.898
384 HB3 ASN 49 3HB ASN 49 6.303 -4.897 -11.249
385 HD21 ASN 49 2HD2 ASN 49 8.702 -2.794 -9.520
386 HD22 ASN 49 1HD2 ASN 49 7.255 -3.673 -9.174
387 H ASN 50 H ASN 50 7.807 -6.826 -7.472
388 HA ASN 50 HA ASN 50 9.705 -7.468 -6.396
389 HB2 ASN 50 2HB ASN 50 9.266 -9.435 -8.013
390 HB3 ASN 50 3HB ASN 50 10.607 -8.782 -8.949
391 HD21 ASN 50 2HD2 ASN 50 11.885 -11.361 -6.632
392 HD22 ASN 50 1HD2 ASN 50 10.705 -11.306 -7.893
393 H ALA 51 H ALA 51 10.708 -5.515 -6.077
394 HA ALA 51 HA ALA 51 13.200 -5.109 -7.369
395 HB1 ALA 51 1HB ALA 51 11.080 -4.015 -8.766
396 HB2 ALA 51 2HB ALA 51 11.737 -2.653 -7.858
397 HB3 ALA 51 3HB ALA 51 12.781 -3.581 -8.934
398 H VAL 52 H VAL 52 14.418 -4.511 -5.710
399 HA VAL 52 HA VAL 52 13.236 -2.901 -3.564
400 HB VAL 52 HB VAL 52 14.432 -5.075 -3.052
401 HG11 VAL 52 1HG1 VAL 52 16.286 -4.778 -4.630
402 HG12 VAL 52 2HG1 VAL 52 16.874 -3.417 -3.674
403 HG13 VAL 52 3HG1 VAL 52 16.862 -5.041 -2.985
404 HG21 VAL 52 3HG2 VAL 52 15.472 -2.562 -1.746
405 HG22 VAL 52 1HG2 VAL 52 13.968 -3.392 -1.346
406 HG23 VAL 52 2HG2 VAL 52 15.517 -4.181 -1.050
407 H ASP 53 H ASP 53 14.129 -0.978 -2.871
408 HA ASP 53 HA ASP 53 15.932 0.311 -4.792
409 HB2 ASP 53 2HB ASP 53 13.946 1.381 -2.798
410 HB3 ASP 53 3HB ASP 53 15.171 2.419 -3.522
411 H CYS 54 H CYS 54 17.636 -1.064 -3.680
412 HA CYS 54 HA CYS 54 18.492 -0.732 -1.081
413 HB2 CYS 54 2HB CYS 54 20.131 -1.129 -3.590
414 HB3 CYS 54 3HB CYS 54 20.782 -1.268 -1.961
415 H ASP 55 H ASP 55 20.178 0.550 -0.142
416 HA ASP 55 HA ASP 55 19.904 3.286 -0.506
417 HB2 ASP 55 2HB ASP 55 21.192 1.672 1.309
418 HB3 ASP 55 3HB ASP 55 22.536 2.489 0.516
Start of MODEL 3
1 H1 ALA 1 H ALA 1 1.973 -0.693 -1.099
2 HA ALA 1 HA ALA 1 2.266 1.069 -3.167
3 HB1 ALA 1 1HB ALA 1 1.578 2.487 -0.613
4 HB2 ALA 1 2HB ALA 1 2.538 3.259 -1.876
5 HB3 ALA 1 3HB ALA 1 0.897 2.716 -2.223
6 H LYS 2 H LYS 2 3.967 -0.682 -2.751
7 HA LYS 2 HA LYS 2 6.158 -1.183 -2.401
8 HB2 LYS 2 2HB LYS 2 6.084 1.591 -2.816
9 HB3 LYS 2 3HB LYS 2 7.116 1.359 -1.410
10 HG2 LYS 2 2HG LYS 2 8.021 -0.569 -3.133
11 HG3 LYS 2 3HG LYS 2 7.610 0.761 -4.218
12 HD2 LYS 2 2HD LYS 2 9.157 1.348 -1.737
13 HD3 LYS 2 3HD LYS 2 9.989 0.605 -3.106
14 HE2 LYS 2 2HE LYS 2 8.270 2.875 -3.809
15 HE3 LYS 2 3HE LYS 2 9.624 3.285 -2.757
16 HZ1 LYS 2 3HZ LYS 2 9.631 2.669 -5.530
17 HZ2 LYS 2 1HZ LYS 2 10.670 1.631 -4.689
18 HZ3 LYS 2 2HZ LYS 2 10.872 3.307 -4.573
19 H TYR 3 H TYR 3 7.769 -1.494 -0.709
20 HA TYR 3 HA TYR 3 6.638 -1.117 1.987
21 HB2 TYR 3 2HB TYR 3 8.253 -3.451 0.941
22 HB3 TYR 3 3HB TYR 3 7.756 -3.241 2.616
23 HD1 TYR 3 HD1 TYR 3 5.182 -2.975 3.006
24 HD2 TYR 3 HD2 TYR 3 6.903 -4.670 -0.497
25 HE1 TYR 3 HE1 TYR 3 3.059 -4.119 2.523
26 HE2 TYR 3 HE2 TYR 3 4.785 -5.818 -0.990
27 HH TYR 3 HH TYR 3 1.873 -5.122 0.732
28 H THR 4 H THR 4 8.507 -1.571 3.673
29 HA THR 4 HA THR 4 10.955 -0.202 2.792
30 HB THR 4 HB THR 4 9.877 0.422 5.506
31 HG1 THR 4 HG1 THR 4 9.147 2.024 3.297
32 HG21 THR 4 3HG2 THR 4 11.158 2.389 5.295
33 HG22 THR 4 1HG2 THR 4 11.276 2.223 3.544
34 HG23 THR 4 2HG2 THR 4 12.159 1.116 4.596
35 H GLY 5 H GLY 5 12.828 -0.637 4.058
36 HA2 GLY 5 2HA GLY 5 12.872 -2.302 6.324
37 HA3 GLY 5 3HA GLY 5 13.085 -3.301 4.895
38 H LYS 6 H LYS 6 15.180 -3.806 5.831
39 HA LYS 6 HA LYS 6 17.191 -1.876 4.949
40 HB2 LYS 6 2HB LYS 6 17.538 -3.281 7.585
41 HB3 LYS 6 3HB LYS 6 18.423 -1.899 6.953
42 HG2 LYS 6 2HG LYS 6 17.100 -0.825 8.445
43 HG3 LYS 6 3HG LYS 6 16.020 -0.788 7.049
44 HD2 LYS 6 2HD LYS 6 14.492 -1.830 8.285
45 HD3 LYS 6 3HD LYS 6 15.548 -3.245 8.311
46 HE2 LYS 6 2HE LYS 6 16.601 -2.479 10.337
47 HE3 LYS 6 3HE LYS 6 15.705 -0.962 10.275
48 HZ1 LYS 6 3HZ LYS 6 14.117 -1.931 11.450
49 HZ2 LYS 6 1HZ LYS 6 14.931 -3.414 11.421
50 HZ3 LYS 6 2HZ LYS 6 13.841 -3.023 10.188
51 H CYS 7 H CYS 7 19.212 -2.801 4.417
52 HA CYS 7 HA CYS 7 19.027 -5.644 3.765
53 HB2 CYS 7 2HB CYS 7 20.769 -3.394 2.783
54 HB3 CYS 7 3HB CYS 7 21.167 -5.075 2.440
55 H THR 8 H THR 8 21.505 -6.548 3.657
56 HA THR 8 HA THR 8 22.844 -5.957 6.190
57 HB THR 8 HB THR 8 22.930 -8.774 5.918
58 HG1 THR 8 HG1 THR 8 20.997 -9.266 5.234
59 HG21 THR 8 3HG2 THR 8 22.414 -8.732 8.141
60 HG22 THR 8 1HG2 THR 8 21.161 -7.507 7.941
61 HG23 THR 8 2HG2 THR 8 22.862 -7.039 7.937
62 H LYS 9 H LYS 9 24.825 -5.423 5.540
63 HA LYS 9 HA LYS 9 26.060 -6.092 3.156
64 HB2 LYS 9 2HB LYS 9 28.190 -5.471 4.291
65 HB3 LYS 9 3HB LYS 9 26.904 -4.291 4.511
66 HG2 LYS 9 2HG LYS 9 27.008 -4.481 6.716
67 HG3 LYS 9 3HG LYS 9 26.881 -6.240 6.633
68 HD2 LYS 9 2HD LYS 9 28.957 -6.052 7.567
69 HD3 LYS 9 3HD LYS 9 29.403 -6.023 5.859
70 HE2 LYS 9 2HE LYS 9 28.816 -3.371 6.535
71 HE3 LYS 9 3HE LYS 9 29.758 -4.004 7.883
72 HZ1 LYS 9 3HZ LYS 9 30.546 -3.573 5.105
73 HZ2 LYS 9 1HZ LYS 9 31.211 -4.914 5.894
74 HZ3 LYS 9 2HZ LYS 9 31.437 -3.362 6.528
75 H SER 10 H SER 10 25.616 -8.005 5.973
76 HA SER 10 HA SER 10 27.704 -9.744 6.055
77 HB2 SER 10 2HB SER 10 25.496 -9.752 7.401
78 HB3 SER 10 3HB SER 10 24.885 -10.800 6.121
79 HG SER 10 HG SER 10 26.566 -12.252 6.590
80 H LYS 11 H LYS 11 24.844 -10.153 3.965
81 HA LYS 11 HA LYS 11 26.497 -11.281 1.875
82 HB2 LYS 11 2HB LYS 11 25.298 -13.019 3.711
83 HB3 LYS 11 3HB LYS 11 24.257 -13.071 2.294
84 HG2 LYS 11 2HG LYS 11 25.857 -14.022 0.977
85 HG3 LYS 11 3HG LYS 11 27.190 -13.306 1.887
86 HD2 LYS 11 2HD LYS 11 27.398 -15.149 3.115
87 HD3 LYS 11 3HD LYS 11 25.697 -15.078 3.579
88 HE2 LYS 11 2HE LYS 11 25.044 -16.515 1.920
89 HE3 LYS 11 3HE LYS 11 26.379 -16.069 0.858
90 HZ1 LYS 11 3HZ LYS 11 26.832 -17.566 3.367
91 HZ2 LYS 11 1HZ LYS 11 27.852 -17.426 2.024
92 HZ3 LYS 11 2HZ LYS 11 26.445 -18.358 1.923
93 H ASN 12 H ASN 12 24.549 -9.037 2.459
94 HA ASN 12 HA ASN 12 23.028 -7.820 1.283
95 HB2 ASN 12 2HB ASN 12 24.409 -9.362 -0.663
96 HB3 ASN 12 3HB ASN 12 22.704 -9.368 -1.101
97 HD21 ASN 12 2HD2 ASN 12 22.859 -6.228 -2.486
98 HD22 ASN 12 1HD2 ASN 12 22.145 -7.799 -2.408
99 H GLU 13 H GLU 13 21.007 -7.849 1.993
100 HA GLU 13 HA GLU 13 19.015 -9.536 1.001
101 HB2 GLU 13 2HB GLU 13 20.544 -10.809 2.973
102 HB3 GLU 13 3HB GLU 13 19.064 -10.318 3.786
103 HG2 GLU 13 2HG GLU 13 17.761 -11.446 2.020
104 HG3 GLU 13 3HG GLU 13 19.271 -12.005 1.303
105 H CYS 14 H CYS 14 17.548 -7.956 0.930
106 HA CYS 14 HA CYS 14 17.207 -6.188 3.234
107 HB2 CYS 14 2HB CYS 14 16.727 -5.984 0.348
108 HB3 CYS 14 3HB CYS 14 15.420 -5.328 1.328
109 H LYS 15 H LYS 15 15.822 -6.826 4.740
110 HA LYS 15 HA LYS 15 13.680 -8.670 4.128
111 HB2 LYS 15 2HB LYS 15 14.814 -9.057 6.187
112 HB3 LYS 15 3HB LYS 15 14.635 -7.378 6.680
113 HG2 LYS 15 2HG LYS 15 12.157 -8.922 6.183
114 HG3 LYS 15 3HG LYS 15 13.093 -9.315 7.627
115 HD2 LYS 15 2HD LYS 15 12.669 -6.442 7.136
116 HD3 LYS 15 3HD LYS 15 11.214 -7.369 7.512
117 HE2 LYS 15 2HE LYS 15 12.386 -8.267 9.516
118 HE3 LYS 15 3HE LYS 15 13.731 -7.184 9.163
119 HZ1 LYS 15 3HZ LYS 15 10.959 -6.440 9.902
120 HZ2 LYS 15 1HZ LYS 15 12.080 -5.328 9.295
121 HZ3 LYS 15 2HZ LYS 15 12.381 -6.117 10.760
122 H TYR 16 H TYR 16 11.468 -8.272 4.412
123 HA TYR 16 HA TYR 16 10.456 -5.706 5.140
124 HB2 TYR 16 2HB TYR 16 9.679 -4.910 3.051
125 HB3 TYR 16 3HB TYR 16 11.361 -5.356 2.784
126 HD1 TYR 16 HD1 TYR 16 11.696 -7.857 1.947
127 HD2 TYR 16 HD2 TYR 16 8.115 -5.603 1.503
128 HE1 TYR 16 HE1 TYR 16 11.019 -9.312 0.083
129 HE2 TYR 16 HE2 TYR 16 7.427 -7.053 -0.361
130 HH TYR 16 HH TYR 16 9.370 -9.854 -1.325
131 H LYS 17 H LYS 17 8.013 -5.703 3.952
132 HA LYS 17 HA LYS 17 6.862 -8.275 4.812
133 HB2 LYS 17 2HB LYS 17 4.789 -6.933 5.294
134 HB3 LYS 17 3HB LYS 17 6.164 -6.573 6.330
135 HG2 LYS 17 2HG LYS 17 6.271 -4.840 4.083
136 HG3 LYS 17 3HG LYS 17 4.634 -4.799 4.744
137 HD2 LYS 17 2HD LYS 17 6.052 -4.672 7.024
138 HD3 LYS 17 3HD LYS 17 7.187 -3.887 5.923
139 HE2 LYS 17 2HE LYS 17 4.868 -2.680 5.215
140 HE3 LYS 17 3HE LYS 17 4.576 -2.973 6.929
141 HZ1 LYS 17 3HZ LYS 17 6.152 -1.504 7.540
142 HZ2 LYS 17 1HZ LYS 17 5.846 -0.835 6.017
143 HZ3 LYS 17 2HZ LYS 17 7.172 -1.861 6.239
144 H ASN 18 H ASN 18 5.872 -9.436 3.303
145 HA ASN 18 HA ASN 18 5.347 -8.237 0.702
146 HB2 ASN 18 2HB ASN 18 4.825 -10.660 0.082
147 HB3 ASN 18 3HB ASN 18 6.489 -10.303 0.536
148 HD21 ASN 18 2HD2 ASN 18 6.475 -12.263 3.427
149 HD22 ASN 18 1HD2 ASN 18 7.260 -10.999 2.548
150 H ASP 19 H ASP 19 3.589 -10.228 3.077
151 HA ASP 19 HA ASP 19 1.061 -9.701 1.789
152 HB2 ASP 19 2HB ASP 19 2.027 -11.401 4.010
153 HB3 ASP 19 3HB ASP 19 0.363 -10.839 4.143
154 H ALA 20 H ALA 20 2.687 -8.740 4.783
155 HA ALA 20 HA ALA 20 1.524 -6.195 4.868
156 HB1 ALA 20 1HB ALA 20 0.052 -6.547 6.892
157 HB2 ALA 20 2HB ALA 20 -0.572 -7.168 5.364
158 HB3 ALA 20 3HB ALA 20 0.136 -8.274 6.541
159 H GLY 21 H GLY 21 2.695 -8.881 6.868
160 HA2 GLY 21 2HA GLY 21 4.676 -7.069 8.031
161 HA3 GLY 21 3HA GLY 21 3.589 -7.894 9.139
162 H LYS 22 H LYS 22 4.336 -9.689 6.352
163 HA LYS 22 HA LYS 22 5.712 -11.672 7.886
164 HB2 LYS 22 2HB LYS 22 4.694 -11.405 5.124
165 HB3 LYS 22 3HB LYS 22 6.074 -12.477 5.322
166 HG2 LYS 22 2HG LYS 22 4.056 -12.943 7.343
167 HG3 LYS 22 3HG LYS 22 3.411 -13.114 5.709
168 HD2 LYS 22 2HD LYS 22 4.195 -15.243 6.120
169 HD3 LYS 22 3HD LYS 22 5.580 -14.511 5.306
170 HE2 LYS 22 2HE LYS 22 6.271 -13.873 7.759
171 HE3 LYS 22 3HE LYS 22 5.213 -15.218 8.180
172 HZ1 LYS 22 3HZ LYS 22 6.581 -16.731 7.172
173 HZ2 LYS 22 1HZ LYS 22 7.727 -15.616 7.725
174 HZ3 LYS 22 2HZ LYS 22 7.251 -15.604 6.103
175 H ASP 23 H ASP 23 7.704 -11.143 8.583
176 HA ASP 23 HA ASP 23 9.545 -9.523 7.199
177 HB2 ASP 23 2HB ASP 23 9.995 -11.566 9.384
178 HB3 ASP 23 3HB ASP 23 11.212 -10.422 8.825
179 H THR 24 H THR 24 9.858 -10.207 5.105
180 HA THR 24 HA THR 24 11.142 -12.840 4.774
181 HB THR 24 HB THR 24 9.589 -11.236 2.734
182 HG1 THR 24 HG1 THR 24 8.998 -13.440 4.376
183 HG21 THR 24 3HG2 THR 24 9.936 -13.801 1.765
184 HG22 THR 24 1HG2 THR 24 11.507 -13.409 2.462
185 HG23 THR 24 2HG2 THR 24 10.804 -12.363 1.228
186 H PHE 25 H PHE 25 13.218 -12.835 4.228
187 HA PHE 25 HA PHE 25 14.500 -10.335 3.498
188 HB2 PHE 25 2HB PHE 25 15.544 -13.069 4.222
189 HB3 PHE 25 3HB PHE 25 16.600 -11.790 3.631
190 HD1 PHE 25 HD1 PHE 25 13.889 -12.192 6.169
191 HD2 PHE 25 HD2 PHE 25 17.721 -10.597 5.227
192 HE1 PHE 25 HE1 PHE 25 14.076 -11.299 8.454
193 HE2 PHE 25 HE2 PHE 25 17.914 -9.702 7.510
194 HZ PHE 25 HZ PHE 25 16.091 -10.054 9.128
195 H ILE 26 H ILE 26 15.648 -9.966 1.608
196 HA ILE 26 HA ILE 26 15.847 -11.966 -0.445
197 HB ILE 26 HB ILE 26 13.528 -11.344 -0.792
198 HG12 ILE 26 2HG1 ILE 26 13.675 -10.575 -3.137
199 HG13 ILE 26 3HG1 ILE 26 15.353 -10.114 -2.871
200 HG21 ILE 26 1HG2 ILE 26 14.500 -8.512 -1.145
201 HG22 ILE 26 2HG2 ILE 26 12.838 -9.084 -1.280
202 HG23 ILE 26 3HG2 ILE 26 13.660 -9.121 0.280
203 HD11 ILE 26 3HD1 ILE 26 14.491 -12.506 -3.860
204 HD12 ILE 26 1HD1 ILE 26 16.078 -12.198 -3.155
205 HD13 ILE 26 2HD1 ILE 26 14.789 -12.881 -2.163
206 H LYS 27 H LYS 27 17.537 -11.545 -1.733
207 HA LYS 27 HA LYS 27 19.326 -9.483 -1.205
208 HB2 LYS 27 2HB LYS 27 20.562 -10.228 -3.090
209 HB3 LYS 27 3HB LYS 27 19.790 -11.657 -2.414
210 HG2 LYS 27 2HG LYS 27 17.947 -11.236 -4.148
211 HG3 LYS 27 3HG LYS 27 19.119 -10.169 -4.924
212 HD2 LYS 27 2HD LYS 27 20.569 -12.463 -4.404
213 HD3 LYS 27 3HD LYS 27 18.983 -13.074 -4.880
214 HE2 LYS 27 2HE LYS 27 19.282 -11.248 -6.785
215 HE3 LYS 27 3HE LYS 27 20.987 -11.541 -6.447
216 HZ1 LYS 27 3HZ LYS 27 20.206 -12.988 -8.197
217 HZ2 LYS 27 1HZ LYS 27 18.980 -13.596 -7.203
218 HZ3 LYS 27 2HZ LYS 27 20.601 -13.908 -6.833
219 H CYS 28 H CYS 28 20.142 -8.098 -3.247
220 HA CYS 28 HA CYS 28 17.811 -6.497 -4.066
221 HB2 CYS 28 2HB CYS 28 20.634 -5.469 -4.049
222 HB3 CYS 28 3HB CYS 28 19.128 -4.562 -3.959
223 HA PRO 29 HA PRO 29 19.395 -8.356 -7.977
224 HB2 PRO 29 2HB PRO 29 16.933 -8.664 -9.078
225 HB3 PRO 29 3HB PRO 29 17.656 -9.858 -7.993
226 HG2 PRO 29 2HG PRO 29 15.639 -7.728 -7.393
227 HG3 PRO 29 3HG PRO 29 15.679 -9.415 -6.850
228 HD2 PRO 29 2HD PRO 29 16.476 -7.360 -5.277
229 HD3 PRO 29 3HD PRO 29 17.208 -8.975 -5.183
230 H LYS 30 H LYS 30 17.408 -5.648 -7.161
231 HA LYS 30 HA LYS 30 16.852 -4.487 -9.597
232 HB2 LYS 30 2HB LYS 30 16.779 -3.697 -6.909
233 HB3 LYS 30 3HB LYS 30 17.761 -2.483 -7.718
234 HG2 LYS 30 2HG LYS 30 15.097 -3.323 -8.804
235 HG3 LYS 30 3HG LYS 30 15.247 -2.078 -7.561
236 HD2 LYS 30 2HD LYS 30 17.046 -1.127 -9.262
237 HD3 LYS 30 3HD LYS 30 16.064 -2.027 -10.420
238 HE2 LYS 30 2HE LYS 30 14.696 -0.254 -8.457
239 HE3 LYS 30 3HE LYS 30 15.529 0.485 -9.823
240 HZ1 LYS 30 3HZ LYS 30 14.215 -1.014 -11.283
241 HZ2 LYS 30 1HZ LYS 30 13.279 0.116 -10.441
242 HZ3 LYS 30 2HZ LYS 30 13.323 -1.495 -9.928
243 H PHE 31 H PHE 31 19.696 -3.698 -7.587
244 HA PHE 31 HA PHE 31 21.086 -2.867 -10.042
245 HB2 PHE 31 2HB PHE 31 22.247 -2.197 -7.399
246 HB3 PHE 31 3HB PHE 31 22.142 -1.225 -8.863
247 HD1 PHE 31 HD1 PHE 31 20.360 -2.312 -5.843
248 HD2 PHE 31 HD2 PHE 31 20.289 0.228 -9.258
249 HE1 PHE 31 HE1 PHE 31 18.478 -1.061 -4.869
250 HE2 PHE 31 HE2 PHE 31 18.408 1.483 -8.290
251 HZ PHE 31 HZ PHE 31 17.500 0.839 -6.092
252 H ASP 32 H ASP 32 23.239 -3.513 -10.402
253 HA ASP 32 HA ASP 32 23.938 -6.034 -9.067
254 HB2 ASP 32 2HB ASP 32 23.626 -5.897 -11.606
255 HB3 ASP 32 3HB ASP 32 25.140 -4.997 -11.629
256 H ASN 33 H ASN 33 25.042 -2.799 -9.690
257 HA ASN 33 HA ASN 33 27.520 -3.388 -8.206
258 HB2 ASN 33 2HB ASN 33 27.599 -2.576 -10.700
259 HB3 ASN 33 3HB ASN 33 27.268 -0.996 -9.994
260 HD21 ASN 33 2HD2 ASN 33 30.744 -2.844 -8.863
261 HD22 ASN 33 1HD2 ASN 33 29.287 -3.756 -9.042
262 H LYS 34 H LYS 34 24.573 -1.776 -8.161
263 HA LYS 34 HA LYS 34 25.525 0.075 -6.073
264 HB2 LYS 34 2HB LYS 34 23.197 0.340 -7.980
265 HB3 LYS 34 3HB LYS 34 23.459 1.408 -6.608
266 HG2 LYS 34 2HG LYS 34 24.503 2.668 -8.147
267 HG3 LYS 34 3HG LYS 34 25.860 1.596 -7.794
268 HD2 LYS 34 2HD LYS 34 25.648 1.721 -10.165
269 HD3 LYS 34 3HD LYS 34 25.068 0.129 -9.668
270 HE2 LYS 34 2HE LYS 34 22.803 0.774 -9.938
271 HE3 LYS 34 3HE LYS 34 23.234 2.476 -10.095
272 HZ1 LYS 34 3HZ LYS 34 24.276 0.525 -12.034
273 HZ2 LYS 34 1HZ LYS 34 23.988 2.181 -12.230
274 HZ3 LYS 34 2HZ LYS 34 22.692 1.096 -12.194
275 H LYS 35 H LYS 35 24.539 -2.802 -6.005
276 HA LYS 35 HA LYS 35 22.014 -2.790 -4.696
277 HB2 LYS 35 2HB LYS 35 22.600 -5.121 -4.065
278 HB3 LYS 35 3HB LYS 35 22.786 -4.801 -5.784
279 HG2 LYS 35 2HG LYS 35 25.280 -4.255 -4.925
280 HG3 LYS 35 3HG LYS 35 24.800 -5.486 -3.754
281 HD2 LYS 35 2HD LYS 35 24.172 -6.974 -5.618
282 HD3 LYS 35 3HD LYS 35 24.727 -5.749 -6.761
283 HE2 LYS 35 2HE LYS 35 26.890 -6.262 -6.441
284 HE3 LYS 35 3HE LYS 35 26.687 -6.449 -4.700
285 HZ1 LYS 35 3HZ LYS 35 27.166 -8.579 -5.355
286 HZ2 LYS 35 1HZ LYS 35 26.351 -8.444 -6.831
287 HZ3 LYS 35 2HZ LYS 35 25.476 -8.617 -5.394
288 H CYS 36 H CYS 36 22.158 -4.176 -2.428
289 HA CYS 36 HA CYS 36 22.761 -2.304 -0.472
290 HB2 CYS 36 2HB CYS 36 22.708 -5.302 -0.083
291 HB3 CYS 36 3HB CYS 36 22.420 -4.073 1.144
292 H THR 37 H THR 37 24.468 -1.958 0.904
293 HA THR 37 HA THR 37 26.836 -3.628 0.745
294 HB THR 37 HB THR 37 28.234 -1.456 0.392
295 HG1 THR 37 HG1 THR 37 26.034 -0.287 0.312
296 HG21 THR 37 3HG2 THR 37 26.951 -2.217 -2.159
297 HG22 THR 37 1HG2 THR 37 27.629 -3.536 -1.206
298 HG23 THR 37 2HG2 THR 37 28.656 -2.193 -1.711
299 H LYS 38 H LYS 38 24.764 -2.516 2.691
300 HA LYS 38 HA LYS 38 26.691 -1.874 4.787
301 HB2 LYS 38 2HB LYS 38 25.283 0.158 3.600
302 HB3 LYS 38 3HB LYS 38 24.248 -0.253 4.961
303 HG2 LYS 38 2HG LYS 38 27.119 0.029 5.563
304 HG3 LYS 38 3HG LYS 38 26.269 1.504 5.099
305 HD2 LYS 38 2HD LYS 38 25.152 1.595 7.039
306 HD3 LYS 38 3HD LYS 38 24.786 -0.132 7.008
307 HE2 LYS 38 2HE LYS 38 26.865 -0.685 7.986
308 HE3 LYS 38 3HE LYS 38 27.509 0.933 7.714
309 HZ1 LYS 38 3HZ LYS 38 25.857 -0.052 9.865
310 HZ2 LYS 38 1HZ LYS 38 25.348 1.432 9.232
311 HZ3 LYS 38 2HZ LYS 38 26.921 1.263 9.831
312 H ASP 39 H ASP 39 25.639 -1.931 6.978
313 HA ASP 39 HA ASP 39 23.725 -4.150 7.037
314 HB2 ASP 39 2HB ASP 39 24.406 -4.185 9.516
315 HB3 ASP 39 3HB ASP 39 25.610 -4.692 8.334
316 H ASN 40 H ASN 40 21.660 -3.736 7.413
317 HA ASN 40 HA ASN 40 19.744 -2.773 8.171
318 HB2 ASN 40 2HB ASN 40 21.402 -1.271 10.193
319 HB3 ASN 40 3HB ASN 40 19.721 -1.781 10.326
320 HD21 ASN 40 2HD2 ASN 40 20.434 -4.971 11.501
321 HD22 ASN 40 1HD2 ASN 40 19.245 -3.866 10.910
322 H ASN 41 H ASN 41 20.888 -1.603 5.977
323 HA ASN 41 HA ASN 41 20.979 1.267 6.362
324 HB2 ASN 41 2HB ASN 41 21.246 1.246 3.823
325 HB3 ASN 41 3HB ASN 41 22.524 0.470 4.754
326 HD21 ASN 41 2HD2 ASN 41 22.248 -2.243 2.626
327 HD22 ASN 41 1HD2 ASN 41 23.216 -0.964 3.268
328 H LYS 42 H LYS 42 19.766 2.378 4.274
329 HA LYS 42 HA LYS 42 16.940 1.868 4.818
330 HB2 LYS 42 2HB LYS 42 18.059 4.185 4.955
331 HB3 LYS 42 3HB LYS 42 18.035 4.154 3.196
332 HG2 LYS 42 2HG LYS 42 15.930 4.827 3.179
333 HG3 LYS 42 3HG LYS 42 15.448 3.451 4.175
334 HD2 LYS 42 2HD LYS 42 15.496 4.658 6.105
335 HD3 LYS 42 3HD LYS 42 16.801 5.706 5.545
336 HE2 LYS 42 2HE LYS 42 15.234 6.887 4.092
337 HE3 LYS 42 3HE LYS 42 13.930 5.825 4.622
338 HZ1 LYS 42 3HZ LYS 42 13.647 7.002 6.474
339 HZ2 LYS 42 1HZ LYS 42 14.595 8.202 5.751
340 HZ3 LYS 42 2HZ LYS 42 15.305 7.083 6.801
341 H CYS 43 H CYS 43 15.968 0.474 3.504
342 HA CYS 43 HA CYS 43 16.240 0.835 0.621
343 HB2 CYS 43 2HB CYS 43 16.731 -1.437 0.148
344 HB3 CYS 43 3HB CYS 43 17.863 -0.956 1.407
345 H THR 44 H THR 44 14.421 0.296 -0.540
346 HA THR 44 HA THR 44 12.108 -0.637 1.033
347 HB THR 44 HB THR 44 10.761 0.732 -0.713
348 HG1 THR 44 HG1 THR 44 11.958 2.570 -1.455
349 HG21 THR 44 3HG2 THR 44 11.915 2.811 0.862
350 HG22 THR 44 1HG2 THR 44 11.838 1.343 1.836
351 HG23 THR 44 2HG2 THR 44 10.375 1.983 1.088
352 H VAL 45 H VAL 45 11.106 -2.390 0.284
353 HA VAL 45 HA VAL 45 11.950 -3.507 -2.269
354 HB VAL 45 HB VAL 45 10.203 -4.685 -0.103
355 HG11 VAL 45 1HG1 VAL 45 9.534 -5.983 -1.829
356 HG12 VAL 45 2HG1 VAL 45 10.955 -5.608 -2.805
357 HG13 VAL 45 3HG1 VAL 45 11.062 -6.803 -1.512
358 HG21 VAL 45 3HG2 VAL 45 12.772 -5.943 -0.617
359 HG22 VAL 45 1HG2 VAL 45 12.931 -4.269 -0.088
360 HG23 VAL 45 2HG2 VAL 45 12.051 -5.428 0.907
361 H ASP 46 H ASP 46 10.595 -3.960 -3.975
362 HA ASP 46 HA ASP 46 7.927 -2.714 -3.847
363 HB2 ASP 46 2HB ASP 46 10.078 -2.283 -5.650
364 HB3 ASP 46 3HB ASP 46 8.793 -3.084 -6.549
365 H THR 47 H THR 47 6.266 -4.056 -3.982
366 HA THR 47 HA THR 47 6.703 -6.803 -4.850
367 HB THR 47 HB THR 47 5.486 -6.446 -2.752
368 HG1 THR 47 HG1 THR 47 4.038 -8.004 -3.194
369 HG21 THR 47 3HG2 THR 47 3.033 -5.499 -4.074
370 HG22 THR 47 1HG2 THR 47 4.331 -4.311 -3.966
371 HG23 THR 47 2HG2 THR 47 3.711 -5.074 -2.502
372 H TYR 48 H TYR 48 6.883 -5.033 -6.955
373 HA TYR 48 HA TYR 48 4.373 -5.524 -8.420
374 HB2 TYR 48 2HB TYR 48 5.200 -3.078 -7.918
375 HB3 TYR 48 3HB TYR 48 6.292 -3.386 -9.263
376 HD1 TYR 48 HD1 TYR 48 2.684 -3.445 -8.340
377 HD2 TYR 48 HD2 TYR 48 5.558 -3.085 -11.457
378 HE1 TYR 48 HE1 TYR 48 0.890 -2.866 -9.919
379 HE2 TYR 48 HE2 TYR 48 3.771 -2.504 -13.045
380 HH TYR 48 HH TYR 48 0.395 -2.718 -12.170
381 H ASN 49 H ASN 49 7.864 -5.653 -8.456
382 HA ASN 49 HA ASN 49 7.855 -7.693 -10.456
383 HB2 ASN 49 2HB ASN 49 9.463 -6.310 -11.958
384 HB3 ASN 49 3HB ASN 49 7.728 -6.045 -12.104
385 HD21 ASN 49 2HD2 ASN 49 10.137 -3.171 -10.494
386 HD22 ASN 49 1HD2 ASN 49 10.658 -4.816 -10.586
387 H ASN 50 H ASN 50 8.813 -7.184 -7.731
388 HA ASN 50 HA ASN 50 10.630 -7.559 -6.410
389 HB2 ASN 50 2HB ASN 50 11.419 -9.098 -8.887
390 HB3 ASN 50 3HB ASN 50 12.336 -9.157 -7.385
391 HD21 ASN 50 2HD2 ASN 50 10.342 -11.590 -5.998
392 HD22 ASN 50 1HD2 ASN 50 11.843 -10.737 -6.056
393 H ALA 51 H ALA 51 11.238 -5.345 -6.358
394 HA ALA 51 HA ALA 51 13.882 -4.887 -7.455
395 HB1 ALA 51 1HB ALA 51 13.053 -2.547 -8.235
396 HB2 ALA 51 2HB ALA 51 12.833 -3.949 -9.284
397 HB3 ALA 51 3HB ALA 51 11.480 -3.340 -8.329
398 H VAL 52 H VAL 52 14.774 -4.654 -5.465
399 HA VAL 52 HA VAL 52 13.527 -2.928 -3.486
400 HB VAL 52 HB VAL 52 14.693 -5.145 -2.954
401 HG11 VAL 52 1HG1 VAL 52 16.714 -4.662 -4.306
402 HG12 VAL 52 2HG1 VAL 52 17.152 -3.410 -3.142
403 HG13 VAL 52 3HG1 VAL 52 17.079 -5.099 -2.637
404 HG21 VAL 52 3HG2 VAL 52 14.042 -3.204 -1.373
405 HG22 VAL 52 1HG2 VAL 52 15.152 -4.444 -0.788
406 HG23 VAL 52 2HG2 VAL 52 15.774 -2.881 -1.318
407 H ASP 53 H ASP 53 14.484 -1.074 -2.615
408 HA ASP 53 HA ASP 53 16.316 0.286 -4.449
409 HB2 ASP 53 2HB ASP 53 14.329 1.209 -2.407
410 HB3 ASP 53 3HB ASP 53 15.651 2.277 -2.870
411 H CYS 54 H CYS 54 17.707 -1.547 -3.146
412 HA CYS 54 HA CYS 54 18.692 -1.026 -0.612
413 HB2 CYS 54 2HB CYS 54 19.739 -2.428 -3.018
414 HB3 CYS 54 3HB CYS 54 20.892 -2.046 -1.743
415 H ASP 55 H ASP 55 20.211 0.301 0.247
416 HA ASP 55 HA ASP 55 20.741 2.771 -0.863
417 HB2 ASP 55 2HB ASP 55 21.250 1.572 1.552
418 HB3 ASP 55 3HB ASP 55 22.873 1.804 0.909
Start of MODEL 4
1 H1 ALA 1 H ALA 1 2.193 2.461 -3.880
2 HA ALA 1 HA ALA 1 1.813 0.306 -1.907
3 HB1 ALA 1 1HB ALA 1 0.464 -0.200 -3.853
4 HB2 ALA 1 2HB ALA 1 1.861 0.016 -4.908
5 HB3 ALA 1 3HB ALA 1 1.825 -1.318 -3.755
6 H LYS 2 H LYS 2 3.715 0.083 -0.920
7 HA LYS 2 HA LYS 2 5.994 -0.864 -2.255
8 HB2 LYS 2 2HB LYS 2 5.768 1.882 -2.512
9 HB3 LYS 2 3HB LYS 2 6.861 1.696 -1.147
10 HG2 LYS 2 2HG LYS 2 7.884 -0.099 -2.925
11 HG3 LYS 2 3HG LYS 2 7.296 1.181 -3.989
12 HD2 LYS 2 2HD LYS 2 9.107 1.604 -1.612
13 HD3 LYS 2 3HD LYS 2 9.648 1.505 -3.290
14 HE2 LYS 2 2HE LYS 2 7.608 3.388 -3.330
15 HE3 LYS 2 3HE LYS 2 8.486 3.731 -1.841
16 HZ1 LYS 2 3HZ LYS 2 9.194 4.584 -4.309
17 HZ2 LYS 2 1HZ LYS 2 10.202 3.243 -4.093
18 HZ3 LYS 2 2HZ LYS 2 10.226 4.508 -2.971
19 H TYR 3 H TYR 3 7.599 -1.560 -0.830
20 HA TYR 3 HA TYR 3 6.861 -1.358 2.012
21 HB2 TYR 3 2HB TYR 3 8.416 -3.508 0.561
22 HB3 TYR 3 3HB TYR 3 8.113 -3.483 2.294
23 HD1 TYR 3 HD1 TYR 3 5.526 -3.215 2.916
24 HD2 TYR 3 HD2 TYR 3 7.015 -4.789 -0.746
25 HE1 TYR 3 HE1 TYR 3 3.397 -4.396 2.565
26 HE2 TYR 3 HE2 TYR 3 4.891 -5.974 -1.108
27 HH TYR 3 HH TYR 3 2.198 -5.659 1.185
28 H THR 4 H THR 4 8.461 -1.015 3.571
29 HA THR 4 HA THR 4 11.060 -0.086 2.539
30 HB THR 4 HB THR 4 9.686 1.178 4.904
31 HG1 THR 4 HG1 THR 4 8.745 2.607 3.567
32 HG21 THR 4 3HG2 THR 4 11.494 2.492 5.031
33 HG22 THR 4 1HG2 THR 4 11.498 2.785 3.292
34 HG23 THR 4 2HG2 THR 4 12.277 1.343 3.946
35 H GLY 5 H GLY 5 12.800 -0.936 3.502
36 HA2 GLY 5 2HA GLY 5 12.708 -1.816 6.260
37 HA3 GLY 5 3HA GLY 5 12.867 -3.114 5.086
38 H LYS 6 H LYS 6 14.909 -3.635 6.005
39 HA LYS 6 HA LYS 6 17.064 -1.991 4.910
40 HB2 LYS 6 2HB LYS 6 17.282 -3.073 7.709
41 HB3 LYS 6 3HB LYS 6 18.296 -1.874 6.917
42 HG2 LYS 6 2HG LYS 6 17.073 -0.496 8.235
43 HG3 LYS 6 3HG LYS 6 16.009 -0.541 6.828
44 HD2 LYS 6 2HD LYS 6 15.073 -2.675 8.151
45 HD3 LYS 6 3HD LYS 6 15.661 -1.726 9.519
46 HE2 LYS 6 2HE LYS 6 14.125 -0.210 7.526
47 HE3 LYS 6 3HE LYS 6 13.209 -1.451 8.379
48 HZ1 LYS 6 3HZ LYS 6 13.956 -0.472 10.479
49 HZ2 LYS 6 1HZ LYS 6 13.077 0.635 9.549
50 HZ3 LYS 6 2HZ LYS 6 14.762 0.749 9.630
51 H CYS 7 H CYS 7 19.000 -3.128 4.506
52 HA CYS 7 HA CYS 7 18.642 -6.046 4.420
53 HB2 CYS 7 2HB CYS 7 20.832 -4.870 2.841
54 HB3 CYS 7 3HB CYS 7 19.630 -6.072 2.383
55 H THR 8 H THR 8 21.214 -6.863 4.003
56 HA THR 8 HA THR 8 22.768 -5.867 6.282
57 HB THR 8 HB THR 8 22.888 -8.783 6.005
58 HG1 THR 8 HG1 THR 8 20.839 -9.204 6.318
59 HG21 THR 8 3HG2 THR 8 22.877 -6.717 8.132
60 HG22 THR 8 1HG2 THR 8 23.937 -8.108 7.911
61 HG23 THR 8 2HG2 THR 8 22.319 -8.329 8.577
62 H LYS 9 H LYS 9 24.807 -5.508 5.719
63 HA LYS 9 HA LYS 9 25.824 -6.016 3.164
64 HB2 LYS 9 2HB LYS 9 28.021 -5.376 4.131
65 HB3 LYS 9 3HB LYS 9 26.735 -4.243 4.525
66 HG2 LYS 9 2HG LYS 9 27.132 -4.490 6.685
67 HG3 LYS 9 3HG LYS 9 26.882 -6.233 6.566
68 HD2 LYS 9 2HD LYS 9 29.264 -6.377 5.711
69 HD3 LYS 9 3HD LYS 9 29.445 -4.693 6.211
70 HE2 LYS 9 2HE LYS 9 29.071 -5.233 8.484
71 HE3 LYS 9 3HE LYS 9 28.497 -6.850 8.081
72 HZ1 LYS 9 3HZ LYS 9 30.952 -6.904 7.043
73 HZ2 LYS 9 1HZ LYS 9 30.588 -7.415 8.614
74 HZ3 LYS 9 2HZ LYS 9 31.208 -5.864 8.351
75 H SER 10 H SER 10 25.560 -8.061 5.883
76 HA SER 10 HA SER 10 27.717 -9.755 5.719
77 HB2 SER 10 2HB SER 10 24.833 -10.225 6.418
78 HB3 SER 10 3HB SER 10 25.970 -11.573 6.386
79 HG SER 10 HG SER 10 27.193 -10.544 7.952
80 H LYS 11 H LYS 11 24.598 -10.724 4.318
81 HA LYS 11 HA LYS 11 26.070 -11.803 2.004
82 HB2 LYS 11 2HB LYS 11 24.071 -13.056 3.790
83 HB3 LYS 11 3HB LYS 11 23.868 -13.373 2.072
84 HG2 LYS 11 2HG LYS 11 26.621 -13.692 2.926
85 HG3 LYS 11 3HG LYS 11 25.511 -14.742 3.812
86 HD2 LYS 11 2HD LYS 11 24.617 -15.583 1.696
87 HD3 LYS 11 3HD LYS 11 25.715 -14.524 0.807
88 HE2 LYS 11 2HE LYS 11 27.474 -15.884 1.126
89 HE3 LYS 11 3HE LYS 11 27.024 -16.235 2.794
90 HZ1 LYS 11 3HZ LYS 11 26.695 -18.258 1.823
91 HZ2 LYS 11 1HZ LYS 11 26.237 -17.611 0.328
92 HZ3 LYS 11 2HZ LYS 11 25.149 -17.601 1.624
93 H ASN 12 H ASN 12 24.280 -9.322 2.749
94 HA ASN 12 HA ASN 12 22.894 -7.914 1.623
95 HB2 ASN 12 2HB ASN 12 24.084 -7.840 -0.326
96 HB3 ASN 12 3HB ASN 12 24.076 -9.590 -0.523
97 HD21 ASN 12 2HD2 ASN 12 21.038 -7.318 -2.025
98 HD22 ASN 12 1HD2 ASN 12 22.079 -6.703 -0.790
99 H GLU 13 H GLU 13 20.873 -8.080 2.364
100 HA GLU 13 HA GLU 13 18.927 -9.568 0.911
101 HB2 GLU 13 2HB GLU 13 20.183 -10.928 3.055
102 HB3 GLU 13 3HB GLU 13 18.563 -10.509 3.594
103 HG2 GLU 13 2HG GLU 13 17.632 -11.586 1.599
104 HG3 GLU 13 3HG GLU 13 19.260 -12.033 1.094
105 H CYS 14 H CYS 14 17.777 -7.696 0.727
106 HA CYS 14 HA CYS 14 17.273 -5.911 2.871
107 HB2 CYS 14 2HB CYS 14 17.157 -5.424 0.363
108 HB3 CYS 14 3HB CYS 14 15.568 -6.183 0.398
109 H LYS 15 H LYS 15 16.142 -6.456 4.613
110 HA LYS 15 HA LYS 15 14.056 -8.451 4.502
111 HB2 LYS 15 2HB LYS 15 15.538 -8.406 6.427
112 HB3 LYS 15 3HB LYS 15 15.084 -6.743 6.776
113 HG2 LYS 15 2HG LYS 15 12.875 -8.693 6.662
114 HG3 LYS 15 3HG LYS 15 14.009 -8.868 8.003
115 HD2 LYS 15 2HD LYS 15 12.637 -6.283 7.276
116 HD3 LYS 15 3HD LYS 15 12.039 -7.410 8.495
117 HE2 LYS 15 2HE LYS 15 14.537 -7.149 9.379
118 HE3 LYS 15 3HE LYS 15 14.384 -5.594 8.562
119 HZ1 LYS 15 3HZ LYS 15 12.753 -6.646 10.796
120 HZ2 LYS 15 1HZ LYS 15 12.257 -5.324 9.863
121 HZ3 LYS 15 2HZ LYS 15 13.689 -5.238 10.758
122 H TYR 16 H TYR 16 11.971 -8.064 4.172
123 HA TYR 16 HA TYR 16 10.806 -5.522 4.997
124 HB2 TYR 16 2HB TYR 16 9.885 -4.981 2.880
125 HB3 TYR 16 3HB TYR 16 11.581 -5.344 2.582
126 HD1 TYR 16 HD1 TYR 16 8.401 -5.805 1.329
127 HD2 TYR 16 HD2 TYR 16 11.960 -8.001 2.115
128 HE1 TYR 16 HE1 TYR 16 7.742 -7.467 -0.360
129 HE2 TYR 16 HE2 TYR 16 11.311 -9.668 0.428
130 HH TYR 16 HH TYR 16 8.612 -9.171 -1.704
131 H LYS 17 H LYS 17 8.316 -5.756 3.938
132 HA LYS 17 HA LYS 17 7.346 -8.279 5.111
133 HB2 LYS 17 2HB LYS 17 5.184 -6.933 5.422
134 HB3 LYS 17 3HB LYS 17 6.535 -6.557 6.483
135 HG2 LYS 17 2HG LYS 17 6.541 -4.960 4.055
136 HG3 LYS 17 3HG LYS 17 5.072 -4.754 5.013
137 HD2 LYS 17 2HD LYS 17 7.627 -4.743 6.502
138 HD3 LYS 17 3HD LYS 17 7.327 -3.360 5.446
139 HE2 LYS 17 2HE LYS 17 5.175 -2.989 6.553
140 HE3 LYS 17 3HE LYS 17 5.477 -4.370 7.605
141 HZ1 LYS 17 3HZ LYS 17 6.103 -2.530 8.859
142 HZ2 LYS 17 1HZ LYS 17 6.861 -1.761 7.556
143 HZ3 LYS 17 2HZ LYS 17 7.576 -3.118 8.269
144 H ASN 18 H ASN 18 6.573 -9.672 3.680
145 HA ASN 18 HA ASN 18 5.535 -8.658 1.126
146 HB2 ASN 18 2HB ASN 18 6.233 -10.609 0.114
147 HB3 ASN 18 3HB ASN 18 7.437 -10.471 1.392
148 HD21 ASN 18 2HD2 ASN 18 6.042 -13.118 3.342
149 HD22 ASN 18 1HD2 ASN 18 6.759 -11.553 3.490
150 H ASP 19 H ASP 19 4.736 -10.633 3.910
151 HA ASP 19 HA ASP 19 2.038 -11.073 2.831
152 HB2 ASP 19 2HB ASP 19 3.753 -12.851 4.027
153 HB3 ASP 19 3HB ASP 19 2.716 -12.381 5.371
154 H ALA 20 H ALA 20 2.889 -8.515 3.863
155 HA ALA 20 HA ALA 20 1.940 -6.830 5.078
156 HB1 ALA 20 1HB ALA 20 -0.168 -8.250 4.669
157 HB2 ALA 20 2HB ALA 20 0.036 -8.766 6.344
158 HB3 ALA 20 3HB ALA 20 -0.196 -7.059 5.970
159 H GLY 21 H GLY 21 4.147 -8.449 6.038
160 HA2 GLY 21 2HA GLY 21 4.941 -7.432 8.320
161 HA3 GLY 21 3HA GLY 21 3.717 -8.533 8.935
162 H LYS 22 H LYS 22 4.456 -10.391 6.626
163 HA LYS 22 HA LYS 22 6.109 -12.126 8.054
164 HB2 LYS 22 2HB LYS 22 5.112 -11.959 5.267
165 HB3 LYS 22 3HB LYS 22 6.517 -12.983 5.533
166 HG2 LYS 22 2HG LYS 22 3.984 -13.228 7.132
167 HG3 LYS 22 3HG LYS 22 4.284 -14.128 5.643
168 HD2 LYS 22 2HD LYS 22 5.784 -15.508 6.625
169 HD3 LYS 22 3HD LYS 22 6.423 -14.239 7.673
170 HE2 LYS 22 2HE LYS 22 5.353 -15.377 9.292
171 HE3 LYS 22 3HE LYS 22 3.932 -14.525 8.689
172 HZ1 LYS 22 3HZ LYS 22 4.111 -17.185 8.920
173 HZ2 LYS 22 1HZ LYS 22 4.559 -16.984 7.301
174 HZ3 LYS 22 2HZ LYS 22 3.070 -16.397 7.845
175 H ASP 23 H ASP 23 8.153 -11.809 8.619
176 HA ASP 23 HA ASP 23 9.875 -9.928 7.427
177 HB2 ASP 23 2HB ASP 23 11.652 -11.032 8.794
178 HB3 ASP 23 3HB ASP 23 10.219 -10.592 9.719
179 H THR 24 H THR 24 10.079 -10.256 5.234
180 HA THR 24 HA THR 24 11.407 -12.755 4.410
181 HB THR 24 HB THR 24 9.695 -10.892 2.754
182 HG1 THR 24 HG1 THR 24 8.501 -13.025 2.622
183 HG21 THR 24 3HG2 THR 24 9.978 -12.540 0.959
184 HG22 THR 24 1HG2 THR 24 11.093 -13.454 1.973
185 HG23 THR 24 2HG2 THR 24 11.523 -11.832 1.429
186 H PHE 25 H PHE 25 13.326 -12.657 3.368
187 HA PHE 25 HA PHE 25 14.542 -10.002 3.096
188 HB2 PHE 25 2HB PHE 25 16.052 -12.592 2.902
189 HB3 PHE 25 3HB PHE 25 16.638 -11.006 3.393
190 HD1 PHE 25 HD1 PHE 25 14.723 -10.201 5.424
191 HD2 PHE 25 HD2 PHE 25 16.451 -14.017 4.671
192 HE1 PHE 25 HE1 PHE 25 14.398 -10.810 7.786
193 HE2 PHE 25 HE2 PHE 25 16.128 -14.633 7.031
194 HZ PHE 25 HZ PHE 25 15.099 -13.029 8.592
195 H ILE 26 H ILE 26 15.082 -9.181 1.171
196 HA ILE 26 HA ILE 26 15.186 -10.965 -1.158
197 HB ILE 26 HB ILE 26 12.975 -10.020 -1.245
198 HG12 ILE 26 2HG1 ILE 26 13.082 -8.837 -3.395
199 HG13 ILE 26 3HG1 ILE 26 14.803 -8.552 -3.160
200 HG21 ILE 26 1HG2 ILE 26 12.489 -7.697 -1.129
201 HG22 ILE 26 2HG2 ILE 26 13.528 -8.074 0.244
202 HG23 ILE 26 3HG2 ILE 26 14.200 -7.272 -1.175
203 HD11 ILE 26 3HD1 ILE 26 15.368 -10.681 -3.690
204 HD12 ILE 26 1HD1 ILE 26 13.859 -11.356 -3.078
205 HD13 ILE 26 2HD1 ILE 26 13.890 -10.538 -4.641
206 H LYS 27 H LYS 27 17.084 -10.730 -2.115
207 HA LYS 27 HA LYS 27 18.943 -8.727 -1.525
208 HB2 LYS 27 2HB LYS 27 18.815 -10.435 -4.017
209 HB3 LYS 27 3HB LYS 27 20.234 -9.594 -3.407
210 HG2 LYS 27 2HG LYS 27 19.949 -11.000 -1.298
211 HG3 LYS 27 3HG LYS 27 18.837 -11.983 -2.254
212 HD2 LYS 27 2HD LYS 27 21.034 -11.710 -3.903
213 HD3 LYS 27 3HD LYS 27 21.747 -11.874 -2.296
214 HE2 LYS 27 2HE LYS 27 19.808 -13.800 -2.263
215 HE3 LYS 27 3HE LYS 27 20.332 -13.839 -3.946
216 HZ1 LYS 27 3HZ LYS 27 21.888 -15.211 -3.113
217 HZ2 LYS 27 1HZ LYS 27 21.767 -14.601 -1.540
218 HZ3 LYS 27 2HZ LYS 27 22.679 -13.774 -2.699
219 H CYS 28 H CYS 28 20.001 -7.663 -3.737
220 HA CYS 28 HA CYS 28 17.860 -5.910 -4.739
221 HB2 CYS 28 2HB CYS 28 19.735 -4.917 -3.330
222 HB3 CYS 28 3HB CYS 28 20.806 -5.262 -4.684
223 HA PRO 29 HA PRO 29 19.206 -8.309 -8.434
224 HB2 PRO 29 2HB PRO 29 16.726 -8.408 -9.535
225 HB3 PRO 29 3HB PRO 29 17.290 -9.572 -8.330
226 HG2 PRO 29 2HG PRO 29 15.560 -7.155 -7.967
227 HG3 PRO 29 3HG PRO 29 15.384 -8.774 -7.263
228 HD2 PRO 29 2HD PRO 29 16.433 -6.693 -5.885
229 HD3 PRO 29 3HD PRO 29 16.954 -8.370 -5.625
230 H LYS 30 H LYS 30 17.582 -5.303 -7.909
231 HA LYS 30 HA LYS 30 17.205 -4.336 -10.472
232 HB2 LYS 30 2HB LYS 30 17.157 -3.285 -7.869
233 HB3 LYS 30 3HB LYS 30 18.277 -2.266 -8.765
234 HG2 LYS 30 2HG LYS 30 16.595 -1.775 -10.411
235 HG3 LYS 30 3HG LYS 30 15.475 -2.913 -9.658
236 HD2 LYS 30 2HD LYS 30 14.938 -1.483 -7.988
237 HD3 LYS 30 3HD LYS 30 16.567 -0.810 -7.896
238 HE2 LYS 30 2HE LYS 30 15.231 0.948 -8.690
239 HE3 LYS 30 3HE LYS 30 16.047 0.318 -10.120
240 HZ1 LYS 30 3HZ LYS 30 14.124 -0.358 -11.014
241 HZ2 LYS 30 1HZ LYS 30 13.404 0.729 -9.936
242 HZ3 LYS 30 2HZ LYS 30 13.497 -0.913 -9.545
243 H PHE 31 H PHE 31 20.051 -3.622 -8.437
244 HA PHE 31 HA PHE 31 21.631 -3.393 -10.914
245 HB2 PHE 31 2HB PHE 31 22.736 -2.104 -8.518
246 HB3 PHE 31 3HB PHE 31 22.594 -1.493 -10.163
247 HD1 PHE 31 HD1 PHE 31 20.800 -0.089 -10.805
248 HD2 PHE 31 HD2 PHE 31 20.819 -1.923 -6.964
249 HE1 PHE 31 HE1 PHE 31 18.940 1.363 -10.106
250 HE2 PHE 31 HE2 PHE 31 18.959 -0.475 -6.259
251 HZ PHE 31 HZ PHE 31 18.016 1.170 -7.831
252 H ASP 32 H ASP 32 23.615 -4.383 -11.022
253 HA ASP 32 HA ASP 32 24.104 -6.424 -8.986
254 HB2 ASP 32 2HB ASP 32 25.690 -6.244 -11.514
255 HB3 ASP 32 3HB ASP 32 25.189 -7.668 -10.607
256 H ASN 33 H ASN 33 24.982 -3.344 -9.392
257 HA ASN 33 HA ASN 33 27.586 -3.784 -8.111
258 HB2 ASN 33 2HB ASN 33 27.214 -2.703 -10.707
259 HB3 ASN 33 3HB ASN 33 27.690 -1.372 -9.656
260 HD21 ASN 33 2HD2 ASN 33 30.268 -4.545 -9.819
261 HD22 ASN 33 1HD2 ASN 33 28.565 -4.805 -9.687
262 H LYS 34 H LYS 34 24.690 -2.859 -7.468
263 HA LYS 34 HA LYS 34 25.540 -0.640 -5.750
264 HB2 LYS 34 2HB LYS 34 22.892 -0.616 -7.193
265 HB3 LYS 34 3HB LYS 34 23.619 0.681 -6.254
266 HG2 LYS 34 2HG LYS 34 24.736 -0.391 -8.836
267 HG3 LYS 34 3HG LYS 34 23.719 1.045 -8.695
268 HD2 LYS 34 2HD LYS 34 26.014 1.035 -6.880
269 HD3 LYS 34 3HD LYS 34 26.456 1.021 -8.589
270 HE2 LYS 34 2HE LYS 34 25.310 3.031 -9.008
271 HE3 LYS 34 3HE LYS 34 24.427 2.942 -7.485
272 HZ1 LYS 34 3HZ LYS 34 27.284 3.593 -7.898
273 HZ2 LYS 34 1HZ LYS 34 26.667 3.167 -6.381
274 HZ3 LYS 34 2HZ LYS 34 26.089 4.545 -7.173
275 H LYS 35 H LYS 35 24.551 -3.647 -5.766
276 HA LYS 35 HA LYS 35 22.225 -3.904 -4.312
277 HB2 LYS 35 2HB LYS 35 23.322 -5.987 -3.345
278 HB3 LYS 35 3HB LYS 35 23.246 -5.883 -5.099
279 HG2 LYS 35 2HG LYS 35 25.395 -6.689 -4.572
280 HG3 LYS 35 3HG LYS 35 25.604 -4.998 -5.035
281 HD2 LYS 35 2HD LYS 35 26.068 -4.327 -2.878
282 HD3 LYS 35 3HD LYS 35 25.202 -5.686 -2.157
283 HE2 LYS 35 2HE LYS 35 27.428 -6.221 -1.773
284 HE3 LYS 35 3HE LYS 35 27.049 -7.135 -3.232
285 HZ1 LYS 35 3HZ LYS 35 28.015 -4.490 -3.782
286 HZ2 LYS 35 1HZ LYS 35 28.522 -5.978 -4.409
287 HZ3 LYS 35 2HZ LYS 35 29.137 -5.429 -2.932
288 H CYS 36 H CYS 36 21.996 -4.508 -1.987
289 HA CYS 36 HA CYS 36 22.791 -2.405 -0.325
290 HB2 CYS 36 2HB CYS 36 21.524 -5.072 0.115
291 HB3 CYS 36 3HB CYS 36 22.130 -4.195 1.516
292 H THR 37 H THR 37 24.720 -1.965 0.486
293 HA THR 37 HA THR 37 26.497 -4.206 1.201
294 HB THR 37 HB THR 37 28.387 -2.517 0.717
295 HG1 THR 37 HG1 THR 37 27.790 -0.683 -0.136
296 HG21 THR 37 3HG2 THR 37 27.139 -4.473 -0.829
297 HG22 THR 37 1HG2 THR 37 28.741 -3.785 -1.087
298 HG23 THR 37 2HG2 THR 37 27.343 -3.101 -1.917
299 H LYS 38 H LYS 38 24.665 -2.978 2.969
300 HA LYS 38 HA LYS 38 26.520 -2.075 5.005
301 HB2 LYS 38 2HB LYS 38 24.913 -0.216 3.548
302 HB3 LYS 38 3HB LYS 38 24.309 -0.298 5.197
303 HG2 LYS 38 2HG LYS 38 27.237 -0.066 4.853
304 HG3 LYS 38 3HG LYS 38 26.261 1.348 4.450
305 HD2 LYS 38 2HD LYS 38 25.682 -0.048 7.007
306 HD3 LYS 38 3HD LYS 38 27.165 0.905 6.910
307 HE2 LYS 38 2HE LYS 38 24.670 2.153 5.903
308 HE3 LYS 38 3HE LYS 38 24.826 1.951 7.648
309 HZ1 LYS 38 3HZ LYS 38 26.459 3.479 7.769
310 HZ2 LYS 38 1HZ LYS 38 25.760 4.057 6.341
311 HZ3 LYS 38 2HZ LYS 38 27.131 3.069 6.272
312 H ASP 39 H ASP 39 25.598 -2.106 7.148
313 HA ASP 39 HA ASP 39 23.513 -4.125 7.379
314 HB2 ASP 39 2HB ASP 39 25.436 -2.906 9.359
315 HB3 ASP 39 3HB ASP 39 24.142 -3.998 9.845
316 H ASN 40 H ASN 40 21.463 -3.649 7.782
317 HA ASN 40 HA ASN 40 19.577 -2.541 8.404
318 HB2 ASN 40 2HB ASN 40 21.265 -0.811 10.202
319 HB3 ASN 40 3HB ASN 40 19.588 -1.307 10.418
320 HD21 ASN 40 2HD2 ASN 40 22.466 -3.386 12.130
321 HD22 ASN 40 1HD2 ASN 40 22.613 -1.780 11.510
322 H ASN 41 H ASN 41 20.906 -1.666 6.099
323 HA ASN 41 HA ASN 41 21.048 1.205 6.089
324 HB2 ASN 41 2HB ASN 41 21.440 0.969 3.681
325 HB3 ASN 41 3HB ASN 41 22.460 -0.142 4.591
326 HD21 ASN 41 2HD2 ASN 41 21.197 -3.001 3.117
327 HD22 ASN 41 1HD2 ASN 41 22.304 -2.275 4.228
328 H LYS 42 H LYS 42 19.824 1.979 3.787
329 HA LYS 42 HA LYS 42 16.980 1.626 4.450
330 HB2 LYS 42 2HB LYS 42 18.151 3.936 4.528
331 HB3 LYS 42 3HB LYS 42 18.075 3.865 2.772
332 HG2 LYS 42 2HG LYS 42 15.523 3.234 3.977
333 HG3 LYS 42 3HG LYS 42 16.119 4.817 4.481
334 HD2 LYS 42 2HD LYS 42 16.632 5.075 1.913
335 HD3 LYS 42 3HD LYS 42 15.387 3.833 1.763
336 HE2 LYS 42 2HE LYS 42 14.257 5.894 1.587
337 HE3 LYS 42 3HE LYS 42 13.935 5.314 3.220
338 HZ1 LYS 42 3HZ LYS 42 14.640 7.304 3.878
339 HZ2 LYS 42 1HZ LYS 42 15.296 7.683 2.366
340 HZ3 LYS 42 2HZ LYS 42 16.204 6.795 3.483
341 H CYS 43 H CYS 43 16.037 0.182 3.164
342 HA CYS 43 HA CYS 43 16.309 0.497 0.275
343 HB2 CYS 43 2HB CYS 43 16.589 -1.943 -0.043
344 HB3 CYS 43 3HB CYS 43 17.953 -1.214 0.798
345 H THR 44 H THR 44 14.379 0.459 -0.665
346 HA THR 44 HA THR 44 12.114 -0.651 0.848
347 HB THR 44 HB THR 44 10.783 0.743 -0.910
348 HG1 THR 44 HG1 THR 44 12.173 1.632 -2.268
349 HG21 THR 44 3HG2 THR 44 12.092 1.491 1.598
350 HG22 THR 44 1HG2 THR 44 10.415 1.692 1.093
351 HG23 THR 44 2HG2 THR 44 11.632 2.868 0.597
352 H VAL 45 H VAL 45 10.987 -2.328 0.076
353 HA VAL 45 HA VAL 45 11.779 -3.435 -2.515
354 HB VAL 45 HB VAL 45 10.175 -4.685 -0.280
355 HG11 VAL 45 1HG1 VAL 45 9.506 -5.653 -2.367
356 HG12 VAL 45 2HG1 VAL 45 11.186 -5.824 -2.881
357 HG13 VAL 45 3HG1 VAL 45 10.569 -6.796 -1.545
358 HG21 VAL 45 3HG2 VAL 45 12.122 -5.903 0.295
359 HG22 VAL 45 1HG2 VAL 45 12.972 -5.366 -1.153
360 HG23 VAL 45 2HG2 VAL 45 12.625 -4.220 0.141
361 H ASP 46 H ASP 46 10.327 -3.905 -4.141
362 HA ASP 46 HA ASP 46 7.616 -2.797 -3.806
363 HB2 ASP 46 2HB ASP 46 9.665 -2.125 -5.714
364 HB3 ASP 46 3HB ASP 46 8.259 -2.776 -6.552
365 H THR 47 H THR 47 6.085 -4.283 -3.947
366 HA THR 47 HA THR 47 6.673 -6.840 -5.233
367 HB THR 47 HB THR 47 5.694 -6.803 -2.935
368 HG1 THR 47 HG1 THR 47 5.384 -8.607 -4.353
369 HG21 THR 47 3HG2 THR 47 3.240 -5.778 -4.367
370 HG22 THR 47 1HG2 THR 47 4.213 -4.872 -3.209
371 HG23 THR 47 2HG2 THR 47 3.311 -6.293 -2.683
372 H TYR 48 H TYR 48 6.081 -4.315 -6.718
373 HA TYR 48 HA TYR 48 3.588 -5.090 -8.068
374 HB2 TYR 48 2HB TYR 48 4.011 -2.702 -7.154
375 HB3 TYR 48 3HB TYR 48 5.064 -2.516 -8.553
376 HD1 TYR 48 HD1 TYR 48 4.153 -1.682 -10.506
377 HD2 TYR 48 HD2 TYR 48 1.593 -3.618 -7.714
378 HE1 TYR 48 HE1 TYR 48 2.209 -1.105 -11.898
379 HE2 TYR 48 HE2 TYR 48 -0.358 -3.048 -9.098
380 HH TYR 48 HH TYR 48 -0.965 -1.335 -10.805
381 H ASN 49 H ASN 49 7.015 -4.765 -8.478
382 HA ASN 49 HA ASN 49 6.834 -6.069 -11.065
383 HB2 ASN 49 2HB ASN 49 8.032 -4.455 -12.304
384 HB3 ASN 49 3HB ASN 49 6.820 -3.533 -11.419
385 HD21 ASN 49 2HD2 ASN 49 9.246 -2.193 -9.111
386 HD22 ASN 49 1HD2 ASN 49 7.690 -2.945 -9.107
387 H ASN 50 H ASN 50 7.899 -6.431 -8.228
388 HA ASN 50 HA ASN 50 9.710 -7.329 -7.174
389 HB2 ASN 50 2HB ASN 50 9.133 -8.982 -9.106
390 HB3 ASN 50 3HB ASN 50 10.625 -8.389 -9.830
391 HD21 ASN 50 2HD2 ASN 50 10.699 -11.086 -6.868
392 HD22 ASN 50 1HD2 ASN 50 9.240 -10.497 -7.582
393 H ALA 51 H ALA 51 10.740 -5.359 -6.688
394 HA ALA 51 HA ALA 51 13.394 -5.136 -7.647
395 HB1 ALA 51 1HB ALA 51 12.030 -4.104 -9.534
396 HB2 ALA 51 2HB ALA 51 11.698 -2.780 -8.416
397 HB3 ALA 51 3HB ALA 51 13.359 -3.143 -8.885
398 H VAL 52 H VAL 52 14.621 -4.169 -6.137
399 HA VAL 52 HA VAL 52 13.227 -2.678 -4.011
400 HB VAL 52 HB VAL 52 14.381 -4.900 -3.445
401 HG11 VAL 52 1HG1 VAL 52 16.756 -4.854 -3.091
402 HG12 VAL 52 2HG1 VAL 52 16.429 -4.404 -4.766
403 HG13 VAL 52 3HG1 VAL 52 16.841 -3.162 -3.582
404 HG21 VAL 52 3HG2 VAL 52 13.625 -3.298 -1.765
405 HG22 VAL 52 1HG2 VAL 52 15.148 -4.047 -1.284
406 HG23 VAL 52 2HG2 VAL 52 15.137 -2.404 -1.925
407 H ASP 53 H ASP 53 14.359 -0.915 -3.015
408 HA ASP 53 HA ASP 53 16.177 0.433 -4.890
409 HB2 ASP 53 2HB ASP 53 14.132 1.406 -2.938
410 HB3 ASP 53 3HB ASP 53 15.499 2.449 -3.322
411 H CYS 54 H CYS 54 17.633 -1.295 -3.669
412 HA CYS 54 HA CYS 54 18.530 -0.898 -1.082
413 HB2 CYS 54 2HB CYS 54 20.701 -1.896 -1.914
414 HB3 CYS 54 3HB CYS 54 19.254 -2.839 -2.258
415 H ASP 55 H ASP 55 20.279 0.235 -0.180
416 HA ASP 55 HA ASP 55 20.594 2.885 -1.069
417 HB2 ASP 55 2HB ASP 55 20.902 2.565 1.233
418 HB3 ASP 55 3HB ASP 55 21.997 1.207 0.992
Start of MODEL 5
1 H1 ALA 1 H ALA 1 0.870 -0.924 -0.810
2 HA ALA 1 HA ALA 1 1.444 0.175 -2.880
3 HB1 ALA 1 1HB ALA 1 1.607 2.386 -2.762
4 HB2 ALA 1 2HB ALA 1 1.824 2.329 -1.012
5 HB3 ALA 1 3HB ALA 1 3.220 2.180 -2.078
6 H LYS 2 H LYS 2 3.802 0.455 -0.212
7 HA LYS 2 HA LYS 2 5.421 -1.632 -1.425
8 HB2 LYS 2 2HB LYS 2 7.458 -0.287 -1.450
9 HB3 LYS 2 3HB LYS 2 6.237 0.420 -2.500
10 HG2 LYS 2 2HG LYS 2 6.032 2.281 -1.240
11 HG3 LYS 2 3HG LYS 2 6.305 1.418 0.275
12 HD2 LYS 2 2HD LYS 2 8.351 2.307 0.274
13 HD3 LYS 2 3HD LYS 2 8.725 1.215 -1.062
14 HE2 LYS 2 2HE LYS 2 8.626 2.864 -2.612
15 HE3 LYS 2 3HE LYS 2 7.333 3.720 -1.773
16 HZ1 LYS 2 3HZ LYS 2 10.240 3.835 -1.276
17 HZ2 LYS 2 1HZ LYS 2 9.136 4.292 -0.079
18 HZ3 LYS 2 2HZ LYS 2 9.163 5.108 -1.560
19 H TYR 3 H TYR 3 7.608 -1.674 0.033
20 HA TYR 3 HA TYR 3 6.746 -1.495 2.843
21 HB2 TYR 3 2HB TYR 3 8.312 -3.763 1.594
22 HB3 TYR 3 3HB TYR 3 7.890 -3.620 3.297
23 HD1 TYR 3 HD1 TYR 3 6.944 -5.013 0.210
24 HD2 TYR 3 HD2 TYR 3 5.311 -3.381 3.783
25 HE1 TYR 3 HE1 TYR 3 4.832 -6.196 -0.222
26 HE2 TYR 3 HE2 TYR 3 3.195 -4.560 3.362
27 HH TYR 3 HH TYR 3 2.344 -5.829 0.460
28 H THR 4 H THR 4 8.411 -1.186 4.385
29 HA THR 4 HA THR 4 10.913 -0.132 3.233
30 HB THR 4 HB THR 4 9.625 0.765 5.816
31 HG1 THR 4 HG1 THR 4 8.402 1.966 4.590
32 HG21 THR 4 3HG2 THR 4 11.278 2.761 4.896
33 HG22 THR 4 1HG2 THR 4 12.172 1.297 4.488
34 HG23 THR 4 2HG2 THR 4 11.681 1.595 6.156
35 H GLY 5 H GLY 5 12.822 -0.834 4.039
36 HA2 GLY 5 2HA GLY 5 13.029 -2.107 6.610
37 HA3 GLY 5 3HA GLY 5 13.129 -3.245 5.275
38 H LYS 6 H LYS 6 15.284 -3.617 6.267
39 HA LYS 6 HA LYS 6 17.248 -1.876 4.970
40 HB2 LYS 6 2HB LYS 6 17.748 -2.887 7.756
41 HB3 LYS 6 3HB LYS 6 18.591 -1.614 6.881
42 HG2 LYS 6 2HG LYS 6 17.355 -0.330 8.279
43 HG3 LYS 6 3HG LYS 6 16.194 -0.488 6.958
44 HD2 LYS 6 2HD LYS 6 15.555 -2.677 8.365
45 HD3 LYS 6 3HD LYS 6 16.159 -1.661 9.676
46 HE2 LYS 6 2HE LYS 6 14.326 -0.350 7.776
47 HE3 LYS 6 3HE LYS 6 13.614 -1.616 8.774
48 HZ1 LYS 6 3HZ LYS 6 14.172 1.010 9.497
49 HZ2 LYS 6 1HZ LYS 6 15.233 0.031 10.380
50 HZ3 LYS 6 2HZ LYS 6 13.564 -0.227 10.478
51 H CYS 7 H CYS 7 19.243 -2.893 4.485
52 HA CYS 7 HA CYS 7 19.060 -5.829 4.448
53 HB2 CYS 7 2HB CYS 7 21.074 -4.519 2.736
54 HB3 CYS 7 3HB CYS 7 19.958 -5.830 2.365
55 H THR 8 H THR 8 21.653 -6.488 3.894
56 HA THR 8 HA THR 8 23.251 -5.380 6.093
57 HB THR 8 HB THR 8 23.514 -8.295 5.738
58 HG1 THR 8 HG1 THR 8 21.321 -7.427 7.280
59 HG21 THR 8 3HG2 THR 8 24.313 -6.408 7.578
60 HG22 THR 8 1HG2 THR 8 24.351 -8.155 7.814
61 HG23 THR 8 2HG2 THR 8 22.975 -7.215 8.395
62 H LYS 9 H LYS 9 25.227 -4.864 5.435
63 HA LYS 9 HA LYS 9 26.149 -5.257 2.827
64 HB2 LYS 9 2HB LYS 9 28.393 -4.571 3.795
65 HB3 LYS 9 3HB LYS 9 27.063 -3.450 4.054
66 HG2 LYS 9 2HG LYS 9 27.199 -3.633 6.269
67 HG3 LYS 9 3HG LYS 9 27.340 -5.391 6.204
68 HD2 LYS 9 2HD LYS 9 29.357 -4.576 7.157
69 HD3 LYS 9 3HD LYS 9 29.737 -5.062 5.503
70 HE2 LYS 9 2HE LYS 9 30.095 -2.923 4.813
71 HE3 LYS 9 3HE LYS 9 28.916 -2.247 5.936
72 HZ1 LYS 9 3HZ LYS 9 31.610 -2.143 6.224
73 HZ2 LYS 9 1HZ LYS 9 31.182 -3.419 7.249
74 HZ3 LYS 9 2HZ LYS 9 30.482 -1.894 7.460
75 H SER 10 H SER 10 26.182 -7.358 5.523
76 HA SER 10 HA SER 10 28.434 -8.894 5.213
77 HB2 SER 10 2HB SER 10 25.642 -9.525 6.088
78 HB3 SER 10 3HB SER 10 26.793 -10.845 5.884
79 HG SER 10 HG SER 10 28.027 -10.039 7.481
80 H LYS 11 H LYS 11 25.323 -10.050 3.941
81 HA LYS 11 HA LYS 11 26.741 -10.957 1.522
82 HB2 LYS 11 2HB LYS 11 24.761 -12.403 3.255
83 HB3 LYS 11 3HB LYS 11 24.929 -12.821 1.555
84 HG2 LYS 11 2HG LYS 11 27.362 -13.198 1.968
85 HG3 LYS 11 3HG LYS 11 27.043 -12.973 3.690
86 HD2 LYS 11 2HD LYS 11 25.443 -14.841 3.619
87 HD3 LYS 11 3HD LYS 11 25.814 -15.078 1.909
88 HE2 LYS 11 2HE LYS 11 28.298 -15.142 2.945
89 HE3 LYS 11 3HE LYS 11 27.382 -15.774 4.313
90 HZ1 LYS 11 3HZ LYS 11 28.163 -17.523 2.806
91 HZ2 LYS 11 1HZ LYS 11 27.254 -16.849 1.548
92 HZ3 LYS 11 2HZ LYS 11 26.475 -17.485 2.907
93 H ASN 12 H ASN 12 24.737 -8.701 2.482
94 HA ASN 12 HA ASN 12 23.186 -7.390 1.458
95 HB2 ASN 12 2HB ASN 12 23.989 -7.125 -0.625
96 HB3 ASN 12 3HB ASN 12 24.492 -8.810 -0.727
97 HD21 ASN 12 2HD2 ASN 12 20.908 -7.602 -2.234
98 HD22 ASN 12 1HD2 ASN 12 21.808 -6.600 -1.151
99 H GLU 13 H GLU 13 21.134 -7.543 2.050
100 HA GLU 13 HA GLU 13 19.250 -9.220 0.844
101 HB2 GLU 13 2HB GLU 13 20.758 -10.635 2.679
102 HB3 GLU 13 3HB GLU 13 19.329 -10.188 3.599
103 HG2 GLU 13 2HG GLU 13 17.925 -11.163 1.813
104 HG3 GLU 13 3HG GLU 13 19.394 -11.698 0.998
105 H CYS 14 H CYS 14 17.972 -7.421 0.796
106 HA CYS 14 HA CYS 14 17.432 -5.889 3.176
107 HB2 CYS 14 2HB CYS 14 16.828 -5.679 0.301
108 HB3 CYS 14 3HB CYS 14 15.567 -5.058 1.361
109 H LYS 15 H LYS 15 16.172 -6.722 4.704
110 HA LYS 15 HA LYS 15 14.081 -8.616 4.074
111 HB2 LYS 15 2HB LYS 15 15.535 -8.822 6.096
112 HB3 LYS 15 3HB LYS 15 14.776 -7.372 6.740
113 HG2 LYS 15 2HG LYS 15 13.051 -9.659 5.929
114 HG3 LYS 15 3HG LYS 15 13.951 -9.753 7.444
115 HD2 LYS 15 2HD LYS 15 12.620 -7.193 7.109
116 HD3 LYS 15 3HD LYS 15 11.488 -8.546 7.064
117 HE2 LYS 15 2HE LYS 15 13.560 -8.575 9.183
118 HE3 LYS 15 3HE LYS 15 12.267 -7.387 9.338
119 HZ1 LYS 15 3HZ LYS 15 11.714 -9.448 10.466
120 HZ2 LYS 15 1HZ LYS 15 11.893 -10.317 9.025
121 HZ3 LYS 15 2HZ LYS 15 10.652 -9.177 9.177
122 H TYR 16 H TYR 16 11.875 -8.324 4.390
123 HA TYR 16 HA TYR 16 10.858 -5.740 5.209
124 HB2 TYR 16 2HB TYR 16 9.746 -5.186 3.181
125 HB3 TYR 16 3HB TYR 16 11.411 -5.551 2.743
126 HD1 TYR 16 HD1 TYR 16 11.897 -7.934 1.883
127 HD2 TYR 16 HD2 TYR 16 7.987 -6.270 2.101
128 HE1 TYR 16 HE1 TYR 16 11.108 -9.591 0.246
129 HE2 TYR 16 HE2 TYR 16 7.186 -7.924 0.466
130 HH TYR 16 HH TYR 16 9.214 -9.756 -1.438
131 H LYS 17 H LYS 17 8.281 -5.905 4.407
132 HA LYS 17 HA LYS 17 7.363 -8.463 5.551
133 HB2 LYS 17 2HB LYS 17 5.370 -7.135 6.358
134 HB3 LYS 17 3HB LYS 17 6.896 -6.770 7.152
135 HG2 LYS 17 2HG LYS 17 6.547 -5.057 4.881
136 HG3 LYS 17 3HG LYS 17 5.125 -4.983 5.924
137 HD2 LYS 17 2HD LYS 17 6.397 -4.299 7.784
138 HD3 LYS 17 3HD LYS 17 7.918 -4.757 7.014
139 HE2 LYS 17 2HE LYS 17 7.567 -2.973 5.343
140 HE3 LYS 17 3HE LYS 17 6.099 -2.493 6.193
141 HZ1 LYS 17 3HZ LYS 17 7.275 -1.379 7.696
142 HZ2 LYS 17 1HZ LYS 17 8.608 -1.547 6.668
143 HZ3 LYS 17 2HZ LYS 17 8.368 -2.649 7.928
144 H ASN 18 H ASN 18 5.858 -9.595 4.459
145 HA ASN 18 HA ASN 18 4.453 -8.293 2.235
146 HB2 ASN 18 2HB ASN 18 5.147 -9.793 0.638
147 HB3 ASN 18 3HB ASN 18 6.591 -9.752 1.646
148 HD21 ASN 18 2HD2 ASN 18 5.703 -12.933 3.209
149 HD22 ASN 18 1HD2 ASN 18 6.057 -11.318 3.712
150 H ASP 19 H ASP 19 2.606 -9.596 1.439
151 HA ASP 19 HA ASP 19 0.714 -10.837 1.734
152 HB2 ASP 19 2HB ASP 19 2.474 -12.575 2.531
153 HB3 ASP 19 3HB ASP 19 1.915 -12.162 4.149
154 H ALA 20 H ALA 20 1.917 -10.461 5.070
155 HA ALA 20 HA ALA 20 0.063 -8.376 5.685
156 HB1 ALA 20 1HB ALA 20 -1.323 -9.598 7.273
157 HB2 ALA 20 2HB ALA 20 -1.493 -10.262 5.647
158 HB3 ALA 20 3HB ALA 20 -0.507 -11.102 6.844
159 H GLY 21 H GLY 21 2.925 -9.113 5.947
160 HA2 GLY 21 2HA GLY 21 4.164 -7.926 7.742
161 HA3 GLY 21 3HA GLY 21 3.158 -8.811 8.879
162 H LYS 22 H LYS 22 3.898 -10.781 6.292
163 HA LYS 22 HA LYS 22 5.538 -12.486 7.861
164 HB2 LYS 22 2HB LYS 22 4.325 -12.522 5.197
165 HB3 LYS 22 3HB LYS 22 5.886 -13.331 5.258
166 HG2 LYS 22 2HG LYS 22 5.117 -14.811 6.981
167 HG3 LYS 22 3HG LYS 22 3.596 -13.926 7.119
168 HD2 LYS 22 2HD LYS 22 3.451 -14.501 4.538
169 HD3 LYS 22 3HD LYS 22 4.514 -15.825 5.021
170 HE2 LYS 22 2HE LYS 22 2.148 -15.357 6.725
171 HE3 LYS 22 3HE LYS 22 1.828 -15.962 5.100
172 HZ1 LYS 22 3HZ LYS 22 3.965 -17.400 6.254
173 HZ2 LYS 22 1HZ LYS 22 2.463 -17.973 5.726
174 HZ3 LYS 22 2HZ LYS 22 2.645 -17.417 7.313
175 H ASP 23 H ASP 23 7.690 -12.627 8.038
176 HA ASP 23 HA ASP 23 9.341 -10.559 6.985
177 HB2 ASP 23 2HB ASP 23 11.203 -11.980 8.001
178 HB3 ASP 23 3HB ASP 23 9.963 -11.396 9.107
179 H THR 24 H THR 24 10.103 -10.462 4.989
180 HA THR 24 HA THR 24 10.905 -12.963 3.659
181 HB THR 24 HB THR 24 9.511 -10.635 2.323
182 HG1 THR 24 HG1 THR 24 7.936 -12.438 1.945
183 HG21 THR 24 3HG2 THR 24 11.260 -12.559 1.251
184 HG22 THR 24 1HG2 THR 24 10.223 -11.439 0.369
185 HG23 THR 24 2HG2 THR 24 9.635 -13.051 0.775
186 H PHE 25 H PHE 25 12.913 -12.954 2.876
187 HA PHE 25 HA PHE 25 14.354 -10.394 2.813
188 HB2 PHE 25 2HB PHE 25 15.448 -13.213 2.924
189 HB3 PHE 25 3HB PHE 25 16.404 -11.736 2.978
190 HD1 PHE 25 HD1 PHE 25 16.798 -10.630 4.999
191 HD2 PHE 25 HD2 PHE 25 13.819 -13.664 4.797
192 HE1 PHE 25 HE1 PHE 25 16.584 -10.579 7.450
193 HE2 PHE 25 HE2 PHE 25 13.600 -13.617 7.247
194 HZ PHE 25 HZ PHE 25 14.983 -12.073 8.577
195 H ILE 26 H ILE 26 15.356 -9.673 0.997
196 HA ILE 26 HA ILE 26 15.694 -11.369 -1.314
197 HB ILE 26 HB ILE 26 13.353 -10.741 -1.586
198 HG12 ILE 26 2HG1 ILE 26 13.513 -9.717 -3.822
199 HG13 ILE 26 3HG1 ILE 26 15.175 -9.244 -3.485
200 HG21 ILE 26 1HG2 ILE 26 13.361 -8.691 -0.272
201 HG22 ILE 26 2HG2 ILE 26 14.345 -7.895 -1.499
202 HG23 ILE 26 3HG2 ILE 26 12.699 -8.400 -1.880
203 HD11 ILE 26 3HD1 ILE 26 15.974 -11.299 -3.891
204 HD12 ILE 26 1HD1 ILE 26 14.586 -12.103 -3.159
205 HD13 ILE 26 2HD1 ILE 26 14.477 -11.477 -4.805
206 H LYS 27 H LYS 27 17.348 -10.693 -2.555
207 HA LYS 27 HA LYS 27 18.804 -8.341 -1.705
208 HB2 LYS 27 2HB LYS 27 20.492 -9.123 -3.378
209 HB3 LYS 27 3HB LYS 27 20.104 -10.309 -2.139
210 HG2 LYS 27 2HG LYS 27 18.974 -11.677 -3.611
211 HG3 LYS 27 3HG LYS 27 18.661 -10.367 -4.752
212 HD2 LYS 27 2HD LYS 27 20.997 -10.327 -5.395
213 HD3 LYS 27 3HD LYS 27 21.377 -11.556 -4.186
214 HE2 LYS 27 2HE LYS 27 19.816 -13.098 -5.373
215 HE3 LYS 27 3HE LYS 27 19.647 -11.877 -6.634
216 HZ1 LYS 27 3HZ LYS 27 21.914 -12.086 -7.203
217 HZ2 LYS 27 1HZ LYS 27 21.322 -13.666 -7.075
218 HZ3 LYS 27 2HZ LYS 27 22.264 -13.013 -5.832
219 H CYS 28 H CYS 28 19.402 -6.606 -3.051
220 HA CYS 28 HA CYS 28 17.433 -5.453 -4.582
221 HB2 CYS 28 2HB CYS 28 19.799 -4.590 -3.680
222 HB3 CYS 28 3HB CYS 28 20.243 -4.862 -5.362
223 HA PRO 29 HA PRO 29 17.658 -8.183 -8.151
224 HB2 PRO 29 2HB PRO 29 15.375 -7.252 -9.288
225 HB3 PRO 29 3HB PRO 29 15.380 -8.419 -7.961
226 HG2 PRO 29 2HG PRO 29 14.948 -5.458 -7.877
227 HG3 PRO 29 3HG PRO 29 14.075 -6.740 -7.019
228 HD2 PRO 29 2HD PRO 29 15.993 -5.240 -5.835
229 HD3 PRO 29 3HD PRO 29 15.700 -6.936 -5.397
230 H LYS 30 H LYS 30 17.127 -4.693 -8.162
231 HA LYS 30 HA LYS 30 17.486 -4.165 -10.868
232 HB2 LYS 30 2HB LYS 30 17.271 -2.665 -8.487
233 HB3 LYS 30 3HB LYS 30 18.739 -2.115 -9.285
234 HG2 LYS 30 2HG LYS 30 16.042 -2.276 -10.611
235 HG3 LYS 30 3HG LYS 30 16.720 -0.816 -9.888
236 HD2 LYS 30 2HD LYS 30 18.680 -1.911 -11.619
237 HD3 LYS 30 3HD LYS 30 17.148 -1.882 -12.496
238 HE2 LYS 30 2HE LYS 30 16.905 0.449 -12.178
239 HE3 LYS 30 3HE LYS 30 18.189 0.493 -10.971
240 HZ1 LYS 30 3HZ LYS 30 18.987 -0.501 -13.569
241 HZ2 LYS 30 1HZ LYS 30 19.770 0.588 -12.538
242 HZ3 LYS 30 2HZ LYS 30 18.525 1.126 -13.547
243 H PHE 31 H PHE 31 19.977 -3.774 -8.340
244 HA PHE 31 HA PHE 31 22.017 -4.227 -10.407
245 HB2 PHE 31 2HB PHE 31 22.818 -3.222 -7.735
246 HB3 PHE 31 3HB PHE 31 23.392 -2.757 -9.333
247 HD1 PHE 31 HD1 PHE 31 22.367 -0.973 -10.551
248 HD2 PHE 31 HD2 PHE 31 20.793 -2.225 -6.799
249 HE1 PHE 31 HE1 PHE 31 20.987 1.062 -10.454
250 HE2 PHE 31 HE2 PHE 31 19.410 -0.192 -6.697
251 HZ PHE 31 HZ PHE 31 19.505 1.454 -8.526
252 H ASP 32 H ASP 32 23.613 -5.750 -10.140
253 HA ASP 32 HA ASP 32 23.098 -7.744 -8.047
254 HB2 ASP 32 2HB ASP 32 24.618 -9.177 -9.557
255 HB3 ASP 32 3HB ASP 32 22.996 -8.806 -10.138
256 H ASN 33 H ASN 33 25.380 -5.411 -9.109
257 HA ASN 33 HA ASN 33 27.344 -6.435 -7.164
258 HB2 ASN 33 2HB ASN 33 27.660 -5.595 -9.923
259 HB3 ASN 33 3HB ASN 33 28.690 -4.654 -8.847
260 HD21 ASN 33 2HD2 ASN 33 30.410 -7.631 -7.670
261 HD22 ASN 33 1HD2 ASN 33 29.577 -6.269 -7.009
262 H LYS 34 H LYS 34 25.182 -3.975 -7.884
263 HA LYS 34 HA LYS 34 26.579 -2.097 -6.093
264 HB2 LYS 34 2HB LYS 34 24.408 -1.346 -8.044
265 HB3 LYS 34 3HB LYS 34 25.526 -0.280 -7.203
266 HG2 LYS 34 2HG LYS 34 26.326 -2.287 -9.300
267 HG3 LYS 34 3HG LYS 34 26.049 -0.569 -9.598
268 HD2 LYS 34 2HD LYS 34 27.923 -1.254 -7.412
269 HD3 LYS 34 3HD LYS 34 28.467 -1.593 -9.056
270 HE2 LYS 34 2HE LYS 34 29.074 0.549 -9.164
271 HE3 LYS 34 3HE LYS 34 27.355 0.934 -9.233
272 HZ1 LYS 34 3HZ LYS 34 29.060 1.829 -7.351
273 HZ2 LYS 34 1HZ LYS 34 28.359 0.504 -6.566
274 HZ3 LYS 34 2HZ LYS 34 27.380 1.746 -7.166
275 H LYS 35 H LYS 35 24.681 -4.396 -5.551
276 HA LYS 35 HA LYS 35 22.213 -3.318 -4.675
277 HB2 LYS 35 2HB LYS 35 21.874 -5.431 -3.563
278 HB3 LYS 35 3HB LYS 35 22.614 -5.731 -5.130
279 HG2 LYS 35 2HG LYS 35 24.815 -5.570 -3.584
280 HG3 LYS 35 3HG LYS 35 23.652 -6.210 -2.421
281 HD2 LYS 35 2HD LYS 35 23.169 -8.081 -3.830
282 HD3 LYS 35 3HD LYS 35 24.105 -7.391 -5.157
283 HE2 LYS 35 2HE LYS 35 25.360 -8.023 -2.505
284 HE3 LYS 35 3HE LYS 35 25.184 -9.251 -3.758
285 HZ1 LYS 35 3HZ LYS 35 26.951 -6.941 -3.659
286 HZ2 LYS 35 1HZ LYS 35 26.286 -7.307 -5.171
287 HZ3 LYS 35 2HZ LYS 35 27.200 -8.467 -4.345
288 H CYS 36 H CYS 36 21.833 -4.127 -2.103
289 HA CYS 36 HA CYS 36 22.651 -1.983 -0.578
290 HB2 CYS 36 2HB CYS 36 21.659 -4.724 0.094
291 HB3 CYS 36 3HB CYS 36 22.249 -3.691 1.392
292 H THR 37 H THR 37 24.558 -1.365 0.169
293 HA THR 37 HA THR 37 26.576 -3.427 0.773
294 HB THR 37 HB THR 37 28.319 -1.767 0.100
295 HG1 THR 37 HG1 THR 37 27.599 0.002 -1.189
296 HG21 THR 37 3HG2 THR 37 26.650 -3.366 -1.554
297 HG22 THR 37 1HG2 THR 37 28.339 -2.925 -1.801
298 HG23 THR 37 2HG2 THR 37 27.056 -1.899 -2.444
299 H LYS 38 H LYS 38 24.781 -2.422 2.673
300 HA LYS 38 HA LYS 38 26.650 -1.342 4.591
301 HB2 LYS 38 2HB LYS 38 24.861 0.401 3.216
302 HB3 LYS 38 3HB LYS 38 24.324 0.276 4.886
303 HG2 LYS 38 2HG LYS 38 27.215 0.719 4.419
304 HG3 LYS 38 3HG LYS 38 26.117 2.062 4.089
305 HD2 LYS 38 2HD LYS 38 25.919 0.542 6.661
306 HD3 LYS 38 3HD LYS 38 27.140 1.802 6.462
307 HE2 LYS 38 2HE LYS 38 25.435 3.438 5.980
308 HE3 LYS 38 3HE LYS 38 24.185 2.195 6.004
309 HZ1 LYS 38 3HZ LYS 38 24.545 1.858 8.330
310 HZ2 LYS 38 1HZ LYS 38 24.312 3.514 8.069
311 HZ3 LYS 38 2HZ LYS 38 25.869 2.912 8.341
312 H ASP 39 H ASP 39 25.911 -1.515 6.767
313 HA ASP 39 HA ASP 39 23.992 -3.658 7.117
314 HB2 ASP 39 2HB ASP 39 24.702 -3.445 9.549
315 HB3 ASP 39 3HB ASP 39 25.967 -3.899 8.410
316 H ASN 40 H ASN 40 21.915 -3.339 7.526
317 HA ASN 40 HA ASN 40 19.951 -2.375 8.145
318 HB2 ASN 40 2HB ASN 40 21.051 -2.414 10.380
319 HB3 ASN 40 3HB ASN 40 21.655 -0.788 10.076
320 HD21 ASN 40 2HD2 ASN 40 18.838 0.628 11.442
321 HD22 ASN 40 1HD2 ASN 40 20.549 0.627 11.201
322 H ASN 41 H ASN 41 21.036 -1.331 5.872
323 HA ASN 41 HA ASN 41 21.145 1.539 5.988
324 HB2 ASN 41 2HB ASN 41 21.284 1.393 3.517
325 HB3 ASN 41 3HB ASN 41 22.466 0.363 4.319
326 HD21 ASN 41 2HD2 ASN 41 21.272 -2.599 2.983
327 HD22 ASN 41 1HD2 ASN 41 22.393 -1.803 4.030
328 H LYS 42 H LYS 42 19.738 2.466 3.896
329 HA LYS 42 HA LYS 42 16.961 2.031 4.748
330 HB2 LYS 42 2HB LYS 42 18.135 4.347 4.794
331 HB3 LYS 42 3HB LYS 42 17.885 4.333 3.053
332 HG2 LYS 42 2HG LYS 42 15.479 3.654 4.534
333 HG3 LYS 42 3HG LYS 42 16.112 5.250 4.942
334 HD2 LYS 42 2HD LYS 42 15.481 6.102 2.976
335 HD3 LYS 42 3HD LYS 42 16.165 4.742 2.083
336 HE2 LYS 42 2HE LYS 42 14.200 3.511 2.207
337 HE3 LYS 42 3HE LYS 42 13.599 4.426 3.588
338 HZ1 LYS 42 3HZ LYS 42 13.826 6.301 1.643
339 HZ2 LYS 42 1HZ LYS 42 12.392 5.523 2.092
340 HZ3 LYS 42 2HZ LYS 42 13.295 4.945 0.783
341 H CYS 43 H CYS 43 15.924 0.619 3.498
342 HA CYS 43 HA CYS 43 15.925 1.041 0.613
343 HB2 CYS 43 2HB CYS 43 16.360 -1.266 0.080
344 HB3 CYS 43 3HB CYS 43 17.672 -0.680 1.097
345 H THR 44 H THR 44 14.000 0.574 -0.353
346 HA THR 44 HA THR 44 11.889 -0.536 1.381
347 HB THR 44 HB THR 44 10.270 0.891 0.190
348 HG1 THR 44 HG1 THR 44 11.227 1.324 -1.749
349 HG21 THR 44 3HG2 THR 44 10.619 2.697 1.535
350 HG22 THR 44 1HG2 THR 44 12.318 2.840 1.089
351 HG23 THR 44 2HG2 THR 44 11.811 1.611 2.247
352 H VAL 45 H VAL 45 11.078 -2.388 0.674
353 HA VAL 45 HA VAL 45 11.635 -3.317 -2.005
354 HB VAL 45 HB VAL 45 10.096 -4.630 0.239
355 HG11 VAL 45 1HG1 VAL 45 9.302 -5.708 -1.647
356 HG12 VAL 45 2HG1 VAL 45 10.829 -5.534 -2.516
357 HG13 VAL 45 3HG1 VAL 45 10.687 -6.705 -1.204
358 HG21 VAL 45 3HG2 VAL 45 12.035 -5.728 0.851
359 HG22 VAL 45 1HG2 VAL 45 12.800 -5.469 -0.716
360 HG23 VAL 45 2HG2 VAL 45 12.646 -4.131 0.423
361 H ASP 46 H ASP 46 10.205 -3.597 -3.652
362 HA ASP 46 HA ASP 46 7.497 -2.514 -3.234
363 HB2 ASP 46 2HB ASP 46 9.506 -1.876 -5.165
364 HB3 ASP 46 3HB ASP 46 8.131 -2.587 -6.005
365 H THR 47 H THR 47 5.900 -3.932 -3.351
366 HA THR 47 HA THR 47 6.387 -6.564 -4.500
367 HB THR 47 HB THR 47 5.319 -6.468 -2.303
368 HG1 THR 47 HG1 THR 47 4.556 -8.252 -3.204
369 HG21 THR 47 3HG2 THR 47 3.963 -4.289 -3.282
370 HG22 THR 47 1HG2 THR 47 3.593 -5.133 -1.779
371 HG23 THR 47 2HG2 THR 47 2.718 -5.538 -3.256
372 H TYR 48 H TYR 48 6.350 -4.661 -6.465
373 HA TYR 48 HA TYR 48 3.767 -5.163 -7.794
374 HB2 TYR 48 2HB TYR 48 4.225 -2.749 -7.130
375 HB3 TYR 48 3HB TYR 48 5.521 -2.764 -8.320
376 HD1 TYR 48 HD1 TYR 48 2.044 -4.133 -8.390
377 HD2 TYR 48 HD2 TYR 48 4.879 -1.479 -10.130
378 HE1 TYR 48 HE1 TYR 48 0.424 -3.567 -10.153
379 HE2 TYR 48 HE2 TYR 48 3.266 -0.905 -11.896
380 HH TYR 48 HH TYR 48 -0.044 -1.893 -11.755
381 H ASN 49 H ASN 49 7.253 -4.871 -8.122
382 HA ASN 49 HA ASN 49 7.208 -6.684 -10.373
383 HB2 ASN 49 2HB ASN 49 8.722 -5.073 -11.697
384 HB3 ASN 49 3HB ASN 49 6.991 -4.748 -11.688
385 HD21 ASN 49 2HD2 ASN 49 9.593 -2.239 -9.802
386 HD22 ASN 49 1HD2 ASN 49 10.061 -3.845 -10.236
387 H ASN 50 H ASN 50 8.248 -6.523 -7.599
388 HA ASN 50 HA ASN 50 10.117 -7.032 -6.400
389 HB2 ASN 50 2HB ASN 50 9.940 -9.040 -7.852
390 HB3 ASN 50 3HB ASN 50 11.010 -8.263 -9.016
391 HD21 ASN 50 2HD2 ASN 50 13.485 -10.136 -7.393
392 HD22 ASN 50 1HD2 ASN 50 12.436 -10.034 -8.762
393 H ALA 51 H ALA 51 10.826 -4.892 -6.100
394 HA ALA 51 HA ALA 51 13.435 -4.367 -7.173
395 HB1 ALA 51 1HB ALA 51 11.478 -2.175 -7.711
396 HB2 ALA 51 2HB ALA 51 13.053 -2.481 -8.445
397 HB3 ALA 51 3HB ALA 51 11.670 -3.489 -8.872
398 H VAL 52 H VAL 52 14.404 -3.994 -5.280
399 HA VAL 52 HA VAL 52 13.054 -2.391 -3.243
400 HB VAL 52 HB VAL 52 14.211 -4.594 -2.707
401 HG11 VAL 52 1HG1 VAL 52 16.248 -3.914 -4.111
402 HG12 VAL 52 2HG1 VAL 52 16.734 -2.972 -2.699
403 HG13 VAL 52 3HG1 VAL 52 16.538 -4.720 -2.570
404 HG21 VAL 52 3HG2 VAL 52 15.055 -2.132 -1.179
405 HG22 VAL 52 1HG2 VAL 52 13.524 -2.989 -0.996
406 HG23 VAL 52 2HG2 VAL 52 15.037 -3.782 -0.555
407 H ASP 53 H ASP 53 13.825 -0.465 -2.469
408 HA ASP 53 HA ASP 53 15.590 0.997 -4.230
409 HB2 ASP 53 2HB ASP 53 13.810 1.694 -1.933
410 HB3 ASP 53 3HB ASP 53 15.097 2.813 -2.373
411 H CYS 54 H CYS 54 17.234 -0.795 -3.415
412 HA CYS 54 HA CYS 54 18.468 -0.519 -0.912
413 HB2 CYS 54 2HB CYS 54 20.425 -1.636 -2.013
414 HB3 CYS 54 3HB CYS 54 18.895 -2.477 -2.235
415 H ASP 55 H ASP 55 20.022 0.797 -0.129
416 HA ASP 55 HA ASP 55 20.440 3.324 -1.208
417 HB2 ASP 55 2HB ASP 55 20.865 3.115 1.089
418 HB3 ASP 55 3HB ASP 55 21.916 1.720 0.862
Start of MODEL 6
1 H1 ALA 1 H ALA 1 1.847 0.664 -3.648
2 HA ALA 1 HA ALA 1 2.033 1.596 -1.579
3 HB1 ALA 1 1HB ALA 1 0.941 -0.568 -0.989
4 HB2 ALA 1 2HB ALA 1 2.540 -1.215 -0.622
5 HB3 ALA 1 3HB ALA 1 1.901 0.138 0.311
6 H LYS 2 H LYS 2 4.572 -0.632 -2.500
7 HA LYS 2 HA LYS 2 6.834 -0.557 -2.269
8 HB2 LYS 2 2HB LYS 2 5.976 2.198 -2.286
9 HB3 LYS 2 3HB LYS 2 7.377 2.005 -1.241
10 HG2 LYS 2 2HG LYS 2 7.588 0.644 -3.829
11 HG3 LYS 2 3HG LYS 2 7.483 2.404 -3.919
12 HD2 LYS 2 2HD LYS 2 9.329 1.263 -1.902
13 HD3 LYS 2 3HD LYS 2 9.796 1.108 -3.597
14 HE2 LYS 2 2HE LYS 2 8.822 3.762 -2.738
15 HE3 LYS 2 3HE LYS 2 10.377 3.252 -2.082
16 HZ1 LYS 2 3HZ LYS 2 11.003 4.269 -4.020
17 HZ2 LYS 2 1HZ LYS 2 9.623 3.782 -4.871
18 HZ3 LYS 2 2HZ LYS 2 10.857 2.670 -4.554
19 H TYR 3 H TYR 3 7.410 -1.877 -0.653
20 HA TYR 3 HA TYR 3 6.869 -1.192 2.108
21 HB2 TYR 3 2HB TYR 3 8.201 -3.581 0.824
22 HB3 TYR 3 3HB TYR 3 7.991 -3.400 2.563
23 HD1 TYR 3 HD1 TYR 3 6.495 -4.500 -0.486
24 HD2 TYR 3 HD2 TYR 3 5.598 -3.133 3.442
25 HE1 TYR 3 HE1 TYR 3 4.250 -5.488 -0.662
26 HE2 TYR 3 HE2 TYR 3 3.351 -4.119 3.278
27 HH TYR 3 HH TYR 3 1.755 -4.776 1.501
28 H THR 4 H THR 4 8.303 -0.479 3.586
29 HA THR 4 HA THR 4 11.004 0.156 2.619
30 HB THR 4 HB THR 4 9.559 1.322 5.006
31 HG1 THR 4 HG1 THR 4 8.737 2.745 3.664
32 HG21 THR 4 3HG2 THR 4 11.341 3.121 4.657
33 HG22 THR 4 1HG2 THR 4 12.175 1.936 3.653
34 HG23 THR 4 2HG2 THR 4 11.872 1.592 5.356
35 H GLY 5 H GLY 5 12.747 -0.782 3.491
36 HA2 GLY 5 2HA GLY 5 12.665 -1.855 6.189
37 HA3 GLY 5 3HA GLY 5 12.836 -3.052 4.913
38 H LYS 6 H LYS 6 14.876 -3.591 5.900
39 HA LYS 6 HA LYS 6 17.027 -1.898 4.873
40 HB2 LYS 6 2HB LYS 6 17.216 -3.050 7.648
41 HB3 LYS 6 3HB LYS 6 18.238 -1.830 6.899
42 HG2 LYS 6 2HG LYS 6 16.994 -0.482 8.227
43 HG3 LYS 6 3HG LYS 6 15.944 -0.504 6.808
44 HD2 LYS 6 2HD LYS 6 14.402 -1.891 7.806
45 HD3 LYS 6 3HD LYS 6 15.590 -2.598 8.904
46 HE2 LYS 6 2HE LYS 6 15.522 0.101 9.576
47 HE3 LYS 6 3HE LYS 6 13.836 -0.327 9.285
48 HZ1 LYS 6 3HZ LYS 6 15.632 -1.892 11.052
49 HZ2 LYS 6 1HZ LYS 6 13.953 -2.039 10.899
50 HZ3 LYS 6 2HZ LYS 6 14.620 -0.658 11.612
51 H CYS 7 H CYS 7 19.087 -3.022 4.710
52 HA CYS 7 HA CYS 7 18.727 -5.937 4.468
53 HB2 CYS 7 2HB CYS 7 20.927 -4.735 2.937
54 HB3 CYS 7 3HB CYS 7 19.716 -5.912 2.437
55 H THR 8 H THR 8 21.325 -6.696 4.069
56 HA THR 8 HA THR 8 22.802 -5.735 6.417
57 HB THR 8 HB THR 8 23.038 -8.628 5.989
58 HG1 THR 8 HG1 THR 8 20.942 -8.822 7.254
59 HG21 THR 8 3HG2 THR 8 22.651 -6.783 8.334
60 HG22 THR 8 1HG2 THR 8 24.085 -7.709 7.895
61 HG23 THR 8 2HG2 THR 8 22.654 -8.538 8.508
62 H LYS 9 H LYS 9 24.860 -5.315 5.961
63 HA LYS 9 HA LYS 9 25.951 -5.618 3.399
64 HB2 LYS 9 2HB LYS 9 28.139 -5.066 4.552
65 HB3 LYS 9 3HB LYS 9 26.836 -3.906 4.780
66 HG2 LYS 9 2HG LYS 9 26.819 -4.201 6.986
67 HG3 LYS 9 3HG LYS 9 26.887 -5.959 6.840
68 HD2 LYS 9 2HD LYS 9 28.918 -5.613 7.808
69 HD3 LYS 9 3HD LYS 9 29.390 -5.403 6.120
70 HE2 LYS 9 2HE LYS 9 28.558 -2.890 6.807
71 HE3 LYS 9 3HE LYS 9 29.288 -3.460 8.307
72 HZ1 LYS 9 3HZ LYS 9 31.313 -3.267 7.446
73 HZ2 LYS 9 1HZ LYS 9 30.614 -2.417 6.161
74 HZ3 LYS 9 2HZ LYS 9 30.889 -4.080 6.024
75 H SER 10 H SER 10 25.650 -7.853 5.949
76 HA SER 10 HA SER 10 27.846 -9.472 5.817
77 HB2 SER 10 2HB SER 10 25.456 -9.686 7.039
78 HB3 SER 10 3HB SER 10 25.241 -10.894 5.773
79 HG SER 10 HG SER 10 26.183 -11.972 7.424
80 H LYS 11 H LYS 11 24.938 -9.866 3.787
81 HA LYS 11 HA LYS 11 26.596 -10.661 1.542
82 HB2 LYS 11 2HB LYS 11 25.414 -12.616 3.212
83 HB3 LYS 11 3HB LYS 11 24.477 -12.589 1.723
84 HG2 LYS 11 2HG LYS 11 27.449 -12.666 1.558
85 HG3 LYS 11 3HG LYS 11 26.567 -14.139 1.967
86 HD2 LYS 11 2HD LYS 11 25.350 -14.075 -0.075
87 HD3 LYS 11 3HD LYS 11 25.915 -12.442 -0.435
88 HE2 LYS 11 2HE LYS 11 27.844 -14.716 -0.121
89 HE3 LYS 11 3HE LYS 11 27.015 -14.433 -1.651
90 HZ1 LYS 11 3HZ LYS 11 28.541 -12.306 -0.272
91 HZ2 LYS 11 1HZ LYS 11 28.022 -12.346 -1.881
92 HZ3 LYS 11 2HZ LYS 11 29.269 -13.367 -1.370
93 H ASN 12 H ASN 12 24.556 -8.585 2.413
94 HA ASN 12 HA ASN 12 22.940 -7.329 1.422
95 HB2 ASN 12 2HB ASN 12 23.849 -7.082 -0.640
96 HB3 ASN 12 3HB ASN 12 24.167 -8.805 -0.816
97 HD21 ASN 12 2HD2 ASN 12 20.744 -7.147 -2.238
98 HD22 ASN 12 1HD2 ASN 12 21.805 -6.273 -1.192
99 H GLU 13 H GLU 13 20.976 -7.646 2.233
100 HA GLU 13 HA GLU 13 19.169 -9.494 0.995
101 HB2 GLU 13 2HB GLU 13 20.610 -10.371 3.296
102 HB3 GLU 13 3HB GLU 13 18.928 -10.144 3.755
103 HG2 GLU 13 2HG GLU 13 18.168 -11.736 2.242
104 HG3 GLU 13 3HG GLU 13 19.652 -11.679 1.293
105 H CYS 14 H CYS 14 18.085 -7.513 0.612
106 HA CYS 14 HA CYS 14 17.283 -5.747 2.672
107 HB2 CYS 14 2HB CYS 14 17.382 -5.137 0.263
108 HB3 CYS 14 3HB CYS 14 15.992 -6.177 -0.030
109 H LYS 15 H LYS 15 15.922 -6.184 4.263
110 HA LYS 15 HA LYS 15 13.949 -8.304 3.967
111 HB2 LYS 15 2HB LYS 15 15.437 -8.029 6.010
112 HB3 LYS 15 3HB LYS 15 14.467 -6.619 6.416
113 HG2 LYS 15 2HG LYS 15 13.068 -9.189 5.896
114 HG3 LYS 15 3HG LYS 15 13.941 -8.994 7.418
115 HD2 LYS 15 2HD LYS 15 12.229 -6.726 6.651
116 HD3 LYS 15 3HD LYS 15 11.373 -8.225 7.018
117 HE2 LYS 15 2HE LYS 15 13.517 -7.384 8.885
118 HE3 LYS 15 3HE LYS 15 12.026 -6.443 8.890
119 HZ1 LYS 15 3HZ LYS 15 12.302 -9.357 9.380
120 HZ2 LYS 15 1HZ LYS 15 10.816 -8.570 9.196
121 HZ3 LYS 15 2HZ LYS 15 11.828 -8.173 10.492
122 H TYR 16 H TYR 16 11.725 -8.024 4.303
123 HA TYR 16 HA TYR 16 10.566 -5.458 4.773
124 HB2 TYR 16 2HB TYR 16 9.659 -4.971 2.644
125 HB3 TYR 16 3HB TYR 16 11.351 -5.354 2.347
126 HD1 TYR 16 HD1 TYR 16 7.989 -6.072 1.451
127 HD2 TYR 16 HD2 TYR 16 11.880 -7.784 1.630
128 HE1 TYR 16 HE1 TYR 16 7.307 -7.777 -0.185
129 HE2 TYR 16 HE2 TYR 16 11.209 -9.494 -0.005
130 HH TYR 16 HH TYR 16 9.621 -10.119 -1.469
131 H LYS 17 H LYS 17 8.079 -5.706 3.833
132 HA LYS 17 HA LYS 17 7.153 -8.337 4.785
133 HB2 LYS 17 2HB LYS 17 5.178 -7.149 5.749
134 HB3 LYS 17 3HB LYS 17 6.702 -6.754 6.533
135 HG2 LYS 17 2HG LYS 17 6.749 -4.732 4.942
136 HG3 LYS 17 3HG LYS 17 5.033 -5.072 4.707
137 HD2 LYS 17 2HD LYS 17 4.663 -3.851 6.537
138 HD3 LYS 17 3HD LYS 17 5.373 -5.180 7.457
139 HE2 LYS 17 2HE LYS 17 7.190 -3.171 6.221
140 HE3 LYS 17 3HE LYS 17 6.286 -2.711 7.663
141 HZ1 LYS 17 3HZ LYS 17 7.575 -3.973 8.949
142 HZ2 LYS 17 1HZ LYS 17 8.651 -4.029 7.645
143 HZ3 LYS 17 2HZ LYS 17 7.543 -5.284 7.880
144 H ASN 18 H ASN 18 5.394 -9.241 3.748
145 HA ASN 18 HA ASN 18 4.468 -7.828 1.333
146 HB2 ASN 18 2HB ASN 18 4.066 -10.532 0.846
147 HB3 ASN 18 3HB ASN 18 5.359 -9.538 0.182
148 HD21 ASN 18 2HD2 ASN 18 6.144 -12.474 2.800
149 HD22 ASN 18 1HD2 ASN 18 4.558 -12.138 2.201
150 H ASP 19 H ASP 19 3.448 -10.814 2.969
151 HA ASP 19 HA ASP 19 0.721 -10.454 2.532
152 HB2 ASP 19 2HB ASP 19 2.257 -12.060 4.563
153 HB3 ASP 19 3HB ASP 19 0.496 -12.059 4.537
154 H ALA 20 H ALA 20 2.132 -10.343 5.793
155 HA ALA 20 HA ALA 20 1.033 -7.754 6.360
156 HB1 ALA 20 1HB ALA 20 -0.974 -9.225 6.478
157 HB2 ALA 20 2HB ALA 20 -0.199 -10.094 7.803
158 HB3 ALA 20 3HB ALA 20 -0.605 -8.388 7.986
159 H GLY 21 H GLY 21 3.594 -8.358 6.545
160 HA2 GLY 21 2HA GLY 21 5.017 -7.637 8.393
161 HA3 GLY 21 3HA GLY 21 4.046 -8.652 9.449
162 H LYS 22 H LYS 22 4.198 -10.551 6.915
163 HA LYS 22 HA LYS 22 5.947 -12.413 7.963
164 HB2 LYS 22 2HB LYS 22 5.077 -11.964 5.107
165 HB3 LYS 22 3HB LYS 22 6.003 -13.368 5.622
166 HG2 LYS 22 2HG LYS 22 3.330 -12.617 6.779
167 HG3 LYS 22 3HG LYS 22 3.542 -13.736 5.431
168 HD2 LYS 22 2HD LYS 22 3.738 -15.346 6.964
169 HD3 LYS 22 3HD LYS 22 5.319 -14.658 7.342
170 HE2 LYS 22 2HE LYS 22 4.553 -13.584 9.221
171 HE3 LYS 22 3HE LYS 22 2.902 -13.471 8.613
172 HZ1 LYS 22 3HZ LYS 22 3.930 -16.147 9.133
173 HZ2 LYS 22 1HZ LYS 22 2.380 -15.515 9.381
174 HZ3 LYS 22 2HZ LYS 22 3.617 -15.182 10.486
175 H ASP 23 H ASP 23 8.000 -11.963 8.479
176 HA ASP 23 HA ASP 23 9.680 -10.122 7.240
177 HB2 ASP 23 2HB ASP 23 11.542 -11.422 8.343
178 HB3 ASP 23 3HB ASP 23 10.244 -10.915 9.421
179 H THR 24 H THR 24 9.902 -10.208 5.066
180 HA THR 24 HA THR 24 10.954 -12.712 3.918
181 HB THR 24 HB THR 24 9.365 -10.549 2.523
182 HG1 THR 24 HG1 THR 24 8.668 -13.259 3.065
183 HG21 THR 24 3HG2 THR 24 10.188 -11.344 0.613
184 HG22 THR 24 1HG2 THR 24 9.516 -12.928 1.001
185 HG23 THR 24 2HG2 THR 24 11.160 -12.522 1.495
186 H PHE 25 H PHE 25 12.995 -12.636 3.271
187 HA PHE 25 HA PHE 25 14.270 -10.027 2.898
188 HB2 PHE 25 2HB PHE 25 15.481 -12.782 3.208
189 HB3 PHE 25 3HB PHE 25 16.396 -11.287 3.048
190 HD1 PHE 25 HD1 PHE 25 14.017 -13.108 5.212
191 HD2 PHE 25 HD2 PHE 25 16.813 -9.914 4.908
192 HE1 PHE 25 HE1 PHE 25 13.925 -12.800 7.652
193 HE2 PHE 25 HE2 PHE 25 16.727 -9.602 7.347
194 HZ PHE 25 HZ PHE 25 15.283 -11.046 8.722
195 H ILE 26 H ILE 26 15.223 -9.401 1.013
196 HA ILE 26 HA ILE 26 15.324 -11.275 -1.225
197 HB ILE 26 HB ILE 26 13.143 -10.240 -1.477
198 HG12 ILE 26 2HG1 ILE 26 13.436 -9.256 -3.721
199 HG13 ILE 26 3HG1 ILE 26 15.163 -9.098 -3.420
200 HG21 ILE 26 1HG2 ILE 26 12.731 -8.143 -0.881
201 HG22 ILE 26 2HG2 ILE 26 14.427 -7.969 -0.434
202 HG23 ILE 26 3HG2 ILE 26 13.896 -7.541 -2.060
203 HD11 ILE 26 3HD1 ILE 26 14.036 -11.165 -4.715
204 HD12 ILE 26 1HD1 ILE 26 15.561 -11.265 -3.836
205 HD13 ILE 26 2HD1 ILE 26 14.065 -11.799 -3.070
206 H LYS 27 H LYS 27 17.196 -11.088 -2.252
207 HA LYS 27 HA LYS 27 19.162 -9.222 -1.559
208 HB2 LYS 27 2HB LYS 27 18.967 -10.845 -4.104
209 HB3 LYS 27 3HB LYS 27 20.424 -10.093 -3.467
210 HG2 LYS 27 2HG LYS 27 20.843 -12.028 -2.468
211 HG3 LYS 27 3HG LYS 27 19.513 -11.649 -1.370
212 HD2 LYS 27 2HD LYS 27 18.979 -13.774 -2.170
213 HD3 LYS 27 3HD LYS 27 18.005 -12.697 -3.173
214 HE2 LYS 27 2HE LYS 27 18.944 -14.217 -4.685
215 HE3 LYS 27 3HE LYS 27 19.947 -12.774 -4.830
216 HZ1 LYS 27 3HZ LYS 27 20.606 -15.392 -3.714
217 HZ2 LYS 27 1HZ LYS 27 21.311 -14.039 -2.982
218 HZ3 LYS 27 2HZ LYS 27 21.559 -14.335 -4.628
219 H CYS 28 H CYS 28 20.310 -8.186 -3.767
220 HA CYS 28 HA CYS 28 18.310 -6.229 -4.680
221 HB2 CYS 28 2HB CYS 28 20.235 -5.381 -3.309
222 HB3 CYS 28 3HB CYS 28 21.314 -5.895 -4.602
223 HA PRO 29 HA PRO 29 19.273 -8.600 -8.490
224 HB2 PRO 29 2HB PRO 29 16.802 -8.272 -9.565
225 HB3 PRO 29 3HB PRO 29 17.185 -9.554 -8.411
226 HG2 PRO 29 2HG PRO 29 15.853 -6.915 -7.938
227 HG3 PRO 29 3HG PRO 29 15.431 -8.513 -7.293
228 HD2 PRO 29 2HD PRO 29 16.799 -6.674 -5.850
229 HD3 PRO 29 3HD PRO 29 17.054 -8.421 -5.659
230 H LYS 30 H LYS 30 18.185 -5.398 -7.820
231 HA LYS 30 HA LYS 30 18.024 -4.344 -10.416
232 HB2 LYS 30 2HB LYS 30 18.030 -3.340 -7.717
233 HB3 LYS 30 3HB LYS 30 19.036 -2.319 -8.736
234 HG2 LYS 30 2HG LYS 30 17.089 -2.228 -10.345
235 HG3 LYS 30 3HG LYS 30 16.123 -2.970 -9.067
236 HD2 LYS 30 2HD LYS 30 17.141 -1.012 -7.627
237 HD3 LYS 30 3HD LYS 30 17.330 -0.249 -9.207
238 HE2 LYS 30 2HE LYS 30 14.722 -1.457 -8.342
239 HE3 LYS 30 3HE LYS 30 15.164 0.192 -7.903
240 HZ1 LYS 30 3HZ LYS 30 15.550 -0.354 -10.688
241 HZ2 LYS 30 1HZ LYS 30 14.712 0.913 -9.944
242 HZ3 LYS 30 2HZ LYS 30 13.942 -0.569 -10.209
243 H PHE 31 H PHE 31 20.696 -3.843 -8.104
244 HA PHE 31 HA PHE 31 22.551 -3.893 -10.393
245 HB2 PHE 31 2HB PHE 31 23.497 -2.342 -8.113
246 HB3 PHE 31 3HB PHE 31 23.436 -1.909 -9.818
247 HD1 PHE 31 HD1 PHE 31 21.755 -0.494 -10.657
248 HD2 PHE 31 HD2 PHE 31 21.461 -2.032 -6.699
249 HE1 PHE 31 HE1 PHE 31 19.894 1.050 -10.199
250 HE2 PHE 31 HE2 PHE 31 19.599 -0.492 -6.235
251 HZ PHE 31 HZ PHE 31 18.813 1.052 -7.986
252 H ASP 32 H ASP 32 23.794 -5.632 -10.274
253 HA ASP 32 HA ASP 32 24.191 -7.081 -7.839
254 HB2 ASP 32 2HB ASP 32 25.788 -8.435 -9.300
255 HB3 ASP 32 3HB ASP 32 24.100 -8.397 -9.802
256 H ASN 33 H ASN 33 25.616 -4.338 -9.070
257 HA ASN 33 HA ASN 33 28.153 -4.869 -7.672
258 HB2 ASN 33 2HB ASN 33 28.037 -4.195 -10.210
259 HB3 ASN 33 3HB ASN 33 27.807 -2.573 -9.564
260 HD21 ASN 33 2HD2 ASN 33 31.321 -4.468 -8.650
261 HD22 ASN 33 1HD2 ASN 33 29.834 -5.348 -8.673
262 H LYS 34 H LYS 34 25.289 -2.997 -7.694
263 HA LYS 34 HA LYS 34 26.398 -1.238 -5.605
264 HB2 LYS 34 2HB LYS 34 23.993 -0.588 -7.301
265 HB3 LYS 34 3HB LYS 34 24.928 0.499 -6.282
266 HG2 LYS 34 2HG LYS 34 25.939 -0.816 -8.795
267 HG3 LYS 34 3HG LYS 34 25.352 0.844 -8.674
268 HD2 LYS 34 2HD LYS 34 27.241 0.605 -6.641
269 HD3 LYS 34 3HD LYS 34 27.947 -0.251 -8.014
270 HE2 LYS 34 2HE LYS 34 28.662 1.958 -8.283
271 HE3 LYS 34 3HE LYS 34 27.298 1.808 -9.390
272 HZ1 LYS 34 3HZ LYS 34 27.525 3.814 -7.712
273 HZ2 LYS 34 1HZ LYS 34 26.729 2.734 -6.681
274 HZ3 LYS 34 2HZ LYS 34 26.017 3.182 -8.148
275 H LYS 35 H LYS 35 25.347 -3.862 -5.153
276 HA LYS 35 HA LYS 35 22.658 -3.690 -4.211
277 HB2 LYS 35 2HB LYS 35 23.141 -5.889 -3.164
278 HB3 LYS 35 3HB LYS 35 23.550 -5.834 -4.873
279 HG2 LYS 35 2HG LYS 35 25.910 -5.112 -3.733
280 HG3 LYS 35 3HG LYS 35 25.263 -6.236 -2.535
281 HD2 LYS 35 2HD LYS 35 25.058 -7.080 -5.358
282 HD3 LYS 35 3HD LYS 35 26.688 -7.007 -4.684
283 HE2 LYS 35 2HE LYS 35 25.610 -8.309 -2.694
284 HE3 LYS 35 3HE LYS 35 24.372 -8.717 -3.881
285 HZ1 LYS 35 3HZ LYS 35 26.223 -10.352 -3.691
286 HZ2 LYS 35 1HZ LYS 35 27.268 -9.180 -4.320
287 HZ3 LYS 35 2HZ LYS 35 25.982 -9.755 -5.255
288 H CYS 36 H CYS 36 22.178 -4.307 -1.857
289 HA CYS 36 HA CYS 36 22.854 -2.234 -0.174
290 HB2 CYS 36 2HB CYS 36 21.703 -4.949 0.227
291 HB3 CYS 36 3HB CYS 36 22.269 -4.093 1.658
292 H THR 37 H THR 37 24.761 -1.659 0.609
293 HA THR 37 HA THR 37 26.640 -3.774 1.439
294 HB THR 37 HB THR 37 28.463 -2.080 0.960
295 HG1 THR 37 HG1 THR 37 27.911 -0.374 -0.421
296 HG21 THR 37 3HG2 THR 37 28.733 -3.404 -0.810
297 HG22 THR 37 1HG2 THR 37 27.605 -2.391 -1.711
298 HG23 THR 37 2HG2 THR 37 27.013 -3.793 -0.820
299 H LYS 38 H LYS 38 24.786 -2.860 3.232
300 HA LYS 38 HA LYS 38 26.478 -1.778 5.285
301 HB2 LYS 38 2HB LYS 38 24.763 -0.009 3.791
302 HB3 LYS 38 3HB LYS 38 24.237 -0.081 5.468
303 HG2 LYS 38 2HG LYS 38 27.133 0.288 4.923
304 HG3 LYS 38 3HG LYS 38 26.045 1.652 4.654
305 HD2 LYS 38 2HD LYS 38 25.425 0.389 7.155
306 HD3 LYS 38 3HD LYS 38 27.147 0.774 7.090
307 HE2 LYS 38 2HE LYS 38 26.158 2.697 7.980
308 HE3 LYS 38 3HE LYS 38 26.410 3.086 6.279
309 HZ1 LYS 38 3HZ LYS 38 24.088 2.529 5.857
310 HZ2 LYS 38 1HZ LYS 38 24.219 3.765 7.005
311 HZ3 LYS 38 2HZ LYS 38 23.854 2.189 7.497
312 H ASP 39 H ASP 39 25.460 -1.817 7.397
313 HA ASP 39 HA ASP 39 23.464 -3.936 7.555
314 HB2 ASP 39 2HB ASP 39 24.003 -3.781 10.045
315 HB3 ASP 39 3HB ASP 39 25.305 -4.323 8.989
316 H ASN 40 H ASN 40 21.383 -3.520 7.836
317 HA ASN 40 HA ASN 40 19.433 -2.491 8.398
318 HB2 ASN 40 2HB ASN 40 21.020 -0.764 10.296
319 HB3 ASN 40 3HB ASN 40 19.326 -1.230 10.414
320 HD21 ASN 40 2HD2 ASN 40 21.757 -3.267 12.561
321 HD22 ASN 40 1HD2 ASN 40 21.772 -1.587 12.158
322 H ASN 41 H ASN 41 20.913 -1.520 6.186
323 HA ASN 41 HA ASN 41 20.943 1.342 6.205
324 HB2 ASN 41 2HB ASN 41 21.403 1.140 3.799
325 HB3 ASN 41 3HB ASN 41 22.437 0.067 4.737
326 HD21 ASN 41 2HD2 ASN 41 21.289 -2.852 3.270
327 HD22 ASN 41 1HD2 ASN 41 22.308 -2.097 4.444
328 H LYS 42 H LYS 42 19.778 2.128 3.881
329 HA LYS 42 HA LYS 42 16.926 1.753 4.473
330 HB2 LYS 42 2HB LYS 42 18.101 4.068 4.470
331 HB3 LYS 42 3HB LYS 42 18.035 3.925 2.718
332 HG2 LYS 42 2HG LYS 42 15.490 3.374 4.042
333 HG3 LYS 42 3HG LYS 42 16.094 5.013 4.293
334 HD2 LYS 42 2HD LYS 42 16.460 5.087 1.771
335 HD3 LYS 42 3HD LYS 42 15.475 3.624 1.698
336 HE2 LYS 42 2HE LYS 42 14.418 5.947 3.221
337 HE3 LYS 42 3HE LYS 42 14.423 6.047 1.461
338 HZ1 LYS 42 3HZ LYS 42 12.753 4.484 3.199
339 HZ2 LYS 42 1HZ LYS 42 13.417 3.580 1.933
340 HZ3 LYS 42 2HZ LYS 42 12.498 4.959 1.596
341 H CYS 43 H CYS 43 16.029 0.236 3.237
342 HA CYS 43 HA CYS 43 16.308 0.453 0.342
343 HB2 CYS 43 2HB CYS 43 16.838 -1.857 0.005
344 HB3 CYS 43 3HB CYS 43 18.007 -1.215 1.155
345 H THR 44 H THR 44 14.503 -0.161 -0.782
346 HA THR 44 HA THR 44 12.208 -1.046 0.843
347 HB THR 44 HB THR 44 10.741 0.144 -0.695
348 HG1 THR 44 HG1 THR 44 11.851 0.108 -2.616
349 HG21 THR 44 3HG2 THR 44 11.087 2.252 0.163
350 HG22 THR 44 1HG2 THR 44 12.833 2.176 -0.062
351 HG23 THR 44 2HG2 THR 44 12.076 1.289 1.261
352 H VAL 45 H VAL 45 10.486 -2.164 -0.469
353 HA VAL 45 HA VAL 45 11.596 -3.733 -2.687
354 HB VAL 45 HB VAL 45 10.074 -4.962 -0.385
355 HG11 VAL 45 1HG1 VAL 45 11.104 -5.988 -2.989
356 HG12 VAL 45 2HG1 VAL 45 11.060 -7.066 -1.592
357 HG13 VAL 45 3HG1 VAL 45 9.574 -6.315 -2.176
358 HG21 VAL 45 3HG2 VAL 45 12.386 -6.184 -0.185
359 HG22 VAL 45 1HG2 VAL 45 12.989 -4.720 -0.962
360 HG23 VAL 45 2HG2 VAL 45 12.133 -4.614 0.576
361 H ASP 46 H ASP 46 10.265 -3.768 -4.370
362 HA ASP 46 HA ASP 46 7.497 -2.900 -3.997
363 HB2 ASP 46 2HB ASP 46 9.476 -2.497 -6.026
364 HB3 ASP 46 3HB ASP 46 8.081 -3.296 -6.746
365 H THR 47 H THR 47 5.875 -4.300 -4.004
366 HA THR 47 HA THR 47 6.379 -7.039 -4.919
367 HB THR 47 HB THR 47 5.520 -6.696 -2.602
368 HG1 THR 47 HG1 THR 47 3.708 -8.064 -4.329
369 HG21 THR 47 3HG2 THR 47 3.157 -6.099 -2.306
370 HG22 THR 47 1HG2 THR 47 3.025 -5.773 -4.034
371 HG23 THR 47 2HG2 THR 47 4.072 -4.774 -3.025
372 H TYR 48 H TYR 48 5.713 -4.648 -6.636
373 HA TYR 48 HA TYR 48 3.339 -5.802 -7.947
374 HB2 TYR 48 2HB TYR 48 3.014 -3.516 -6.877
375 HB3 TYR 48 3HB TYR 48 4.127 -2.892 -8.090
376 HD1 TYR 48 HD1 TYR 48 3.480 -2.809 -10.448
377 HD2 TYR 48 HD2 TYR 48 0.770 -4.183 -7.469
378 HE1 TYR 48 HE1 TYR 48 1.619 -2.563 -12.036
379 HE2 TYR 48 HE2 TYR 48 -1.098 -3.941 -9.050
380 HH TYR 48 HH TYR 48 -1.728 -3.228 -11.062
381 H ASN 49 H ASN 49 6.477 -4.268 -8.333
382 HA ASN 49 HA ASN 49 6.581 -5.328 -11.075
383 HB2 ASN 49 2HB ASN 49 7.507 -3.369 -11.947
384 HB3 ASN 49 3HB ASN 49 6.270 -2.761 -10.851
385 HD21 ASN 49 2HD2 ASN 49 8.584 -1.505 -8.473
386 HD22 ASN 49 1HD2 ASN 49 7.027 -2.237 -8.634
387 H ASN 50 H ASN 50 7.691 -5.859 -8.178
388 HA ASN 50 HA ASN 50 9.598 -6.671 -7.232
389 HB2 ASN 50 2HB ASN 50 9.121 -8.264 -9.203
390 HB3 ASN 50 3HB ASN 50 10.463 -7.455 -10.007
391 HD21 ASN 50 2HD2 ASN 50 12.139 -10.232 -8.547
392 HD22 ASN 50 1HD2 ASN 50 11.212 -9.758 -9.925
393 H ALA 51 H ALA 51 10.162 -4.337 -6.917
394 HA ALA 51 HA ALA 51 12.746 -3.786 -8.208
395 HB1 ALA 51 1HB ALA 51 12.163 -1.349 -8.130
396 HB2 ALA 51 2HB ALA 51 11.234 -2.300 -9.288
397 HB3 ALA 51 3HB ALA 51 10.507 -1.825 -7.753
398 H VAL 52 H VAL 52 14.348 -3.337 -6.828
399 HA VAL 52 HA VAL 52 13.636 -2.846 -4.012
400 HB VAL 52 HB VAL 52 14.833 -4.957 -4.365
401 HG11 VAL 52 1HG1 VAL 52 16.707 -3.175 -5.823
402 HG12 VAL 52 2HG1 VAL 52 17.387 -4.534 -4.927
403 HG13 VAL 52 3HG1 VAL 52 16.190 -4.820 -6.191
404 HG21 VAL 52 3HG2 VAL 52 15.144 -3.663 -2.281
405 HG22 VAL 52 1HG2 VAL 52 16.551 -4.644 -2.693
406 HG23 VAL 52 2HG2 VAL 52 16.569 -2.906 -2.992
407 H ASP 53 H ASP 53 14.841 -1.334 -2.812
408 HA ASP 53 HA ASP 53 16.307 0.622 -4.460
409 HB2 ASP 53 2HB ASP 53 14.017 1.228 -3.335
410 HB3 ASP 53 3HB ASP 53 14.991 1.372 -1.874
411 H CYS 54 H CYS 54 17.749 -1.456 -3.500
412 HA CYS 54 HA CYS 54 18.820 -1.238 -0.938
413 HB2 CYS 54 2HB CYS 54 20.833 -2.395 -1.937
414 HB3 CYS 54 3HB CYS 54 19.291 -3.199 -2.210
415 H ASP 55 H ASP 55 20.424 -0.052 -0.025
416 HA ASP 55 HA ASP 55 21.082 2.451 -1.188
417 HB2 ASP 55 2HB ASP 55 21.440 1.125 1.364
418 HB3 ASP 55 3HB ASP 55 22.895 2.001 0.896
Start of MODEL 7
1 H1 ALA 1 H ALA 1 2.345 1.165 -3.982
2 HA ALA 1 HA ALA 1 1.697 -0.281 -1.719
3 HB1 ALA 1 1HB ALA 1 1.122 -2.413 -2.328
4 HB2 ALA 1 2HB ALA 1 0.311 -1.489 -3.593
5 HB3 ALA 1 3HB ALA 1 1.855 -2.274 -3.926
6 H LYS 2 H LYS 2 3.672 -0.041 -0.882
7 HA LYS 2 HA LYS 2 5.891 -1.443 -2.119
8 HB2 LYS 2 2HB LYS 2 5.632 1.257 -2.622
9 HB3 LYS 2 3HB LYS 2 6.723 1.223 -1.242
10 HG2 LYS 2 2HG LYS 2 7.438 -0.728 -3.271
11 HG3 LYS 2 3HG LYS 2 7.425 0.927 -3.886
12 HD2 LYS 2 2HD LYS 2 8.734 0.416 -1.265
13 HD3 LYS 2 3HD LYS 2 9.567 -0.118 -2.727
14 HE2 LYS 2 2HE LYS 2 10.277 1.957 -3.065
15 HE3 LYS 2 3HE LYS 2 8.605 2.497 -3.209
16 HZ1 LYS 2 3HZ LYS 2 8.700 3.470 -1.228
17 HZ2 LYS 2 1HZ LYS 2 10.376 3.242 -1.273
18 HZ3 LYS 2 2HZ LYS 2 9.390 2.114 -0.488
19 H TYR 3 H TYR 3 7.631 -1.851 -0.673
20 HA TYR 3 HA TYR 3 6.938 -1.411 2.158
21 HB2 TYR 3 2HB TYR 3 8.465 -3.755 1.011
22 HB3 TYR 3 3HB TYR 3 7.956 -3.547 2.683
23 HD1 TYR 3 HD1 TYR 3 5.322 -3.151 2.946
24 HD2 TYR 3 HD2 TYR 3 7.189 -5.134 -0.323
25 HE1 TYR 3 HE1 TYR 3 3.210 -4.311 2.452
26 HE2 TYR 3 HE2 TYR 3 5.082 -6.299 -0.827
27 HH TYR 3 HH TYR 3 3.012 -6.760 -0.091
28 H THR 4 H THR 4 8.597 -0.935 3.603
29 HA THR 4 HA THR 4 11.178 -0.217 2.373
30 HB THR 4 HB THR 4 9.715 1.278 4.557
31 HG1 THR 4 HG1 THR 4 9.888 2.961 2.838
32 HG21 THR 4 3HG2 THR 4 12.456 1.615 3.364
33 HG22 THR 4 1HG2 THR 4 12.009 1.476 5.064
34 HG23 THR 4 2HG2 THR 4 11.611 2.940 4.164
35 H GLY 5 H GLY 5 13.005 -0.837 3.414
36 HA2 GLY 5 2HA GLY 5 12.976 -1.619 6.191
37 HA3 GLY 5 3HA GLY 5 13.135 -2.972 5.082
38 H LYS 6 H LYS 6 15.205 -3.410 5.979
39 HA LYS 6 HA LYS 6 17.301 -1.718 4.819
40 HB2 LYS 6 2HB LYS 6 17.607 -2.903 7.569
41 HB3 LYS 6 3HB LYS 6 18.593 -1.668 6.796
42 HG2 LYS 6 2HG LYS 6 17.395 -0.348 8.193
43 HG3 LYS 6 3HG LYS 6 16.295 -0.351 6.812
44 HD2 LYS 6 2HD LYS 6 14.728 -1.050 8.242
45 HD3 LYS 6 3HD LYS 6 15.560 -2.607 8.223
46 HE2 LYS 6 2HE LYS 6 16.918 -1.892 10.136
47 HE3 LYS 6 3HE LYS 6 16.072 -0.346 10.156
48 HZ1 LYS 6 3HZ LYS 6 15.336 -2.334 11.683
49 HZ2 LYS 6 1HZ LYS 6 14.465 -2.786 10.305
50 HZ3 LYS 6 2HZ LYS 6 14.200 -1.274 11.015
51 H CYS 7 H CYS 7 19.251 -2.804 4.330
52 HA CYS 7 HA CYS 7 18.938 -5.724 4.138
53 HB2 CYS 7 2HB CYS 7 21.062 -4.493 2.531
54 HB3 CYS 7 3HB CYS 7 19.815 -5.644 2.060
55 H THR 8 H THR 8 21.499 -6.489 3.618
56 HA THR 8 HA THR 8 23.134 -5.524 5.850
57 HB THR 8 HB THR 8 23.204 -8.447 5.532
58 HG1 THR 8 HG1 THR 8 21.204 -8.855 6.190
59 HG21 THR 8 3HG2 THR 8 23.013 -6.558 7.879
60 HG22 THR 8 1HG2 THR 8 24.461 -7.367 7.280
61 HG23 THR 8 2HG2 THR 8 23.166 -8.309 8.021
62 H LYS 9 H LYS 9 25.145 -5.158 5.200
63 HA LYS 9 HA LYS 9 26.050 -5.696 2.599
64 HB2 LYS 9 2HB LYS 9 28.151 -4.796 3.292
65 HB3 LYS 9 3HB LYS 9 26.896 -3.890 4.127
66 HG2 LYS 9 2HG LYS 9 28.173 -4.246 5.930
67 HG3 LYS 9 3HG LYS 9 27.404 -5.835 5.938
68 HD2 LYS 9 2HD LYS 9 29.364 -6.455 4.315
69 HD3 LYS 9 3HD LYS 9 30.144 -5.051 5.045
70 HE2 LYS 9 2HE LYS 9 30.003 -6.008 7.221
71 HE3 LYS 9 3HE LYS 9 28.954 -7.304 6.649
72 HZ1 LYS 9 3HZ LYS 9 31.827 -6.913 6.024
73 HZ2 LYS 9 1HZ LYS 9 30.845 -8.043 5.236
74 HZ3 LYS 9 2HZ LYS 9 31.129 -8.183 6.897
75 H SER 10 H SER 10 25.918 -7.682 5.360
76 HA SER 10 HA SER 10 28.119 -9.332 5.135
77 HB2 SER 10 2HB SER 10 25.285 -9.881 5.994
78 HB3 SER 10 3HB SER 10 26.511 -11.149 6.014
79 HG SER 10 HG SER 10 26.365 -10.063 8.023
80 H LYS 11 H LYS 11 24.943 -10.435 3.993
81 HA LYS 11 HA LYS 11 26.263 -11.499 1.584
82 HB2 LYS 11 2HB LYS 11 25.351 -13.077 3.580
83 HB3 LYS 11 3HB LYS 11 23.889 -12.938 2.612
84 HG2 LYS 11 2HG LYS 11 24.972 -13.864 0.704
85 HG3 LYS 11 3HG LYS 11 26.549 -13.791 1.494
86 HD2 LYS 11 2HD LYS 11 25.498 -15.331 3.267
87 HD3 LYS 11 3HD LYS 11 24.237 -15.618 2.065
88 HE2 LYS 11 2HE LYS 11 25.640 -16.758 0.667
89 HE3 LYS 11 3HE LYS 11 27.068 -15.873 1.202
90 HZ1 LYS 11 3HZ LYS 11 27.449 -17.319 2.865
91 HZ2 LYS 11 1HZ LYS 11 26.547 -18.381 1.905
92 HZ3 LYS 11 2HZ LYS 11 25.809 -17.571 3.193
93 H ASN 12 H ASN 12 24.384 -9.134 2.446
94 HA ASN 12 HA ASN 12 22.845 -7.838 1.382
95 HB2 ASN 12 2HB ASN 12 24.206 -9.056 -0.661
96 HB3 ASN 12 3HB ASN 12 22.544 -9.524 -1.009
97 HD21 ASN 12 2HD2 ASN 12 22.326 -6.542 -2.780
98 HD22 ASN 12 1HD2 ASN 12 22.386 -8.268 -2.831
99 H GLU 13 H GLU 13 20.781 -7.773 1.955
100 HA GLU 13 HA GLU 13 18.787 -9.520 1.094
101 HB2 GLU 13 2HB GLU 13 20.305 -10.743 3.045
102 HB3 GLU 13 3HB GLU 13 18.955 -10.085 3.959
103 HG2 GLU 13 2HG GLU 13 17.432 -11.199 2.292
104 HG3 GLU 13 3HG GLU 13 18.859 -12.023 1.667
105 H CYS 14 H CYS 14 17.670 -7.611 0.817
106 HA CYS 14 HA CYS 14 17.280 -5.744 2.955
107 HB2 CYS 14 2HB CYS 14 17.283 -5.096 0.550
108 HB3 CYS 14 3HB CYS 14 15.772 -5.976 0.343
109 H LYS 15 H LYS 15 15.908 -5.962 4.582
110 HA LYS 15 HA LYS 15 13.887 -8.022 4.549
111 HB2 LYS 15 2HB LYS 15 15.320 -7.427 6.551
112 HB3 LYS 15 3HB LYS 15 14.367 -5.956 6.697
113 HG2 LYS 15 2HG LYS 15 12.778 -8.408 6.522
114 HG3 LYS 15 3HG LYS 15 13.817 -8.303 7.945
115 HD2 LYS 15 2HD LYS 15 12.025 -6.040 7.107
116 HD3 LYS 15 3HD LYS 15 11.456 -7.350 8.144
117 HE2 LYS 15 2HE LYS 15 13.714 -6.714 9.437
118 HE3 LYS 15 3HE LYS 15 13.346 -5.147 8.718
119 HZ1 LYS 15 3HZ LYS 15 11.715 -4.825 10.169
120 HZ2 LYS 15 1HZ LYS 15 12.272 -6.179 11.016
121 HZ3 LYS 15 2HZ LYS 15 11.034 -6.345 9.876
122 H TYR 16 H TYR 16 11.641 -7.600 5.138
123 HA TYR 16 HA TYR 16 10.478 -5.039 5.043
124 HB2 TYR 16 2HB TYR 16 9.544 -4.937 2.861
125 HB3 TYR 16 3HB TYR 16 11.252 -5.303 2.639
126 HD1 TYR 16 HD1 TYR 16 7.930 -6.270 1.843
127 HD2 TYR 16 HD2 TYR 16 11.869 -7.801 2.338
128 HE1 TYR 16 HE1 TYR 16 7.326 -8.241 0.502
129 HE2 TYR 16 HE2 TYR 16 11.276 -9.776 0.998
130 HH TYR 16 HH TYR 16 9.710 -10.775 -0.215
131 H LYS 17 H LYS 17 7.996 -5.524 4.041
132 HA LYS 17 HA LYS 17 7.079 -7.892 5.536
133 HB2 LYS 17 2HB LYS 17 5.022 -6.565 6.078
134 HB3 LYS 17 3HB LYS 17 6.493 -5.971 6.839
135 HG2 LYS 17 2HG LYS 17 6.643 -4.338 4.889
136 HG3 LYS 17 3HG LYS 17 4.974 -4.794 4.537
137 HD2 LYS 17 2HD LYS 17 5.461 -4.141 7.348
138 HD3 LYS 17 3HD LYS 17 5.746 -2.796 6.241
139 HE2 LYS 17 2HE LYS 17 3.562 -2.573 5.762
140 HE3 LYS 17 3HE LYS 17 3.300 -4.315 5.695
141 HZ1 LYS 17 3HZ LYS 17 2.088 -3.196 7.514
142 HZ2 LYS 17 1HZ LYS 17 3.567 -2.765 8.212
143 HZ3 LYS 17 2HZ LYS 17 3.145 -4.396 8.066
144 H ASN 18 H ASN 18 5.624 -9.195 4.555
145 HA ASN 18 HA ASN 18 4.371 -8.272 2.067
146 HB2 ASN 18 2HB ASN 18 5.164 -10.004 0.778
147 HB3 ASN 18 3HB ASN 18 6.541 -9.780 1.854
148 HD21 ASN 18 2HD2 ASN 18 5.578 -12.682 3.849
149 HD22 ASN 18 1HD2 ASN 18 5.901 -11.003 4.104
150 H ASP 19 H ASP 19 2.593 -9.729 1.357
151 HA ASP 19 HA ASP 19 0.679 -10.914 1.721
152 HB2 ASP 19 2HB ASP 19 2.583 -12.155 3.432
153 HB3 ASP 19 3HB ASP 19 1.074 -12.011 4.330
154 H ALA 20 H ALA 20 1.617 -10.079 5.054
155 HA ALA 20 HA ALA 20 -0.244 -7.911 5.216
156 HB1 ALA 20 1HB ALA 20 -1.771 -8.885 6.835
157 HB2 ALA 20 2HB ALA 20 -1.805 -9.801 5.328
158 HB3 ALA 20 3HB ALA 20 -0.930 -10.432 6.723
159 H GLY 21 H GLY 21 2.559 -8.414 5.757
160 HA2 GLY 21 2HA GLY 21 3.667 -7.040 7.466
161 HA3 GLY 21 3HA GLY 21 2.581 -7.770 8.640
162 H LYS 22 H LYS 22 3.518 -10.073 6.418
163 HA LYS 22 HA LYS 22 5.039 -11.522 8.328
164 HB2 LYS 22 2HB LYS 22 3.950 -11.969 5.680
165 HB3 LYS 22 3HB LYS 22 5.570 -12.639 5.819
166 HG2 LYS 22 2HG LYS 22 4.447 -13.500 8.133
167 HG3 LYS 22 3HG LYS 22 3.055 -13.505 7.048
168 HD2 LYS 22 2HD LYS 22 3.948 -15.630 6.758
169 HD3 LYS 22 3HD LYS 22 4.638 -14.728 5.407
170 HE2 LYS 22 2HE LYS 22 6.436 -14.338 7.483
171 HE3 LYS 22 3HE LYS 22 5.953 -16.025 7.643
172 HZ1 LYS 22 3HZ LYS 22 7.788 -14.979 5.868
173 HZ2 LYS 22 1HZ LYS 22 6.441 -15.385 4.928
174 HZ3 LYS 22 2HZ LYS 22 7.181 -16.558 5.896
175 H ASP 23 H ASP 23 7.156 -11.529 8.730
176 HA ASP 23 HA ASP 23 8.879 -9.632 7.508
177 HB2 ASP 23 2HB ASP 23 9.620 -11.971 9.278
178 HB3 ASP 23 3HB ASP 23 10.614 -10.555 8.946
179 H THR 24 H THR 24 9.769 -9.813 5.571
180 HA THR 24 HA THR 24 10.758 -12.446 4.710
181 HB THR 24 HB THR 24 9.307 -10.467 2.940
182 HG1 THR 24 HG1 THR 24 8.585 -12.977 4.058
183 HG21 THR 24 3HG2 THR 24 9.534 -12.184 1.203
184 HG22 THR 24 1HG2 THR 24 10.490 -13.174 2.305
185 HG23 THR 24 2HG2 THR 24 11.110 -11.617 1.755
186 H PHE 25 H PHE 25 12.635 -12.442 3.484
187 HA PHE 25 HA PHE 25 14.010 -9.843 3.298
188 HB2 PHE 25 2HB PHE 25 15.342 -12.532 3.644
189 HB3 PHE 25 3HB PHE 25 16.096 -10.945 3.749
190 HD1 PHE 25 HD1 PHE 25 13.802 -13.291 5.422
191 HD2 PHE 25 HD2 PHE 25 16.034 -9.681 5.753
192 HE1 PHE 25 HE1 PHE 25 13.393 -13.265 7.848
193 HE2 PHE 25 HE2 PHE 25 15.629 -9.650 8.180
194 HZ PHE 25 HZ PHE 25 14.308 -11.444 9.231
195 H ILE 26 H ILE 26 14.935 -9.279 1.400
196 HA ILE 26 HA ILE 26 15.143 -11.281 -0.727
197 HB ILE 26 HB ILE 26 12.972 -10.197 -1.061
198 HG12 ILE 26 2HG1 ILE 26 13.314 -9.477 -3.383
199 HG13 ILE 26 3HG1 ILE 26 15.039 -9.298 -3.082
200 HG21 ILE 26 1HG2 ILE 26 13.598 -8.063 0.069
201 HG22 ILE 26 2HG2 ILE 26 14.492 -7.617 -1.383
202 HG23 ILE 26 3HG2 ILE 26 12.745 -7.850 -1.460
203 HD11 ILE 26 3HD1 ILE 26 15.427 -11.494 -3.288
204 HD12 ILE 26 1HD1 ILE 26 13.935 -11.944 -2.463
205 HD13 ILE 26 2HD1 ILE 26 13.898 -11.484 -4.166
206 H LYS 27 H LYS 27 17.011 -11.136 -1.782
207 HA LYS 27 HA LYS 27 19.008 -9.300 -1.083
208 HB2 LYS 27 2HB LYS 27 20.314 -10.263 -2.869
209 HB3 LYS 27 3HB LYS 27 19.418 -11.545 -2.065
210 HG2 LYS 27 2HG LYS 27 18.700 -12.182 -4.059
211 HG3 LYS 27 3HG LYS 27 17.754 -10.694 -4.129
212 HD2 LYS 27 2HD LYS 27 18.951 -10.281 -5.986
213 HD3 LYS 27 3HD LYS 27 20.219 -9.799 -4.855
214 HE2 LYS 27 2HE LYS 27 21.525 -11.434 -5.596
215 HE3 LYS 27 3HE LYS 27 20.303 -12.629 -5.165
216 HZ1 LYS 27 3HZ LYS 27 19.604 -12.803 -7.280
217 HZ2 LYS 27 1HZ LYS 27 21.142 -12.205 -7.654
218 HZ3 LYS 27 2HZ LYS 27 19.814 -11.159 -7.618
219 H CYS 28 H CYS 28 20.197 -8.380 -3.357
220 HA CYS 28 HA CYS 28 18.249 -6.396 -4.331
221 HB2 CYS 28 2HB CYS 28 20.419 -5.800 -2.909
222 HB3 CYS 28 3HB CYS 28 21.181 -5.884 -4.495
223 HA PRO 29 HA PRO 29 19.511 -8.944 -7.996
224 HB2 PRO 29 2HB PRO 29 17.005 -9.116 -9.027
225 HB3 PRO 29 3HB PRO 29 17.627 -10.248 -7.820
226 HG2 PRO 29 2HG PRO 29 15.853 -7.866 -7.446
227 HG3 PRO 29 3HG PRO 29 15.733 -9.476 -6.714
228 HD2 PRO 29 2HD PRO 29 16.772 -7.350 -5.397
229 HD3 PRO 29 3HD PRO 29 17.337 -9.011 -5.125
230 H LYS 30 H LYS 30 17.841 -5.965 -7.470
231 HA LYS 30 HA LYS 30 17.464 -5.091 -10.103
232 HB2 LYS 30 2HB LYS 30 17.172 -4.016 -7.513
233 HB3 LYS 30 3HB LYS 30 18.209 -2.900 -8.391
234 HG2 LYS 30 2HG LYS 30 16.443 -3.012 -10.241
235 HG3 LYS 30 3HG LYS 30 15.401 -3.735 -9.014
236 HD2 LYS 30 2HD LYS 30 16.114 -1.683 -7.582
237 HD3 LYS 30 3HD LYS 30 16.555 -0.976 -9.138
238 HE2 LYS 30 2HE LYS 30 14.430 -0.445 -9.495
239 HE3 LYS 30 3HE LYS 30 13.989 -2.150 -9.415
240 HZ1 LYS 30 3HZ LYS 30 12.957 -0.419 -7.775
241 HZ2 LYS 30 1HZ LYS 30 14.383 -0.688 -6.905
242 HZ3 LYS 30 2HZ LYS 30 13.345 -1.979 -7.248
243 H PHE 31 H PHE 31 20.049 -3.995 -7.901
244 HA PHE 31 HA PHE 31 21.757 -3.592 -10.262
245 HB2 PHE 31 2HB PHE 31 22.541 -2.409 -7.659
246 HB3 PHE 31 3HB PHE 31 22.650 -1.735 -9.282
247 HD1 PHE 31 HD1 PHE 31 20.912 -0.387 -10.180
248 HD2 PHE 31 HD2 PHE 31 20.422 -2.304 -6.412
249 HE1 PHE 31 HE1 PHE 31 18.919 0.988 -9.744
250 HE2 PHE 31 HE2 PHE 31 18.427 -0.933 -5.970
251 HZ PHE 31 HZ PHE 31 17.673 0.715 -7.637
252 H ASP 32 H ASP 32 24.051 -4.045 -10.025
253 HA ASP 32 HA ASP 32 24.548 -6.266 -8.152
254 HB2 ASP 32 2HB ASP 32 24.572 -6.426 -10.873
255 HB3 ASP 32 3HB ASP 32 26.267 -6.081 -10.539
256 H ASN 33 H ASN 33 25.612 -3.214 -9.344
257 HA ASN 33 HA ASN 33 28.081 -3.427 -7.752
258 HB2 ASN 33 2HB ASN 33 27.532 -2.312 -10.377
259 HB3 ASN 33 3HB ASN 33 28.279 -1.123 -9.315
260 HD21 ASN 33 2HD2 ASN 33 31.224 -3.194 -8.836
261 HD22 ASN 33 1HD2 ASN 33 30.055 -2.358 -7.877
262 H LYS 34 H LYS 34 25.042 -1.909 -8.013
263 HA LYS 34 HA LYS 34 25.826 0.098 -6.001
264 HB2 LYS 34 2HB LYS 34 23.445 0.257 -7.852
265 HB3 LYS 34 3HB LYS 34 24.059 1.522 -6.795
266 HG2 LYS 34 2HG LYS 34 25.609 0.374 -9.104
267 HG3 LYS 34 3HG LYS 34 24.599 1.818 -9.211
268 HD2 LYS 34 2HD LYS 34 26.252 2.166 -6.961
269 HD3 LYS 34 3HD LYS 34 27.289 1.551 -8.250
270 HE2 LYS 34 2HE LYS 34 26.836 3.358 -9.642
271 HE3 LYS 34 3HE LYS 34 25.358 3.778 -8.778
272 HZ1 LYS 34 3HZ LYS 34 27.447 5.211 -8.440
273 HZ2 LYS 34 1HZ LYS 34 27.971 3.960 -7.429
274 HZ3 LYS 34 2HZ LYS 34 26.534 4.781 -7.082
275 H LYS 35 H LYS 35 24.895 -2.766 -5.749
276 HA LYS 35 HA LYS 35 22.269 -2.701 -4.645
277 HB2 LYS 35 2HB LYS 35 22.812 -4.967 -3.812
278 HB3 LYS 35 3HB LYS 35 23.168 -4.772 -5.524
279 HG2 LYS 35 2HG LYS 35 25.565 -4.164 -4.570
280 HG3 LYS 35 3HG LYS 35 25.004 -5.171 -3.233
281 HD2 LYS 35 2HD LYS 35 24.407 -6.917 -4.952
282 HD3 LYS 35 3HD LYS 35 25.266 -5.930 -6.137
283 HE2 LYS 35 2HE LYS 35 27.314 -6.393 -5.240
284 HE3 LYS 35 3HE LYS 35 26.675 -6.602 -3.610
285 HZ1 LYS 35 3HZ LYS 35 26.738 -8.534 -5.833
286 HZ2 LYS 35 1HZ LYS 35 25.581 -8.690 -4.608
287 HZ3 LYS 35 2HZ LYS 35 27.228 -8.739 -4.227
288 H CYS 36 H CYS 36 22.273 -3.914 -2.270
289 HA CYS 36 HA CYS 36 22.961 -1.822 -0.472
290 HB2 CYS 36 2HB CYS 36 21.770 -4.554 -0.199
291 HB3 CYS 36 3HB CYS 36 22.338 -3.720 1.244
292 H THR 37 H THR 37 24.939 -1.408 0.232
293 HA THR 37 HA THR 37 26.739 -3.677 0.787
294 HB THR 37 HB THR 37 28.606 -1.952 0.367
295 HG1 THR 37 HG1 THR 37 26.756 -0.278 0.140
296 HG21 THR 37 3HG2 THR 37 28.647 -3.577 -1.228
297 HG22 THR 37 1HG2 THR 37 28.119 -2.237 -2.245
298 HG23 THR 37 2HG2 THR 37 26.939 -3.390 -1.621
299 H LYS 38 H LYS 38 24.878 -2.390 2.608
300 HA LYS 38 HA LYS 38 26.797 -1.658 4.678
301 HB2 LYS 38 2HB LYS 38 25.169 0.261 3.361
302 HB3 LYS 38 3HB LYS 38 24.526 0.053 4.985
303 HG2 LYS 38 2HG LYS 38 27.453 0.486 4.541
304 HG3 LYS 38 3HG LYS 38 26.326 1.844 4.577
305 HD2 LYS 38 2HD LYS 38 25.578 0.450 6.796
306 HD3 LYS 38 3HD LYS 38 27.317 0.151 6.760
307 HE2 LYS 38 2HE LYS 38 27.832 2.414 6.946
308 HE3 LYS 38 3HE LYS 38 26.230 2.920 6.411
309 HZ1 LYS 38 3HZ LYS 38 26.472 3.274 8.768
310 HZ2 LYS 38 1HZ LYS 38 26.888 1.653 9.015
311 HZ3 LYS 38 2HZ LYS 38 25.328 2.057 8.501
312 H ASP 39 H ASP 39 25.935 -1.833 6.837
313 HA ASP 39 HA ASP 39 23.910 -3.914 7.008
314 HB2 ASP 39 2HB ASP 39 24.577 -3.911 9.455
315 HB3 ASP 39 3HB ASP 39 25.849 -4.345 8.317
316 H ASN 40 H ASN 40 21.848 -3.483 7.386
317 HA ASN 40 HA ASN 40 19.937 -2.473 8.096
318 HB2 ASN 40 2HB ASN 40 21.568 -0.792 9.988
319 HB3 ASN 40 3HB ASN 40 19.921 -1.385 10.185
320 HD21 ASN 40 2HD2 ASN 40 22.886 -3.398 11.793
321 HD22 ASN 40 1HD2 ASN 40 22.926 -1.743 11.299
322 H ASN 41 H ASN 41 21.182 -1.439 5.833
323 HA ASN 41 HA ASN 41 21.300 1.427 5.982
324 HB2 ASN 41 2HB ASN 41 21.581 1.318 3.535
325 HB3 ASN 41 3HB ASN 41 22.680 0.219 4.364
326 HD21 ASN 41 2HD2 ASN 41 21.471 -2.640 2.844
327 HD22 ASN 41 1HD2 ASN 41 22.587 -1.909 3.943
328 H LYS 42 H LYS 42 19.997 2.305 3.752
329 HA LYS 42 HA LYS 42 17.182 1.933 4.514
330 HB2 LYS 42 2HB LYS 42 18.294 4.233 4.627
331 HB3 LYS 42 3HB LYS 42 18.291 4.201 2.868
332 HG2 LYS 42 2HG LYS 42 16.269 5.103 2.965
333 HG3 LYS 42 3HG LYS 42 15.690 3.545 3.559
334 HD2 LYS 42 2HD LYS 42 14.977 4.768 5.314
335 HD3 LYS 42 3HD LYS 42 16.654 4.620 5.845
336 HE2 LYS 42 2HE LYS 42 16.054 6.844 3.996
337 HE3 LYS 42 3HE LYS 42 15.367 6.969 5.615
338 HZ1 LYS 42 3HZ LYS 42 17.632 7.968 5.306
339 HZ2 LYS 42 1HZ LYS 42 18.233 6.396 5.129
340 HZ3 LYS 42 2HZ LYS 42 17.499 6.863 6.580
341 H CYS 43 H CYS 43 16.149 0.543 3.242
342 HA CYS 43 HA CYS 43 16.396 0.854 0.341
343 HB2 CYS 43 2HB CYS 43 16.528 -1.560 0.001
344 HB3 CYS 43 3HB CYS 43 17.885 -1.005 0.975
345 H THR 44 H THR 44 14.662 -0.589 -0.758
346 HA THR 44 HA THR 44 12.257 -0.947 0.829
347 HB THR 44 HB THR 44 10.854 0.453 -0.602
348 HG1 THR 44 HG1 THR 44 13.077 1.729 -1.725
349 HG21 THR 44 3HG2 THR 44 11.793 1.436 1.439
350 HG22 THR 44 1HG2 THR 44 11.606 2.647 0.172
351 HG23 THR 44 2HG2 THR 44 13.201 1.983 0.528
352 H VAL 45 H VAL 45 11.061 -2.602 0.096
353 HA VAL 45 HA VAL 45 11.931 -3.931 -2.350
354 HB VAL 45 HB VAL 45 10.012 -4.850 -0.205
355 HG11 VAL 45 1HG1 VAL 45 9.310 -6.150 -1.929
356 HG12 VAL 45 2HG1 VAL 45 10.833 -6.001 -2.808
357 HG13 VAL 45 3HG1 VAL 45 10.708 -7.107 -1.439
358 HG21 VAL 45 3HG2 VAL 45 12.053 -4.931 0.848
359 HG22 VAL 45 1HG2 VAL 45 12.016 -6.519 0.083
360 HG23 VAL 45 2HG2 VAL 45 12.939 -5.208 -0.651
361 H ASP 46 H ASP 46 10.604 -4.389 -4.081
362 HA ASP 46 HA ASP 46 8.016 -2.978 -4.117
363 HB2 ASP 46 2HB ASP 46 10.288 -2.780 -5.881
364 HB3 ASP 46 3HB ASP 46 8.875 -3.337 -6.774
365 H THR 47 H THR 47 6.400 -4.384 -4.063
366 HA THR 47 HA THR 47 6.756 -7.057 -5.188
367 HB THR 47 HB THR 47 5.816 -6.848 -2.907
368 HG1 THR 47 HG1 THR 47 4.162 -8.343 -3.282
369 HG21 THR 47 3HG2 THR 47 4.322 -4.783 -3.996
370 HG22 THR 47 1HG2 THR 47 4.114 -5.490 -2.395
371 HG23 THR 47 2HG2 THR 47 3.146 -6.073 -3.749
372 H TYR 48 H TYR 48 6.378 -4.601 -6.835
373 HA TYR 48 HA TYR 48 3.898 -5.392 -8.219
374 HB2 TYR 48 2HB TYR 48 3.908 -3.078 -7.250
375 HB3 TYR 48 3HB TYR 48 5.239 -2.685 -8.332
376 HD1 TYR 48 HD1 TYR 48 1.652 -3.309 -8.079
377 HD2 TYR 48 HD2 TYR 48 4.868 -2.501 -10.744
378 HE1 TYR 48 HE1 TYR 48 0.038 -2.727 -9.840
379 HE2 TYR 48 HE2 TYR 48 3.263 -1.915 -12.513
380 HH TYR 48 HH TYR 48 0.403 -1.037 -12.185
381 H ASN 49 H ASN 49 7.303 -4.782 -8.482
382 HA ASN 49 HA ASN 49 7.229 -5.779 -11.241
383 HB2 ASN 49 2HB ASN 49 9.255 -4.146 -11.583
384 HB3 ASN 49 3HB ASN 49 7.605 -3.549 -11.741
385 HD21 ASN 49 2HD2 ASN 49 9.819 -2.520 -8.456
386 HD22 ASN 49 1HD2 ASN 49 10.134 -3.995 -9.300
387 H ASN 50 H ASN 50 8.033 -6.631 -8.356
388 HA ASN 50 HA ASN 50 9.639 -7.895 -7.350
389 HB2 ASN 50 2HB ASN 50 9.450 -8.787 -10.138
390 HB3 ASN 50 3HB ASN 50 10.974 -9.210 -9.364
391 HD21 ASN 50 2HD2 ASN 50 9.468 -12.042 -8.090
392 HD22 ASN 50 1HD2 ASN 50 10.739 -11.326 -9.016
393 H ALA 51 H ALA 51 10.930 -6.202 -6.579
394 HA ALA 51 HA ALA 51 13.629 -6.267 -7.331
395 HB1 ALA 51 1HB ALA 51 11.992 -4.112 -8.573
396 HB2 ALA 51 2HB ALA 51 13.636 -3.740 -8.050
397 HB3 ALA 51 3HB ALA 51 13.354 -5.019 -9.231
398 H VAL 52 H VAL 52 14.785 -4.171 -6.371
399 HA VAL 52 HA VAL 52 13.416 -3.136 -4.027
400 HB VAL 52 HB VAL 52 14.473 -5.363 -3.389
401 HG11 VAL 52 1HG1 VAL 52 17.025 -3.768 -3.559
402 HG12 VAL 52 2HG1 VAL 52 16.846 -5.445 -3.041
403 HG13 VAL 52 3HG1 VAL 52 16.543 -5.004 -4.722
404 HG21 VAL 52 3HG2 VAL 52 15.358 -4.462 -1.257
405 HG22 VAL 52 1HG2 VAL 52 15.292 -2.842 -1.951
406 HG23 VAL 52 2HG2 VAL 52 13.806 -3.761 -1.713
407 H ASP 53 H ASP 53 14.155 -1.166 -3.423
408 HA ASP 53 HA ASP 53 16.271 0.001 -5.061
409 HB2 ASP 53 2HB ASP 53 14.361 1.369 -5.070
410 HB3 ASP 53 3HB ASP 53 14.087 1.152 -3.344
411 H CYS 54 H CYS 54 18.094 -0.909 -4.064
412 HA CYS 54 HA CYS 54 18.580 -0.727 -1.268
413 HB2 CYS 54 2HB CYS 54 20.365 -1.282 -3.635
414 HB3 CYS 54 3HB CYS 54 20.977 -1.237 -1.985
415 H ASP 55 H ASP 55 20.352 0.500 -0.283
416 HA ASP 55 HA ASP 55 20.088 3.231 -0.570
417 HB2 ASP 55 2HB ASP 55 21.799 3.456 0.993
418 HB3 ASP 55 3HB ASP 55 21.214 1.824 1.307
Start of MODEL 8
1 H1 ALA 1 H ALA 1 1.787 -1.190 -0.582
2 HA ALA 1 HA ALA 1 1.986 -2.477 -2.749
3 HB1 ALA 1 1HB ALA 1 1.304 -1.042 -4.384
4 HB2 ALA 1 2HB ALA 1 2.070 0.358 -3.632
5 HB3 ALA 1 3HB ALA 1 3.049 -0.816 -4.511
6 H LYS 2 H LYS 2 4.108 0.369 -2.556
7 HA LYS 2 HA LYS 2 6.457 -1.257 -2.523
8 HB2 LYS 2 2HB LYS 2 5.863 1.421 -3.071
9 HB3 LYS 2 3HB LYS 2 6.904 1.471 -1.655
10 HG2 LYS 2 2HG LYS 2 8.108 -0.364 -3.372
11 HG3 LYS 2 3HG LYS 2 7.572 0.962 -4.406
12 HD2 LYS 2 2HD LYS 2 9.164 1.337 -1.873
13 HD3 LYS 2 3HD LYS 2 9.882 1.230 -3.482
14 HE2 LYS 2 2HE LYS 2 7.706 3.207 -2.929
15 HE3 LYS 2 3HE LYS 2 9.365 3.561 -2.449
16 HZ1 LYS 2 3HZ LYS 2 9.334 2.604 -5.099
17 HZ2 LYS 2 1HZ LYS 2 9.840 4.112 -4.524
18 HZ3 LYS 2 2HZ LYS 2 8.223 3.873 -4.960
19 H TYR 3 H TYR 3 7.779 -1.804 -0.855
20 HA TYR 3 HA TYR 3 6.817 -1.136 1.848
21 HB2 TYR 3 2HB TYR 3 8.332 -3.568 0.879
22 HB3 TYR 3 3HB TYR 3 7.942 -3.241 2.564
23 HD1 TYR 3 HD1 TYR 3 5.515 -3.145 3.249
24 HD2 TYR 3 HD2 TYR 3 6.759 -4.579 -0.559
25 HE1 TYR 3 HE1 TYR 3 3.342 -4.263 2.966
26 HE2 TYR 3 HE2 TYR 3 4.590 -5.699 -0.853
27 HH TYR 3 HH TYR 3 2.080 -5.531 1.658
28 H THR 4 H THR 4 8.361 -0.733 3.492
29 HA THR 4 HA THR 4 10.983 0.143 2.466
30 HB THR 4 HB THR 4 9.480 1.314 4.813
31 HG1 THR 4 HG1 THR 4 9.412 3.157 3.228
32 HG21 THR 4 3HG2 THR 4 11.271 3.181 4.134
33 HG22 THR 4 1HG2 THR 4 12.164 1.746 3.631
34 HG23 THR 4 2HG2 THR 4 11.622 1.907 5.302
35 H GLY 5 H GLY 5 12.790 -0.555 3.474
36 HA2 GLY 5 2HA GLY 5 12.755 -1.567 6.165
37 HA3 GLY 5 3HA GLY 5 12.898 -2.839 4.961
38 H LYS 6 H LYS 6 14.965 -3.296 5.957
39 HA LYS 6 HA LYS 6 17.078 -1.608 4.819
40 HB2 LYS 6 2HB LYS 6 17.556 -2.835 7.494
41 HB3 LYS 6 3HB LYS 6 18.258 -1.387 6.784
42 HG2 LYS 6 2HG LYS 6 15.745 -0.542 7.007
43 HG3 LYS 6 3HG LYS 6 15.748 -1.732 8.312
44 HD2 LYS 6 2HD LYS 6 17.855 -0.623 9.153
45 HD3 LYS 6 3HD LYS 6 17.546 0.663 7.984
46 HE2 LYS 6 2HE LYS 6 15.602 1.347 9.072
47 HE3 LYS 6 3HE LYS 6 15.434 -0.181 9.935
48 HZ1 LYS 6 3HZ LYS 6 16.234 1.795 11.264
49 HZ2 LYS 6 1HZ LYS 6 17.698 1.660 10.426
50 HZ3 LYS 6 2HZ LYS 6 17.157 0.384 11.395
51 H CYS 7 H CYS 7 19.209 -2.752 4.780
52 HA CYS 7 HA CYS 7 18.845 -5.661 4.476
53 HB2 CYS 7 2HB CYS 7 20.926 -4.521 2.778
54 HB3 CYS 7 3HB CYS 7 19.617 -5.623 2.365
55 H THR 8 H THR 8 21.056 -6.790 4.369
56 HA THR 8 HA THR 8 22.737 -5.682 6.519
57 HB THR 8 HB THR 8 23.250 -8.473 5.998
58 HG1 THR 8 HG1 THR 8 21.212 -8.938 5.499
59 HG21 THR 8 3HG2 THR 8 23.494 -8.488 8.229
60 HG22 THR 8 1HG2 THR 8 21.911 -7.761 8.497
61 HG23 THR 8 2HG2 THR 8 23.300 -6.739 8.128
62 H LYS 9 H LYS 9 24.736 -5.080 6.025
63 HA LYS 9 HA LYS 9 25.817 -4.997 3.505
64 HB2 LYS 9 2HB LYS 9 27.916 -4.458 4.518
65 HB3 LYS 9 3HB LYS 9 26.651 -3.779 5.534
66 HG2 LYS 9 2HG LYS 9 27.778 -4.729 7.210
67 HG3 LYS 9 3HG LYS 9 27.005 -6.223 6.674
68 HD2 LYS 9 2HD LYS 9 28.910 -6.984 5.617
69 HD3 LYS 9 3HD LYS 9 29.569 -5.360 5.409
70 HE2 LYS 9 2HE LYS 9 30.917 -6.123 7.091
71 HE3 LYS 9 3HE LYS 9 29.615 -5.411 8.044
72 HZ1 LYS 9 3HZ LYS 9 28.616 -7.765 7.923
73 HZ2 LYS 9 1HZ LYS 9 29.890 -7.477 8.999
74 HZ3 LYS 9 2HZ LYS 9 30.186 -8.254 7.526
75 H SER 10 H SER 10 25.717 -7.671 5.700
76 HA SER 10 HA SER 10 27.815 -9.254 4.899
77 HB2 SER 10 2HB SER 10 25.023 -9.918 5.791
78 HB3 SER 10 3HB SER 10 26.143 -11.200 5.333
79 HG SER 10 HG SER 10 27.057 -10.969 7.199
80 H LYS 11 H LYS 11 24.544 -9.930 3.691
81 HA LYS 11 HA LYS 11 25.729 -10.466 1.045
82 HB2 LYS 11 2HB LYS 11 24.643 -12.361 2.598
83 HB3 LYS 11 3HB LYS 11 23.179 -11.785 1.811
84 HG2 LYS 11 2HG LYS 11 23.756 -12.638 -0.196
85 HG3 LYS 11 3HG LYS 11 25.478 -12.335 0.046
86 HD2 LYS 11 2HD LYS 11 25.192 -14.221 1.874
87 HD3 LYS 11 3HD LYS 11 23.820 -14.671 0.859
88 HE2 LYS 11 2HE LYS 11 25.495 -14.540 -1.090
89 HE3 LYS 11 3HE LYS 11 26.737 -14.585 0.161
90 HZ1 LYS 11 3HZ LYS 11 26.425 -16.797 -0.454
91 HZ2 LYS 11 1HZ LYS 11 24.740 -16.656 -0.515
92 HZ3 LYS 11 2HZ LYS 11 25.535 -16.651 0.978
93 H ASN 12 H ASN 12 24.664 -7.943 1.989
94 HA ASN 12 HA ASN 12 23.087 -6.342 1.506
95 HB2 ASN 12 2HB ASN 12 22.861 -5.954 -0.890
96 HB3 ASN 12 3HB ASN 12 24.515 -6.423 -0.510
97 HD21 ASN 12 2HD2 ASN 12 22.264 -8.601 -3.029
98 HD22 ASN 12 1HD2 ASN 12 21.694 -7.159 -2.267
99 H GLU 13 H GLU 13 21.859 -8.641 2.554
100 HA GLU 13 HA GLU 13 19.555 -9.236 0.897
101 HB2 GLU 13 2HB GLU 13 20.893 -10.510 3.052
102 HB3 GLU 13 3HB GLU 13 19.247 -10.187 3.577
103 HG2 GLU 13 2HG GLU 13 18.336 -11.423 1.767
104 HG3 GLU 13 3HG GLU 13 19.911 -11.555 0.986
105 H CYS 14 H CYS 14 18.155 -7.585 0.726
106 HA CYS 14 HA CYS 14 17.550 -5.897 3.003
107 HB2 CYS 14 2HB CYS 14 17.090 -5.811 0.094
108 HB3 CYS 14 3HB CYS 14 15.786 -5.137 1.065
109 H LYS 15 H LYS 15 16.141 -6.545 4.480
110 HA LYS 15 HA LYS 15 14.084 -8.486 3.808
111 HB2 LYS 15 2HB LYS 15 15.442 -8.691 5.890
112 HB3 LYS 15 3HB LYS 15 14.706 -7.205 6.475
113 HG2 LYS 15 2HG LYS 15 12.838 -9.319 5.628
114 HG3 LYS 15 3HG LYS 15 13.797 -9.659 7.069
115 HD2 LYS 15 2HD LYS 15 12.691 -6.964 7.051
116 HD3 LYS 15 3HD LYS 15 11.449 -8.216 6.983
117 HE2 LYS 15 2HE LYS 15 13.486 -8.909 8.896
118 HE3 LYS 15 3HE LYS 15 12.838 -7.306 9.238
119 HZ1 LYS 15 3HZ LYS 15 11.638 -9.846 9.644
120 HZ2 LYS 15 1HZ LYS 15 10.656 -8.880 8.662
121 HZ3 LYS 15 2HZ LYS 15 11.131 -8.326 10.187
122 H TYR 16 H TYR 16 11.845 -8.160 4.412
123 HA TYR 16 HA TYR 16 10.876 -5.530 4.998
124 HB2 TYR 16 2HB TYR 16 9.798 -5.019 2.942
125 HB3 TYR 16 3HB TYR 16 11.458 -5.436 2.530
126 HD1 TYR 16 HD1 TYR 16 11.895 -7.857 1.755
127 HD2 TYR 16 HD2 TYR 16 8.023 -6.097 1.883
128 HE1 TYR 16 HE1 TYR 16 11.080 -9.549 0.167
129 HE2 TYR 16 HE2 TYR 16 7.197 -7.785 0.296
130 HH TYR 16 HH TYR 16 8.104 -10.366 -0.284
131 H LYS 17 H LYS 17 8.306 -5.662 4.203
132 HA LYS 17 HA LYS 17 7.327 -8.185 5.372
133 HB2 LYS 17 2HB LYS 17 5.385 -6.810 6.207
134 HB3 LYS 17 3HB LYS 17 6.930 -6.471 6.976
135 HG2 LYS 17 2HG LYS 17 6.454 -4.785 4.662
136 HG3 LYS 17 3HG LYS 17 5.201 -4.621 5.894
137 HD2 LYS 17 2HD LYS 17 8.145 -4.485 6.513
138 HD3 LYS 17 3HD LYS 17 7.177 -3.063 6.116
139 HE2 LYS 17 2HE LYS 17 6.442 -2.946 8.208
140 HE3 LYS 17 3HE LYS 17 5.816 -4.591 8.107
141 HZ1 LYS 17 3HZ LYS 17 8.029 -3.650 9.557
142 HZ2 LYS 17 1HZ LYS 17 8.582 -4.758 8.404
143 HZ3 LYS 17 2HZ LYS 17 7.388 -5.215 9.511
144 H ASN 18 H ASN 18 5.729 -9.251 4.330
145 HA ASN 18 HA ASN 18 4.379 -7.916 2.093
146 HB2 ASN 18 2HB ASN 18 4.963 -9.496 0.518
147 HB3 ASN 18 3HB ASN 18 6.433 -9.461 1.488
148 HD21 ASN 18 2HD2 ASN 18 5.559 -12.577 3.150
149 HD22 ASN 18 1HD2 ASN 18 6.001 -10.964 3.581
150 H ASP 19 H ASP 19 2.509 -9.248 1.279
151 HA ASP 19 HA ASP 19 0.564 -10.390 1.611
152 HB2 ASP 19 2HB ASP 19 2.494 -11.879 3.089
153 HB3 ASP 19 3HB ASP 19 1.021 -11.793 4.051
154 H ALA 20 H ALA 20 1.681 -9.993 4.969
155 HA ALA 20 HA ALA 20 -0.102 -7.796 5.456
156 HB1 ALA 20 1HB ALA 20 -0.735 -10.450 6.741
157 HB2 ALA 20 2HB ALA 20 -1.527 -8.912 7.086
158 HB3 ALA 20 3HB ALA 20 -1.695 -9.653 5.495
159 H GLY 21 H GLY 21 2.746 -8.650 5.785
160 HA2 GLY 21 2HA GLY 21 4.000 -7.382 7.527
161 HA3 GLY 21 3HA GLY 21 2.964 -8.185 8.697
162 H LYS 22 H LYS 22 3.695 -10.278 6.194
163 HA LYS 22 HA LYS 22 5.269 -11.956 7.862
164 HB2 LYS 22 2HB LYS 22 4.289 -12.045 5.050
165 HB3 LYS 22 3HB LYS 22 5.628 -13.100 5.482
166 HG2 LYS 22 2HG LYS 22 3.333 -13.124 7.327
167 HG3 LYS 22 3HG LYS 22 3.043 -13.786 5.716
168 HD2 LYS 22 2HD LYS 22 4.584 -15.486 5.995
169 HD3 LYS 22 3HD LYS 22 5.480 -14.609 7.237
170 HE2 LYS 22 2HE LYS 22 4.266 -15.521 8.867
171 HE3 LYS 22 3HE LYS 22 2.754 -15.111 8.058
172 HZ1 LYS 22 3HZ LYS 22 2.599 -17.144 7.115
173 HZ2 LYS 22 1HZ LYS 22 3.524 -17.599 8.456
174 HZ3 LYS 22 2HZ LYS 22 4.272 -17.344 6.960
175 H ASP 23 H ASP 23 7.393 -11.978 8.178
176 HA ASP 23 HA ASP 23 9.103 -10.056 6.999
177 HB2 ASP 23 2HB ASP 23 9.952 -12.556 8.469
178 HB3 ASP 23 3HB ASP 23 10.863 -11.059 8.290
179 H THR 24 H THR 24 9.935 -10.092 5.030
180 HA THR 24 HA THR 24 10.706 -12.684 3.866
181 HB THR 24 HB THR 24 9.365 -10.406 2.397
182 HG1 THR 24 HG1 THR 24 8.446 -13.078 2.667
183 HG21 THR 24 3HG2 THR 24 11.066 -11.465 1.008
184 HG22 THR 24 1HG2 THR 24 9.454 -11.893 0.439
185 HG23 THR 24 2HG2 THR 24 10.396 -13.055 1.373
186 H PHE 25 H PHE 25 12.685 -12.763 2.967
187 HA PHE 25 HA PHE 25 14.234 -10.266 2.919
188 HB2 PHE 25 2HB PHE 25 15.189 -13.135 3.040
189 HB3 PHE 25 3HB PHE 25 16.230 -11.714 3.039
190 HD1 PHE 25 HD1 PHE 25 16.742 -10.600 5.027
191 HD2 PHE 25 HD2 PHE 25 13.575 -13.443 4.958
192 HE1 PHE 25 HE1 PHE 25 16.591 -10.486 7.480
193 HE2 PHE 25 HE2 PHE 25 13.418 -13.333 7.411
194 HZ PHE 25 HZ PHE 25 14.927 -11.853 8.676
195 H ILE 26 H ILE 26 15.278 -9.592 1.103
196 HA ILE 26 HA ILE 26 15.342 -11.309 -1.249
197 HB ILE 26 HB ILE 26 13.187 -10.165 -1.444
198 HG12 ILE 26 2HG1 ILE 26 13.535 -9.169 -3.670
199 HG13 ILE 26 3HG1 ILE 26 15.267 -9.092 -3.364
200 HG21 ILE 26 1HG2 ILE 26 13.005 -7.776 -1.597
201 HG22 ILE 26 2HG2 ILE 26 13.819 -8.184 -0.088
202 HG23 ILE 26 3HG2 ILE 26 14.753 -7.591 -1.461
203 HD11 ILE 26 3HD1 ILE 26 13.981 -11.109 -4.656
204 HD12 ILE 26 1HD1 ILE 26 15.566 -11.236 -3.894
205 HD13 ILE 26 2HD1 ILE 26 14.124 -11.755 -3.021
206 H LYS 27 H LYS 27 17.185 -11.058 -2.336
207 HA LYS 27 HA LYS 27 19.225 -9.349 -1.446
208 HB2 LYS 27 2HB LYS 27 20.503 -10.134 -3.326
209 HB3 LYS 27 3HB LYS 27 19.567 -11.482 -2.694
210 HG2 LYS 27 2HG LYS 27 17.880 -11.039 -4.487
211 HG3 LYS 27 3HG LYS 27 19.011 -9.870 -5.171
212 HD2 LYS 27 2HD LYS 27 19.383 -11.871 -6.357
213 HD3 LYS 27 3HD LYS 27 20.711 -11.760 -5.200
214 HE2 LYS 27 2HE LYS 27 20.156 -13.753 -4.394
215 HE3 LYS 27 3HE LYS 27 18.583 -13.115 -3.921
216 HZ1 LYS 27 3HZ LYS 27 18.314 -15.023 -5.344
217 HZ2 LYS 27 1HZ LYS 27 19.268 -14.315 -6.549
218 HZ3 LYS 27 2HZ LYS 27 17.768 -13.642 -6.154
219 H CYS 28 H CYS 28 20.408 -8.182 -3.597
220 HA CYS 28 HA CYS 28 18.476 -6.082 -4.331
221 HB2 CYS 28 2HB CYS 28 20.630 -5.654 -2.847
222 HB3 CYS 28 3HB CYS 28 21.420 -5.598 -4.419
223 HA PRO 29 HA PRO 29 19.671 -8.182 -8.278
224 HB2 PRO 29 2HB PRO 29 17.171 -8.105 -9.335
225 HB3 PRO 29 3HB PRO 29 17.726 -9.405 -8.273
226 HG2 PRO 29 2HG PRO 29 16.063 -7.003 -7.618
227 HG3 PRO 29 3HG PRO 29 15.858 -8.683 -7.089
228 HD2 PRO 29 2HD PRO 29 16.983 -6.787 -5.516
229 HD3 PRO 29 3HD PRO 29 17.466 -8.494 -5.448
230 H LYS 30 H LYS 30 18.164 -5.208 -7.391
231 HA LYS 30 HA LYS 30 17.863 -4.007 -9.911
232 HB2 LYS 30 2HB LYS 30 17.558 -3.244 -7.209
233 HB3 LYS 30 3HB LYS 30 18.646 -2.069 -7.936
234 HG2 LYS 30 2HG LYS 30 15.937 -2.821 -9.015
235 HG3 LYS 30 3HG LYS 30 16.293 -1.384 -8.054
236 HD2 LYS 30 2HD LYS 30 17.929 -0.703 -9.809
237 HD3 LYS 30 3HD LYS 30 17.377 -2.066 -10.785
238 HE2 LYS 30 2HE LYS 30 16.186 -0.183 -11.566
239 HE3 LYS 30 3HE LYS 30 15.049 -1.099 -10.579
240 HZ1 LYS 30 3HZ LYS 30 16.609 1.053 -9.331
241 HZ2 LYS 30 1HZ LYS 30 15.073 0.468 -8.930
242 HZ3 LYS 30 2HZ LYS 30 15.273 1.459 -10.286
243 H PHE 31 H PHE 31 20.437 -3.316 -7.538
244 HA PHE 31 HA PHE 31 22.233 -2.756 -9.804
245 HB2 PHE 31 2HB PHE 31 23.021 -1.755 -7.149
246 HB3 PHE 31 3HB PHE 31 23.059 -0.951 -8.714
247 HD1 PHE 31 HD1 PHE 31 21.274 0.445 -9.431
248 HD2 PHE 31 HD2 PHE 31 20.952 -1.777 -5.815
249 HE1 PHE 31 HE1 PHE 31 19.288 1.755 -8.807
250 HE2 PHE 31 HE2 PHE 31 18.965 -0.470 -5.185
251 HZ PHE 31 HZ PHE 31 18.129 1.298 -6.682
252 H ASP 32 H ASP 32 23.180 -4.721 -10.116
253 HA ASP 32 HA ASP 32 24.021 -6.445 -8.032
254 HB2 ASP 32 2HB ASP 32 23.680 -6.749 -10.702
255 HB3 ASP 32 3HB ASP 32 25.435 -6.622 -10.624
256 H ASN 33 H ASN 33 25.308 -3.558 -9.218
257 HA ASN 33 HA ASN 33 27.977 -4.205 -8.154
258 HB2 ASN 33 2HB ASN 33 27.229 -3.007 -10.586
259 HB3 ASN 33 3HB ASN 33 27.883 -1.705 -9.597
260 HD21 ASN 33 2HD2 ASN 33 30.351 -4.888 -10.338
261 HD22 ASN 33 1HD2 ASN 33 28.678 -5.141 -9.989
262 H LYS 34 H LYS 34 25.159 -2.322 -7.707
263 HA LYS 34 HA LYS 34 26.507 -0.808 -5.570
264 HB2 LYS 34 2HB LYS 34 24.138 0.208 -7.137
265 HB3 LYS 34 3HB LYS 34 25.148 1.104 -6.009
266 HG2 LYS 34 2HG LYS 34 26.032 1.867 -7.946
267 HG3 LYS 34 3HG LYS 34 27.031 0.425 -7.752
268 HD2 LYS 34 2HD LYS 34 25.734 -0.797 -9.310
269 HD3 LYS 34 3HD LYS 34 24.453 0.418 -9.306
270 HE2 LYS 34 2HE LYS 34 25.944 2.016 -10.375
271 HE3 LYS 34 3HE LYS 34 27.260 0.844 -10.329
272 HZ1 LYS 34 3HZ LYS 34 26.555 0.006 -12.235
273 HZ2 LYS 34 1HZ LYS 34 25.329 1.169 -12.308
274 HZ3 LYS 34 2HZ LYS 34 25.032 -0.327 -11.578
275 H LYS 35 H LYS 35 25.379 -3.305 -5.140
276 HA LYS 35 HA LYS 35 22.683 -3.149 -4.244
277 HB2 LYS 35 2HB LYS 35 23.160 -5.323 -3.159
278 HB3 LYS 35 3HB LYS 35 23.647 -5.288 -4.848
279 HG2 LYS 35 2HG LYS 35 25.801 -4.480 -3.092
280 HG3 LYS 35 3HG LYS 35 25.187 -6.087 -2.695
281 HD2 LYS 35 2HD LYS 35 25.525 -5.615 -5.565
282 HD3 LYS 35 3HD LYS 35 27.028 -5.534 -4.642
283 HE2 LYS 35 2HE LYS 35 25.208 -7.785 -4.033
284 HE3 LYS 35 3HE LYS 35 26.011 -7.821 -5.602
285 HZ1 LYS 35 3HZ LYS 35 27.113 -8.809 -3.425
286 HZ2 LYS 35 1HZ LYS 35 27.668 -7.217 -3.279
287 HZ3 LYS 35 2HZ LYS 35 28.033 -8.117 -4.664
288 H CYS 36 H CYS 36 22.476 -4.113 -1.778
289 HA CYS 36 HA CYS 36 23.027 -1.863 -0.136
290 HB2 CYS 36 2HB CYS 36 21.769 -4.537 0.253
291 HB3 CYS 36 3HB CYS 36 22.294 -3.660 1.686
292 H THR 37 H THR 37 24.940 -1.369 0.687
293 HA THR 37 HA THR 37 26.702 -3.563 1.568
294 HB THR 37 HB THR 37 28.631 -2.127 1.080
295 HG1 THR 37 HG1 THR 37 28.366 -0.130 0.174
296 HG21 THR 37 3HG2 THR 37 27.373 -3.633 -0.674
297 HG22 THR 37 1HG2 THR 37 28.712 -2.600 -1.170
298 HG23 THR 37 2HG2 THR 37 27.049 -2.083 -1.449
299 H LYS 38 H LYS 38 24.839 -2.618 3.323
300 HA LYS 38 HA LYS 38 26.499 -1.627 5.440
301 HB2 LYS 38 2HB LYS 38 25.043 0.267 3.894
302 HB3 LYS 38 3HB LYS 38 24.265 0.153 5.468
303 HG2 LYS 38 2HG LYS 38 27.221 0.582 5.130
304 HG3 LYS 38 3HG LYS 38 26.055 1.903 5.246
305 HD2 LYS 38 2HD LYS 38 25.319 0.477 7.393
306 HD3 LYS 38 3HD LYS 38 27.025 0.028 7.322
307 HE2 LYS 38 2HE LYS 38 26.014 2.868 7.295
308 HE3 LYS 38 3HE LYS 38 26.537 2.018 8.749
309 HZ1 LYS 38 3HZ LYS 38 28.110 3.361 6.844
310 HZ2 LYS 38 1HZ LYS 38 28.546 1.726 6.845
311 HZ3 LYS 38 2HZ LYS 38 28.601 2.617 8.282
312 H ASP 39 H ASP 39 25.427 -1.671 7.513
313 HA ASP 39 HA ASP 39 23.299 -3.665 7.564
314 HB2 ASP 39 2HB ASP 39 25.175 -2.579 9.656
315 HB3 ASP 39 3HB ASP 39 23.798 -3.592 10.080
316 H ASN 40 H ASN 40 21.242 -3.162 7.907
317 HA ASN 40 HA ASN 40 19.356 -2.042 8.513
318 HB2 ASN 40 2HB ASN 40 20.951 -0.233 10.299
319 HB3 ASN 40 3HB ASN 40 19.327 -0.871 10.532
320 HD21 ASN 40 2HD2 ASN 40 22.273 -2.621 12.387
321 HD22 ASN 40 1HD2 ASN 40 22.205 -0.984 11.838
322 H ASN 41 H ASN 41 20.889 -1.184 6.256
323 HA ASN 41 HA ASN 41 21.003 1.672 6.195
324 HB2 ASN 41 2HB ASN 41 21.439 1.391 3.793
325 HB3 ASN 41 3HB ASN 41 22.443 0.308 4.753
326 HD21 ASN 41 2HD2 ASN 41 21.295 -2.564 3.235
327 HD22 ASN 41 1HD2 ASN 41 22.414 -1.787 4.296
328 H LYS 42 H LYS 42 19.848 2.444 3.867
329 HA LYS 42 HA LYS 42 16.986 2.145 4.465
330 HB2 LYS 42 2HB LYS 42 18.207 4.435 4.485
331 HB3 LYS 42 3HB LYS 42 18.149 4.306 2.732
332 HG2 LYS 42 2HG LYS 42 16.006 4.890 2.662
333 HG3 LYS 42 3HG LYS 42 15.575 3.772 3.959
334 HD2 LYS 42 2HD LYS 42 15.893 5.346 5.604
335 HD3 LYS 42 3HD LYS 42 17.051 6.271 4.644
336 HE2 LYS 42 2HE LYS 42 14.749 6.460 3.163
337 HE3 LYS 42 3HE LYS 42 14.144 6.498 4.818
338 HZ1 LYS 42 3HZ LYS 42 15.515 8.518 3.361
339 HZ2 LYS 42 1HZ LYS 42 16.324 8.169 4.805
340 HZ3 LYS 42 2HZ LYS 42 14.698 8.632 4.837
341 H CYS 43 H CYS 43 15.998 0.723 3.196
342 HA CYS 43 HA CYS 43 16.293 0.944 0.313
343 HB2 CYS 43 2HB CYS 43 16.830 -1.347 -0.074
344 HB3 CYS 43 3HB CYS 43 17.986 -0.753 1.115
345 H THR 44 H THR 44 14.472 0.374 -0.801
346 HA THR 44 HA THR 44 12.189 -0.539 0.826
347 HB THR 44 HB THR 44 10.761 0.636 -0.896
348 HG1 THR 44 HG1 THR 44 11.789 2.148 -2.217
349 HG21 THR 44 3HG2 THR 44 10.644 2.125 0.757
350 HG22 THR 44 1HG2 THR 44 12.025 2.964 0.051
351 HG23 THR 44 2HG2 THR 44 12.279 1.728 1.283
352 H VAL 45 H VAL 45 11.165 -2.343 0.222
353 HA VAL 45 HA VAL 45 12.057 -3.678 -2.223
354 HB VAL 45 HB VAL 45 10.433 -4.741 0.093
355 HG11 VAL 45 1HG1 VAL 45 11.263 -6.953 -1.076
356 HG12 VAL 45 2HG1 VAL 45 9.783 -6.144 -1.596
357 HG13 VAL 45 3HG1 VAL 45 11.278 -5.921 -2.505
358 HG21 VAL 45 3HG2 VAL 45 13.280 -5.388 -0.645
359 HG22 VAL 45 1HG2 VAL 45 12.840 -4.158 0.540
360 HG23 VAL 45 2HG2 VAL 45 12.408 -5.845 0.819
361 H ASP 46 H ASP 46 10.669 -4.374 -3.825
362 HA ASP 46 HA ASP 46 7.907 -3.356 -3.674
363 HB2 ASP 46 2HB ASP 46 9.985 -2.759 -5.579
364 HB3 ASP 46 3HB ASP 46 8.633 -3.543 -6.391
365 H THR 47 H THR 47 6.480 -4.948 -3.666
366 HA THR 47 HA THR 47 7.215 -7.586 -4.635
367 HB THR 47 HB THR 47 6.009 -7.316 -2.475
368 HG1 THR 47 HG1 THR 47 4.689 -9.084 -2.858
369 HG21 THR 47 3HG2 THR 47 3.593 -6.658 -4.153
370 HG22 THR 47 1HG2 THR 47 4.545 -5.435 -3.313
371 HG23 THR 47 2HG2 THR 47 3.715 -6.690 -2.394
372 H TYR 48 H TYR 48 5.321 -4.866 -5.630
373 HA TYR 48 HA TYR 48 3.700 -6.290 -7.519
374 HB2 TYR 48 2HB TYR 48 3.121 -4.073 -6.414
375 HB3 TYR 48 3HB TYR 48 4.270 -3.327 -7.519
376 HD1 TYR 48 HD1 TYR 48 3.841 -3.423 -9.981
377 HD2 TYR 48 HD2 TYR 48 0.942 -4.677 -7.131
378 HE1 TYR 48 HE1 TYR 48 2.091 -3.264 -11.701
379 HE2 TYR 48 HE2 TYR 48 -0.817 -4.523 -8.844
380 HH TYR 48 HH TYR 48 -0.233 -4.375 -12.071
381 H ASN 49 H ASN 49 6.863 -4.929 -7.512
382 HA ASN 49 HA ASN 49 7.054 -5.358 -10.422
383 HB2 ASN 49 2HB ASN 49 7.401 -3.034 -10.029
384 HB3 ASN 49 3HB ASN 49 8.456 -3.352 -8.656
385 HD21 ASN 49 2HD2 ASN 49 11.334 -3.880 -10.561
386 HD22 ASN 49 1HD2 ASN 49 10.565 -4.081 -9.027
387 H ASN 50 H ASN 50 8.086 -6.357 -7.364
388 HA ASN 50 HA ASN 50 9.578 -7.921 -6.656
389 HB2 ASN 50 2HB ASN 50 9.104 -8.584 -9.474
390 HB3 ASN 50 3HB ASN 50 10.654 -9.158 -8.866
391 HD21 ASN 50 2HD2 ASN 50 7.642 -11.457 -8.244
392 HD22 ASN 50 1HD2 ASN 50 7.976 -10.422 -9.587
393 H ALA 51 H ALA 51 10.934 -6.150 -5.980
394 HA ALA 51 HA ALA 51 13.603 -6.414 -6.780
395 HB1 ALA 51 1HB ALA 51 12.868 -3.682 -7.570
396 HB2 ALA 51 2HB ALA 51 14.018 -4.807 -8.295
397 HB3 ALA 51 3HB ALA 51 12.297 -4.954 -8.651
398 H VAL 52 H VAL 52 14.794 -4.135 -6.069
399 HA VAL 52 HA VAL 52 13.561 -3.061 -3.667
400 HB VAL 52 HB VAL 52 14.813 -5.211 -3.055
401 HG11 VAL 52 1HG1 VAL 52 16.778 -4.460 -4.572
402 HG12 VAL 52 2HG1 VAL 52 17.275 -3.516 -3.166
403 HG13 VAL 52 3HG1 VAL 52 17.126 -5.270 -3.045
404 HG21 VAL 52 3HG2 VAL 52 14.116 -3.611 -1.385
405 HG22 VAL 52 1HG2 VAL 52 15.738 -4.188 -1.002
406 HG23 VAL 52 2HG2 VAL 52 15.516 -2.595 -1.727
407 H ASP 53 H ASP 53 14.587 -1.174 -2.877
408 HA ASP 53 HA ASP 53 16.425 0.058 -4.820
409 HB2 ASP 53 2HB ASP 53 14.314 1.266 -3.036
410 HB3 ASP 53 3HB ASP 53 15.546 2.238 -3.836
411 H CYS 54 H CYS 54 18.107 -1.129 -3.558
412 HA CYS 54 HA CYS 54 18.736 -0.689 -0.907
413 HB2 CYS 54 2HB CYS 54 20.541 -1.113 -3.291
414 HB3 CYS 54 3HB CYS 54 21.132 -1.086 -1.633
415 H ASP 55 H ASP 55 20.435 0.654 0.045
416 HA ASP 55 HA ASP 55 20.059 3.403 -0.618
417 HB2 ASP 55 2HB ASP 55 20.345 3.003 1.674
418 HB3 ASP 55 3HB ASP 55 21.724 1.939 1.411
Start of MODEL 9
1 H1 ALA 1 H ALA 1 2.768 0.971 -5.130
2 HA ALA 1 HA ALA 1 3.004 2.338 -2.622
3 HB1 ALA 1 1HB ALA 1 0.944 1.256 -2.105
4 HB2 ALA 1 2HB ALA 1 1.534 -0.289 -2.718
5 HB3 ALA 1 3HB ALA 1 2.224 0.398 -1.248
6 H LYS 2 H LYS 2 4.437 1.072 -1.090
7 HA LYS 2 HA LYS 2 6.019 -1.062 -2.136
8 HB2 LYS 2 2HB LYS 2 8.163 0.203 -2.207
9 HB3 LYS 2 3HB LYS 2 7.030 0.672 -3.467
10 HG2 LYS 2 2HG LYS 2 6.822 2.765 -2.682
11 HG3 LYS 2 3HG LYS 2 6.864 2.249 -0.995
12 HD2 LYS 2 2HD LYS 2 8.866 3.340 -1.100
13 HD3 LYS 2 3HD LYS 2 9.391 1.731 -1.602
14 HE2 LYS 2 2HE LYS 2 9.819 2.392 -3.714
15 HE3 LYS 2 3HE LYS 2 8.425 3.471 -3.768
16 HZ1 LYS 2 3HZ LYS 2 10.690 4.228 -2.075
17 HZ2 LYS 2 1HZ LYS 2 9.616 5.207 -2.942
18 HZ3 LYS 2 2HZ LYS 2 10.862 4.396 -3.750
19 H TYR 3 H TYR 3 7.568 -1.851 -0.616
20 HA TYR 3 HA TYR 3 6.924 -1.059 2.126
21 HB2 TYR 3 2HB TYR 3 8.284 -3.515 1.006
22 HB3 TYR 3 3HB TYR 3 8.075 -3.209 2.726
23 HD1 TYR 3 HD1 TYR 3 6.692 -4.785 -0.086
24 HD2 TYR 3 HD2 TYR 3 5.581 -2.699 3.452
25 HE1 TYR 3 HE1 TYR 3 4.466 -5.827 -0.178
26 HE2 TYR 3 HE2 TYR 3 3.352 -3.736 3.370
27 HH TYR 3 HH TYR 3 1.880 -4.822 1.913
28 H THR 4 H THR 4 8.562 -0.733 3.697
29 HA THR 4 HA THR 4 11.184 0.010 2.571
30 HB THR 4 HB THR 4 9.858 1.397 4.903
31 HG1 THR 4 HG1 THR 4 8.672 2.278 3.377
32 HG21 THR 4 3HG2 THR 4 12.027 2.007 5.153
33 HG22 THR 4 1HG2 THR 4 11.620 3.156 3.879
34 HG23 THR 4 2HG2 THR 4 12.435 1.644 3.476
35 H GLY 5 H GLY 5 12.955 -0.761 3.576
36 HA2 GLY 5 2HA GLY 5 12.857 -1.640 6.332
37 HA3 GLY 5 3HA GLY 5 13.019 -2.943 5.164
38 H LYS 6 H LYS 6 15.062 -3.485 6.021
39 HA LYS 6 HA LYS 6 17.213 -1.808 4.969
40 HB2 LYS 6 2HB LYS 6 17.433 -2.974 7.735
41 HB3 LYS 6 3HB LYS 6 18.458 -1.764 6.975
42 HG2 LYS 6 2HG LYS 6 17.250 -0.412 8.333
43 HG3 LYS 6 3HG LYS 6 16.185 -0.406 6.925
44 HD2 LYS 6 2HD LYS 6 14.584 -1.026 8.364
45 HD3 LYS 6 3HD LYS 6 15.335 -2.622 8.291
46 HE2 LYS 6 2HE LYS 6 16.818 -1.127 10.155
47 HE3 LYS 6 3HE LYS 6 15.120 -0.810 10.507
48 HZ1 LYS 6 3HZ LYS 6 16.647 -3.244 10.826
49 HZ2 LYS 6 1HZ LYS 6 15.115 -3.465 10.141
50 HZ3 LYS 6 2HZ LYS 6 15.267 -2.714 11.649
51 H CYS 7 H CYS 7 19.200 -2.938 4.626
52 HA CYS 7 HA CYS 7 18.832 -5.855 4.441
53 HB2 CYS 7 2HB CYS 7 20.989 -4.705 2.829
54 HB3 CYS 7 3HB CYS 7 19.709 -5.821 2.365
55 H THR 8 H THR 8 21.410 -6.629 3.945
56 HA THR 8 HA THR 8 22.994 -5.665 6.218
57 HB THR 8 HB THR 8 22.961 -8.606 5.752
58 HG1 THR 8 HG1 THR 8 20.984 -8.850 6.467
59 HG21 THR 8 3HG2 THR 8 22.821 -7.650 8.480
60 HG22 THR 8 1HG2 THR 8 24.121 -6.860 7.589
61 HG23 THR 8 2HG2 THR 8 24.066 -8.620 7.693
62 H LYS 9 H LYS 9 25.067 -5.363 5.715
63 HA LYS 9 HA LYS 9 26.033 -5.731 3.097
64 HB2 LYS 9 2HB LYS 9 28.121 -4.902 3.902
65 HB3 LYS 9 3HB LYS 9 26.856 -4.040 4.768
66 HG2 LYS 9 2HG LYS 9 28.132 -4.527 6.551
67 HG3 LYS 9 3HG LYS 9 27.275 -6.069 6.477
68 HD2 LYS 9 2HD LYS 9 29.083 -7.181 5.579
69 HD3 LYS 9 3HD LYS 9 29.776 -5.713 4.886
70 HE2 LYS 9 2HE LYS 9 29.745 -5.283 7.644
71 HE3 LYS 9 3HE LYS 9 30.268 -6.955 7.445
72 HZ1 LYS 9 3HZ LYS 9 31.920 -6.097 5.802
73 HZ2 LYS 9 1HZ LYS 9 32.190 -5.600 7.397
74 HZ3 LYS 9 2HZ LYS 9 31.510 -4.527 6.281
75 H SER 10 H SER 10 25.720 -7.915 5.661
76 HA SER 10 HA SER 10 27.888 -9.579 5.548
77 HB2 SER 10 2HB SER 10 26.305 -10.223 7.121
78 HB3 SER 10 3HB SER 10 24.967 -10.091 5.981
79 HG SER 10 HG SER 10 26.992 -12.080 5.923
80 H LYS 11 H LYS 11 24.928 -10.476 3.799
81 HA LYS 11 HA LYS 11 26.584 -11.205 1.481
82 HB2 LYS 11 2HB LYS 11 25.435 -13.049 3.208
83 HB3 LYS 11 3HB LYS 11 24.297 -12.972 1.869
84 HG2 LYS 11 2HG LYS 11 26.455 -13.223 0.412
85 HG3 LYS 11 3HG LYS 11 27.130 -13.889 1.901
86 HD2 LYS 11 2HD LYS 11 24.906 -15.297 1.889
87 HD3 LYS 11 3HD LYS 11 24.948 -14.940 0.160
88 HE2 LYS 11 2HE LYS 11 27.139 -15.933 -0.032
89 HE3 LYS 11 3HE LYS 11 27.221 -16.174 1.712
90 HZ1 LYS 11 3HZ LYS 11 25.402 -17.523 -0.202
91 HZ2 LYS 11 1HZ LYS 11 25.238 -17.636 1.478
92 HZ3 LYS 11 2HZ LYS 11 26.629 -18.230 0.722
93 H ASN 12 H ASN 12 24.631 -8.994 2.253
94 HA ASN 12 HA ASN 12 23.123 -7.683 1.165
95 HB2 ASN 12 2HB ASN 12 24.629 -8.642 -0.827
96 HB3 ASN 12 3HB ASN 12 23.100 -9.396 -1.270
97 HD21 ASN 12 2HD2 ASN 12 22.172 -6.542 -2.959
98 HD22 ASN 12 1HD2 ASN 12 22.357 -8.260 -2.920
99 H GLU 13 H GLU 13 21.080 -7.722 1.801
100 HA GLU 13 HA GLU 13 19.120 -9.411 0.718
101 HB2 GLU 13 2HB GLU 13 20.572 -10.786 2.576
102 HB3 GLU 13 3HB GLU 13 19.274 -10.136 3.567
103 HG2 GLU 13 2HG GLU 13 17.690 -11.079 1.806
104 HG3 GLU 13 3HG GLU 13 19.083 -11.983 1.216
105 H CYS 14 H CYS 14 17.926 -7.560 0.529
106 HA CYS 14 HA CYS 14 17.490 -5.764 2.711
107 HB2 CYS 14 2HB CYS 14 17.424 -5.055 0.332
108 HB3 CYS 14 3HB CYS 14 15.961 -6.010 0.112
109 H LYS 15 H LYS 15 16.165 -6.070 4.361
110 HA LYS 15 HA LYS 15 14.140 -8.151 4.238
111 HB2 LYS 15 2HB LYS 15 15.630 -7.959 6.206
112 HB3 LYS 15 3HB LYS 15 14.955 -6.370 6.542
113 HG2 LYS 15 2HG LYS 15 13.032 -8.599 6.306
114 HG3 LYS 15 3HG LYS 15 14.093 -8.605 7.717
115 HD2 LYS 15 2HD LYS 15 12.624 -6.116 6.936
116 HD3 LYS 15 3HD LYS 15 11.805 -7.386 7.848
117 HE2 LYS 15 2HE LYS 15 14.208 -7.067 9.175
118 HE3 LYS 15 3HE LYS 15 13.763 -5.423 8.723
119 HZ1 LYS 15 3HZ LYS 15 12.875 -6.065 10.894
120 HZ2 LYS 15 1HZ LYS 15 12.004 -7.324 10.175
121 HZ3 LYS 15 2HZ LYS 15 11.637 -5.718 9.794
122 H TYR 16 H TYR 16 11.935 -7.808 4.755
123 HA TYR 16 HA TYR 16 10.829 -5.220 5.136
124 HB2 TYR 16 2HB TYR 16 9.806 -4.823 3.023
125 HB3 TYR 16 3HB TYR 16 11.503 -5.157 2.696
126 HD1 TYR 16 HD1 TYR 16 8.141 -6.029 1.923
127 HD2 TYR 16 HD2 TYR 16 12.107 -7.566 2.005
128 HE1 TYR 16 HE1 TYR 16 7.481 -7.800 0.349
129 HE2 TYR 16 HE2 TYR 16 11.459 -9.340 0.430
130 HH TYR 16 HH TYR 16 9.273 -9.395 -1.482
131 H LYS 17 H LYS 17 8.302 -5.496 4.234
132 HA LYS 17 HA LYS 17 7.389 -8.029 5.433
133 HB2 LYS 17 2HB LYS 17 5.364 -6.730 6.173
134 HB3 LYS 17 3HB LYS 17 6.864 -6.290 6.978
135 HG2 LYS 17 2HG LYS 17 7.052 -4.408 5.292
136 HG3 LYS 17 3HG LYS 17 5.382 -4.775 4.852
137 HD2 LYS 17 2HD LYS 17 5.369 -4.648 7.632
138 HD3 LYS 17 3HD LYS 17 6.417 -3.319 7.129
139 HE2 LYS 17 2HE LYS 17 4.644 -2.548 5.594
140 HE3 LYS 17 3HE LYS 17 3.599 -3.838 6.186
141 HZ1 LYS 17 3HZ LYS 17 4.767 -1.753 7.942
142 HZ2 LYS 17 1HZ LYS 17 3.557 -2.869 8.333
143 HZ3 LYS 17 2HZ LYS 17 3.235 -1.623 7.236
144 H ASN 18 H ASN 18 5.865 -9.180 4.365
145 HA ASN 18 HA ASN 18 4.548 -7.956 2.049
146 HB2 ASN 18 2HB ASN 18 5.255 -9.543 0.531
147 HB3 ASN 18 3HB ASN 18 6.688 -9.412 1.546
148 HD21 ASN 18 2HD2 ASN 18 5.917 -12.530 3.255
149 HD22 ASN 18 1HD2 ASN 18 6.266 -10.886 3.660
150 H ASP 19 H ASP 19 2.775 -9.397 1.193
151 HA ASP 19 HA ASP 19 0.871 -10.616 1.481
152 HB2 ASP 19 2HB ASP 19 2.809 -11.980 3.073
153 HB3 ASP 19 3HB ASP 19 1.287 -11.954 3.959
154 H ALA 20 H ALA 20 1.834 -10.119 4.871
155 HA ALA 20 HA ALA 20 -0.073 -7.997 5.243
156 HB1 ALA 20 1HB ALA 20 -1.473 -9.156 6.872
157 HB2 ALA 20 2HB ALA 20 -1.569 -9.924 5.287
158 HB3 ALA 20 3HB ALA 20 -0.599 -10.656 6.565
159 H GLY 21 H GLY 21 2.809 -8.707 5.683
160 HA2 GLY 21 2HA GLY 21 3.926 -7.311 7.433
161 HA3 GLY 21 3HA GLY 21 2.912 -8.164 8.587
162 H LYS 22 H LYS 22 3.824 -10.261 6.162
163 HA LYS 22 HA LYS 22 5.479 -11.786 7.897
164 HB2 LYS 22 2HB LYS 22 4.405 -12.045 5.166
165 HB3 LYS 22 3HB LYS 22 5.940 -12.860 5.433
166 HG2 LYS 22 2HG LYS 22 4.913 -13.997 7.399
167 HG3 LYS 22 3HG LYS 22 3.366 -13.288 6.930
168 HD2 LYS 22 2HD LYS 22 3.937 -14.366 4.605
169 HD3 LYS 22 3HD LYS 22 4.978 -15.406 5.580
170 HE2 LYS 22 2HE LYS 22 3.238 -16.563 6.361
171 HE3 LYS 22 3HE LYS 22 2.343 -15.095 6.751
172 HZ1 LYS 22 3HZ LYS 22 2.543 -15.910 3.942
173 HZ2 LYS 22 1HZ LYS 22 1.299 -15.084 4.738
174 HZ3 LYS 22 2HZ LYS 22 1.477 -16.753 4.949
175 H ASP 23 H ASP 23 7.565 -11.533 8.307
176 HA ASP 23 HA ASP 23 9.163 -9.597 7.005
177 HB2 ASP 23 2HB ASP 23 9.805 -11.810 8.951
178 HB3 ASP 23 3HB ASP 23 11.043 -10.727 8.320
179 H THR 24 H THR 24 9.993 -9.753 5.039
180 HA THR 24 HA THR 24 11.020 -12.367 4.148
181 HB THR 24 HB THR 24 9.585 -10.321 2.444
182 HG1 THR 24 HG1 THR 24 8.857 -13.015 3.006
183 HG21 THR 24 3HG2 THR 24 10.833 -12.967 1.692
184 HG22 THR 24 1HG2 THR 24 11.401 -11.371 1.203
185 HG23 THR 24 2HG2 THR 24 9.843 -11.967 0.630
186 H PHE 25 H PHE 25 12.925 -12.366 2.982
187 HA PHE 25 HA PHE 25 14.347 -9.787 2.894
188 HB2 PHE 25 2HB PHE 25 15.645 -12.506 3.057
189 HB3 PHE 25 3HB PHE 25 16.394 -10.935 3.320
190 HD1 PHE 25 HD1 PHE 25 16.236 -9.822 5.420
191 HD2 PHE 25 HD2 PHE 25 14.131 -13.458 4.738
192 HE1 PHE 25 HE1 PHE 25 15.786 -10.010 7.832
193 HE2 PHE 25 HE2 PHE 25 13.677 -13.651 7.149
194 HZ PHE 25 HZ PHE 25 14.504 -11.925 8.699
195 H ILE 26 H ILE 26 15.527 -9.250 1.076
196 HA ILE 26 HA ILE 26 15.740 -11.091 -1.141
197 HB ILE 26 HB ILE 26 13.491 -10.282 -1.521
198 HG12 ILE 26 2HG1 ILE 26 13.779 -9.316 -3.760
199 HG13 ILE 26 3HG1 ILE 26 15.452 -8.920 -3.383
200 HG21 ILE 26 1HG2 ILE 26 14.482 -7.884 -0.441
201 HG22 ILE 26 2HG2 ILE 26 13.990 -7.523 -2.094
202 HG23 ILE 26 3HG2 ILE 26 12.836 -8.236 -0.967
203 HD11 ILE 26 3HD1 ILE 26 14.619 -11.166 -4.661
204 HD12 ILE 26 1HD1 ILE 26 16.156 -10.992 -3.814
205 HD13 ILE 26 2HD1 ILE 26 14.779 -11.736 -3.000
206 H LYS 27 H LYS 27 17.656 -10.765 -2.040
207 HA LYS 27 HA LYS 27 19.361 -8.647 -1.341
208 HB2 LYS 27 2HB LYS 27 19.625 -10.326 -3.833
209 HB3 LYS 27 3HB LYS 27 20.909 -9.556 -2.911
210 HG2 LYS 27 2HG LYS 27 21.195 -11.475 -1.847
211 HG3 LYS 27 3HG LYS 27 19.616 -11.233 -1.096
212 HD2 LYS 27 2HD LYS 27 18.963 -12.208 -3.580
213 HD3 LYS 27 3HD LYS 27 20.435 -13.099 -3.188
214 HE2 LYS 27 2HE LYS 27 19.493 -14.080 -1.309
215 HE3 LYS 27 3HE LYS 27 18.248 -12.840 -1.164
216 HZ1 LYS 27 3HZ LYS 27 18.341 -14.748 -3.428
217 HZ2 LYS 27 1HZ LYS 27 17.059 -13.748 -2.961
218 HZ3 LYS 27 2HZ LYS 27 17.493 -15.070 -2.000
219 H CYS 28 H CYS 28 20.557 -7.719 -3.613
220 HA CYS 28 HA CYS 28 18.437 -6.054 -4.800
221 HB2 CYS 28 2HB CYS 28 20.363 -5.054 -3.335
222 HB3 CYS 28 3HB CYS 28 21.328 -5.260 -4.793
223 HA PRO 29 HA PRO 29 20.087 -8.638 -8.260
224 HB2 PRO 29 2HB PRO 29 17.664 -9.012 -9.427
225 HB3 PRO 29 3HB PRO 29 18.274 -10.043 -8.127
226 HG2 PRO 29 2HG PRO 29 16.346 -7.756 -7.985
227 HG3 PRO 29 3HG PRO 29 16.273 -9.333 -7.177
228 HD2 PRO 29 2HD PRO 29 17.104 -7.087 -5.915
229 HD3 PRO 29 3HD PRO 29 17.746 -8.695 -5.523
230 H LYS 30 H LYS 30 18.261 -5.728 -7.977
231 HA LYS 30 HA LYS 30 17.924 -4.989 -10.642
232 HB2 LYS 30 2HB LYS 30 18.337 -3.383 -8.129
233 HB3 LYS 30 3HB LYS 30 18.114 -2.604 -9.690
234 HG2 LYS 30 2HG LYS 30 16.156 -4.592 -8.579
235 HG3 LYS 30 3HG LYS 30 16.056 -2.860 -8.252
236 HD2 LYS 30 2HD LYS 30 14.816 -2.770 -10.117
237 HD3 LYS 30 3HD LYS 30 16.354 -2.918 -10.972
238 HE2 LYS 30 2HE LYS 30 16.053 -5.187 -11.373
239 HE3 LYS 30 3HE LYS 30 14.870 -5.360 -10.078
240 HZ1 LYS 30 3HZ LYS 30 13.797 -3.539 -11.852
241 HZ2 LYS 30 1HZ LYS 30 13.309 -5.142 -11.615
242 HZ3 LYS 30 2HZ LYS 30 14.442 -4.771 -12.815
243 H PHE 31 H PHE 31 20.489 -3.756 -8.488
244 HA PHE 31 HA PHE 31 22.195 -3.432 -10.862
245 HB2 PHE 31 2HB PHE 31 22.979 -2.158 -8.304
246 HB3 PHE 31 3HB PHE 31 23.072 -1.536 -9.949
247 HD1 PHE 31 HD1 PHE 31 20.888 -2.005 -7.033
248 HD2 PHE 31 HD2 PHE 31 21.294 -0.259 -10.893
249 HE1 PHE 31 HE1 PHE 31 18.884 -0.639 -6.621
250 HE2 PHE 31 HE2 PHE 31 19.291 1.111 -10.488
251 HZ PHE 31 HZ PHE 31 18.084 0.923 -8.350
252 H ASP 32 H ASP 32 24.613 -3.570 -10.292
253 HA ASP 32 HA ASP 32 25.063 -5.877 -8.515
254 HB2 ASP 32 2HB ASP 32 25.481 -5.697 -11.331
255 HB3 ASP 32 3HB ASP 32 27.056 -5.820 -10.550
256 H ASN 33 H ASN 33 25.686 -2.686 -9.002
257 HA ASN 33 HA ASN 33 28.230 -2.854 -7.528
258 HB2 ASN 33 2HB ASN 33 27.809 -1.714 -10.082
259 HB3 ASN 33 3HB ASN 33 28.027 -0.371 -8.962
260 HD21 ASN 33 2HD2 ASN 33 31.073 -3.098 -9.217
261 HD22 ASN 33 1HD2 ASN 33 29.426 -3.622 -9.243
262 H LYS 34 H LYS 34 25.080 -2.053 -7.316
263 HA LYS 34 HA LYS 34 25.606 0.082 -5.354
264 HB2 LYS 34 2HB LYS 34 23.090 -0.265 -6.992
265 HB3 LYS 34 3HB LYS 34 23.436 1.041 -5.866
266 HG2 LYS 34 2HG LYS 34 25.021 0.501 -8.366
267 HG3 LYS 34 3HG LYS 34 23.693 1.659 -8.255
268 HD2 LYS 34 2HD LYS 34 25.832 1.893 -6.223
269 HD3 LYS 34 3HD LYS 34 26.263 2.329 -7.879
270 HE2 LYS 34 2HE LYS 34 24.231 3.805 -7.909
271 HE3 LYS 34 3HE LYS 34 24.059 3.488 -6.183
272 HZ1 LYS 34 3HZ LYS 34 26.670 4.242 -6.494
273 HZ2 LYS 34 1HZ LYS 34 25.417 5.200 -5.882
274 HZ3 LYS 34 2HZ LYS 34 25.823 5.284 -7.522
275 H LYS 35 H LYS 35 25.028 -3.043 -5.500
276 HA LYS 35 HA LYS 35 22.731 -3.642 -4.097
277 HB2 LYS 35 2HB LYS 35 24.042 -5.620 -3.209
278 HB3 LYS 35 3HB LYS 35 24.017 -5.437 -4.958
279 HG2 LYS 35 2HG LYS 35 26.267 -4.110 -3.634
280 HG3 LYS 35 3HG LYS 35 26.243 -5.867 -3.466
281 HD2 LYS 35 2HD LYS 35 25.597 -5.214 -6.160
282 HD3 LYS 35 3HD LYS 35 27.046 -4.314 -5.703
283 HE2 LYS 35 2HE LYS 35 27.011 -7.118 -4.835
284 HE3 LYS 35 3HE LYS 35 27.024 -6.889 -6.583
285 HZ1 LYS 35 3HZ LYS 35 29.177 -6.455 -6.466
286 HZ2 LYS 35 1HZ LYS 35 29.159 -6.653 -4.785
287 HZ3 LYS 35 2HZ LYS 35 28.881 -5.127 -5.460
288 H CYS 36 H CYS 36 22.332 -4.093 -1.863
289 HA CYS 36 HA CYS 36 23.017 -2.051 -0.114
290 HB2 CYS 36 2HB CYS 36 21.841 -4.779 0.243
291 HB3 CYS 36 3HB CYS 36 22.300 -3.853 1.668
292 H THR 37 H THR 37 25.031 -1.573 0.485
293 HA THR 37 HA THR 37 26.782 -3.773 1.367
294 HB THR 37 HB THR 37 27.701 -2.652 -0.590
295 HG1 THR 37 HG1 THR 37 29.683 -2.503 0.266
296 HG21 THR 37 3HG2 THR 37 28.504 -0.152 0.213
297 HG22 THR 37 1HG2 THR 37 26.873 -0.260 0.874
298 HG23 THR 37 2HG2 THR 37 27.142 -0.494 -0.854
299 H LYS 38 H LYS 38 24.985 -2.843 3.187
300 HA LYS 38 HA LYS 38 26.717 -1.833 5.243
301 HB2 LYS 38 2HB LYS 38 25.131 0.024 3.772
302 HB3 LYS 38 3HB LYS 38 24.454 -0.107 5.389
303 HG2 LYS 38 2HG LYS 38 27.388 0.184 5.202
304 HG3 LYS 38 3HG LYS 38 26.414 1.588 4.757
305 HD2 LYS 38 2HD LYS 38 25.833 1.990 6.884
306 HD3 LYS 38 3HD LYS 38 25.512 0.285 7.209
307 HE2 LYS 38 2HE LYS 38 27.770 -0.149 7.714
308 HE3 LYS 38 3HE LYS 38 28.305 1.373 7.003
309 HZ1 LYS 38 3HZ LYS 38 27.965 1.015 9.612
310 HZ2 LYS 38 1HZ LYS 38 26.427 1.593 9.207
311 HZ3 LYS 38 2HZ LYS 38 27.798 2.519 8.855
312 H ASP 39 H ASP 39 25.803 -2.010 7.350
313 HA ASP 39 HA ASP 39 23.743 -4.049 7.495
314 HB2 ASP 39 2HB ASP 39 24.308 -4.080 9.922
315 HB3 ASP 39 3HB ASP 39 25.699 -4.364 8.879
316 H ASN 40 H ASN 40 21.667 -3.582 7.727
317 HA ASN 40 HA ASN 40 19.730 -2.547 8.323
318 HB2 ASN 40 2HB ASN 40 21.218 -0.785 10.244
319 HB3 ASN 40 3HB ASN 40 19.605 -1.476 10.393
320 HD21 ASN 40 2HD2 ASN 40 22.472 -3.223 12.323
321 HD22 ASN 40 1HD2 ASN 40 22.332 -1.556 11.894
322 H ASN 41 H ASN 41 21.068 -1.586 6.094
323 HA ASN 41 HA ASN 41 21.206 1.287 6.178
324 HB2 ASN 41 2HB ASN 41 21.635 1.122 3.766
325 HB3 ASN 41 3HB ASN 41 22.657 0.006 4.668
326 HD21 ASN 41 2HD2 ASN 41 21.467 -2.837 3.105
327 HD22 ASN 41 1HD2 ASN 41 22.543 -2.119 4.250
328 H LYS 42 H LYS 42 20.024 2.117 3.869
329 HA LYS 42 HA LYS 42 17.173 1.788 4.499
330 HB2 LYS 42 2HB LYS 42 18.392 4.082 4.516
331 HB3 LYS 42 3HB LYS 42 18.293 3.969 2.764
332 HG2 LYS 42 2HG LYS 42 15.761 3.437 4.115
333 HG3 LYS 42 3HG LYS 42 16.396 5.060 4.394
334 HD2 LYS 42 2HD LYS 42 16.786 4.995 1.791
335 HD3 LYS 42 3HD LYS 42 15.518 3.768 1.855
336 HE2 LYS 42 2HE LYS 42 14.975 6.208 3.403
337 HE3 LYS 42 3HE LYS 42 15.075 6.440 1.658
338 HZ1 LYS 42 3HZ LYS 42 13.540 4.266 1.795
339 HZ2 LYS 42 1HZ LYS 42 12.926 5.842 1.748
340 HZ3 LYS 42 2HZ LYS 42 13.080 5.039 3.228
341 H CYS 43 H CYS 43 16.203 0.339 3.241
342 HA CYS 43 HA CYS 43 16.448 0.595 0.352
343 HB2 CYS 43 2HB CYS 43 16.860 -1.780 0.002
344 HB3 CYS 43 3HB CYS 43 18.150 -1.083 0.976
345 H THR 44 H THR 44 14.568 0.223 -0.685
346 HA THR 44 HA THR 44 12.316 -0.749 0.944
347 HB THR 44 HB THR 44 10.933 0.428 -0.899
348 HG1 THR 44 HG1 THR 44 12.250 1.164 -2.410
349 HG21 THR 44 3HG2 THR 44 12.365 1.547 1.415
350 HG22 THR 44 1HG2 THR 44 10.645 1.566 1.030
351 HG23 THR 44 2HG2 THR 44 11.729 2.738 0.281
352 H VAL 45 H VAL 45 10.858 -2.231 0.081
353 HA VAL 45 HA VAL 45 11.794 -3.631 -2.339
354 HB VAL 45 HB VAL 45 10.333 -4.791 0.038
355 HG11 VAL 45 1HG1 VAL 45 11.239 -6.915 -1.361
356 HG12 VAL 45 2HG1 VAL 45 9.615 -6.245 -1.529
357 HG13 VAL 45 3HG1 VAL 45 10.879 -5.797 -2.675
358 HG21 VAL 45 3HG2 VAL 45 12.967 -5.844 -0.698
359 HG22 VAL 45 1HG2 VAL 45 12.983 -4.176 -0.124
360 HG23 VAL 45 2HG2 VAL 45 12.304 -5.451 0.888
361 H ASP 46 H ASP 46 10.298 -4.285 -3.861
362 HA ASP 46 HA ASP 46 7.606 -3.128 -3.554
363 HB2 ASP 46 2HB ASP 46 9.549 -2.896 -5.646
364 HB3 ASP 46 3HB ASP 46 8.122 -3.711 -6.282
365 H THR 47 H THR 47 5.858 -4.402 -3.770
366 HA THR 47 HA THR 47 6.336 -7.241 -4.390
367 HB THR 47 HB THR 47 5.493 -6.768 -2.102
368 HG1 THR 47 HG1 THR 47 3.501 -8.090 -3.640
369 HG21 THR 47 3HG2 THR 47 4.125 -4.792 -2.677
370 HG22 THR 47 1HG2 THR 47 3.210 -6.004 -1.781
371 HG23 THR 47 2HG2 THR 47 2.992 -5.845 -3.524
372 H TYR 48 H TYR 48 5.411 -4.643 -5.978
373 HA TYR 48 HA TYR 48 3.200 -5.994 -7.382
374 HB2 TYR 48 2HB TYR 48 2.692 -3.782 -6.233
375 HB3 TYR 48 3HB TYR 48 3.743 -3.026 -7.424
376 HD1 TYR 48 HD1 TYR 48 3.129 -3.167 -9.857
377 HD2 TYR 48 HD2 TYR 48 0.461 -4.361 -6.765
378 HE1 TYR 48 HE1 TYR 48 1.247 -3.022 -11.433
379 HE2 TYR 48 HE2 TYR 48 -1.428 -4.221 -8.333
380 HH TYR 48 HH TYR 48 -1.483 -4.412 -11.170
381 H ASN 49 H ASN 49 6.345 -4.617 -7.625
382 HA ASN 49 HA ASN 49 6.306 -5.037 -10.542
383 HB2 ASN 49 2HB ASN 49 6.668 -2.711 -10.171
384 HB3 ASN 49 3HB ASN 49 7.834 -3.027 -8.889
385 HD21 ASN 49 2HD2 ASN 49 10.552 -3.514 -11.021
386 HD22 ASN 49 1HD2 ASN 49 9.913 -3.712 -9.428
387 H ASN 50 H ASN 50 7.562 -6.060 -7.586
388 HA ASN 50 HA ASN 50 9.102 -7.631 -7.010
389 HB2 ASN 50 2HB ASN 50 8.032 -8.722 -9.111
390 HB3 ASN 50 3HB ASN 50 9.534 -8.274 -9.914
391 HD21 ASN 50 2HD2 ASN 50 9.407 -11.330 -7.248
392 HD22 ASN 50 1HD2 ASN 50 8.074 -10.251 -7.455
393 H ALA 51 H ALA 51 10.486 -5.881 -6.361
394 HA ALA 51 HA ALA 51 13.101 -6.085 -7.339
395 HB1 ALA 51 1HB ALA 51 12.301 -3.334 -7.976
396 HB2 ALA 51 2HB ALA 51 13.399 -4.425 -8.822
397 HB3 ALA 51 3HB ALA 51 11.657 -4.566 -9.062
398 H VAL 52 H VAL 52 14.564 -4.397 -6.363
399 HA VAL 52 HA VAL 52 13.403 -3.254 -3.911
400 HB VAL 52 HB VAL 52 14.773 -5.439 -3.621
401 HG11 VAL 52 1HG1 VAL 52 16.635 -4.612 -5.083
402 HG12 VAL 52 2HG1 VAL 52 17.056 -3.482 -3.795
403 HG13 VAL 52 3HG1 VAL 52 17.142 -5.220 -3.508
404 HG21 VAL 52 3HG2 VAL 52 15.561 -4.698 -1.467
405 HG22 VAL 52 1HG2 VAL 52 15.519 -3.015 -1.990
406 HG23 VAL 52 2HG2 VAL 52 14.016 -3.920 -1.812
407 H ASP 53 H ASP 53 14.709 -1.528 -2.952
408 HA ASP 53 HA ASP 53 16.307 -0.101 -4.977
409 HB2 ASP 53 2HB ASP 53 14.151 0.855 -3.144
410 HB3 ASP 53 3HB ASP 53 15.468 1.958 -3.536
411 H CYS 54 H CYS 54 17.885 -1.607 -3.679
412 HA CYS 54 HA CYS 54 18.694 -1.105 -1.096
413 HB2 CYS 54 2HB CYS 54 21.005 -1.792 -1.923
414 HB3 CYS 54 3HB CYS 54 19.695 -2.928 -2.226
415 H ASP 55 H ASP 55 20.433 0.146 -0.212
416 HA ASP 55 HA ASP 55 20.388 2.856 -1.037
417 HB2 ASP 55 2HB ASP 55 20.718 2.538 1.262
418 HB3 ASP 55 3HB ASP 55 21.966 1.321 1.008
Start of MODEL 10
1 H1 ALA 1 H ALA 1 3.247 2.442 -2.883
2 HA ALA 1 HA ALA 1 2.153 1.305 -0.634
3 HB1 ALA 1 1HB ALA 1 1.004 0.150 -3.156
4 HB2 ALA 1 2HB ALA 1 1.104 -0.780 -1.660
5 HB3 ALA 1 3HB ALA 1 0.158 0.707 -1.711
6 H LYS 2 H LYS 2 4.637 1.599 -0.969
7 HA LYS 2 HA LYS 2 5.768 -0.934 -1.960
8 HB2 LYS 2 2HB LYS 2 7.948 0.365 -1.990
9 HB3 LYS 2 3HB LYS 2 6.747 0.842 -3.182
10 HG2 LYS 2 2HG LYS 2 6.631 2.910 -2.378
11 HG3 LYS 2 3HG LYS 2 6.488 2.340 -0.714
12 HD2 LYS 2 2HD LYS 2 8.511 3.321 -0.495
13 HD3 LYS 2 3HD LYS 2 9.087 1.799 -1.178
14 HE2 LYS 2 2HE LYS 2 10.004 2.965 -2.832
15 HE3 LYS 2 3HE LYS 2 8.379 3.387 -3.369
16 HZ1 LYS 2 3HZ LYS 2 9.522 5.404 -3.086
17 HZ2 LYS 2 1HZ LYS 2 10.167 4.940 -1.592
18 HZ3 LYS 2 2HZ LYS 2 8.515 5.276 -1.732
19 H TYR 3 H TYR 3 6.909 -2.217 -0.611
20 HA TYR 3 HA TYR 3 6.713 -1.722 2.208
21 HB2 TYR 3 2HB TYR 3 8.216 -3.945 0.816
22 HB3 TYR 3 3HB TYR 3 7.655 -3.924 2.484
23 HD1 TYR 3 HD1 TYR 3 5.050 -3.616 2.770
24 HD2 TYR 3 HD2 TYR 3 6.936 -5.037 -0.769
25 HE1 TYR 3 HE1 TYR 3 2.940 -4.675 2.078
26 HE2 TYR 3 HE2 TYR 3 4.832 -6.099 -1.471
27 HH TYR 3 HH TYR 3 1.859 -5.708 0.408
28 H THR 4 H THR 4 8.114 -0.626 3.393
29 HA THR 4 HA THR 4 10.803 -0.133 2.335
30 HB THR 4 HB THR 4 9.412 1.230 4.648
31 HG1 THR 4 HG1 THR 4 8.333 1.827 2.807
32 HG21 THR 4 3HG2 THR 4 11.935 1.901 3.131
33 HG22 THR 4 1HG2 THR 4 11.826 1.380 4.811
34 HG23 THR 4 2HG2 THR 4 11.170 2.944 4.329
35 H GLY 5 H GLY 5 12.617 -0.842 3.322
36 HA2 GLY 5 2HA GLY 5 12.574 -1.757 6.067
37 HA3 GLY 5 3HA GLY 5 12.767 -3.039 4.881
38 H LYS 6 H LYS 6 14.835 -3.532 5.695
39 HA LYS 6 HA LYS 6 16.919 -1.767 4.655
40 HB2 LYS 6 2HB LYS 6 17.207 -2.974 7.396
41 HB3 LYS 6 3HB LYS 6 18.183 -1.717 6.648
42 HG2 LYS 6 2HG LYS 6 16.946 -0.432 8.046
43 HG3 LYS 6 3HG LYS 6 15.868 -0.433 6.648
44 HD2 LYS 6 2HD LYS 6 14.331 -1.767 7.664
45 HD3 LYS 6 3HD LYS 6 15.547 -2.643 8.596
46 HE2 LYS 6 2HE LYS 6 15.740 -0.149 9.664
47 HE3 LYS 6 3HE LYS 6 14.024 -0.223 9.267
48 HZ1 LYS 6 3HZ LYS 6 13.643 -1.670 10.901
49 HZ2 LYS 6 1HZ LYS 6 15.159 -1.227 11.508
50 HZ3 LYS 6 2HZ LYS 6 15.006 -2.605 10.539
51 H CYS 7 H CYS 7 18.940 -2.826 4.277
52 HA CYS 7 HA CYS 7 18.645 -5.740 3.985
53 HB2 CYS 7 2HB CYS 7 20.829 -4.430 2.513
54 HB3 CYS 7 3HB CYS 7 19.647 -5.613 1.961
55 H THR 8 H THR 8 21.239 -6.471 3.561
56 HA THR 8 HA THR 8 22.745 -5.573 5.911
57 HB THR 8 HB THR 8 22.943 -8.462 5.497
58 HG1 THR 8 HG1 THR 8 20.798 -8.586 5.224
59 HG21 THR 8 3HG2 THR 8 23.951 -7.432 7.410
60 HG22 THR 8 1HG2 THR 8 22.604 -8.415 7.981
61 HG23 THR 8 2HG2 THR 8 22.431 -6.664 7.865
62 H LYS 9 H LYS 9 24.738 -5.062 5.319
63 HA LYS 9 HA LYS 9 25.795 -5.494 2.769
64 HB2 LYS 9 2HB LYS 9 27.816 -4.543 3.584
65 HB3 LYS 9 3HB LYS 9 26.507 -3.741 4.442
66 HG2 LYS 9 2HG LYS 9 27.760 -4.162 6.249
67 HG3 LYS 9 3HG LYS 9 27.045 -5.772 6.142
68 HD2 LYS 9 2HD LYS 9 29.198 -6.445 6.156
69 HD3 LYS 9 3HD LYS 9 29.126 -6.044 4.439
70 HE2 LYS 9 2HE LYS 9 29.696 -3.628 5.642
71 HE3 LYS 9 3HE LYS 9 30.624 -4.785 6.594
72 HZ1 LYS 9 3HZ LYS 9 30.764 -5.078 3.702
73 HZ2 LYS 9 1HZ LYS 9 31.975 -5.261 4.870
74 HZ3 LYS 9 2HZ LYS 9 31.525 -3.715 4.352
75 H SER 10 H SER 10 25.641 -7.570 5.482
76 HA SER 10 HA SER 10 27.881 -9.155 5.278
77 HB2 SER 10 2HB SER 10 25.091 -9.593 6.186
78 HB3 SER 10 3HB SER 10 26.041 -11.042 5.854
79 HG SER 10 HG SER 10 26.211 -10.245 8.041
80 H LYS 11 H LYS 11 24.795 -10.325 3.972
81 HA LYS 11 HA LYS 11 26.230 -11.213 1.559
82 HB2 LYS 11 2HB LYS 11 24.931 -12.820 3.553
83 HB3 LYS 11 3HB LYS 11 24.079 -12.991 2.024
84 HG2 LYS 11 2HG LYS 11 26.911 -13.128 1.589
85 HG3 LYS 11 3HG LYS 11 26.424 -14.282 2.833
86 HD2 LYS 11 2HD LYS 11 24.607 -15.039 1.259
87 HD3 LYS 11 3HD LYS 11 25.379 -14.050 0.017
88 HE2 LYS 11 2HE LYS 11 27.373 -15.649 1.269
89 HE3 LYS 11 3HE LYS 11 26.021 -16.691 0.830
90 HZ1 LYS 11 3HZ LYS 11 27.778 -16.374 -0.915
91 HZ2 LYS 11 1HZ LYS 11 27.244 -14.776 -1.070
92 HZ3 LYS 11 2HZ LYS 11 26.193 -16.056 -1.416
93 H ASN 12 H ASN 12 24.257 -8.975 2.411
94 HA ASN 12 HA ASN 12 22.663 -7.739 1.357
95 HB2 ASN 12 2HB ASN 12 24.008 -9.050 -0.707
96 HB3 ASN 12 3HB ASN 12 22.302 -9.337 -1.041
97 HD21 ASN 12 2HD2 ASN 12 22.210 -6.293 -2.672
98 HD22 ASN 12 1HD2 ASN 12 21.993 -8.006 -2.724
99 H GLU 13 H GLU 13 20.574 -7.726 1.860
100 HA GLU 13 HA GLU 13 18.692 -9.643 1.069
101 HB2 GLU 13 2HB GLU 13 20.170 -10.325 3.453
102 HB3 GLU 13 3HB GLU 13 18.467 -10.103 3.831
103 HG2 GLU 13 2HG GLU 13 17.806 -11.793 2.333
104 HG3 GLU 13 3HG GLU 13 19.393 -11.840 1.567
105 H CYS 14 H CYS 14 17.672 -7.664 0.564
106 HA CYS 14 HA CYS 14 17.058 -5.698 2.519
107 HB2 CYS 14 2HB CYS 14 17.099 -5.468 -0.051
108 HB3 CYS 14 3HB CYS 14 15.470 -6.135 -0.001
109 H LYS 15 H LYS 15 15.832 -6.133 4.232
110 HA LYS 15 HA LYS 15 13.772 -8.133 4.186
111 HB2 LYS 15 2HB LYS 15 15.273 -7.466 6.168
112 HB3 LYS 15 3HB LYS 15 14.182 -6.102 6.370
113 HG2 LYS 15 2HG LYS 15 12.973 -8.800 6.181
114 HG3 LYS 15 3HG LYS 15 13.849 -8.392 7.659
115 HD2 LYS 15 2HD LYS 15 11.989 -6.329 6.680
116 HD3 LYS 15 3HD LYS 15 11.235 -7.828 7.230
117 HE2 LYS 15 2HE LYS 15 13.150 -7.269 9.160
118 HE3 LYS 15 3HE LYS 15 12.465 -5.695 8.761
119 HZ1 LYS 15 3HZ LYS 15 11.373 -7.621 10.411
120 HZ2 LYS 15 1HZ LYS 15 10.414 -7.629 9.018
121 HZ3 LYS 15 2HZ LYS 15 10.636 -6.193 9.882
122 H TYR 16 H TYR 16 11.536 -7.783 4.590
123 HA TYR 16 HA TYR 16 10.359 -5.205 4.633
124 HB2 TYR 16 2HB TYR 16 9.407 -5.085 2.435
125 HB3 TYR 16 3HB TYR 16 11.143 -5.311 2.251
126 HD1 TYR 16 HD1 TYR 16 7.952 -6.448 1.251
127 HD2 TYR 16 HD2 TYR 16 11.934 -7.783 1.932
128 HE1 TYR 16 HE1 TYR 16 7.537 -8.400 -0.187
129 HE2 TYR 16 HE2 TYR 16 11.531 -9.738 0.495
130 HH TYR 16 HH TYR 16 9.444 -10.044 -1.653
131 H LYS 17 H LYS 17 7.892 -5.655 3.599
132 HA LYS 17 HA LYS 17 6.967 -8.062 5.025
133 HB2 LYS 17 2HB LYS 17 6.272 -6.210 6.331
134 HB3 LYS 17 3HB LYS 17 5.783 -5.294 4.911
135 HG2 LYS 17 2HG LYS 17 3.980 -6.960 4.529
136 HG3 LYS 17 3HG LYS 17 4.426 -7.723 6.058
137 HD2 LYS 17 2HD LYS 17 3.521 -4.864 5.714
138 HD3 LYS 17 3HD LYS 17 2.529 -6.191 6.324
139 HE2 LYS 17 2HE LYS 17 3.227 -5.537 8.348
140 HE3 LYS 17 3HE LYS 17 4.740 -6.338 7.926
141 HZ1 LYS 17 3HZ LYS 17 4.249 -3.504 7.244
142 HZ2 LYS 17 1HZ LYS 17 5.726 -4.324 7.344
143 HZ3 LYS 17 2HZ LYS 17 4.866 -3.955 8.753
144 H ASN 18 H ASN 18 5.308 -9.258 4.112
145 HA ASN 18 HA ASN 18 4.414 -8.440 1.433
146 HB2 ASN 18 2HB ASN 18 4.496 -11.154 1.194
147 HB3 ASN 18 3HB ASN 18 5.767 -10.070 0.636
148 HD21 ASN 18 2HD2 ASN 18 6.465 -12.724 3.544
149 HD22 ASN 18 1HD2 ASN 18 4.983 -12.639 2.661
150 H ASP 19 H ASP 19 3.842 -11.333 3.414
151 HA ASP 19 HA ASP 19 1.128 -11.536 2.866
152 HB2 ASP 19 2HB ASP 19 2.828 -12.535 5.135
153 HB3 ASP 19 3HB ASP 19 1.092 -12.830 5.114
154 H ALA 20 H ALA 20 2.290 -10.715 6.122
155 HA ALA 20 HA ALA 20 0.540 -8.396 6.224
156 HB1 ALA 20 1HB ALA 20 -0.664 -9.150 8.200
157 HB2 ALA 20 2HB ALA 20 -0.939 -10.246 6.845
158 HB3 ALA 20 3HB ALA 20 0.175 -10.701 8.134
159 H GLY 21 H GLY 21 2.820 -10.520 7.897
160 HA2 GLY 21 2HA GLY 21 4.269 -8.211 8.869
161 HA3 GLY 21 3HA GLY 21 3.503 -9.167 10.130
162 H LYS 22 H LYS 22 4.586 -10.817 7.307
163 HA LYS 22 HA LYS 22 6.537 -12.264 8.889
164 HB2 LYS 22 2HB LYS 22 5.213 -12.644 6.251
165 HB3 LYS 22 3HB LYS 22 6.785 -13.397 6.483
166 HG2 LYS 22 2HG LYS 22 5.286 -15.056 7.095
167 HG3 LYS 22 3HG LYS 22 5.780 -14.360 8.640
168 HD2 LYS 22 2HD LYS 22 3.581 -12.845 7.782
169 HD3 LYS 22 3HD LYS 22 3.158 -14.530 7.469
170 HE2 LYS 22 2HE LYS 22 4.191 -13.473 10.098
171 HE3 LYS 22 3HE LYS 22 2.490 -13.742 9.724
172 HZ1 LYS 22 3HZ LYS 22 4.629 -15.712 10.148
173 HZ2 LYS 22 1HZ LYS 22 3.317 -16.118 9.159
174 HZ3 LYS 22 2HZ LYS 22 3.057 -15.684 10.773
175 H ASP 23 H ASP 23 8.446 -11.292 9.160
176 HA ASP 23 HA ASP 23 9.588 -9.393 7.445
177 HB2 ASP 23 2HB ASP 23 11.209 -11.173 9.253
178 HB3 ASP 23 3HB ASP 23 11.504 -9.491 8.818
179 H THR 24 H THR 24 9.716 -10.021 5.329
180 HA THR 24 HA THR 24 11.264 -12.440 4.710
181 HB THR 24 HB THR 24 9.551 -10.779 2.852
182 HG1 THR 24 HG1 THR 24 8.492 -12.052 4.614
183 HG21 THR 24 3HG2 THR 24 11.237 -13.210 2.511
184 HG22 THR 24 1HG2 THR 24 10.957 -11.868 1.403
185 HG23 THR 24 2HG2 THR 24 9.723 -13.111 1.613
186 H PHE 25 H PHE 25 13.146 -12.363 3.585
187 HA PHE 25 HA PHE 25 14.232 -9.685 3.041
188 HB2 PHE 25 2HB PHE 25 15.715 -12.288 3.470
189 HB3 PHE 25 3HB PHE 25 16.449 -10.703 3.248
190 HD1 PHE 25 HD1 PHE 25 16.793 -9.271 5.063
191 HD2 PHE 25 HD2 PHE 25 14.276 -12.675 5.506
192 HE1 PHE 25 HE1 PHE 25 16.713 -8.891 7.493
193 HE2 PHE 25 HE2 PHE 25 14.192 -12.300 7.936
194 HZ PHE 25 HZ PHE 25 15.411 -10.406 8.933
195 H ILE 26 H ILE 26 15.004 -9.150 1.057
196 HA ILE 26 HA ILE 26 15.018 -11.226 -1.024
197 HB ILE 26 HB ILE 26 12.914 -10.058 -1.284
198 HG12 ILE 26 2HG1 ILE 26 13.191 -9.229 -3.588
199 HG13 ILE 26 3HG1 ILE 26 14.933 -9.152 -3.349
200 HG21 ILE 26 1HG2 ILE 26 12.681 -7.921 -0.740
201 HG22 ILE 26 2HG2 ILE 26 14.416 -7.809 -0.453
202 HG23 ILE 26 3HG2 ILE 26 13.763 -7.455 -2.052
203 HD11 ILE 26 3HD1 ILE 26 13.363 -11.698 -3.099
204 HD12 ILE 26 1HD1 ILE 26 14.076 -11.144 -4.614
205 HD13 ILE 26 2HD1 ILE 26 15.111 -11.502 -3.231
206 H LYS 27 H LYS 27 16.846 -11.245 -2.148
207 HA LYS 27 HA LYS 27 19.009 -9.580 -1.647
208 HB2 LYS 27 2HB LYS 27 20.054 -10.574 -3.599
209 HB3 LYS 27 3HB LYS 27 19.174 -11.807 -2.705
210 HG2 LYS 27 2HG LYS 27 17.466 -11.907 -4.310
211 HG3 LYS 27 3HG LYS 27 17.974 -10.394 -5.064
212 HD2 LYS 27 2HD LYS 27 19.727 -11.378 -6.173
213 HD3 LYS 27 3HD LYS 27 19.901 -12.665 -4.977
214 HE2 LYS 27 2HE LYS 27 17.376 -13.078 -6.012
215 HE3 LYS 27 3HE LYS 27 18.316 -12.578 -7.417
216 HZ1 LYS 27 3HZ LYS 27 18.846 -14.862 -5.605
217 HZ2 LYS 27 1HZ LYS 27 19.982 -14.295 -6.723
218 HZ3 LYS 27 2HZ LYS 27 18.502 -14.911 -7.260
219 H CYS 28 H CYS 28 20.155 -8.440 -3.650
220 HA CYS 28 HA CYS 28 18.227 -6.444 -4.631
221 HB2 CYS 28 2HB CYS 28 20.364 -5.942 -3.096
222 HB3 CYS 28 3HB CYS 28 21.145 -5.876 -4.672
223 HA PRO 29 HA PRO 29 19.497 -8.691 -8.434
224 HB2 PRO 29 2HB PRO 29 17.097 -8.385 -9.666
225 HB3 PRO 29 3HB PRO 29 17.432 -9.695 -8.528
226 HG2 PRO 29 2HG PRO 29 16.006 -7.104 -8.066
227 HG3 PRO 29 3HG PRO 29 15.582 -8.731 -7.502
228 HD2 PRO 29 2HD PRO 29 16.802 -6.910 -5.912
229 HD3 PRO 29 3HD PRO 29 17.087 -8.655 -5.758
230 H LYS 30 H LYS 30 18.241 -5.543 -7.759
231 HA LYS 30 HA LYS 30 18.286 -4.429 -10.342
232 HB2 LYS 30 2HB LYS 30 18.438 -3.306 -7.569
233 HB3 LYS 30 3HB LYS 30 18.726 -2.252 -8.947
234 HG2 LYS 30 2HG LYS 30 16.274 -3.956 -8.845
235 HG3 LYS 30 3HG LYS 30 16.347 -2.434 -7.953
236 HD2 LYS 30 2HD LYS 30 17.185 -2.416 -10.804
237 HD3 LYS 30 3HD LYS 30 15.461 -2.563 -10.453
238 HE2 LYS 30 2HE LYS 30 16.498 -0.537 -8.773
239 HE3 LYS 30 3HE LYS 30 17.118 -0.238 -10.396
240 HZ1 LYS 30 3HZ LYS 30 14.937 0.823 -9.893
241 HZ2 LYS 30 1HZ LYS 30 14.251 -0.721 -9.807
242 HZ3 LYS 30 2HZ LYS 30 14.924 -0.174 -11.259
243 H PHE 31 H PHE 31 20.660 -3.845 -7.743
244 HA PHE 31 HA PHE 31 22.700 -3.443 -9.822
245 HB2 PHE 31 2HB PHE 31 23.239 -2.679 -7.000
246 HB3 PHE 31 3HB PHE 31 23.707 -1.872 -8.493
247 HD1 PHE 31 HD1 PHE 31 22.326 -0.204 -9.486
248 HD2 PHE 31 HD2 PHE 31 20.995 -2.351 -6.060
249 HE1 PHE 31 HE1 PHE 31 20.497 1.415 -9.185
250 HE2 PHE 31 HE2 PHE 31 19.164 -0.737 -5.755
251 HZ PHE 31 HZ PHE 31 18.913 1.149 -7.319
252 H ASP 32 H ASP 32 24.763 -4.380 -9.597
253 HA ASP 32 HA ASP 32 24.794 -6.771 -7.877
254 HB2 ASP 32 2HB ASP 32 26.458 -6.353 -10.360
255 HB3 ASP 32 3HB ASP 32 26.162 -7.860 -9.497
256 H ASN 33 H ASN 33 26.482 -3.874 -8.782
257 HA ASN 33 HA ASN 33 28.615 -4.546 -6.862
258 HB2 ASN 33 2HB ASN 33 28.868 -3.819 -9.552
259 HB3 ASN 33 3HB ASN 33 29.294 -2.367 -8.651
260 HD21 ASN 33 2HD2 ASN 33 31.499 -5.725 -7.857
261 HD22 ASN 33 1HD2 ASN 33 29.785 -5.828 -8.048
262 H LYS 34 H LYS 34 26.010 -2.508 -7.563
263 HA LYS 34 HA LYS 34 26.917 -0.567 -5.539
264 HB2 LYS 34 2HB LYS 34 24.960 -0.067 -7.789
265 HB3 LYS 34 3HB LYS 34 25.543 1.118 -6.628
266 HG2 LYS 34 2HG LYS 34 27.369 -0.339 -8.516
267 HG3 LYS 34 3HG LYS 34 26.585 1.189 -8.922
268 HD2 LYS 34 2HD LYS 34 28.300 0.802 -6.475
269 HD3 LYS 34 3HD LYS 34 28.928 1.380 -8.020
270 HE2 LYS 34 2HE LYS 34 28.180 3.440 -7.634
271 HE3 LYS 34 3HE LYS 34 26.566 2.846 -7.247
272 HZ1 LYS 34 3HZ LYS 34 26.970 3.379 -5.150
273 HZ2 LYS 34 1HZ LYS 34 28.572 3.796 -5.499
274 HZ3 LYS 34 2HZ LYS 34 28.182 2.201 -5.094
275 H LYS 35 H LYS 35 25.421 -3.150 -5.292
276 HA LYS 35 HA LYS 35 22.724 -2.475 -4.607
277 HB2 LYS 35 2HB LYS 35 22.551 -4.752 -3.804
278 HB3 LYS 35 3HB LYS 35 23.396 -4.740 -5.347
279 HG2 LYS 35 2HG LYS 35 25.451 -4.556 -3.545
280 HG3 LYS 35 3HG LYS 35 24.302 -5.610 -2.718
281 HD2 LYS 35 2HD LYS 35 24.243 -6.656 -5.216
282 HD3 LYS 35 3HD LYS 35 25.912 -6.085 -5.138
283 HE2 LYS 35 2HE LYS 35 26.462 -7.851 -3.912
284 HE3 LYS 35 3HE LYS 35 25.305 -7.360 -2.676
285 HZ1 LYS 35 3HZ LYS 35 23.577 -8.558 -3.884
286 HZ2 LYS 35 1HZ LYS 35 24.844 -9.591 -3.446
287 HZ3 LYS 35 2HZ LYS 35 24.707 -9.051 -5.043
288 H CYS 36 H CYS 36 22.232 -3.675 -2.218
289 HA CYS 36 HA CYS 36 22.816 -1.679 -0.356
290 HB2 CYS 36 2HB CYS 36 21.723 -4.458 -0.169
291 HB3 CYS 36 3HB CYS 36 22.154 -3.610 1.313
292 H THR 37 H THR 37 24.779 -1.173 0.353
293 HA THR 37 HA THR 37 26.600 -3.365 1.110
294 HB THR 37 HB THR 37 28.490 -1.919 0.605
295 HG1 THR 37 HG1 THR 37 28.238 0.162 0.249
296 HG21 THR 37 3HG2 THR 37 28.474 -2.436 -1.584
297 HG22 THR 37 1HG2 THR 37 27.006 -1.510 -1.891
298 HG23 THR 37 2HG2 THR 37 26.897 -3.147 -1.243
299 H LYS 38 H LYS 38 24.693 -2.400 2.897
300 HA LYS 38 HA LYS 38 26.417 -1.477 5.024
301 HB2 LYS 38 2HB LYS 38 24.820 0.392 3.596
302 HB3 LYS 38 3HB LYS 38 24.097 0.183 5.185
303 HG2 LYS 38 2HG LYS 38 27.030 0.571 5.068
304 HG3 LYS 38 3HG LYS 38 26.005 1.962 4.707
305 HD2 LYS 38 2HD LYS 38 25.311 2.161 6.842
306 HD3 LYS 38 3HD LYS 38 25.212 0.415 7.078
307 HE2 LYS 38 2HE LYS 38 27.269 0.304 7.962
308 HE3 LYS 38 3HE LYS 38 27.942 1.411 6.766
309 HZ1 LYS 38 3HZ LYS 38 26.185 2.633 8.713
310 HZ2 LYS 38 1HZ LYS 38 27.678 3.162 8.118
311 HZ3 LYS 38 2HZ LYS 38 27.620 2.007 9.352
312 H ASP 39 H ASP 39 25.489 -1.743 7.117
313 HA ASP 39 HA ASP 39 23.482 -3.837 7.180
314 HB2 ASP 39 2HB ASP 39 24.034 -3.967 9.589
315 HB3 ASP 39 3HB ASP 39 25.462 -4.109 8.567
316 H ASN 40 H ASN 40 21.393 -3.435 7.412
317 HA ASN 40 HA ASN 40 19.424 -2.469 8.017
318 HB2 ASN 40 2HB ASN 40 20.888 -0.758 10.011
319 HB3 ASN 40 3HB ASN 40 19.257 -1.416 10.110
320 HD21 ASN 40 2HD2 ASN 40 22.123 -3.302 11.963
321 HD22 ASN 40 1HD2 ASN 40 22.076 -1.628 11.538
322 H ASN 41 H ASN 41 20.677 -1.419 5.816
323 HA ASN 41 HA ASN 41 20.746 1.462 6.000
324 HB2 ASN 41 2HB ASN 41 21.234 1.390 3.595
325 HB3 ASN 41 3HB ASN 41 22.278 0.284 4.484
326 HD21 ASN 41 2HD2 ASN 41 21.204 -2.562 2.836
327 HD22 ASN 41 1HD2 ASN 41 22.210 -1.851 4.047
328 H LYS 42 H LYS 42 19.581 2.323 3.696
329 HA LYS 42 HA LYS 42 16.736 1.906 4.278
330 HB2 LYS 42 2HB LYS 42 17.899 4.093 2.563
331 HB3 LYS 42 3HB LYS 42 16.324 4.047 3.345
332 HG2 LYS 42 2HG LYS 42 17.534 4.091 5.548
333 HG3 LYS 42 3HG LYS 42 19.012 4.416 4.639
334 HD2 LYS 42 2HD LYS 42 17.030 6.201 3.695
335 HD3 LYS 42 3HD LYS 42 16.973 6.238 5.459
336 HE2 LYS 42 2HE LYS 42 19.538 6.478 3.905
337 HE3 LYS 42 3HE LYS 42 18.554 7.875 4.338
338 HZ1 LYS 42 3HZ LYS 42 18.737 6.843 6.706
339 HZ2 LYS 42 1HZ LYS 42 20.001 7.781 6.088
340 HZ3 LYS 42 2HZ LYS 42 20.115 6.094 6.072
341 H CYS 43 H CYS 43 15.838 0.387 3.045
342 HA CYS 43 HA CYS 43 16.002 0.640 0.160
343 HB2 CYS 43 2HB CYS 43 16.731 -1.591 -0.277
344 HB3 CYS 43 3HB CYS 43 17.884 -0.892 0.855
345 H THR 44 H THR 44 14.193 -0.086 -0.879
346 HA THR 44 HA THR 44 12.067 -1.176 0.846
347 HB THR 44 HB THR 44 10.435 -0.077 -0.490
348 HG1 THR 44 HG1 THR 44 11.128 -0.245 -2.559
349 HG21 THR 44 3HG2 THR 44 10.878 2.168 -0.035
350 HG22 THR 44 1HG2 THR 44 12.601 1.996 -0.368
351 HG23 THR 44 2HG2 THR 44 11.915 1.313 1.107
352 H VAL 45 H VAL 45 10.250 -2.051 -0.902
353 HA VAL 45 HA VAL 45 11.512 -3.745 -2.897
354 HB VAL 45 HB VAL 45 9.975 -4.925 -0.579
355 HG11 VAL 45 1HG1 VAL 45 11.023 -7.017 -1.987
356 HG12 VAL 45 2HG1 VAL 45 9.355 -6.451 -2.098
357 HG13 VAL 45 3HG1 VAL 45 10.553 -5.907 -3.273
358 HG21 VAL 45 3HG2 VAL 45 12.272 -4.383 0.006
359 HG22 VAL 45 1HG2 VAL 45 12.066 -6.130 -0.116
360 HG23 VAL 45 2HG2 VAL 45 12.857 -5.242 -1.419
361 H ASP 46 H ASP 46 10.253 -3.872 -4.634
362 HA ASP 46 HA ASP 46 7.435 -3.091 -4.371
363 HB2 ASP 46 2HB ASP 46 9.226 -2.008 -6.008
364 HB3 ASP 46 3HB ASP 46 8.751 -3.359 -7.034
365 H THR 47 H THR 47 6.114 -4.772 -4.155
366 HA THR 47 HA THR 47 6.765 -7.368 -5.233
367 HB THR 47 HB THR 47 5.608 -7.074 -3.034
368 HG1 THR 47 HG1 THR 47 4.146 -8.567 -4.976
369 HG21 THR 47 3HG2 THR 47 4.093 -5.236 -3.861
370 HG22 THR 47 1HG2 THR 47 3.297 -6.501 -2.927
371 HG23 THR 47 2HG2 THR 47 3.156 -6.481 -4.685
372 H TYR 48 H TYR 48 5.584 -4.665 -6.627
373 HA TYR 48 HA TYR 48 3.455 -5.834 -8.188
374 HB2 TYR 48 2HB TYR 48 3.768 -3.342 -7.456
375 HB3 TYR 48 3HB TYR 48 4.795 -3.242 -8.882
376 HD1 TYR 48 HD1 TYR 48 1.449 -3.134 -7.651
377 HD2 TYR 48 HD2 TYR 48 3.766 -3.945 -11.126
378 HE1 TYR 48 HE1 TYR 48 -0.544 -2.794 -9.052
379 HE2 TYR 48 HE2 TYR 48 1.780 -3.607 -12.537
380 HH TYR 48 HH TYR 48 -0.887 -3.832 -12.042
381 H ASN 49 H ASN 49 6.816 -4.853 -8.710
382 HA ASN 49 HA ASN 49 6.889 -6.589 -11.068
383 HB2 ASN 49 2HB ASN 49 8.287 -4.851 -12.244
384 HB3 ASN 49 3HB ASN 49 6.590 -4.424 -12.044
385 HD21 ASN 49 2HD2 ASN 49 9.514 -2.343 -10.122
386 HD22 ASN 49 1HD2 ASN 49 9.834 -3.880 -10.844
387 H ASN 50 H ASN 50 7.903 -6.595 -8.223
388 HA ASN 50 HA ASN 50 9.777 -7.163 -7.057
389 HB2 ASN 50 2HB ASN 50 9.528 -9.000 -8.877
390 HB3 ASN 50 3HB ASN 50 10.925 -8.229 -9.622
391 HD21 ASN 50 2HD2 ASN 50 12.240 -10.905 -7.533
392 HD22 ASN 50 1HD2 ASN 50 11.284 -10.736 -8.963
393 H ALA 51 H ALA 51 10.168 -4.760 -7.042
394 HA ALA 51 HA ALA 51 12.737 -4.160 -8.359
395 HB1 ALA 51 1HB ALA 51 11.607 -1.708 -7.752
396 HB2 ALA 51 2HB ALA 51 11.685 -2.463 -9.345
397 HB3 ALA 51 3HB ALA 51 10.251 -2.671 -8.340
398 H VAL 52 H VAL 52 14.383 -3.592 -7.075
399 HA VAL 52 HA VAL 52 13.805 -3.171 -4.219
400 HB VAL 52 HB VAL 52 15.170 -5.129 -4.579
401 HG11 VAL 52 1HG1 VAL 52 17.351 -5.019 -5.664
402 HG12 VAL 52 2HG1 VAL 52 16.070 -4.531 -6.775
403 HG13 VAL 52 3HG1 VAL 52 17.097 -3.311 -6.021
404 HG21 VAL 52 3HG2 VAL 52 15.661 -3.767 -2.611
405 HG22 VAL 52 1HG2 VAL 52 17.118 -4.551 -3.221
406 HG23 VAL 52 2HG2 VAL 52 16.838 -2.839 -3.539
407 H ASP 53 H ASP 53 14.529 -1.385 -3.182
408 HA ASP 53 HA ASP 53 15.930 0.620 -4.825
409 HB2 ASP 53 2HB ASP 53 13.815 0.848 -2.716
410 HB3 ASP 53 3HB ASP 53 14.931 2.188 -2.969
411 H CYS 54 H CYS 54 17.643 -1.102 -3.817
412 HA CYS 54 HA CYS 54 18.532 -0.915 -1.219
413 HB2 CYS 54 2HB CYS 54 19.979 -1.352 -3.816
414 HB3 CYS 54 3HB CYS 54 20.866 -1.286 -2.297
415 H ASP 55 H ASP 55 19.889 0.425 -0.077
416 HA ASP 55 HA ASP 55 19.802 3.158 -0.576
417 HB2 ASP 55 2HB ASP 55 20.247 2.161 1.643
418 HB3 ASP 55 3HB ASP 55 21.844 1.668 1.087
Start of MODEL 11
1 H1 ALA 1 H ALA 1 2.693 0.104 -5.843
2 HA ALA 1 HA ALA 1 2.683 1.203 -3.113
3 HB1 ALA 1 1HB ALA 1 1.465 -1.355 -4.086
4 HB2 ALA 1 2HB ALA 1 2.002 -1.183 -2.415
5 HB3 ALA 1 3HB ALA 1 0.763 -0.106 -3.058
6 H LYS 2 H LYS 2 4.342 0.563 -1.789
7 HA LYS 2 HA LYS 2 6.157 -1.538 -2.616
8 HB2 LYS 2 2HB LYS 2 8.142 -0.003 -2.473
9 HB3 LYS 2 3HB LYS 2 7.112 0.252 -3.876
10 HG2 LYS 2 2HG LYS 2 7.054 2.398 -3.334
11 HG3 LYS 2 3HG LYS 2 6.089 1.952 -1.924
12 HD2 LYS 2 2HD LYS 2 9.054 1.707 -1.763
13 HD3 LYS 2 3HD LYS 2 8.332 3.316 -1.673
14 HE2 LYS 2 2HE LYS 2 6.779 2.257 0.103
15 HE3 LYS 2 3HE LYS 2 7.994 0.982 0.177
16 HZ1 LYS 2 3HZ LYS 2 9.422 3.312 0.315
17 HZ2 LYS 2 1HZ LYS 2 9.059 2.283 1.607
18 HZ3 LYS 2 2HZ LYS 2 8.065 3.611 1.280
19 H TYR 3 H TYR 3 7.689 -2.114 -0.969
20 HA TYR 3 HA TYR 3 6.748 -1.362 1.706
21 HB2 TYR 3 2HB TYR 3 8.390 -3.732 0.791
22 HB3 TYR 3 3HB TYR 3 7.911 -3.423 2.456
23 HD1 TYR 3 HD1 TYR 3 5.314 -3.117 2.818
24 HD2 TYR 3 HD2 TYR 3 7.068 -5.119 -0.501
25 HE1 TYR 3 HE1 TYR 3 3.205 -4.324 2.439
26 HE2 TYR 3 HE2 TYR 3 4.963 -6.330 -0.890
27 HH TYR 3 HH TYR 3 2.287 -6.133 1.360
28 H THR 4 H THR 4 8.255 -0.931 3.390
29 HA THR 4 HA THR 4 10.848 0.075 2.411
30 HB THR 4 HB THR 4 9.827 1.178 4.950
31 HG1 THR 4 HG1 THR 4 8.020 1.931 4.162
32 HG21 THR 4 3HG2 THR 4 11.711 1.832 2.950
33 HG22 THR 4 1HG2 THR 4 11.353 2.716 4.432
34 HG23 THR 4 2HG2 THR 4 10.492 3.106 2.943
35 H GLY 5 H GLY 5 12.674 -0.566 3.423
36 HA2 GLY 5 2HA GLY 5 12.697 -1.591 6.097
37 HA3 GLY 5 3HA GLY 5 12.823 -2.874 4.902
38 H LYS 6 H LYS 6 14.912 -3.259 5.946
39 HA LYS 6 HA LYS 6 16.994 -1.645 4.660
40 HB2 LYS 6 2HB LYS 6 17.347 -2.600 7.489
41 HB3 LYS 6 3HB LYS 6 18.274 -1.388 6.615
42 HG2 LYS 6 2HG LYS 6 17.043 -0.013 7.926
43 HG3 LYS 6 3HG LYS 6 15.923 -0.165 6.570
44 HD2 LYS 6 2HD LYS 6 14.388 -0.939 7.980
45 HD3 LYS 6 3HD LYS 6 15.412 -2.345 8.275
46 HE2 LYS 6 2HE LYS 6 16.485 -1.257 10.116
47 HE3 LYS 6 3HE LYS 6 15.689 0.271 9.744
48 HZ1 LYS 6 3HZ LYS 6 13.614 -0.594 10.409
49 HZ2 LYS 6 1HZ LYS 6 14.706 -1.043 11.620
50 HZ3 LYS 6 2HZ LYS 6 14.195 -2.181 10.478
51 H CYS 7 H CYS 7 18.998 -2.753 4.348
52 HA CYS 7 HA CYS 7 18.675 -5.677 4.324
53 HB2 CYS 7 2HB CYS 7 20.860 -4.491 2.738
54 HB3 CYS 7 3HB CYS 7 19.704 -5.747 2.305
55 H THR 8 H THR 8 21.256 -6.476 3.961
56 HA THR 8 HA THR 8 22.785 -5.393 6.216
57 HB THR 8 HB THR 8 22.937 -8.310 6.066
58 HG1 THR 8 HG1 THR 8 20.827 -8.374 7.295
59 HG21 THR 8 3HG2 THR 8 23.885 -6.785 7.840
60 HG22 THR 8 1HG2 THR 8 22.936 -8.143 8.440
61 HG23 THR 8 2HG2 THR 8 22.231 -6.528 8.392
62 H LYS 9 H LYS 9 24.797 -4.994 5.600
63 HA LYS 9 HA LYS 9 25.834 -5.656 3.088
64 HB2 LYS 9 2HB LYS 9 27.882 -4.688 3.821
65 HB3 LYS 9 3HB LYS 9 26.590 -3.780 4.596
66 HG2 LYS 9 2HG LYS 9 27.832 -4.064 6.438
67 HG3 LYS 9 3HG LYS 9 27.070 -5.656 6.478
68 HD2 LYS 9 2HD LYS 9 28.950 -6.700 5.533
69 HD3 LYS 9 3HD LYS 9 29.632 -5.165 4.988
70 HE2 LYS 9 2HE LYS 9 30.923 -5.717 6.849
71 HE3 LYS 9 3HE LYS 9 29.749 -4.566 7.483
72 HZ1 LYS 9 3HZ LYS 9 29.615 -7.523 7.723
73 HZ2 LYS 9 1HZ LYS 9 28.419 -6.455 8.263
74 HZ3 LYS 9 2HZ LYS 9 29.956 -6.429 8.967
75 H SER 10 H SER 10 25.629 -7.501 5.954
76 HA SER 10 HA SER 10 27.831 -9.138 5.918
77 HB2 SER 10 2HB SER 10 24.977 -9.559 6.698
78 HB3 SER 10 3HB SER 10 26.048 -10.959 6.644
79 HG SER 10 HG SER 10 25.897 -8.989 8.488
80 H LYS 11 H LYS 11 24.750 -10.288 4.569
81 HA LYS 11 HA LYS 11 26.265 -11.475 2.337
82 HB2 LYS 11 2HB LYS 11 24.719 -12.788 4.340
83 HB3 LYS 11 3HB LYS 11 23.875 -12.957 2.806
84 HG2 LYS 11 2HG LYS 11 26.784 -13.492 2.799
85 HG3 LYS 11 3HG LYS 11 25.749 -14.660 3.624
86 HD2 LYS 11 2HD LYS 11 24.322 -14.490 1.436
87 HD3 LYS 11 3HD LYS 11 25.831 -13.897 0.737
88 HE2 LYS 11 2HE LYS 11 26.890 -15.984 1.821
89 HE3 LYS 11 3HE LYS 11 25.234 -16.574 1.950
90 HZ1 LYS 11 3HZ LYS 11 25.430 -15.697 -0.623
91 HZ2 LYS 11 1HZ LYS 11 25.510 -17.309 -0.115
92 HZ3 LYS 11 2HZ LYS 11 26.932 -16.424 -0.345
93 H ASN 12 H ASN 12 24.360 -9.034 2.927
94 HA ASN 12 HA ASN 12 22.950 -7.754 1.683
95 HB2 ASN 12 2HB ASN 12 23.881 -7.768 -0.364
96 HB3 ASN 12 3HB ASN 12 24.268 -9.483 -0.262
97 HD21 ASN 12 2HD2 ASN 12 20.972 -8.186 -2.225
98 HD22 ASN 12 1HD2 ASN 12 21.955 -7.119 -1.287
99 H GLU 13 H GLU 13 20.868 -7.725 2.179
100 HA GLU 13 HA GLU 13 18.944 -9.413 1.046
101 HB2 GLU 13 2HB GLU 13 20.227 -10.493 3.383
102 HB3 GLU 13 3HB GLU 13 18.533 -10.179 3.729
103 HG2 GLU 13 2HG GLU 13 17.862 -11.532 1.839
104 HG3 GLU 13 3HG GLU 13 19.550 -11.796 1.404
105 H CYS 14 H CYS 14 17.846 -7.509 0.724
106 HA CYS 14 HA CYS 14 17.323 -5.624 2.788
107 HB2 CYS 14 2HB CYS 14 16.559 -5.988 -0.040
108 HB3 CYS 14 3HB CYS 14 15.399 -5.098 0.941
109 H LYS 15 H LYS 15 16.146 -6.152 4.512
110 HA LYS 15 HA LYS 15 14.071 -8.121 4.439
111 HB2 LYS 15 2HB LYS 15 15.226 -7.989 6.482
112 HB3 LYS 15 3HB LYS 15 15.104 -6.235 6.540
113 HG2 LYS 15 2HG LYS 15 13.021 -6.268 7.423
114 HG3 LYS 15 3HG LYS 15 12.566 -7.752 6.582
115 HD2 LYS 15 2HD LYS 15 12.720 -8.111 8.996
116 HD3 LYS 15 3HD LYS 15 13.935 -9.056 8.130
117 HE2 LYS 15 2HE LYS 15 15.612 -8.014 9.168
118 HE3 LYS 15 3HE LYS 15 14.914 -6.425 8.858
119 HZ1 LYS 15 3HZ LYS 15 13.381 -6.885 10.760
120 HZ2 LYS 15 1HZ LYS 15 15.008 -6.707 11.188
121 HZ3 LYS 15 2HZ LYS 15 14.317 -8.248 11.117
122 H TYR 16 H TYR 16 11.848 -7.824 4.722
123 HA TYR 16 HA TYR 16 10.672 -5.219 4.861
124 HB2 TYR 16 2HB TYR 16 9.757 -5.027 2.698
125 HB3 TYR 16 3HB TYR 16 11.435 -5.484 2.429
126 HD1 TYR 16 HD1 TYR 16 8.064 -6.223 1.653
127 HD2 TYR 16 HD2 TYR 16 11.887 -8.032 2.117
128 HE1 TYR 16 HE1 TYR 16 7.318 -8.133 0.295
129 HE2 TYR 16 HE2 TYR 16 11.152 -9.947 0.758
130 HH TYR 16 HH TYR 16 9.540 -10.649 -0.715
131 H LYS 17 H LYS 17 8.180 -5.685 3.883
132 HA LYS 17 HA LYS 17 7.287 -8.073 5.362
133 HB2 LYS 17 2HB LYS 17 5.205 -6.760 5.873
134 HB3 LYS 17 3HB LYS 17 6.663 -6.165 6.656
135 HG2 LYS 17 2HG LYS 17 6.841 -4.519 4.728
136 HG3 LYS 17 3HG LYS 17 5.188 -4.988 4.324
137 HD2 LYS 17 2HD LYS 17 5.894 -4.126 7.106
138 HD3 LYS 17 3HD LYS 17 5.581 -2.928 5.847
139 HE2 LYS 17 2HE LYS 17 3.366 -3.446 5.715
140 HE3 LYS 17 3HE LYS 17 3.622 -5.134 6.156
141 HZ1 LYS 17 3HZ LYS 17 3.834 -2.864 8.058
142 HZ2 LYS 17 1HZ LYS 17 3.892 -4.513 8.433
143 HZ3 LYS 17 2HZ LYS 17 2.453 -3.824 7.872
144 H ASN 18 H ASN 18 5.822 -9.387 4.399
145 HA ASN 18 HA ASN 18 4.697 -8.521 1.821
146 HB2 ASN 18 2HB ASN 18 5.103 -10.732 0.887
147 HB3 ASN 18 3HB ASN 18 6.620 -10.038 1.451
148 HD21 ASN 18 2HD2 ASN 18 6.925 -12.288 4.204
149 HD22 ASN 18 1HD2 ASN 18 7.172 -10.636 3.762
150 H ASP 19 H ASP 19 4.452 -10.739 4.564
151 HA ASP 19 HA ASP 19 1.645 -11.257 3.910
152 HB2 ASP 19 2HB ASP 19 3.663 -12.892 4.904
153 HB3 ASP 19 3HB ASP 19 2.651 -12.565 6.308
154 H ALA 20 H ALA 20 2.488 -8.661 4.872
155 HA ALA 20 HA ALA 20 1.603 -7.053 6.234
156 HB1 ALA 20 1HB ALA 20 -0.365 -7.428 7.403
157 HB2 ALA 20 2HB ALA 20 -0.437 -8.632 6.115
158 HB3 ALA 20 3HB ALA 20 0.039 -9.110 7.745
159 H GLY 21 H GLY 21 4.077 -8.027 6.821
160 HA2 GLY 21 2HA GLY 21 5.142 -7.160 8.933
161 HA3 GLY 21 3HA GLY 21 4.061 -8.268 9.765
162 H LYS 22 H LYS 22 4.464 -10.243 7.514
163 HA LYS 22 HA LYS 22 6.334 -11.891 8.697
164 HB2 LYS 22 2HB LYS 22 4.947 -11.789 6.110
165 HB3 LYS 22 3HB LYS 22 6.479 -12.652 6.066
166 HG2 LYS 22 2HG LYS 22 5.559 -13.870 8.164
167 HG3 LYS 22 3HG LYS 22 3.994 -13.287 7.592
168 HD2 LYS 22 2HD LYS 22 5.038 -14.287 5.299
169 HD3 LYS 22 3HD LYS 22 5.760 -15.369 6.493
170 HE2 LYS 22 2HE LYS 22 3.719 -16.195 7.173
171 HE3 LYS 22 3HE LYS 22 2.844 -14.756 6.652
172 HZ1 LYS 22 3HZ LYS 22 2.299 -16.463 5.144
173 HZ2 LYS 22 1HZ LYS 22 3.912 -16.941 4.959
174 HZ3 LYS 22 2HZ LYS 22 3.389 -15.464 4.322
175 H ASP 23 H ASP 23 8.341 -11.200 9.166
176 HA ASP 23 HA ASP 23 9.882 -9.447 7.599
177 HB2 ASP 23 2HB ASP 23 11.069 -11.480 9.477
178 HB3 ASP 23 3HB ASP 23 11.645 -9.856 9.111
179 H THR 24 H THR 24 10.209 -9.992 5.507
180 HA THR 24 HA THR 24 11.593 -12.544 4.992
181 HB THR 24 HB THR 24 9.676 -11.084 3.163
182 HG1 THR 24 HG1 THR 24 9.519 -13.602 4.495
183 HG21 THR 24 3HG2 THR 24 11.205 -12.006 1.681
184 HG22 THR 24 1HG2 THR 24 10.014 -13.296 1.835
185 HG23 THR 24 2HG2 THR 24 11.536 -13.390 2.722
186 H PHE 25 H PHE 25 13.383 -12.513 3.689
187 HA PHE 25 HA PHE 25 14.487 -9.861 3.122
188 HB2 PHE 25 2HB PHE 25 16.022 -12.427 2.851
189 HB3 PHE 25 3HB PHE 25 16.619 -10.814 3.226
190 HD1 PHE 25 HD1 PHE 25 15.388 -9.844 5.474
191 HD2 PHE 25 HD2 PHE 25 16.183 -13.925 4.565
192 HE1 PHE 25 HE1 PHE 25 15.342 -10.384 7.874
193 HE2 PHE 25 HE2 PHE 25 16.137 -14.472 6.963
194 HZ PHE 25 HZ PHE 25 15.715 -12.701 8.622
195 H ILE 26 H ILE 26 15.217 -9.253 1.102
196 HA ILE 26 HA ILE 26 14.790 -11.100 -1.130
197 HB ILE 26 HB ILE 26 12.725 -9.868 -1.060
198 HG12 ILE 26 2HG1 ILE 26 12.771 -8.794 -3.265
199 HG13 ILE 26 3HG1 ILE 26 14.528 -8.724 -3.205
200 HG21 ILE 26 1HG2 ILE 26 12.636 -7.828 -0.195
201 HG22 ILE 26 2HG2 ILE 26 14.396 -7.738 -0.177
202 HG23 ILE 26 3HG2 ILE 26 13.501 -7.206 -1.600
203 HD11 ILE 26 3HD1 ILE 26 14.703 -10.780 -3.999
204 HD12 ILE 26 1HD1 ILE 26 13.589 -11.412 -2.787
205 HD13 ILE 26 2HD1 ILE 26 12.965 -10.739 -4.293
206 H LYS 27 H LYS 27 16.606 -11.168 -2.257
207 HA LYS 27 HA LYS 27 18.810 -9.543 -1.953
208 HB2 LYS 27 2HB LYS 27 18.056 -10.924 -4.532
209 HB3 LYS 27 3HB LYS 27 19.674 -10.513 -3.980
210 HG2 LYS 27 2HG LYS 27 18.902 -12.059 -1.938
211 HG3 LYS 27 3HG LYS 27 17.926 -12.767 -3.227
212 HD2 LYS 27 2HD LYS 27 20.596 -12.301 -4.169
213 HD3 LYS 27 3HD LYS 27 20.644 -13.228 -2.667
214 HE2 LYS 27 2HE LYS 27 20.526 -14.678 -4.645
215 HE3 LYS 27 3HE LYS 27 19.117 -14.866 -3.602
216 HZ1 LYS 27 3HZ LYS 27 19.180 -14.199 -6.316
217 HZ2 LYS 27 1HZ LYS 27 18.571 -12.861 -5.479
218 HZ3 LYS 27 2HZ LYS 27 17.828 -14.371 -5.314
219 H CYS 28 H CYS 28 19.821 -8.178 -3.737
220 HA CYS 28 HA CYS 28 17.795 -6.285 -4.728
221 HB2 CYS 28 2HB CYS 28 20.693 -5.591 -4.342
222 HB3 CYS 28 3HB CYS 28 19.298 -4.518 -4.389
223 HA PRO 29 HA PRO 29 19.660 -8.210 -8.494
224 HB2 PRO 29 2HB PRO 29 17.319 -8.317 -9.866
225 HB3 PRO 29 3HB PRO 29 17.835 -9.583 -8.744
226 HG2 PRO 29 2HG PRO 29 15.914 -7.329 -8.304
227 HG3 PRO 29 3HG PRO 29 15.779 -9.027 -7.811
228 HD2 PRO 29 2HD PRO 29 16.535 -7.069 -6.100
229 HD3 PRO 29 3HD PRO 29 17.140 -8.733 -5.975
230 H LYS 30 H LYS 30 17.707 -5.409 -7.860
231 HA LYS 30 HA LYS 30 17.581 -4.171 -10.324
232 HB2 LYS 30 2HB LYS 30 17.120 -3.442 -7.650
233 HB3 LYS 30 3HB LYS 30 18.239 -2.241 -8.280
234 HG2 LYS 30 2HG LYS 30 15.726 -2.993 -9.735
235 HG3 LYS 30 3HG LYS 30 15.758 -1.745 -8.487
236 HD2 LYS 30 2HD LYS 30 17.918 -1.312 -10.311
237 HD3 LYS 30 3HD LYS 30 16.418 -1.497 -11.222
238 HE2 LYS 30 2HE LYS 30 16.813 0.378 -8.892
239 HE3 LYS 30 3HE LYS 30 16.887 0.847 -10.590
240 HZ1 LYS 30 3HZ LYS 30 14.495 -0.508 -9.533
241 HZ2 LYS 30 1HZ LYS 30 14.636 0.523 -10.867
242 HZ3 LYS 30 2HZ LYS 30 14.698 1.155 -9.300
243 H PHE 31 H PHE 31 20.071 -3.485 -7.860
244 HA PHE 31 HA PHE 31 21.881 -2.703 -10.042
245 HB2 PHE 31 2HB PHE 31 22.591 -2.040 -7.243
246 HB3 PHE 31 3HB PHE 31 22.758 -1.076 -8.707
247 HD1 PHE 31 HD1 PHE 31 20.455 -2.111 -6.039
248 HD2 PHE 31 HD2 PHE 31 21.046 0.428 -9.404
249 HE1 PHE 31 HE1 PHE 31 18.465 -0.810 -5.403
250 HE2 PHE 31 HE2 PHE 31 19.058 1.733 -8.773
251 HZ PHE 31 HZ PHE 31 17.765 1.116 -6.770
252 H ASP 32 H ASP 32 22.876 -4.582 -10.598
253 HA ASP 32 HA ASP 32 23.779 -6.495 -8.673
254 HB2 ASP 32 2HB ASP 32 24.812 -6.363 -11.489
255 HB3 ASP 32 3HB ASP 32 24.495 -7.778 -10.489
256 H ASN 33 H ASN 33 24.943 -3.514 -9.583
257 HA ASN 33 HA ASN 33 27.666 -4.228 -8.713
258 HB2 ASN 33 2HB ASN 33 26.793 -2.862 -11.117
259 HB3 ASN 33 3HB ASN 33 27.881 -1.849 -10.172
260 HD21 ASN 33 2HD2 ASN 33 30.560 -4.291 -10.376
261 HD22 ASN 33 1HD2 ASN 33 29.719 -3.383 -9.171
262 H LYS 34 H LYS 34 25.036 -2.993 -7.536
263 HA LYS 34 HA LYS 34 26.435 -1.165 -5.780
264 HB2 LYS 34 2HB LYS 34 24.165 -0.267 -7.554
265 HB3 LYS 34 3HB LYS 34 24.634 0.596 -6.094
266 HG2 LYS 34 2HG LYS 34 26.392 0.089 -8.486
267 HG3 LYS 34 3HG LYS 34 25.604 1.614 -8.076
268 HD2 LYS 34 2HD LYS 34 27.043 0.747 -5.793
269 HD3 LYS 34 3HD LYS 34 28.117 0.607 -7.187
270 HE2 LYS 34 2HE LYS 34 27.212 2.993 -7.750
271 HE3 LYS 34 3HE LYS 34 26.794 3.027 -6.038
272 HZ1 LYS 34 3HZ LYS 34 29.209 3.674 -7.088
273 HZ2 LYS 34 1HZ LYS 34 29.464 2.099 -6.528
274 HZ3 LYS 34 2HZ LYS 34 28.916 3.295 -5.466
275 H LYS 35 H LYS 35 24.910 -3.763 -5.768
276 HA LYS 35 HA LYS 35 22.438 -3.559 -4.541
277 HB2 LYS 35 2HB LYS 35 22.957 -5.781 -3.533
278 HB3 LYS 35 3HB LYS 35 23.267 -5.697 -5.262
279 HG2 LYS 35 2HG LYS 35 25.688 -4.992 -4.181
280 HG3 LYS 35 3HG LYS 35 25.092 -6.216 -3.056
281 HD2 LYS 35 2HD LYS 35 25.219 -7.880 -4.592
282 HD3 LYS 35 3HD LYS 35 24.795 -6.817 -5.936
283 HE2 LYS 35 2HE LYS 35 27.037 -5.880 -5.928
284 HE3 LYS 35 3HE LYS 35 27.466 -6.870 -4.534
285 HZ1 LYS 35 3HZ LYS 35 26.896 -8.834 -5.997
286 HZ2 LYS 35 1HZ LYS 35 28.311 -7.993 -6.388
287 HZ3 LYS 35 2HZ LYS 35 26.907 -7.756 -7.301
288 H CYS 36 H CYS 36 21.986 -4.178 -2.202
289 HA CYS 36 HA CYS 36 22.760 -2.159 -0.493
290 HB2 CYS 36 2HB CYS 36 21.514 -4.835 -0.125
291 HB3 CYS 36 3HB CYS 36 22.133 -4.030 1.313
292 H THR 37 H THR 37 24.673 -1.670 0.328
293 HA THR 37 HA THR 37 26.471 -3.864 1.124
294 HB THR 37 HB THR 37 28.377 -2.283 0.562
295 HG1 THR 37 HG1 THR 37 27.939 -0.534 -0.697
296 HG21 THR 37 3HG2 THR 37 28.579 -3.615 -1.210
297 HG22 THR 37 1HG2 THR 37 27.373 -2.666 -2.078
298 HG23 THR 37 2HG2 THR 37 26.871 -4.034 -1.084
299 H LYS 38 H LYS 38 24.601 -2.550 2.808
300 HA LYS 38 HA LYS 38 26.436 -1.541 4.820
301 HB2 LYS 38 2HB LYS 38 24.724 0.197 3.298
302 HB3 LYS 38 3HB LYS 38 24.216 0.197 4.982
303 HG2 LYS 38 2HG LYS 38 27.112 0.493 4.407
304 HG3 LYS 38 3HG LYS 38 26.049 1.862 4.072
305 HD2 LYS 38 2HD LYS 38 26.031 2.384 6.232
306 HD3 LYS 38 3HD LYS 38 25.355 0.799 6.617
307 HE2 LYS 38 2HE LYS 38 27.526 -0.151 6.860
308 HE3 LYS 38 3HE LYS 38 28.297 1.289 6.196
309 HZ1 LYS 38 3HZ LYS 38 28.368 1.034 8.685
310 HZ2 LYS 38 1HZ LYS 38 26.705 1.349 8.692
311 HZ3 LYS 38 2HZ LYS 38 27.785 2.517 8.116
312 H ASP 39 H ASP 39 25.539 -1.547 6.959
313 HA ASP 39 HA ASP 39 23.493 -3.592 7.269
314 HB2 ASP 39 2HB ASP 39 24.125 -3.392 9.719
315 HB3 ASP 39 3HB ASP 39 25.405 -3.937 8.638
316 H ASN 40 H ASN 40 21.430 -3.111 7.575
317 HA ASN 40 HA ASN 40 19.520 -2.027 8.167
318 HB2 ASN 40 2HB ASN 40 21.167 -0.252 9.962
319 HB3 ASN 40 3HB ASN 40 19.488 -0.747 10.157
320 HD21 ASN 40 2HD2 ASN 40 20.210 -3.685 11.846
321 HD22 ASN 40 1HD2 ASN 40 19.020 -2.657 11.130
322 H ASN 41 H ASN 41 20.840 -1.178 5.861
323 HA ASN 41 HA ASN 41 20.973 1.692 5.798
324 HB2 ASN 41 2HB ASN 41 21.339 1.405 3.384
325 HB3 ASN 41 3HB ASN 41 22.389 0.344 4.319
326 HD21 ASN 41 2HD2 ASN 41 21.145 -2.596 2.982
327 HD22 ASN 41 1HD2 ASN 41 22.224 -1.821 4.087
328 H LYS 42 H LYS 42 19.740 2.454 3.515
329 HA LYS 42 HA LYS 42 16.899 2.101 4.185
330 HB2 LYS 42 2HB LYS 42 17.969 4.409 4.269
331 HB3 LYS 42 3HB LYS 42 18.090 4.314 2.517
332 HG2 LYS 42 2HG LYS 42 16.066 5.215 2.447
333 HG3 LYS 42 3HG LYS 42 15.452 3.667 3.031
334 HD2 LYS 42 2HD LYS 42 15.571 4.424 5.313
335 HD3 LYS 42 3HD LYS 42 16.361 5.922 4.817
336 HE2 LYS 42 2HE LYS 42 14.248 6.297 3.386
337 HE3 LYS 42 3HE LYS 42 13.518 5.060 4.409
338 HZ1 LYS 42 3HZ LYS 42 14.453 6.558 6.303
339 HZ2 LYS 42 1HZ LYS 42 12.992 6.955 5.548
340 HZ3 LYS 42 2HZ LYS 42 14.414 7.763 5.117
341 H CYS 43 H CYS 43 15.891 0.690 2.921
342 HA CYS 43 HA CYS 43 16.123 0.944 0.035
343 HB2 CYS 43 2HB CYS 43 16.691 -1.325 -0.394
344 HB3 CYS 43 3HB CYS 43 17.848 -0.749 0.802
345 H THR 44 H THR 44 14.314 0.245 -1.075
346 HA THR 44 HA THR 44 12.073 -0.697 0.595
347 HB THR 44 HB THR 44 10.571 0.518 -1.015
348 HG1 THR 44 HG1 THR 44 11.434 1.606 -2.620
349 HG21 THR 44 3HG2 THR 44 10.793 1.596 1.035
350 HG22 THR 44 1HG2 THR 44 11.273 2.845 -0.113
351 HG23 THR 44 2HG2 THR 44 12.502 1.947 0.778
352 H VAL 45 H VAL 45 10.824 -2.338 -0.175
353 HA VAL 45 HA VAL 45 11.824 -3.716 -2.552
354 HB VAL 45 HB VAL 45 9.920 -4.667 -0.408
355 HG11 VAL 45 1HG1 VAL 45 10.475 -6.926 -1.467
356 HG12 VAL 45 2HG1 VAL 45 9.349 -5.878 -2.331
357 HG13 VAL 45 3HG1 VAL 45 11.028 -5.997 -2.860
358 HG21 VAL 45 3HG2 VAL 45 12.820 -5.328 -0.916
359 HG22 VAL 45 1HG2 VAL 45 12.187 -4.368 0.421
360 HG23 VAL 45 2HG2 VAL 45 11.794 -6.083 0.304
361 H ASP 46 H ASP 46 10.589 -4.169 -4.324
362 HA ASP 46 HA ASP 46 7.891 -2.982 -4.385
363 HB2 ASP 46 2HB ASP 46 10.180 -2.488 -6.062
364 HB3 ASP 46 3HB ASP 46 8.862 -3.147 -7.027
365 H THR 47 H THR 47 6.413 -4.532 -4.436
366 HA THR 47 HA THR 47 7.043 -7.108 -5.662
367 HB THR 47 HB THR 47 6.024 -7.070 -3.398
368 HG1 THR 47 HG1 THR 47 5.650 -8.783 -5.063
369 HG21 THR 47 3HG2 THR 47 4.537 -5.051 -4.034
370 HG22 THR 47 1HG2 THR 47 3.867 -6.292 -2.975
371 HG23 THR 47 2HG2 THR 47 3.437 -6.266 -4.685
372 H TYR 48 H TYR 48 6.494 -4.637 -7.226
373 HA TYR 48 HA TYR 48 4.123 -5.575 -8.703
374 HB2 TYR 48 2HB TYR 48 4.127 -3.230 -7.588
375 HB3 TYR 48 3HB TYR 48 5.196 -2.776 -8.911
376 HD1 TYR 48 HD1 TYR 48 1.815 -4.050 -8.108
377 HD2 TYR 48 HD2 TYR 48 4.344 -2.356 -11.081
378 HE1 TYR 48 HE1 TYR 48 -0.141 -3.678 -9.552
379 HE2 TYR 48 HE2 TYR 48 2.395 -1.978 -12.532
380 HH TYR 48 HH TYR 48 0.081 -1.841 -12.509
381 H ASN 49 H ASN 49 7.477 -4.734 -8.844
382 HA ASN 49 HA ASN 49 7.546 -5.610 -11.642
383 HB2 ASN 49 2HB ASN 49 9.449 -3.822 -11.872
384 HB3 ASN 49 3HB ASN 49 7.765 -3.337 -12.043
385 HD21 ASN 49 2HD2 ASN 49 10.017 -2.045 -8.921
386 HD22 ASN 49 1HD2 ASN 49 10.565 -3.301 -9.973
387 H ASN 50 H ASN 50 8.347 -6.491 -8.756
388 HA ASN 50 HA ASN 50 10.022 -7.665 -7.749
389 HB2 ASN 50 2HB ASN 50 10.860 -8.382 -10.561
390 HB3 ASN 50 3HB ASN 50 11.080 -9.335 -9.097
391 HD21 ASN 50 2HD2 ASN 50 7.786 -10.572 -9.021
392 HD22 ASN 50 1HD2 ASN 50 9.171 -10.186 -8.063
393 H ALA 51 H ALA 51 11.105 -5.781 -6.987
394 HA ALA 51 HA ALA 51 13.844 -5.682 -7.657
395 HB1 ALA 51 1HB ALA 51 12.452 -3.138 -8.418
396 HB2 ALA 51 2HB ALA 51 14.095 -3.661 -8.792
397 HB3 ALA 51 3HB ALA 51 12.722 -4.424 -9.595
398 H VAL 52 H VAL 52 15.011 -3.990 -6.422
399 HA VAL 52 HA VAL 52 13.466 -2.898 -4.178
400 HB VAL 52 HB VAL 52 14.637 -5.130 -3.628
401 HG11 VAL 52 1HG1 VAL 52 16.766 -4.498 -4.754
402 HG12 VAL 52 2HG1 VAL 52 17.037 -3.313 -3.475
403 HG13 VAL 52 3HG1 VAL 52 16.970 -5.032 -3.086
404 HG21 VAL 52 3HG2 VAL 52 15.342 -4.236 -1.382
405 HG22 VAL 52 1HG2 VAL 52 15.005 -2.621 -2.006
406 HG23 VAL 52 2HG2 VAL 52 13.707 -3.808 -1.886
407 H ASP 53 H ASP 53 14.412 -1.094 -3.145
408 HA ASP 53 HA ASP 53 16.277 0.360 -4.865
409 HB2 ASP 53 2HB ASP 53 14.269 1.156 -2.795
410 HB3 ASP 53 3HB ASP 53 15.606 2.245 -3.151
411 H CYS 54 H CYS 54 17.720 -1.496 -3.742
412 HA CYS 54 HA CYS 54 18.685 -1.033 -1.137
413 HB2 CYS 54 2HB CYS 54 19.602 -2.585 -3.505
414 HB3 CYS 54 3HB CYS 54 20.789 -2.251 -2.248
415 H ASP 55 H ASP 55 20.228 0.277 -0.336
416 HA ASP 55 HA ASP 55 20.957 2.625 -1.588
417 HB2 ASP 55 2HB ASP 55 21.597 1.280 0.872
418 HB3 ASP 55 3HB ASP 55 23.053 2.012 0.203
Start of MODEL 12
1 H1 ALA 1 H ALA 1 2.010 -3.252 -1.968
2 HA ALA 1 HA ALA 1 3.159 -2.843 -3.889
3 HB1 ALA 1 1HB ALA 1 1.931 -1.132 -4.677
4 HB2 ALA 1 2HB ALA 1 2.005 -0.240 -3.157
5 HB3 ALA 1 3HB ALA 1 3.360 -0.175 -4.285
6 H LYS 2 H LYS 2 4.150 -0.029 -1.942
7 HA LYS 2 HA LYS 2 6.945 -0.837 -2.348
8 HB2 LYS 2 2HB LYS 2 5.555 1.720 -2.321
9 HB3 LYS 2 3HB LYS 2 6.954 1.719 -1.255
10 HG2 LYS 2 2HG LYS 2 7.316 0.614 -3.979
11 HG3 LYS 2 3HG LYS 2 7.118 2.361 -3.821
12 HD2 LYS 2 2HD LYS 2 9.068 0.868 -2.100
13 HD3 LYS 2 3HD LYS 2 9.501 1.366 -3.737
14 HE2 LYS 2 2HE LYS 2 8.282 3.408 -1.965
15 HE3 LYS 2 3HE LYS 2 9.931 2.904 -1.601
16 HZ1 LYS 2 3HZ LYS 2 8.987 3.938 -4.221
17 HZ2 LYS 2 1HZ LYS 2 10.572 3.475 -3.853
18 HZ3 LYS 2 2HZ LYS 2 9.883 4.814 -3.084
19 H TYR 3 H TYR 3 7.705 -2.000 -0.703
20 HA TYR 3 HA TYR 3 6.779 -1.446 2.014
21 HB2 TYR 3 2HB TYR 3 8.505 -3.703 0.976
22 HB3 TYR 3 3HB TYR 3 7.862 -3.564 2.608
23 HD1 TYR 3 HD1 TYR 3 7.256 -4.739 -0.714
24 HD2 TYR 3 HD2 TYR 3 5.323 -3.565 2.890
25 HE1 TYR 3 HE1 TYR 3 5.226 -5.936 -1.419
26 HE2 TYR 3 HE2 TYR 3 3.289 -4.761 2.195
27 HH TYR 3 HH TYR 3 2.458 -6.281 0.725
28 H THR 4 H THR 4 8.246 -1.139 3.750
29 HA THR 4 HA THR 4 10.811 0.037 2.904
30 HB THR 4 HB THR 4 9.692 0.652 5.592
31 HG1 THR 4 HG1 THR 4 8.787 2.170 3.398
32 HG21 THR 4 3HG2 THR 4 11.476 1.885 3.576
33 HG22 THR 4 1HG2 THR 4 11.602 1.858 5.335
34 HG23 THR 4 2HG2 THR 4 10.500 2.987 4.547
35 H GLY 5 H GLY 5 12.670 -0.765 3.685
36 HA2 GLY 5 2HA GLY 5 12.745 -2.249 6.168
37 HA3 GLY 5 3HA GLY 5 13.015 -3.228 4.734
38 H LYS 6 H LYS 6 15.114 -3.665 5.689
39 HA LYS 6 HA LYS 6 17.064 -1.655 4.854
40 HB2 LYS 6 2HB LYS 6 17.406 -3.069 7.488
41 HB3 LYS 6 3HB LYS 6 18.280 -1.670 6.876
42 HG2 LYS 6 2HG LYS 6 16.910 -0.627 8.350
43 HG3 LYS 6 3HG LYS 6 15.861 -0.597 6.931
44 HD2 LYS 6 2HD LYS 6 14.520 -2.319 7.732
45 HD3 LYS 6 3HD LYS 6 15.761 -2.898 8.845
46 HE2 LYS 6 2HE LYS 6 15.445 -0.546 9.945
47 HE3 LYS 6 3HE LYS 6 13.890 -0.586 9.115
48 HZ1 LYS 6 3HZ LYS 6 14.119 -3.039 10.318
49 HZ2 LYS 6 1HZ LYS 6 13.155 -1.750 10.837
50 HZ3 LYS 6 2HZ LYS 6 14.708 -1.953 11.474
51 H CYS 7 H CYS 7 19.162 -2.508 4.416
52 HA CYS 7 HA CYS 7 19.086 -5.364 3.754
53 HB2 CYS 7 2HB CYS 7 19.929 -3.099 2.321
54 HB3 CYS 7 3HB CYS 7 21.403 -3.968 2.738
55 H THR 8 H THR 8 21.726 -5.971 3.553
56 HA THR 8 HA THR 8 22.961 -5.363 6.133
57 HB THR 8 HB THR 8 23.405 -8.122 5.738
58 HG1 THR 8 HG1 THR 8 21.281 -7.740 4.510
59 HG21 THR 8 3HG2 THR 8 21.458 -7.023 7.735
60 HG22 THR 8 1HG2 THR 8 23.174 -6.633 7.848
61 HG23 THR 8 2HG2 THR 8 22.644 -8.314 7.930
62 H LYS 9 H LYS 9 24.933 -4.670 5.658
63 HA LYS 9 HA LYS 9 26.243 -5.034 3.216
64 HB2 LYS 9 2HB LYS 9 28.117 -3.968 4.206
65 HB3 LYS 9 3HB LYS 9 26.697 -3.255 4.960
66 HG2 LYS 9 2HG LYS 9 27.800 -3.631 6.867
67 HG3 LYS 9 3HG LYS 9 27.228 -5.289 6.672
68 HD2 LYS 9 2HD LYS 9 29.277 -6.063 6.014
69 HD3 LYS 9 3HD LYS 9 29.757 -4.515 5.313
70 HE2 LYS 9 2HE LYS 9 29.535 -3.871 7.946
71 HE3 LYS 9 3HE LYS 9 30.085 -5.543 8.045
72 HZ1 LYS 9 3HZ LYS 9 32.055 -5.049 6.989
73 HZ2 LYS 9 1HZ LYS 9 31.810 -3.651 7.909
74 HZ3 LYS 9 2HZ LYS 9 31.454 -3.648 6.255
75 H SER 10 H SER 10 25.935 -7.133 5.892
76 HA SER 10 HA SER 10 28.261 -8.594 5.927
77 HB2 SER 10 2HB SER 10 26.343 -8.974 7.449
78 HB3 SER 10 3HB SER 10 25.458 -9.724 6.121
79 HG SER 10 HG SER 10 27.182 -11.275 6.014
80 H LYS 11 H LYS 11 25.380 -9.644 4.108
81 HA LYS 11 HA LYS 11 27.099 -10.416 1.872
82 HB2 LYS 11 2HB LYS 11 26.069 -12.636 1.725
83 HB3 LYS 11 3HB LYS 11 26.922 -12.427 3.249
84 HG2 LYS 11 2HG LYS 11 24.994 -12.408 4.487
85 HG3 LYS 11 3HG LYS 11 24.006 -11.838 3.140
86 HD2 LYS 11 2HD LYS 11 25.263 -14.486 2.796
87 HD3 LYS 11 3HD LYS 11 24.002 -14.382 4.026
88 HE2 LYS 11 2HE LYS 11 22.512 -14.593 2.388
89 HE3 LYS 11 3HE LYS 11 22.988 -12.986 1.840
90 HZ1 LYS 11 3HZ LYS 11 24.571 -15.309 0.991
91 HZ2 LYS 11 1HZ LYS 11 24.312 -13.837 0.198
92 HZ3 LYS 11 2HZ LYS 11 23.091 -15.007 0.230
93 H ASN 12 H ASN 12 24.970 -8.385 2.482
94 HA ASN 12 HA ASN 12 23.304 -7.339 1.338
95 HB2 ASN 12 2HB ASN 12 23.958 -7.384 -0.809
96 HB3 ASN 12 3HB ASN 12 24.607 -9.014 -0.648
97 HD21 ASN 12 2HD2 ASN 12 21.011 -8.351 -2.358
98 HD22 ASN 12 1HD2 ASN 12 21.952 -7.081 -1.660
99 H GLU 13 H GLU 13 21.267 -7.471 1.985
100 HA GLU 13 HA GLU 13 19.448 -9.439 1.208
101 HB2 GLU 13 2HB GLU 13 21.090 -10.474 3.132
102 HB3 GLU 13 3HB GLU 13 19.764 -9.851 4.103
103 HG2 GLU 13 2HG GLU 13 18.267 -11.111 2.400
104 HG3 GLU 13 3HG GLU 13 19.745 -12.000 2.035
105 H CYS 14 H CYS 14 17.923 -7.913 0.948
106 HA CYS 14 HA CYS 14 17.368 -6.041 3.123
107 HB2 CYS 14 2HB CYS 14 16.992 -6.047 0.216
108 HB3 CYS 14 3HB CYS 14 15.600 -5.433 1.102
109 H LYS 15 H LYS 15 15.848 -6.484 4.561
110 HA LYS 15 HA LYS 15 13.875 -8.554 3.988
111 HB2 LYS 15 2HB LYS 15 15.165 -8.613 6.110
112 HB3 LYS 15 3HB LYS 15 14.431 -7.083 6.572
113 HG2 LYS 15 2HG LYS 15 12.563 -9.244 5.844
114 HG3 LYS 15 3HG LYS 15 13.489 -9.477 7.328
115 HD2 LYS 15 2HD LYS 15 12.051 -6.902 6.778
116 HD3 LYS 15 3HD LYS 15 11.212 -8.286 7.483
117 HE2 LYS 15 2HE LYS 15 13.352 -8.226 9.082
118 HE3 LYS 15 3HE LYS 15 13.289 -6.520 8.643
119 HZ1 LYS 15 3HZ LYS 15 10.707 -7.133 9.233
120 HZ2 LYS 15 1HZ LYS 15 11.793 -6.342 10.261
121 HZ3 LYS 15 2HZ LYS 15 11.576 -8.015 10.385
122 H TYR 16 H TYR 16 11.617 -8.235 4.470
123 HA TYR 16 HA TYR 16 10.547 -5.633 4.925
124 HB2 TYR 16 2HB TYR 16 9.620 -5.140 2.795
125 HB3 TYR 16 3HB TYR 16 11.312 -5.530 2.505
126 HD1 TYR 16 HD1 TYR 16 11.745 -8.104 1.973
127 HD2 TYR 16 HD2 TYR 16 8.042 -6.087 1.406
128 HE1 TYR 16 HE1 TYR 16 11.074 -9.810 0.333
129 HE2 TYR 16 HE2 TYR 16 7.360 -7.788 -0.234
130 HH TYR 16 HH TYR 16 9.429 -9.870 -1.691
131 H LYS 17 H LYS 17 8.049 -5.846 3.896
132 HA LYS 17 HA LYS 17 7.044 -8.357 5.070
133 HB2 LYS 17 2HB LYS 17 4.979 -7.034 5.623
134 HB3 LYS 17 3HB LYS 17 6.422 -6.557 6.509
135 HG2 LYS 17 2HG LYS 17 6.318 -4.993 4.156
136 HG3 LYS 17 3HG LYS 17 4.714 -4.966 4.891
137 HD2 LYS 17 2HD LYS 17 6.021 -4.522 7.095
138 HD3 LYS 17 3HD LYS 17 7.332 -4.044 6.014
139 HE2 LYS 17 2HE LYS 17 5.014 -2.800 5.033
140 HE3 LYS 17 3HE LYS 17 4.978 -2.587 6.783
141 HZ1 LYS 17 3HZ LYS 17 6.750 -1.231 6.740
142 HZ2 LYS 17 1HZ LYS 17 6.317 -0.993 5.122
143 HZ3 LYS 17 2HZ LYS 17 7.539 -2.093 5.517
144 H ASN 18 H ASN 18 5.370 -9.429 4.046
145 HA ASN 18 HA ASN 18 4.730 -8.469 1.335
146 HB2 ASN 18 2HB ASN 18 4.240 -11.062 1.052
147 HB3 ASN 18 3HB ASN 18 5.866 -10.410 0.862
148 HD21 ASN 18 2HD2 ASN 18 7.141 -11.864 3.798
149 HD22 ASN 18 1HD2 ASN 18 7.317 -10.569 2.668
150 H ASP 19 H ASP 19 3.391 -10.917 3.551
151 HA ASP 19 HA ASP 19 0.708 -10.320 2.742
152 HB2 ASP 19 2HB ASP 19 1.034 -12.568 3.316
153 HB3 ASP 19 3HB ASP 19 1.936 -12.162 4.773
154 H ALA 20 H ALA 20 2.005 -10.403 6.056
155 HA ALA 20 HA ALA 20 0.904 -7.754 6.575
156 HB1 ALA 20 1HB ALA 20 -0.919 -9.395 7.027
157 HB2 ALA 20 2HB ALA 20 0.100 -10.105 8.280
158 HB3 ALA 20 3HB ALA 20 -0.445 -8.434 8.428
159 H GLY 21 H GLY 21 3.441 -7.850 6.498
160 HA2 GLY 21 2HA GLY 21 5.136 -7.079 7.948
161 HA3 GLY 21 3HA GLY 21 4.295 -7.831 9.295
162 H LYS 22 H LYS 22 4.408 -9.963 6.732
163 HA LYS 22 HA LYS 22 6.030 -11.823 8.039
164 HB2 LYS 22 2HB LYS 22 4.705 -11.596 5.445
165 HB3 LYS 22 3HB LYS 22 6.200 -12.520 5.367
166 HG2 LYS 22 2HG LYS 22 5.051 -13.598 7.568
167 HG3 LYS 22 3HG LYS 22 3.628 -13.186 6.609
168 HD2 LYS 22 2HD LYS 22 5.227 -14.303 4.720
169 HD3 LYS 22 3HD LYS 22 5.699 -15.224 6.150
170 HE2 LYS 22 2HE LYS 22 3.254 -15.633 6.564
171 HE3 LYS 22 3HE LYS 22 2.937 -14.916 4.985
172 HZ1 LYS 22 3HZ LYS 22 3.750 -16.709 3.906
173 HZ2 LYS 22 1HZ LYS 22 3.308 -17.505 5.332
174 HZ3 LYS 22 2HZ LYS 22 4.918 -17.050 5.081
175 H ASP 23 H ASP 23 8.052 -11.221 8.613
176 HA ASP 23 HA ASP 23 9.798 -9.641 7.084
177 HB2 ASP 23 2HB ASP 23 10.541 -11.701 9.172
178 HB3 ASP 23 3HB ASP 23 11.535 -10.351 8.632
179 H THR 24 H THR 24 9.999 -10.337 4.986
180 HA THR 24 HA THR 24 11.259 -12.974 4.600
181 HB THR 24 HB THR 24 9.541 -11.406 2.667
182 HG1 THR 24 HG1 THR 24 9.041 -14.001 3.687
183 HG21 THR 24 3HG2 THR 24 11.030 -14.009 2.336
184 HG22 THR 24 1HG2 THR 24 11.245 -12.526 1.407
185 HG23 THR 24 2HG2 THR 24 9.757 -13.458 1.247
186 H PHE 25 H PHE 25 13.338 -12.873 4.098
187 HA PHE 25 HA PHE 25 14.594 -10.429 3.307
188 HB2 PHE 25 2HB PHE 25 15.894 -13.138 3.160
189 HB3 PHE 25 3HB PHE 25 16.637 -11.580 3.504
190 HD1 PHE 25 HD1 PHE 25 16.365 -14.457 5.000
191 HD2 PHE 25 HD2 PHE 25 14.870 -10.515 5.585
192 HE1 PHE 25 HE1 PHE 25 16.157 -14.898 7.412
193 HE2 PHE 25 HE2 PHE 25 14.661 -10.949 7.998
194 HZ PHE 25 HZ PHE 25 15.305 -13.142 8.914
195 H ILE 26 H ILE 26 14.919 -9.672 1.323
196 HA ILE 26 HA ILE 26 14.858 -11.548 -0.941
197 HB ILE 26 HB ILE 26 12.692 -10.492 -0.928
198 HG12 ILE 26 2HG1 ILE 26 12.726 -9.403 -3.130
199 HG13 ILE 26 3HG1 ILE 26 14.471 -9.205 -3.011
200 HG21 ILE 26 1HG2 ILE 26 13.400 -8.527 0.442
201 HG22 ILE 26 2HG2 ILE 26 14.083 -7.823 -1.022
202 HG23 ILE 26 3HG2 ILE 26 12.349 -8.128 -0.917
203 HD11 ILE 26 3HD1 ILE 26 13.305 -11.216 -4.318
204 HD12 ILE 26 1HD1 ILE 26 14.883 -11.354 -3.544
205 HD13 ILE 26 2HD1 ILE 26 13.442 -11.952 -2.721
206 H LYS 27 H LYS 27 16.653 -11.412 -2.097
207 HA LYS 27 HA LYS 27 18.706 -9.590 -1.658
208 HB2 LYS 27 2HB LYS 27 19.648 -10.414 -3.804
209 HB3 LYS 27 3HB LYS 27 19.135 -11.709 -2.730
210 HG2 LYS 27 2HG LYS 27 16.953 -11.703 -4.062
211 HG3 LYS 27 3HG LYS 27 17.836 -10.740 -5.250
212 HD2 LYS 27 2HD LYS 27 19.514 -12.892 -4.601
213 HD3 LYS 27 3HD LYS 27 17.899 -13.579 -4.790
214 HE2 LYS 27 2HE LYS 27 17.846 -12.098 -6.944
215 HE3 LYS 27 3HE LYS 27 19.601 -12.142 -6.780
216 HZ1 LYS 27 3HZ LYS 27 18.071 -14.024 -8.004
217 HZ2 LYS 27 1HZ LYS 27 18.391 -14.724 -6.497
218 HZ3 LYS 27 2HZ LYS 27 19.669 -14.236 -7.491
219 H CYS 28 H CYS 28 19.659 -8.305 -3.656
220 HA CYS 28 HA CYS 28 17.520 -6.489 -4.548
221 HB2 CYS 28 2HB CYS 28 20.420 -5.724 -4.496
222 HB3 CYS 28 3HB CYS 28 18.998 -4.692 -4.389
223 HA PRO 29 HA PRO 29 18.985 -8.527 -8.409
224 HB2 PRO 29 2HB PRO 29 16.537 -8.539 -9.581
225 HB3 PRO 29 3HB PRO 29 17.077 -9.805 -8.473
226 HG2 PRO 29 2HG PRO 29 15.319 -7.442 -7.937
227 HG3 PRO 29 3HG PRO 29 15.137 -9.119 -7.390
228 HD2 PRO 29 2HD PRO 29 16.133 -7.167 -5.799
229 HD3 PRO 29 3HD PRO 29 16.660 -8.858 -5.679
230 H LYS 30 H LYS 30 17.329 -5.590 -7.653
231 HA LYS 30 HA LYS 30 17.115 -4.435 -10.197
232 HB2 LYS 30 2HB LYS 30 16.705 -3.631 -7.513
233 HB3 LYS 30 3HB LYS 30 17.762 -2.433 -8.247
234 HG2 LYS 30 2HG LYS 30 16.121 -2.212 -10.102
235 HG3 LYS 30 3HG LYS 30 15.042 -3.288 -9.210
236 HD2 LYS 30 2HD LYS 30 14.743 -1.738 -7.479
237 HD3 LYS 30 3HD LYS 30 16.158 -0.797 -7.958
238 HE2 LYS 30 2HE LYS 30 14.157 -0.997 -10.065
239 HE3 LYS 30 3HE LYS 30 13.536 -0.237 -8.601
240 HZ1 LYS 30 3HZ LYS 30 14.852 1.553 -8.865
241 HZ2 LYS 30 1HZ LYS 30 14.842 1.087 -10.491
242 HZ3 LYS 30 2HZ LYS 30 16.146 0.668 -9.500
243 H PHE 31 H PHE 31 19.600 -3.722 -7.734
244 HA PHE 31 HA PHE 31 21.417 -2.960 -9.914
245 HB2 PHE 31 2HB PHE 31 22.146 -2.358 -7.105
246 HB3 PHE 31 3HB PHE 31 22.334 -1.375 -8.553
247 HD1 PHE 31 HD1 PHE 31 20.048 -2.365 -5.865
248 HD2 PHE 31 HD2 PHE 31 20.612 0.133 -9.265
249 HE1 PHE 31 HE1 PHE 31 18.084 -1.036 -5.209
250 HE2 PHE 31 HE2 PHE 31 18.650 1.467 -8.614
251 HZ PHE 31 HZ PHE 31 17.383 0.884 -6.584
252 H ASP 32 H ASP 32 22.109 -5.052 -10.444
253 HA ASP 32 HA ASP 32 23.179 -6.839 -8.485
254 HB2 ASP 32 2HB ASP 32 22.855 -6.809 -11.424
255 HB3 ASP 32 3HB ASP 32 24.203 -7.767 -10.816
256 H ASN 33 H ASN 33 24.345 -4.020 -9.820
257 HA ASN 33 HA ASN 33 27.127 -4.813 -9.261
258 HB2 ASN 33 2HB ASN 33 26.020 -3.700 -11.651
259 HB3 ASN 33 3HB ASN 33 27.108 -2.515 -10.935
260 HD21 ASN 33 2HD2 ASN 33 28.726 -6.171 -11.816
261 HD22 ASN 33 1HD2 ASN 33 27.165 -6.057 -11.085
262 H LYS 34 H LYS 34 24.710 -3.309 -7.887
263 HA LYS 34 HA LYS 34 26.426 -1.487 -6.432
264 HB2 LYS 34 2HB LYS 34 24.048 -0.528 -8.023
265 HB3 LYS 34 3HB LYS 34 24.735 0.390 -6.690
266 HG2 LYS 34 2HG LYS 34 26.179 -0.418 -9.206
267 HG3 LYS 34 3HG LYS 34 25.557 1.191 -8.832
268 HD2 LYS 34 2HD LYS 34 27.169 0.358 -6.653
269 HD3 LYS 34 3HD LYS 34 28.070 0.043 -8.138
270 HE2 LYS 34 2HE LYS 34 28.323 2.233 -8.596
271 HE3 LYS 34 3HE LYS 34 26.698 2.639 -8.047
272 HZ1 LYS 34 3HZ LYS 34 28.926 3.311 -6.741
273 HZ2 LYS 34 1HZ LYS 34 28.548 1.859 -5.960
274 HZ3 LYS 34 2HZ LYS 34 27.421 3.119 -5.993
275 H LYS 35 H LYS 35 24.821 -3.945 -5.985
276 HA LYS 35 HA LYS 35 22.475 -3.538 -4.592
277 HB2 LYS 35 2HB LYS 35 23.018 -5.627 -3.374
278 HB3 LYS 35 3HB LYS 35 23.269 -5.764 -5.109
279 HG2 LYS 35 2HG LYS 35 25.736 -5.003 -4.303
280 HG3 LYS 35 3HG LYS 35 25.194 -5.928 -2.901
281 HD2 LYS 35 2HD LYS 35 24.838 -7.872 -4.208
282 HD3 LYS 35 3HD LYS 35 24.993 -6.971 -5.718
283 HE2 LYS 35 2HE LYS 35 27.382 -6.444 -4.537
284 HE3 LYS 35 3HE LYS 35 27.063 -8.074 -3.946
285 HZ1 LYS 35 3HZ LYS 35 28.311 -7.906 -6.104
286 HZ2 LYS 35 1HZ LYS 35 26.877 -7.354 -6.813
287 HZ3 LYS 35 2HZ LYS 35 26.943 -8.900 -6.131
288 H CYS 36 H CYS 36 22.228 -3.881 -2.151
289 HA CYS 36 HA CYS 36 23.079 -1.666 -0.773
290 HB2 CYS 36 2HB CYS 36 22.620 -3.097 1.320
291 HB3 CYS 36 3HB CYS 36 21.297 -2.852 0.186
292 H THR 37 H THR 37 24.683 -1.232 0.754
293 HA THR 37 HA THR 37 26.863 -3.172 1.008
294 HB THR 37 HB THR 37 28.424 -1.071 0.768
295 HG1 THR 37 HG1 THR 37 27.608 0.430 -0.716
296 HG21 THR 37 3HG2 THR 37 28.955 -2.682 -0.748
297 HG22 THR 37 1HG2 THR 37 28.226 -1.527 -1.862
298 HG23 THR 37 2HG2 THR 37 27.284 -2.896 -1.271
299 H LYS 38 H LYS 38 24.682 -1.701 2.658
300 HA LYS 38 HA LYS 38 26.465 -1.093 4.912
301 HB2 LYS 38 2HB LYS 38 24.659 0.729 3.572
302 HB3 LYS 38 3HB LYS 38 24.210 0.534 5.261
303 HG2 LYS 38 2HG LYS 38 27.069 1.018 4.613
304 HG3 LYS 38 3HG LYS 38 25.935 2.366 4.490
305 HD2 LYS 38 2HD LYS 38 25.307 1.127 6.904
306 HD3 LYS 38 3HD LYS 38 27.071 1.115 6.839
307 HE2 LYS 38 2HE LYS 38 27.095 3.510 6.446
308 HE3 LYS 38 3HE LYS 38 25.333 3.544 6.414
309 HZ1 LYS 38 3HZ LYS 38 27.140 3.398 8.677
310 HZ2 LYS 38 1HZ LYS 38 25.771 2.410 8.782
311 HZ3 LYS 38 2HZ LYS 38 25.595 4.078 8.566
312 H ASP 39 H ASP 39 25.668 -1.617 6.954
313 HA ASP 39 HA ASP 39 23.658 -3.689 6.959
314 HB2 ASP 39 2HB ASP 39 25.923 -3.323 8.408
315 HB3 ASP 39 3HB ASP 39 24.718 -2.719 9.541
316 H ASN 40 H ASN 40 21.583 -3.479 7.501
317 HA ASN 40 HA ASN 40 19.601 -2.524 8.081
318 HB2 ASN 40 2HB ASN 40 21.364 -1.276 10.199
319 HB3 ASN 40 3HB ASN 40 19.604 -1.209 10.210
320 HD21 ASN 40 2HD2 ASN 40 21.098 -4.095 12.195
321 HD22 ASN 40 1HD2 ASN 40 21.605 -2.451 12.037
322 H ASN 41 H ASN 41 20.738 -1.305 5.933
323 HA ASN 41 HA ASN 41 20.754 1.565 6.339
324 HB2 ASN 41 2HB ASN 41 21.317 1.710 3.981
325 HB3 ASN 41 3HB ASN 41 22.323 0.484 4.746
326 HD21 ASN 41 2HD2 ASN 41 21.437 -1.912 2.449
327 HD22 ASN 41 1HD2 ASN 41 22.590 -1.237 3.545
328 H LYS 42 H LYS 42 19.576 2.535 4.075
329 HA LYS 42 HA LYS 42 16.745 2.027 4.634
330 HB2 LYS 42 2HB LYS 42 17.855 4.280 2.971
331 HB3 LYS 42 3HB LYS 42 16.287 4.183 3.762
332 HG2 LYS 42 2HG LYS 42 17.922 3.972 5.897
333 HG3 LYS 42 3HG LYS 42 18.904 4.982 4.834
334 HD2 LYS 42 2HD LYS 42 16.328 6.034 4.653
335 HD3 LYS 42 3HD LYS 42 16.550 5.662 6.365
336 HE2 LYS 42 2HE LYS 42 18.811 6.849 6.126
337 HE3 LYS 42 3HE LYS 42 18.172 7.478 4.608
338 HZ1 LYS 42 3HZ LYS 42 16.380 8.517 5.784
339 HZ2 LYS 42 1HZ LYS 42 17.835 8.982 6.512
340 HZ3 LYS 42 2HZ LYS 42 16.857 7.816 7.248
341 H CYS 43 H CYS 43 15.890 0.505 3.370
342 HA CYS 43 HA CYS 43 16.149 0.804 0.476
343 HB2 CYS 43 2HB CYS 43 16.754 -1.448 0.070
344 HB3 CYS 43 3HB CYS 43 17.843 -0.893 1.337
345 H THR 44 H THR 44 14.340 0.237 -0.656
346 HA THR 44 HA THR 44 12.072 -0.791 0.924
347 HB THR 44 HB THR 44 10.610 0.500 -0.684
348 HG1 THR 44 HG1 THR 44 12.152 0.917 -2.302
349 HG21 THR 44 3HG2 THR 44 12.103 2.656 0.563
350 HG22 THR 44 1HG2 THR 44 11.864 1.296 1.659
351 HG23 THR 44 2HG2 THR 44 10.473 2.072 0.900
352 H VAL 45 H VAL 45 11.136 -2.592 0.201
353 HA VAL 45 HA VAL 45 12.039 -3.725 -2.325
354 HB VAL 45 HB VAL 45 10.309 -4.919 -0.154
355 HG11 VAL 45 1HG1 VAL 45 10.705 -7.055 -1.298
356 HG12 VAL 45 2HG1 VAL 45 9.821 -5.917 -2.316
357 HG13 VAL 45 3HG1 VAL 45 11.540 -6.198 -2.593
358 HG21 VAL 45 3HG2 VAL 45 12.199 -5.990 0.674
359 HG22 VAL 45 1HG2 VAL 45 13.117 -5.729 -0.810
360 HG23 VAL 45 2HG2 VAL 45 12.800 -4.379 0.280
361 H ASP 46 H ASP 46 10.834 -3.904 -4.116
362 HA ASP 46 HA ASP 46 8.006 -3.086 -3.949
363 HB2 ASP 46 2HB ASP 46 10.134 -2.017 -5.518
364 HB3 ASP 46 3HB ASP 46 8.986 -2.787 -6.610
365 H THR 47 H THR 47 7.151 -5.141 -3.758
366 HA THR 47 HA THR 47 7.909 -7.347 -5.355
367 HB THR 47 HB THR 47 6.017 -8.495 -4.477
368 HG1 THR 47 HG1 THR 47 4.210 -7.491 -3.812
369 HG21 THR 47 3HG2 THR 47 6.913 -6.510 -2.384
370 HG22 THR 47 1HG2 THR 47 7.790 -7.969 -2.843
371 HG23 THR 47 2HG2 THR 47 6.203 -8.096 -2.086
372 H TYR 48 H TYR 48 6.126 -4.568 -6.083
373 HA TYR 48 HA TYR 48 4.153 -5.400 -7.819
374 HB2 TYR 48 2HB TYR 48 4.625 -3.037 -7.107
375 HB3 TYR 48 3HB TYR 48 5.940 -3.006 -8.276
376 HD1 TYR 48 HD1 TYR 48 2.503 -4.428 -8.559
377 HD2 TYR 48 HD2 TYR 48 5.287 -1.521 -9.939
378 HE1 TYR 48 HE1 TYR 48 0.919 -3.753 -10.315
379 HE2 TYR 48 HE2 TYR 48 3.710 -0.837 -11.698
380 HH TYR 48 HH TYR 48 1.614 -1.035 -12.470
381 H ASN 49 H ASN 49 7.615 -5.102 -8.390
382 HA ASN 49 HA ASN 49 7.389 -6.836 -10.698
383 HB2 ASN 49 2HB ASN 49 8.910 -5.127 -11.981
384 HB3 ASN 49 3HB ASN 49 7.160 -4.924 -11.988
385 HD21 ASN 49 2HD2 ASN 49 9.559 -2.292 -10.008
386 HD22 ASN 49 1HD2 ASN 49 10.147 -3.842 -10.494
387 H ASN 50 H ASN 50 8.615 -6.814 -7.998
388 HA ASN 50 HA ASN 50 10.553 -7.395 -6.950
389 HB2 ASN 50 2HB ASN 50 10.799 -8.658 -9.661
390 HB3 ASN 50 3HB ASN 50 12.124 -8.790 -8.508
391 HD21 ASN 50 2HD2 ASN 50 10.463 -10.998 -6.349
392 HD22 ASN 50 1HD2 ASN 50 11.725 -9.828 -6.494
393 H ALA 51 H ALA 51 11.202 -5.180 -6.716
394 HA ALA 51 HA ALA 51 13.797 -4.683 -7.849
395 HB1 ALA 51 1HB ALA 51 13.088 -3.487 -9.595
396 HB2 ALA 51 2HB ALA 51 11.445 -3.377 -8.965
397 HB3 ALA 51 3HB ALA 51 12.677 -2.240 -8.419
398 H VAL 52 H VAL 52 14.547 -4.631 -5.750
399 HA VAL 52 HA VAL 52 13.341 -2.900 -3.779
400 HB VAL 52 HB VAL 52 14.478 -5.120 -3.273
401 HG11 VAL 52 1HG1 VAL 52 16.876 -5.116 -2.973
402 HG12 VAL 52 2HG1 VAL 52 16.490 -4.694 -4.643
403 HG13 VAL 52 3HG1 VAL 52 16.970 -3.437 -3.502
404 HG21 VAL 52 3HG2 VAL 52 13.853 -3.317 -1.614
405 HG22 VAL 52 1HG2 VAL 52 15.131 -4.422 -1.108
406 HG23 VAL 52 2HG2 VAL 52 15.539 -2.802 -1.673
407 H ASP 53 H ASP 53 14.576 -1.244 -2.635
408 HA ASP 53 HA ASP 53 16.327 0.234 -4.482
409 HB2 ASP 53 2HB ASP 53 14.332 1.099 -2.425
410 HB3 ASP 53 3HB ASP 53 15.680 2.164 -2.813
411 H CYS 54 H CYS 54 17.707 -1.651 -3.279
412 HA CYS 54 HA CYS 54 18.676 -1.229 -0.704
413 HB2 CYS 54 2HB CYS 54 19.852 -2.519 -3.150
414 HB3 CYS 54 3HB CYS 54 20.793 -2.383 -1.668
415 H ASP 55 H ASP 55 20.025 0.200 0.188
416 HA ASP 55 HA ASP 55 20.750 2.574 -1.030
417 HB2 ASP 55 2HB ASP 55 20.754 1.878 1.481
418 HB3 ASP 55 3HB ASP 55 22.427 1.419 1.175
Start of MODEL 13
1 H1 ALA 1 H ALA 1 0.819 -0.942 -3.849
2 HA ALA 1 HA ALA 1 1.483 -0.604 -1.253
3 HB1 ALA 1 1HB ALA 1 1.653 -3.160 -2.841
4 HB2 ALA 1 2HB ALA 1 1.687 -3.079 -1.079
5 HB3 ALA 1 3HB ALA 1 0.257 -2.539 -1.960
6 H LYS 2 H LYS 2 3.445 0.700 -1.346
7 HA LYS 2 HA LYS 2 5.923 -0.667 -1.986
8 HB2 LYS 2 2HB LYS 2 5.147 1.965 -2.097
9 HB3 LYS 2 3HB LYS 2 6.108 1.926 -0.625
10 HG2 LYS 2 2HG LYS 2 7.439 0.504 -2.742
11 HG3 LYS 2 3HG LYS 2 7.029 2.145 -3.244
12 HD2 LYS 2 2HD LYS 2 8.289 1.662 -0.574
13 HD3 LYS 2 3HD LYS 2 9.286 1.694 -2.030
14 HE2 LYS 2 2HE LYS 2 7.739 3.921 -2.350
15 HE3 LYS 2 3HE LYS 2 7.955 3.879 -0.601
16 HZ1 LYS 2 3HZ LYS 2 10.420 3.521 -1.198
17 HZ2 LYS 2 1HZ LYS 2 9.771 5.079 -1.316
18 HZ3 LYS 2 2HZ LYS 2 9.993 4.148 -2.710
19 H TYR 3 H TYR 3 7.496 -1.270 -0.532
20 HA TYR 3 HA TYR 3 6.718 -1.195 2.310
21 HB2 TYR 3 2HB TYR 3 8.159 -3.381 0.798
22 HB3 TYR 3 3HB TYR 3 7.955 -3.353 2.546
23 HD1 TYR 3 HD1 TYR 3 6.683 -4.691 -0.385
24 HD2 TYR 3 HD2 TYR 3 5.382 -2.941 3.268
25 HE1 TYR 3 HE1 TYR 3 4.510 -5.816 -0.628
26 HE2 TYR 3 HE2 TYR 3 3.205 -4.062 3.036
27 HH TYR 3 HH TYR 3 2.077 -5.680 1.914
28 H THR 4 H THR 4 8.382 -0.974 3.850
29 HA THR 4 HA THR 4 10.932 0.027 2.759
30 HB THR 4 HB THR 4 9.513 1.030 5.234
31 HG1 THR 4 HG1 THR 4 8.487 2.192 3.790
32 HG21 THR 4 3HG2 THR 4 11.902 1.199 5.495
33 HG22 THR 4 1HG2 THR 4 11.259 2.806 5.157
34 HG23 THR 4 2HG2 THR 4 12.071 1.895 3.884
35 H GLY 5 H GLY 5 12.784 -0.738 3.636
36 HA2 GLY 5 2HA GLY 5 12.836 -1.992 6.231
37 HA3 GLY 5 3HA GLY 5 12.978 -3.134 4.903
38 H LYS 6 H LYS 6 15.072 -3.570 5.968
39 HA LYS 6 HA LYS 6 17.134 -1.834 4.817
40 HB2 LYS 6 2HB LYS 6 17.473 -2.984 7.575
41 HB3 LYS 6 3HB LYS 6 18.404 -1.712 6.797
42 HG2 LYS 6 2HG LYS 6 17.155 -0.419 8.163
43 HG3 LYS 6 3HG LYS 6 16.026 -0.516 6.810
44 HD2 LYS 6 2HD LYS 6 14.536 -1.689 8.001
45 HD3 LYS 6 3HD LYS 6 15.779 -2.744 8.678
46 HE2 LYS 6 2HE LYS 6 16.263 -1.220 10.414
47 HE3 LYS 6 3HE LYS 6 15.375 0.082 9.623
48 HZ1 LYS 6 3HZ LYS 6 14.098 -0.802 11.443
49 HZ2 LYS 6 1HZ LYS 6 14.202 -2.371 10.818
50 HZ3 LYS 6 2HZ LYS 6 13.325 -1.186 9.989
51 H CYS 7 H CYS 7 19.230 -2.896 4.603
52 HA CYS 7 HA CYS 7 18.951 -5.820 4.367
53 HB2 CYS 7 2HB CYS 7 21.044 -4.524 2.752
54 HB3 CYS 7 3HB CYS 7 19.889 -5.776 2.307
55 H THR 8 H THR 8 21.551 -6.504 3.876
56 HA THR 8 HA THR 8 23.101 -5.472 6.143
57 HB THR 8 HB THR 8 23.274 -8.395 5.727
58 HG1 THR 8 HG1 THR 8 21.026 -8.149 5.680
59 HG21 THR 8 3HG2 THR 8 23.992 -8.396 7.879
60 HG22 THR 8 1HG2 THR 8 22.828 -7.171 8.382
61 HG23 THR 8 2HG2 THR 8 24.301 -6.694 7.538
62 H LYS 9 H LYS 9 25.127 -5.027 5.586
63 HA LYS 9 HA LYS 9 26.109 -5.407 2.983
64 HB2 LYS 9 2HB LYS 9 28.298 -4.679 3.949
65 HB3 LYS 9 3HB LYS 9 26.956 -3.603 4.318
66 HG2 LYS 9 2HG LYS 9 27.584 -3.725 6.440
67 HG3 LYS 9 3HG LYS 9 26.994 -5.389 6.436
68 HD2 LYS 9 2HD LYS 9 29.464 -5.669 5.310
69 HD3 LYS 9 3HD LYS 9 29.739 -4.358 6.460
70 HE2 LYS 9 2HE LYS 9 28.738 -5.759 8.235
71 HE3 LYS 9 3HE LYS 9 28.575 -7.074 7.072
72 HZ1 LYS 9 3HZ LYS 9 30.806 -7.460 7.054
73 HZ2 LYS 9 1HZ LYS 9 30.645 -6.904 8.643
74 HZ3 LYS 9 2HZ LYS 9 31.218 -5.865 7.438
75 H SER 10 H SER 10 25.975 -7.530 5.634
76 HA SER 10 HA SER 10 28.232 -9.083 5.450
77 HB2 SER 10 2HB SER 10 26.845 -9.769 7.162
78 HB3 SER 10 3HB SER 10 25.391 -9.663 6.170
79 HG SER 10 HG SER 10 25.852 -11.818 6.480
80 H LYS 11 H LYS 11 25.198 -10.197 3.973
81 HA LYS 11 HA LYS 11 26.735 -11.019 1.600
82 HB2 LYS 11 2HB LYS 11 25.001 -12.633 3.382
83 HB3 LYS 11 3HB LYS 11 24.822 -12.916 1.656
84 HG2 LYS 11 2HG LYS 11 27.293 -13.275 1.544
85 HG3 LYS 11 3HG LYS 11 27.319 -13.202 3.307
86 HD2 LYS 11 2HD LYS 11 25.456 -15.079 1.907
87 HD3 LYS 11 3HD LYS 11 27.156 -15.509 2.115
88 HE2 LYS 11 2HE LYS 11 26.990 -15.522 4.442
89 HE3 LYS 11 3HE LYS 11 25.505 -14.572 4.435
90 HZ1 LYS 11 3HZ LYS 11 24.803 -16.717 4.911
91 HZ2 LYS 11 1HZ LYS 11 25.862 -17.433 3.802
92 HZ3 LYS 11 2HZ LYS 11 24.506 -16.584 3.251
93 H ASN 12 H ASN 12 24.715 -8.817 2.451
94 HA ASN 12 HA ASN 12 23.152 -7.554 1.383
95 HB2 ASN 12 2HB ASN 12 24.655 -8.235 -0.616
96 HB3 ASN 12 3HB ASN 12 23.351 -9.346 -1.023
97 HD21 ASN 12 2HD2 ASN 12 21.542 -6.926 -2.659
98 HD22 ASN 12 1HD2 ASN 12 21.965 -8.586 -2.431
99 H GLU 13 H GLU 13 21.089 -7.636 1.949
100 HA GLU 13 HA GLU 13 19.194 -9.400 0.907
101 HB2 GLU 13 2HB GLU 13 20.718 -10.684 2.819
102 HB3 GLU 13 3HB GLU 13 19.308 -10.157 3.728
103 HG2 GLU 13 2HG GLU 13 17.900 -11.221 1.929
104 HG3 GLU 13 3HG GLU 13 19.388 -11.938 1.312
105 H CYS 14 H CYS 14 17.992 -7.534 0.731
106 HA CYS 14 HA CYS 14 17.425 -5.909 3.049
107 HB2 CYS 14 2HB CYS 14 17.024 -5.721 0.156
108 HB3 CYS 14 3HB CYS 14 15.660 -5.109 1.086
109 H LYS 15 H LYS 15 16.058 -6.638 4.536
110 HA LYS 15 HA LYS 15 13.972 -8.519 3.904
111 HB2 LYS 15 2HB LYS 15 15.237 -8.613 6.032
112 HB3 LYS 15 3HB LYS 15 14.540 -7.065 6.494
113 HG2 LYS 15 2HG LYS 15 12.632 -9.194 5.759
114 HG3 LYS 15 3HG LYS 15 13.535 -9.421 7.258
115 HD2 LYS 15 2HD LYS 15 12.267 -6.776 6.735
116 HD3 LYS 15 3HD LYS 15 11.241 -8.125 7.229
117 HE2 LYS 15 2HE LYS 15 13.484 -8.165 8.926
118 HE3 LYS 15 3HE LYS 15 12.975 -6.480 8.817
119 HZ1 LYS 15 3HZ LYS 15 10.629 -7.591 9.183
120 HZ2 LYS 15 1HZ LYS 15 11.629 -7.179 10.485
121 HZ3 LYS 15 2HZ LYS 15 11.565 -8.779 9.941
122 H TYR 16 H TYR 16 11.715 -8.180 4.363
123 HA TYR 16 HA TYR 16 10.681 -5.553 4.800
124 HB2 TYR 16 2HB TYR 16 9.770 -5.067 2.676
125 HB3 TYR 16 3HB TYR 16 11.434 -5.546 2.359
126 HD1 TYR 16 HD1 TYR 16 8.050 -6.059 1.476
127 HD2 TYR 16 HD2 TYR 16 11.796 -8.059 1.750
128 HE1 TYR 16 HE1 TYR 16 7.250 -7.762 -0.108
129 HE2 TYR 16 HE2 TYR 16 11.007 -9.767 0.166
130 HH TYR 16 HH TYR 16 8.854 -9.554 -1.848
131 H LYS 17 H LYS 17 8.172 -5.706 3.904
132 HA LYS 17 HA LYS 17 7.142 -8.266 4.940
133 HB2 LYS 17 2HB LYS 17 5.221 -6.949 5.865
134 HB3 LYS 17 3HB LYS 17 6.765 -6.624 6.642
135 HG2 LYS 17 2HG LYS 17 6.957 -4.629 5.081
136 HG3 LYS 17 3HG LYS 17 5.252 -4.898 4.708
137 HD2 LYS 17 2HD LYS 17 5.037 -3.414 6.432
138 HD3 LYS 17 3HD LYS 17 5.052 -4.924 7.346
139 HE2 LYS 17 2HE LYS 17 7.613 -3.492 6.769
140 HE3 LYS 17 3HE LYS 17 6.574 -2.945 8.084
141 HZ1 LYS 17 3HZ LYS 17 7.942 -5.548 7.792
142 HZ2 LYS 17 1HZ LYS 17 6.638 -5.350 8.851
143 HZ3 LYS 17 2HZ LYS 17 8.047 -4.440 9.065
144 H ASN 18 H ASN 18 5.538 -9.231 3.808
145 HA ASN 18 HA ASN 18 4.338 -7.738 1.576
146 HB2 ASN 18 2HB ASN 18 4.409 -10.142 0.451
147 HB3 ASN 18 3HB ASN 18 5.768 -9.030 0.325
148 HD21 ASN 18 2HD2 ASN 18 6.048 -12.430 2.548
149 HD22 ASN 18 1HD2 ASN 18 4.515 -11.824 2.029
150 H ASP 19 H ASP 19 4.109 -10.476 3.790
151 HA ASP 19 HA ASP 19 1.264 -10.774 3.187
152 HB2 ASP 19 2HB ASP 19 3.249 -12.613 3.795
153 HB3 ASP 19 3HB ASP 19 2.323 -12.496 5.289
154 H ALA 20 H ALA 20 2.277 -8.416 4.572
155 HA ALA 20 HA ALA 20 1.513 -7.039 6.227
156 HB1 ALA 20 1HB ALA 20 -0.625 -8.432 5.855
157 HB2 ALA 20 2HB ALA 20 -0.169 -9.245 7.353
158 HB3 ALA 20 3HB ALA 20 -0.466 -7.506 7.349
159 H GLY 21 H GLY 21 3.926 -8.211 6.590
160 HA2 GLY 21 2HA GLY 21 5.047 -7.826 8.810
161 HA3 GLY 21 3HA GLY 21 3.914 -9.016 9.433
162 H LYS 22 H LYS 22 4.215 -10.520 6.814
163 HA LYS 22 HA LYS 22 5.968 -12.483 7.627
164 HB2 LYS 22 2HB LYS 22 4.619 -11.765 5.129
165 HB3 LYS 22 3HB LYS 22 6.124 -12.641 4.880
166 HG2 LYS 22 2HG LYS 22 3.865 -13.571 6.640
167 HG3 LYS 22 3HG LYS 22 4.150 -14.109 4.983
168 HD2 LYS 22 2HD LYS 22 5.537 -15.666 5.752
169 HD3 LYS 22 3HD LYS 22 6.587 -14.396 6.385
170 HE2 LYS 22 2HE LYS 22 6.122 -15.665 8.270
171 HE3 LYS 22 3HE LYS 22 4.944 -14.358 8.380
172 HZ1 LYS 22 3HZ LYS 22 4.527 -17.192 7.779
173 HZ2 LYS 22 1HZ LYS 22 3.495 -16.070 7.044
174 HZ3 LYS 22 2HZ LYS 22 3.602 -16.143 8.730
175 H ASP 23 H ASP 23 8.003 -12.045 8.245
176 HA ASP 23 HA ASP 23 9.674 -10.093 7.084
177 HB2 ASP 23 2HB ASP 23 11.511 -11.403 8.305
178 HB3 ASP 23 3HB ASP 23 10.213 -10.729 9.286
179 H THR 24 H THR 24 9.846 -10.319 4.881
180 HA THR 24 HA THR 24 11.020 -12.822 3.877
181 HB THR 24 HB THR 24 9.578 -10.630 2.373
182 HG1 THR 24 HG1 THR 24 8.851 -13.342 2.877
183 HG21 THR 24 3HG2 THR 24 11.333 -11.610 0.994
184 HG22 THR 24 1HG2 THR 24 9.746 -12.131 0.430
185 HG23 THR 24 2HG2 THR 24 10.751 -13.230 1.376
186 H PHE 25 H PHE 25 13.023 -12.847 3.054
187 HA PHE 25 HA PHE 25 14.495 -10.315 2.988
188 HB2 PHE 25 2HB PHE 25 15.716 -13.057 2.750
189 HB3 PHE 25 3HB PHE 25 16.479 -11.561 3.279
190 HD1 PHE 25 HD1 PHE 25 15.479 -14.605 4.410
191 HD2 PHE 25 HD2 PHE 25 15.025 -10.482 5.366
192 HE1 PHE 25 HE1 PHE 25 15.013 -15.203 6.751
193 HE2 PHE 25 HE2 PHE 25 14.559 -11.073 7.708
194 HZ PHE 25 HZ PHE 25 14.554 -13.436 8.404
195 H ILE 26 H ILE 26 15.087 -9.405 1.133
196 HA ILE 26 HA ILE 26 15.307 -11.064 -1.276
197 HB ILE 26 HB ILE 26 13.099 -10.117 -1.437
198 HG12 ILE 26 2HG1 ILE 26 13.318 -8.846 -3.522
199 HG13 ILE 26 3HG1 ILE 26 15.019 -8.553 -3.178
200 HG21 ILE 26 1HG2 ILE 26 14.363 -7.403 -1.090
201 HG22 ILE 26 2HG2 ILE 26 12.649 -7.753 -1.314
202 HG23 ILE 26 3HG2 ILE 26 13.468 -8.264 0.161
203 HD11 ILE 26 3HD1 ILE 26 14.217 -11.376 -3.203
204 HD12 ILE 26 1HD1 ILE 26 14.101 -10.537 -4.750
205 HD13 ILE 26 2HD1 ILE 26 15.638 -10.586 -3.887
206 H LYS 27 H LYS 27 17.155 -10.704 -2.301
207 HA LYS 27 HA LYS 27 18.982 -8.705 -1.453
208 HB2 LYS 27 2HB LYS 27 19.107 -10.334 -3.994
209 HB3 LYS 27 3HB LYS 27 20.449 -9.555 -3.168
210 HG2 LYS 27 2HG LYS 27 19.574 -11.127 -1.187
211 HG3 LYS 27 3HG LYS 27 19.072 -12.095 -2.575
212 HD2 LYS 27 2HD LYS 27 21.741 -11.087 -2.960
213 HD3 LYS 27 3HD LYS 27 21.624 -11.953 -1.426
214 HE2 LYS 27 2HE LYS 27 20.508 -13.115 -3.955
215 HE3 LYS 27 3HE LYS 27 22.217 -13.280 -3.555
216 HZ1 LYS 27 3HZ LYS 27 20.393 -13.965 -1.418
217 HZ2 LYS 27 1HZ LYS 27 21.782 -14.766 -1.955
218 HZ3 LYS 27 2HZ LYS 27 20.314 -14.985 -2.765
219 H CYS 28 H CYS 28 20.161 -7.707 -3.705
220 HA CYS 28 HA CYS 28 18.059 -5.959 -4.805
221 HB2 CYS 28 2HB CYS 28 19.811 -4.924 -3.271
222 HB3 CYS 28 3HB CYS 28 20.979 -5.244 -4.549
223 HA PRO 29 HA PRO 29 19.926 -8.387 -8.315
224 HB2 PRO 29 2HB PRO 29 17.547 -9.064 -9.434
225 HB3 PRO 29 3HB PRO 29 18.320 -10.024 -8.167
226 HG2 PRO 29 2HG PRO 29 16.109 -8.018 -7.942
227 HG3 PRO 29 3HG PRO 29 16.267 -9.602 -7.160
228 HD2 PRO 29 2HD PRO 29 16.822 -7.283 -5.877
229 HD3 PRO 29 3HD PRO 29 17.681 -8.797 -5.528
230 H LYS 30 H LYS 30 17.791 -5.725 -7.922
231 HA LYS 30 HA LYS 30 17.104 -4.943 -10.447
232 HB2 LYS 30 2HB LYS 30 17.245 -3.726 -7.917
233 HB3 LYS 30 3HB LYS 30 18.120 -2.657 -9.006
234 HG2 LYS 30 2HG LYS 30 15.931 -3.153 -10.491
235 HG3 LYS 30 3HG LYS 30 15.250 -3.287 -8.868
236 HD2 LYS 30 2HD LYS 30 15.512 -1.083 -8.436
237 HD3 LYS 30 3HD LYS 30 17.035 -0.983 -9.324
238 HE2 LYS 30 2HE LYS 30 14.387 -1.293 -10.711
239 HE3 LYS 30 3HE LYS 30 15.037 0.287 -10.275
240 HZ1 LYS 30 3HZ LYS 30 16.971 -1.322 -11.619
241 HZ2 LYS 30 1HZ LYS 30 16.421 0.235 -11.992
242 HZ3 LYS 30 2HZ LYS 30 15.579 -1.118 -12.559
243 H PHE 31 H PHE 31 20.105 -3.921 -8.805
244 HA PHE 31 HA PHE 31 21.264 -3.329 -11.434
245 HB2 PHE 31 2HB PHE 31 22.624 -2.642 -8.858
246 HB3 PHE 31 3HB PHE 31 22.674 -1.803 -10.404
247 HD1 PHE 31 HD1 PHE 31 20.668 -2.398 -7.378
248 HD2 PHE 31 HD2 PHE 31 21.090 -0.120 -10.949
249 HE1 PHE 31 HE1 PHE 31 18.957 -0.823 -6.572
250 HE2 PHE 31 HE2 PHE 31 19.381 1.458 -10.149
251 HZ PHE 31 HZ PHE 31 18.313 1.109 -7.957
252 H ASP 32 H ASP 32 21.854 -5.154 -8.470
253 HA ASP 32 HA ASP 32 23.120 -7.001 -8.056
254 HB2 ASP 32 2HB ASP 32 22.208 -7.448 -10.548
255 HB3 ASP 32 3HB ASP 32 23.936 -7.375 -10.884
256 H ASN 33 H ASN 33 24.230 -4.157 -8.844
257 HA ASN 33 HA ASN 33 27.050 -4.980 -8.660
258 HB2 ASN 33 2HB ASN 33 25.828 -3.544 -10.788
259 HB3 ASN 33 3HB ASN 33 26.868 -2.419 -9.920
260 HD21 ASN 33 2HD2 ASN 33 28.669 -5.779 -11.410
261 HD22 ASN 33 1HD2 ASN 33 27.131 -5.882 -10.630
262 H LYS 34 H LYS 34 24.599 -2.555 -7.948
263 HA LYS 34 HA LYS 34 26.381 -1.413 -5.900
264 HB2 LYS 34 2HB LYS 34 23.958 -0.166 -7.212
265 HB3 LYS 34 3HB LYS 34 24.985 0.603 -6.009
266 HG2 LYS 34 2HG LYS 34 25.907 -0.302 -8.728
267 HG3 LYS 34 3HG LYS 34 25.453 1.351 -8.308
268 HD2 LYS 34 2HD LYS 34 27.629 -0.197 -6.911
269 HD3 LYS 34 3HD LYS 34 27.918 0.890 -8.271
270 HE2 LYS 34 2HE LYS 34 26.571 2.582 -6.772
271 HE3 LYS 34 3HE LYS 34 27.097 1.512 -5.474
272 HZ1 LYS 34 3HZ LYS 34 28.674 3.291 -7.171
273 HZ2 LYS 34 1HZ LYS 34 29.394 1.835 -6.696
274 HZ3 LYS 34 2HZ LYS 34 28.848 2.928 -5.528
275 H LYS 35 H LYS 35 24.692 -3.837 -5.692
276 HA LYS 35 HA LYS 35 22.338 -3.515 -4.313
277 HB2 LYS 35 2HB LYS 35 23.037 -5.664 -3.095
278 HB3 LYS 35 3HB LYS 35 22.931 -5.719 -4.850
279 HG2 LYS 35 2HG LYS 35 25.578 -4.956 -3.997
280 HG3 LYS 35 3HG LYS 35 25.084 -6.487 -3.270
281 HD2 LYS 35 2HD LYS 35 24.612 -7.424 -5.434
282 HD3 LYS 35 3HD LYS 35 24.895 -5.868 -6.217
283 HE2 LYS 35 2HE LYS 35 26.991 -7.361 -4.650
284 HE3 LYS 35 3HE LYS 35 26.783 -7.512 -6.394
285 HZ1 LYS 35 3HZ LYS 35 27.839 -5.601 -6.731
286 HZ2 LYS 35 1HZ LYS 35 28.317 -5.658 -5.109
287 HZ3 LYS 35 2HZ LYS 35 26.939 -4.785 -5.555
288 H CYS 36 H CYS 36 22.002 -3.978 -1.919
289 HA CYS 36 HA CYS 36 22.875 -1.873 -0.380
290 HB2 CYS 36 2HB CYS 36 21.790 -4.582 0.321
291 HB3 CYS 36 3HB CYS 36 22.309 -3.485 1.597
292 H THR 37 H THR 37 24.784 -1.334 0.420
293 HA THR 37 HA THR 37 26.715 -3.478 1.030
294 HB THR 37 HB THR 37 28.481 -1.678 0.593
295 HG1 THR 37 HG1 THR 37 27.274 0.167 0.432
296 HG21 THR 37 3HG2 THR 37 27.734 -1.938 -2.055
297 HG22 THR 37 1HG2 THR 37 26.961 -3.317 -1.273
298 HG23 THR 37 2HG2 THR 37 28.704 -3.086 -1.134
299 H LYS 38 H LYS 38 24.772 -2.335 2.839
300 HA LYS 38 HA LYS 38 26.613 -1.485 4.924
301 HB2 LYS 38 2HB LYS 38 24.933 0.367 3.562
302 HB3 LYS 38 3HB LYS 38 24.299 0.162 5.189
303 HG2 LYS 38 2HG LYS 38 27.214 0.534 4.981
304 HG3 LYS 38 3HG LYS 38 26.216 1.923 4.544
305 HD2 LYS 38 2HD LYS 38 25.522 0.475 7.039
306 HD3 LYS 38 3HD LYS 38 26.995 1.448 7.049
307 HE2 LYS 38 2HE LYS 38 25.531 3.068 7.662
308 HE3 LYS 38 3HE LYS 38 25.344 3.209 5.915
309 HZ1 LYS 38 3HZ LYS 38 23.363 1.952 5.981
310 HZ2 LYS 38 1HZ LYS 38 23.230 3.093 7.223
311 HZ3 LYS 38 2HZ LYS 38 23.608 1.486 7.588
312 H ASP 39 H ASP 39 25.670 -1.612 7.074
313 HA ASP 39 HA ASP 39 23.719 -3.771 7.221
314 HB2 ASP 39 2HB ASP 39 24.332 -3.687 9.698
315 HB3 ASP 39 3HB ASP 39 25.610 -4.166 8.585
316 H ASN 40 H ASN 40 21.639 -3.408 7.579
317 HA ASN 40 HA ASN 40 19.687 -2.440 8.233
318 HB2 ASN 40 2HB ASN 40 21.274 -0.727 10.141
319 HB3 ASN 40 3HB ASN 40 19.610 -1.281 10.300
320 HD21 ASN 40 2HD2 ASN 40 20.413 -4.320 11.769
321 HD22 ASN 40 1HD2 ASN 40 19.195 -3.294 11.100
322 H ASN 41 H ASN 41 21.071 -1.364 6.012
323 HA ASN 41 HA ASN 41 21.092 1.487 6.113
324 HB2 ASN 41 2HB ASN 41 21.351 1.346 3.658
325 HB3 ASN 41 3HB ASN 41 22.479 0.291 4.504
326 HD21 ASN 41 2HD2 ASN 41 21.314 -2.633 3.068
327 HD22 ASN 41 1HD2 ASN 41 22.408 -1.860 4.159
328 H LYS 42 H LYS 42 19.778 2.372 3.917
329 HA LYS 42 HA LYS 42 16.963 1.937 4.653
330 HB2 LYS 42 2HB LYS 42 18.005 4.249 4.870
331 HB3 LYS 42 3HB LYS 42 18.075 4.281 3.113
332 HG2 LYS 42 2HG LYS 42 15.464 3.566 3.637
333 HG3 LYS 42 3HG LYS 42 15.836 4.745 4.897
334 HD2 LYS 42 2HD LYS 42 16.021 6.454 3.425
335 HD3 LYS 42 3HD LYS 42 16.740 5.437 2.174
336 HE2 LYS 42 2HE LYS 42 14.422 4.409 1.915
337 HE3 LYS 42 3HE LYS 42 13.837 5.759 2.885
338 HZ1 LYS 42 3HZ LYS 42 15.116 7.162 1.147
339 HZ2 LYS 42 1HZ LYS 42 13.589 6.546 0.757
340 HZ3 LYS 42 2HZ LYS 42 14.983 5.782 0.177
341 H CYS 43 H CYS 43 15.933 0.608 3.320
342 HA CYS 43 HA CYS 43 16.130 1.049 0.446
343 HB2 CYS 43 2HB CYS 43 16.554 -1.253 -0.091
344 HB3 CYS 43 3HB CYS 43 17.799 -0.727 1.038
345 H THR 44 H THR 44 14.251 0.673 -0.629
346 HA THR 44 HA THR 44 12.003 -0.370 0.969
347 HB THR 44 HB THR 44 10.560 1.043 -0.585
348 HG1 THR 44 HG1 THR 44 11.561 2.184 -2.050
349 HG21 THR 44 3HG2 THR 44 11.722 1.614 1.829
350 HG22 THR 44 1HG2 THR 44 10.471 2.581 1.050
351 HG23 THR 44 2HG2 THR 44 12.169 3.016 0.858
352 H VAL 45 H VAL 45 10.922 -2.068 0.189
353 HA VAL 45 HA VAL 45 11.769 -3.239 -2.318
354 HB VAL 45 HB VAL 45 9.748 -4.211 -0.292
355 HG11 VAL 45 1HG1 VAL 45 10.635 -5.251 -2.914
356 HG12 VAL 45 2HG1 VAL 45 10.476 -6.425 -1.606
357 HG13 VAL 45 3HG1 VAL 45 9.093 -5.438 -2.080
358 HG21 VAL 45 3HG2 VAL 45 11.775 -4.333 0.816
359 HG22 VAL 45 1HG2 VAL 45 11.677 -5.921 0.053
360 HG23 VAL 45 2HG2 VAL 45 12.682 -4.659 -0.661
361 H ASP 46 H ASP 46 10.504 -3.590 -4.118
362 HA ASP 46 HA ASP 46 7.902 -2.207 -4.169
363 HB2 ASP 46 2HB ASP 46 10.259 -1.734 -5.761
364 HB3 ASP 46 3HB ASP 46 8.922 -2.235 -6.793
365 H THR 47 H THR 47 6.761 -4.124 -3.820
366 HA THR 47 HA THR 47 7.153 -6.519 -5.246
367 HB THR 47 HB THR 47 5.035 -7.243 -4.401
368 HG1 THR 47 HG1 THR 47 3.656 -5.578 -4.821
369 HG21 THR 47 3HG2 THR 47 6.997 -6.669 -2.787
370 HG22 THR 47 1HG2 THR 47 5.413 -7.059 -2.120
371 HG23 THR 47 2HG2 THR 47 5.930 -5.377 -2.238
372 H TYR 48 H TYR 48 5.829 -3.540 -6.212
373 HA TYR 48 HA TYR 48 3.838 -4.197 -8.002
374 HB2 TYR 48 2HB TYR 48 4.732 -1.882 -7.349
375 HB3 TYR 48 3HB TYR 48 5.924 -2.113 -8.623
376 HD1 TYR 48 HD1 TYR 48 5.295 -2.011 -10.948
377 HD2 TYR 48 HD2 TYR 48 2.358 -1.621 -7.895
378 HE1 TYR 48 HE1 TYR 48 3.682 -1.187 -12.613
379 HE2 TYR 48 HE2 TYR 48 0.737 -0.798 -9.551
380 HH TYR 48 HH TYR 48 1.203 0.478 -12.104
381 H ASN 49 H ASN 49 7.343 -4.225 -8.511
382 HA ASN 49 HA ASN 49 6.938 -6.017 -10.789
383 HB2 ASN 49 2HB ASN 49 8.921 -4.671 -11.871
384 HB3 ASN 49 3HB ASN 49 7.262 -4.107 -12.053
385 HD21 ASN 49 2HD2 ASN 49 9.837 -2.097 -9.591
386 HD22 ASN 49 1HD2 ASN 49 10.079 -3.773 -9.935
387 H ASN 50 H ASN 50 7.944 -6.149 -7.946
388 HA ASN 50 HA ASN 50 9.620 -7.123 -6.748
389 HB2 ASN 50 2HB ASN 50 10.142 -8.546 -9.367
390 HB3 ASN 50 3HB ASN 50 10.654 -9.087 -7.771
391 HD21 ASN 50 2HD2 ASN 50 7.488 -10.763 -8.916
392 HD22 ASN 50 1HD2 ASN 50 9.004 -10.466 -9.689
393 H ALA 51 H ALA 51 10.811 -5.163 -6.526
394 HA ALA 51 HA ALA 51 13.502 -5.373 -7.463
395 HB1 ALA 51 1HB ALA 51 13.330 -2.935 -8.437
396 HB2 ALA 51 2HB ALA 51 12.983 -4.344 -9.441
397 HB3 ALA 51 3HB ALA 51 11.659 -3.414 -8.738
398 H VAL 52 H VAL 52 14.472 -5.020 -5.574
399 HA VAL 52 HA VAL 52 13.393 -3.275 -3.574
400 HB VAL 52 HB VAL 52 14.898 -5.416 -3.309
401 HG11 VAL 52 1HG1 VAL 52 16.762 -4.274 -4.606
402 HG12 VAL 52 2HG1 VAL 52 17.022 -3.294 -3.162
403 HG13 VAL 52 3HG1 VAL 52 17.212 -5.046 -3.085
404 HG21 VAL 52 3HG2 VAL 52 14.767 -4.910 -1.139
405 HG22 VAL 52 1HG2 VAL 52 15.809 -3.500 -1.327
406 HG23 VAL 52 2HG2 VAL 52 14.079 -3.366 -1.643
407 H ASP 53 H ASP 53 14.262 -1.343 -2.795
408 HA ASP 53 HA ASP 53 15.867 0.126 -4.766
409 HB2 ASP 53 2HB ASP 53 13.842 0.937 -2.717
410 HB3 ASP 53 3HB ASP 53 15.057 2.105 -3.229
411 H CYS 54 H CYS 54 17.521 -1.449 -3.531
412 HA CYS 54 HA CYS 54 18.506 -0.880 -1.022
413 HB2 CYS 54 2HB CYS 54 20.747 -1.630 -1.977
414 HB3 CYS 54 3HB CYS 54 19.404 -2.754 -2.158
415 H ASP 55 H ASP 55 20.112 0.480 -0.206
416 HA ASP 55 HA ASP 55 20.084 3.124 -0.996
417 HB2 ASP 55 2HB ASP 55 21.532 1.521 0.923
418 HB3 ASP 55 3HB ASP 55 22.587 2.743 0.219
Start of MODEL 14
1 H1 ALA 1 H ALA 1 1.425 -1.167 -0.593
2 HA ALA 1 HA ALA 1 1.993 -2.947 -2.135
3 HB1 ALA 1 1HB ALA 1 1.217 -1.014 -3.966
4 HB2 ALA 1 2HB ALA 1 2.933 -1.260 -4.290
5 HB3 ALA 1 3HB ALA 1 1.823 -2.630 -4.331
6 H LYS 2 H LYS 2 3.650 0.203 -2.309
7 HA LYS 2 HA LYS 2 6.260 -0.893 -2.395
8 HB2 LYS 2 2HB LYS 2 5.809 1.365 -3.184
9 HB3 LYS 2 3HB LYS 2 5.309 1.856 -1.571
10 HG2 LYS 2 2HG LYS 2 7.487 2.686 -1.849
11 HG3 LYS 2 3HG LYS 2 7.648 1.267 -0.810
12 HD2 LYS 2 2HD LYS 2 9.271 0.686 -2.257
13 HD3 LYS 2 3HD LYS 2 7.927 0.146 -3.265
14 HE2 LYS 2 2HE LYS 2 8.069 1.964 -4.664
15 HE3 LYS 2 3HE LYS 2 8.799 2.991 -3.431
16 HZ1 LYS 2 3HZ LYS 2 10.877 2.121 -3.808
17 HZ2 LYS 2 1HZ LYS 2 10.233 2.105 -5.373
18 HZ3 LYS 2 2HZ LYS 2 10.291 0.678 -4.468
19 H TYR 3 H TYR 3 7.465 -1.734 -0.830
20 HA TYR 3 HA TYR 3 6.634 -1.287 1.959
21 HB2 TYR 3 2HB TYR 3 8.136 -3.604 0.725
22 HB3 TYR 3 3HB TYR 3 7.811 -3.428 2.446
23 HD1 TYR 3 HD1 TYR 3 5.263 -3.093 3.058
24 HD2 TYR 3 HD2 TYR 3 6.667 -4.849 -0.555
25 HE1 TYR 3 HE1 TYR 3 3.094 -4.216 2.768
26 HE2 TYR 3 HE2 TYR 3 4.502 -5.976 -0.855
27 HH TYR 3 HH TYR 3 1.759 -5.254 1.155
28 H THR 4 H THR 4 8.154 -0.780 3.519
29 HA THR 4 HA THR 4 10.781 0.068 2.485
30 HB THR 4 HB THR 4 9.238 1.237 4.809
31 HG1 THR 4 HG1 THR 4 8.381 2.470 3.330
32 HG21 THR 4 3HG2 THR 4 11.969 1.728 3.694
33 HG22 THR 4 1HG2 THR 4 11.448 1.626 5.375
34 HG23 THR 4 2HG2 THR 4 11.070 3.060 4.420
35 H GLY 5 H GLY 5 12.606 -0.572 3.526
36 HA2 GLY 5 2HA GLY 5 12.569 -1.635 6.192
37 HA3 GLY 5 3HA GLY 5 12.729 -2.890 4.973
38 H LYS 6 H LYS 6 14.799 -3.373 5.893
39 HA LYS 6 HA LYS 6 16.900 -1.678 4.769
40 HB2 LYS 6 2HB LYS 6 17.169 -2.761 7.565
41 HB3 LYS 6 3HB LYS 6 18.166 -1.556 6.761
42 HG2 LYS 6 2HG LYS 6 16.948 -0.179 8.081
43 HG3 LYS 6 3HG LYS 6 15.860 -0.247 6.692
44 HD2 LYS 6 2HD LYS 6 14.256 -1.086 7.981
45 HD3 LYS 6 3HD LYS 6 15.287 -2.461 8.384
46 HE2 LYS 6 2HE LYS 6 14.853 -1.570 10.467
47 HE3 LYS 6 3HE LYS 6 16.385 -0.799 10.059
48 HZ1 LYS 6 3HZ LYS 6 14.779 1.009 9.083
49 HZ2 LYS 6 1HZ LYS 6 15.185 0.999 10.725
50 HZ3 LYS 6 2HZ LYS 6 13.703 0.363 10.217
51 H CYS 7 H CYS 7 18.913 -2.773 4.446
52 HA CYS 7 HA CYS 7 18.596 -5.696 4.302
53 HB2 CYS 7 2HB CYS 7 20.774 -4.513 2.734
54 HB3 CYS 7 3HB CYS 7 19.541 -5.674 2.253
55 H THR 8 H THR 8 21.174 -6.471 3.893
56 HA THR 8 HA THR 8 22.726 -5.443 6.155
57 HB THR 8 HB THR 8 22.859 -8.361 5.933
58 HG1 THR 8 HG1 THR 8 20.832 -8.813 6.505
59 HG21 THR 8 3HG2 THR 8 22.406 -7.994 8.470
60 HG22 THR 8 1HG2 THR 8 22.675 -6.294 8.091
61 HG23 THR 8 2HG2 THR 8 23.945 -7.478 7.782
62 H LYS 9 H LYS 9 24.760 -5.085 5.574
63 HA LYS 9 HA LYS 9 25.761 -5.669 3.019
64 HB2 LYS 9 2HB LYS 9 27.826 -4.744 3.765
65 HB3 LYS 9 3HB LYS 9 26.546 -3.840 4.563
66 HG2 LYS 9 2HG LYS 9 27.803 -4.175 6.389
67 HG3 LYS 9 3HG LYS 9 27.006 -5.751 6.408
68 HD2 LYS 9 2HD LYS 9 29.032 -6.325 4.764
69 HD3 LYS 9 3HD LYS 9 29.791 -5.031 5.693
70 HE2 LYS 9 2HE LYS 9 28.334 -7.120 7.209
71 HE3 LYS 9 3HE LYS 9 29.857 -7.588 6.454
72 HZ1 LYS 9 3HZ LYS 9 30.389 -5.189 7.654
73 HZ2 LYS 9 1HZ LYS 9 30.833 -6.716 8.231
74 HZ3 LYS 9 2HZ LYS 9 29.405 -5.989 8.773
75 H SER 10 H SER 10 25.527 -7.609 5.807
76 HA SER 10 HA SER 10 27.727 -9.258 5.721
77 HB2 SER 10 2HB SER 10 26.105 -9.517 7.475
78 HB3 SER 10 3HB SER 10 24.843 -9.942 6.320
79 HG SER 10 HG SER 10 26.890 -11.485 7.366
80 H LYS 11 H LYS 11 24.631 -10.350 4.361
81 HA LYS 11 HA LYS 11 26.137 -11.537 2.122
82 HB2 LYS 11 2HB LYS 11 24.991 -13.049 3.937
83 HB3 LYS 11 3HB LYS 11 23.522 -12.663 3.050
84 HG2 LYS 11 2HG LYS 11 25.170 -13.394 1.027
85 HG3 LYS 11 3HG LYS 11 25.753 -14.424 2.336
86 HD2 LYS 11 2HD LYS 11 23.765 -15.561 2.509
87 HD3 LYS 11 3HD LYS 11 22.816 -14.212 1.881
88 HE2 LYS 11 2HE LYS 11 23.381 -14.691 -0.332
89 HE3 LYS 11 3HE LYS 11 24.769 -15.672 0.138
90 HZ1 LYS 11 3HZ LYS 11 23.410 -17.438 0.748
91 HZ2 LYS 11 1HZ LYS 11 22.684 -16.865 -0.669
92 HZ3 LYS 11 2HZ LYS 11 22.017 -16.483 0.838
93 H ASN 12 H ASN 12 24.308 -9.015 2.743
94 HA ASN 12 HA ASN 12 22.987 -7.636 1.508
95 HB2 ASN 12 2HB ASN 12 24.184 -7.597 -0.420
96 HB3 ASN 12 3HB ASN 12 24.296 -9.352 -0.506
97 HD21 ASN 12 2HD2 ASN 12 21.094 -7.430 -2.174
98 HD22 ASN 12 1HD2 ASN 12 21.978 -6.704 -0.879
99 H GLU 13 H GLU 13 20.914 -7.697 2.069
100 HA GLU 13 HA GLU 13 19.011 -9.203 0.631
101 HB2 GLU 13 2HB GLU 13 20.191 -10.578 2.823
102 HB3 GLU 13 3HB GLU 13 18.541 -10.174 3.276
103 HG2 GLU 13 2HG GLU 13 17.759 -11.218 1.170
104 HG3 GLU 13 3HG GLU 13 19.419 -11.718 0.848
105 H CYS 14 H CYS 14 17.778 -7.413 0.436
106 HA CYS 14 HA CYS 14 17.271 -5.598 2.570
107 HB2 CYS 14 2HB CYS 14 17.211 -4.941 0.182
108 HB3 CYS 14 3HB CYS 14 15.774 -5.935 -0.037
109 H LYS 15 H LYS 15 16.032 -6.017 4.264
110 HA LYS 15 HA LYS 15 14.032 -8.095 4.191
111 HB2 LYS 15 2HB LYS 15 15.135 -8.076 6.231
112 HB3 LYS 15 3HB LYS 15 15.188 -6.320 6.303
113 HG2 LYS 15 2HG LYS 15 13.112 -6.152 7.210
114 HG3 LYS 15 3HG LYS 15 12.524 -7.613 6.414
115 HD2 LYS 15 2HD LYS 15 12.688 -7.993 8.797
116 HD3 LYS 15 3HD LYS 15 13.896 -8.968 7.957
117 HE2 LYS 15 2HE LYS 15 14.942 -8.003 9.873
118 HE3 LYS 15 3HE LYS 15 15.567 -7.177 8.446
119 HZ1 LYS 15 3HZ LYS 15 13.332 -6.112 10.075
120 HZ2 LYS 15 1HZ LYS 15 14.224 -5.304 8.886
121 HZ3 LYS 15 2HZ LYS 15 14.951 -5.709 10.358
122 H TYR 16 H TYR 16 11.817 -7.846 4.464
123 HA TYR 16 HA TYR 16 10.588 -5.285 4.775
124 HB2 TYR 16 2HB TYR 16 9.669 -4.961 2.623
125 HB3 TYR 16 3HB TYR 16 11.367 -5.329 2.342
126 HD1 TYR 16 HD1 TYR 16 7.987 -6.239 1.609
127 HD2 TYR 16 HD2 TYR 16 11.973 -7.724 1.694
128 HE1 TYR 16 HE1 TYR 16 7.333 -8.065 0.097
129 HE2 TYR 16 HE2 TYR 16 11.330 -9.553 0.181
130 HH TYR 16 HH TYR 16 7.981 -9.917 -0.943
131 H LYS 17 H LYS 17 8.109 -5.599 4.008
132 HA LYS 17 HA LYS 17 7.253 -8.225 5.035
133 HB2 LYS 17 2HB LYS 17 5.291 -7.028 6.034
134 HB3 LYS 17 3HB LYS 17 6.838 -6.625 6.768
135 HG2 LYS 17 2HG LYS 17 6.407 -4.784 4.672
136 HG3 LYS 17 3HG LYS 17 4.907 -4.897 5.596
137 HD2 LYS 17 2HD LYS 17 7.484 -4.662 7.072
138 HD3 LYS 17 3HD LYS 17 6.819 -3.224 6.295
139 HE2 LYS 17 2HE LYS 17 4.661 -3.709 7.492
140 HE3 LYS 17 3HE LYS 17 5.524 -4.952 8.396
141 HZ1 LYS 17 3HZ LYS 17 6.990 -2.554 8.489
142 HZ2 LYS 17 1HZ LYS 17 6.281 -3.408 9.766
143 HZ3 LYS 17 2HZ LYS 17 5.393 -2.228 8.942
144 H ASN 18 H ASN 18 5.421 -9.148 4.119
145 HA ASN 18 HA ASN 18 4.194 -7.739 1.859
146 HB2 ASN 18 2HB ASN 18 4.413 -9.645 0.401
147 HB3 ASN 18 3HB ASN 18 6.013 -9.241 1.018
148 HD21 ASN 18 2HD2 ASN 18 6.143 -12.114 3.174
149 HD22 ASN 18 1HD2 ASN 18 6.474 -10.418 3.188
150 H ASP 19 H ASP 19 4.088 -10.488 4.078
151 HA ASP 19 HA ASP 19 1.220 -10.798 3.607
152 HB2 ASP 19 2HB ASP 19 3.280 -12.610 4.178
153 HB3 ASP 19 3HB ASP 19 2.305 -12.545 5.643
154 H ALA 20 H ALA 20 2.293 -8.447 4.968
155 HA ALA 20 HA ALA 20 1.593 -7.087 6.665
156 HB1 ALA 20 1HB ALA 20 -0.014 -9.312 7.859
157 HB2 ALA 20 2HB ALA 20 -0.328 -7.576 7.873
158 HB3 ALA 20 3HB ALA 20 -0.549 -8.501 6.387
159 H GLY 21 H GLY 21 4.029 -8.236 6.903
160 HA2 GLY 21 2HA GLY 21 5.249 -7.859 9.074
161 HA3 GLY 21 3HA GLY 21 4.162 -9.071 9.734
162 H LYS 22 H LYS 22 4.351 -10.552 7.100
163 HA LYS 22 HA LYS 22 6.177 -12.491 7.805
164 HB2 LYS 22 2HB LYS 22 4.676 -11.787 5.395
165 HB3 LYS 22 3HB LYS 22 6.183 -12.624 5.049
166 HG2 LYS 22 2HG LYS 22 5.348 -14.276 6.891
167 HG3 LYS 22 3HG LYS 22 3.770 -13.587 6.504
168 HD2 LYS 22 2HD LYS 22 4.709 -14.061 4.020
169 HD3 LYS 22 3HD LYS 22 5.515 -15.354 4.910
170 HE2 LYS 22 2HE LYS 22 2.731 -15.089 5.668
171 HE3 LYS 22 3HE LYS 22 2.914 -15.371 3.938
172 HZ1 LYS 22 3HZ LYS 22 4.561 -17.202 4.788
173 HZ2 LYS 22 1HZ LYS 22 2.897 -17.500 4.709
174 HZ3 LYS 22 2HZ LYS 22 3.617 -17.109 6.189
175 H ASP 23 H ASP 23 8.235 -12.024 8.313
176 HA ASP 23 HA ASP 23 9.810 -10.038 7.083
177 HB2 ASP 23 2HB ASP 23 11.732 -11.385 8.168
178 HB3 ASP 23 3HB ASP 23 10.520 -10.666 9.224
179 H THR 24 H THR 24 9.984 -10.178 4.898
180 HA THR 24 HA THR 24 11.063 -12.676 3.774
181 HB THR 24 HB THR 24 9.667 -10.421 2.320
182 HG1 THR 24 HG1 THR 24 8.051 -12.204 2.090
183 HG21 THR 24 3HG2 THR 24 10.252 -11.396 0.397
184 HG22 THR 24 1HG2 THR 24 9.786 -12.991 0.986
185 HG23 THR 24 2HG2 THR 24 11.397 -12.361 1.328
186 H PHE 25 H PHE 25 13.100 -12.694 3.097
187 HA PHE 25 HA PHE 25 14.529 -10.147 2.876
188 HB2 PHE 25 2HB PHE 25 15.777 -12.890 2.852
189 HB3 PHE 25 3HB PHE 25 16.536 -11.350 3.243
190 HD1 PHE 25 HD1 PHE 25 15.538 -10.107 5.316
191 HD2 PHE 25 HD2 PHE 25 15.101 -14.273 4.561
192 HE1 PHE 25 HE1 PHE 25 15.084 -10.489 7.704
193 HE2 PHE 25 HE2 PHE 25 14.645 -14.661 6.947
194 HZ PHE 25 HZ PHE 25 14.635 -12.768 8.522
195 H ILE 26 H ILE 26 15.125 -9.348 0.971
196 HA ILE 26 HA ILE 26 15.349 -11.163 -1.329
197 HB ILE 26 HB ILE 26 13.169 -10.125 -1.532
198 HG12 ILE 26 2HG1 ILE 26 13.447 -9.036 -3.722
199 HG13 ILE 26 3HG1 ILE 26 15.171 -8.852 -3.414
200 HG21 ILE 26 1HG2 ILE 26 13.887 -7.395 -1.975
201 HG22 ILE 26 2HG2 ILE 26 12.751 -8.070 -0.809
202 HG23 ILE 26 3HG2 ILE 26 14.453 -7.897 -0.382
203 HD11 ILE 26 3HD1 ILE 26 14.308 -10.801 -4.890
204 HD12 ILE 26 1HD1 ILE 26 15.597 -11.088 -3.721
205 HD13 ILE 26 2HD1 ILE 26 13.941 -11.565 -3.343
206 H LYS 27 H LYS 27 17.229 -10.940 -2.331
207 HA LYS 27 HA LYS 27 19.184 -9.086 -1.575
208 HB2 LYS 27 2HB LYS 27 19.092 -10.509 -4.234
209 HB3 LYS 27 3HB LYS 27 20.514 -9.962 -3.357
210 HG2 LYS 27 2HG LYS 27 20.682 -11.988 -2.487
211 HG3 LYS 27 3HG LYS 27 19.177 -11.691 -1.613
212 HD2 LYS 27 2HD LYS 27 17.889 -12.787 -3.209
213 HD3 LYS 27 3HD LYS 27 19.124 -12.623 -4.459
214 HE2 LYS 27 2HE LYS 27 20.096 -14.124 -2.183
215 HE3 LYS 27 3HE LYS 27 18.640 -14.849 -2.863
216 HZ1 LYS 27 3HZ LYS 27 20.840 -15.585 -3.829
217 HZ2 LYS 27 1HZ LYS 27 20.936 -14.059 -4.554
218 HZ3 LYS 27 2HZ LYS 27 19.660 -15.100 -4.940
219 H CYS 28 H CYS 28 20.327 -8.017 -3.797
220 HA CYS 28 HA CYS 28 18.321 -6.039 -4.654
221 HB2 CYS 28 2HB CYS 28 20.513 -5.472 -3.251
222 HB3 CYS 28 3HB CYS 28 21.238 -5.463 -4.855
223 HA PRO 29 HA PRO 29 19.469 -8.358 -8.480
224 HB2 PRO 29 2HB PRO 29 16.959 -8.326 -9.513
225 HB3 PRO 29 3HB PRO 29 17.515 -9.561 -8.377
226 HG2 PRO 29 2HG PRO 29 15.879 -7.109 -7.858
227 HG3 PRO 29 3HG PRO 29 15.666 -8.750 -7.222
228 HD2 PRO 29 2HD PRO 29 16.823 -6.769 -5.784
229 HD3 PRO 29 3HD PRO 29 17.293 -8.473 -5.613
230 H LYS 30 H LYS 30 17.992 -5.322 -7.767
231 HA LYS 30 HA LYS 30 17.597 -4.243 -10.299
232 HB2 LYS 30 2HB LYS 30 17.615 -3.302 -7.631
233 HB3 LYS 30 3HB LYS 30 18.671 -2.236 -8.549
234 HG2 LYS 30 2HG LYS 30 15.794 -2.877 -9.163
235 HG3 LYS 30 3HG LYS 30 16.431 -1.356 -8.534
236 HD2 LYS 30 2HD LYS 30 16.693 -0.656 -10.628
237 HD3 LYS 30 3HD LYS 30 17.902 -1.922 -10.862
238 HE2 LYS 30 2HE LYS 30 16.149 -3.476 -11.545
239 HE3 LYS 30 3HE LYS 30 14.929 -2.231 -11.282
240 HZ1 LYS 30 3HZ LYS 30 16.365 -2.719 -13.600
241 HZ2 LYS 30 1HZ LYS 30 16.949 -1.252 -12.993
242 HZ3 LYS 30 2HZ LYS 30 15.297 -1.441 -13.302
243 H PHE 31 H PHE 31 20.448 -3.677 -8.224
244 HA PHE 31 HA PHE 31 22.007 -3.149 -10.659
245 HB2 PHE 31 2HB PHE 31 23.164 -2.543 -7.997
246 HB3 PHE 31 3HB PHE 31 23.242 -1.623 -9.495
247 HD1 PHE 31 HD1 PHE 31 21.589 0.026 -10.030
248 HD2 PHE 31 HD2 PHE 31 21.257 -2.320 -6.493
249 HE1 PHE 31 HE1 PHE 31 19.862 1.558 -9.179
250 HE2 PHE 31 HE2 PHE 31 19.529 -0.792 -5.638
251 HZ PHE 31 HZ PHE 31 18.828 1.150 -6.981
252 H ASP 32 H ASP 32 24.547 -3.526 -9.778
253 HA ASP 32 HA ASP 32 24.651 -6.330 -8.895
254 HB2 ASP 32 2HB ASP 32 25.031 -5.663 -11.491
255 HB3 ASP 32 3HB ASP 32 26.675 -5.493 -10.884
256 H ASN 33 H ASN 33 26.361 -3.269 -9.309
257 HA ASN 33 HA ASN 33 28.235 -4.103 -7.193
258 HB2 ASN 33 2HB ASN 33 28.673 -2.853 -9.756
259 HB3 ASN 33 3HB ASN 33 29.259 -1.808 -8.465
260 HD21 ASN 33 2HD2 ASN 33 31.502 -4.440 -7.258
261 HD22 ASN 33 1HD2 ASN 33 30.209 -3.487 -6.622
262 H LYS 34 H LYS 34 25.481 -2.646 -7.296
263 HA LYS 34 HA LYS 34 26.280 -0.469 -5.478
264 HB2 LYS 34 2HB LYS 34 23.833 -0.398 -7.240
265 HB3 LYS 34 3HB LYS 34 24.518 0.918 -6.295
266 HG2 LYS 34 2HG LYS 34 25.865 -0.382 -8.654
267 HG3 LYS 34 3HG LYS 34 24.944 1.123 -8.715
268 HD2 LYS 34 2HD LYS 34 26.676 1.611 -6.664
269 HD3 LYS 34 3HD LYS 34 27.659 0.608 -7.734
270 HE2 LYS 34 2HE LYS 34 26.101 2.980 -8.726
271 HE3 LYS 34 3HE LYS 34 27.744 3.125 -8.103
272 HZ1 LYS 34 3HZ LYS 34 27.598 2.879 -10.552
273 HZ2 LYS 34 1HZ LYS 34 26.978 1.320 -10.330
274 HZ3 LYS 34 2HZ LYS 34 28.543 1.690 -9.806
275 H LYS 35 H LYS 35 24.909 -3.407 -5.617
276 HA LYS 35 HA LYS 35 22.481 -3.328 -4.328
277 HB2 LYS 35 2HB LYS 35 23.201 -5.543 -3.298
278 HB3 LYS 35 3HB LYS 35 23.262 -5.435 -5.052
279 HG2 LYS 35 2HG LYS 35 25.233 -6.538 -4.377
280 HG3 LYS 35 3HG LYS 35 25.710 -4.898 -4.823
281 HD2 LYS 35 2HD LYS 35 26.099 -4.275 -2.632
282 HD3 LYS 35 3HD LYS 35 25.027 -5.517 -1.980
283 HE2 LYS 35 2HE LYS 35 27.439 -5.961 -1.581
284 HE3 LYS 35 3HE LYS 35 26.621 -7.238 -2.480
285 HZ1 LYS 35 3HZ LYS 35 27.868 -5.163 -4.083
286 HZ2 LYS 35 1HZ LYS 35 27.830 -6.838 -4.317
287 HZ3 LYS 35 2HZ LYS 35 28.933 -6.162 -3.228
288 H CYS 36 H CYS 36 22.017 -3.920 -2.023
289 HA CYS 36 HA CYS 36 22.813 -1.939 -0.278
290 HB2 CYS 36 2HB CYS 36 21.604 -4.652 0.124
291 HB3 CYS 36 3HB CYS 36 22.083 -3.698 1.524
292 H THR 37 H THR 37 24.775 -1.497 0.457
293 HA THR 37 HA THR 37 26.529 -3.741 1.222
294 HB THR 37 HB THR 37 28.421 -2.050 0.814
295 HG1 THR 37 HG1 THR 37 27.839 -0.456 -0.784
296 HG21 THR 37 3HG2 THR 37 28.797 -3.111 -1.134
297 HG22 THR 37 1HG2 THR 37 27.267 -2.578 -1.830
298 HG23 THR 37 2HG2 THR 37 27.309 -3.983 -0.764
299 H LYS 38 H LYS 38 24.605 -2.449 2.926
300 HA LYS 38 HA LYS 38 26.419 -1.611 5.042
301 HB2 LYS 38 2HB LYS 38 24.858 0.259 3.576
302 HB3 LYS 38 3HB LYS 38 24.147 0.118 5.179
303 HG2 LYS 38 2HG LYS 38 27.071 0.367 5.140
304 HG3 LYS 38 3HG LYS 38 26.187 1.773 4.544
305 HD2 LYS 38 2HD LYS 38 25.212 0.537 7.053
306 HD3 LYS 38 3HD LYS 38 26.749 1.401 7.132
307 HE2 LYS 38 2HE LYS 38 25.199 3.130 5.697
308 HE3 LYS 38 3HE LYS 38 24.021 2.420 6.800
309 HZ1 LYS 38 3HZ LYS 38 26.192 2.961 8.370
310 HZ2 LYS 38 1HZ LYS 38 24.767 3.870 8.287
311 HZ3 LYS 38 2HZ LYS 38 26.101 4.299 7.339
312 H ASP 39 H ASP 39 25.473 -1.726 7.160
313 HA ASP 39 HA ASP 39 23.426 -3.783 7.315
314 HB2 ASP 39 2HB ASP 39 25.175 -2.501 9.422
315 HB3 ASP 39 3HB ASP 39 23.984 -3.754 9.762
316 H ASN 40 H ASN 40 21.351 -3.338 7.588
317 HA ASN 40 HA ASN 40 19.414 -2.295 8.166
318 HB2 ASN 40 2HB ASN 40 21.028 -0.615 10.085
319 HB3 ASN 40 3HB ASN 40 19.324 -1.048 10.195
320 HD21 ASN 40 2HD2 ASN 40 22.147 -3.391 11.791
321 HD22 ASN 40 1HD2 ASN 40 22.474 -1.854 11.072
322 H ASN 41 H ASN 41 20.744 -1.350 5.925
323 HA ASN 41 HA ASN 41 20.872 1.524 5.982
324 HB2 ASN 41 2HB ASN 41 21.283 1.332 3.563
325 HB3 ASN 41 3HB ASN 41 22.329 0.252 4.480
326 HD21 ASN 41 2HD2 ASN 41 21.183 -2.641 2.976
327 HD22 ASN 41 1HD2 ASN 41 22.251 -1.883 4.103
328 H LYS 42 H LYS 42 19.683 2.345 3.683
329 HA LYS 42 HA LYS 42 16.836 2.014 4.321
330 HB2 LYS 42 2HB LYS 42 18.043 4.175 2.601
331 HB3 LYS 42 3HB LYS 42 16.461 4.161 3.369
332 HG2 LYS 42 2HG LYS 42 18.072 3.935 5.531
333 HG3 LYS 42 3HG LYS 42 19.086 4.900 4.455
334 HD2 LYS 42 2HD LYS 42 16.590 6.057 4.203
335 HD3 LYS 42 3HD LYS 42 16.679 5.639 5.916
336 HE2 LYS 42 2HE LYS 42 18.465 7.038 6.300
337 HE3 LYS 42 3HE LYS 42 19.016 6.968 4.628
338 HZ1 LYS 42 3HZ LYS 42 17.395 8.903 5.843
339 HZ2 LYS 42 1HZ LYS 42 16.477 8.130 4.650
340 HZ3 LYS 42 2HZ LYS 42 17.952 8.854 4.247
341 H CYS 43 H CYS 43 15.828 0.577 3.084
342 HA CYS 43 HA CYS 43 16.086 0.768 0.191
343 HB2 CYS 43 2HB CYS 43 16.524 -1.574 -0.145
344 HB3 CYS 43 3HB CYS 43 17.759 -0.936 0.936
345 H THR 44 H THR 44 14.226 0.297 -0.878
346 HA THR 44 HA THR 44 11.965 -0.656 0.757
347 HB THR 44 HB THR 44 10.469 0.710 -0.571
348 HG1 THR 44 HG1 THR 44 11.521 0.731 -2.558
349 HG21 THR 44 3HG2 THR 44 10.955 2.753 0.390
350 HG22 THR 44 1HG2 THR 44 12.684 2.609 0.078
351 HG23 THR 44 2HG2 THR 44 11.940 1.668 1.372
352 H VAL 45 H VAL 45 10.889 -2.396 0.058
353 HA VAL 45 HA VAL 45 11.699 -3.581 -2.490
354 HB VAL 45 HB VAL 45 10.105 -4.765 -0.211
355 HG11 VAL 45 1HG1 VAL 45 10.828 -5.763 -2.912
356 HG12 VAL 45 2HG1 VAL 45 10.895 -6.903 -1.566
357 HG13 VAL 45 3HG1 VAL 45 9.388 -6.065 -1.940
358 HG21 VAL 45 3HG2 VAL 45 12.311 -6.208 -0.193
359 HG22 VAL 45 1HG2 VAL 45 12.996 -4.755 -0.921
360 HG23 VAL 45 2HG2 VAL 45 12.222 -4.667 0.661
361 H ASP 46 H ASP 46 10.271 -4.125 -4.108
362 HA ASP 46 HA ASP 46 7.506 -3.156 -3.803
363 HB2 ASP 46 2HB ASP 46 9.541 -2.268 -5.654
364 HB3 ASP 46 3HB ASP 46 8.160 -2.930 -6.523
365 H THR 47 H THR 47 6.745 -5.246 -3.416
366 HA THR 47 HA THR 47 7.348 -7.491 -5.014
367 HB THR 47 HB THR 47 5.547 -8.615 -3.923
368 HG1 THR 47 HG1 THR 47 3.771 -7.440 -3.848
369 HG21 THR 47 3HG2 THR 47 7.507 -8.005 -2.515
370 HG22 THR 47 1HG2 THR 47 6.017 -8.208 -1.594
371 HG23 THR 47 2HG2 THR 47 6.616 -6.589 -1.956
372 H TYR 48 H TYR 48 5.429 -4.759 -5.625
373 HA TYR 48 HA TYR 48 3.332 -5.697 -7.156
374 HB2 TYR 48 2HB TYR 48 4.192 -3.243 -6.513
375 HB3 TYR 48 3HB TYR 48 4.768 -3.302 -8.175
376 HD1 TYR 48 HD1 TYR 48 1.666 -4.126 -6.250
377 HD2 TYR 48 HD2 TYR 48 3.350 -2.487 -9.796
378 HE1 TYR 48 HE1 TYR 48 -0.588 -3.541 -7.043
379 HE2 TYR 48 HE2 TYR 48 1.102 -1.896 -10.599
380 HH TYR 48 HH TYR 48 -1.068 -1.714 -10.027
381 H ASN 49 H ASN 49 6.669 -5.040 -8.164
382 HA ASN 49 HA ASN 49 6.279 -6.842 -10.434
383 HB2 ASN 49 2HB ASN 49 7.137 -5.339 -12.047
384 HB3 ASN 49 3HB ASN 49 5.952 -4.408 -11.136
385 HD21 ASN 49 2HD2 ASN 49 8.491 -2.522 -9.398
386 HD22 ASN 49 1HD2 ASN 49 7.045 -3.408 -9.067
387 H ASN 50 H ASN 50 7.743 -6.762 -7.787
388 HA ASN 50 HA ASN 50 9.724 -7.464 -6.919
389 HB2 ASN 50 2HB ASN 50 10.483 -8.447 -9.661
390 HB3 ASN 50 3HB ASN 50 10.886 -9.142 -8.094
391 HD21 ASN 50 2HD2 ASN 50 8.034 -10.864 -9.979
392 HD22 ASN 50 1HD2 ASN 50 9.486 -10.145 -10.578
393 H ALA 51 H ALA 51 10.709 -5.540 -6.435
394 HA ALA 51 HA ALA 51 13.103 -4.910 -7.800
395 HB1 ALA 51 1HB ALA 51 12.601 -3.191 -9.142
396 HB2 ALA 51 2HB ALA 51 10.949 -3.805 -9.063
397 HB3 ALA 51 3HB ALA 51 11.457 -2.501 -7.990
398 H VAL 52 H VAL 52 14.454 -4.080 -6.342
399 HA VAL 52 HA VAL 52 13.299 -2.816 -3.944
400 HB VAL 52 HB VAL 52 14.570 -4.979 -3.637
401 HG11 VAL 52 1HG1 VAL 52 16.940 -3.228 -4.283
402 HG12 VAL 52 2HG1 VAL 52 17.000 -4.893 -3.702
403 HG13 VAL 52 3HG1 VAL 52 16.326 -4.537 -5.293
404 HG21 VAL 52 3HG2 VAL 52 15.734 -4.200 -1.639
405 HG22 VAL 52 1HG2 VAL 52 15.650 -2.539 -2.228
406 HG23 VAL 52 2HG2 VAL 52 14.170 -3.401 -1.806
407 H ASP 53 H ASP 53 14.331 -0.996 -3.047
408 HA ASP 53 HA ASP 53 16.027 0.471 -4.957
409 HB2 ASP 53 2HB ASP 53 13.839 1.331 -3.114
410 HB3 ASP 53 3HB ASP 53 15.141 2.467 -3.457
411 H CYS 54 H CYS 54 17.666 -0.992 -3.753
412 HA CYS 54 HA CYS 54 18.439 -0.623 -1.135
413 HB2 CYS 54 2HB CYS 54 20.195 -1.066 -3.558
414 HB3 CYS 54 3HB CYS 54 20.727 -1.255 -1.891
415 H ASP 55 H ASP 55 20.208 0.610 -0.209
416 HA ASP 55 HA ASP 55 20.019 3.377 -0.855
417 HB2 ASP 55 2HB ASP 55 20.334 2.943 1.426
418 HB3 ASP 55 3HB ASP 55 21.629 1.788 1.123
Start of MODEL 15
1 H1 ALA 1 H ALA 1 1.600 1.399 -3.568
2 HA ALA 1 HA ALA 1 2.464 2.541 -1.299
3 HB1 ALA 1 1HB ALA 1 0.107 1.103 -0.661
4 HB2 ALA 1 2HB ALA 1 1.466 0.286 0.112
5 HB3 ALA 1 3HB ALA 1 1.175 1.998 0.421
6 H LYS 2 H LYS 2 4.373 1.659 -0.579
7 HA LYS 2 HA LYS 2 5.092 -0.984 -1.664
8 HB2 LYS 2 2HB LYS 2 7.347 -0.163 -2.094
9 HB3 LYS 2 3HB LYS 2 6.165 0.805 -2.965
10 HG2 LYS 2 2HG LYS 2 6.583 2.670 -1.744
11 HG3 LYS 2 3HG LYS 2 6.988 1.761 -0.286
12 HD2 LYS 2 2HD LYS 2 9.076 2.478 -0.847
13 HD3 LYS 2 3HD LYS 2 9.034 0.995 -1.802
14 HE2 LYS 2 2HE LYS 2 9.238 2.144 -3.694
15 HE3 LYS 2 3HE LYS 2 7.856 3.158 -3.280
16 HZ1 LYS 2 3HZ LYS 2 9.351 4.791 -3.171
17 HZ2 LYS 2 1HZ LYS 2 10.667 3.731 -3.099
18 HZ3 LYS 2 2HZ LYS 2 9.819 4.123 -1.689
19 H TYR 3 H TYR 3 7.056 -1.914 -0.539
20 HA TYR 3 HA TYR 3 6.646 -1.663 2.335
21 HB2 TYR 3 2HB TYR 3 8.371 -3.647 0.843
22 HB3 TYR 3 3HB TYR 3 7.860 -3.745 2.525
23 HD1 TYR 3 HD1 TYR 3 7.183 -4.833 -0.746
24 HD2 TYR 3 HD2 TYR 3 5.244 -3.749 2.882
25 HE1 TYR 3 HE1 TYR 3 5.197 -6.112 -1.432
26 HE2 TYR 3 HE2 TYR 3 3.253 -5.026 2.207
27 HH TYR 3 HH TYR 3 2.667 -6.868 0.712
28 H THR 4 H THR 4 8.390 -1.425 3.815
29 HA THR 4 HA THR 4 10.845 -0.271 2.677
30 HB THR 4 HB THR 4 9.492 0.856 5.128
31 HG1 THR 4 HG1 THR 4 8.401 2.190 3.862
32 HG21 THR 4 3HG2 THR 4 12.011 1.312 3.740
33 HG22 THR 4 1HG2 THR 4 11.503 1.817 5.351
34 HG23 THR 4 2HG2 THR 4 11.070 2.790 3.945
35 H GLY 5 H GLY 5 12.712 -0.885 3.637
36 HA2 GLY 5 2HA GLY 5 12.726 -1.986 6.316
37 HA3 GLY 5 3HA GLY 5 13.040 -3.159 5.046
38 H LYS 6 H LYS 6 15.135 -3.523 5.875
39 HA LYS 6 HA LYS 6 17.069 -1.525 4.975
40 HB2 LYS 6 2HB LYS 6 17.417 -2.863 7.650
41 HB3 LYS 6 3HB LYS 6 18.306 -1.496 6.991
42 HG2 LYS 6 2HG LYS 6 16.952 -0.388 8.432
43 HG3 LYS 6 3HG LYS 6 15.900 -0.392 7.014
44 HD2 LYS 6 2HD LYS 6 14.427 -1.827 7.951
45 HD3 LYS 6 3HD LYS 6 15.689 -2.751 8.769
46 HE2 LYS 6 2HE LYS 6 15.031 0.019 9.682
47 HE3 LYS 6 3HE LYS 6 14.004 -1.332 10.160
48 HZ1 LYS 6 3HZ LYS 6 16.458 -0.543 11.258
49 HZ2 LYS 6 1HZ LYS 6 16.665 -2.077 10.575
50 HZ3 LYS 6 2HZ LYS 6 15.459 -1.823 11.734
51 H CYS 7 H CYS 7 19.119 -2.373 4.450
52 HA CYS 7 HA CYS 7 19.080 -5.262 3.949
53 HB2 CYS 7 2HB CYS 7 19.881 -3.016 2.402
54 HB3 CYS 7 3HB CYS 7 21.322 -3.974 2.726
55 H THR 8 H THR 8 21.295 -6.326 4.009
56 HA THR 8 HA THR 8 22.855 -5.339 6.304
57 HB THR 8 HB THR 8 22.833 -8.254 6.017
58 HG1 THR 8 HG1 THR 8 20.448 -6.909 6.819
59 HG21 THR 8 3HG2 THR 8 22.931 -8.217 8.334
60 HG22 THR 8 1HG2 THR 8 22.034 -6.704 8.451
61 HG23 THR 8 2HG2 THR 8 23.712 -6.694 7.910
62 H LYS 9 H LYS 9 24.913 -5.024 5.804
63 HA LYS 9 HA LYS 9 26.039 -5.691 3.320
64 HB2 LYS 9 2HB LYS 9 28.167 -4.943 4.289
65 HB3 LYS 9 3HB LYS 9 26.860 -3.829 4.669
66 HG2 LYS 9 2HG LYS 9 27.251 -4.041 6.835
67 HG3 LYS 9 3HG LYS 9 27.071 -5.794 6.738
68 HD2 LYS 9 2HD LYS 9 29.608 -4.706 5.701
69 HD3 LYS 9 3HD LYS 9 29.361 -4.549 7.442
70 HE2 LYS 9 2HE LYS 9 29.647 -6.741 7.786
71 HE3 LYS 9 3HE LYS 9 28.631 -7.176 6.413
72 HZ1 LYS 9 3HZ LYS 9 31.517 -6.520 6.403
73 HZ2 LYS 9 1HZ LYS 9 30.592 -6.551 4.987
74 HZ3 LYS 9 2HZ LYS 9 30.772 -7.956 5.911
75 H SER 10 H SER 10 25.577 -7.563 6.119
76 HA SER 10 HA SER 10 27.724 -9.265 6.241
77 HB2 SER 10 2HB SER 10 24.939 -9.354 7.039
78 HB3 SER 10 3HB SER 10 25.505 -10.948 6.541
79 HG SER 10 HG SER 10 25.838 -10.238 8.832
80 H LYS 11 H LYS 11 24.779 -9.877 4.319
81 HA LYS 11 HA LYS 11 26.425 -11.106 2.244
82 HB2 LYS 11 2HB LYS 11 24.932 -12.625 4.120
83 HB3 LYS 11 3HB LYS 11 24.092 -12.731 2.579
84 HG2 LYS 11 2HG LYS 11 25.810 -13.843 1.559
85 HG3 LYS 11 3HG LYS 11 27.036 -13.153 2.625
86 HD2 LYS 11 2HD LYS 11 26.567 -14.651 4.340
87 HD3 LYS 11 3HD LYS 11 24.963 -15.026 3.705
88 HE2 LYS 11 2HE LYS 11 26.091 -16.104 1.746
89 HE3 LYS 11 3HE LYS 11 27.627 -15.880 2.583
90 HZ1 LYS 11 3HZ LYS 11 25.408 -17.268 3.932
91 HZ2 LYS 11 1HZ LYS 11 27.074 -17.411 4.192
92 HZ3 LYS 11 2HZ LYS 11 26.370 -18.104 2.819
93 H ASN 12 H ASN 12 24.458 -8.767 2.833
94 HA ASN 12 HA ASN 12 23.030 -7.495 1.601
95 HB2 ASN 12 2HB ASN 12 23.999 -7.455 -0.430
96 HB3 ASN 12 3HB ASN 12 24.392 -9.171 -0.367
97 HD21 ASN 12 2HD2 ASN 12 21.126 -7.837 -2.349
98 HD22 ASN 12 1HD2 ASN 12 22.106 -6.788 -1.387
99 H GLU 13 H GLU 13 20.941 -7.519 2.072
100 HA GLU 13 HA GLU 13 19.051 -9.188 0.883
101 HB2 GLU 13 2HB GLU 13 20.401 -10.515 2.940
102 HB3 GLU 13 3HB GLU 13 18.869 -10.027 3.651
103 HG2 GLU 13 2HG GLU 13 17.701 -11.095 1.745
104 HG3 GLU 13 3HG GLU 13 19.261 -11.679 1.168
105 H CYS 14 H CYS 14 17.538 -7.669 0.735
106 HA CYS 14 HA CYS 14 17.093 -5.788 2.898
107 HB2 CYS 14 2HB CYS 14 17.108 -5.070 0.508
108 HB3 CYS 14 3HB CYS 14 15.649 -6.023 0.251
109 H LYS 15 H LYS 15 15.722 -6.174 4.493
110 HA LYS 15 HA LYS 15 13.781 -8.314 4.282
111 HB2 LYS 15 2HB LYS 15 15.111 -8.071 6.329
112 HB3 LYS 15 3HB LYS 15 14.440 -6.465 6.583
113 HG2 LYS 15 2HG LYS 15 12.525 -8.709 6.324
114 HG3 LYS 15 3HG LYS 15 13.489 -8.622 7.800
115 HD2 LYS 15 2HD LYS 15 12.225 -6.107 6.884
116 HD3 LYS 15 3HD LYS 15 11.145 -7.357 7.506
117 HE2 LYS 15 2HE LYS 15 13.534 -6.926 9.139
118 HE3 LYS 15 3HE LYS 15 12.484 -5.515 9.024
119 HZ1 LYS 15 3HZ LYS 15 10.628 -7.169 9.583
120 HZ2 LYS 15 1HZ LYS 15 11.655 -6.669 10.832
121 HZ3 LYS 15 2HZ LYS 15 11.872 -8.185 10.115
122 H TYR 16 H TYR 16 11.534 -8.059 4.724
123 HA TYR 16 HA TYR 16 10.259 -5.565 5.025
124 HB2 TYR 16 2HB TYR 16 9.410 -5.123 2.847
125 HB3 TYR 16 3HB TYR 16 11.144 -5.359 2.659
126 HD1 TYR 16 HD1 TYR 16 11.841 -7.866 2.118
127 HD2 TYR 16 HD2 TYR 16 8.003 -6.192 1.363
128 HE1 TYR 16 HE1 TYR 16 11.426 -9.598 0.421
129 HE2 TYR 16 HE2 TYR 16 7.577 -7.920 -0.334
130 HH TYR 16 HH TYR 16 8.792 -9.438 -1.761
131 H LYS 17 H LYS 17 7.847 -5.955 3.835
132 HA LYS 17 HA LYS 17 6.969 -8.555 4.912
133 HB2 LYS 17 2HB LYS 17 4.815 -7.434 5.454
134 HB3 LYS 17 3HB LYS 17 6.183 -6.788 6.351
135 HG2 LYS 17 2HG LYS 17 6.278 -5.013 4.481
136 HG3 LYS 17 3HG LYS 17 4.634 -5.542 4.117
137 HD2 LYS 17 2HD LYS 17 4.387 -5.235 6.753
138 HD3 LYS 17 3HD LYS 17 5.688 -4.076 6.471
139 HE2 LYS 17 2HE LYS 17 4.373 -2.729 5.132
140 HE3 LYS 17 3HE LYS 17 3.271 -4.040 4.716
141 HZ1 LYS 17 3HZ LYS 17 1.930 -3.290 6.292
142 HZ2 LYS 17 1HZ LYS 17 3.065 -2.143 6.801
143 HZ3 LYS 17 2HZ LYS 17 3.087 -3.703 7.455
144 H ASN 18 H ASN 18 5.354 -9.674 3.808
145 HA ASN 18 HA ASN 18 4.832 -8.710 1.072
146 HB2 ASN 18 2HB ASN 18 4.452 -11.319 0.747
147 HB3 ASN 18 3HB ASN 18 6.058 -10.605 0.642
148 HD21 ASN 18 2HD2 ASN 18 7.236 -12.025 3.638
149 HD22 ASN 18 1HD2 ASN 18 7.415 -10.711 2.531
150 H ASP 19 H ASP 19 3.456 -11.268 3.131
151 HA ASP 19 HA ASP 19 0.808 -10.754 2.195
152 HB2 ASP 19 2HB ASP 19 2.061 -12.612 4.160
153 HB3 ASP 19 3HB ASP 19 0.328 -12.325 4.288
154 H ALA 20 H ALA 20 1.848 -10.840 5.593
155 HA ALA 20 HA ALA 20 0.641 -8.222 6.047
156 HB1 ALA 20 1HB ALA 20 -0.191 -10.618 7.675
157 HB2 ALA 20 2HB ALA 20 -0.799 -8.967 7.810
158 HB3 ALA 20 3HB ALA 20 -1.152 -9.921 6.369
159 H GLY 21 H GLY 21 3.193 -8.266 6.131
160 HA2 GLY 21 2HA GLY 21 4.749 -7.428 7.704
161 HA3 GLY 21 3HA GLY 21 3.854 -8.237 8.983
162 H LYS 22 H LYS 22 4.213 -10.324 6.410
163 HA LYS 22 HA LYS 22 5.800 -12.153 7.780
164 HB2 LYS 22 2HB LYS 22 4.719 -11.880 5.075
165 HB3 LYS 22 3HB LYS 22 6.234 -12.772 5.127
166 HG2 LYS 22 2HG LYS 22 4.009 -13.458 7.002
167 HG3 LYS 22 3HG LYS 22 4.003 -14.051 5.339
168 HD2 LYS 22 2HD LYS 22 5.208 -15.757 6.165
169 HD3 LYS 22 3HD LYS 22 6.555 -14.616 6.120
170 HE2 LYS 22 2HE LYS 22 5.295 -14.041 8.509
171 HE3 LYS 22 3HE LYS 22 5.176 -15.796 8.396
172 HZ1 LYS 22 3HZ LYS 22 7.771 -14.762 7.703
173 HZ2 LYS 22 1HZ LYS 22 7.354 -16.034 8.738
174 HZ3 LYS 22 2HZ LYS 22 7.325 -14.440 9.303
175 H ASP 23 H ASP 23 7.778 -11.653 8.507
176 HA ASP 23 HA ASP 23 9.583 -9.886 7.279
177 HB2 ASP 23 2HB ASP 23 10.309 -12.151 9.144
178 HB3 ASP 23 3HB ASP 23 11.201 -10.655 8.882
179 H THR 24 H THR 24 9.932 -10.352 5.135
180 HA THR 24 HA THR 24 11.387 -12.858 4.589
181 HB THR 24 HB THR 24 9.522 -11.373 2.728
182 HG1 THR 24 HG1 THR 24 9.322 -14.027 3.739
183 HG21 THR 24 3HG2 THR 24 11.514 -13.544 2.286
184 HG22 THR 24 1HG2 THR 24 11.049 -12.209 1.232
185 HG23 THR 24 2HG2 THR 24 9.990 -13.610 1.401
186 H PHE 25 H PHE 25 13.327 -12.689 3.626
187 HA PHE 25 HA PHE 25 14.323 -10.002 3.068
188 HB2 PHE 25 2HB PHE 25 15.972 -12.518 3.000
189 HB3 PHE 25 3HB PHE 25 16.497 -10.868 3.320
190 HD1 PHE 25 HD1 PHE 25 14.548 -10.013 5.345
191 HD2 PHE 25 HD2 PHE 25 16.601 -13.713 4.882
192 HE1 PHE 25 HE1 PHE 25 14.354 -10.420 7.764
193 HE2 PHE 25 HE2 PHE 25 16.410 -14.126 7.300
194 HZ PHE 25 HZ PHE 25 15.285 -12.478 8.744
195 H ILE 26 H ILE 26 14.819 -9.272 1.086
196 HA ILE 26 HA ILE 26 14.810 -11.189 -1.148
197 HB ILE 26 HB ILE 26 12.674 -10.074 -1.217
198 HG12 ILE 26 2HG1 ILE 26 12.804 -9.027 -3.435
199 HG13 ILE 26 3HG1 ILE 26 14.549 -8.870 -3.266
200 HG21 ILE 26 1HG2 ILE 26 13.430 -8.101 0.140
201 HG22 ILE 26 2HG2 ILE 26 14.121 -7.438 -1.340
202 HG23 ILE 26 3HG2 ILE 26 12.383 -7.714 -1.226
203 HD11 ILE 26 3HD1 ILE 26 13.028 -11.465 -3.352
204 HD12 ILE 26 1HD1 ILE 26 13.926 -10.749 -4.690
205 HD13 ILE 26 2HD1 ILE 26 14.778 -11.284 -3.242
206 H LYS 27 H LYS 27 16.670 -11.137 -2.201
207 HA LYS 27 HA LYS 27 18.746 -9.357 -1.742
208 HB2 LYS 27 2HB LYS 27 18.187 -11.056 -4.178
209 HB3 LYS 27 3HB LYS 27 19.713 -10.235 -3.876
210 HG2 LYS 27 2HG LYS 27 19.923 -11.531 -1.766
211 HG3 LYS 27 3HG LYS 27 18.476 -12.430 -2.229
212 HD2 LYS 27 2HD LYS 27 20.123 -12.527 -4.473
213 HD3 LYS 27 3HD LYS 27 21.214 -12.757 -3.105
214 HE2 LYS 27 2HE LYS 27 20.168 -14.700 -2.430
215 HE3 LYS 27 3HE LYS 27 18.645 -14.275 -3.209
216 HZ1 LYS 27 3HZ LYS 27 19.317 -15.705 -4.771
217 HZ2 LYS 27 1HZ LYS 27 20.935 -15.661 -4.281
218 HZ3 LYS 27 2HZ LYS 27 20.328 -14.456 -5.300
219 H CYS 28 H CYS 28 19.804 -8.103 -3.679
220 HA CYS 28 HA CYS 28 17.738 -6.289 -4.737
221 HB2 CYS 28 2HB CYS 28 20.618 -5.502 -4.479
222 HB3 CYS 28 3HB CYS 28 19.181 -4.485 -4.461
223 HA PRO 29 HA PRO 29 19.598 -8.390 -8.416
224 HB2 PRO 29 2HB PRO 29 17.241 -8.645 -9.739
225 HB3 PRO 29 3HB PRO 29 17.811 -9.828 -8.556
226 HG2 PRO 29 2HG PRO 29 15.831 -7.610 -8.212
227 HG3 PRO 29 3HG PRO 29 15.754 -9.279 -7.621
228 HD2 PRO 29 2HD PRO 29 16.477 -7.205 -6.038
229 HD3 PRO 29 3HD PRO 29 17.134 -8.840 -5.828
230 H LYS 30 H LYS 30 17.662 -5.583 -7.865
231 HA LYS 30 HA LYS 30 17.493 -4.518 -10.444
232 HB2 LYS 30 2HB LYS 30 17.549 -3.284 -7.706
233 HB3 LYS 30 3HB LYS 30 17.503 -2.271 -9.143
234 HG2 LYS 30 2HG LYS 30 15.491 -4.444 -8.660
235 HG3 LYS 30 3HG LYS 30 15.288 -2.809 -8.028
236 HD2 LYS 30 2HD LYS 30 15.904 -3.199 -10.924
237 HD3 LYS 30 3HD LYS 30 14.260 -3.473 -10.342
238 HE2 LYS 30 2HE LYS 30 14.012 -1.270 -10.707
239 HE3 LYS 30 3HE LYS 30 14.842 -1.103 -9.160
240 HZ1 LYS 30 3HZ LYS 30 16.566 -0.152 -10.153
241 HZ2 LYS 30 1HZ LYS 30 15.651 -0.078 -11.574
242 HZ3 LYS 30 2HZ LYS 30 16.691 -1.385 -11.304
243 H PHE 31 H PHE 31 19.790 -3.488 -7.913
244 HA PHE 31 HA PHE 31 21.643 -2.675 -10.039
245 HB2 PHE 31 2HB PHE 31 22.168 -1.978 -7.195
246 HB3 PHE 31 3HB PHE 31 22.437 -1.029 -8.653
247 HD1 PHE 31 HD1 PHE 31 19.960 -2.057 -6.149
248 HD2 PHE 31 HD2 PHE 31 20.739 0.406 -9.532
249 HE1 PHE 31 HE1 PHE 31 17.899 -0.792 -5.698
250 HE2 PHE 31 HE2 PHE 31 18.679 1.675 -9.086
251 HZ PHE 31 HZ PHE 31 17.256 1.078 -7.167
252 H ASP 32 H ASP 32 22.541 -4.687 -10.513
253 HA ASP 32 HA ASP 32 23.572 -6.456 -8.556
254 HB2 ASP 32 2HB ASP 32 24.849 -7.409 -10.558
255 HB3 ASP 32 3HB ASP 32 23.091 -7.410 -10.661
256 H ASN 33 H ASN 33 24.684 -3.485 -9.705
257 HA ASN 33 HA ASN 33 27.433 -4.077 -8.830
258 HB2 ASN 33 2HB ASN 33 26.334 -2.421 -11.012
259 HB3 ASN 33 3HB ASN 33 27.649 -1.681 -10.104
260 HD21 ASN 33 2HD2 ASN 33 29.911 -4.414 -10.967
261 HD22 ASN 33 1HD2 ASN 33 29.321 -3.646 -9.536
262 H LYS 34 H LYS 34 24.612 -2.173 -8.279
263 HA LYS 34 HA LYS 34 26.042 -0.660 -6.192
264 HB2 LYS 34 2HB LYS 34 23.459 0.211 -7.476
265 HB3 LYS 34 3HB LYS 34 24.565 1.170 -6.501
266 HG2 LYS 34 2HG LYS 34 25.186 0.073 -9.236
267 HG3 LYS 34 3HG LYS 34 24.663 1.724 -8.895
268 HD2 LYS 34 2HD LYS 34 26.958 0.804 -7.309
269 HD3 LYS 34 3HD LYS 34 27.257 0.921 -9.044
270 HE2 LYS 34 2HE LYS 34 27.690 3.079 -8.600
271 HE3 LYS 34 3HE LYS 34 25.935 3.247 -8.574
272 HZ1 LYS 34 3HZ LYS 34 27.830 3.398 -6.404
273 HZ2 LYS 34 1HZ LYS 34 26.466 2.458 -6.060
274 HZ3 LYS 34 2HZ LYS 34 26.283 4.069 -6.540
275 H LYS 35 H LYS 35 24.878 -3.315 -5.951
276 HA LYS 35 HA LYS 35 22.368 -3.208 -4.652
277 HB2 LYS 35 2HB LYS 35 22.972 -5.472 -3.808
278 HB3 LYS 35 3HB LYS 35 23.164 -5.297 -5.548
279 HG2 LYS 35 2HG LYS 35 25.648 -4.642 -4.685
280 HG3 LYS 35 3HG LYS 35 25.162 -5.827 -3.470
281 HD2 LYS 35 2HD LYS 35 25.046 -7.537 -4.988
282 HD3 LYS 35 3HD LYS 35 24.661 -6.462 -6.333
283 HE2 LYS 35 2HE LYS 35 26.935 -5.719 -6.469
284 HE3 LYS 35 3HE LYS 35 27.356 -6.579 -4.989
285 HZ1 LYS 35 3HZ LYS 35 27.934 -8.263 -6.292
286 HZ2 LYS 35 1HZ LYS 35 27.261 -7.542 -7.666
287 HZ3 LYS 35 2HZ LYS 35 26.296 -8.488 -6.649
288 H CYS 36 H CYS 36 22.474 -4.392 -2.274
289 HA CYS 36 HA CYS 36 22.987 -2.375 -0.461
290 HB2 CYS 36 2HB CYS 36 23.092 -5.330 0.170
291 HB3 CYS 36 3HB CYS 36 22.700 -4.022 1.281
292 H THR 37 H THR 37 24.684 -1.748 0.781
293 HA THR 37 HA THR 37 27.141 -3.324 0.764
294 HB THR 37 HB THR 37 28.375 -1.049 0.356
295 HG1 THR 37 HG1 THR 37 25.796 -0.626 -0.753
296 HG21 THR 37 3HG2 THR 37 27.688 -3.239 -1.262
297 HG22 THR 37 1HG2 THR 37 29.009 -2.098 -1.505
298 HG23 THR 37 2HG2 THR 37 27.441 -1.804 -2.256
299 H LYS 38 H LYS 38 24.942 -2.124 2.610
300 HA LYS 38 HA LYS 38 26.820 -1.377 4.725
301 HB2 LYS 38 2HB LYS 38 25.383 0.562 3.428
302 HB3 LYS 38 3HB LYS 38 24.323 0.174 4.778
303 HG2 LYS 38 2HG LYS 38 25.776 2.010 5.358
304 HG3 LYS 38 3HG LYS 38 26.173 0.594 6.335
305 HD2 LYS 38 2HD LYS 38 27.789 0.336 4.102
306 HD3 LYS 38 3HD LYS 38 27.811 2.068 4.441
307 HE2 LYS 38 2HE LYS 38 28.209 0.085 6.647
308 HE3 LYS 38 3HE LYS 38 29.549 0.516 5.586
309 HZ1 LYS 38 3HZ LYS 38 27.942 2.572 6.977
310 HZ2 LYS 38 1HZ LYS 38 29.475 2.731 6.280
311 HZ3 LYS 38 2HZ LYS 38 29.283 1.846 7.709
312 H ASP 39 H ASP 39 25.431 -1.104 6.862
313 HA ASP 39 HA ASP 39 23.634 -3.436 6.981
314 HB2 ASP 39 2HB ASP 39 25.972 -3.186 8.306
315 HB3 ASP 39 3HB ASP 39 24.884 -2.449 9.479
316 H ASN 40 H ASN 40 21.605 -3.138 7.654
317 HA ASN 40 HA ASN 40 19.716 -2.146 8.444
318 HB2 ASN 40 2HB ASN 40 21.411 -0.259 10.062
319 HB3 ASN 40 3HB ASN 40 19.826 -0.924 10.448
320 HD21 ASN 40 2HD2 ASN 40 21.037 -3.790 11.979
321 HD22 ASN 40 1HD2 ASN 40 19.671 -2.897 11.412
322 H ASN 41 H ASN 41 21.285 -1.047 6.139
323 HA ASN 41 HA ASN 41 20.998 1.770 6.098
324 HB2 ASN 41 2HB ASN 41 21.202 1.448 3.581
325 HB3 ASN 41 3HB ASN 41 22.533 0.827 4.553
326 HD21 ASN 41 2HD2 ASN 41 21.939 -2.547 3.806
327 HD22 ASN 41 1HD2 ASN 41 22.661 -1.438 4.917
328 H LYS 42 H LYS 42 19.675 2.525 3.905
329 HA LYS 42 HA LYS 42 16.890 1.906 4.584
330 HB2 LYS 42 2HB LYS 42 17.918 4.181 2.884
331 HB3 LYS 42 3HB LYS 42 16.305 4.004 3.564
332 HG2 LYS 42 2HG LYS 42 17.940 3.892 5.778
333 HG3 LYS 42 3HG LYS 42 18.718 5.097 4.749
334 HD2 LYS 42 2HD LYS 42 16.301 6.035 4.490
335 HD3 LYS 42 3HD LYS 42 15.984 5.117 5.964
336 HE2 LYS 42 2HE LYS 42 16.606 7.126 6.865
337 HE3 LYS 42 3HE LYS 42 18.174 6.324 6.787
338 HZ1 LYS 42 3HZ LYS 42 17.091 8.368 4.936
339 HZ2 LYS 42 1HZ LYS 42 18.457 7.439 4.573
340 HZ3 LYS 42 2HZ LYS 42 18.470 8.475 5.910
341 H CYS 43 H CYS 43 15.847 0.517 3.333
342 HA CYS 43 HA CYS 43 16.182 0.644 0.441
343 HB2 CYS 43 2HB CYS 43 16.637 -1.683 0.160
344 HB3 CYS 43 3HB CYS 43 17.796 -1.077 1.338
345 H THR 44 H THR 44 14.354 0.146 -0.680
346 HA THR 44 HA THR 44 12.031 -0.737 0.907
347 HB THR 44 HB THR 44 10.614 0.596 -0.645
348 HG1 THR 44 HG1 THR 44 11.865 0.898 -2.430
349 HG21 THR 44 3HG2 THR 44 10.767 2.442 0.663
350 HG22 THR 44 1HG2 THR 44 12.505 2.606 0.416
351 HG23 THR 44 2HG2 THR 44 11.886 1.431 1.577
352 H VAL 45 H VAL 45 10.611 -2.193 -0.017
353 HA VAL 45 HA VAL 45 11.567 -3.482 -2.488
354 HB VAL 45 HB VAL 45 9.970 -4.679 -0.220
355 HG11 VAL 45 1HG1 VAL 45 10.931 -5.853 -2.821
356 HG12 VAL 45 2HG1 VAL 45 10.393 -6.825 -1.450
357 HG13 VAL 45 3HG1 VAL 45 9.270 -5.720 -2.244
358 HG21 VAL 45 3HG2 VAL 45 12.520 -4.169 -0.007
359 HG22 VAL 45 1HG2 VAL 45 11.888 -5.734 0.505
360 HG23 VAL 45 2HG2 VAL 45 12.694 -5.577 -1.056
361 H ASP 46 H ASP 46 10.174 -3.864 -4.150
362 HA ASP 46 HA ASP 46 7.417 -2.871 -3.822
363 HB2 ASP 46 2HB ASP 46 9.475 -2.080 -5.688
364 HB3 ASP 46 3HB ASP 46 8.077 -2.716 -6.550
365 H THR 47 H THR 47 5.961 -4.425 -4.011
366 HA THR 47 HA THR 47 6.657 -6.927 -5.325
367 HB THR 47 HB THR 47 5.558 -7.063 -3.150
368 HG1 THR 47 HG1 THR 47 3.687 -8.366 -3.925
369 HG21 THR 47 3HG2 THR 47 3.019 -6.472 -3.209
370 HG22 THR 47 1HG2 THR 47 3.489 -5.384 -4.514
371 HG23 THR 47 2HG2 THR 47 4.202 -5.199 -2.911
372 H TYR 48 H TYR 48 6.506 -4.919 -7.171
373 HA TYR 48 HA TYR 48 3.969 -5.492 -8.557
374 HB2 TYR 48 2HB TYR 48 4.275 -3.102 -7.799
375 HB3 TYR 48 3HB TYR 48 5.635 -2.996 -8.912
376 HD1 TYR 48 HD1 TYR 48 2.043 -4.043 -8.935
377 HD2 TYR 48 HD2 TYR 48 5.225 -2.122 -11.005
378 HE1 TYR 48 HE1 TYR 48 0.497 -3.459 -10.756
379 HE2 TYR 48 HE2 TYR 48 3.688 -1.532 -12.832
380 HH TYR 48 HH TYR 48 0.449 -1.554 -12.589
381 H ASN 49 H ASN 49 7.443 -5.130 -8.800
382 HA ASN 49 HA ASN 49 7.468 -6.784 -11.170
383 HB2 ASN 49 2HB ASN 49 9.008 -5.076 -12.337
384 HB3 ASN 49 3HB ASN 49 7.273 -4.772 -12.363
385 HD21 ASN 49 2HD2 ASN 49 9.684 -2.456 -9.999
386 HD22 ASN 49 1HD2 ASN 49 10.128 -4.084 -10.374
387 H ASN 50 H ASN 50 8.451 -6.728 -8.341
388 HA ASN 50 HA ASN 50 10.302 -7.279 -7.131
389 HB2 ASN 50 2HB ASN 50 11.036 -8.506 -9.797
390 HB3 ASN 50 3HB ASN 50 11.893 -8.827 -8.293
391 HD21 ASN 50 2HD2 ASN 50 9.611 -11.601 -8.604
392 HD22 ASN 50 1HD2 ASN 50 11.076 -11.006 -9.301
393 H ALA 51 H ALA 51 10.963 -5.089 -6.853
394 HA ALA 51 HA ALA 51 13.601 -4.586 -7.932
395 HB1 ALA 51 1HB ALA 51 12.999 -2.263 -8.643
396 HB2 ALA 51 2HB ALA 51 12.334 -3.542 -9.659
397 HB3 ALA 51 3HB ALA 51 11.303 -2.721 -8.487
398 H VAL 52 H VAL 52 14.665 -4.331 -6.073
399 HA VAL 52 HA VAL 52 13.417 -2.910 -3.851
400 HB VAL 52 HB VAL 52 14.716 -5.119 -3.617
401 HG11 VAL 52 1HG1 VAL 52 17.095 -4.979 -3.376
402 HG12 VAL 52 2HG1 VAL 52 16.663 -4.324 -4.957
403 HG13 VAL 52 3HG1 VAL 52 17.067 -3.234 -3.630
404 HG21 VAL 52 3HG2 VAL 52 13.956 -3.608 -1.766
405 HG22 VAL 52 1HG2 VAL 52 15.388 -4.568 -1.396
406 HG23 VAL 52 2HG2 VAL 52 15.553 -2.861 -1.806
407 H ASP 53 H ASP 53 14.709 -1.315 -2.638
408 HA ASP 53 HA ASP 53 16.344 0.327 -4.459
409 HB2 ASP 53 2HB ASP 53 14.002 1.117 -3.466
410 HB3 ASP 53 3HB ASP 53 15.013 1.553 -2.091
411 H CYS 54 H CYS 54 17.822 -1.488 -3.321
412 HA CYS 54 HA CYS 54 18.718 -1.059 -0.698
413 HB2 CYS 54 2HB CYS 54 19.986 -2.325 -3.117
414 HB3 CYS 54 3HB CYS 54 20.849 -2.206 -1.587
415 H ASP 55 H ASP 55 20.323 0.180 0.178
416 HA ASP 55 HA ASP 55 20.930 2.641 -1.041
417 HB2 ASP 55 2HB ASP 55 21.332 1.408 1.501
418 HB3 ASP 55 3HB ASP 55 22.869 2.085 0.970
Start of MODEL 16
1 H1 ALA 1 H ALA 1 1.565 -0.860 0.231
2 HA ALA 1 HA ALA 1 1.793 0.414 -1.914
3 HB1 ALA 1 1HB ALA 1 2.397 2.909 -1.312
4 HB2 ALA 1 2HB ALA 1 0.725 2.403 -1.561
5 HB3 ALA 1 3HB ALA 1 1.359 2.581 0.076
6 H LYS 2 H LYS 2 3.646 -0.837 -1.975
7 HA LYS 2 HA LYS 2 5.881 -1.258 -1.939
8 HB2 LYS 2 2HB LYS 2 6.144 1.006 -2.766
9 HB3 LYS 2 3HB LYS 2 6.004 1.654 -1.137
10 HG2 LYS 2 2HG LYS 2 8.145 1.196 -0.627
11 HG3 LYS 2 3HG LYS 2 8.147 -0.322 -1.528
12 HD2 LYS 2 2HD LYS 2 9.607 1.020 -2.745
13 HD3 LYS 2 3HD LYS 2 8.085 1.184 -3.625
14 HE2 LYS 2 2HE LYS 2 7.903 3.194 -1.782
15 HE3 LYS 2 3HE LYS 2 9.630 3.177 -2.136
16 HZ1 LYS 2 3HZ LYS 2 8.996 4.489 -3.829
17 HZ2 LYS 2 1HZ LYS 2 7.399 3.929 -3.831
18 HZ3 LYS 2 2HZ LYS 2 8.611 3.028 -4.591
19 H TYR 3 H TYR 3 7.559 -1.864 -0.517
20 HA TYR 3 HA TYR 3 6.847 -1.632 2.333
21 HB2 TYR 3 2HB TYR 3 8.325 -3.879 0.948
22 HB3 TYR 3 3HB TYR 3 7.938 -3.807 2.663
23 HD1 TYR 3 HD1 TYR 3 6.979 -5.236 -0.329
24 HD2 TYR 3 HD2 TYR 3 5.295 -3.308 3.070
25 HE1 TYR 3 HE1 TYR 3 4.827 -6.340 -0.777
26 HE2 TYR 3 HE2 TYR 3 3.139 -4.407 2.632
27 HH TYR 3 HH TYR 3 2.066 -5.447 0.192
28 H THR 4 H THR 4 8.216 -0.523 3.545
29 HA THR 4 HA THR 4 10.902 0.034 2.515
30 HB THR 4 HB THR 4 9.497 1.336 4.853
31 HG1 THR 4 HG1 THR 4 8.350 1.877 3.023
32 HG21 THR 4 3HG2 THR 4 11.615 2.024 5.225
33 HG22 THR 4 1HG2 THR 4 11.282 3.141 3.902
34 HG23 THR 4 2HG2 THR 4 12.140 1.632 3.588
35 H GLY 5 H GLY 5 12.696 -0.762 3.433
36 HA2 GLY 5 2HA GLY 5 12.716 -1.620 6.198
37 HA3 GLY 5 3HA GLY 5 12.849 -2.927 5.031
38 H LYS 6 H LYS 6 14.929 -3.328 6.047
39 HA LYS 6 HA LYS 6 17.025 -1.725 4.775
40 HB2 LYS 6 2HB LYS 6 17.331 -2.659 7.620
41 HB3 LYS 6 3HB LYS 6 18.307 -1.489 6.742
42 HG2 LYS 6 2HG LYS 6 17.095 -0.060 8.014
43 HG3 LYS 6 3HG LYS 6 15.995 -0.197 6.641
44 HD2 LYS 6 2HD LYS 6 14.424 -1.218 7.869
45 HD3 LYS 6 3HD LYS 6 15.600 -2.280 8.646
46 HE2 LYS 6 2HE LYS 6 16.238 0.016 9.854
47 HE3 LYS 6 3HE LYS 6 14.543 0.351 9.506
48 HZ1 LYS 6 3HZ LYS 6 14.771 -0.656 11.669
49 HZ2 LYS 6 1HZ LYS 6 15.591 -1.983 11.014
50 HZ3 LYS 6 2HZ LYS 6 13.963 -1.724 10.636
51 H CYS 7 H CYS 7 19.015 -2.845 4.460
52 HA CYS 7 HA CYS 7 18.702 -5.772 4.521
53 HB2 CYS 7 2HB CYS 7 20.814 -4.713 2.791
54 HB3 CYS 7 3HB CYS 7 19.550 -5.887 2.436
55 H THR 8 H THR 8 21.271 -6.561 4.062
56 HA THR 8 HA THR 8 22.902 -5.375 6.186
57 HB THR 8 HB THR 8 22.956 -8.326 6.113
58 HG1 THR 8 HG1 THR 8 20.993 -8.627 6.949
59 HG21 THR 8 3HG2 THR 8 23.419 -8.113 8.399
60 HG22 THR 8 1HG2 THR 8 22.656 -6.527 8.500
61 HG23 THR 8 2HG2 THR 8 24.205 -6.710 7.677
62 H LYS 9 H LYS 9 24.936 -5.097 5.550
63 HA LYS 9 HA LYS 9 25.837 -5.822 2.988
64 HB2 LYS 9 2HB LYS 9 27.939 -4.878 3.614
65 HB3 LYS 9 3HB LYS 9 26.687 -3.909 4.378
66 HG2 LYS 9 2HG LYS 9 27.989 -4.130 6.190
67 HG3 LYS 9 3HG LYS 9 27.175 -5.689 6.340
68 HD2 LYS 9 2HD LYS 9 28.993 -6.812 5.251
69 HD3 LYS 9 3HD LYS 9 29.767 -5.275 4.856
70 HE2 LYS 9 2HE LYS 9 29.239 -6.176 7.679
71 HE3 LYS 9 3HE LYS 9 30.737 -6.533 6.820
72 HZ1 LYS 9 3HZ LYS 9 30.438 -4.388 8.317
73 HZ2 LYS 9 1HZ LYS 9 29.863 -3.751 6.859
74 HZ3 LYS 9 2HZ LYS 9 31.424 -4.396 6.943
75 H SER 10 H SER 10 25.663 -7.612 5.867
76 HA SER 10 HA SER 10 27.851 -9.267 5.854
77 HB2 SER 10 2HB SER 10 26.244 -9.479 7.612
78 HB3 SER 10 3HB SER 10 24.962 -9.900 6.476
79 HG SER 10 HG SER 10 26.749 -11.505 7.692
80 H LYS 11 H LYS 11 24.755 -10.077 4.274
81 HA LYS 11 HA LYS 11 26.264 -11.377 2.120
82 HB2 LYS 11 2HB LYS 11 24.705 -12.720 4.120
83 HB3 LYS 11 3HB LYS 11 23.933 -12.925 2.553
84 HG2 LYS 11 2HG LYS 11 26.007 -13.810 1.632
85 HG3 LYS 11 3HG LYS 11 26.804 -13.579 3.190
86 HD2 LYS 11 2HD LYS 11 25.629 -15.300 4.193
87 HD3 LYS 11 3HD LYS 11 24.303 -15.209 3.031
88 HE2 LYS 11 2HE LYS 11 26.708 -15.841 1.637
89 HE3 LYS 11 3HE LYS 11 26.548 -16.934 3.011
90 HZ1 LYS 11 3HZ LYS 11 24.044 -16.824 1.916
91 HZ2 LYS 11 1HZ LYS 11 25.157 -18.086 1.743
92 HZ3 LYS 11 2HZ LYS 11 25.070 -16.868 0.572
93 H ASN 12 H ASN 12 24.364 -8.958 2.741
94 HA ASN 12 HA ASN 12 22.893 -7.694 1.553
95 HB2 ASN 12 2HB ASN 12 23.968 -7.692 -0.449
96 HB3 ASN 12 3HB ASN 12 24.129 -9.445 -0.482
97 HD21 ASN 12 2HD2 ASN 12 20.858 -7.626 -2.104
98 HD22 ASN 12 1HD2 ASN 12 21.868 -6.796 -0.974
99 H GLU 13 H GLU 13 20.883 -7.848 2.307
100 HA GLU 13 HA GLU 13 18.967 -9.524 1.056
101 HB2 GLU 13 2HB GLU 13 20.310 -10.599 3.365
102 HB3 GLU 13 3HB GLU 13 18.607 -10.353 3.725
103 HG2 GLU 13 2HG GLU 13 17.953 -11.729 1.879
104 HG3 GLU 13 3HG GLU 13 19.621 -11.853 1.323
105 H CYS 14 H CYS 14 17.848 -7.613 0.780
106 HA CYS 14 HA CYS 14 17.298 -5.760 2.837
107 HB2 CYS 14 2HB CYS 14 17.152 -5.260 0.401
108 HB3 CYS 14 3HB CYS 14 15.703 -6.256 0.315
109 H LYS 15 H LYS 15 15.928 -5.865 4.482
110 HA LYS 15 HA LYS 15 14.096 -8.100 4.690
111 HB2 LYS 15 2HB LYS 15 15.177 -7.724 6.713
112 HB3 LYS 15 3HB LYS 15 15.079 -5.975 6.558
113 HG2 LYS 15 2HG LYS 15 13.084 -5.873 7.565
114 HG3 LYS 15 3HG LYS 15 12.482 -7.314 6.741
115 HD2 LYS 15 2HD LYS 15 12.570 -8.048 8.922
116 HD3 LYS 15 3HD LYS 15 14.152 -8.555 8.328
117 HE2 LYS 15 2HE LYS 15 13.517 -6.099 9.957
118 HE3 LYS 15 3HE LYS 15 14.419 -7.520 10.482
119 HZ1 LYS 15 3HZ LYS 15 15.247 -5.445 8.543
120 HZ2 LYS 15 1HZ LYS 15 16.022 -6.946 8.631
121 HZ3 LYS 15 2HZ LYS 15 16.022 -5.915 9.972
122 H TYR 16 H TYR 16 11.879 -7.987 4.790
123 HA TYR 16 HA TYR 16 10.395 -5.587 4.927
124 HB2 TYR 16 2HB TYR 16 9.729 -5.208 2.717
125 HB3 TYR 16 3HB TYR 16 11.454 -5.529 2.569
126 HD1 TYR 16 HD1 TYR 16 8.316 -6.265 1.235
127 HD2 TYR 16 HD2 TYR 16 12.026 -8.113 2.197
128 HE1 TYR 16 HE1 TYR 16 7.837 -8.056 -0.382
129 HE2 TYR 16 HE2 TYR 16 11.558 -9.908 0.582
130 HH TYR 16 HH TYR 16 9.544 -9.767 -1.793
131 H LYS 17 H LYS 17 8.083 -6.188 3.689
132 HA LYS 17 HA LYS 17 7.369 -8.856 4.719
133 HB2 LYS 17 2HB LYS 17 5.131 -7.874 5.270
134 HB3 LYS 17 3HB LYS 17 6.458 -7.240 6.235
135 HG2 LYS 17 2HG LYS 17 6.237 -5.557 3.998
136 HG3 LYS 17 3HG LYS 17 4.595 -5.843 4.577
137 HD2 LYS 17 2HD LYS 17 5.923 -5.421 6.913
138 HD3 LYS 17 3HD LYS 17 6.807 -4.359 5.815
139 HE2 LYS 17 2HE LYS 17 4.200 -3.859 5.144
140 HE3 LYS 17 3HE LYS 17 4.092 -4.132 6.883
141 HZ1 LYS 17 3HZ LYS 17 5.138 -1.890 5.475
142 HZ2 LYS 17 1HZ LYS 17 6.284 -2.518 6.550
143 HZ3 LYS 17 2HZ LYS 17 4.763 -2.045 7.117
144 H ASN 18 H ASN 18 5.915 -10.071 3.539
145 HA ASN 18 HA ASN 18 5.391 -9.082 0.819
146 HB2 ASN 18 2HB ASN 18 5.068 -11.563 0.314
147 HB3 ASN 18 3HB ASN 18 6.709 -11.045 0.690
148 HD21 ASN 18 2HD2 ASN 18 6.908 -12.791 3.735
149 HD22 ASN 18 1HD2 ASN 18 7.510 -11.446 2.832
150 H ASP 19 H ASP 19 3.914 -11.116 3.345
151 HA ASP 19 HA ASP 19 1.299 -10.863 2.147
152 HB2 ASP 19 2HB ASP 19 2.494 -12.381 4.394
153 HB3 ASP 19 3HB ASP 19 0.787 -11.977 4.551
154 H ALA 20 H ALA 20 2.951 -9.661 5.040
155 HA ALA 20 HA ALA 20 1.577 -7.222 5.092
156 HB1 ALA 20 1HB ALA 20 -0.045 -9.272 6.005
157 HB2 ALA 20 2HB ALA 20 0.565 -8.518 7.479
158 HB3 ALA 20 3HB ALA 20 -0.281 -7.545 6.276
159 H GLY 21 H GLY 21 2.911 -9.713 7.262
160 HA2 GLY 21 2HA GLY 21 4.804 -7.698 8.261
161 HA3 GLY 21 3HA GLY 21 3.840 -8.605 9.417
162 H LYS 22 H LYS 22 4.564 -10.476 6.723
163 HA LYS 22 HA LYS 22 6.203 -12.250 8.212
164 HB2 LYS 22 2HB LYS 22 5.147 -12.109 5.446
165 HB3 LYS 22 3HB LYS 22 6.590 -13.087 5.680
166 HG2 LYS 22 2HG LYS 22 5.105 -14.005 7.710
167 HG3 LYS 22 3HG LYS 22 3.822 -13.536 6.593
168 HD2 LYS 22 2HD LYS 22 6.050 -15.011 5.370
169 HD3 LYS 22 3HD LYS 22 5.112 -15.929 6.550
170 HE2 LYS 22 2HE LYS 22 3.084 -14.886 5.213
171 HE3 LYS 22 3HE LYS 22 4.287 -14.788 3.928
172 HZ1 LYS 22 3HZ LYS 22 4.647 -17.134 4.067
173 HZ2 LYS 22 1HZ LYS 22 2.983 -16.867 3.910
174 HZ3 LYS 22 2HZ LYS 22 3.636 -17.272 5.417
175 H ASP 23 H ASP 23 8.182 -11.638 8.832
176 HA ASP 23 HA ASP 23 9.833 -9.819 7.456
177 HB2 ASP 23 2HB ASP 23 10.909 -11.915 9.324
178 HB3 ASP 23 3HB ASP 23 11.456 -10.256 9.095
179 H THR 24 H THR 24 10.146 -10.377 5.331
180 HA THR 24 HA THR 24 11.663 -12.860 4.853
181 HB THR 24 HB THR 24 9.794 -11.427 2.956
182 HG1 THR 24 HG1 THR 24 8.696 -13.527 3.143
183 HG21 THR 24 3HG2 THR 24 11.245 -12.305 1.439
184 HG22 THR 24 1HG2 THR 24 10.298 -13.761 1.743
185 HG23 THR 24 2HG2 THR 24 11.845 -13.529 2.557
186 H PHE 25 H PHE 25 13.569 -12.727 3.790
187 HA PHE 25 HA PHE 25 14.603 -10.051 3.268
188 HB2 PHE 25 2HB PHE 25 16.131 -12.648 3.121
189 HB3 PHE 25 3HB PHE 25 16.780 -11.023 3.314
190 HD1 PHE 25 HD1 PHE 25 15.076 -9.937 5.433
191 HD2 PHE 25 HD2 PHE 25 16.804 -13.804 5.008
192 HE1 PHE 25 HE1 PHE 25 15.045 -10.216 7.878
193 HE2 PHE 25 HE2 PHE 25 16.775 -14.089 7.452
194 HZ PHE 25 HZ PHE 25 15.894 -12.294 8.890
195 H ILE 26 H ILE 26 15.323 -9.339 1.299
196 HA ILE 26 HA ILE 26 15.062 -11.149 -0.996
197 HB ILE 26 HB ILE 26 12.982 -9.903 -0.937
198 HG12 ILE 26 2HG1 ILE 26 13.104 -8.828 -3.159
199 HG13 ILE 26 3HG1 ILE 26 14.862 -8.866 -3.071
200 HG21 ILE 26 1HG2 ILE 26 12.817 -7.774 -0.309
201 HG22 ILE 26 2HG2 ILE 26 14.530 -7.850 0.102
202 HG23 ILE 26 3HG2 ILE 26 14.029 -7.262 -1.483
203 HD11 ILE 26 3HD1 ILE 26 13.366 -10.733 -4.295
204 HD12 ILE 26 1HD1 ILE 26 14.966 -11.038 -3.619
205 HD13 ILE 26 2HD1 ILE 26 13.523 -11.453 -2.693
206 H LYS 27 H LYS 27 16.829 -11.111 -2.205
207 HA LYS 27 HA LYS 27 19.051 -9.521 -1.715
208 HB2 LYS 27 2HB LYS 27 20.010 -10.452 -3.674
209 HB3 LYS 27 3HB LYS 27 18.954 -11.694 -3.014
210 HG2 LYS 27 2HG LYS 27 17.261 -10.428 -4.709
211 HG3 LYS 27 3HG LYS 27 18.799 -10.234 -5.552
212 HD2 LYS 27 2HD LYS 27 18.392 -12.286 -6.362
213 HD3 LYS 27 3HD LYS 27 18.904 -12.851 -4.770
214 HE2 LYS 27 2HE LYS 27 16.072 -12.039 -5.065
215 HE3 LYS 27 3HE LYS 27 16.563 -13.525 -5.875
216 HZ1 LYS 27 3HZ LYS 27 16.072 -13.077 -3.123
217 HZ2 LYS 27 1HZ LYS 27 17.654 -13.638 -3.342
218 HZ3 LYS 27 2HZ LYS 27 16.349 -14.537 -3.932
219 H CYS 28 H CYS 28 20.083 -8.245 -3.706
220 HA CYS 28 HA CYS 28 18.126 -6.160 -4.408
221 HB2 CYS 28 2HB CYS 28 20.223 -5.696 -2.904
222 HB3 CYS 28 3HB CYS 28 21.087 -5.695 -4.439
223 HA PRO 29 HA PRO 29 19.339 -8.162 -8.402
224 HB2 PRO 29 2HB PRO 29 16.835 -8.102 -9.450
225 HB3 PRO 29 3HB PRO 29 17.413 -9.415 -8.417
226 HG2 PRO 29 2HG PRO 29 15.716 -7.053 -7.707
227 HG3 PRO 29 3HG PRO 29 15.538 -8.747 -7.214
228 HD2 PRO 29 2HD PRO 29 16.638 -6.868 -5.604
229 HD3 PRO 29 3HD PRO 29 17.147 -8.568 -5.573
230 H LYS 30 H LYS 30 17.741 -5.241 -7.465
231 HA LYS 30 HA LYS 30 17.312 -3.945 -9.861
232 HB2 LYS 30 2HB LYS 30 17.425 -3.229 -7.130
233 HB3 LYS 30 3HB LYS 30 18.461 -2.095 -7.985
234 HG2 LYS 30 2HG LYS 30 16.300 -2.102 -9.603
235 HG3 LYS 30 3HG LYS 30 15.541 -2.402 -8.038
236 HD2 LYS 30 2HD LYS 30 16.815 -0.430 -7.151
237 HD3 LYS 30 3HD LYS 30 17.311 -0.087 -8.810
238 HE2 LYS 30 2HE LYS 30 14.612 -0.376 -9.078
239 HE3 LYS 30 3HE LYS 30 14.737 0.351 -7.476
240 HZ1 LYS 30 3HZ LYS 30 16.219 2.055 -8.549
241 HZ2 LYS 30 1HZ LYS 30 14.589 2.118 -8.998
242 HZ3 LYS 30 2HZ LYS 30 15.729 1.438 -10.046
243 H PHE 31 H PHE 31 20.240 -3.544 -7.858
244 HA PHE 31 HA PHE 31 21.709 -2.844 -10.307
245 HB2 PHE 31 2HB PHE 31 22.955 -2.378 -7.658
246 HB3 PHE 31 3HB PHE 31 22.967 -1.371 -9.102
247 HD1 PHE 31 HD1 PHE 31 21.077 -2.287 -6.092
248 HD2 PHE 31 HD2 PHE 31 21.303 0.305 -9.460
249 HE1 PHE 31 HE1 PHE 31 19.367 -0.834 -5.084
250 HE2 PHE 31 HE2 PHE 31 19.594 1.763 -8.457
251 HZ PHE 31 HZ PHE 31 18.624 1.195 -6.266
252 H ASP 32 H ASP 32 24.038 -3.502 -10.322
253 HA ASP 32 HA ASP 32 24.303 -6.236 -9.258
254 HB2 ASP 32 2HB ASP 32 24.763 -5.108 -11.892
255 HB3 ASP 32 3HB ASP 32 26.201 -5.922 -11.282
256 H ASN 33 H ASN 33 25.767 -3.096 -9.506
257 HA ASN 33 HA ASN 33 27.978 -4.037 -7.802
258 HB2 ASN 33 2HB ASN 33 28.128 -2.773 -10.354
259 HB3 ASN 33 3HB ASN 33 28.743 -1.644 -9.150
260 HD21 ASN 33 2HD2 ASN 33 31.301 -4.021 -8.085
261 HD22 ASN 33 1HD2 ASN 33 30.016 -3.117 -7.367
262 H LYS 34 H LYS 34 25.253 -2.716 -7.361
263 HA LYS 34 HA LYS 34 26.248 -0.679 -5.502
264 HB2 LYS 34 2HB LYS 34 23.761 -0.236 -7.149
265 HB3 LYS 34 3HB LYS 34 24.596 0.920 -6.118
266 HG2 LYS 34 2HG LYS 34 25.752 -0.257 -8.636
267 HG3 LYS 34 3HG LYS 34 24.935 1.304 -8.540
268 HD2 LYS 34 2HD LYS 34 27.048 0.950 -6.548
269 HD3 LYS 34 3HD LYS 34 27.624 0.896 -8.216
270 HE2 LYS 34 2HE LYS 34 26.190 3.025 -8.528
271 HE3 LYS 34 3HE LYS 34 26.225 3.115 -6.768
272 HZ1 LYS 34 3HZ LYS 34 28.514 3.237 -8.642
273 HZ2 LYS 34 1HZ LYS 34 28.716 2.959 -6.985
274 HZ3 LYS 34 2HZ LYS 34 28.018 4.404 -7.522
275 H LYS 35 H LYS 35 24.895 -3.515 -5.677
276 HA LYS 35 HA LYS 35 22.421 -3.463 -4.434
277 HB2 LYS 35 2HB LYS 35 23.000 -5.726 -3.577
278 HB3 LYS 35 3HB LYS 35 23.329 -5.523 -5.293
279 HG2 LYS 35 2HG LYS 35 25.723 -4.837 -4.232
280 HG3 LYS 35 3HG LYS 35 25.164 -6.036 -3.063
281 HD2 LYS 35 2HD LYS 35 24.772 -6.783 -5.876
282 HD3 LYS 35 3HD LYS 35 26.459 -6.619 -5.383
283 HE2 LYS 35 2HE LYS 35 26.129 -8.193 -3.585
284 HE3 LYS 35 3HE LYS 35 24.402 -8.278 -3.929
285 HZ1 LYS 35 3HZ LYS 35 26.223 -8.924 -6.114
286 HZ2 LYS 35 1HZ LYS 35 24.728 -9.607 -5.713
287 HZ3 LYS 35 2HZ LYS 35 26.116 -10.047 -4.853
288 H CYS 36 H CYS 36 21.958 -4.168 -2.149
289 HA CYS 36 HA CYS 36 22.731 -2.251 -0.326
290 HB2 CYS 36 2HB CYS 36 21.529 -4.976 -0.062
291 HB3 CYS 36 3HB CYS 36 22.047 -4.133 1.395
292 H THR 37 H THR 37 24.774 -1.814 0.213
293 HA THR 37 HA THR 37 26.495 -4.059 1.046
294 HB THR 37 HB THR 37 28.408 -2.422 0.507
295 HG1 THR 37 HG1 THR 37 27.400 -0.529 0.076
296 HG21 THR 37 3HG2 THR 37 26.957 -3.245 -1.973
297 HG22 THR 37 1HG2 THR 37 27.505 -4.479 -0.839
298 HG23 THR 37 2HG2 THR 37 28.670 -3.381 -1.578
299 H LYS 38 H LYS 38 24.633 -2.572 2.707
300 HA LYS 38 HA LYS 38 26.539 -1.678 4.730
301 HB2 LYS 38 2HB LYS 38 24.925 0.118 3.230
302 HB3 LYS 38 3HB LYS 38 24.275 0.062 4.863
303 HG2 LYS 38 2HG LYS 38 27.207 0.335 4.607
304 HG3 LYS 38 3HG LYS 38 26.224 1.722 4.130
305 HD2 LYS 38 2HD LYS 38 25.419 2.054 6.257
306 HD3 LYS 38 3HD LYS 38 25.637 0.364 6.718
307 HE2 LYS 38 2HE LYS 38 27.258 1.643 7.905
308 HE3 LYS 38 3HE LYS 38 28.109 0.756 6.641
309 HZ1 LYS 38 3HZ LYS 38 27.956 2.820 5.274
310 HZ2 LYS 38 1HZ LYS 38 28.935 2.961 6.647
311 HZ3 LYS 38 2HZ LYS 38 27.382 3.631 6.644
312 H ASP 39 H ASP 39 25.657 -1.658 6.887
313 HA ASP 39 HA ASP 39 23.625 -3.711 7.226
314 HB2 ASP 39 2HB ASP 39 24.263 -3.486 9.668
315 HB3 ASP 39 3HB ASP 39 25.551 -4.016 8.590
316 H ASN 40 H ASN 40 21.559 -3.248 7.536
317 HA ASN 40 HA ASN 40 19.641 -2.179 8.129
318 HB2 ASN 40 2HB ASN 40 21.264 -0.335 9.872
319 HB3 ASN 40 3HB ASN 40 19.605 -0.881 10.101
320 HD21 ASN 40 2HD2 ASN 40 20.447 -3.761 11.834
321 HD22 ASN 40 1HD2 ASN 40 19.214 -2.785 11.117
322 H ASN 41 H ASN 41 20.927 -1.359 5.795
323 HA ASN 41 HA ASN 41 21.028 1.509 5.675
324 HB2 ASN 41 2HB ASN 41 21.367 1.178 3.261
325 HB3 ASN 41 3HB ASN 41 22.440 0.149 4.205
326 HD21 ASN 41 2HD2 ASN 41 21.247 -2.822 2.904
327 HD22 ASN 41 1HD2 ASN 41 22.349 -2.004 3.954
328 H LYS 42 H LYS 42 19.762 2.185 3.367
329 HA LYS 42 HA LYS 42 16.934 1.853 4.100
330 HB2 LYS 42 2HB LYS 42 18.110 4.164 3.985
331 HB3 LYS 42 3HB LYS 42 17.977 3.971 2.242
332 HG2 LYS 42 2HG LYS 42 15.816 4.499 2.247
333 HG3 LYS 42 3HG LYS 42 15.473 3.439 3.616
334 HD2 LYS 42 2HD LYS 42 14.963 5.634 4.338
335 HD3 LYS 42 3HD LYS 42 16.507 5.220 5.086
336 HE2 LYS 42 2HE LYS 42 17.707 6.627 3.684
337 HE3 LYS 42 3HE LYS 42 16.439 6.651 2.460
338 HZ1 LYS 42 3HZ LYS 42 15.293 8.258 3.544
339 HZ2 LYS 42 1HZ LYS 42 16.839 8.659 4.102
340 HZ3 LYS 42 2HZ LYS 42 15.793 7.761 5.082
341 H CYS 43 H CYS 43 15.926 0.362 2.928
342 HA CYS 43 HA CYS 43 16.190 0.445 0.019
343 HB2 CYS 43 2HB CYS 43 16.442 -1.974 -0.154
344 HB3 CYS 43 3HB CYS 43 17.764 -1.294 0.789
345 H THR 44 H THR 44 14.302 0.154 -1.020
346 HA THR 44 HA THR 44 11.988 -0.704 0.593
347 HB THR 44 HB THR 44 10.633 0.690 -1.061
348 HG1 THR 44 HG1 THR 44 13.197 1.849 -1.527
349 HG21 THR 44 3HG2 THR 44 10.536 2.184 0.593
350 HG22 THR 44 1HG2 THR 44 12.179 2.736 0.268
351 HG23 THR 44 2HG2 THR 44 11.907 1.358 1.334
352 H VAL 45 H VAL 45 11.060 -2.527 -0.048
353 HA VAL 45 HA VAL 45 11.738 -3.665 -2.635
354 HB VAL 45 HB VAL 45 10.086 -4.812 -0.380
355 HG11 VAL 45 1HG1 VAL 45 9.365 -6.066 -2.148
356 HG12 VAL 45 2HG1 VAL 45 10.854 -5.830 -3.066
357 HG13 VAL 45 3HG1 VAL 45 10.819 -6.967 -1.717
358 HG21 VAL 45 3HG2 VAL 45 12.531 -4.370 0.075
359 HG22 VAL 45 1HG2 VAL 45 12.005 -6.042 0.265
360 HG23 VAL 45 2HG2 VAL 45 12.892 -5.555 -1.180
361 H ASP 46 H ASP 46 10.284 -4.169 -4.251
362 HA ASP 46 HA ASP 46 7.635 -2.900 -4.010
363 HB2 ASP 46 2HB ASP 46 9.700 -2.590 -5.977
364 HB3 ASP 46 3HB ASP 46 8.272 -3.280 -6.744
365 H THR 47 H THR 47 6.034 -4.312 -3.880
366 HA THR 47 HA THR 47 6.401 -7.030 -4.870
367 HB THR 47 HB THR 47 5.481 -6.753 -2.615
368 HG1 THR 47 HG1 THR 47 4.777 -8.504 -4.084
369 HG21 THR 47 3HG2 THR 47 3.272 -5.811 -2.257
370 HG22 THR 47 1HG2 THR 47 3.120 -5.451 -3.976
371 HG23 THR 47 2HG2 THR 47 4.323 -4.606 -3.002
372 H TYR 48 H TYR 48 6.209 -5.089 -6.884
373 HA TYR 48 HA TYR 48 3.573 -5.715 -8.047
374 HB2 TYR 48 2HB TYR 48 3.931 -3.289 -7.516
375 HB3 TYR 48 3HB TYR 48 5.263 -3.285 -8.666
376 HD1 TYR 48 HD1 TYR 48 4.707 -2.212 -10.623
377 HD2 TYR 48 HD2 TYR 48 1.764 -4.614 -8.708
378 HE1 TYR 48 HE1 TYR 48 3.133 -1.729 -12.450
379 HE2 TYR 48 HE2 TYR 48 0.182 -4.139 -10.530
380 HH TYR 48 HH TYR 48 0.689 -1.696 -12.814
381 H ASN 49 H ASN 49 7.027 -5.465 -8.549
382 HA ASN 49 HA ASN 49 6.817 -7.243 -10.835
383 HB2 ASN 49 2HB ASN 49 8.009 -5.860 -12.370
384 HB3 ASN 49 3HB ASN 49 6.703 -4.874 -11.719
385 HD21 ASN 49 2HD2 ASN 49 8.981 -2.969 -9.635
386 HD22 ASN 49 1HD2 ASN 49 7.509 -3.859 -9.477
387 H ASN 50 H ASN 50 7.970 -7.018 -8.013
388 HA ASN 50 HA ASN 50 9.790 -7.763 -6.871
389 HB2 ASN 50 2HB ASN 50 10.037 -9.159 -9.509
390 HB3 ASN 50 3HB ASN 50 11.346 -9.298 -8.339
391 HD21 ASN 50 2HD2 ASN 50 9.755 -11.695 -6.451
392 HD22 ASN 50 1HD2 ASN 50 11.193 -10.832 -6.866
393 H ALA 51 H ALA 51 10.874 -5.898 -6.410
394 HA ALA 51 HA ALA 51 13.436 -5.524 -7.505
395 HB1 ALA 51 1HB ALA 51 12.814 -4.449 -9.391
396 HB2 ALA 51 2HB ALA 51 11.258 -3.951 -8.727
397 HB3 ALA 51 3HB ALA 51 12.722 -3.063 -8.304
398 H VAL 52 H VAL 52 14.668 -4.443 -6.076
399 HA VAL 52 HA VAL 52 13.279 -2.936 -3.956
400 HB VAL 52 HB VAL 52 14.447 -5.099 -3.296
401 HG11 VAL 52 1HG1 VAL 52 16.432 -4.763 -4.726
402 HG12 VAL 52 2HG1 VAL 52 16.918 -3.416 -3.695
403 HG13 VAL 52 3HG1 VAL 52 16.848 -5.051 -3.036
404 HG21 VAL 52 3HG2 VAL 52 15.829 -3.236 -1.608
405 HG22 VAL 52 1HG2 VAL 52 14.227 -2.616 -2.006
406 HG23 VAL 52 2HG2 VAL 52 14.398 -4.206 -1.261
407 H ASP 53 H ASP 53 14.258 -1.049 -3.152
408 HA ASP 53 HA ASP 53 16.185 0.171 -5.011
409 HB2 ASP 53 2HB ASP 53 13.856 1.222 -3.497
410 HB3 ASP 53 3HB ASP 53 15.243 2.295 -3.662
411 H CYS 54 H CYS 54 17.788 -1.107 -3.698
412 HA CYS 54 HA CYS 54 18.364 -0.653 -1.030
413 HB2 CYS 54 2HB CYS 54 20.254 -1.184 -3.331
414 HB3 CYS 54 3HB CYS 54 20.722 -1.251 -1.635
415 H ASP 55 H ASP 55 20.320 0.539 -0.184
416 HA ASP 55 HA ASP 55 19.986 3.279 -0.439
417 HB2 ASP 55 2HB ASP 55 21.325 1.765 1.298
418 HB3 ASP 55 3HB ASP 55 22.688 2.267 0.302
Start of MODEL 17
1 H1 ALA 1 H ALA 1 1.935 1.874 -3.756
2 HA ALA 1 HA ALA 1 2.459 1.210 -1.610
3 HB1 ALA 1 1HB ALA 1 0.615 -0.073 -1.520
4 HB2 ALA 1 2HB ALA 1 1.000 -0.916 -3.021
5 HB3 ALA 1 3HB ALA 1 1.772 -1.405 -1.513
6 H LYS 2 H LYS 2 4.755 1.464 -1.741
7 HA LYS 2 HA LYS 2 6.281 -1.007 -2.160
8 HB2 LYS 2 2HB LYS 2 6.754 1.642 -2.919
9 HB3 LYS 2 3HB LYS 2 7.878 1.347 -1.600
10 HG2 LYS 2 2HG LYS 2 8.395 -0.845 -2.935
11 HG3 LYS 2 3HG LYS 2 7.729 0.074 -4.286
12 HD2 LYS 2 2HD LYS 2 9.942 1.068 -2.495
13 HD3 LYS 2 3HD LYS 2 10.210 0.250 -4.036
14 HE2 LYS 2 2HE LYS 2 8.375 2.220 -4.653
15 HE3 LYS 2 3HE LYS 2 9.444 3.002 -3.490
16 HZ1 LYS 2 3HZ LYS 2 10.800 3.331 -5.203
17 HZ2 LYS 2 1HZ LYS 2 9.944 2.272 -6.208
18 HZ3 LYS 2 2HZ LYS 2 11.135 1.673 -5.167
19 H TYR 3 H TYR 3 7.415 -1.977 -0.557
20 HA TYR 3 HA TYR 3 6.836 -1.134 2.157
21 HB2 TYR 3 2HB TYR 3 8.248 -3.565 1.046
22 HB3 TYR 3 3HB TYR 3 7.995 -3.276 2.764
23 HD1 TYR 3 HD1 TYR 3 6.699 -4.849 -0.088
24 HD2 TYR 3 HD2 TYR 3 5.476 -2.792 3.430
25 HE1 TYR 3 HE1 TYR 3 4.487 -5.914 -0.242
26 HE2 TYR 3 HE2 TYR 3 3.261 -3.852 3.286
27 HH TYR 3 HH TYR 3 2.576 -6.369 0.951
28 H THR 4 H THR 4 8.251 -0.292 3.585
29 HA THR 4 HA THR 4 10.939 0.340 2.577
30 HB THR 4 HB THR 4 9.623 1.642 4.954
31 HG1 THR 4 HG1 THR 4 8.614 3.024 3.627
32 HG21 THR 4 3HG2 THR 4 12.098 1.880 4.531
33 HG22 THR 4 1HG2 THR 4 11.197 3.394 4.595
34 HG23 THR 4 2HG2 THR 4 11.685 2.723 3.038
35 H GLY 5 H GLY 5 12.703 -0.473 3.532
36 HA2 GLY 5 2HA GLY 5 12.692 -1.286 6.302
37 HA3 GLY 5 3HA GLY 5 12.769 -2.630 5.172
38 H LYS 6 H LYS 6 14.836 -3.095 6.172
39 HA LYS 6 HA LYS 6 16.986 -1.523 4.931
40 HB2 LYS 6 2HB LYS 6 17.264 -2.694 7.690
41 HB3 LYS 6 3HB LYS 6 18.302 -1.518 6.894
42 HG2 LYS 6 2HG LYS 6 17.188 -0.100 8.251
43 HG3 LYS 6 3HG LYS 6 16.037 -0.114 6.913
44 HD2 LYS 6 2HD LYS 6 14.513 -0.696 8.444
45 HD3 LYS 6 3HD LYS 6 15.268 -2.291 8.407
46 HE2 LYS 6 2HE LYS 6 16.252 -2.015 10.421
47 HE3 LYS 6 3HE LYS 6 16.570 -0.303 10.148
48 HZ1 LYS 6 3HZ LYS 6 14.549 -1.438 11.688
49 HZ2 LYS 6 1HZ LYS 6 13.795 -0.704 10.363
50 HZ3 LYS 6 2HZ LYS 6 14.811 0.202 11.367
51 H CYS 7 H CYS 7 19.082 -2.751 4.903
52 HA CYS 7 HA CYS 7 18.580 -5.636 4.570
53 HB2 CYS 7 2HB CYS 7 20.775 -4.478 2.986
54 HB3 CYS 7 3HB CYS 7 19.542 -5.645 2.521
55 H THR 8 H THR 8 21.105 -6.529 4.128
56 HA THR 8 HA THR 8 22.684 -5.626 6.437
57 HB THR 8 HB THR 8 22.830 -8.515 5.979
58 HG1 THR 8 HG1 THR 8 20.802 -9.018 6.602
59 HG21 THR 8 3HG2 THR 8 22.594 -8.518 8.455
60 HG22 THR 8 1HG2 THR 8 22.374 -6.770 8.400
61 HG23 THR 8 2HG2 THR 8 23.900 -7.483 7.878
62 H LYS 9 H LYS 9 24.697 -5.170 5.864
63 HA LYS 9 HA LYS 9 25.752 -5.411 3.331
64 HB2 LYS 9 2HB LYS 9 27.915 -4.918 4.305
65 HB3 LYS 9 3HB LYS 9 26.677 -3.968 5.116
66 HG2 LYS 9 2HG LYS 9 27.658 -4.680 6.990
67 HG3 LYS 9 3HG LYS 9 26.775 -6.180 6.693
68 HD2 LYS 9 2HD LYS 9 29.040 -6.777 7.105
69 HD3 LYS 9 3HD LYS 9 28.766 -6.967 5.372
70 HE2 LYS 9 2HE LYS 9 30.571 -5.696 5.070
71 HE3 LYS 9 3HE LYS 9 29.596 -4.339 5.633
72 HZ1 LYS 9 3HZ LYS 9 31.136 -4.152 7.214
73 HZ2 LYS 9 1HZ LYS 9 31.769 -5.696 6.933
74 HZ3 LYS 9 2HZ LYS 9 30.418 -5.504 7.933
75 H SER 10 H SER 10 25.471 -7.820 5.774
76 HA SER 10 HA SER 10 27.540 -9.559 4.961
77 HB2 SER 10 2HB SER 10 26.680 -10.054 7.072
78 HB3 SER 10 3HB SER 10 25.007 -9.905 6.534
79 HG SER 10 HG SER 10 26.764 -12.055 6.331
80 H LYS 11 H LYS 11 27.474 -9.622 2.686
81 HA LYS 11 HA LYS 11 27.005 -10.613 0.692
82 HB2 LYS 11 2HB LYS 11 26.500 -12.566 2.460
83 HB3 LYS 11 3HB LYS 11 24.878 -12.358 1.813
84 HG2 LYS 11 2HG LYS 11 25.762 -14.012 0.468
85 HG3 LYS 11 3HG LYS 11 26.020 -12.554 -0.493
86 HD2 LYS 11 2HD LYS 11 28.259 -12.704 -0.339
87 HD3 LYS 11 3HD LYS 11 28.207 -13.201 1.353
88 HE2 LYS 11 2HE LYS 11 27.126 -15.291 -0.262
89 HE3 LYS 11 3HE LYS 11 28.679 -14.797 -0.935
90 HZ1 LYS 11 3HZ LYS 11 28.173 -15.628 1.871
91 HZ2 LYS 11 1HZ LYS 11 29.661 -15.091 1.272
92 HZ3 LYS 11 2HZ LYS 11 28.986 -16.529 0.693
93 H ASN 12 H ASN 12 25.115 -8.595 2.229
94 HA ASN 12 HA ASN 12 23.359 -7.273 1.642
95 HB2 ASN 12 2HB ASN 12 23.687 -6.719 -0.503
96 HB3 ASN 12 3HB ASN 12 24.379 -8.299 -0.860
97 HD21 ASN 12 2HD2 ASN 12 20.584 -7.390 -1.900
98 HD22 ASN 12 1HD2 ASN 12 21.578 -6.306 -0.992
99 H GLU 13 H GLU 13 21.212 -7.380 2.027
100 HA GLU 13 HA GLU 13 19.462 -9.369 1.126
101 HB2 GLU 13 2HB GLU 13 21.074 -10.447 3.022
102 HB3 GLU 13 3HB GLU 13 19.768 -9.834 4.027
103 HG2 GLU 13 2HG GLU 13 18.183 -11.060 2.489
104 HG3 GLU 13 3HG GLU 13 19.606 -11.845 1.805
105 H CYS 14 H CYS 14 18.119 -7.619 0.806
106 HA CYS 14 HA CYS 14 17.444 -5.817 2.939
107 HB2 CYS 14 2HB CYS 14 17.474 -5.238 0.469
108 HB3 CYS 14 3HB CYS 14 15.981 -6.158 0.321
109 H LYS 15 H LYS 15 15.921 -6.069 4.430
110 HA LYS 15 HA LYS 15 14.015 -8.282 4.119
111 HB2 LYS 15 2HB LYS 15 15.323 -8.515 6.103
112 HB3 LYS 15 3HB LYS 15 15.057 -6.835 6.552
113 HG2 LYS 15 2HG LYS 15 12.637 -8.492 6.266
114 HG3 LYS 15 3HG LYS 15 13.707 -8.895 7.612
115 HD2 LYS 15 2HD LYS 15 12.680 -6.117 7.045
116 HD3 LYS 15 3HD LYS 15 11.912 -7.243 8.167
117 HE2 LYS 15 2HE LYS 15 14.233 -7.383 9.273
118 HE3 LYS 15 3HE LYS 15 14.596 -5.916 8.364
119 HZ1 LYS 15 3HZ LYS 15 12.514 -6.297 10.437
120 HZ2 LYS 15 1HZ LYS 15 12.539 -4.956 9.404
121 HZ3 LYS 15 2HZ LYS 15 13.827 -5.231 10.465
122 H TYR 16 H TYR 16 11.819 -7.988 4.402
123 HA TYR 16 HA TYR 16 10.733 -5.418 5.116
124 HB2 TYR 16 2HB TYR 16 9.699 -4.870 3.047
125 HB3 TYR 16 3HB TYR 16 11.386 -5.210 2.674
126 HD1 TYR 16 HD1 TYR 16 11.780 -7.853 2.161
127 HD2 TYR 16 HD2 TYR 16 8.160 -5.701 1.555
128 HE1 TYR 16 HE1 TYR 16 11.081 -9.513 0.487
129 HE2 TYR 16 HE2 TYR 16 7.450 -7.357 -0.119
130 HH TYR 16 HH TYR 16 8.447 -10.224 -0.411
131 H LYS 17 H LYS 17 8.194 -5.643 4.159
132 HA LYS 17 HA LYS 17 7.273 -8.217 5.261
133 HB2 LYS 17 2HB LYS 17 5.237 -6.948 6.020
134 HB3 LYS 17 3HB LYS 17 6.727 -6.528 6.854
135 HG2 LYS 17 2HG LYS 17 6.926 -4.595 5.228
136 HG3 LYS 17 3HG LYS 17 5.261 -4.952 4.762
137 HD2 LYS 17 2HD LYS 17 4.946 -4.888 7.413
138 HD3 LYS 17 3HD LYS 17 6.333 -3.804 7.277
139 HE2 LYS 17 2HE LYS 17 5.158 -2.247 6.037
140 HE3 LYS 17 3HE LYS 17 3.978 -3.430 5.477
141 HZ1 LYS 17 3HZ LYS 17 3.039 -1.899 7.109
142 HZ2 LYS 17 1HZ LYS 17 4.179 -2.398 8.255
143 HZ3 LYS 17 2HZ LYS 17 3.022 -3.491 7.682
144 H ASN 18 H ASN 18 6.325 -9.437 3.779
145 HA ASN 18 HA ASN 18 4.863 -8.111 1.590
146 HB2 ASN 18 2HB ASN 18 5.616 -9.691 0.072
147 HB3 ASN 18 3HB ASN 18 7.019 -9.532 1.125
148 HD21 ASN 18 2HD2 ASN 18 6.507 -12.703 2.697
149 HD22 ASN 18 1HD2 ASN 18 6.952 -11.072 3.053
150 H ASP 19 H ASP 19 3.249 -9.753 0.555
151 HA ASP 19 HA ASP 19 1.359 -11.014 0.736
152 HB2 ASP 19 2HB ASP 19 3.150 -12.170 2.645
153 HB3 ASP 19 3HB ASP 19 1.527 -12.157 3.329
154 H ALA 20 H ALA 20 1.914 -10.260 4.167
155 HA ALA 20 HA ALA 20 0.011 -8.128 4.208
156 HB1 ALA 20 1HB ALA 20 -0.824 -10.734 5.476
157 HB2 ALA 20 2HB ALA 20 -1.687 -9.200 5.586
158 HB3 ALA 20 3HB ALA 20 -1.535 -10.017 4.030
159 H GLY 21 H GLY 21 2.750 -8.832 5.102
160 HA2 GLY 21 2HA GLY 21 3.586 -7.456 7.013
161 HA3 GLY 21 3HA GLY 21 2.404 -8.313 7.991
162 H LYS 22 H LYS 22 3.641 -10.426 5.748
163 HA LYS 22 HA LYS 22 5.088 -11.887 7.734
164 HB2 LYS 22 2HB LYS 22 4.310 -12.294 4.902
165 HB3 LYS 22 3HB LYS 22 5.728 -13.174 5.457
166 HG2 LYS 22 2HG LYS 22 3.227 -13.260 7.077
167 HG3 LYS 22 3HG LYS 22 3.359 -14.245 5.618
168 HD2 LYS 22 2HD LYS 22 5.019 -15.565 6.496
169 HD3 LYS 22 3HD LYS 22 5.596 -14.301 7.585
170 HE2 LYS 22 2HE LYS 22 4.421 -15.208 9.235
171 HE3 LYS 22 3HE LYS 22 2.937 -14.906 8.331
172 HZ1 LYS 22 3HZ LYS 22 3.277 -17.046 7.203
173 HZ2 LYS 22 1HZ LYS 22 3.101 -17.226 8.876
174 HZ3 LYS 22 2HZ LYS 22 4.634 -17.338 8.170
175 H ASP 23 H ASP 23 7.184 -11.812 8.211
176 HA ASP 23 HA ASP 23 8.899 -9.918 6.934
177 HB2 ASP 23 2HB ASP 23 9.887 -12.047 8.806
178 HB3 ASP 23 3HB ASP 23 10.445 -10.387 8.622
179 H THR 24 H THR 24 9.953 -10.231 5.100
180 HA THR 24 HA THR 24 11.134 -12.857 4.557
181 HB THR 24 HB THR 24 9.469 -11.310 2.561
182 HG1 THR 24 HG1 THR 24 8.203 -12.554 3.973
183 HG21 THR 24 3HG2 THR 24 11.104 -13.828 2.243
184 HG22 THR 24 1HG2 THR 24 11.373 -12.283 1.439
185 HG23 THR 24 2HG2 THR 24 9.939 -13.236 1.060
186 H PHE 25 H PHE 25 13.066 -12.804 3.475
187 HA PHE 25 HA PHE 25 14.274 -10.159 3.180
188 HB2 PHE 25 2HB PHE 25 15.701 -12.803 2.942
189 HB3 PHE 25 3HB PHE 25 16.384 -11.226 3.325
190 HD1 PHE 25 HD1 PHE 25 16.313 -14.096 4.778
191 HD2 PHE 25 HD2 PHE 25 14.455 -10.317 5.394
192 HE1 PHE 25 HE1 PHE 25 16.102 -14.595 7.178
193 HE2 PHE 25 HE2 PHE 25 14.242 -10.809 7.795
194 HZ PHE 25 HZ PHE 25 15.067 -12.950 8.690
195 H ILE 26 H ILE 26 15.737 -9.791 1.325
196 HA ILE 26 HA ILE 26 15.525 -11.343 -1.041
197 HB ILE 26 HB ILE 26 13.274 -10.443 -1.144
198 HG12 ILE 26 2HG1 ILE 26 13.394 -9.339 -3.342
199 HG13 ILE 26 3HG1 ILE 26 15.116 -9.056 -3.105
200 HG21 ILE 26 1HG2 ILE 26 14.460 -8.146 -0.036
201 HG22 ILE 26 2HG2 ILE 26 13.819 -7.674 -1.609
202 HG23 ILE 26 3HG2 ILE 26 12.758 -8.413 -0.411
203 HD11 ILE 26 3HD1 ILE 26 15.624 -11.078 -3.847
204 HD12 ILE 26 1HD1 ILE 26 14.453 -11.844 -2.773
205 HD13 ILE 26 2HD1 ILE 26 13.939 -11.231 -4.346
206 H LYS 27 H LYS 27 17.361 -10.999 -2.088
207 HA LYS 27 HA LYS 27 19.196 -8.996 -1.395
208 HB2 LYS 27 2HB LYS 27 19.122 -10.519 -4.003
209 HB3 LYS 27 3HB LYS 27 20.527 -9.779 -3.247
210 HG2 LYS 27 2HG LYS 27 20.959 -11.734 -2.306
211 HG3 LYS 27 3HG LYS 27 19.502 -11.530 -1.331
212 HD2 LYS 27 2HD LYS 27 19.172 -13.596 -2.348
213 HD3 LYS 27 3HD LYS 27 18.269 -12.492 -3.388
214 HE2 LYS 27 2HE LYS 27 20.111 -12.425 -4.962
215 HE3 LYS 27 3HE LYS 27 21.088 -13.438 -3.900
216 HZ1 LYS 27 3HZ LYS 27 20.268 -15.146 -5.035
217 HZ2 LYS 27 1HZ LYS 27 19.091 -14.197 -5.795
218 HZ3 LYS 27 2HZ LYS 27 18.786 -14.860 -4.270
219 H CYS 28 H CYS 28 20.201 -7.918 -3.700
220 HA CYS 28 HA CYS 28 18.063 -6.048 -4.469
221 HB2 CYS 28 2HB CYS 28 20.061 -5.130 -3.249
222 HB3 CYS 28 3HB CYS 28 21.048 -5.598 -4.629
223 HA PRO 29 HA PRO 29 18.781 -8.373 -8.349
224 HB2 PRO 29 2HB PRO 29 16.245 -8.038 -9.257
225 HB3 PRO 29 3HB PRO 29 16.701 -9.324 -8.134
226 HG2 PRO 29 2HG PRO 29 15.408 -6.685 -7.567
227 HG3 PRO 29 3HG PRO 29 15.027 -8.283 -6.900
228 HD2 PRO 29 2HD PRO 29 16.490 -6.450 -5.547
229 HD3 PRO 29 3HD PRO 29 16.755 -8.197 -5.377
230 H LYS 30 H LYS 30 17.714 -5.173 -7.608
231 HA LYS 30 HA LYS 30 17.352 -4.087 -10.149
232 HB2 LYS 30 2HB LYS 30 17.716 -3.106 -7.460
233 HB3 LYS 30 3HB LYS 30 18.606 -2.102 -8.597
234 HG2 LYS 30 2HG LYS 30 15.700 -2.809 -8.919
235 HG3 LYS 30 3HG LYS 30 16.277 -1.347 -8.116
236 HD2 LYS 30 2HD LYS 30 17.147 -0.461 -10.089
237 HD3 LYS 30 3HD LYS 30 17.178 -2.033 -10.892
238 HE2 LYS 30 2HE LYS 30 14.682 -2.025 -10.829
239 HE3 LYS 30 3HE LYS 30 14.753 -0.374 -10.214
240 HZ1 LYS 30 3HZ LYS 30 16.261 -0.901 -12.643
241 HZ2 LYS 30 1HZ LYS 30 15.323 0.442 -12.218
242 HZ3 LYS 30 2HZ LYS 30 14.577 -0.963 -12.793
243 H PHE 31 H PHE 31 20.278 -3.623 -8.162
244 HA PHE 31 HA PHE 31 21.841 -3.591 -10.659
245 HB2 PHE 31 2HB PHE 31 23.040 -2.418 -8.225
246 HB3 PHE 31 3HB PHE 31 23.076 -1.844 -9.889
247 HD1 PHE 31 HD1 PHE 31 21.058 -1.960 -6.806
248 HD2 PHE 31 HD2 PHE 31 21.534 -0.229 -10.665
249 HE1 PHE 31 HE1 PHE 31 19.362 -0.265 -6.252
250 HE2 PHE 31 HE2 PHE 31 19.840 1.468 -10.117
251 HZ PHE 31 HZ PHE 31 18.752 1.453 -7.908
252 H ASP 32 H ASP 32 24.088 -4.357 -10.464
253 HA ASP 32 HA ASP 32 24.230 -6.659 -8.637
254 HB2 ASP 32 2HB ASP 32 26.064 -7.378 -10.339
255 HB3 ASP 32 3HB ASP 32 24.369 -7.540 -10.788
256 H ASN 33 H ASN 33 25.624 -3.639 -9.379
257 HA ASN 33 HA ASN 33 27.898 -4.238 -7.603
258 HB2 ASN 33 2HB ASN 33 28.029 -3.416 -10.271
259 HB3 ASN 33 3HB ASN 33 28.363 -1.959 -9.338
260 HD21 ASN 33 2HD2 ASN 33 31.174 -3.665 -7.668
261 HD22 ASN 33 1HD2 ASN 33 29.678 -2.956 -7.173
262 H LYS 34 H LYS 34 25.100 -3.047 -7.264
263 HA LYS 34 HA LYS 34 25.976 -0.794 -5.619
264 HB2 LYS 34 2HB LYS 34 23.579 -0.609 -7.448
265 HB3 LYS 34 3HB LYS 34 24.212 0.656 -6.403
266 HG2 LYS 34 2HG LYS 34 25.806 -0.535 -8.653
267 HG3 LYS 34 3HG LYS 34 24.739 0.856 -8.862
268 HD2 LYS 34 2HD LYS 34 26.005 2.119 -7.235
269 HD3 LYS 34 3HD LYS 34 27.016 0.715 -6.887
270 HE2 LYS 34 2HE LYS 34 28.398 1.714 -8.372
271 HE3 LYS 34 3HE LYS 34 27.376 0.877 -9.539
272 HZ1 LYS 34 3HZ LYS 34 26.399 3.471 -8.722
273 HZ2 LYS 34 1HZ LYS 34 26.508 2.791 -10.268
274 HZ3 LYS 34 2HZ LYS 34 27.866 3.513 -9.565
275 H LYS 35 H LYS 35 24.918 -3.634 -5.334
276 HA LYS 35 HA LYS 35 22.330 -3.511 -4.205
277 HB2 LYS 35 2HB LYS 35 22.883 -5.715 -3.230
278 HB3 LYS 35 3HB LYS 35 23.270 -5.621 -4.943
279 HG2 LYS 35 2HG LYS 35 25.632 -4.881 -3.865
280 HG3 LYS 35 3HG LYS 35 25.032 -5.979 -2.620
281 HD2 LYS 35 2HD LYS 35 24.757 -6.909 -5.408
282 HD3 LYS 35 3HD LYS 35 26.407 -6.787 -4.792
283 HE2 LYS 35 2HE LYS 35 24.374 -8.090 -3.064
284 HE3 LYS 35 3HE LYS 35 24.932 -8.976 -4.482
285 HZ1 LYS 35 3HZ LYS 35 26.299 -8.422 -2.018
286 HZ2 LYS 35 1HZ LYS 35 27.229 -8.055 -3.383
287 HZ3 LYS 35 2HZ LYS 35 26.605 -9.614 -3.179
288 H CYS 36 H CYS 36 21.895 -4.074 -1.870
289 HA CYS 36 HA CYS 36 22.665 -2.035 -0.187
290 HB2 CYS 36 2HB CYS 36 21.495 -4.747 0.263
291 HB3 CYS 36 3HB CYS 36 22.036 -3.823 1.661
292 H THR 37 H THR 37 24.647 -1.521 0.450
293 HA THR 37 HA THR 37 26.462 -3.693 1.277
294 HB THR 37 HB THR 37 28.333 -2.098 0.727
295 HG1 THR 37 HG1 THR 37 26.432 -0.715 -0.851
296 HG21 THR 37 3HG2 THR 37 27.026 -3.884 -0.866
297 HG22 THR 37 1HG2 THR 37 28.522 -3.059 -1.301
298 HG23 THR 37 2HG2 THR 37 26.972 -2.424 -1.853
299 H LYS 38 H LYS 38 24.719 -2.764 3.137
300 HA LYS 38 HA LYS 38 26.486 -1.734 5.138
301 HB2 LYS 38 2HB LYS 38 24.926 0.142 3.656
302 HB3 LYS 38 3HB LYS 38 24.283 0.063 5.291
303 HG2 LYS 38 2HG LYS 38 27.222 0.354 4.853
304 HG3 LYS 38 3HG LYS 38 26.157 1.756 4.728
305 HD2 LYS 38 2HD LYS 38 26.296 1.951 6.942
306 HD3 LYS 38 3HD LYS 38 25.372 0.452 7.067
307 HE2 LYS 38 2HE LYS 38 27.700 -0.675 6.734
308 HE3 LYS 38 3HE LYS 38 28.323 0.889 7.257
309 HZ1 LYS 38 3HZ LYS 38 26.230 -0.405 8.856
310 HZ2 LYS 38 1HZ LYS 38 27.473 0.634 9.347
311 HZ3 LYS 38 2HZ LYS 38 27.816 -0.981 8.979
312 H ASP 39 H ASP 39 25.497 -1.700 7.271
313 HA ASP 39 HA ASP 39 23.411 -3.725 7.477
314 HB2 ASP 39 2HB ASP 39 25.284 -2.489 9.496
315 HB3 ASP 39 3HB ASP 39 23.990 -3.595 9.949
316 H ASN 40 H ASN 40 21.354 -3.234 7.825
317 HA ASN 40 HA ASN 40 19.460 -2.119 8.410
318 HB2 ASN 40 2HB ASN 40 21.176 -0.412 10.215
319 HB3 ASN 40 3HB ASN 40 19.462 -0.781 10.386
320 HD21 ASN 40 2HD2 ASN 40 19.945 -3.725 12.136
321 HD22 ASN 40 1HD2 ASN 40 18.849 -2.592 11.428
322 H ASN 41 H ASN 41 20.856 -1.277 6.118
323 HA ASN 41 HA ASN 41 20.974 1.596 6.068
324 HB2 ASN 41 2HB ASN 41 21.454 1.330 3.684
325 HB3 ASN 41 3HB ASN 41 22.444 0.230 4.639
326 HD21 ASN 41 2HD2 ASN 41 21.246 -2.643 3.142
327 HD22 ASN 41 1HD2 ASN 41 22.318 -1.902 4.276
328 H LYS 42 H LYS 42 19.818 2.304 3.702
329 HA LYS 42 HA LYS 42 16.962 2.001 4.319
330 HB2 LYS 42 2HB LYS 42 18.184 4.094 2.528
331 HB3 LYS 42 3HB LYS 42 16.597 4.108 3.286
332 HG2 LYS 42 2HG LYS 42 17.752 4.237 5.501
333 HG3 LYS 42 3HG LYS 42 19.268 4.455 4.624
334 HD2 LYS 42 2HD LYS 42 18.591 6.520 3.744
335 HD3 LYS 42 3HD LYS 42 16.892 6.221 4.119
336 HE2 LYS 42 2HE LYS 42 17.371 7.618 5.842
337 HE3 LYS 42 3HE LYS 42 17.880 6.106 6.591
338 HZ1 LYS 42 3HZ LYS 42 19.530 8.278 5.492
339 HZ2 LYS 42 1HZ LYS 42 20.149 6.704 5.530
340 HZ3 LYS 42 2HZ LYS 42 19.677 7.461 6.966
341 H CYS 43 H CYS 43 16.007 0.480 3.137
342 HA CYS 43 HA CYS 43 16.233 0.591 0.243
343 HB2 CYS 43 2HB CYS 43 16.802 -1.730 -0.045
344 HB3 CYS 43 3HB CYS 43 18.014 -0.995 0.998
345 H THR 44 H THR 44 14.395 -0.039 -0.789
346 HA THR 44 HA THR 44 12.176 -0.923 0.935
347 HB THR 44 HB THR 44 10.669 0.054 -0.776
348 HG1 THR 44 HG1 THR 44 12.082 -0.017 -2.570
349 HG21 THR 44 3HG2 THR 44 10.785 1.684 0.765
350 HG22 THR 44 1HG2 THR 44 11.822 2.511 -0.397
351 HG23 THR 44 2HG2 THR 44 12.538 1.556 0.902
352 H VAL 45 H VAL 45 10.380 -2.005 -0.504
353 HA VAL 45 HA VAL 45 11.480 -3.744 -2.559
354 HB VAL 45 HB VAL 45 10.254 -4.864 -0.035
355 HG11 VAL 45 1HG1 VAL 45 9.471 -6.294 -1.672
356 HG12 VAL 45 2HG1 VAL 45 10.895 -6.075 -2.692
357 HG13 VAL 45 3HG1 VAL 45 10.999 -7.054 -1.228
358 HG21 VAL 45 3HG2 VAL 45 13.049 -4.825 -1.123
359 HG22 VAL 45 1HG2 VAL 45 12.478 -4.379 0.485
360 HG23 VAL 45 2HG2 VAL 45 12.519 -6.075 0.002
361 H ASP 46 H ASP 46 10.046 -3.968 -4.141
362 HA ASP 46 HA ASP 46 7.255 -3.247 -3.615
363 HB2 ASP 46 2HB ASP 46 9.025 -2.590 -5.686
364 HB3 ASP 46 3HB ASP 46 7.873 -3.714 -6.403
365 H THR 47 H THR 47 5.712 -4.738 -3.553
366 HA THR 47 HA THR 47 6.373 -7.473 -4.370
367 HB THR 47 HB THR 47 5.514 -7.075 -2.058
368 HG1 THR 47 HG1 THR 47 3.966 -8.809 -2.207
369 HG21 THR 47 3HG2 THR 47 3.925 -5.273 -2.621
370 HG22 THR 47 1HG2 THR 47 3.155 -6.586 -1.731
371 HG23 THR 47 2HG2 THR 47 2.921 -6.446 -3.474
372 H TYR 48 H TYR 48 5.523 -5.190 -6.168
373 HA TYR 48 HA TYR 48 3.191 -6.527 -7.378
374 HB2 TYR 48 2HB TYR 48 2.893 -4.143 -6.445
375 HB3 TYR 48 3HB TYR 48 3.868 -3.627 -7.816
376 HD1 TYR 48 HD1 TYR 48 3.029 -3.994 -10.132
377 HD2 TYR 48 HD2 TYR 48 0.608 -4.750 -6.715
378 HE1 TYR 48 HE1 TYR 48 1.023 -3.970 -11.555
379 HE2 TYR 48 HE2 TYR 48 -1.404 -4.729 -8.129
380 HH TYR 48 HH TYR 48 -1.184 -4.480 -11.636
381 H ASN 49 H ASN 49 6.223 -4.819 -7.973
382 HA ASN 49 HA ASN 49 6.398 -6.186 -10.568
383 HB2 ASN 49 2HB ASN 49 7.050 -4.264 -11.724
384 HB3 ASN 49 3HB ASN 49 5.765 -3.671 -10.676
385 HD21 ASN 49 2HD2 ASN 49 7.914 -1.781 -8.601
386 HD22 ASN 49 1HD2 ASN 49 6.443 -2.686 -8.629
387 H ASN 50 H ASN 50 7.592 -6.316 -7.710
388 HA ASN 50 HA ASN 50 9.595 -6.777 -6.726
389 HB2 ASN 50 2HB ASN 50 9.348 -8.515 -8.657
390 HB3 ASN 50 3HB ASN 50 10.644 -7.597 -9.417
391 HD21 ASN 50 2HD2 ASN 50 12.534 -10.087 -7.733
392 HD22 ASN 50 1HD2 ASN 50 11.667 -9.764 -9.192
393 H ALA 51 H ALA 51 9.962 -4.476 -6.414
394 HA ALA 51 HA ALA 51 12.312 -3.555 -7.927
395 HB1 ALA 51 1HB ALA 51 9.766 -2.354 -7.952
396 HB2 ALA 51 2HB ALA 51 10.811 -1.309 -6.989
397 HB3 ALA 51 3HB ALA 51 11.266 -1.733 -8.639
398 H VAL 52 H VAL 52 13.998 -3.092 -6.678
399 HA VAL 52 HA VAL 52 13.523 -2.641 -3.804
400 HB VAL 52 HB VAL 52 14.755 -4.707 -4.237
401 HG11 VAL 52 1HG1 VAL 52 17.052 -4.570 -5.189
402 HG12 VAL 52 2HG1 VAL 52 15.773 -4.213 -6.351
403 HG13 VAL 52 3HG1 VAL 52 16.715 -2.900 -5.643
404 HG21 VAL 52 3HG2 VAL 52 16.932 -3.020 -3.194
405 HG22 VAL 52 1HG2 VAL 52 15.369 -2.825 -2.401
406 HG23 VAL 52 2HG2 VAL 52 16.130 -4.414 -2.472
407 H ASP 53 H ASP 53 14.688 -1.038 -2.733
408 HA ASP 53 HA ASP 53 16.000 0.926 -4.496
409 HB2 ASP 53 2HB ASP 53 13.785 1.585 -3.416
410 HB3 ASP 53 3HB ASP 53 14.646 1.573 -1.879
411 H CYS 54 H CYS 54 17.472 -1.168 -3.434
412 HA CYS 54 HA CYS 54 18.685 -0.749 -0.971
413 HB2 CYS 54 2HB CYS 54 20.635 -1.999 -1.964
414 HB3 CYS 54 3HB CYS 54 19.078 -2.803 -2.132
415 H ASP 55 H ASP 55 20.322 0.506 -0.231
416 HA ASP 55 HA ASP 55 20.847 2.975 -1.347
417 HB2 ASP 55 2HB ASP 55 21.938 1.373 0.840
418 HB3 ASP 55 3HB ASP 55 23.134 2.448 0.120
Start of MODEL 18
1 H1 ALA 1 H ALA 1 2.704 1.234 0.220
2 HA ALA 1 HA ALA 1 1.518 0.710 -2.152
3 HB1 ALA 1 1HB ALA 1 3.244 2.514 -3.407
4 HB2 ALA 1 2HB ALA 1 1.482 2.577 -3.355
5 HB3 ALA 1 3HB ALA 1 2.432 3.438 -2.143
6 H LYS 2 H LYS 2 4.594 1.629 -0.706
7 HA LYS 2 HA LYS 2 5.806 -0.744 -1.946
8 HB2 LYS 2 2HB LYS 2 7.939 0.539 -2.157
9 HB3 LYS 2 3HB LYS 2 6.653 1.112 -3.211
10 HG2 LYS 2 2HG LYS 2 6.723 3.142 -2.322
11 HG3 LYS 2 3HG LYS 2 6.622 2.500 -0.681
12 HD2 LYS 2 2HD LYS 2 8.679 3.551 -0.655
13 HD3 LYS 2 3HD LYS 2 9.127 1.891 -1.056
14 HE2 LYS 2 2HE LYS 2 10.338 3.170 -2.580
15 HE3 LYS 2 3HE LYS 2 8.929 2.650 -3.504
16 HZ1 LYS 2 3HZ LYS 2 9.775 5.191 -3.311
17 HZ2 LYS 2 1HZ LYS 2 8.586 5.153 -2.108
18 HZ3 LYS 2 2HZ LYS 2 8.192 4.738 -3.699
19 H TYR 3 H TYR 3 6.733 -2.063 -0.520
20 HA TYR 3 HA TYR 3 6.681 -1.531 2.251
21 HB2 TYR 3 2HB TYR 3 8.355 -3.661 0.925
22 HB3 TYR 3 3HB TYR 3 7.651 -3.685 2.538
23 HD1 TYR 3 HD1 TYR 3 5.018 -3.530 2.597
24 HD2 TYR 3 HD2 TYR 3 7.282 -4.809 -0.771
25 HE1 TYR 3 HE1 TYR 3 3.041 -4.701 1.720
26 HE2 TYR 3 HE2 TYR 3 5.311 -5.983 -1.658
27 HH TYR 3 HH TYR 3 2.270 -6.100 0.159
28 H THR 4 H THR 4 8.412 -1.306 3.730
29 HA THR 4 HA THR 4 10.934 -0.335 2.559
30 HB THR 4 HB THR 4 9.489 0.904 4.909
31 HG1 THR 4 HG1 THR 4 9.321 2.699 3.441
32 HG21 THR 4 3HG2 THR 4 12.169 1.403 3.653
33 HG22 THR 4 1HG2 THR 4 11.767 1.194 5.357
34 HG23 THR 4 2HG2 THR 4 11.315 2.680 4.520
35 H GLY 5 H GLY 5 12.809 -0.817 3.671
36 HA2 GLY 5 2HA GLY 5 12.817 -1.902 6.311
37 HA3 GLY 5 3HA GLY 5 12.970 -3.168 5.102
38 H LYS 6 H LYS 6 15.053 -3.515 6.202
39 HA LYS 6 HA LYS 6 17.127 -1.865 4.945
40 HB2 LYS 6 2HB LYS 6 17.459 -2.860 7.763
41 HB3 LYS 6 3HB LYS 6 18.384 -1.625 6.919
42 HG2 LYS 6 2HG LYS 6 17.130 -0.237 8.164
43 HG3 LYS 6 3HG LYS 6 15.955 -0.484 6.870
44 HD2 LYS 6 2HD LYS 6 14.611 -0.980 8.633
45 HD3 LYS 6 3HD LYS 6 15.327 -2.577 8.404
46 HE2 LYS 6 2HE LYS 6 17.099 -1.132 10.044
47 HE3 LYS 6 3HE LYS 6 15.479 -0.825 10.669
48 HZ1 LYS 6 3HZ LYS 6 15.423 -2.849 11.533
49 HZ2 LYS 6 1HZ LYS 6 17.033 -3.079 11.067
50 HZ3 LYS 6 2HZ LYS 6 15.779 -3.566 10.043
51 H CYS 7 H CYS 7 19.114 -2.941 4.566
52 HA CYS 7 HA CYS 7 18.856 -5.872 4.557
53 HB2 CYS 7 2HB CYS 7 20.972 -4.660 2.907
54 HB3 CYS 7 3HB CYS 7 19.812 -5.922 2.506
55 H THR 8 H THR 8 21.451 -6.602 4.116
56 HA THR 8 HA THR 8 22.987 -5.499 6.361
57 HB THR 8 HB THR 8 23.209 -8.421 6.056
58 HG1 THR 8 HG1 THR 8 20.877 -7.285 7.240
59 HG21 THR 8 3HG2 THR 8 23.068 -6.436 8.305
60 HG22 THR 8 1HG2 THR 8 24.408 -7.482 7.838
61 HG23 THR 8 2HG2 THR 8 22.977 -8.171 8.604
62 H LYS 9 H LYS 9 24.987 -5.014 5.759
63 HA LYS 9 HA LYS 9 26.003 -5.476 3.199
64 HB2 LYS 9 2HB LYS 9 28.042 -4.516 3.973
65 HB3 LYS 9 3HB LYS 9 26.739 -3.694 4.822
66 HG2 LYS 9 2HG LYS 9 28.011 -4.073 6.626
67 HG3 LYS 9 3HG LYS 9 27.284 -5.680 6.567
68 HD2 LYS 9 2HD LYS 9 29.423 -6.384 6.567
69 HD3 LYS 9 3HD LYS 9 29.355 -5.993 4.847
70 HE2 LYS 9 2HE LYS 9 30.112 -3.902 6.850
71 HE3 LYS 9 3HE LYS 9 31.305 -5.074 6.293
72 HZ1 LYS 9 3HZ LYS 9 29.966 -4.056 4.058
73 HZ2 LYS 9 1HZ LYS 9 31.593 -3.865 4.480
74 HZ3 LYS 9 2HZ LYS 9 30.444 -2.743 5.011
75 H SER 10 H SER 10 25.899 -7.522 5.933
76 HA SER 10 HA SER 10 28.132 -9.097 5.761
77 HB2 SER 10 2HB SER 10 26.561 -9.538 7.498
78 HB3 SER 10 3HB SER 10 25.269 -9.864 6.342
79 HG SER 10 HG SER 10 27.608 -11.427 6.334
80 H LYS 11 H LYS 11 25.083 -10.227 4.326
81 HA LYS 11 HA LYS 11 26.616 -11.156 1.988
82 HB2 LYS 11 2HB LYS 11 25.386 -12.775 3.899
83 HB3 LYS 11 3HB LYS 11 24.266 -12.769 2.542
84 HG2 LYS 11 2HG LYS 11 26.267 -13.343 1.086
85 HG3 LYS 11 3HG LYS 11 27.128 -13.670 2.592
86 HD2 LYS 11 2HD LYS 11 26.309 -15.761 2.028
87 HD3 LYS 11 3HD LYS 11 25.074 -15.164 3.139
88 HE2 LYS 11 2HE LYS 11 23.523 -14.894 1.485
89 HE3 LYS 11 3HE LYS 11 24.738 -14.576 0.248
90 HZ1 LYS 11 3HZ LYS 11 23.844 -16.671 -0.251
91 HZ2 LYS 11 1HZ LYS 11 23.908 -17.192 1.357
92 HZ3 LYS 11 2HZ LYS 11 25.337 -17.002 0.472
93 H ASN 12 H ASN 12 24.622 -8.875 2.787
94 HA ASN 12 HA ASN 12 23.102 -7.592 1.684
95 HB2 ASN 12 2HB ASN 12 24.012 -7.427 -0.373
96 HB3 ASN 12 3HB ASN 12 24.408 -9.142 -0.430
97 HD21 ASN 12 2HD2 ASN 12 20.960 -7.732 -2.061
98 HD22 ASN 12 1HD2 ASN 12 21.919 -6.759 -1.002
99 H GLU 13 H GLU 13 21.059 -7.740 2.311
100 HA GLU 13 HA GLU 13 19.217 -9.525 1.106
101 HB2 GLU 13 2HB GLU 13 20.609 -10.671 3.212
102 HB3 GLU 13 3HB GLU 13 19.106 -10.138 3.953
103 HG2 GLU 13 2HG GLU 13 17.871 -11.351 2.169
104 HG3 GLU 13 3HG GLU 13 19.414 -11.986 1.600
105 H CYS 14 H CYS 14 18.055 -7.649 0.744
106 HA CYS 14 HA CYS 14 17.357 -5.846 2.852
107 HB2 CYS 14 2HB CYS 14 16.827 -6.086 -0.044
108 HB3 CYS 14 3HB CYS 14 15.570 -5.276 0.885
109 H LYS 15 H LYS 15 15.985 -6.359 4.415
110 HA LYS 15 HA LYS 15 13.962 -8.392 4.032
111 HB2 LYS 15 2HB LYS 15 15.146 -8.386 6.132
112 HB3 LYS 15 3HB LYS 15 14.726 -6.702 6.417
113 HG2 LYS 15 2HG LYS 15 12.500 -8.625 6.062
114 HG3 LYS 15 3HG LYS 15 13.425 -8.703 7.563
115 HD2 LYS 15 2HD LYS 15 12.591 -6.011 6.674
116 HD3 LYS 15 3HD LYS 15 11.302 -7.091 7.210
117 HE2 LYS 15 2HE LYS 15 13.792 -6.666 8.835
118 HE3 LYS 15 3HE LYS 15 12.408 -5.581 8.960
119 HZ1 LYS 15 3HZ LYS 15 12.656 -8.379 9.792
120 HZ2 LYS 15 1HZ LYS 15 11.140 -7.830 9.280
121 HZ3 LYS 15 2HZ LYS 15 11.915 -7.081 10.583
122 H TYR 16 H TYR 16 11.721 -8.084 4.305
123 HA TYR 16 HA TYR 16 10.546 -5.526 4.682
124 HB2 TYR 16 2HB TYR 16 9.755 -5.033 2.495
125 HB3 TYR 16 3HB TYR 16 11.478 -5.354 2.329
126 HD1 TYR 16 HD1 TYR 16 12.085 -7.853 1.739
127 HD2 TYR 16 HD2 TYR 16 8.290 -6.063 1.033
128 HE1 TYR 16 HE1 TYR 16 11.607 -9.555 0.029
129 HE2 TYR 16 HE2 TYR 16 7.801 -7.760 -0.678
130 HH TYR 16 HH TYR 16 10.211 -9.926 -1.859
131 H LYS 17 H LYS 17 8.119 -5.680 3.788
132 HA LYS 17 HA LYS 17 7.117 -8.279 4.737
133 HB2 LYS 17 2HB LYS 17 5.049 -7.089 5.324
134 HB3 LYS 17 3HB LYS 17 6.448 -6.392 6.130
135 HG2 LYS 17 2HG LYS 17 6.353 -4.865 3.906
136 HG3 LYS 17 3HG LYS 17 4.640 -5.227 4.130
137 HD2 LYS 17 2HD LYS 17 4.488 -3.928 5.955
138 HD3 LYS 17 3HD LYS 17 6.031 -4.495 6.599
139 HE2 LYS 17 2HE LYS 17 6.079 -2.707 4.226
140 HE3 LYS 17 3HE LYS 17 5.674 -1.995 5.787
141 HZ1 LYS 17 3HZ LYS 17 8.207 -2.939 4.806
142 HZ2 LYS 17 1HZ LYS 17 7.839 -3.511 6.355
143 HZ3 LYS 17 2HZ LYS 17 7.869 -1.847 6.054
144 H ASN 18 H ASN 18 5.344 -9.258 3.678
145 HA ASN 18 HA ASN 18 4.896 -8.304 0.926
146 HB2 ASN 18 2HB ASN 18 4.436 -10.901 0.593
147 HB3 ASN 18 3HB ASN 18 6.059 -10.230 0.470
148 HD21 ASN 18 2HD2 ASN 18 7.240 -11.699 3.439
149 HD22 ASN 18 1HD2 ASN 18 7.442 -10.388 2.332
150 H ASP 19 H ASP 19 3.462 -10.829 2.987
151 HA ASP 19 HA ASP 19 0.822 -10.227 2.073
152 HB2 ASP 19 2HB ASP 19 1.140 -12.480 2.632
153 HB3 ASP 19 3HB ASP 19 1.961 -12.087 4.140
154 H ALA 20 H ALA 20 1.888 -10.388 5.460
155 HA ALA 20 HA ALA 20 0.737 -7.747 5.954
156 HB1 ALA 20 1HB ALA 20 -1.056 -9.446 6.313
157 HB2 ALA 20 2HB ALA 20 -0.071 -10.133 7.605
158 HB3 ALA 20 3HB ALA 20 -0.672 -8.480 7.738
159 H GLY 21 H GLY 21 3.280 -7.784 5.978
160 HA2 GLY 21 2HA GLY 21 4.901 -6.991 7.495
161 HA3 GLY 21 3HA GLY 21 4.017 -7.759 8.806
162 H LYS 22 H LYS 22 4.292 -9.872 6.232
163 HA LYS 22 HA LYS 22 5.869 -11.720 7.607
164 HB2 LYS 22 2HB LYS 22 4.685 -11.487 4.949
165 HB3 LYS 22 3HB LYS 22 6.203 -12.376 4.936
166 HG2 LYS 22 2HG LYS 22 4.002 -13.028 6.867
167 HG3 LYS 22 3HG LYS 22 4.059 -13.710 5.240
168 HD2 LYS 22 2HD LYS 22 6.436 -13.880 7.057
169 HD3 LYS 22 3HD LYS 22 5.112 -15.039 7.195
170 HE2 LYS 22 2HE LYS 22 5.824 -14.745 4.443
171 HE3 LYS 22 3HE LYS 22 7.280 -15.066 5.385
172 HZ1 LYS 22 3HZ LYS 22 5.032 -16.795 4.813
173 HZ2 LYS 22 1HZ LYS 22 5.569 -16.846 6.417
174 HZ3 LYS 22 2HZ LYS 22 6.642 -17.187 5.155
175 H ASP 23 H ASP 23 7.849 -11.107 8.299
176 HA ASP 23 HA ASP 23 9.652 -9.488 6.863
177 HB2 ASP 23 2HB ASP 23 11.346 -10.342 8.506
178 HB3 ASP 23 3HB ASP 23 9.889 -9.683 9.245
179 H THR 24 H THR 24 9.936 -10.247 4.782
180 HA THR 24 HA THR 24 11.229 -12.880 4.511
181 HB THR 24 HB THR 24 9.741 -11.248 2.446
182 HG1 THR 24 HG1 THR 24 9.159 -13.605 3.912
183 HG21 THR 24 3HG2 THR 24 11.724 -13.323 2.144
184 HG22 THR 24 1HG2 THR 24 10.918 -12.357 0.908
185 HG23 THR 24 2HG2 THR 24 10.169 -13.842 1.495
186 H PHE 25 H PHE 25 13.343 -12.858 4.170
187 HA PHE 25 HA PHE 25 14.695 -10.414 3.431
188 HB2 PHE 25 2HB PHE 25 16.020 -13.098 3.730
189 HB3 PHE 25 3HB PHE 25 16.696 -11.499 4.022
190 HD1 PHE 25 HD1 PHE 25 16.225 -14.232 5.733
191 HD2 PHE 25 HD2 PHE 25 14.661 -10.274 5.729
192 HE1 PHE 25 HE1 PHE 25 15.685 -14.447 8.123
193 HE2 PHE 25 HE2 PHE 25 14.118 -10.482 8.119
194 HZ PHE 25 HZ PHE 25 14.631 -12.570 9.320
195 H ILE 26 H ILE 26 15.565 -9.912 1.501
196 HA ILE 26 HA ILE 26 15.875 -11.959 -0.546
197 HB ILE 26 HB ILE 26 13.518 -10.856 -0.646
198 HG12 ILE 26 2HG1 ILE 26 14.958 -12.207 -2.428
199 HG13 ILE 26 3HG1 ILE 26 13.413 -11.479 -2.852
200 HG21 ILE 26 1HG2 ILE 26 14.276 -8.553 -0.436
201 HG22 ILE 26 2HG2 ILE 26 15.211 -8.712 -1.922
202 HG23 ILE 26 3HG2 ILE 26 13.451 -8.799 -1.975
203 HD11 ILE 26 3HD1 ILE 26 16.064 -10.134 -3.289
204 HD12 ILE 26 1HD1 ILE 26 15.242 -11.114 -4.503
205 HD13 ILE 26 2HD1 ILE 26 14.487 -9.637 -3.902
206 H LYS 27 H LYS 27 17.550 -11.565 -1.884
207 HA LYS 27 HA LYS 27 19.431 -9.581 -1.259
208 HB2 LYS 27 2HB LYS 27 20.664 -10.348 -3.170
209 HB3 LYS 27 3HB LYS 27 19.922 -11.747 -2.405
210 HG2 LYS 27 2HG LYS 27 18.130 -11.688 -4.093
211 HG3 LYS 27 3HG LYS 27 18.949 -10.337 -4.882
212 HD2 LYS 27 2HD LYS 27 19.603 -12.261 -6.079
213 HD3 LYS 27 3HD LYS 27 20.978 -11.856 -5.049
214 HE2 LYS 27 2HE LYS 27 19.353 -13.553 -3.523
215 HE3 LYS 27 3HE LYS 27 19.399 -14.262 -5.137
216 HZ1 LYS 27 3HZ LYS 27 21.553 -14.790 -4.932
217 HZ2 LYS 27 1HZ LYS 27 21.275 -14.645 -3.269
218 HZ3 LYS 27 2HZ LYS 27 21.954 -13.356 -4.127
219 H CYS 28 H CYS 28 20.297 -8.501 -3.642
220 HA CYS 28 HA CYS 28 18.138 -6.591 -4.235
221 HB2 CYS 28 2HB CYS 28 20.516 -5.971 -3.199
222 HB3 CYS 28 3HB CYS 28 20.973 -5.965 -4.899
223 HA PRO 29 HA PRO 29 18.589 -8.889 -8.177
224 HB2 PRO 29 2HB PRO 29 15.990 -8.574 -8.895
225 HB3 PRO 29 3HB PRO 29 16.541 -9.867 -7.822
226 HG2 PRO 29 2HG PRO 29 15.264 -7.248 -7.134
227 HG3 PRO 29 3HG PRO 29 14.950 -8.857 -6.459
228 HD2 PRO 29 2HD PRO 29 16.488 -7.022 -5.194
229 HD3 PRO 29 3HD PRO 29 16.783 -8.768 -5.064
230 H LYS 30 H LYS 30 17.558 -5.709 -7.323
231 HA LYS 30 HA LYS 30 17.055 -4.637 -9.873
232 HB2 LYS 30 2HB LYS 30 17.356 -3.656 -7.180
233 HB3 LYS 30 3HB LYS 30 18.200 -2.598 -8.303
234 HG2 LYS 30 2HG LYS 30 15.308 -3.417 -8.489
235 HG3 LYS 30 3HG LYS 30 15.913 -1.857 -7.926
236 HD2 LYS 30 2HD LYS 30 17.110 -1.820 -10.253
237 HD3 LYS 30 3HD LYS 30 15.868 -2.997 -10.687
238 HE2 LYS 30 2HE LYS 30 14.965 -0.915 -11.286
239 HE3 LYS 30 3HE LYS 30 14.189 -1.323 -9.757
240 HZ1 LYS 30 3HZ LYS 30 15.261 0.327 -8.665
241 HZ2 LYS 30 1HZ LYS 30 15.262 1.032 -10.203
242 HZ3 LYS 30 2HZ LYS 30 16.647 0.247 -9.632
243 H PHE 31 H PHE 31 19.968 -4.113 -7.878
244 HA PHE 31 HA PHE 31 21.502 -3.812 -10.371
245 HB2 PHE 31 2HB PHE 31 22.731 -2.950 -7.826
246 HB3 PHE 31 3HB PHE 31 22.729 -2.163 -9.401
247 HD1 PHE 31 HD1 PHE 31 21.066 -0.553 -9.980
248 HD2 PHE 31 HD2 PHE 31 20.862 -2.637 -6.274
249 HE1 PHE 31 HE1 PHE 31 19.364 1.036 -9.184
250 HE2 PHE 31 HE2 PHE 31 19.160 -1.052 -5.473
251 HZ PHE 31 HZ PHE 31 18.408 0.787 -6.928
252 H ASP 32 H ASP 32 23.873 -4.431 -10.110
253 HA ASP 32 HA ASP 32 24.037 -6.988 -8.653
254 HB2 ASP 32 2HB ASP 32 24.190 -6.678 -11.352
255 HB3 ASP 32 3HB ASP 32 25.891 -6.565 -10.909
256 H ASN 33 H ASN 33 25.500 -3.921 -9.275
257 HA ASN 33 HA ASN 33 27.742 -4.649 -7.505
258 HB2 ASN 33 2HB ASN 33 27.749 -3.421 -10.116
259 HB3 ASN 33 3HB ASN 33 28.458 -2.328 -8.930
260 HD21 ASN 33 2HD2 ASN 33 31.030 -4.745 -8.052
261 HD22 ASN 33 1HD2 ASN 33 29.828 -3.791 -7.260
262 H LYS 34 H LYS 34 24.955 -2.847 -7.807
263 HA LYS 34 HA LYS 34 25.879 -0.844 -5.856
264 HB2 LYS 34 2HB LYS 34 23.391 -0.694 -7.560
265 HB3 LYS 34 3HB LYS 34 24.098 0.590 -6.589
266 HG2 LYS 34 2HG LYS 34 25.467 -0.668 -8.954
267 HG3 LYS 34 3HG LYS 34 24.487 0.798 -9.041
268 HD2 LYS 34 2HD LYS 34 26.416 0.989 -6.910
269 HD3 LYS 34 3HD LYS 34 27.214 0.606 -8.437
270 HE2 LYS 34 2HE LYS 34 26.415 2.545 -9.471
271 HE3 LYS 34 3HE LYS 34 25.163 2.788 -8.254
272 HZ1 LYS 34 3HZ LYS 34 27.031 4.343 -8.028
273 HZ2 LYS 34 1HZ LYS 34 28.079 3.043 -7.752
274 HZ3 LYS 34 2HZ LYS 34 26.837 3.377 -6.653
275 H LYS 35 H LYS 35 24.789 -3.717 -5.593
276 HA LYS 35 HA LYS 35 22.276 -3.685 -4.390
277 HB2 LYS 35 2HB LYS 35 22.782 -5.833 -3.548
278 HB3 LYS 35 3HB LYS 35 23.676 -5.702 -5.057
279 HG2 LYS 35 2HG LYS 35 25.425 -4.763 -3.103
280 HG3 LYS 35 3HG LYS 35 24.639 -6.171 -2.385
281 HD2 LYS 35 2HD LYS 35 25.621 -7.610 -3.821
282 HD3 LYS 35 3HD LYS 35 25.499 -6.494 -5.183
283 HE2 LYS 35 2HE LYS 35 27.394 -5.222 -4.314
284 HE3 LYS 35 3HE LYS 35 27.506 -6.317 -2.936
285 HZ1 LYS 35 3HZ LYS 35 27.600 -7.519 -5.591
286 HZ2 LYS 35 1HZ LYS 35 28.437 -7.938 -4.182
287 HZ3 LYS 35 2HZ LYS 35 28.954 -6.625 -5.113
288 H CYS 36 H CYS 36 22.189 -4.502 -1.916
289 HA CYS 36 HA CYS 36 22.752 -2.196 -0.371
290 HB2 CYS 36 2HB CYS 36 21.558 -4.869 0.121
291 HB3 CYS 36 3HB CYS 36 22.188 -4.016 1.526
292 H THR 37 H THR 37 24.669 -1.612 0.378
293 HA THR 37 HA THR 37 26.529 -3.712 1.281
294 HB THR 37 HB THR 37 27.408 -2.753 -0.765
295 HG1 THR 37 HG1 THR 37 29.364 -2.578 0.073
296 HG21 THR 37 3HG2 THR 37 28.131 -0.197 -0.393
297 HG22 THR 37 1HG2 THR 37 26.638 -0.212 0.545
298 HG23 THR 37 2HG2 THR 37 26.613 -0.661 -1.160
299 H LYS 38 H LYS 38 24.769 -2.706 3.075
300 HA LYS 38 HA LYS 38 26.519 -1.466 4.987
301 HB2 LYS 38 2HB LYS 38 24.736 0.177 3.449
302 HB3 LYS 38 3HB LYS 38 24.222 0.179 5.131
303 HG2 LYS 38 2HG LYS 38 27.101 0.606 4.517
304 HG3 LYS 38 3HG LYS 38 25.961 1.925 4.239
305 HD2 LYS 38 2HD LYS 38 25.850 2.371 6.418
306 HD3 LYS 38 3HD LYS 38 25.483 0.686 6.797
307 HE2 LYS 38 2HE LYS 38 27.957 0.228 6.548
308 HE3 LYS 38 3HE LYS 38 28.188 1.975 6.502
309 HZ1 LYS 38 3HZ LYS 38 27.216 0.307 8.736
310 HZ2 LYS 38 1HZ LYS 38 26.896 1.968 8.686
311 HZ3 LYS 38 2HZ LYS 38 28.494 1.415 8.720
312 H ASP 39 H ASP 39 25.703 -1.547 7.130
313 HA ASP 39 HA ASP 39 23.729 -3.642 7.500
314 HB2 ASP 39 2HB ASP 39 25.498 -2.169 9.462
315 HB3 ASP 39 3HB ASP 39 24.391 -3.465 9.905
316 H ASN 40 H ASN 40 21.649 -3.238 7.805
317 HA ASN 40 HA ASN 40 19.699 -2.224 8.390
318 HB2 ASN 40 2HB ASN 40 21.238 -0.358 10.180
319 HB3 ASN 40 3HB ASN 40 19.611 -0.998 10.395
320 HD21 ASN 40 2HD2 ASN 40 22.574 -2.754 12.247
321 HD22 ASN 40 1HD2 ASN 40 22.534 -1.127 11.667
322 H ASN 41 H ASN 41 20.937 -1.335 6.076
323 HA ASN 41 HA ASN 41 21.015 1.533 6.002
324 HB2 ASN 41 2HB ASN 41 21.280 1.237 3.567
325 HB3 ASN 41 3HB ASN 41 22.399 0.222 4.472
326 HD21 ASN 41 2HD2 ASN 41 21.219 -2.764 3.192
327 HD22 ASN 41 1HD2 ASN 41 22.331 -1.934 4.222
328 H LYS 42 H LYS 42 19.693 2.300 3.786
329 HA LYS 42 HA LYS 42 16.879 1.864 4.526
330 HB2 LYS 42 2HB LYS 42 17.991 4.201 4.620
331 HB3 LYS 42 3HB LYS 42 17.871 4.165 2.866
332 HG2 LYS 42 2HG LYS 42 15.721 4.704 2.922
333 HG3 LYS 42 3HG LYS 42 15.365 3.438 4.099
334 HD2 LYS 42 2HD LYS 42 15.867 4.853 5.920
335 HD3 LYS 42 3HD LYS 42 16.650 6.043 4.879
336 HE2 LYS 42 2HE LYS 42 13.718 5.350 4.764
337 HE3 LYS 42 3HE LYS 42 14.381 6.707 5.674
338 HZ1 LYS 42 3HZ LYS 42 13.613 7.482 3.561
339 HZ2 LYS 42 1HZ LYS 42 14.509 6.309 2.735
340 HZ3 LYS 42 2HZ LYS 42 15.303 7.552 3.562
341 H CYS 43 H CYS 43 15.955 0.405 3.240
342 HA CYS 43 HA CYS 43 16.084 0.806 0.356
343 HB2 CYS 43 2HB CYS 43 16.695 -1.434 -0.167
344 HB3 CYS 43 3HB CYS 43 17.868 -0.866 1.017
345 H THR 44 H THR 44 14.254 0.162 -0.727
346 HA THR 44 HA THR 44 12.051 -0.814 0.969
347 HB THR 44 HB THR 44 10.578 0.241 -0.848
348 HG1 THR 44 HG1 THR 44 12.811 1.895 -1.344
349 HG21 THR 44 3HG2 THR 44 11.859 2.557 0.316
350 HG22 THR 44 1HG2 THR 44 11.691 1.261 1.500
351 HG23 THR 44 2HG2 THR 44 10.270 1.868 0.649
352 H VAL 45 H VAL 45 10.215 -1.704 -0.624
353 HA VAL 45 HA VAL 45 11.337 -3.348 -2.745
354 HB VAL 45 HB VAL 45 9.919 -4.597 -0.387
355 HG11 VAL 45 1HG1 VAL 45 10.833 -6.692 -1.718
356 HG12 VAL 45 2HG1 VAL 45 9.270 -5.965 -2.096
357 HG13 VAL 45 3HG1 VAL 45 10.682 -5.586 -3.084
358 HG21 VAL 45 3HG2 VAL 45 12.139 -4.105 0.286
359 HG22 VAL 45 1HG2 VAL 45 12.113 -5.816 -0.139
360 HG23 VAL 45 2HG2 VAL 45 12.800 -4.640 -1.259
361 H ASP 46 H ASP 46 9.855 -3.951 -4.280
362 HA ASP 46 HA ASP 46 7.061 -3.142 -3.810
363 HB2 ASP 46 2HB ASP 46 8.838 -1.932 -5.585
364 HB3 ASP 46 3HB ASP 46 7.855 -2.983 -6.601
365 H THR 47 H THR 47 5.860 -4.918 -3.776
366 HA THR 47 HA THR 47 6.653 -7.374 -4.977
367 HB THR 47 HB THR 47 5.295 -7.465 -2.997
368 HG1 THR 47 HG1 THR 47 3.888 -8.996 -3.710
369 HG21 THR 47 3HG2 THR 47 3.270 -5.912 -4.605
370 HG22 THR 47 1HG2 THR 47 4.085 -5.402 -3.127
371 HG23 THR 47 2HG2 THR 47 2.905 -6.712 -3.077
372 H TYR 48 H TYR 48 5.016 -4.618 -6.142
373 HA TYR 48 HA TYR 48 3.226 -5.604 -7.992
374 HB2 TYR 48 2HB TYR 48 4.005 -3.139 -7.364
375 HB3 TYR 48 3HB TYR 48 4.965 -3.330 -8.827
376 HD1 TYR 48 HD1 TYR 48 2.015 -2.030 -7.663
377 HD2 TYR 48 HD2 TYR 48 3.459 -4.510 -10.805
378 HE1 TYR 48 HE1 TYR 48 0.049 -1.445 -9.020
379 HE2 TYR 48 HE2 TYR 48 1.498 -3.931 -12.171
380 HH TYR 48 HH TYR 48 -0.583 -1.378 -11.413
381 H ASN 49 H ASN 49 6.715 -5.079 -8.400
382 HA ASN 49 HA ASN 49 6.781 -7.157 -10.426
383 HB2 ASN 49 2HB ASN 49 8.183 -5.569 -11.911
384 HB3 ASN 49 3HB ASN 49 6.430 -5.400 -11.936
385 HD21 ASN 49 2HD2 ASN 49 8.690 -2.554 -10.050
386 HD22 ASN 49 1HD2 ASN 49 9.246 -4.187 -10.152
387 H ASN 50 H ASN 50 7.813 -6.834 -7.733
388 HA ASN 50 HA ASN 50 9.715 -7.126 -6.513
389 HB2 ASN 50 2HB ASN 50 10.980 -8.234 -9.010
390 HB3 ASN 50 3HB ASN 50 11.225 -8.735 -7.340
391 HD21 ASN 50 2HD2 ASN 50 8.622 -11.020 -7.302
392 HD22 ASN 50 1HD2 ASN 50 9.881 -10.212 -6.438
393 H ALA 51 H ALA 51 10.017 -4.799 -6.431
394 HA ALA 51 HA ALA 51 12.459 -3.975 -7.856
395 HB1 ALA 51 1HB ALA 51 9.845 -2.728 -7.876
396 HB2 ALA 51 2HB ALA 51 11.101 -1.621 -7.321
397 HB3 ALA 51 3HB ALA 51 11.255 -2.414 -8.889
398 H VAL 52 H VAL 52 14.048 -3.751 -6.434
399 HA VAL 52 HA VAL 52 13.401 -2.891 -3.697
400 HB VAL 52 HB VAL 52 14.548 -5.031 -3.797
401 HG11 VAL 52 1HG1 VAL 52 16.672 -3.522 -5.313
402 HG12 VAL 52 2HG1 VAL 52 16.885 -5.142 -4.648
403 HG13 VAL 52 3HG1 VAL 52 15.681 -4.855 -5.905
404 HG21 VAL 52 3HG2 VAL 52 16.509 -4.485 -2.378
405 HG22 VAL 52 1HG2 VAL 52 16.288 -2.784 -2.788
406 HG23 VAL 52 2HG2 VAL 52 15.038 -3.644 -1.889
407 H ASP 53 H ASP 53 14.300 -1.095 -2.819
408 HA ASP 53 HA ASP 53 15.902 0.584 -4.624
409 HB2 ASP 53 2HB ASP 53 13.589 1.274 -3.512
410 HB3 ASP 53 3HB ASP 53 14.638 1.694 -2.161
411 H CYS 54 H CYS 54 17.518 -1.178 -3.636
412 HA CYS 54 HA CYS 54 18.532 -0.997 -1.083
413 HB2 CYS 54 2HB CYS 54 19.962 -1.501 -3.696
414 HB3 CYS 54 3HB CYS 54 20.733 -1.686 -2.124
415 H ASP 55 H ASP 55 20.079 0.241 -0.053
416 HA ASP 55 HA ASP 55 20.254 2.968 -0.877
417 HB2 ASP 55 2HB ASP 55 20.250 1.954 1.526
418 HB3 ASP 55 3HB ASP 55 21.984 1.781 1.269
Start of MODEL 19
1 H1 ALA 1 H ALA 1 0.288 -0.527 -2.827
2 HA ALA 1 HA ALA 1 1.984 1.030 -1.244
3 HB1 ALA 1 1HB ALA 1 -0.224 -0.067 -0.606
4 HB2 ALA 1 2HB ALA 1 0.721 -1.523 -0.291
5 HB3 ALA 1 3HB ALA 1 1.045 -0.047 0.618
6 H LYS 2 H LYS 2 4.143 0.846 -1.432
7 HA LYS 2 HA LYS 2 5.436 -1.716 -1.710
8 HB2 LYS 2 2HB LYS 2 7.522 -0.409 -1.721
9 HB3 LYS 2 3HB LYS 2 6.348 0.220 -2.870
10 HG2 LYS 2 2HG LYS 2 6.197 2.193 -1.825
11 HG3 LYS 2 3HG LYS 2 6.220 1.458 -0.220
12 HD2 LYS 2 2HD LYS 2 8.379 1.938 0.027
13 HD3 LYS 2 3HD LYS 2 8.777 1.142 -1.497
14 HE2 LYS 2 2HE LYS 2 9.432 3.531 -1.432
15 HE3 LYS 2 3HE LYS 2 8.302 3.150 -2.730
16 HZ1 LYS 2 3HZ LYS 2 6.951 3.923 -0.341
17 HZ2 LYS 2 1HZ LYS 2 6.818 4.558 -1.903
18 HZ3 LYS 2 2HZ LYS 2 8.021 5.126 -0.860
19 H TYR 3 H TYR 3 7.625 -1.737 -0.234
20 HA TYR 3 HA TYR 3 6.707 -1.512 2.557
21 HB2 TYR 3 2HB TYR 3 8.531 -3.685 1.525
22 HB3 TYR 3 3HB TYR 3 7.752 -3.591 3.100
23 HD1 TYR 3 HD1 TYR 3 7.440 -4.683 -0.317
24 HD2 TYR 3 HD2 TYR 3 5.252 -3.858 3.237
25 HE1 TYR 3 HE1 TYR 3 5.552 -6.002 -1.181
26 HE2 TYR 3 HE2 TYR 3 3.358 -5.175 2.384
27 HH TYR 3 HH TYR 3 2.531 -6.307 0.659
28 H THR 4 H THR 4 8.407 -1.275 4.149
29 HA THR 4 HA THR 4 10.880 -0.112 3.046
30 HB THR 4 HB THR 4 9.427 0.903 5.494
31 HG1 THR 4 HG1 THR 4 9.046 2.749 4.043
32 HG21 THR 4 3HG2 THR 4 11.983 1.586 4.131
33 HG22 THR 4 1HG2 THR 4 11.591 1.567 5.850
34 HG23 THR 4 2HG2 THR 4 11.039 2.899 4.834
35 H GLY 5 H GLY 5 12.749 -0.792 3.930
36 HA2 GLY 5 2HA GLY 5 12.905 -1.832 6.602
37 HA3 GLY 5 3HA GLY 5 12.996 -3.094 5.383
38 H LYS 6 H LYS 6 15.134 -3.457 6.347
39 HA LYS 6 HA LYS 6 17.137 -1.781 5.009
40 HB2 LYS 6 2HB LYS 6 17.849 -2.849 7.688
41 HB3 LYS 6 3HB LYS 6 18.375 -1.373 6.890
42 HG2 LYS 6 2HG LYS 6 15.876 -0.660 7.272
43 HG3 LYS 6 3HG LYS 6 15.959 -1.879 8.546
44 HD2 LYS 6 2HD LYS 6 18.065 -0.704 9.335
45 HD3 LYS 6 3HD LYS 6 17.630 0.606 8.234
46 HE2 LYS 6 2HE LYS 6 16.475 1.427 9.967
47 HE3 LYS 6 3HE LYS 6 15.288 0.183 9.578
48 HZ1 LYS 6 3HZ LYS 6 15.639 -0.253 11.770
49 HZ2 LYS 6 1HZ LYS 6 17.249 0.267 11.751
50 HZ3 LYS 6 2HZ LYS 6 16.841 -1.245 11.110
51 H CYS 7 H CYS 7 19.213 -2.855 4.717
52 HA CYS 7 HA CYS 7 18.887 -5.773 4.505
53 HB2 CYS 7 2HB CYS 7 21.006 -4.336 2.978
54 HB3 CYS 7 3HB CYS 7 20.068 -5.758 2.531
55 H THR 8 H THR 8 21.463 -6.551 4.099
56 HA THR 8 HA THR 8 22.943 -5.627 6.465
57 HB THR 8 HB THR 8 23.316 -8.470 5.997
58 HG1 THR 8 HG1 THR 8 20.705 -7.545 6.678
59 HG21 THR 8 3HG2 THR 8 22.679 -6.661 8.296
60 HG22 THR 8 1HG2 THR 8 24.097 -7.674 8.032
61 HG23 THR 8 2HG2 THR 8 22.560 -8.409 8.488
62 H LYS 9 H LYS 9 24.852 -4.907 5.814
63 HA LYS 9 HA LYS 9 25.976 -5.226 3.307
64 HB2 LYS 9 2HB LYS 9 27.954 -4.246 4.185
65 HB3 LYS 9 3HB LYS 9 26.614 -3.540 5.080
66 HG2 LYS 9 2HG LYS 9 27.831 -4.028 6.885
67 HG3 LYS 9 3HG LYS 9 27.249 -5.677 6.642
68 HD2 LYS 9 2HD LYS 9 29.567 -5.912 6.855
69 HD3 LYS 9 3HD LYS 9 29.287 -5.966 5.113
70 HE2 LYS 9 2HE LYS 9 30.593 -4.195 4.802
71 HE3 LYS 9 3HE LYS 9 29.654 -3.250 5.958
72 HZ1 LYS 9 3HZ LYS 9 31.674 -5.196 6.878
73 HZ2 LYS 9 1HZ LYS 9 31.035 -3.861 7.699
74 HZ3 LYS 9 2HZ LYS 9 32.124 -3.629 6.426
75 H SER 10 H SER 10 25.959 -7.404 5.971
76 HA SER 10 HA SER 10 28.222 -8.907 5.694
77 HB2 SER 10 2HB SER 10 26.836 -9.618 7.419
78 HB3 SER 10 3HB SER 10 25.398 -9.626 6.398
79 HG SER 10 HG SER 10 27.479 -11.521 6.549
80 H LYS 11 H LYS 11 25.201 -10.093 4.251
81 HA LYS 11 HA LYS 11 26.742 -10.872 1.863
82 HB2 LYS 11 2HB LYS 11 25.082 -12.812 1.721
83 HB3 LYS 11 3HB LYS 11 26.325 -12.911 2.961
84 HG2 LYS 11 2HG LYS 11 24.763 -12.263 4.662
85 HG3 LYS 11 3HG LYS 11 23.514 -11.954 3.453
86 HD2 LYS 11 2HD LYS 11 22.868 -14.048 4.028
87 HD3 LYS 11 3HD LYS 11 24.097 -14.500 2.845
88 HE2 LYS 11 2HE LYS 11 25.432 -14.111 5.294
89 HE3 LYS 11 3HE LYS 11 23.990 -15.058 5.653
90 HZ1 LYS 11 3HZ LYS 11 24.775 -16.828 4.544
91 HZ2 LYS 11 1HZ LYS 11 26.286 -16.105 4.786
92 HZ3 LYS 11 2HZ LYS 11 25.477 -15.903 3.315
93 H ASN 12 H ASN 12 24.684 -8.675 2.781
94 HA ASN 12 HA ASN 12 23.158 -7.359 1.724
95 HB2 ASN 12 2HB ASN 12 23.971 -7.065 -0.346
96 HB3 ASN 12 3HB ASN 12 24.551 -8.727 -0.426
97 HD21 ASN 12 2HD2 ASN 12 21.062 -7.633 -2.172
98 HD22 ASN 12 1HD2 ASN 12 21.946 -6.559 -1.147
99 H GLU 13 H GLU 13 21.084 -7.511 2.234
100 HA GLU 13 HA GLU 13 19.241 -9.189 0.979
101 HB2 GLU 13 2HB GLU 13 20.674 -10.456 3.123
102 HB3 GLU 13 3HB GLU 13 18.981 -10.290 3.567
103 HG2 GLU 13 2HG GLU 13 18.307 -11.448 1.552
104 HG3 GLU 13 3HG GLU 13 19.986 -11.555 1.028
105 H CYS 14 H CYS 14 17.913 -7.441 0.919
106 HA CYS 14 HA CYS 14 17.334 -5.896 3.282
107 HB2 CYS 14 2HB CYS 14 16.736 -5.727 0.403
108 HB3 CYS 14 3HB CYS 14 15.462 -5.116 1.453
109 H LYS 15 H LYS 15 16.088 -6.746 4.814
110 HA LYS 15 HA LYS 15 14.073 -8.716 4.231
111 HB2 LYS 15 2HB LYS 15 15.333 -8.921 6.283
112 HB3 LYS 15 3HB LYS 15 14.847 -7.309 6.791
113 HG2 LYS 15 2HG LYS 15 12.685 -9.250 6.239
114 HG3 LYS 15 3HG LYS 15 13.668 -9.520 7.680
115 HD2 LYS 15 2HD LYS 15 12.654 -6.771 7.185
116 HD3 LYS 15 3HD LYS 15 11.497 -7.992 7.719
117 HE2 LYS 15 2HE LYS 15 12.809 -8.446 9.684
118 HE3 LYS 15 3HE LYS 15 14.097 -7.383 9.120
119 HZ1 LYS 15 3HZ LYS 15 12.961 -5.539 9.716
120 HZ2 LYS 15 1HZ LYS 15 12.245 -6.598 10.824
121 HZ3 LYS 15 2HZ LYS 15 11.443 -6.208 9.388
122 H TYR 16 H TYR 16 11.835 -8.511 4.585
123 HA TYR 16 HA TYR 16 10.602 -6.059 5.320
124 HB2 TYR 16 2HB TYR 16 9.782 -5.271 3.254
125 HB3 TYR 16 3HB TYR 16 11.485 -5.605 2.961
126 HD1 TYR 16 HD1 TYR 16 8.199 -6.108 1.784
127 HD2 TYR 16 HD2 TYR 16 12.011 -7.986 1.995
128 HE1 TYR 16 HE1 TYR 16 7.581 -7.561 -0.102
129 HE2 TYR 16 HE2 TYR 16 11.404 -9.443 0.109
130 HH TYR 16 HH TYR 16 9.685 -10.175 -1.173
131 H LYS 17 H LYS 17 8.170 -6.244 4.132
132 HA LYS 17 HA LYS 17 7.252 -8.933 4.917
133 HB2 LYS 17 2HB LYS 17 5.057 -7.756 5.410
134 HB3 LYS 17 3HB LYS 17 6.389 -7.401 6.501
135 HG2 LYS 17 2HG LYS 17 6.364 -5.533 4.319
136 HG3 LYS 17 3HG LYS 17 4.789 -5.582 5.114
137 HD2 LYS 17 2HD LYS 17 5.869 -5.207 7.277
138 HD3 LYS 17 3HD LYS 17 7.447 -5.169 6.486
139 HE2 LYS 17 2HE LYS 17 6.811 -3.199 5.236
140 HE3 LYS 17 3HE LYS 17 5.179 -3.269 5.899
141 HZ1 LYS 17 3HZ LYS 17 7.550 -2.154 7.037
142 HZ2 LYS 17 1HZ LYS 17 6.801 -3.242 8.094
143 HZ3 LYS 17 2HZ LYS 17 5.934 -1.926 7.481
144 H ASN 18 H ASN 18 6.058 -10.085 3.513
145 HA ASN 18 HA ASN 18 5.229 -8.749 1.020
146 HB2 ASN 18 2HB ASN 18 5.648 -10.835 -0.163
147 HB3 ASN 18 3HB ASN 18 7.102 -10.338 0.697
148 HD21 ASN 18 2HD2 ASN 18 7.154 -13.075 2.870
149 HD22 ASN 18 1HD2 ASN 18 7.723 -11.473 2.563
150 H ASP 19 H ASP 19 4.470 -11.294 3.354
151 HA ASP 19 HA ASP 19 1.774 -11.539 2.244
152 HB2 ASP 19 2HB ASP 19 3.505 -13.425 3.243
153 HB3 ASP 19 3HB ASP 19 2.425 -13.152 4.607
154 H ALA 20 H ALA 20 2.516 -9.112 3.581
155 HA ALA 20 HA ALA 20 1.483 -7.617 4.967
156 HB1 ALA 20 1HB ALA 20 -0.295 -9.765 6.056
157 HB2 ALA 20 2HB ALA 20 -0.627 -8.047 5.832
158 HB3 ALA 20 3HB ALA 20 -0.550 -9.120 4.434
159 H GLY 21 H GLY 21 3.690 -9.525 5.729
160 HA2 GLY 21 2HA GLY 21 4.506 -8.612 8.108
161 HA3 GLY 21 3HA GLY 21 3.341 -9.834 8.598
162 H LYS 22 H LYS 22 4.173 -11.331 6.042
163 HA LYS 22 HA LYS 22 5.939 -13.136 7.270
164 HB2 LYS 22 2HB LYS 22 4.861 -12.747 4.526
165 HB3 LYS 22 3HB LYS 22 6.290 -13.760 4.691
166 HG2 LYS 22 2HG LYS 22 3.998 -14.889 4.748
167 HG3 LYS 22 3HG LYS 22 5.175 -15.340 5.984
168 HD2 LYS 22 2HD LYS 22 4.068 -14.121 7.646
169 HD3 LYS 22 3HD LYS 22 3.159 -13.170 6.470
170 HE2 LYS 22 2HE LYS 22 1.523 -14.687 6.364
171 HE3 LYS 22 3HE LYS 22 2.664 -16.024 6.222
172 HZ1 LYS 22 3HZ LYS 22 2.791 -16.266 8.505
173 HZ2 LYS 22 1HZ LYS 22 1.154 -15.905 8.274
174 HZ3 LYS 22 2HZ LYS 22 2.215 -14.707 8.822
175 H ASP 23 H ASP 23 7.891 -12.458 7.939
176 HA ASP 23 HA ASP 23 9.475 -10.519 6.641
177 HB2 ASP 23 2HB ASP 23 10.616 -12.652 8.429
178 HB3 ASP 23 3HB ASP 23 11.118 -10.973 8.259
179 H THR 24 H THR 24 10.367 -10.727 4.705
180 HA THR 24 HA THR 24 11.778 -13.219 4.063
181 HB THR 24 HB THR 24 9.893 -11.781 2.186
182 HG1 THR 24 HG1 THR 24 9.798 -14.470 3.113
183 HG21 THR 24 3HG2 THR 24 10.466 -13.729 0.668
184 HG22 THR 24 1HG2 THR 24 11.829 -14.046 1.740
185 HG23 THR 24 2HG2 THR 24 11.727 -12.514 0.873
186 H PHE 25 H PHE 25 13.738 -12.923 3.177
187 HA PHE 25 HA PHE 25 14.671 -10.200 2.818
188 HB2 PHE 25 2HB PHE 25 16.316 -12.689 2.411
189 HB3 PHE 25 3HB PHE 25 16.861 -11.080 2.874
190 HD1 PHE 25 HD1 PHE 25 14.967 -10.448 5.045
191 HD2 PHE 25 HD2 PHE 25 17.043 -14.053 4.142
192 HE1 PHE 25 HE1 PHE 25 14.867 -11.097 7.417
193 HE2 PHE 25 HE2 PHE 25 16.945 -14.707 6.511
194 HZ PHE 25 HZ PHE 25 15.855 -13.229 8.152
195 H ILE 26 H ILE 26 16.237 -9.839 0.928
196 HA ILE 26 HA ILE 26 15.990 -11.259 -1.476
197 HB ILE 26 HB ILE 26 13.681 -10.537 -1.511
198 HG12 ILE 26 2HG1 ILE 26 13.662 -9.330 -3.658
199 HG13 ILE 26 3HG1 ILE 26 15.360 -8.918 -3.441
200 HG21 ILE 26 1HG2 ILE 26 14.058 -7.699 -1.842
201 HG22 ILE 26 2HG2 ILE 26 12.988 -8.570 -0.745
202 HG23 ILE 26 3HG2 ILE 26 14.654 -8.238 -0.273
203 HD11 ILE 26 3HD1 ILE 26 14.398 -11.073 -4.815
204 HD12 ILE 26 1HD1 ILE 26 16.041 -10.896 -4.198
205 HD13 ILE 26 2HD1 ILE 26 14.835 -11.775 -3.257
206 H LYS 27 H LYS 27 17.773 -10.755 -2.548
207 HA LYS 27 HA LYS 27 19.314 -8.438 -1.878
208 HB2 LYS 27 2HB LYS 27 20.852 -9.276 -3.662
209 HB3 LYS 27 3HB LYS 27 20.487 -10.461 -2.415
210 HG2 LYS 27 2HG LYS 27 18.977 -11.618 -3.857
211 HG3 LYS 27 3HG LYS 27 19.090 -10.348 -5.078
212 HD2 LYS 27 2HD LYS 27 21.724 -11.124 -4.616
213 HD3 LYS 27 3HD LYS 27 20.806 -12.632 -4.624
214 HE2 LYS 27 2HE LYS 27 19.712 -11.607 -6.765
215 HE3 LYS 27 3HE LYS 27 21.165 -10.610 -6.794
216 HZ1 LYS 27 3HZ LYS 27 21.763 -12.421 -8.062
217 HZ2 LYS 27 1HZ LYS 27 20.915 -13.528 -7.103
218 HZ3 LYS 27 2HZ LYS 27 22.366 -12.862 -6.544
219 H CYS 28 H CYS 28 19.757 -6.634 -3.111
220 HA CYS 28 HA CYS 28 17.761 -5.470 -4.589
221 HB2 CYS 28 2HB CYS 28 20.148 -4.618 -3.686
222 HB3 CYS 28 3HB CYS 28 20.529 -4.771 -5.398
223 HA PRO 29 HA PRO 29 18.016 -8.065 -8.258
224 HB2 PRO 29 2HB PRO 29 15.695 -7.157 -9.334
225 HB3 PRO 29 3HB PRO 29 15.749 -8.372 -8.051
226 HG2 PRO 29 2HG PRO 29 15.235 -5.430 -7.852
227 HG3 PRO 29 3HG PRO 29 14.408 -6.768 -7.033
228 HD2 PRO 29 2HD PRO 29 16.298 -5.259 -5.814
229 HD3 PRO 29 3HD PRO 29 16.058 -6.978 -5.437
230 H LYS 30 H LYS 30 17.173 -4.614 -8.251
231 HA LYS 30 HA LYS 30 17.600 -4.017 -10.916
232 HB2 LYS 30 2HB LYS 30 17.205 -2.571 -8.525
233 HB3 LYS 30 3HB LYS 30 18.644 -1.895 -9.277
234 HG2 LYS 30 2HG LYS 30 16.027 -2.270 -10.713
235 HG3 LYS 30 3HG LYS 30 16.507 -0.776 -9.905
236 HD2 LYS 30 2HD LYS 30 18.448 -0.590 -11.359
237 HD3 LYS 30 3HD LYS 30 18.035 -2.121 -12.134
238 HE2 LYS 30 2HE LYS 30 15.791 -0.998 -12.687
239 HE3 LYS 30 3HE LYS 30 16.604 0.513 -12.282
240 HZ1 LYS 30 3HZ LYS 30 16.592 -0.394 -14.718
241 HZ2 LYS 30 1HZ LYS 30 17.904 -1.312 -14.172
242 HZ3 LYS 30 2HZ LYS 30 17.962 0.377 -14.093
243 H PHE 31 H PHE 31 19.984 -3.481 -8.313
244 HA PHE 31 HA PHE 31 22.106 -3.841 -10.324
245 HB2 PHE 31 2HB PHE 31 22.832 -2.567 -7.769
246 HB3 PHE 31 3HB PHE 31 23.270 -2.123 -9.415
247 HD1 PHE 31 HD1 PHE 31 20.707 -1.801 -6.799
248 HD2 PHE 31 HD2 PHE 31 22.021 -0.505 -10.635
249 HE1 PHE 31 HE1 PHE 31 19.097 0.058 -6.719
250 HE2 PHE 31 HE2 PHE 31 20.414 1.356 -10.560
251 HZ PHE 31 HZ PHE 31 18.950 1.640 -8.600
252 H ASP 32 H ASP 32 22.689 -5.932 -10.190
253 HA ASP 32 HA ASP 32 22.755 -7.377 -7.720
254 HB2 ASP 32 2HB ASP 32 22.419 -8.247 -10.170
255 HB3 ASP 32 3HB ASP 32 24.180 -8.307 -10.188
256 H ASN 33 H ASN 33 24.799 -5.116 -9.044
257 HA ASN 33 HA ASN 33 27.134 -6.228 -7.632
258 HB2 ASN 33 2HB ASN 33 26.894 -5.221 -10.278
259 HB3 ASN 33 3HB ASN 33 27.882 -4.081 -9.369
260 HD21 ASN 33 2HD2 ASN 33 30.271 -6.741 -8.536
261 HD22 ASN 33 1HD2 ASN 33 29.257 -5.642 -7.670
262 H LYS 34 H LYS 34 24.936 -3.585 -7.916
263 HA LYS 34 HA LYS 34 26.489 -2.055 -5.933
264 HB2 LYS 34 2HB LYS 34 24.280 -0.944 -7.656
265 HB3 LYS 34 3HB LYS 34 25.492 -0.057 -6.741
266 HG2 LYS 34 2HG LYS 34 26.048 -1.779 -9.148
267 HG3 LYS 34 3HG LYS 34 25.923 -0.018 -9.152
268 HD2 LYS 34 2HD LYS 34 27.748 -0.328 -7.212
269 HD3 LYS 34 3HD LYS 34 28.093 -1.772 -8.167
270 HE2 LYS 34 2HE LYS 34 27.914 0.055 -10.133
271 HE3 LYS 34 3HE LYS 34 28.488 1.081 -8.819
272 HZ1 LYS 34 3HZ LYS 34 30.511 0.320 -9.234
273 HZ2 LYS 34 1HZ LYS 34 29.931 -0.791 -10.370
274 HZ3 LYS 34 2HZ LYS 34 30.018 -1.220 -8.736
275 H LYS 35 H LYS 35 24.541 -4.316 -5.560
276 HA LYS 35 HA LYS 35 22.113 -3.374 -4.526
277 HB2 LYS 35 2HB LYS 35 21.976 -5.529 -3.362
278 HB3 LYS 35 3HB LYS 35 22.501 -5.733 -5.028
279 HG2 LYS 35 2HG LYS 35 24.843 -5.448 -3.519
280 HG3 LYS 35 3HG LYS 35 23.796 -6.533 -2.601
281 HD2 LYS 35 2HD LYS 35 24.155 -6.942 -5.541
282 HD3 LYS 35 3HD LYS 35 25.399 -7.497 -4.418
283 HE2 LYS 35 2HE LYS 35 24.103 -9.158 -3.598
284 HE3 LYS 35 3HE LYS 35 22.623 -8.207 -3.720
285 HZ1 LYS 35 3HZ LYS 35 23.714 -8.870 -6.281
286 HZ2 LYS 35 1HZ LYS 35 22.149 -9.106 -5.682
287 HZ3 LYS 35 2HZ LYS 35 23.357 -10.248 -5.367
288 H CYS 36 H CYS 36 21.771 -4.168 -1.987
289 HA CYS 36 HA CYS 36 22.598 -2.041 -0.442
290 HB2 CYS 36 2HB CYS 36 21.573 -4.775 0.183
291 HB3 CYS 36 3HB CYS 36 22.212 -3.802 1.504
292 H THR 37 H THR 37 24.443 -1.464 0.494
293 HA THR 37 HA THR 37 26.483 -3.527 0.992
294 HB THR 37 HB THR 37 28.239 -1.916 0.345
295 HG1 THR 37 HG1 THR 37 26.131 -0.336 -0.732
296 HG21 THR 37 3HG2 THR 37 26.723 -3.476 -1.305
297 HG22 THR 37 1HG2 THR 37 28.194 -2.633 -1.788
298 HG23 THR 37 2HG2 THR 37 26.618 -1.905 -2.100
299 H LYS 38 H LYS 38 24.559 -2.336 2.807
300 HA LYS 38 HA LYS 38 26.433 -1.438 4.833
301 HB2 LYS 38 2HB LYS 38 24.749 0.403 3.425
302 HB3 LYS 38 3HB LYS 38 24.212 0.304 5.097
303 HG2 LYS 38 2HG LYS 38 27.120 0.585 4.639
304 HG3 LYS 38 3HG LYS 38 26.107 1.985 4.282
305 HD2 LYS 38 2HD LYS 38 25.493 0.660 6.825
306 HD3 LYS 38 3HD LYS 38 27.110 1.365 6.742
307 HE2 LYS 38 2HE LYS 38 26.293 3.514 6.428
308 HE3 LYS 38 3HE LYS 38 24.727 2.942 5.854
309 HZ1 LYS 38 3HZ LYS 38 25.033 2.003 8.449
310 HZ2 LYS 38 1HZ LYS 38 23.966 3.197 7.901
311 HZ3 LYS 38 2HZ LYS 38 25.497 3.630 8.475
312 H ASP 39 H ASP 39 25.503 -1.453 6.993
313 HA ASP 39 HA ASP 39 23.420 -3.493 7.213
314 HB2 ASP 39 2HB ASP 39 25.543 -2.464 9.071
315 HB3 ASP 39 3HB ASP 39 24.166 -3.361 9.704
316 H ASN 40 H ASN 40 21.414 -3.043 7.846
317 HA ASN 40 HA ASN 40 19.592 -1.934 8.637
318 HB2 ASN 40 2HB ASN 40 21.368 -0.104 10.222
319 HB3 ASN 40 3HB ASN 40 19.777 -0.735 10.636
320 HD21 ASN 40 2HD2 ASN 40 23.118 -2.671 11.725
321 HD22 ASN 40 1HD2 ASN 40 23.130 -1.159 10.889
322 H ASN 41 H ASN 41 21.002 -1.032 6.249
323 HA ASN 41 HA ASN 41 21.003 1.812 6.162
324 HB2 ASN 41 2HB ASN 41 21.253 1.543 3.744
325 HB3 ASN 41 3HB ASN 41 22.329 0.442 4.601
326 HD21 ASN 41 2HD2 ASN 41 20.991 -2.429 3.224
327 HD22 ASN 41 1HD2 ASN 41 22.170 -1.687 4.246
328 H LYS 42 H LYS 42 19.627 2.545 3.941
329 HA LYS 42 HA LYS 42 16.831 2.142 4.770
330 HB2 LYS 42 2HB LYS 42 17.952 4.474 4.821
331 HB3 LYS 42 3HB LYS 42 17.796 4.427 3.070
332 HG2 LYS 42 2HG LYS 42 15.307 3.715 4.322
333 HG3 LYS 42 3HG LYS 42 15.891 5.268 4.924
334 HD2 LYS 42 2HD LYS 42 16.349 5.624 2.314
335 HD3 LYS 42 3HD LYS 42 15.002 4.490 2.208
336 HE2 LYS 42 2HE LYS 42 13.909 6.091 3.965
337 HE3 LYS 42 3HE LYS 42 15.080 7.251 3.341
338 HZ1 LYS 42 3HZ LYS 42 13.188 5.746 1.623
339 HZ2 LYS 42 1HZ LYS 42 14.177 7.042 1.170
340 HZ3 LYS 42 2HZ LYS 42 12.878 7.297 2.222
341 H CYS 43 H CYS 43 15.871 0.675 3.519
342 HA CYS 43 HA CYS 43 15.968 1.041 0.623
343 HB2 CYS 43 2HB CYS 43 16.463 -1.246 0.147
344 HB3 CYS 43 3HB CYS 43 17.687 -0.685 1.283
345 H THR 44 H THR 44 14.092 0.512 -0.419
346 HA THR 44 HA THR 44 11.906 -0.536 1.260
347 HB THR 44 HB THR 44 10.471 0.852 -0.475
348 HG1 THR 44 HG1 THR 44 11.712 2.070 -1.675
349 HG21 THR 44 3HG2 THR 44 9.990 1.616 1.583
350 HG22 THR 44 1HG2 THR 44 11.138 2.903 1.214
351 HG23 THR 44 2HG2 THR 44 11.664 1.486 2.123
352 H VAL 45 H VAL 45 11.075 -2.383 0.557
353 HA VAL 45 HA VAL 45 11.755 -3.387 -2.070
354 HB VAL 45 HB VAL 45 10.110 -4.636 0.135
355 HG11 VAL 45 1HG1 VAL 45 9.397 -5.923 -1.577
356 HG12 VAL 45 2HG1 VAL 45 10.758 -5.487 -2.613
357 HG13 VAL 45 3HG1 VAL 45 10.960 -6.708 -1.357
358 HG21 VAL 45 3HG2 VAL 45 12.003 -5.422 1.040
359 HG22 VAL 45 1HG2 VAL 45 12.703 -5.801 -0.534
360 HG23 VAL 45 2HG2 VAL 45 12.809 -4.161 0.106
361 H ASP 46 H ASP 46 10.431 -3.592 -3.791
362 HA ASP 46 HA ASP 46 7.641 -2.696 -3.467
363 HB2 ASP 46 2HB ASP 46 9.726 -1.681 -5.175
364 HB3 ASP 46 3HB ASP 46 8.401 -2.304 -6.154
365 H THR 47 H THR 47 6.578 -4.608 -3.420
366 HA THR 47 HA THR 47 7.270 -6.874 -4.972
367 HB THR 47 HB THR 47 5.991 -7.141 -2.926
368 HG1 THR 47 HG1 THR 47 4.663 -8.687 -3.726
369 HG21 THR 47 3HG2 THR 47 3.918 -5.503 -4.371
370 HG22 THR 47 1HG2 THR 47 4.678 -5.170 -2.816
371 HG23 THR 47 2HG2 THR 47 3.536 -6.505 -2.972
372 H TYR 48 H TYR 48 5.714 -3.983 -5.781
373 HA TYR 48 HA TYR 48 3.769 -4.687 -7.604
374 HB2 TYR 48 2HB TYR 48 4.322 -2.362 -6.889
375 HB3 TYR 48 3HB TYR 48 5.737 -2.414 -7.934
376 HD1 TYR 48 HD1 TYR 48 5.482 -2.416 -10.374
377 HD2 TYR 48 HD2 TYR 48 2.109 -2.094 -7.801
378 HE1 TYR 48 HE1 TYR 48 4.118 -1.641 -12.269
379 HE2 TYR 48 HE2 TYR 48 0.735 -1.319 -9.688
380 HH TYR 48 HH TYR 48 2.138 -0.553 -12.789
381 H ASN 49 H ASN 49 7.256 -4.311 -8.180
382 HA ASN 49 HA ASN 49 7.022 -6.127 -10.459
383 HB2 ASN 49 2HB ASN 49 8.088 -4.713 -12.001
384 HB3 ASN 49 3HB ASN 49 6.939 -3.655 -11.187
385 HD21 ASN 49 2HD2 ASN 49 9.466 -1.899 -9.366
386 HD22 ASN 49 1HD2 ASN 49 7.883 -2.567 -9.185
387 H ASN 50 H ASN 50 8.141 -6.176 -7.689
388 HA ASN 50 HA ASN 50 9.992 -6.895 -6.571
389 HB2 ASN 50 2HB ASN 50 10.360 -8.168 -9.280
390 HB3 ASN 50 3HB ASN 50 11.463 -8.483 -7.944
391 HD21 ASN 50 2HD2 ASN 50 8.384 -10.793 -8.247
392 HD22 ASN 50 1HD2 ASN 50 9.265 -9.997 -9.502
393 H ALA 51 H ALA 51 10.915 -4.850 -6.220
394 HA ALA 51 HA ALA 51 13.544 -4.540 -7.265
395 HB1 ALA 51 1HB ALA 51 11.881 -2.169 -7.939
396 HB2 ALA 51 2HB ALA 51 13.373 -2.752 -8.677
397 HB3 ALA 51 3HB ALA 51 11.844 -3.558 -9.026
398 H VAL 52 H VAL 52 14.434 -4.225 -5.315
399 HA VAL 52 HA VAL 52 13.159 -2.507 -3.352
400 HB VAL 52 HB VAL 52 14.326 -4.694 -2.785
401 HG11 VAL 52 1HG1 VAL 52 16.344 -4.038 -4.231
402 HG12 VAL 52 2HG1 VAL 52 16.851 -3.077 -2.841
403 HG13 VAL 52 3HG1 VAL 52 16.653 -4.823 -2.683
404 HG21 VAL 52 3HG2 VAL 52 15.338 -2.294 -1.272
405 HG22 VAL 52 1HG2 VAL 52 13.681 -2.888 -1.163
406 HG23 VAL 52 2HG2 VAL 52 15.020 -3.912 -0.645
407 H ASP 53 H ASP 53 14.053 -0.626 -2.496
408 HA ASP 53 HA ASP 53 15.826 0.795 -4.325
409 HB2 ASP 53 2HB ASP 53 13.908 1.603 -2.182
410 HB3 ASP 53 3HB ASP 53 15.221 2.702 -2.595
411 H CYS 54 H CYS 54 17.450 -0.909 -3.359
412 HA CYS 54 HA CYS 54 18.524 -0.575 -0.801
413 HB2 CYS 54 2HB CYS 54 20.595 -1.604 -1.785
414 HB3 CYS 54 3HB CYS 54 19.116 -2.512 -2.083
415 H ASP 55 H ASP 55 20.044 0.749 0.066
416 HA ASP 55 HA ASP 55 20.391 3.322 -0.894
417 HB2 ASP 55 2HB ASP 55 21.362 1.761 1.316
418 HB3 ASP 55 3HB ASP 55 22.676 2.733 0.661
Start of MODEL 20
1 H1 ALA 1 H ALA 1 1.295 -1.532 -0.972
2 HA ALA 1 HA ALA 1 1.940 -1.375 -3.166
3 HB1 ALA 1 1HB ALA 1 2.516 1.546 -2.778
4 HB2 ALA 1 2HB ALA 1 2.104 0.692 -4.265
5 HB3 ALA 1 3HB ALA 1 0.879 0.936 -3.020
6 H LYS 2 H LYS 2 3.886 0.550 -0.907
7 HA LYS 2 HA LYS 2 6.282 -0.793 -1.965
8 HB2 LYS 2 2HB LYS 2 6.272 1.508 -2.771
9 HB3 LYS 2 3HB LYS 2 6.040 2.104 -1.133
10 HG2 LYS 2 2HG LYS 2 8.312 2.421 -1.589
11 HG3 LYS 2 3HG LYS 2 8.247 0.980 -0.572
12 HD2 LYS 2 2HD LYS 2 9.519 0.028 -2.151
13 HD3 LYS 2 3HD LYS 2 8.030 -0.068 -3.096
14 HE2 LYS 2 2HE LYS 2 8.610 1.690 -4.439
15 HE3 LYS 2 3HE LYS 2 9.592 2.459 -3.194
16 HZ1 LYS 2 3HZ LYS 2 10.366 0.604 -5.233
17 HZ2 LYS 2 1HZ LYS 2 10.894 0.126 -3.698
18 HZ3 LYS 2 2HZ LYS 2 11.322 1.645 -4.305
19 H TYR 3 H TYR 3 7.377 -1.876 -0.470
20 HA TYR 3 HA TYR 3 6.759 -1.387 2.351
21 HB2 TYR 3 2HB TYR 3 8.230 -3.710 1.089
22 HB3 TYR 3 3HB TYR 3 7.714 -3.592 2.767
23 HD1 TYR 3 HD1 TYR 3 6.892 -4.879 -0.387
24 HD2 TYR 3 HD2 TYR 3 5.114 -3.167 3.079
25 HE1 TYR 3 HE1 TYR 3 4.745 -5.919 -0.982
26 HE2 TYR 3 HE2 TYR 3 2.962 -4.204 2.494
27 HH TYR 3 HH TYR 3 1.858 -5.020 0.269
28 H THR 4 H THR 4 8.172 -0.477 3.692
29 HA THR 4 HA THR 4 10.864 0.103 2.688
30 HB THR 4 HB THR 4 9.572 1.276 5.150
31 HG1 THR 4 HG1 THR 4 8.549 2.667 3.900
32 HG21 THR 4 3HG2 THR 4 11.213 3.015 4.916
33 HG22 THR 4 1HG2 THR 4 11.770 2.348 3.382
34 HG23 THR 4 2HG2 THR 4 12.048 1.462 4.882
35 H GLY 5 H GLY 5 12.637 -0.801 3.539
36 HA2 GLY 5 2HA GLY 5 12.578 -1.897 6.238
37 HA3 GLY 5 3HA GLY 5 12.830 -3.054 4.940
38 H LYS 6 H LYS 6 14.896 -3.601 5.651
39 HA LYS 6 HA LYS 6 16.950 -1.659 4.909
40 HB2 LYS 6 2HB LYS 6 17.213 -3.237 7.460
41 HB3 LYS 6 3HB LYS 6 18.197 -1.888 6.908
42 HG2 LYS 6 2HG LYS 6 16.927 -0.814 8.451
43 HG3 LYS 6 3HG LYS 6 15.883 -0.615 7.041
44 HD2 LYS 6 2HD LYS 6 14.314 -2.047 7.837
45 HD3 LYS 6 3HD LYS 6 15.506 -3.085 8.623
46 HE2 LYS 6 2HE LYS 6 15.688 -1.626 10.478
47 HE3 LYS 6 3HE LYS 6 14.814 -0.341 9.644
48 HZ1 LYS 6 3HZ LYS 6 12.840 -1.811 9.663
49 HZ2 LYS 6 1HZ LYS 6 13.358 -1.363 11.211
50 HZ3 LYS 6 2HZ LYS 6 13.698 -2.912 10.621
51 H CYS 7 H CYS 7 19.060 -2.644 4.556
52 HA CYS 7 HA CYS 7 18.791 -5.441 3.691
53 HB2 CYS 7 2HB CYS 7 19.598 -3.247 2.250
54 HB3 CYS 7 3HB CYS 7 21.135 -3.950 2.744
55 H THR 8 H THR 8 21.424 -6.128 3.401
56 HA THR 8 HA THR 8 22.799 -5.656 5.916
57 HB THR 8 HB THR 8 22.973 -8.415 5.761
58 HG1 THR 8 HG1 THR 8 21.178 -8.550 4.394
59 HG21 THR 8 3HG2 THR 8 20.880 -7.344 7.542
60 HG22 THR 8 1HG2 THR 8 22.457 -6.566 7.663
61 HG23 THR 8 2HG2 THR 8 22.310 -8.304 7.921
62 H LYS 9 H LYS 9 24.789 -5.186 5.268
63 HA LYS 9 HA LYS 9 25.909 -5.798 2.795
64 HB2 LYS 9 2HB LYS 9 28.040 -5.094 3.754
65 HB3 LYS 9 3HB LYS 9 26.747 -4.015 4.261
66 HG2 LYS 9 2HG LYS 9 27.661 -4.281 6.290
67 HG3 LYS 9 3HG LYS 9 26.735 -5.784 6.300
68 HD2 LYS 9 2HD LYS 9 28.781 -6.871 5.252
69 HD3 LYS 9 3HD LYS 9 29.650 -5.392 5.668
70 HE2 LYS 9 2HE LYS 9 28.175 -6.263 7.946
71 HE3 LYS 9 3HE LYS 9 29.089 -7.630 7.311
72 HZ1 LYS 9 3HZ LYS 9 30.071 -5.689 8.932
73 HZ2 LYS 9 1HZ LYS 9 30.617 -5.204 7.406
74 HZ3 LYS 9 2HZ LYS 9 31.000 -6.744 7.991
75 H SER 10 H SER 10 25.557 -7.750 5.591
76 HA SER 10 HA SER 10 27.680 -9.494 5.491
77 HB2 SER 10 2HB SER 10 24.795 -9.850 6.232
78 HB3 SER 10 3HB SER 10 25.873 -11.246 6.215
79 HG SER 10 HG SER 10 27.261 -9.984 7.628
80 H LYS 11 H LYS 11 24.539 -10.471 4.151
81 HA LYS 11 HA LYS 11 25.985 -11.704 1.897
82 HB2 LYS 11 2HB LYS 11 24.041 -13.338 1.857
83 HB3 LYS 11 3HB LYS 11 25.154 -13.488 3.210
84 HG2 LYS 11 2HG LYS 11 23.619 -12.424 4.689
85 HG3 LYS 11 3HG LYS 11 22.552 -11.986 3.353
86 HD2 LYS 11 2HD LYS 11 21.670 -14.073 3.198
87 HD3 LYS 11 3HD LYS 11 23.177 -14.862 3.667
88 HE2 LYS 11 2HE LYS 11 22.771 -14.035 6.000
89 HE3 LYS 11 3HE LYS 11 21.178 -13.500 5.465
90 HZ1 LYS 11 3HZ LYS 11 21.675 -16.207 4.733
91 HZ2 LYS 11 1HZ LYS 11 20.395 -15.555 5.627
92 HZ3 LYS 11 2HZ LYS 11 21.834 -15.990 6.403
93 H ASN 12 H ASN 12 24.228 -9.125 2.554
94 HA ASN 12 HA ASN 12 22.936 -7.698 1.343
95 HB2 ASN 12 2HB ASN 12 24.230 -7.672 -0.541
96 HB3 ASN 12 3HB ASN 12 24.184 -9.423 -0.726
97 HD21 ASN 12 2HD2 ASN 12 21.456 -7.045 -2.555
98 HD22 ASN 12 1HD2 ASN 12 22.554 -6.425 -1.375
99 H GLU 13 H GLU 13 20.868 -7.785 1.941
100 HA GLU 13 HA GLU 13 18.930 -9.129 0.412
101 HB2 GLU 13 2HB GLU 13 20.131 -10.787 2.331
102 HB3 GLU 13 3HB GLU 13 18.574 -10.337 3.012
103 HG2 GLU 13 2HG GLU 13 17.409 -11.216 1.135
104 HG3 GLU 13 3HG GLU 13 18.910 -11.453 0.242
105 H CYS 14 H CYS 14 17.478 -7.548 0.438
106 HA CYS 14 HA CYS 14 17.077 -5.913 2.791
107 HB2 CYS 14 2HB CYS 14 17.091 -4.832 0.611
108 HB3 CYS 14 3HB CYS 14 15.767 -5.856 0.065
109 H LYS 15 H LYS 15 15.627 -6.302 4.318
110 HA LYS 15 HA LYS 15 13.601 -8.354 3.872
111 HB2 LYS 15 2HB LYS 15 14.895 -8.616 5.880
112 HB3 LYS 15 3HB LYS 15 14.572 -6.957 6.367
113 HG2 LYS 15 2HG LYS 15 12.241 -8.743 5.964
114 HG3 LYS 15 3HG LYS 15 13.255 -9.018 7.383
115 HD2 LYS 15 2HD LYS 15 12.532 -6.210 6.869
116 HD3 LYS 15 3HD LYS 15 11.190 -7.271 7.304
117 HE2 LYS 15 2HE LYS 15 12.502 -8.013 9.282
118 HE3 LYS 15 3HE LYS 15 13.727 -6.815 8.869
119 HZ1 LYS 15 3HZ LYS 15 11.214 -6.463 10.191
120 HZ2 LYS 15 1HZ LYS 15 11.401 -5.400 8.888
121 HZ3 LYS 15 2HZ LYS 15 12.552 -5.430 10.127
122 H TYR 16 H TYR 16 11.392 -8.030 4.274
123 HA TYR 16 HA TYR 16 10.382 -5.407 4.898
124 HB2 TYR 16 2HB TYR 16 9.271 -4.958 2.831
125 HB3 TYR 16 3HB TYR 16 10.955 -5.294 2.445
126 HD1 TYR 16 HD1 TYR 16 11.538 -7.652 1.636
127 HD2 TYR 16 HD2 TYR 16 7.553 -6.169 1.802
128 HE1 TYR 16 HE1 TYR 16 10.831 -9.388 0.044
129 HE2 TYR 16 HE2 TYR 16 6.836 -7.902 0.212
130 HH TYR 16 HH TYR 16 8.835 -9.583 -1.700
131 H LYS 17 H LYS 17 7.810 -5.624 4.016
132 HA LYS 17 HA LYS 17 6.871 -8.108 5.296
133 HB2 LYS 17 2HB LYS 17 4.857 -6.747 5.975
134 HB3 LYS 17 3HB LYS 17 6.362 -6.314 6.775
135 HG2 LYS 17 2HG LYS 17 6.105 -4.744 4.416
136 HG3 LYS 17 3HG LYS 17 4.600 -4.649 5.332
137 HD2 LYS 17 2HD LYS 17 5.830 -2.940 6.277
138 HD3 LYS 17 3HD LYS 17 6.190 -4.281 7.367
139 HE2 LYS 17 2HE LYS 17 8.260 -4.712 6.080
140 HE3 LYS 17 3HE LYS 17 7.908 -3.295 5.092
141 HZ1 LYS 17 3HZ LYS 17 7.768 -2.516 7.764
142 HZ2 LYS 17 1HZ LYS 17 8.916 -2.060 6.607
143 HZ3 LYS 17 2HZ LYS 17 9.193 -3.411 7.587
144 H ASN 18 H ASN 18 5.493 -9.346 4.179
145 HA ASN 18 HA ASN 18 4.375 -8.242 1.686
146 HB2 ASN 18 2HB ASN 18 4.265 -10.912 1.269
147 HB3 ASN 18 3HB ASN 18 5.635 -9.911 0.798
148 HD21 ASN 18 2HD2 ASN 18 6.051 -12.814 3.519
149 HD22 ASN 18 1HD2 ASN 18 4.590 -12.529 2.642
150 H ASP 19 H ASP 19 3.681 -11.166 3.585
151 HA ASP 19 HA ASP 19 0.935 -11.155 3.114
152 HB2 ASP 19 2HB ASP 19 2.525 -12.353 5.387
153 HB3 ASP 19 3HB ASP 19 0.812 -12.667 5.125
154 H ALA 20 H ALA 20 2.287 -10.613 6.356
155 HA ALA 20 HA ALA 20 0.737 -8.181 6.673
156 HB1 ALA 20 1HB ALA 20 0.208 -10.574 8.430
157 HB2 ALA 20 2HB ALA 20 -0.486 -8.965 8.626
158 HB3 ALA 20 3HB ALA 20 -0.889 -9.931 7.207
159 H GLY 21 H GLY 21 3.577 -9.129 6.759
160 HA2 GLY 21 2HA GLY 21 4.948 -7.542 8.251
161 HA3 GLY 21 3HA GLY 21 4.237 -8.481 9.555
162 H LYS 22 H LYS 22 4.520 -10.725 7.298
163 HA LYS 22 HA LYS 22 6.589 -12.134 8.468
164 HB2 LYS 22 2HB LYS 22 5.330 -12.255 5.746
165 HB3 LYS 22 3HB LYS 22 6.691 -13.298 6.140
166 HG2 LYS 22 2HG LYS 22 4.289 -13.202 7.918
167 HG3 LYS 22 3HG LYS 22 4.290 -14.185 6.452
168 HD2 LYS 22 2HD LYS 22 6.534 -14.392 8.426
169 HD3 LYS 22 3HD LYS 22 5.020 -15.258 8.696
170 HE2 LYS 22 2HE LYS 22 6.288 -15.488 6.021
171 HE3 LYS 22 3HE LYS 22 7.057 -16.331 7.366
172 HZ1 LYS 22 3HZ LYS 22 4.163 -16.628 6.964
173 HZ2 LYS 22 1HZ LYS 22 5.270 -17.711 7.644
174 HZ3 LYS 22 2HZ LYS 22 5.220 -17.494 5.968
175 H ASP 23 H ASP 23 8.546 -11.232 8.773
176 HA ASP 23 HA ASP 23 9.840 -9.443 7.058
177 HB2 ASP 23 2HB ASP 23 11.935 -10.195 8.319
178 HB3 ASP 23 3HB ASP 23 10.619 -9.534 9.286
179 H THR 24 H THR 24 9.970 -10.047 4.946
180 HA THR 24 HA THR 24 11.350 -12.573 4.334
181 HB THR 24 HB THR 24 9.621 -10.861 2.537
182 HG1 THR 24 HG1 THR 24 9.182 -13.276 3.960
183 HG21 THR 24 3HG2 THR 24 9.782 -12.816 0.993
184 HG22 THR 24 1HG2 THR 24 11.027 -13.487 2.045
185 HG23 THR 24 2HG2 THR 24 11.305 -11.956 1.215
186 H PHE 25 H PHE 25 13.430 -12.391 3.855
187 HA PHE 25 HA PHE 25 14.544 -9.842 3.047
188 HB2 PHE 25 2HB PHE 25 15.784 -12.522 3.677
189 HB3 PHE 25 3HB PHE 25 16.723 -11.138 3.126
190 HD1 PHE 25 HD1 PHE 25 17.735 -9.860 4.732
191 HD2 PHE 25 HD2 PHE 25 14.149 -11.934 5.711
192 HE1 PHE 25 HE1 PHE 25 17.904 -9.051 7.050
193 HE2 PHE 25 HE2 PHE 25 14.312 -11.128 8.029
194 HZ PHE 25 HZ PHE 25 16.190 -9.684 8.702
195 H ILE 26 H ILE 26 15.470 -9.365 1.092
196 HA ILE 26 HA ILE 26 15.536 -11.411 -0.987
197 HB ILE 26 HB ILE 26 13.317 -10.440 -1.236
198 HG12 ILE 26 2HG1 ILE 26 13.486 -9.731 -3.574
199 HG13 ILE 26 3HG1 ILE 26 15.209 -9.433 -3.373
200 HG21 ILE 26 1HG2 ILE 26 13.997 -7.804 -2.118
201 HG22 ILE 26 2HG2 ILE 26 12.894 -8.299 -0.835
202 HG23 ILE 26 3HG2 ILE 26 14.604 -8.056 -0.482
203 HD11 ILE 26 3HD1 ILE 26 14.026 -12.141 -2.897
204 HD12 ILE 26 1HD1 ILE 26 14.488 -11.597 -4.510
205 HD13 ILE 26 2HD1 ILE 26 15.701 -11.705 -3.234
206 H LYS 27 H LYS 27 17.359 -11.258 -2.109
207 HA LYS 27 HA LYS 27 19.343 -9.381 -1.625
208 HB2 LYS 27 2HB LYS 27 20.486 -10.284 -3.563
209 HB3 LYS 27 3HB LYS 27 19.725 -11.591 -2.666
210 HG2 LYS 27 2HG LYS 27 18.603 -12.228 -4.461
211 HG3 LYS 27 3HG LYS 27 17.912 -10.615 -4.652
212 HD2 LYS 27 2HD LYS 27 19.525 -9.954 -6.147
213 HD3 LYS 27 3HD LYS 27 20.730 -11.075 -5.507
214 HE2 LYS 27 2HE LYS 27 19.224 -12.925 -6.440
215 HE3 LYS 27 3HE LYS 27 18.425 -11.642 -7.348
216 HZ1 LYS 27 3HZ LYS 27 20.751 -11.058 -8.148
217 HZ2 LYS 27 1HZ LYS 27 20.050 -12.463 -8.779
218 HZ3 LYS 27 2HZ LYS 27 21.220 -12.575 -7.564
219 H CYS 28 H CYS 28 20.372 -8.140 -3.625
220 HA CYS 28 HA CYS 28 18.248 -6.378 -4.654
221 HB2 CYS 28 2HB CYS 28 19.921 -5.375 -3.066
222 HB3 CYS 28 3HB CYS 28 21.167 -5.691 -4.269
223 HA PRO 29 HA PRO 29 19.999 -8.512 -8.363
224 HB2 PRO 29 2HB PRO 29 17.602 -8.787 -9.609
225 HB3 PRO 29 3HB PRO 29 18.211 -9.954 -8.429
226 HG2 PRO 29 2HG PRO 29 16.239 -7.734 -8.053
227 HG3 PRO 29 3HG PRO 29 16.183 -9.396 -7.437
228 HD2 PRO 29 2HD PRO 29 16.952 -7.300 -5.905
229 HD3 PRO 29 3HD PRO 29 17.618 -8.932 -5.694
230 H LYS 30 H LYS 30 18.049 -5.710 -7.800
231 HA LYS 30 HA LYS 30 17.705 -4.644 -10.319
232 HB2 LYS 30 2HB LYS 30 17.541 -3.715 -7.649
233 HB3 LYS 30 3HB LYS 30 18.509 -2.545 -8.536
234 HG2 LYS 30 2HG LYS 30 16.747 -2.236 -10.146
235 HG3 LYS 30 3HG LYS 30 15.790 -3.514 -9.394
236 HD2 LYS 30 2HD LYS 30 15.044 -2.155 -7.771
237 HD3 LYS 30 3HD LYS 30 16.628 -1.411 -7.540
238 HE2 LYS 30 2HE LYS 30 15.377 0.361 -8.331
239 HE3 LYS 30 3HE LYS 30 16.118 -0.250 -9.809
240 HZ1 LYS 30 3HZ LYS 30 13.967 -1.639 -9.969
241 HZ2 LYS 30 1HZ LYS 30 13.923 -0.005 -10.408
242 HZ3 LYS 30 2HZ LYS 30 13.329 -0.493 -8.901
243 H PHE 31 H PHE 31 20.414 -3.829 -8.140
244 HA PHE 31 HA PHE 31 22.074 -3.406 -10.537
245 HB2 PHE 31 2HB PHE 31 22.957 -1.965 -8.154
246 HB3 PHE 31 3HB PHE 31 22.736 -1.384 -9.802
247 HD1 PHE 31 HD1 PHE 31 21.011 -2.051 -6.609
248 HD2 PHE 31 HD2 PHE 31 20.806 -0.179 -10.426
249 HE1 PHE 31 HE1 PHE 31 18.989 -0.840 -5.903
250 HE2 PHE 31 HE2 PHE 31 18.784 1.035 -9.726
251 HZ PHE 31 HZ PHE 31 17.873 0.706 -7.462
252 H ASP 32 H ASP 32 23.325 -5.169 -10.650
253 HA ASP 32 HA ASP 32 24.223 -6.622 -8.371
254 HB2 ASP 32 2HB ASP 32 24.180 -6.999 -11.183
255 HB3 ASP 32 3HB ASP 32 25.854 -7.169 -10.661
256 H ASN 33 H ASN 33 25.241 -3.739 -9.733
257 HA ASN 33 HA ASN 33 27.971 -4.063 -8.679
258 HB2 ASN 33 2HB ASN 33 27.009 -2.962 -11.122
259 HB3 ASN 33 3HB ASN 33 27.708 -1.648 -10.180
260 HD21 ASN 33 2HD2 ASN 33 30.911 -3.455 -9.995
261 HD22 ASN 33 1HD2 ASN 33 29.739 -2.873 -8.867
262 H LYS 34 H LYS 34 24.983 -2.432 -8.288
263 HA LYS 34 HA LYS 34 26.206 -0.640 -6.292
264 HB2 LYS 34 2HB LYS 34 23.579 -0.125 -7.675
265 HB3 LYS 34 3HB LYS 34 24.552 1.002 -6.739
266 HG2 LYS 34 2HG LYS 34 25.372 -0.188 -9.381
267 HG3 LYS 34 3HG LYS 34 24.646 1.407 -9.170
268 HD2 LYS 34 2HD LYS 34 26.773 1.315 -7.358
269 HD3 LYS 34 3HD LYS 34 27.390 0.579 -8.839
270 HE2 LYS 34 2HE LYS 34 27.740 2.664 -9.556
271 HE3 LYS 34 3HE LYS 34 25.991 2.770 -9.754
272 HZ1 LYS 34 3HZ LYS 34 26.406 3.307 -7.111
273 HZ2 LYS 34 1HZ LYS 34 26.090 4.446 -8.321
274 HZ3 LYS 34 2HZ LYS 34 27.686 4.102 -7.880
275 H LYS 35 H LYS 35 25.104 -3.440 -6.110
276 HA LYS 35 HA LYS 35 22.642 -3.483 -4.798
277 HB2 LYS 35 2HB LYS 35 23.289 -5.656 -3.955
278 HB3 LYS 35 3HB LYS 35 23.846 -5.491 -5.615
279 HG2 LYS 35 2HG LYS 35 26.013 -4.608 -4.230
280 HG3 LYS 35 3HG LYS 35 25.368 -5.838 -3.141
281 HD2 LYS 35 2HD LYS 35 25.895 -7.529 -4.537
282 HD3 LYS 35 3HD LYS 35 25.465 -6.607 -5.979
283 HE2 LYS 35 2HE LYS 35 27.557 -5.649 -6.150
284 HE3 LYS 35 3HE LYS 35 27.911 -5.866 -4.437
285 HZ1 LYS 35 3HZ LYS 35 28.864 -7.424 -6.410
286 HZ2 LYS 35 1HZ LYS 35 27.532 -8.328 -5.890
287 HZ3 LYS 35 2HZ LYS 35 28.741 -7.896 -4.790
288 H CYS 36 H CYS 36 22.678 -4.438 -2.369
289 HA CYS 36 HA CYS 36 22.992 -2.311 -0.664
290 HB2 CYS 36 2HB CYS 36 23.253 -5.229 0.091
291 HB3 CYS 36 3HB CYS 36 22.835 -3.908 1.178
292 H THR 37 H THR 37 24.572 -1.511 0.648
293 HA THR 37 HA THR 37 27.184 -2.844 0.660
294 HB THR 37 HB THR 37 28.373 -0.783 0.188
295 HG1 THR 37 HG1 THR 37 27.142 0.878 0.838
296 HG21 THR 37 3HG2 THR 37 27.109 -2.288 -1.663
297 HG22 THR 37 1HG2 THR 37 28.177 -0.943 -2.062
298 HG23 THR 37 2HG2 THR 37 26.430 -0.703 -2.033
299 H LYS 38 H LYS 38 24.866 -2.170 2.558
300 HA LYS 38 HA LYS 38 26.570 -1.464 4.795
301 HB2 LYS 38 2HB LYS 38 24.874 0.478 3.562
302 HB3 LYS 38 3HB LYS 38 24.221 0.099 5.151
303 HG2 LYS 38 2HG LYS 38 27.132 0.587 4.988
304 HG3 LYS 38 3HG LYS 38 26.068 1.975 4.749
305 HD2 LYS 38 2HD LYS 38 25.100 0.479 6.966
306 HD3 LYS 38 3HD LYS 38 26.834 0.730 7.183
307 HE2 LYS 38 2HE LYS 38 26.604 3.079 7.057
308 HE3 LYS 38 3HE LYS 38 24.955 2.960 6.444
309 HZ1 LYS 38 3HZ LYS 38 24.639 1.727 8.741
310 HZ2 LYS 38 1HZ LYS 38 24.514 3.408 8.605
311 HZ3 LYS 38 2HZ LYS 38 25.944 2.710 9.179
312 H ASP 39 H ASP 39 25.521 -1.828 6.873
313 HA ASP 39 HA ASP 39 23.555 -3.986 6.675
314 HB2 ASP 39 2HB ASP 39 25.866 -3.800 8.127
315 HB3 ASP 39 3HB ASP 39 24.658 -3.347 9.326
316 H ASN 40 H ASN 40 21.496 -3.713 7.227
317 HA ASN 40 HA ASN 40 19.577 -2.811 8.048
318 HB2 ASN 40 2HB ASN 40 21.304 -1.348 10.049
319 HB3 ASN 40 3HB ASN 40 19.607 -1.791 10.215
320 HD21 ASN 40 2HD2 ASN 40 22.110 -4.147 11.907
321 HD22 ASN 40 1HD2 ASN 40 22.153 -2.429 11.727
322 H ASN 41 H ASN 41 20.957 -1.499 5.913
323 HA ASN 41 HA ASN 41 20.885 1.332 6.329
324 HB2 ASN 41 2HB ASN 41 21.373 1.517 3.974
325 HB3 ASN 41 3HB ASN 41 22.346 0.208 4.640
326 HD21 ASN 41 2HD2 ASN 41 21.220 -2.050 2.309
327 HD22 ASN 41 1HD2 ASN 41 22.453 -1.489 3.381
328 H LYS 42 H LYS 42 19.615 2.332 4.112
329 HA LYS 42 HA LYS 42 16.801 1.812 4.774
330 HB2 LYS 42 2HB LYS 42 17.847 4.185 3.242
331 HB3 LYS 42 3HB LYS 42 16.309 4.023 4.080
332 HG2 LYS 42 2HG LYS 42 18.067 3.657 6.118
333 HG3 LYS 42 3HG LYS 42 18.941 4.802 5.098
334 HD2 LYS 42 2HD LYS 42 16.070 5.348 5.606
335 HD3 LYS 42 3HD LYS 42 17.189 5.578 6.953
336 HE2 LYS 42 2HE LYS 42 18.101 6.706 4.404
337 HE3 LYS 42 3HE LYS 42 16.630 7.440 5.040
338 HZ1 LYS 42 3HZ LYS 42 18.085 8.681 6.189
339 HZ2 LYS 42 1HZ LYS 42 19.342 7.557 6.053
340 HZ3 LYS 42 2HZ LYS 42 18.147 7.350 7.231
341 H CYS 43 H CYS 43 15.933 0.362 3.432
342 HA CYS 43 HA CYS 43 16.357 0.740 0.542
343 HB2 CYS 43 2HB CYS 43 16.369 -1.623 0.188
344 HB3 CYS 43 3HB CYS 43 17.519 -1.291 1.479
345 H THR 44 H THR 44 14.557 -1.020 -0.458
346 HA THR 44 HA THR 44 12.005 -0.879 0.812
347 HB THR 44 HB THR 44 11.363 0.497 -1.535
348 HG1 THR 44 HG1 THR 44 13.306 2.039 -0.180
349 HG21 THR 44 3HG2 THR 44 10.142 0.757 0.507
350 HG22 THR 44 1HG2 THR 44 10.781 2.340 0.066
351 HG23 THR 44 2HG2 THR 44 11.559 1.398 1.338
352 H VAL 45 H VAL 45 10.809 -2.521 0.087
353 HA VAL 45 HA VAL 45 11.615 -3.810 -2.429
354 HB VAL 45 HB VAL 45 10.050 -4.938 -0.103
355 HG11 VAL 45 1HG1 VAL 45 9.256 -6.316 -1.695
356 HG12 VAL 45 2HG1 VAL 45 10.533 -5.899 -2.840
357 HG13 VAL 45 3HG1 VAL 45 10.842 -7.076 -1.563
358 HG21 VAL 45 3HG2 VAL 45 11.976 -5.652 0.773
359 HG22 VAL 45 1HG2 VAL 45 12.571 -6.207 -0.792
360 HG23 VAL 45 2HG2 VAL 45 12.772 -4.520 -0.320
361 H ASP 46 H ASP 46 10.278 -3.861 -4.120
362 HA ASP 46 HA ASP 46 7.532 -2.878 -3.732
363 HB2 ASP 46 2HB ASP 46 9.576 -2.245 -5.650
364 HB3 ASP 46 3HB ASP 46 8.171 -2.902 -6.486
365 H THR 47 H THR 47 5.963 -4.325 -3.866
366 HA THR 47 HA THR 47 6.496 -6.920 -5.090
367 HB THR 47 HB THR 47 5.481 -6.866 -2.840
368 HG1 THR 47 HG1 THR 47 3.565 -7.852 -4.690
369 HG21 THR 47 3HG2 THR 47 3.322 -6.015 -2.419
370 HG22 THR 47 1HG2 THR 47 2.978 -5.811 -4.136
371 HG23 THR 47 2HG2 THR 47 4.143 -4.753 -3.338
372 H TYR 48 H TYR 48 6.270 -4.777 -6.896
373 HA TYR 48 HA TYR 48 3.716 -5.414 -8.224
374 HB2 TYR 48 2HB TYR 48 3.956 -3.036 -7.404
375 HB3 TYR 48 3HB TYR 48 5.271 -2.845 -8.559
376 HD1 TYR 48 HD1 TYR 48 1.644 -3.325 -8.183
377 HD2 TYR 48 HD2 TYR 48 4.832 -2.639 -10.916
378 HE1 TYR 48 HE1 TYR 48 0.013 -2.750 -9.932
379 HE2 TYR 48 HE2 TYR 48 3.210 -2.062 -12.672
380 HH TYR 48 HH TYR 48 -0.086 -2.717 -12.416
381 H ASN 49 H ASN 49 7.164 -4.894 -8.566
382 HA ASN 49 HA ASN 49 7.099 -6.356 -11.091
383 HB2 ASN 49 2HB ASN 49 8.880 -4.623 -11.913
384 HB3 ASN 49 3HB ASN 49 7.165 -4.250 -12.064
385 HD21 ASN 49 2HD2 ASN 49 9.546 -2.166 -9.508
386 HD22 ASN 49 1HD2 ASN 49 10.072 -3.650 -10.218
387 H ASN 50 H ASN 50 8.086 -6.531 -8.170
388 HA ASN 50 HA ASN 50 9.869 -7.364 -7.021
389 HB2 ASN 50 2HB ASN 50 9.313 -9.119 -8.912
390 HB3 ASN 50 3HB ASN 50 10.889 -8.633 -9.529
391 HD21 ASN 50 2HD2 ASN 50 12.669 -10.539 -7.278
392 HD22 ASN 50 1HD2 ASN 50 12.632 -9.563 -8.703
393 H ALA 51 H ALA 51 10.909 -5.371 -6.664
394 HA ALA 51 HA ALA 51 13.563 -5.233 -7.725
395 HB1 ALA 51 1HB ALA 51 11.996 -4.090 -9.445
396 HB2 ALA 51 2HB ALA 51 11.955 -2.772 -8.274
397 HB3 ALA 51 3HB ALA 51 13.491 -3.284 -8.970
398 H VAL 52 H VAL 52 14.685 -4.856 -5.938
399 HA VAL 52 HA VAL 52 13.517 -3.292 -3.773
400 HB VAL 52 HB VAL 52 14.795 -5.536 -3.504
401 HG11 VAL 52 1HG1 VAL 52 16.767 -4.743 -4.813
402 HG12 VAL 52 2HG1 VAL 52 17.140 -3.642 -3.485
403 HG13 VAL 52 3HG1 VAL 52 17.166 -5.386 -3.221
404 HG21 VAL 52 3HG2 VAL 52 14.398 -4.879 -1.412
405 HG22 VAL 52 1HG2 VAL 52 16.001 -4.142 -1.423
406 HG23 VAL 52 2HG2 VAL 52 14.584 -3.178 -1.841
407 H ASP 53 H ASP 53 14.377 -1.408 -2.962
408 HA ASP 53 HA ASP 53 16.233 -0.012 -4.751
409 HB2 ASP 53 2HB ASP 53 14.090 0.871 -2.865
410 HB3 ASP 53 3HB ASP 53 15.421 1.973 -3.204
411 H CYS 54 H CYS 54 17.673 -1.725 -3.416
412 HA CYS 54 HA CYS 54 18.495 -1.236 -0.828
413 HB2 CYS 54 2HB CYS 54 20.722 -2.181 -1.582
414 HB3 CYS 54 3HB CYS 54 19.314 -3.178 -1.932
415 H ASP 55 H ASP 55 19.935 0.116 0.161
416 HA ASP 55 HA ASP 55 20.287 2.694 -0.831
417 HB2 ASP 55 2HB ASP 55 20.479 1.824 1.590
418 HB3 ASP 55 3HB ASP 55 22.157 1.470 1.185