Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
25849 | 2kcn RC | 16087 | 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 -15.920 2.287 1.675
2 HA ALA 1 HA ALA 1 -16.007 2.586 -1.258
3 HB1 ALA 1 1HB ALA 1 -15.339 4.689 -1.039
4 HB2 ALA 1 2HB ALA 1 -15.489 4.524 0.711
5 HB3 ALA 1 3HB ALA 1 -13.948 4.187 -0.078
6 H LYS 2 H LYS 2 -13.429 2.985 -1.869
7 HA LYS 2 HA LYS 2 -11.668 1.120 -0.593
8 HB2 LYS 2 1HB LYS 2 -13.182 0.342 -3.025
9 HB3 LYS 2 2HB LYS 2 -11.473 -0.073 -2.990
10 HG2 LYS 2 1HG LYS 2 -11.949 -1.854 -1.775
11 HG3 LYS 2 2HG LYS 2 -12.553 -0.806 -0.489
12 HD2 LYS 2 1HD LYS 2 -14.389 -2.142 -0.925
13 HD3 LYS 2 2HD LYS 2 -14.717 -0.730 -1.932
14 HE2 LYS 2 1HE LYS 2 -13.138 -2.872 -3.199
15 HE3 LYS 2 2HE LYS 2 -14.811 -3.278 -2.820
16 HZ1 LYS 2 3HZ LYS 2 -13.887 -0.981 -4.459
17 HZ2 LYS 2 1HZ LYS 2 -15.499 -1.281 -4.040
18 HZ3 LYS 2 2HZ LYS 2 -14.665 -2.371 -5.028
19 H TYR 3 H TYR 3 -9.584 0.908 -1.862
20 HA TYR 3 HA TYR 3 -9.091 3.114 -3.705
21 HB2 TYR 3 1HB TYR 3 -7.304 2.754 -1.304
22 HB3 TYR 3 2HB TYR 3 -7.339 4.094 -2.445
23 HD1 TYR 3 1HD TYR 3 -9.134 5.775 -2.330
24 HD2 TYR 3 2HD TYR 3 -8.831 2.656 0.546
25 HE1 TYR 3 1HE TYR 3 -10.651 7.011 -0.839
26 HE2 TYR 3 2HE TYR 3 -10.348 3.882 2.045
27 HH TYR 3 HH TYR 3 -10.967 6.461 2.326
28 H THR 4 H THR 4 -7.085 2.924 -4.858
29 HA THR 4 HA THR 4 -5.788 0.294 -4.670
30 HB THR 4 HB THR 4 -6.370 1.496 -7.360
31 HG1 THR 4 1HG THR 4 -8.060 -0.217 -5.833
32 HG21 THR 4 3HG2 THR 4 -6.452 -1.352 -7.244
33 HG22 THR 4 1HG2 THR 4 -5.006 -0.798 -6.402
34 HG23 THR 4 2HG2 THR 4 -5.292 -0.317 -8.074
35 H GLY 5 H GLY 5 -3.621 0.237 -5.239
36 HA2 GLY 5 1HA GLY 5 -2.299 2.463 -6.465
37 HA3 GLY 5 2HA GLY 5 -2.030 2.413 -4.729
38 H LYS 6 H LYS 6 0.206 2.085 -5.102
39 HA LYS 6 HA LYS 6 0.858 -0.722 -5.569
40 HB2 LYS 6 1HB LYS 6 2.296 1.540 -6.968
41 HB3 LYS 6 2HB LYS 6 2.729 -0.162 -7.048
42 HG2 LYS 6 1HG LYS 6 1.572 0.043 -8.996
43 HG3 LYS 6 2HG LYS 6 0.254 -0.405 -7.912
44 HD2 LYS 6 1HD LYS 6 -0.799 1.489 -8.407
45 HD3 LYS 6 2HD LYS 6 0.573 2.417 -7.797
46 HE2 LYS 6 1HE LYS 6 1.654 2.212 -10.003
47 HE3 LYS 6 2HE LYS 6 0.238 1.348 -10.599
48 HZ1 LYS 6 3HZ LYS 6 0.577 4.187 -10.025
49 HZ2 LYS 6 1HZ LYS 6 -0.934 3.514 -9.670
50 HZ3 LYS 6 2HZ LYS 6 -0.318 3.428 -11.243
51 H CYS 7 H CYS 7 3.256 -1.102 -5.043
52 HA CYS 7 HA CYS 7 3.924 0.487 -2.655
53 HB2 CYS 7 1HB CYS 7 4.188 -2.426 -3.291
54 HB3 CYS 7 2HB CYS 7 5.317 -1.692 -2.159
55 HG CYS 7 HG CYS 7 3.777 -2.134 -0.161
56 H THR 8 H THR 8 6.339 0.360 -2.112
57 HA THR 8 HA THR 8 7.892 0.741 -4.590
58 HB THR 8 HB THR 8 9.154 2.148 -2.483
59 HG1 THR 8 1HG THR 8 7.515 3.501 -1.768
60 HG21 THR 8 3HG2 THR 8 9.269 3.779 -4.045
61 HG22 THR 8 1HG2 THR 8 7.553 3.674 -4.435
62 HG23 THR 8 2HG2 THR 8 8.686 2.509 -5.121
63 H LYS 9 H LYS 9 9.734 -0.376 -4.797
64 HA LYS 9 HA LYS 9 10.381 -2.536 -3.202
65 HB2 LYS 9 1HB LYS 9 12.680 -2.348 -4.303
66 HB3 LYS 9 2HB LYS 9 11.293 -2.507 -5.372
67 HG2 LYS 9 1HG LYS 9 11.772 -0.596 -6.383
68 HG3 LYS 9 2HG LYS 9 11.837 0.266 -4.844
69 HD2 LYS 9 1HD LYS 9 13.979 0.532 -5.758
70 HD3 LYS 9 2HD LYS 9 14.163 -0.762 -4.572
71 HE2 LYS 9 1HE LYS 9 14.775 -2.225 -6.139
72 HE3 LYS 9 2HE LYS 9 13.417 -1.787 -7.175
73 HZ1 LYS 9 3HZ LYS 9 14.642 -0.195 -8.262
74 HZ2 LYS 9 1HZ LYS 9 15.824 -1.371 -7.977
75 HZ3 LYS 9 2HZ LYS 9 15.744 0.003 -6.993
76 H SER 10 H SER 10 11.433 0.801 -2.949
77 HA SER 10 HA SER 10 13.374 0.221 -0.889
78 HB2 SER 10 1HB SER 10 13.590 2.712 -0.775
79 HB3 SER 10 2HB SER 10 13.849 2.056 -2.391
80 HG SER 10 HG SER 10 12.241 3.959 -1.819
81 H LYS 11 H LYS 11 10.036 1.110 -1.088
82 HA LYS 11 HA LYS 11 9.834 0.946 1.818
83 HB2 LYS 11 1HB LYS 11 9.918 3.415 0.663
84 HB3 LYS 11 2HB LYS 11 8.189 3.096 0.654
85 HG2 LYS 11 1HG LYS 11 8.125 3.788 2.755
86 HG3 LYS 11 2HG LYS 11 9.055 2.355 3.201
87 HD2 LYS 11 1HD LYS 11 11.132 3.670 2.666
88 HD3 LYS 11 2HD LYS 11 10.103 5.096 2.513
89 HE2 LYS 11 1HE LYS 11 9.818 3.477 4.978
90 HE3 LYS 11 2HE LYS 11 11.304 4.409 4.800
91 HZ1 LYS 11 3HZ LYS 11 9.509 5.615 5.960
92 HZ2 LYS 11 1HZ LYS 11 8.577 5.555 4.550
93 HZ3 LYS 11 2HZ LYS 11 10.038 6.406 4.562
94 H ASN 12 H ASN 12 8.450 -0.671 2.103
95 HA ASN 12 HA ASN 12 6.426 -1.301 0.153
96 HB2 ASN 12 1HB ASN 12 7.541 -3.132 1.269
97 HB3 ASN 12 2HB ASN 12 7.082 -2.505 2.849
98 HD21 ASN 12 2HD2 ASN 12 5.761 -3.987 3.655
99 HD22 ASN 12 1HD2 ASN 12 4.348 -4.601 2.873
100 H GLU 13 H GLU 13 5.366 0.839 0.375
101 HA GLU 13 HA GLU 13 3.289 0.699 2.444
102 HB2 GLU 13 1HB GLU 13 3.460 3.001 2.984
103 HB3 GLU 13 2HB GLU 13 5.097 2.363 3.048
104 HG2 GLU 13 1HG GLU 13 5.290 3.200 0.624
105 HG3 GLU 13 2HG GLU 13 3.856 4.153 0.999
106 H CYS 14 H CYS 14 1.296 1.680 1.880
107 HA CYS 14 HA CYS 14 0.807 1.667 -0.982
108 HB2 CYS 14 1HB CYS 14 -0.688 0.485 0.659
109 HB3 CYS 14 2HB CYS 14 -1.186 2.063 1.256
110 HG CYS 14 HG CYS 14 -3.212 2.069 -0.320
111 H LYS 15 H LYS 15 1.330 3.510 -1.987
112 HA LYS 15 HA LYS 15 0.892 6.080 -0.708
113 HB2 LYS 15 1HB LYS 15 1.931 6.984 -2.796
114 HB3 LYS 15 2HB LYS 15 2.949 5.850 -1.919
115 HG2 LYS 15 1HG LYS 15 3.076 4.490 -3.665
116 HG3 LYS 15 2HG LYS 15 1.325 4.497 -3.885
117 HD2 LYS 15 1HD LYS 15 1.424 6.021 -5.532
118 HD3 LYS 15 2HD LYS 15 2.635 6.989 -4.686
119 HE2 LYS 15 1HE LYS 15 3.262 4.399 -6.090
120 HE3 LYS 15 2HE LYS 15 3.379 5.976 -6.869
121 HZ1 LYS 15 3HZ LYS 15 5.028 4.846 -4.714
122 HZ2 LYS 15 1HZ LYS 15 4.855 6.525 -4.830
123 HZ3 LYS 15 2HZ LYS 15 5.509 5.651 -6.122
124 H TYR 16 H TYR 16 -1.519 5.281 -0.787
125 HA TYR 16 HA TYR 16 -2.776 5.983 -3.333
126 HB2 TYR 16 1HB TYR 16 -4.756 4.961 -2.509
127 HB3 TYR 16 2HB TYR 16 -3.430 3.903 -2.038
128 HD1 TYR 16 2HD TYR 16 -2.558 4.072 0.350
129 HD2 TYR 16 1HD TYR 16 -6.227 5.830 -0.899
130 HE1 TYR 16 2HE TYR 16 -3.296 4.184 2.693
131 HE2 TYR 16 1HE TYR 16 -6.974 5.947 1.441
132 HH TYR 16 HH TYR 16 -4.889 4.832 4.094
133 H LYS 17 H LYS 17 -5.187 6.954 -2.572
134 HA LYS 17 HA LYS 17 -4.593 9.358 -0.984
135 HB2 LYS 17 1HB LYS 17 -5.867 10.717 -2.580
136 HB3 LYS 17 2HB LYS 17 -4.475 9.964 -3.348
137 HG2 LYS 17 1HG LYS 17 -6.273 8.110 -3.936
138 HG3 LYS 17 2HG LYS 17 -7.369 9.483 -3.765
139 HD2 LYS 17 1HD LYS 17 -5.266 10.483 -5.268
140 HD3 LYS 17 2HD LYS 17 -5.497 8.849 -5.893
141 HE2 LYS 17 1HE LYS 17 -7.617 9.294 -6.648
142 HE3 LYS 17 2HE LYS 17 -7.896 10.556 -5.449
143 HZ1 LYS 17 3HZ LYS 17 -6.041 11.766 -6.792
144 HZ2 LYS 17 1HZ LYS 17 -7.640 11.782 -7.344
145 HZ3 LYS 17 2HZ LYS 17 -6.518 10.722 -8.035
146 H ASN 18 H ASN 18 -6.121 9.921 0.456
147 HA ASN 18 HA ASN 18 -8.687 8.477 0.346
148 HB2 ASN 18 1HB ASN 18 -8.653 8.130 2.636
149 HB3 ASN 18 2HB ASN 18 -6.942 7.983 2.244
150 HD21 ASN 18 2HD2 ASN 18 -5.760 10.156 2.305
151 HD22 ASN 18 1HD2 ASN 18 -6.092 11.149 3.679
152 H ASP 19 H ASP 19 -10.435 9.615 1.642
153 HA ASP 19 HA ASP 19 -11.744 11.434 2.073
154 HB2 ASP 19 1HB ASP 19 -9.504 12.301 3.061
155 HB3 ASP 19 2HB ASP 19 -9.414 13.271 1.594
156 H ALA 20 H ALA 20 -9.379 12.734 -0.256
157 HA ALA 20 HA ALA 20 -11.049 12.480 -2.513
158 HB1 ALA 20 1HB ALA 20 -11.028 15.217 -1.245
159 HB2 ALA 20 2HB ALA 20 -11.666 14.836 -2.846
160 HB3 ALA 20 3HB ALA 20 -12.422 14.148 -1.409
161 H GLY 21 H GLY 21 -8.394 11.924 -2.055
162 HA2 GLY 21 1HA GLY 21 -6.670 12.144 -3.729
163 HA3 GLY 21 2HA GLY 21 -7.098 13.842 -3.879
164 H LYS 22 H LYS 22 -6.988 12.619 -0.686
165 HA LYS 22 HA LYS 22 -4.759 14.329 -0.055
166 HB2 LYS 22 1HB LYS 22 -6.962 13.339 1.342
167 HB3 LYS 22 2HB LYS 22 -5.580 12.546 2.086
168 HG2 LYS 22 1HG LYS 22 -5.825 15.521 1.693
169 HG3 LYS 22 2HG LYS 22 -6.233 14.666 3.183
170 HD2 LYS 22 1HD LYS 22 -3.849 13.748 3.101
171 HD3 LYS 22 2HD LYS 22 -3.541 14.988 1.883
172 HE2 LYS 22 1HE LYS 22 -4.480 16.644 3.585
173 HE3 LYS 22 2HE LYS 22 -4.322 15.343 4.764
174 HZ1 LYS 22 3HZ LYS 22 -2.186 16.724 3.260
175 HZ2 LYS 22 1HZ LYS 22 -1.923 15.215 3.979
176 HZ3 LYS 22 2HZ LYS 22 -2.349 16.544 4.933
177 H ASP 23 H ASP 23 -2.721 13.718 -0.296
178 HA ASP 23 HA ASP 23 -1.806 11.191 -0.923
179 HB2 ASP 23 1HB ASP 23 -0.580 13.704 0.005
180 HB3 ASP 23 2HB ASP 23 0.369 12.256 0.331
181 H THR 24 H THR 24 -1.591 9.361 0.174
182 HA THR 24 HA THR 24 -1.180 9.464 3.077
183 HB THR 24 HB THR 24 -3.242 7.728 1.706
184 HG1 THR 24 1HG THR 24 -3.575 9.734 3.702
185 HG21 THR 24 3HG2 THR 24 -3.775 6.953 3.992
186 HG22 THR 24 1HG2 THR 24 -2.378 7.841 4.597
187 HG23 THR 24 2HG2 THR 24 -2.151 6.491 3.485
188 H PHE 25 H PHE 25 0.301 8.056 3.803
189 HA PHE 25 HA PHE 25 1.100 5.837 2.045
190 HB2 PHE 25 1HB PHE 25 2.984 7.652 3.564
191 HB3 PHE 25 2HB PHE 25 3.454 6.251 2.606
192 HD1 PHE 25 2HD PHE 25 1.914 9.609 2.404
193 HD2 PHE 25 1HD PHE 25 3.799 6.427 0.297
194 HE1 PHE 25 2HE PHE 25 2.091 11.039 0.409
195 HE2 PHE 25 1HE PHE 25 3.981 7.852 -1.700
196 HZ PHE 25 HZ PHE 25 3.125 10.161 -1.646
197 H ILE 26 H ILE 26 0.652 4.019 3.089
198 HA ILE 26 HA ILE 26 1.336 3.844 5.948
199 HB ILE 26 HB ILE 26 -1.078 3.969 5.798
200 HG12 ILE 26 1HG1 ILE 26 -1.661 1.849 6.894
201 HG13 ILE 26 2HG1 ILE 26 -0.169 1.126 6.302
202 HG21 ILE 26 1HG2 ILE 26 -1.675 1.507 4.468
203 HG22 ILE 26 2HG2 ILE 26 -2.221 3.140 4.088
204 HG23 ILE 26 3HG2 ILE 26 -0.711 2.535 3.407
205 HD11 ILE 26 3HD1 ILE 26 0.035 1.750 8.630
206 HD12 ILE 26 1HD1 ILE 26 1.123 2.716 7.632
207 HD13 ILE 26 2HD1 ILE 26 -0.378 3.419 8.236
208 H LYS 27 H LYS 27 2.752 2.294 6.375
209 HA LYS 27 HA LYS 27 3.706 0.516 4.389
210 HB2 LYS 27 1HB LYS 27 4.120 0.472 7.384
211 HB3 LYS 27 2HB LYS 27 5.045 -0.467 6.220
212 HG2 LYS 27 1HG LYS 27 6.126 1.408 5.375
213 HG3 LYS 27 2HG LYS 27 4.917 2.516 6.028
214 HD2 LYS 27 1HD LYS 27 6.205 2.813 7.816
215 HD3 LYS 27 2HD LYS 27 5.996 1.107 8.219
216 HE2 LYS 27 1HE LYS 27 7.894 0.642 6.605
217 HE3 LYS 27 2HE LYS 27 8.180 2.381 6.587
218 HZ1 LYS 27 3HZ LYS 27 8.141 1.971 9.189
219 HZ2 LYS 27 1HZ LYS 27 9.555 1.813 8.272
220 HZ3 LYS 27 2HZ LYS 27 8.670 0.438 8.705
221 H CYS 28 H CYS 28 3.020 -1.435 3.799
222 HA CYS 28 HA CYS 28 0.677 -2.572 4.970
223 HB2 CYS 28 1HB CYS 28 2.534 -3.901 2.994
224 HB3 CYS 28 2HB CYS 28 0.829 -4.243 3.261
225 HG CYS 28 HG CYS 28 1.962 -1.265 2.018
226 HA PRO 29 HA PRO 29 2.376 -5.288 7.966
227 HB2 PRO 29 1HB PRO 29 0.637 -7.369 7.831
228 HB3 PRO 29 2HB PRO 29 0.214 -5.808 8.543
229 HG2 PRO 29 1HG PRO 29 -0.398 -6.872 5.812
230 HG3 PRO 29 2HG PRO 29 -1.450 -5.981 6.928
231 HD2 PRO 29 1HD PRO 29 -0.215 -4.796 4.830
232 HD3 PRO 29 2HD PRO 29 -0.546 -3.941 6.350
233 H LYS 30 H LYS 30 4.323 -5.664 6.649
234 HA LYS 30 HA LYS 30 4.516 -8.479 5.910
235 HB2 LYS 30 1HB LYS 30 5.269 -6.195 4.085
236 HB3 LYS 30 2HB LYS 30 5.841 -7.842 3.857
237 HG2 LYS 30 1HG LYS 30 2.917 -7.193 4.012
238 HG3 LYS 30 2HG LYS 30 3.821 -7.091 2.500
239 HD2 LYS 30 1HD LYS 30 3.822 -9.311 2.243
240 HD3 LYS 30 2HD LYS 30 4.314 -9.580 3.917
241 HE2 LYS 30 1HE LYS 30 1.582 -8.657 3.762
242 HE3 LYS 30 2HE LYS 30 1.820 -10.105 2.785
243 HZ1 LYS 30 3HZ LYS 30 2.128 -11.370 4.590
244 HZ2 LYS 30 1HZ LYS 30 1.340 -10.122 5.418
245 HZ3 LYS 30 2HZ LYS 30 3.030 -10.196 5.409
246 H PHE 31 H PHE 31 5.550 -8.118 8.120
247 HA PHE 31 HA PHE 31 8.134 -6.850 8.137
248 HB2 PHE 31 1HB PHE 31 6.445 -8.299 10.122
249 HB3 PHE 31 2HB PHE 31 8.175 -8.195 10.432
250 HD1 PHE 31 2HD PHE 31 5.112 -6.209 9.885
251 HD2 PHE 31 1HD PHE 31 9.163 -6.195 11.193
252 HE1 PHE 31 2HE PHE 31 4.806 -3.946 10.798
253 HE2 PHE 31 1HE PHE 31 8.862 -3.932 12.109
254 HZ PHE 31 HZ PHE 31 6.682 -2.803 11.912
255 H ASP 32 H ASP 32 9.743 -7.771 7.040
256 HA ASP 32 HA ASP 32 11.173 -9.330 6.191
257 HB2 ASP 32 1HB ASP 32 10.653 -10.932 8.689
258 HB3 ASP 32 2HB ASP 32 12.148 -10.792 7.767
259 H ASN 33 H ASN 33 8.373 -9.637 5.515
260 HA ASN 33 HA ASN 33 8.347 -12.532 4.978
261 HB2 ASN 33 1HB ASN 33 6.333 -10.880 6.255
262 HB3 ASN 33 2HB ASN 33 5.692 -11.671 4.818
263 HD21 ASN 33 2HD2 ASN 33 5.980 -11.978 8.026
264 HD22 ASN 33 1HD2 ASN 33 5.957 -13.699 8.178
265 H LYS 34 H LYS 34 7.519 -9.301 3.856
266 HA LYS 34 HA LYS 34 8.205 -9.795 1.194
267 HB2 LYS 34 1HB LYS 34 5.494 -10.583 1.921
268 HB3 LYS 34 2HB LYS 34 5.517 -9.389 0.629
269 HG2 LYS 34 1HG LYS 34 7.457 -11.154 -0.162
270 HG3 LYS 34 2HG LYS 34 6.258 -12.206 0.593
271 HD2 LYS 34 1HD LYS 34 4.523 -10.996 -0.809
272 HD3 LYS 34 2HD LYS 34 5.877 -10.294 -1.699
273 HE2 LYS 34 1HE LYS 34 6.675 -12.570 -2.217
274 HE3 LYS 34 2HE LYS 34 5.267 -13.232 -1.387
275 HZ1 LYS 34 3HZ LYS 34 4.047 -12.942 -3.198
276 HZ2 LYS 34 1HZ LYS 34 5.443 -12.490 -4.039
277 HZ3 LYS 34 2HZ LYS 34 4.474 -11.309 -3.311
278 H LYS 35 H LYS 35 9.137 -7.770 2.155
279 HA LYS 35 HA LYS 35 7.372 -5.486 2.318
280 HB2 LYS 35 1HB LYS 35 10.393 -5.538 2.359
281 HB3 LYS 35 2HB LYS 35 9.354 -4.221 2.885
282 HG2 LYS 35 1HG LYS 35 8.623 -5.420 4.778
283 HG3 LYS 35 2HG LYS 35 9.291 -6.936 4.168
284 HD2 LYS 35 1HD LYS 35 10.839 -6.271 5.776
285 HD3 LYS 35 2HD LYS 35 11.562 -5.720 4.262
286 HE2 LYS 35 1HE LYS 35 11.792 -3.793 5.426
287 HE3 LYS 35 2HE LYS 35 10.133 -3.542 4.884
288 HZ1 LYS 35 3HZ LYS 35 9.989 -3.134 7.128
289 HZ2 LYS 35 1HZ LYS 35 11.113 -4.328 7.545
290 HZ3 LYS 35 2HZ LYS 35 9.551 -4.767 7.067
291 H CYS 36 H CYS 36 6.924 -6.394 -0.109
292 HA CYS 36 HA CYS 36 6.836 -5.795 -2.300
293 HB2 CYS 36 1HB CYS 36 6.717 -3.492 -1.274
294 HB3 CYS 36 2HB CYS 36 8.455 -3.367 -1.519
295 HG CYS 36 HG CYS 36 6.806 -4.218 -4.293
296 H THR 37 H THR 37 8.080 -5.818 -4.238
297 HA THR 37 HA THR 37 10.964 -5.983 -4.059
298 HB THR 37 HB THR 37 10.906 -8.264 -5.258
299 HG1 THR 37 1HG THR 37 9.062 -9.329 -5.247
300 HG21 THR 37 3HG2 THR 37 10.077 -8.378 -2.371
301 HG22 THR 37 1HG2 THR 37 11.641 -7.727 -2.859
302 HG23 THR 37 2HG2 THR 37 11.229 -9.402 -3.230
303 H LYS 38 H LYS 38 9.236 -4.222 -5.419
304 HA LYS 38 HA LYS 38 10.379 -4.148 -7.954
305 HB2 LYS 38 1HB LYS 38 8.384 -6.079 -7.868
306 HB3 LYS 38 2HB LYS 38 7.587 -4.686 -8.587
307 HG2 LYS 38 1HG LYS 38 8.807 -4.792 -10.485
308 HG3 LYS 38 2HG LYS 38 10.253 -5.373 -9.654
309 HD2 LYS 38 1HD LYS 38 9.707 -7.534 -9.960
310 HD3 LYS 38 2HD LYS 38 7.996 -7.249 -9.636
311 HE2 LYS 38 1HE LYS 38 8.335 -7.989 -11.932
312 HE3 LYS 38 2HE LYS 38 7.723 -6.336 -11.889
313 HZ1 LYS 38 3HZ LYS 38 10.597 -6.517 -11.906
314 HZ2 LYS 38 1HZ LYS 38 9.568 -5.555 -12.843
315 HZ3 LYS 38 2HZ LYS 38 9.872 -7.156 -13.295
316 H ASP 39 H ASP 39 10.208 -2.117 -8.676
317 HA ASP 39 HA ASP 39 8.986 -0.093 -7.252
318 HB2 ASP 39 1HB ASP 39 9.474 0.019 -10.231
319 HB3 ASP 39 2HB ASP 39 9.486 1.358 -9.086
320 H ASN 40 H ASN 40 6.934 0.428 -6.940
321 HA ASN 40 HA ASN 40 4.666 0.494 -7.147
322 HB2 ASN 40 1HB ASN 40 4.868 0.649 -10.115
323 HB3 ASN 40 2HB ASN 40 3.925 1.634 -9.000
324 HD21 ASN 40 2HD2 ASN 40 4.715 3.536 -8.340
325 HD22 ASN 40 1HD2 ASN 40 6.277 4.151 -8.753
326 H ASN 41 H ASN 41 5.346 -2.025 -6.776
327 HA ASN 41 HA ASN 41 4.738 -3.877 -8.792
328 HB2 ASN 41 1HB ASN 41 5.436 -3.955 -6.042
329 HB3 ASN 41 2HB ASN 41 3.982 -4.928 -6.236
330 HD21 ASN 41 2HD2 ASN 41 6.383 -6.039 -5.491
331 HD22 ASN 41 1HD2 ASN 41 6.965 -7.051 -6.765
332 H LYS 42 H LYS 42 2.701 -3.454 -5.916
333 HA LYS 42 HA LYS 42 0.354 -2.677 -7.217
334 HB2 LYS 42 1HB LYS 42 0.329 -4.762 -8.370
335 HB3 LYS 42 2HB LYS 42 0.712 -5.656 -6.904
336 HG2 LYS 42 1HG LYS 42 -1.426 -5.681 -6.197
337 HG3 LYS 42 2HG LYS 42 -1.771 -4.071 -6.832
338 HD2 LYS 42 1HD LYS 42 -2.272 -4.865 -8.942
339 HD3 LYS 42 2HD LYS 42 -1.315 -6.334 -8.728
340 HE2 LYS 42 1HE LYS 42 -2.964 -7.327 -7.365
341 HE3 LYS 42 2HE LYS 42 -3.812 -5.797 -7.144
342 HZ1 LYS 42 3HZ LYS 42 -3.879 -6.090 -9.810
343 HZ2 LYS 42 1HZ LYS 42 -5.120 -6.574 -8.766
344 HZ3 LYS 42 2HZ LYS 42 -3.981 -7.701 -9.307
345 H CYS 43 H CYS 43 -1.304 -2.300 -5.776
346 HA CYS 43 HA CYS 43 -1.202 -3.436 -3.112
347 HB2 CYS 43 1HB CYS 43 0.225 -1.172 -3.430
348 HB3 CYS 43 2HB CYS 43 -1.357 -0.475 -3.102
349 HG CYS 43 HG CYS 43 0.391 -0.677 -0.793
350 H THR 44 H THR 44 -3.061 -2.604 -1.762
351 HA THR 44 HA THR 44 -5.268 -1.358 -3.081
352 HB THR 44 HB THR 44 -6.490 -3.780 -2.368
353 HG1 THR 44 1HG THR 44 -5.278 -5.189 -3.871
354 HG21 THR 44 3HG2 THR 44 -6.774 -3.954 -4.902
355 HG22 THR 44 1HG2 THR 44 -5.827 -2.470 -4.994
356 HG23 THR 44 2HG2 THR 44 -7.364 -2.483 -4.129
357 H VAL 45 H VAL 45 -6.725 -0.584 -1.633
358 HA VAL 45 HA VAL 45 -6.565 -1.567 1.136
359 HB VAL 45 HB VAL 45 -6.683 1.336 0.306
360 HG11 VAL 45 1HG1 VAL 45 -6.920 -0.027 2.967
361 HG12 VAL 45 2HG1 VAL 45 -6.353 1.640 2.833
362 HG13 VAL 45 3HG1 VAL 45 -7.962 1.206 2.255
363 HG21 VAL 45 3HG2 VAL 45 -4.463 0.188 0.083
364 HG22 VAL 45 1HG2 VAL 45 -4.485 1.554 1.200
365 HG23 VAL 45 2HG2 VAL 45 -4.509 -0.096 1.823
366 H ASP 46 H ASP 46 -8.467 -1.555 2.300
367 HA ASP 46 HA ASP 46 -10.888 -0.729 0.838
368 HB2 ASP 46 1HB ASP 46 -10.341 -3.291 1.082
369 HB3 ASP 46 2HB ASP 46 -10.953 -3.059 2.718
370 H THR 47 H THR 47 -12.422 0.347 1.978
371 HA THR 47 HA THR 47 -11.669 1.486 4.486
372 HB THR 47 HB THR 47 -13.821 2.654 4.405
373 HG1 THR 47 1HG THR 47 -14.328 0.745 2.394
374 HG21 THR 47 3HG2 THR 47 -12.516 3.984 3.140
375 HG22 THR 47 1HG2 THR 47 -13.470 3.362 1.795
376 HG23 THR 47 2HG2 THR 47 -11.909 2.636 2.178
377 H TYR 48 H TYR 48 -13.141 -1.415 3.656
378 HA TYR 48 HA TYR 48 -15.133 -1.815 5.518
379 HB2 TYR 48 1HB TYR 48 -14.397 -3.408 3.703
380 HB3 TYR 48 2HB TYR 48 -13.081 -3.900 4.764
381 HD1 TYR 48 1HD TYR 48 -13.819 -4.679 7.166
382 HD2 TYR 48 2HD TYR 48 -16.389 -4.583 3.776
383 HE1 TYR 48 1HE TYR 48 -15.299 -6.316 8.250
384 HE2 TYR 48 2HE TYR 48 -17.877 -6.220 4.852
385 HH TYR 48 HH TYR 48 -16.995 -7.840 7.809
386 H ASN 49 H ASN 49 -11.696 -2.677 5.937
387 HA ASN 49 HA ASN 49 -11.829 -1.911 8.732
388 HB2 ASN 49 1HB ASN 49 -10.943 -4.105 9.509
389 HB3 ASN 49 2HB ASN 49 -12.582 -4.209 8.873
390 HD21 ASN 49 2HD2 ASN 49 -12.043 -6.495 8.708
391 HD22 ASN 49 1HD2 ASN 49 -11.217 -7.058 7.298
392 H ASN 50 H ASN 50 -10.426 -0.817 6.556
393 HA ASN 50 HA ASN 50 -8.350 -0.171 5.868
394 HB2 ASN 50 1HB ASN 50 -8.488 0.226 8.522
395 HB3 ASN 50 2HB ASN 50 -7.134 -0.899 8.478
396 HD21 ASN 50 2HD2 ASN 50 -5.797 -0.237 6.258
397 HD22 ASN 50 1HD2 ASN 50 -5.221 1.390 6.347
398 H ALA 51 H ALA 51 -8.869 -2.683 5.010
399 HA ALA 51 HA ALA 51 -6.653 -4.425 5.707
400 HB1 ALA 51 1HB ALA 51 -7.746 -5.861 3.858
401 HB2 ALA 51 2HB ALA 51 -8.599 -5.649 5.388
402 HB3 ALA 51 3HB ALA 51 -9.078 -4.710 3.975
403 H VAL 52 H VAL 52 -4.762 -3.639 4.924
404 HA VAL 52 HA VAL 52 -4.631 -2.746 2.140
405 HB VAL 52 HB VAL 52 -2.425 -2.686 4.199
406 HG11 VAL 52 1HG1 VAL 52 -1.401 -1.057 2.730
407 HG12 VAL 52 2HG1 VAL 52 -1.732 -2.543 1.836
408 HG13 VAL 52 3HG1 VAL 52 -2.781 -1.139 1.635
409 HG21 VAL 52 3HG2 VAL 52 -3.162 -0.122 4.029
410 HG22 VAL 52 1HG2 VAL 52 -4.729 -0.884 3.753
411 HG23 VAL 52 2HG2 VAL 52 -3.828 -1.229 5.229
412 H ASP 53 H ASP 53 -4.244 -4.260 0.671
413 HA ASP 53 HA ASP 53 -2.885 -6.718 1.372
414 HB2 ASP 53 1HB ASP 53 -4.138 -5.733 -1.194
415 HB3 ASP 53 2HB ASP 53 -3.333 -7.293 -1.046
416 H CYS 54 H CYS 54 -1.359 -7.506 -0.567
417 HA CYS 54 HA CYS 54 0.438 -5.402 -1.450
418 HB2 CYS 54 1HB CYS 54 2.395 -6.252 -0.383
419 HB3 CYS 54 2HB CYS 54 1.172 -6.072 0.870
420 HG CYS 54 HG CYS 54 2.736 -8.819 -0.204
421 H ASP 55 H ASP 55 1.751 -5.999 -3.176
422 HA ASP 55 HA ASP 55 0.759 -8.023 -4.858
423 HB2 ASP 55 1HB ASP 55 2.080 -5.891 -5.468
424 HB3 ASP 55 2HB ASP 55 3.518 -6.851 -5.129
Start of MODEL 2
1 H1 ALA 1 H ALA 1 -15.695 1.623 1.845
2 HA ALA 1 HA ALA 1 -15.865 2.152 -0.998
3 HB1 ALA 1 1HB ALA 1 -15.230 4.281 -1.012
4 HB2 ALA 1 2HB ALA 1 -15.492 4.306 0.732
5 HB3 ALA 1 3HB ALA 1 -13.890 3.950 0.086
6 H LYS 2 H LYS 2 -13.431 2.420 -1.816
7 HA LYS 2 HA LYS 2 -11.568 0.783 -0.314
8 HB2 LYS 2 1HB LYS 2 -12.583 -0.078 -3.029
9 HB3 LYS 2 2HB LYS 2 -11.235 -0.815 -2.173
10 HG2 LYS 2 1HG LYS 2 -12.826 -1.365 -0.322
11 HG3 LYS 2 2HG LYS 2 -14.134 -0.814 -1.371
12 HD2 LYS 2 1HD LYS 2 -12.170 -2.976 -2.120
13 HD3 LYS 2 2HD LYS 2 -13.748 -3.288 -1.393
14 HE2 LYS 2 1HE LYS 2 -14.880 -2.355 -3.269
15 HE3 LYS 2 2HE LYS 2 -13.377 -1.725 -3.941
16 HZ1 LYS 2 3HZ LYS 2 -12.802 -3.730 -4.768
17 HZ2 LYS 2 1HZ LYS 2 -14.474 -3.992 -4.743
18 HZ3 LYS 2 2HZ LYS 2 -13.504 -4.601 -3.499
19 H TYR 3 H TYR 3 -9.473 0.520 -1.604
20 HA TYR 3 HA TYR 3 -9.015 2.674 -3.516
21 HB2 TYR 3 1HB TYR 3 -7.214 2.406 -1.113
22 HB3 TYR 3 2HB TYR 3 -7.262 3.707 -2.298
23 HD1 TYR 3 2HD TYR 3 -9.251 5.256 -2.317
24 HD2 TYR 3 1HD TYR 3 -8.553 2.478 0.828
25 HE1 TYR 3 2HE TYR 3 -10.772 6.529 -0.864
26 HE2 TYR 3 1HE TYR 3 -10.073 3.742 2.291
27 HH TYR 3 HH TYR 3 -11.756 6.645 1.121
28 H THR 4 H THR 4 -7.242 2.354 -4.857
29 HA THR 4 HA THR 4 -5.745 -0.150 -4.492
30 HB THR 4 HB THR 4 -5.871 -0.478 -6.993
31 HG1 THR 4 1HG THR 4 -7.701 0.568 -7.994
32 HG21 THR 4 3HG2 THR 4 -7.225 -2.057 -6.138
33 HG22 THR 4 1HG2 THR 4 -8.535 -1.013 -6.684
34 HG23 THR 4 2HG2 THR 4 -7.981 -0.932 -5.011
35 H GLY 5 H GLY 5 -3.628 -0.136 -5.194
36 HA2 GLY 5 1HA GLY 5 -2.537 1.920 -6.839
37 HA3 GLY 5 2HA GLY 5 -2.202 2.231 -5.142
38 H LYS 6 H LYS 6 0.023 1.974 -5.412
39 HA LYS 6 HA LYS 6 0.891 -0.801 -5.407
40 HB2 LYS 6 1HB LYS 6 1.978 1.246 -7.349
41 HB3 LYS 6 2HB LYS 6 2.730 -0.312 -7.025
42 HG2 LYS 6 1HG LYS 6 1.547 -0.856 -8.881
43 HG3 LYS 6 2HG LYS 6 0.317 -1.196 -7.660
44 HD2 LYS 6 1HD LYS 6 -1.015 0.198 -8.780
45 HD3 LYS 6 2HD LYS 6 0.014 1.509 -8.197
46 HE2 LYS 6 1HE LYS 6 -0.257 1.636 -10.611
47 HE3 LYS 6 2HE LYS 6 1.419 1.286 -10.190
48 HZ1 LYS 6 3HZ LYS 6 1.276 -0.432 -11.563
49 HZ2 LYS 6 1HZ LYS 6 -0.394 -0.240 -11.758
50 HZ3 LYS 6 2HZ LYS 6 0.208 -1.165 -10.475
51 H CYS 7 H CYS 7 3.250 -0.961 -4.821
52 HA CYS 7 HA CYS 7 3.962 1.225 -2.978
53 HB2 CYS 7 1HB CYS 7 4.557 -1.730 -2.722
54 HB3 CYS 7 2HB CYS 7 5.091 -0.486 -1.599
55 HG CYS 7 HG CYS 7 2.179 0.211 -1.300
56 H THR 8 H THR 8 6.260 1.556 -2.603
57 HA THR 8 HA THR 8 7.825 0.997 -5.033
58 HB THR 8 HB THR 8 7.604 3.348 -4.773
59 HG1 THR 8 1HG THR 8 9.670 3.314 -5.252
60 HG21 THR 8 3HG2 THR 8 8.158 2.788 -1.886
61 HG22 THR 8 1HG2 THR 8 6.870 3.748 -2.611
62 HG23 THR 8 2HG2 THR 8 8.516 4.377 -2.560
63 H LYS 9 H LYS 9 9.880 0.168 -4.899
64 HA LYS 9 HA LYS 9 10.496 -1.582 -2.828
65 HB2 LYS 9 1HB LYS 9 12.834 -1.542 -3.822
66 HB3 LYS 9 2HB LYS 9 11.527 -1.957 -4.923
67 HG2 LYS 9 1HG LYS 9 11.560 0.247 -5.879
68 HG3 LYS 9 2HG LYS 9 12.743 0.787 -4.686
69 HD2 LYS 9 1HD LYS 9 13.207 -1.390 -6.724
70 HD3 LYS 9 2HD LYS 9 13.755 0.281 -6.884
71 HE2 LYS 9 1HE LYS 9 14.587 -1.723 -4.791
72 HE3 LYS 9 2HE LYS 9 15.581 -1.063 -6.089
73 HZ1 LYS 9 3HZ LYS 9 16.133 0.074 -4.097
74 HZ2 LYS 9 1HZ LYS 9 14.511 0.388 -3.735
75 HZ3 LYS 9 2HZ LYS 9 15.248 1.157 -5.049
76 H SER 10 H SER 10 11.108 1.813 -3.141
77 HA SER 10 HA SER 10 13.175 1.956 -1.167
78 HB2 SER 10 1HB SER 10 13.272 4.182 -1.668
79 HB3 SER 10 2HB SER 10 12.366 3.660 -3.090
80 HG SER 10 HG SER 10 11.612 5.348 -1.169
81 H LYS 11 H LYS 11 9.719 1.911 -1.117
82 HA LYS 11 HA LYS 11 9.727 1.817 1.770
83 HB2 LYS 11 1HB LYS 11 8.956 4.228 0.323
84 HB3 LYS 11 2HB LYS 11 7.667 3.627 1.357
85 HG2 LYS 11 1HG LYS 11 8.781 4.110 3.262
86 HG3 LYS 11 2HG LYS 11 10.362 3.765 2.557
87 HD2 LYS 11 1HD LYS 11 8.984 6.095 1.415
88 HD3 LYS 11 2HD LYS 11 9.427 6.256 3.117
89 HE2 LYS 11 1HE LYS 11 11.671 6.165 2.682
90 HE3 LYS 11 2HE LYS 11 11.461 5.182 1.233
91 HZ1 LYS 11 3HZ LYS 11 11.728 7.983 1.444
92 HZ2 LYS 11 1HZ LYS 11 10.236 7.619 0.735
93 HZ3 LYS 11 2HZ LYS 11 11.663 7.026 0.050
94 H ASN 12 H ASN 12 8.483 0.134 2.226
95 HA ASN 12 HA ASN 12 6.516 -0.826 0.356
96 HB2 ASN 12 1HB ASN 12 7.926 -2.393 1.625
97 HB3 ASN 12 2HB ASN 12 7.219 -1.812 3.130
98 HD21 ASN 12 2HD2 ASN 12 5.965 -3.344 3.903
99 HD22 ASN 12 1HD2 ASN 12 4.801 -4.254 3.008
100 H GLU 13 H GLU 13 5.378 1.366 0.628
101 HA GLU 13 HA GLU 13 3.267 1.018 2.643
102 HB2 GLU 13 1HB GLU 13 3.223 3.377 3.117
103 HB3 GLU 13 2HB GLU 13 4.863 2.790 3.359
104 HG2 GLU 13 1HG GLU 13 5.264 3.584 0.940
105 HG3 GLU 13 2HG GLU 13 3.785 4.515 1.171
106 H CYS 14 H CYS 14 1.207 1.786 2.053
107 HA CYS 14 HA CYS 14 0.696 1.672 -0.774
108 HB2 CYS 14 1HB CYS 14 -0.796 0.627 0.935
109 HB3 CYS 14 2HB CYS 14 -1.242 2.240 1.477
110 HG CYS 14 HG CYS 14 -2.492 0.459 -0.985
111 H LYS 15 H LYS 15 0.949 3.377 -2.045
112 HA LYS 15 HA LYS 15 0.542 6.065 -0.945
113 HB2 LYS 15 1HB LYS 15 1.673 6.796 -3.080
114 HB3 LYS 15 2HB LYS 15 2.671 5.849 -1.984
115 HG2 LYS 15 1HG LYS 15 2.546 3.941 -3.345
116 HG3 LYS 15 2HG LYS 15 1.202 4.597 -4.280
117 HD2 LYS 15 1HD LYS 15 2.975 4.929 -5.719
118 HD3 LYS 15 2HD LYS 15 2.908 6.480 -4.877
119 HE2 LYS 15 1HE LYS 15 4.685 5.768 -3.382
120 HE3 LYS 15 2HE LYS 15 4.721 4.182 -4.148
121 HZ1 LYS 15 3HZ LYS 15 5.404 5.231 -6.212
122 HZ2 LYS 15 1HZ LYS 15 6.489 5.607 -4.971
123 HZ3 LYS 15 2HZ LYS 15 5.360 6.757 -5.483
124 H TYR 16 H TYR 16 -1.836 5.367 -1.061
125 HA TYR 16 HA TYR 16 -2.937 5.757 -3.752
126 HB2 TYR 16 1HB TYR 16 -4.934 4.739 -2.992
127 HB3 TYR 16 2HB TYR 16 -3.631 3.780 -2.297
128 HD1 TYR 16 2HD TYR 16 -2.951 4.307 0.127
129 HD2 TYR 16 1HD TYR 16 -6.594 5.638 -1.620
130 HE1 TYR 16 2HE TYR 16 -3.900 4.638 2.372
131 HE2 TYR 16 1HE TYR 16 -7.553 5.974 0.619
132 HH TYR 16 HH TYR 16 -6.390 4.665 3.332
133 H LYS 17 H LYS 17 -5.246 6.876 -3.545
134 HA LYS 17 HA LYS 17 -4.752 9.451 -2.212
135 HB2 LYS 17 1HB LYS 17 -6.386 8.729 -4.643
136 HB3 LYS 17 2HB LYS 17 -6.496 10.297 -3.854
137 HG2 LYS 17 1HG LYS 17 -4.159 10.728 -4.307
138 HG3 LYS 17 2HG LYS 17 -3.979 9.120 -5.015
139 HD2 LYS 17 1HD LYS 17 -6.060 10.088 -6.459
140 HD3 LYS 17 2HD LYS 17 -5.154 11.571 -6.145
141 HE2 LYS 17 1HE LYS 17 -3.183 9.792 -6.843
142 HE3 LYS 17 2HE LYS 17 -4.521 9.311 -7.885
143 HZ1 LYS 17 3HZ LYS 17 -3.874 12.162 -7.677
144 HZ2 LYS 17 1HZ LYS 17 -4.500 11.289 -8.986
145 HZ3 LYS 17 2HZ LYS 17 -2.857 11.177 -8.602
146 H ASN 18 H ASN 18 -5.689 9.333 -0.247
147 HA ASN 18 HA ASN 18 -8.331 8.130 0.030
148 HB2 ASN 18 1HB ASN 18 -7.896 7.927 2.279
149 HB3 ASN 18 2HB ASN 18 -6.247 7.920 1.658
150 HD21 ASN 18 2HD2 ASN 18 -5.357 10.239 1.380
151 HD22 ASN 18 1HD2 ASN 18 -5.588 11.278 2.740
152 H ASP 19 H ASP 19 -10.153 9.232 0.704
153 HA ASP 19 HA ASP 19 -11.568 10.986 1.068
154 HB2 ASP 19 1HB ASP 19 -9.595 11.732 2.584
155 HB3 ASP 19 2HB ASP 19 -9.238 12.869 1.289
156 H ALA 20 H ALA 20 -8.814 12.552 -0.567
157 HA ALA 20 HA ALA 20 -10.054 12.591 -3.118
158 HB1 ALA 20 1HB ALA 20 -10.494 15.011 -3.271
159 HB2 ALA 20 2HB ALA 20 -11.539 14.206 -2.099
160 HB3 ALA 20 3HB ALA 20 -10.165 15.161 -1.544
161 H GLY 21 H GLY 21 -7.597 11.763 -2.517
162 HA2 GLY 21 1HA GLY 21 -5.499 11.992 -3.497
163 HA3 GLY 21 2HA GLY 21 -5.935 13.623 -3.987
164 H LYS 22 H LYS 22 -6.279 12.551 -0.687
165 HA LYS 22 HA LYS 22 -4.510 14.642 0.207
166 HB2 LYS 22 1HB LYS 22 -6.518 12.869 1.405
167 HB3 LYS 22 2HB LYS 22 -5.138 13.182 2.449
168 HG2 LYS 22 1HG LYS 22 -6.012 15.633 1.259
169 HG3 LYS 22 2HG LYS 22 -7.380 14.810 2.011
170 HD2 LYS 22 1HD LYS 22 -6.444 16.162 3.703
171 HD3 LYS 22 2HD LYS 22 -5.893 14.521 4.051
172 HE2 LYS 22 1HE LYS 22 -3.828 15.356 4.113
173 HE3 LYS 22 2HE LYS 22 -3.949 15.540 2.363
174 HZ1 LYS 22 3HZ LYS 22 -3.286 17.608 3.373
175 HZ2 LYS 22 1HZ LYS 22 -4.635 17.596 4.392
176 HZ3 LYS 22 2HZ LYS 22 -4.839 17.779 2.724
177 H ASP 23 H ASP 23 -2.429 14.454 0.721
178 HA ASP 23 HA ASP 23 -0.877 12.248 0.135
179 HB2 ASP 23 1HB ASP 23 0.093 14.456 0.421
180 HB3 ASP 23 2HB ASP 23 -0.333 14.456 2.130
181 H THR 24 H THR 24 -1.131 10.275 0.958
182 HA THR 24 HA THR 24 -0.903 9.919 3.838
183 HB THR 24 HB THR 24 -3.229 8.797 2.265
184 HG1 THR 24 1HG THR 24 -4.444 10.046 3.747
185 HG21 THR 24 3HG2 THR 24 -2.468 7.100 3.777
186 HG22 THR 24 1HG2 THR 24 -3.905 7.842 4.481
187 HG23 THR 24 2HG2 THR 24 -2.306 8.268 5.089
188 H PHE 25 H PHE 25 0.430 8.288 4.280
189 HA PHE 25 HA PHE 25 0.674 6.077 2.370
190 HB2 PHE 25 1HB PHE 25 3.018 7.575 3.562
191 HB3 PHE 25 2HB PHE 25 3.127 6.134 2.556
192 HD1 PHE 25 2HD PHE 25 1.926 9.647 2.537
193 HD2 PHE 25 1HD PHE 25 3.269 6.320 0.246
194 HE1 PHE 25 2HE PHE 25 1.990 11.063 0.525
195 HE2 PHE 25 1HE PHE 25 3.336 7.731 -1.769
196 HZ PHE 25 HZ PHE 25 2.695 10.104 -1.631
197 H ILE 26 H ILE 26 0.592 4.159 3.338
198 HA ILE 26 HA ILE 26 1.408 3.950 6.154
199 HB ILE 26 HB ILE 26 -1.033 4.098 6.112
200 HG12 ILE 26 1HG1 ILE 26 -0.130 1.267 6.678
201 HG13 ILE 26 2HG1 ILE 26 0.144 2.630 7.757
202 HG21 ILE 26 1HG2 ILE 26 -1.244 1.503 4.666
203 HG22 ILE 26 2HG2 ILE 26 -2.417 2.811 4.815
204 HG23 ILE 26 3HG2 ILE 26 -1.037 2.985 3.732
205 HD11 ILE 26 3HD1 ILE 26 -1.730 1.666 8.664
206 HD12 ILE 26 1HD1 ILE 26 -2.436 2.902 7.623
207 HD13 ILE 26 2HD1 ILE 26 -2.394 1.221 7.092
208 H LYS 27 H LYS 27 2.613 2.209 6.628
209 HA LYS 27 HA LYS 27 3.657 0.590 4.560
210 HB2 LYS 27 1HB LYS 27 3.974 0.802 7.490
211 HB3 LYS 27 2HB LYS 27 4.338 -0.776 6.803
212 HG2 LYS 27 1HG LYS 27 6.392 0.193 6.673
213 HG3 LYS 27 2HG LYS 27 5.741 0.666 5.101
214 HD2 LYS 27 1HD LYS 27 6.522 2.689 5.834
215 HD3 LYS 27 2HD LYS 27 4.879 2.750 6.476
216 HE2 LYS 27 1HE LYS 27 5.705 1.942 8.639
217 HE3 LYS 27 2HE LYS 27 7.345 1.896 7.992
218 HZ1 LYS 27 3HZ LYS 27 6.514 3.944 9.341
219 HZ2 LYS 27 1HZ LYS 27 5.837 4.411 7.862
220 HZ3 LYS 27 2HZ LYS 27 7.505 4.164 7.987
221 H CYS 28 H CYS 28 3.087 -1.365 3.809
222 HA CYS 28 HA CYS 28 0.547 -2.455 4.591
223 HB2 CYS 28 1HB CYS 28 2.588 -3.554 2.647
224 HB3 CYS 28 2HB CYS 28 0.910 -4.064 2.790
225 HG CYS 28 HG CYS 28 0.949 -2.590 0.504
226 HA PRO 29 HA PRO 29 1.833 -5.508 7.468
227 HB2 PRO 29 1HB PRO 29 0.046 -7.488 6.963
228 HB3 PRO 29 2HB PRO 29 -0.394 -5.982 7.777
229 HG2 PRO 29 1HG PRO 29 -0.760 -6.763 4.910
230 HG3 PRO 29 2HG PRO 29 -1.888 -5.931 5.997
231 HD2 PRO 29 1HD PRO 29 -0.405 -4.616 4.152
232 HD3 PRO 29 2HD PRO 29 -0.858 -3.890 5.707
233 H LYS 30 H LYS 30 3.897 -5.911 6.429
234 HA LYS 30 HA LYS 30 4.027 -8.613 5.331
235 HB2 LYS 30 1HB LYS 30 5.130 -6.150 3.993
236 HB3 LYS 30 2HB LYS 30 5.770 -7.755 3.663
237 HG2 LYS 30 1HG LYS 30 2.903 -6.922 3.270
238 HG3 LYS 30 2HG LYS 30 4.121 -7.021 1.996
239 HD2 LYS 30 1HD LYS 30 4.406 -9.426 2.514
240 HD3 LYS 30 2HD LYS 30 3.103 -9.297 3.698
241 HE2 LYS 30 1HE LYS 30 1.670 -8.425 1.781
242 HE3 LYS 30 2HE LYS 30 2.953 -8.985 0.710
243 HZ1 LYS 30 3HZ LYS 30 2.222 -11.056 0.880
244 HZ2 LYS 30 1HZ LYS 30 0.869 -10.475 1.714
245 HZ3 LYS 30 2HZ LYS 30 2.229 -11.003 2.571
246 H PHE 31 H PHE 31 4.698 -8.632 7.713
247 HA PHE 31 HA PHE 31 7.330 -7.625 8.305
248 HB2 PHE 31 1HB PHE 31 5.224 -9.121 9.785
249 HB3 PHE 31 2HB PHE 31 6.879 -9.260 10.365
250 HD1 PHE 31 1HD PHE 31 8.060 -7.313 11.233
251 HD2 PHE 31 2HD PHE 31 4.004 -7.066 9.969
252 HE1 PHE 31 1HE PHE 31 7.827 -5.166 12.411
253 HE2 PHE 31 2HE PHE 31 3.765 -4.919 11.143
254 HZ PHE 31 HZ PHE 31 5.678 -3.964 12.366
255 H ASP 32 H ASP 32 8.327 -8.745 6.439
256 HA ASP 32 HA ASP 32 9.734 -10.331 5.614
257 HB2 ASP 32 1HB ASP 32 10.401 -10.256 8.153
258 HB3 ASP 32 2HB ASP 32 9.647 -11.846 8.194
259 H ASN 33 H ASN 33 8.125 -11.095 4.185
260 HA ASN 33 HA ASN 33 7.625 -13.851 4.309
261 HB2 ASN 33 1HB ASN 33 5.904 -12.659 5.985
262 HB3 ASN 33 2HB ASN 33 4.995 -12.477 4.488
263 HD21 ASN 33 2HD2 ASN 33 6.251 -14.693 6.830
264 HD22 ASN 33 1HD2 ASN 33 5.390 -16.087 6.280
265 H LYS 34 H LYS 34 6.652 -10.720 3.047
266 HA LYS 34 HA LYS 34 7.104 -11.443 0.369
267 HB2 LYS 34 1HB LYS 34 4.839 -12.615 1.066
268 HB3 LYS 34 2HB LYS 34 4.177 -11.011 0.783
269 HG2 LYS 34 1HG LYS 34 3.892 -12.102 -1.246
270 HG3 LYS 34 2HG LYS 34 5.350 -11.138 -1.491
271 HD2 LYS 34 1HD LYS 34 6.745 -13.069 -1.118
272 HD3 LYS 34 2HD LYS 34 5.339 -14.050 -0.697
273 HE2 LYS 34 1HE LYS 34 5.381 -12.697 -3.347
274 HE3 LYS 34 2HE LYS 34 6.404 -14.113 -3.116
275 HZ1 LYS 34 3HZ LYS 34 3.895 -14.715 -2.072
276 HZ2 LYS 34 1HZ LYS 34 4.634 -15.373 -3.445
277 HZ3 LYS 34 2HZ LYS 34 3.637 -14.014 -3.590
278 H LYS 35 H LYS 35 8.111 -9.365 1.519
279 HA LYS 35 HA LYS 35 6.448 -7.018 1.366
280 HB2 LYS 35 1HB LYS 35 8.935 -7.696 2.541
281 HB3 LYS 35 2HB LYS 35 9.243 -6.381 1.414
282 HG2 LYS 35 1HG LYS 35 7.321 -5.164 2.523
283 HG3 LYS 35 2HG LYS 35 7.388 -6.406 3.775
284 HD2 LYS 35 1HD LYS 35 10.028 -5.421 3.262
285 HD3 LYS 35 2HD LYS 35 8.942 -4.063 3.566
286 HE2 LYS 35 1HE LYS 35 8.289 -4.956 5.673
287 HE3 LYS 35 2HE LYS 35 9.087 -6.492 5.340
288 HZ1 LYS 35 3HZ LYS 35 10.278 -3.904 6.070
289 HZ2 LYS 35 1HZ LYS 35 11.186 -5.012 5.168
290 HZ3 LYS 35 2HZ LYS 35 10.597 -5.445 6.693
291 H CYS 36 H CYS 36 6.940 -5.177 -0.012
292 HA CYS 36 HA CYS 36 6.940 -5.760 -2.709
293 HB2 CYS 36 1HB CYS 36 6.230 -3.598 -1.688
294 HB3 CYS 36 2HB CYS 36 7.926 -3.186 -1.465
295 HG CYS 36 HG CYS 36 7.142 -4.010 -4.612
296 H THR 37 H THR 37 8.475 -5.600 -4.368
297 HA THR 37 HA THR 37 11.280 -5.301 -3.652
298 HB THR 37 HB THR 37 11.799 -7.446 -4.969
299 HG1 THR 37 1HG THR 37 9.236 -8.262 -4.096
300 HG21 THR 37 3HG2 THR 37 12.138 -7.194 -2.541
301 HG22 THR 37 1HG2 THR 37 11.634 -8.828 -2.972
302 HG23 THR 37 2HG2 THR 37 10.472 -7.704 -2.267
303 H LYS 38 H LYS 38 9.604 -3.660 -5.197
304 HA LYS 38 HA LYS 38 11.161 -3.241 -7.474
305 HB2 LYS 38 1HB LYS 38 9.162 -5.264 -7.822
306 HB3 LYS 38 2HB LYS 38 8.739 -3.869 -8.807
307 HG2 LYS 38 1HG LYS 38 11.558 -4.630 -8.971
308 HG3 LYS 38 2HG LYS 38 10.437 -5.865 -9.548
309 HD2 LYS 38 1HD LYS 38 9.362 -3.706 -10.723
310 HD3 LYS 38 2HD LYS 38 11.045 -3.184 -10.643
311 HE2 LYS 38 1HE LYS 38 11.764 -4.820 -12.072
312 HE3 LYS 38 2HE LYS 38 10.470 -5.931 -11.624
313 HZ1 LYS 38 3HZ LYS 38 10.578 -4.342 -13.865
314 HZ2 LYS 38 1HZ LYS 38 9.430 -3.600 -12.869
315 HZ3 LYS 38 2HZ LYS 38 9.244 -5.222 -13.311
316 H ASP 39 H ASP 39 10.300 -1.519 -8.867
317 HA ASP 39 HA ASP 39 8.984 0.475 -7.317
318 HB2 ASP 39 1HB ASP 39 9.322 0.704 -10.286
319 HB3 ASP 39 2HB ASP 39 9.474 1.949 -9.048
320 H ASN 40 H ASN 40 6.877 0.439 -6.910
321 HA ASN 40 HA ASN 40 4.624 0.309 -7.183
322 HB2 ASN 40 1HB ASN 40 5.625 1.092 -9.852
323 HB3 ASN 40 2HB ASN 40 3.999 0.418 -9.820
324 HD21 ASN 40 2HD2 ASN 40 6.010 2.761 -8.078
325 HD22 ASN 40 1HD2 ASN 40 4.759 3.933 -7.863
326 H ASN 41 H ASN 41 4.950 -1.943 -6.456
327 HA ASN 41 HA ASN 41 4.817 -4.014 -8.472
328 HB2 ASN 41 1HB ASN 41 5.375 -3.865 -5.616
329 HB3 ASN 41 2HB ASN 41 4.305 -5.207 -6.016
330 HD21 ASN 41 2HD2 ASN 41 6.193 -6.428 -5.230
331 HD22 ASN 41 1HD2 ASN 41 7.432 -6.829 -6.365
332 H LYS 42 H LYS 42 2.841 -3.747 -5.542
333 HA LYS 42 HA LYS 42 0.377 -3.260 -6.763
334 HB2 LYS 42 1HB LYS 42 0.544 -5.347 -7.898
335 HB3 LYS 42 2HB LYS 42 1.086 -6.173 -6.443
336 HG2 LYS 42 1HG LYS 42 -1.006 -6.430 -5.644
337 HG3 LYS 42 2HG LYS 42 -1.562 -4.884 -6.292
338 HD2 LYS 42 1HD LYS 42 -0.937 -6.601 -8.474
339 HD3 LYS 42 2HD LYS 42 -1.963 -7.489 -7.345
340 HE2 LYS 42 1HE LYS 42 -3.498 -5.495 -7.348
341 HE3 LYS 42 2HE LYS 42 -2.534 -4.848 -8.675
342 HZ1 LYS 42 3HZ LYS 42 -3.294 -6.420 -10.119
343 HZ2 LYS 42 1HZ LYS 42 -4.657 -6.279 -9.127
344 HZ3 LYS 42 2HZ LYS 42 -3.588 -7.572 -8.915
345 H CYS 43 H CYS 43 -1.265 -3.065 -5.266
346 HA CYS 43 HA CYS 43 -1.208 -4.255 -2.692
347 HB2 CYS 43 1HB CYS 43 -0.695 -2.359 -1.316
348 HB3 CYS 43 2HB CYS 43 0.624 -2.553 -2.463
349 HG CYS 43 HG CYS 43 0.548 0.038 -2.706
350 H THR 44 H THR 44 -3.046 -3.700 -1.412
351 HA THR 44 HA THR 44 -5.044 -1.993 -2.712
352 HB THR 44 HB THR 44 -6.397 -4.246 -1.584
353 HG1 THR 44 1HG THR 44 -5.492 -5.670 -3.414
354 HG21 THR 44 3HG2 THR 44 -7.565 -4.222 -3.589
355 HG22 THR 44 1HG2 THR 44 -6.158 -3.706 -4.520
356 HG23 THR 44 2HG2 THR 44 -6.992 -2.558 -3.471
357 H VAL 45 H VAL 45 -6.883 -1.483 -1.276
358 HA VAL 45 HA VAL 45 -6.452 -1.892 1.570
359 HB VAL 45 HB VAL 45 -6.494 0.880 0.368
360 HG11 VAL 45 1HG1 VAL 45 -7.774 0.942 2.371
361 HG12 VAL 45 2HG1 VAL 45 -6.597 -0.056 3.228
362 HG13 VAL 45 3HG1 VAL 45 -6.181 1.592 2.757
363 HG21 VAL 45 3HG2 VAL 45 -4.272 1.095 1.403
364 HG22 VAL 45 1HG2 VAL 45 -4.352 -0.597 1.894
365 HG23 VAL 45 2HG2 VAL 45 -4.316 -0.178 0.182
366 H ASP 46 H ASP 46 -8.303 -1.683 2.789
367 HA ASP 46 HA ASP 46 -10.759 -0.993 1.315
368 HB2 ASP 46 1HB ASP 46 -10.108 -3.351 3.008
369 HB3 ASP 46 2HB ASP 46 -11.736 -2.693 3.134
370 H THR 47 H THR 47 -12.411 0.036 2.472
371 HA THR 47 HA THR 47 -11.465 1.646 4.682
372 HB THR 47 HB THR 47 -13.599 2.834 4.493
373 HG1 THR 47 1HG THR 47 -15.121 1.430 3.871
374 HG21 THR 47 3HG2 THR 47 -13.264 2.989 1.732
375 HG22 THR 47 1HG2 THR 47 -11.681 2.522 2.349
376 HG23 THR 47 2HG2 THR 47 -12.466 3.983 2.949
377 H TYR 48 H TYR 48 -13.185 -1.259 4.290
378 HA TYR 48 HA TYR 48 -15.025 -1.276 6.344
379 HB2 TYR 48 1HB TYR 48 -14.965 -3.159 4.914
380 HB3 TYR 48 2HB TYR 48 -13.261 -3.457 5.239
381 HD1 TYR 48 1HD TYR 48 -15.980 -2.809 7.692
382 HD2 TYR 48 2HD TYR 48 -13.260 -5.648 6.065
383 HE1 TYR 48 1HE TYR 48 -16.602 -4.407 9.456
384 HE2 TYR 48 2HE TYR 48 -13.876 -7.254 7.823
385 HH TYR 48 HH TYR 48 -16.544 -7.069 9.631
386 H ASN 49 H ASN 49 -11.626 -2.344 6.561
387 HA ASN 49 HA ASN 49 -11.466 -1.316 9.268
388 HB2 ASN 49 1HB ASN 49 -12.352 -3.744 9.310
389 HB3 ASN 49 2HB ASN 49 -10.718 -4.198 8.838
390 HD21 ASN 49 2HD2 ASN 49 -9.560 -4.838 10.490
391 HD22 ASN 49 1HD2 ASN 49 -9.621 -4.198 12.093
392 H ASN 50 H ASN 50 -10.206 -0.517 6.886
393 HA ASN 50 HA ASN 50 -8.169 -0.070 5.967
394 HB2 ASN 50 1HB ASN 50 -7.608 -0.326 8.901
395 HB3 ASN 50 2HB ASN 50 -6.276 -0.056 7.781
396 HD21 ASN 50 2HD2 ASN 50 -5.995 1.920 6.878
397 HD22 ASN 50 1HD2 ASN 50 -6.954 3.302 7.273
398 H ALA 51 H ALA 51 -8.862 -2.572 5.334
399 HA ALA 51 HA ALA 51 -6.843 -4.483 6.093
400 HB1 ALA 51 1HB ALA 51 -9.312 -4.505 4.489
401 HB2 ALA 51 2HB ALA 51 -8.061 -5.639 3.982
402 HB3 ALA 51 3HB ALA 51 -8.685 -5.694 5.630
403 H VAL 52 H VAL 52 -4.967 -3.252 5.433
404 HA VAL 52 HA VAL 52 -4.563 -2.702 2.631
405 HB VAL 52 HB VAL 52 -2.549 -2.623 4.881
406 HG11 VAL 52 1HG1 VAL 52 -1.237 -1.226 3.417
407 HG12 VAL 52 2HG1 VAL 52 -1.603 -2.744 2.595
408 HG13 VAL 52 3HG1 VAL 52 -2.495 -1.280 2.182
409 HG21 VAL 52 3HG2 VAL 52 -3.034 -0.067 4.514
410 HG22 VAL 52 1HG2 VAL 52 -4.588 -0.667 3.937
411 HG23 VAL 52 2HG2 VAL 52 -4.055 -1.035 5.577
412 H ASP 53 H ASP 53 -3.544 -3.935 1.166
413 HA ASP 53 HA ASP 53 -2.348 -6.459 2.106
414 HB2 ASP 53 1HB ASP 53 -3.692 -5.913 -0.550
415 HB3 ASP 53 2HB ASP 53 -3.009 -7.452 -0.033
416 H CYS 54 H CYS 54 -1.043 -7.334 -0.057
417 HA CYS 54 HA CYS 54 0.604 -5.221 -1.165
418 HB2 CYS 54 1HB CYS 54 1.417 -6.529 1.190
419 HB3 CYS 54 2HB CYS 54 2.381 -7.232 -0.103
420 HG CYS 54 HG CYS 54 4.109 -5.346 -0.100
421 H ASP 55 H ASP 55 2.282 -6.148 -2.674
422 HA ASP 55 HA ASP 55 1.023 -7.943 -4.470
423 HB2 ASP 55 1HB ASP 55 2.608 -6.138 -5.148
424 HB3 ASP 55 2HB ASP 55 3.921 -7.075 -4.440
Start of MODEL 3
1 H1 ALA 1 H ALA 1 -15.790 1.963 1.744
2 HA ALA 1 HA ALA 1 -15.870 2.898 -0.952
3 HB1 ALA 1 1HB ALA 1 -15.336 4.863 0.946
4 HB2 ALA 1 2HB ALA 1 -13.760 4.435 0.277
5 HB3 ALA 1 3HB ALA 1 -15.058 4.961 -0.793
6 H LYS 2 H LYS 2 -13.253 3.236 -1.537
7 HA LYS 2 HA LYS 2 -11.573 1.297 -0.265
8 HB2 LYS 2 1HB LYS 2 -13.236 0.490 -2.515
9 HB3 LYS 2 2HB LYS 2 -11.523 0.257 -2.841
10 HG2 LYS 2 1HG LYS 2 -11.304 -1.084 -0.825
11 HG3 LYS 2 2HG LYS 2 -13.011 -0.824 -0.455
12 HD2 LYS 2 1HD LYS 2 -12.386 -1.912 -3.134
13 HD3 LYS 2 2HD LYS 2 -12.102 -2.984 -1.761
14 HE2 LYS 2 1HE LYS 2 -14.515 -2.098 -1.079
15 HE3 LYS 2 2HE LYS 2 -14.642 -1.875 -2.823
16 HZ1 LYS 2 3HZ LYS 2 -13.765 -4.434 -1.622
17 HZ2 LYS 2 1HZ LYS 2 -14.307 -4.149 -3.200
18 HZ3 LYS 2 2HZ LYS 2 -15.396 -4.086 -1.907
19 H TYR 3 H TYR 3 -9.501 0.996 -1.563
20 HA TYR 3 HA TYR 3 -8.916 3.216 -3.362
21 HB2 TYR 3 1HB TYR 3 -7.136 2.721 -0.981
22 HB3 TYR 3 2HB TYR 3 -7.111 4.083 -2.096
23 HD1 TYR 3 1HD TYR 3 -8.921 5.794 -1.989
24 HD2 TYR 3 2HD TYR 3 -8.556 2.715 0.926
25 HE1 TYR 3 1HE TYR 3 -10.369 7.072 -0.466
26 HE2 TYR 3 2HE TYR 3 -10.005 3.985 2.456
27 HH TYR 3 HH TYR 3 -10.751 6.238 2.839
28 H THR 4 H THR 4 -6.816 2.992 -4.426
29 HA THR 4 HA THR 4 -5.559 0.370 -4.272
30 HB THR 4 HB THR 4 -6.457 1.342 -6.974
31 HG1 THR 4 1HG THR 4 -7.854 -0.363 -5.166
32 HG21 THR 4 3HG2 THR 4 -5.108 -1.025 -5.862
33 HG22 THR 4 1HG2 THR 4 -5.015 -0.320 -7.476
34 HG23 THR 4 2HG2 THR 4 -6.365 -1.370 -7.048
35 H GLY 5 H GLY 5 -3.501 0.268 -5.313
36 HA2 GLY 5 1HA GLY 5 -2.338 2.358 -6.780
37 HA3 GLY 5 2HA GLY 5 -1.973 2.618 -5.080
38 H LYS 6 H LYS 6 0.214 2.253 -5.230
39 HA LYS 6 HA LYS 6 0.980 -0.550 -5.498
40 HB2 LYS 6 1HB LYS 6 2.432 1.655 -6.971
41 HB3 LYS 6 2HB LYS 6 2.859 -0.051 -6.962
42 HG2 LYS 6 1HG LYS 6 1.766 0.079 -8.955
43 HG3 LYS 6 2HG LYS 6 0.414 -0.328 -7.894
44 HD2 LYS 6 1HD LYS 6 -0.621 1.567 -8.425
45 HD3 LYS 6 2HD LYS 6 0.785 2.513 -7.930
46 HE2 LYS 6 1HE LYS 6 1.747 1.786 -10.234
47 HE3 LYS 6 2HE LYS 6 0.062 1.458 -10.635
48 HZ1 LYS 6 3HZ LYS 6 0.258 3.623 -11.292
49 HZ2 LYS 6 1HZ LYS 6 1.375 4.023 -10.085
50 HZ3 LYS 6 2HZ LYS 6 -0.262 3.856 -9.698
51 H CYS 7 H CYS 7 3.459 -0.707 -4.966
52 HA CYS 7 HA CYS 7 3.878 0.902 -2.540
53 HB2 CYS 7 1HB CYS 7 4.045 -1.897 -3.041
54 HB3 CYS 7 2HB CYS 7 5.663 -1.321 -2.654
55 HG CYS 7 HG CYS 7 3.243 -0.232 -0.595
56 H THR 8 H THR 8 6.495 0.586 -2.047
57 HA THR 8 HA THR 8 7.916 1.504 -4.448
58 HB THR 8 HB THR 8 8.993 2.945 -2.269
59 HG1 THR 8 1HG THR 8 7.197 2.999 -1.069
60 HG21 THR 8 3HG2 THR 8 7.752 3.454 -4.874
61 HG22 THR 8 1HG2 THR 8 9.187 4.174 -4.143
62 HG23 THR 8 2HG2 THR 8 7.585 4.783 -3.727
63 H LYS 9 H LYS 9 9.878 0.627 -4.696
64 HA LYS 9 HA LYS 9 10.776 -1.495 -3.139
65 HB2 LYS 9 1HB LYS 9 12.989 -1.102 -4.328
66 HB3 LYS 9 2HB LYS 9 11.583 -1.349 -5.356
67 HG2 LYS 9 1HG LYS 9 11.715 0.703 -6.241
68 HG3 LYS 9 2HG LYS 9 12.123 1.453 -4.696
69 HD2 LYS 9 1HD LYS 9 14.060 1.759 -5.934
70 HD3 LYS 9 2HD LYS 9 14.418 0.292 -5.022
71 HE2 LYS 9 1HE LYS 9 14.874 -0.697 -6.962
72 HE3 LYS 9 2HE LYS 9 13.155 -0.596 -7.340
73 HZ1 LYS 9 3HZ LYS 9 13.896 0.562 -9.097
74 HZ2 LYS 9 1HZ LYS 9 15.370 0.962 -8.370
75 HZ3 LYS 9 2HZ LYS 9 13.979 1.853 -8.007
76 H SER 10 H SER 10 11.269 1.921 -2.775
77 HA SER 10 HA SER 10 13.438 1.601 -0.877
78 HB2 SER 10 1HB SER 10 12.792 4.206 -0.648
79 HB3 SER 10 2HB SER 10 13.821 3.586 -1.938
80 HG SER 10 HG SER 10 12.322 4.657 -3.045
81 H LYS 11 H LYS 11 10.022 1.735 -0.844
82 HA LYS 11 HA LYS 11 9.985 1.444 2.027
83 HB2 LYS 11 1HB LYS 11 9.803 4.003 1.179
84 HB3 LYS 11 2HB LYS 11 8.108 3.541 1.109
85 HG2 LYS 11 1HG LYS 11 7.925 3.329 3.368
86 HG3 LYS 11 2HG LYS 11 9.619 2.882 3.575
87 HD2 LYS 11 1HD LYS 11 9.216 5.597 2.554
88 HD3 LYS 11 2HD LYS 11 8.548 5.328 4.166
89 HE2 LYS 11 1HE LYS 11 10.830 4.253 4.691
90 HE3 LYS 11 2HE LYS 11 11.386 5.069 3.230
91 HZ1 LYS 11 3HZ LYS 11 11.841 6.491 5.044
92 HZ2 LYS 11 1HZ LYS 11 10.285 6.314 5.685
93 HZ3 LYS 11 2HZ LYS 11 10.513 7.166 4.242
94 H ASN 12 H ASN 12 8.647 -0.189 2.385
95 HA ASN 12 HA ASN 12 6.706 -0.986 0.415
96 HB2 ASN 12 1HB ASN 12 8.006 -2.665 1.654
97 HB3 ASN 12 2HB ASN 12 7.283 -2.116 3.163
98 HD21 ASN 12 2HD2 ASN 12 5.681 -3.311 3.861
99 HD22 ASN 12 1HD2 ASN 12 4.606 -4.253 2.889
100 H GLU 13 H GLU 13 5.729 1.313 0.842
101 HA GLU 13 HA GLU 13 3.570 0.985 2.821
102 HB2 GLU 13 1HB GLU 13 3.544 3.386 3.150
103 HB3 GLU 13 2HB GLU 13 5.159 2.766 3.461
104 HG2 GLU 13 1HG GLU 13 5.756 3.448 1.118
105 HG3 GLU 13 2HG GLU 13 4.202 4.274 1.046
106 H CYS 14 H CYS 14 1.501 1.670 2.229
107 HA CYS 14 HA CYS 14 0.954 1.502 -0.590
108 HB2 CYS 14 1HB CYS 14 -0.553 0.387 0.928
109 HB3 CYS 14 2HB CYS 14 -0.848 1.884 1.806
110 HG CYS 14 HG CYS 14 -2.533 0.643 -0.669
111 H LYS 15 H LYS 15 1.360 3.238 -1.805
112 HA LYS 15 HA LYS 15 0.809 5.908 -0.754
113 HB2 LYS 15 1HB LYS 15 1.951 6.657 -2.871
114 HB3 LYS 15 2HB LYS 15 2.955 5.723 -1.771
115 HG2 LYS 15 1HG LYS 15 3.323 4.153 -3.297
116 HG3 LYS 15 2HG LYS 15 1.607 4.029 -3.691
117 HD2 LYS 15 1HD LYS 15 2.124 6.359 -4.876
118 HD3 LYS 15 2HD LYS 15 3.743 5.659 -4.954
119 HE2 LYS 15 1HE LYS 15 2.990 4.724 -6.855
120 HE3 LYS 15 2HE LYS 15 2.235 3.560 -5.768
121 HZ1 LYS 15 3HZ LYS 15 0.704 5.969 -6.286
122 HZ2 LYS 15 1HZ LYS 15 0.193 4.358 -6.191
123 HZ3 LYS 15 2HZ LYS 15 0.902 4.937 -7.613
124 H TYR 16 H TYR 16 -1.515 5.603 -0.829
125 HA TYR 16 HA TYR 16 -2.623 5.751 -3.554
126 HB2 TYR 16 1HB TYR 16 -4.656 4.838 -2.732
127 HB3 TYR 16 2HB TYR 16 -3.370 3.855 -2.042
128 HD1 TYR 16 2HD TYR 16 -2.593 4.487 0.351
129 HD2 TYR 16 1HD TYR 16 -6.283 5.757 -1.346
130 HE1 TYR 16 2HE TYR 16 -3.480 4.902 2.606
131 HE2 TYR 16 1HE TYR 16 -7.180 6.177 0.906
132 HH TYR 16 HH TYR 16 -5.718 5.035 3.710
133 H LYS 17 H LYS 17 -5.068 6.810 -3.084
134 HA LYS 17 HA LYS 17 -4.548 9.407 -1.800
135 HB2 LYS 17 1HB LYS 17 -5.818 10.495 -3.633
136 HB3 LYS 17 2HB LYS 17 -4.325 9.747 -4.183
137 HG2 LYS 17 1HG LYS 17 -6.211 7.752 -4.494
138 HG3 LYS 17 2HG LYS 17 -7.062 9.224 -4.967
139 HD2 LYS 17 1HD LYS 17 -5.037 9.755 -6.406
140 HD3 LYS 17 2HD LYS 17 -4.516 8.095 -6.106
141 HE2 LYS 17 1HE LYS 17 -6.113 7.211 -7.441
142 HE3 LYS 17 2HE LYS 17 -7.306 8.432 -7.000
143 HZ1 LYS 17 3HZ LYS 17 -4.997 9.013 -8.763
144 HZ2 LYS 17 1HZ LYS 17 -6.378 9.958 -8.515
145 HZ3 LYS 17 2HZ LYS 17 -6.495 8.497 -9.357
146 H ASN 18 H ASN 18 -6.050 9.988 -0.374
147 HA ASN 18 HA ASN 18 -8.661 8.626 -0.476
148 HB2 ASN 18 1HB ASN 18 -8.706 8.475 1.836
149 HB3 ASN 18 2HB ASN 18 -6.990 8.254 1.509
150 HD21 ASN 18 2HD2 ASN 18 -5.732 10.366 1.458
151 HD22 ASN 18 1HD2 ASN 18 -6.085 11.490 2.722
152 H ASP 19 H ASP 19 -10.423 9.902 0.660
153 HA ASP 19 HA ASP 19 -11.703 11.776 0.896
154 HB2 ASP 19 1HB ASP 19 -9.477 12.678 1.884
155 HB3 ASP 19 2HB ASP 19 -9.321 13.521 0.346
156 H ALA 20 H ALA 20 -9.238 12.833 -1.451
157 HA ALA 20 HA ALA 20 -10.821 12.416 -3.740
158 HB1 ALA 20 1HB ALA 20 -11.830 14.423 -4.187
159 HB2 ALA 20 2HB ALA 20 -11.973 14.382 -2.429
160 HB3 ALA 20 3HB ALA 20 -10.701 15.339 -3.188
161 H GLY 21 H GLY 21 -8.163 11.949 -3.065
162 HA2 GLY 21 1HA GLY 21 -6.405 12.043 -4.754
163 HA3 GLY 21 2HA GLY 21 -6.788 13.745 -4.962
164 H LYS 22 H LYS 22 -6.862 12.720 -1.727
165 HA LYS 22 HA LYS 22 -4.553 14.326 -1.103
166 HB2 LYS 22 1HB LYS 22 -6.880 13.501 0.257
167 HB3 LYS 22 2HB LYS 22 -5.528 12.807 1.141
168 HG2 LYS 22 1HG LYS 22 -4.511 15.142 1.096
169 HG3 LYS 22 2HG LYS 22 -6.107 15.696 0.582
170 HD2 LYS 22 1HD LYS 22 -6.822 15.657 2.686
171 HD3 LYS 22 2HD LYS 22 -6.411 13.946 2.816
172 HE2 LYS 22 1HE LYS 22 -3.962 15.018 3.050
173 HE3 LYS 22 2HE LYS 22 -4.923 16.337 3.714
174 HZ1 LYS 22 3HZ LYS 22 -4.068 14.263 5.146
175 HZ2 LYS 22 1HZ LYS 22 -5.592 13.688 4.687
176 HZ3 LYS 22 2HZ LYS 22 -5.458 15.149 5.528
177 H ASP 23 H ASP 23 -2.563 13.550 -1.274
178 HA ASP 23 HA ASP 23 -1.825 10.906 -1.614
179 HB2 ASP 23 1HB ASP 23 0.469 11.644 -0.985
180 HB3 ASP 23 2HB ASP 23 -0.305 12.707 -2.156
181 H THR 24 H THR 24 -1.508 9.208 -0.316
182 HA THR 24 HA THR 24 -1.247 9.630 2.572
183 HB THR 24 HB THR 24 -3.271 7.760 1.323
184 HG1 THR 24 1HG THR 24 -3.551 10.088 2.948
185 HG21 THR 24 3HG2 THR 24 -3.885 7.193 3.625
186 HG22 THR 24 1HG2 THR 24 -2.574 8.207 4.229
187 HG23 THR 24 2HG2 THR 24 -2.208 6.759 3.289
188 H PHE 25 H PHE 25 0.220 8.328 3.488
189 HA PHE 25 HA PHE 25 1.070 5.928 2.013
190 HB2 PHE 25 1HB PHE 25 2.893 7.863 3.457
191 HB3 PHE 25 2HB PHE 25 3.394 6.388 2.637
192 HD1 PHE 25 2HD PHE 25 1.918 9.735 2.103
193 HD2 PHE 25 1HD PHE 25 3.822 6.366 0.330
194 HE1 PHE 25 2HE PHE 25 2.198 10.999 0.011
195 HE2 PHE 25 1HE PHE 25 4.106 7.625 -1.764
196 HZ PHE 25 HZ PHE 25 3.293 9.944 -1.927
197 H ILE 26 H ILE 26 1.168 4.115 3.184
198 HA ILE 26 HA ILE 26 1.595 4.209 6.051
199 HB ILE 26 HB ILE 26 -0.809 4.484 5.958
200 HG12 ILE 26 1HG1 ILE 26 -1.489 2.518 7.259
201 HG13 ILE 26 2HG1 ILE 26 -0.077 1.638 6.683
202 HG21 ILE 26 1HG2 ILE 26 -2.281 3.004 4.824
203 HG22 ILE 26 2HG2 ILE 26 -1.040 3.484 3.666
204 HG23 ILE 26 3HG2 ILE 26 -0.966 1.896 4.431
205 HD11 ILE 26 3HD1 ILE 26 0.098 4.176 8.279
206 HD12 ILE 26 1HD1 ILE 26 0.098 2.566 8.998
207 HD13 ILE 26 2HD1 ILE 26 1.393 3.041 7.899
208 H LYS 27 H LYS 27 2.912 2.604 6.580
209 HA LYS 27 HA LYS 27 3.881 0.702 4.814
210 HB2 LYS 27 1HB LYS 27 4.936 1.414 6.978
211 HB3 LYS 27 2HB LYS 27 3.771 0.399 7.818
212 HG2 LYS 27 1HG LYS 27 4.803 -1.528 7.216
213 HG3 LYS 27 2HG LYS 27 5.369 -0.875 5.677
214 HD2 LYS 27 1HD LYS 27 6.883 0.619 7.182
215 HD3 LYS 27 2HD LYS 27 6.567 -0.614 8.405
216 HE2 LYS 27 1HE LYS 27 7.231 -1.880 5.928
217 HE3 LYS 27 2HE LYS 27 8.458 -0.674 6.312
218 HZ1 LYS 27 3HZ LYS 27 9.181 -1.845 8.069
219 HZ2 LYS 27 1HZ LYS 27 8.460 -3.157 7.280
220 HZ3 LYS 27 2HZ LYS 27 7.634 -2.359 8.521
221 H CYS 28 H CYS 28 3.313 -1.323 4.228
222 HA CYS 28 HA CYS 28 0.697 -2.270 5.114
223 HB2 CYS 28 1HB CYS 28 2.415 -3.434 2.923
224 HB3 CYS 28 2HB CYS 28 0.689 -3.664 3.172
225 HG CYS 28 HG CYS 28 0.299 -1.999 1.226
226 HA PRO 29 HA PRO 29 2.227 -5.517 7.638
227 HB2 PRO 29 1HB PRO 29 0.322 -7.413 7.252
228 HB3 PRO 29 2HB PRO 29 0.040 -5.947 8.197
229 HG2 PRO 29 1HG PRO 29 -0.705 -6.546 5.361
230 HG3 PRO 29 2HG PRO 29 -1.661 -5.750 6.624
231 HD2 PRO 29 1HD PRO 29 -0.373 -4.369 4.684
232 HD3 PRO 29 2HD PRO 29 -0.606 -3.723 6.322
233 H LYS 30 H LYS 30 4.098 -5.806 6.160
234 HA LYS 30 HA LYS 30 4.106 -8.520 5.113
235 HB2 LYS 30 1HB LYS 30 4.818 -6.106 3.443
236 HB3 LYS 30 2HB LYS 30 5.256 -7.754 3.013
237 HG2 LYS 30 1HG LYS 30 2.431 -6.793 3.413
238 HG3 LYS 30 2HG LYS 30 3.240 -6.917 1.849
239 HD2 LYS 30 1HD LYS 30 3.684 -9.396 2.855
240 HD3 LYS 30 2HD LYS 30 2.117 -9.020 3.576
241 HE2 LYS 30 1HE LYS 30 2.665 -8.643 0.645
242 HE3 LYS 30 2HE LYS 30 2.115 -10.182 1.305
243 HZ1 LYS 30 3HZ LYS 30 0.346 -8.627 0.437
244 HZ2 LYS 30 1HZ LYS 30 0.658 -7.649 1.782
245 HZ3 LYS 30 2HZ LYS 30 0.102 -9.231 1.998
246 H PHE 31 H PHE 31 5.323 -8.310 7.285
247 HA PHE 31 HA PHE 31 8.103 -7.478 6.823
248 HB2 PHE 31 1HB PHE 31 8.238 -7.812 9.378
249 HB3 PHE 31 2HB PHE 31 7.345 -6.420 8.775
250 HD1 PHE 31 2HD PHE 31 4.919 -6.341 8.914
251 HD2 PHE 31 1HD PHE 31 7.119 -9.638 10.467
252 HE1 PHE 31 2HE PHE 31 2.937 -7.063 10.181
253 HE2 PHE 31 1HE PHE 31 5.141 -10.365 11.735
254 HZ PHE 31 HZ PHE 31 3.046 -9.076 11.595
255 H ASP 32 H ASP 32 9.450 -9.035 6.241
256 HA ASP 32 HA ASP 32 10.414 -11.080 5.973
257 HB2 ASP 32 1HB ASP 32 9.408 -11.757 8.729
258 HB3 ASP 32 2HB ASP 32 10.895 -12.284 7.947
259 H ASN 33 H ASN 33 8.466 -11.329 4.461
260 HA ASN 33 HA ASN 33 7.560 -13.966 4.560
261 HB2 ASN 33 1HB ASN 33 6.101 -12.474 6.329
262 HB3 ASN 33 2HB ASN 33 5.114 -12.358 4.874
263 HD21 ASN 33 2HD2 ASN 33 6.747 -14.664 6.987
264 HD22 ASN 33 1HD2 ASN 33 5.623 -15.954 6.743
265 H LYS 34 H LYS 34 7.004 -10.690 3.434
266 HA LYS 34 HA LYS 34 7.158 -11.394 0.717
267 HB2 LYS 34 1HB LYS 34 4.787 -12.213 1.538
268 HB3 LYS 34 2HB LYS 34 4.372 -10.513 1.353
269 HG2 LYS 34 1HG LYS 34 3.959 -10.961 -0.778
270 HG3 LYS 34 2HG LYS 34 5.702 -11.140 -0.994
271 HD2 LYS 34 1HD LYS 34 5.291 -13.570 -0.168
272 HD3 LYS 34 2HD LYS 34 3.611 -13.249 -0.606
273 HE2 LYS 34 1HE LYS 34 4.045 -13.407 -2.794
274 HE3 LYS 34 2HE LYS 34 5.503 -12.425 -2.662
275 HZ1 LYS 34 3HZ LYS 34 5.366 -15.287 -1.893
276 HZ2 LYS 34 1HZ LYS 34 6.752 -14.325 -2.008
277 HZ3 LYS 34 2HZ LYS 34 5.895 -14.742 -3.405
278 H LYS 35 H LYS 35 8.583 -9.551 1.761
279 HA LYS 35 HA LYS 35 7.337 -6.959 1.848
280 HB2 LYS 35 1HB LYS 35 9.834 -8.094 2.634
281 HB3 LYS 35 2HB LYS 35 10.163 -6.736 1.565
282 HG2 LYS 35 1HG LYS 35 8.267 -5.682 3.204
283 HG3 LYS 35 2HG LYS 35 9.118 -6.776 4.298
284 HD2 LYS 35 1HD LYS 35 11.235 -5.652 3.147
285 HD3 LYS 35 2HD LYS 35 10.085 -4.335 2.909
286 HE2 LYS 35 1HE LYS 35 9.555 -4.565 5.389
287 HE3 LYS 35 2HE LYS 35 10.995 -5.577 5.492
288 HZ1 LYS 35 3HZ LYS 35 10.804 -2.704 4.848
289 HZ2 LYS 35 1HZ LYS 35 12.154 -3.606 4.372
290 HZ3 LYS 35 2HZ LYS 35 11.763 -3.470 6.012
291 H CYS 36 H CYS 36 7.657 -5.247 0.392
292 HA CYS 36 HA CYS 36 7.425 -5.809 -2.297
293 HB2 CYS 36 1HB CYS 36 7.697 -3.471 -2.706
294 HB3 CYS 36 2HB CYS 36 6.890 -3.630 -1.151
295 HG CYS 36 HG CYS 36 8.561 -1.568 -0.696
296 H THR 37 H THR 37 8.843 -5.505 -4.091
297 HA THR 37 HA THR 37 11.693 -5.329 -3.608
298 HB THR 37 HB THR 37 12.056 -7.478 -4.979
299 HG1 THR 37 1HG THR 37 10.378 -8.757 -5.272
300 HG21 THR 37 3HG2 THR 37 10.937 -7.971 -2.235
301 HG22 THR 37 1HG2 THR 37 12.445 -7.089 -2.471
302 HG23 THR 37 2HG2 THR 37 12.301 -8.757 -3.027
303 H LYS 38 H LYS 38 9.912 -3.660 -5.001
304 HA LYS 38 HA LYS 38 11.279 -3.245 -7.396
305 HB2 LYS 38 1HB LYS 38 9.140 -5.195 -7.574
306 HB3 LYS 38 2HB LYS 38 8.826 -3.812 -8.615
307 HG2 LYS 38 1HG LYS 38 11.568 -4.774 -8.795
308 HG3 LYS 38 2HG LYS 38 10.370 -5.988 -9.246
309 HD2 LYS 38 1HD LYS 38 10.059 -3.232 -10.324
310 HD3 LYS 38 2HD LYS 38 11.326 -4.256 -11.004
311 HE2 LYS 38 1HE LYS 38 9.700 -5.014 -12.351
312 HE3 LYS 38 2HE LYS 38 9.209 -5.968 -10.951
313 HZ1 LYS 38 3HZ LYS 38 7.282 -4.890 -11.678
314 HZ2 LYS 38 1HZ LYS 38 8.072 -3.412 -11.912
315 HZ3 LYS 38 2HZ LYS 38 7.788 -3.980 -10.344
316 H ASP 39 H ASP 39 10.474 -1.430 -8.596
317 HA ASP 39 HA ASP 39 9.146 0.479 -6.943
318 HB2 ASP 39 1HB ASP 39 9.283 1.901 -9.068
319 HB3 ASP 39 2HB ASP 39 10.806 1.363 -8.367
320 H ASN 40 H ASN 40 7.029 0.548 -6.628
321 HA ASN 40 HA ASN 40 4.783 0.483 -6.977
322 HB2 ASN 40 1HB ASN 40 5.895 1.267 -9.601
323 HB3 ASN 40 2HB ASN 40 4.253 0.631 -9.634
324 HD21 ASN 40 2HD2 ASN 40 6.176 2.807 -7.587
325 HD22 ASN 40 1HD2 ASN 40 4.975 4.044 -7.484
326 H ASN 41 H ASN 41 5.052 -1.789 -6.266
327 HA ASN 41 HA ASN 41 4.910 -3.831 -8.313
328 HB2 ASN 41 1HB ASN 41 5.365 -3.737 -5.423
329 HB3 ASN 41 2HB ASN 41 4.333 -5.076 -5.917
330 HD21 ASN 41 2HD2 ASN 41 6.389 -6.078 -4.940
331 HD22 ASN 41 1HD2 ASN 41 7.613 -6.514 -6.080
332 H LYS 42 H LYS 42 2.882 -3.569 -5.420
333 HA LYS 42 HA LYS 42 0.456 -3.005 -6.691
334 HB2 LYS 42 1HB LYS 42 0.610 -5.090 -7.836
335 HB3 LYS 42 2HB LYS 42 1.084 -5.938 -6.370
336 HG2 LYS 42 1HG LYS 42 -1.065 -5.936 -5.516
337 HG3 LYS 42 2HG LYS 42 -1.575 -4.583 -6.529
338 HD2 LYS 42 1HD LYS 42 -1.394 -6.049 -8.513
339 HD3 LYS 42 2HD LYS 42 -0.985 -7.397 -7.448
340 HE2 LYS 42 1HE LYS 42 -3.141 -7.789 -7.091
341 HE3 LYS 42 2HE LYS 42 -3.351 -6.154 -6.468
342 HZ1 LYS 42 3HZ LYS 42 -4.768 -6.811 -8.434
343 HZ2 LYS 42 1HZ LYS 42 -3.358 -6.743 -9.367
344 HZ3 LYS 42 2HZ LYS 42 -3.919 -5.355 -8.580
345 H CYS 43 H CYS 43 -1.203 -2.763 -5.226
346 HA CYS 43 HA CYS 43 -1.178 -3.966 -2.639
347 HB2 CYS 43 1HB CYS 43 -0.733 -2.047 -1.280
348 HB3 CYS 43 2HB CYS 43 0.598 -2.196 -2.420
349 HG CYS 43 HG CYS 43 0.256 0.471 -2.330
350 H THR 44 H THR 44 -3.013 -3.302 -1.326
351 HA THR 44 HA THR 44 -5.044 -1.699 -2.676
352 HB THR 44 HB THR 44 -6.556 -3.819 -1.750
353 HG1 THR 44 1HG THR 44 -4.322 -4.872 -3.175
354 HG21 THR 44 3HG2 THR 44 -7.214 -2.842 -3.744
355 HG22 THR 44 1HG2 THR 44 -6.594 -4.398 -4.294
356 HG23 THR 44 2HG2 THR 44 -5.602 -2.947 -4.449
357 H VAL 45 H VAL 45 -6.869 -1.169 -1.280
358 HA VAL 45 HA VAL 45 -6.554 -1.687 1.563
359 HB VAL 45 HB VAL 45 -6.479 1.125 0.461
360 HG11 VAL 45 1HG1 VAL 45 -6.694 0.096 3.283
361 HG12 VAL 45 2HG1 VAL 45 -6.238 1.752 2.876
362 HG13 VAL 45 3HG1 VAL 45 -7.829 1.137 2.424
363 HG21 VAL 45 3HG2 VAL 45 -4.320 0.063 0.300
364 HG22 VAL 45 1HG2 VAL 45 -4.293 1.226 1.625
365 HG23 VAL 45 2HG2 VAL 45 -4.430 -0.498 1.969
366 H ASP 46 H ASP 46 -8.442 -1.485 2.716
367 HA ASP 46 HA ASP 46 -10.817 -0.601 1.216
368 HB2 ASP 46 1HB ASP 46 -10.308 -3.155 2.646
369 HB3 ASP 46 2HB ASP 46 -11.915 -2.453 2.810
370 H THR 47 H THR 47 -12.384 0.498 2.355
371 HA THR 47 HA THR 47 -11.508 1.797 4.758
372 HB THR 47 HB THR 47 -13.577 3.067 4.635
373 HG1 THR 47 1HG THR 47 -15.144 1.719 3.969
374 HG21 THR 47 3HG2 THR 47 -11.666 2.871 2.510
375 HG22 THR 47 1HG2 THR 47 -12.519 4.295 3.105
376 HG23 THR 47 2HG2 THR 47 -13.243 3.296 1.844
377 H TYR 48 H TYR 48 -13.093 -1.093 4.136
378 HA TYR 48 HA TYR 48 -15.063 -1.309 6.052
379 HB2 TYR 48 1HB TYR 48 -14.707 -3.088 4.474
380 HB3 TYR 48 2HB TYR 48 -13.083 -3.380 5.089
381 HD1 TYR 48 2HD TYR 48 -16.653 -3.429 6.171
382 HD2 TYR 48 1HD TYR 48 -12.747 -5.036 6.682
383 HE1 TYR 48 2HE TYR 48 -17.553 -5.103 7.732
384 HE2 TYR 48 1HE TYR 48 -13.636 -6.715 8.244
385 HH TYR 48 HH TYR 48 -17.058 -7.153 8.719
386 H ASN 49 H ASN 49 -11.649 -2.265 6.472
387 HA ASN 49 HA ASN 49 -11.718 -1.330 9.219
388 HB2 ASN 49 1HB ASN 49 -10.985 -3.446 10.176
389 HB3 ASN 49 2HB ASN 49 -12.531 -3.665 9.361
390 HD21 ASN 49 2HD2 ASN 49 -11.215 -5.880 9.844
391 HD22 ASN 49 1HD2 ASN 49 -10.471 -6.518 8.422
392 H ASN 50 H ASN 50 -10.329 -0.388 6.964
393 HA ASN 50 HA ASN 50 -8.253 0.176 6.210
394 HB2 ASN 50 1HB ASN 50 -8.340 0.696 8.858
395 HB3 ASN 50 2HB ASN 50 -6.983 -0.426 8.819
396 HD21 ASN 50 2HD2 ASN 50 -5.847 0.195 6.400
397 HD22 ASN 50 1HD2 ASN 50 -5.226 1.806 6.453
398 H ALA 51 H ALA 51 -8.858 -2.397 5.546
399 HA ALA 51 HA ALA 51 -6.735 -4.186 6.319
400 HB1 ALA 51 1HB ALA 51 -8.534 -5.478 5.865
401 HB2 ALA 51 2HB ALA 51 -9.174 -4.356 4.664
402 HB3 ALA 51 3HB ALA 51 -7.855 -5.445 4.237
403 H VAL 52 H VAL 52 -4.885 -2.974 5.675
404 HA VAL 52 HA VAL 52 -4.513 -2.339 2.878
405 HB VAL 52 HB VAL 52 -2.475 -2.227 5.104
406 HG11 VAL 52 1HG1 VAL 52 -1.715 -2.203 2.679
407 HG12 VAL 52 2HG1 VAL 52 -2.522 -0.638 2.553
408 HG13 VAL 52 3HG1 VAL 52 -1.189 -0.856 3.688
409 HG21 VAL 52 3HG2 VAL 52 -4.682 -0.397 4.346
410 HG22 VAL 52 1HG2 VAL 52 -3.963 -0.715 5.925
411 HG23 VAL 52 2HG2 VAL 52 -3.133 0.331 4.773
412 H ASP 53 H ASP 53 -3.754 -3.698 1.406
413 HA ASP 53 HA ASP 53 -2.294 -6.088 2.318
414 HB2 ASP 53 1HB ASP 53 -3.883 -5.675 -0.224
415 HB3 ASP 53 2HB ASP 53 -3.039 -7.154 0.226
416 H CYS 54 H CYS 54 -1.098 -6.961 0.095
417 HA CYS 54 HA CYS 54 0.319 -4.832 -1.245
418 HB2 CYS 54 1HB CYS 54 1.375 -5.589 1.149
419 HB3 CYS 54 2HB CYS 54 2.198 -6.695 0.057
420 HG CYS 54 HG CYS 54 2.238 -3.580 -1.093
421 H ASP 55 H ASP 55 2.253 -5.948 -2.529
422 HA ASP 55 HA ASP 55 0.985 -7.927 -4.184
423 HB2 ASP 55 1HB ASP 55 2.513 -6.009 -4.954
424 HB3 ASP 55 2HB ASP 55 3.849 -7.026 -4.422
Start of MODEL 4
1 H1 ALA 1 H ALA 1 -14.164 -0.577 2.164
2 HA ALA 1 HA ALA 1 -15.109 -0.528 -0.616
3 HB1 ALA 1 1HB ALA 1 -13.514 1.810 0.138
4 HB2 ALA 1 2HB ALA 1 -14.966 1.696 -0.858
5 HB3 ALA 1 3HB ALA 1 -15.104 1.735 0.900
6 H LYS 2 H LYS 2 -12.982 0.637 -1.832
7 HA LYS 2 HA LYS 2 -10.594 -0.807 -0.945
8 HB2 LYS 2 1HB LYS 2 -11.932 -1.081 -3.631
9 HB3 LYS 2 2HB LYS 2 -10.231 -1.461 -3.394
10 HG2 LYS 2 1HG LYS 2 -11.047 -3.528 -3.040
11 HG3 LYS 2 2HG LYS 2 -11.286 -2.909 -1.403
12 HD2 LYS 2 1HD LYS 2 -13.510 -3.036 -1.581
13 HD3 LYS 2 2HD LYS 2 -13.503 -2.261 -3.167
14 HE2 LYS 2 1HE LYS 2 -12.752 -4.481 -4.107
15 HE3 LYS 2 2HE LYS 2 -13.099 -5.176 -2.526
16 HZ1 LYS 2 3HZ LYS 2 -14.875 -4.850 -4.579
17 HZ2 LYS 2 1HZ LYS 2 -15.274 -3.608 -3.501
18 HZ3 LYS 2 2HZ LYS 2 -15.260 -5.215 -2.973
19 H TYR 3 H TYR 3 -8.625 -0.097 -2.087
20 HA TYR 3 HA TYR 3 -8.826 2.522 -3.370
21 HB2 TYR 3 1HB TYR 3 -7.433 1.943 -0.778
22 HB3 TYR 3 2HB TYR 3 -6.798 3.183 -1.853
23 HD1 TYR 3 2HD TYR 3 -9.671 2.205 0.236
24 HD2 TYR 3 1HD TYR 3 -7.908 5.290 -2.106
25 HE1 TYR 3 2HE TYR 3 -11.286 3.817 1.154
26 HE2 TYR 3 1HE TYR 3 -9.517 6.910 -1.193
27 HH TYR 3 HH TYR 3 -11.382 7.169 0.023
28 H THR 4 H THR 4 -7.350 2.836 -4.942
29 HA THR 4 HA THR 4 -5.529 0.630 -5.516
30 HB THR 4 HB THR 4 -6.086 3.036 -7.253
31 HG1 THR 4 1HG THR 4 -7.874 2.081 -7.901
32 HG21 THR 4 3HG2 THR 4 -5.089 0.270 -7.943
33 HG22 THR 4 1HG2 THR 4 -4.068 1.699 -7.781
34 HG23 THR 4 2HG2 THR 4 -5.287 1.625 -9.054
35 H GLY 5 H GLY 5 -3.421 0.726 -5.103
36 HA2 GLY 5 1HA GLY 5 -1.978 3.231 -5.285
37 HA3 GLY 5 2HA GLY 5 -2.078 2.562 -3.662
38 H LYS 6 H LYS 6 0.294 3.001 -5.252
39 HA LYS 6 HA LYS 6 1.208 0.216 -5.563
40 HB2 LYS 6 1HB LYS 6 2.588 2.537 -6.867
41 HB3 LYS 6 2HB LYS 6 2.618 0.838 -7.318
42 HG2 LYS 6 1HG LYS 6 1.259 1.608 -8.954
43 HG3 LYS 6 2HG LYS 6 0.035 1.295 -7.721
44 HD2 LYS 6 1HD LYS 6 -0.585 3.423 -7.983
45 HD3 LYS 6 2HD LYS 6 0.908 3.855 -7.146
46 HE2 LYS 6 1HE LYS 6 1.466 4.976 -8.991
47 HE3 LYS 6 2HE LYS 6 1.721 3.405 -9.749
48 HZ1 LYS 6 3HZ LYS 6 0.197 4.120 -11.198
49 HZ2 LYS 6 1HZ LYS 6 -0.384 5.331 -10.168
50 HZ3 LYS 6 2HZ LYS 6 -0.936 3.740 -10.001
51 H CYS 7 H CYS 7 3.662 0.043 -5.268
52 HA CYS 7 HA CYS 7 4.628 1.842 -3.163
53 HB2 CYS 7 1HB CYS 7 4.700 -1.179 -2.998
54 HB3 CYS 7 2HB CYS 7 5.420 -0.070 -1.837
55 HG CYS 7 HG CYS 7 2.742 1.089 -1.385
56 H THR 8 H THR 8 6.938 1.797 -2.863
57 HA THR 8 HA THR 8 8.338 1.033 -5.331
58 HB THR 8 HB THR 8 8.556 3.374 -4.933
59 HG1 THR 8 1HG THR 8 10.683 3.398 -5.168
60 HG21 THR 8 3HG2 THR 8 9.762 4.045 -2.709
61 HG22 THR 8 1HG2 THR 8 9.085 2.530 -2.113
62 HG23 THR 8 2HG2 THR 8 8.016 3.793 -2.725
63 H LYS 9 H LYS 9 10.269 -0.104 -5.272
64 HA LYS 9 HA LYS 9 10.552 -2.081 -3.325
65 HB2 LYS 9 1HB LYS 9 12.857 -2.394 -4.349
66 HB3 LYS 9 2HB LYS 9 11.493 -2.502 -5.454
67 HG2 LYS 9 1HG LYS 9 12.141 -0.709 -6.630
68 HG3 LYS 9 2HG LYS 9 12.635 0.184 -5.190
69 HD2 LYS 9 1HD LYS 9 14.672 -0.154 -6.185
70 HD3 LYS 9 2HD LYS 9 14.580 -1.590 -5.162
71 HE2 LYS 9 1HE LYS 9 14.596 -2.944 -6.930
72 HE3 LYS 9 2HE LYS 9 13.311 -2.033 -7.721
73 HZ1 LYS 9 3HZ LYS 9 15.171 -0.381 -8.271
74 HZ2 LYS 9 1HZ LYS 9 15.097 -1.820 -9.156
75 HZ3 LYS 9 2HZ LYS 9 16.229 -1.650 -7.911
76 H SER 10 H SER 10 11.737 1.167 -3.426
77 HA SER 10 HA SER 10 13.597 0.685 -1.224
78 HB2 SER 10 1HB SER 10 14.039 3.210 -1.580
79 HB3 SER 10 2HB SER 10 14.590 2.088 -2.823
80 HG SER 10 HG SER 10 13.388 4.017 -3.542
81 H LYS 11 H LYS 11 10.525 0.740 -1.159
82 HA LYS 11 HA LYS 11 10.224 1.723 1.436
83 HB2 LYS 11 1HB LYS 11 10.140 3.771 -0.546
84 HB3 LYS 11 2HB LYS 11 8.515 3.572 0.097
85 HG2 LYS 11 1HG LYS 11 11.009 4.111 1.697
86 HG3 LYS 11 2HG LYS 11 9.725 5.266 1.332
87 HD2 LYS 11 1HD LYS 11 8.716 4.625 3.211
88 HD3 LYS 11 2HD LYS 11 8.437 3.053 2.457
89 HE2 LYS 11 1HE LYS 11 10.865 2.549 3.242
90 HE3 LYS 11 2HE LYS 11 10.598 3.897 4.345
91 HZ1 LYS 11 3HZ LYS 11 8.555 2.708 5.094
92 HZ2 LYS 11 1HZ LYS 11 10.001 1.916 5.473
93 HZ3 LYS 11 2HZ LYS 11 9.052 1.371 4.184
94 H ASN 12 H ASN 12 8.908 0.086 1.963
95 HA ASN 12 HA ASN 12 6.748 -0.721 0.207
96 HB2 ASN 12 1HB ASN 12 8.005 -2.465 1.335
97 HB3 ASN 12 2HB ASN 12 7.636 -1.759 2.906
98 HD21 ASN 12 2HD2 ASN 12 6.216 -2.933 3.952
99 HD22 ASN 12 1HD2 ASN 12 4.840 -3.723 3.269
100 H GLU 13 H GLU 13 5.655 1.385 0.373
101 HA GLU 13 HA GLU 13 3.776 1.363 2.618
102 HB2 GLU 13 1HB GLU 13 3.940 3.804 2.863
103 HB3 GLU 13 2HB GLU 13 5.463 3.007 3.233
104 HG2 GLU 13 1HG GLU 13 6.087 3.525 0.796
105 HG3 GLU 13 2HG GLU 13 4.738 4.659 0.846
106 H CYS 14 H CYS 14 1.715 1.842 2.065
107 HA CYS 14 HA CYS 14 1.069 1.959 -0.724
108 HB2 CYS 14 1HB CYS 14 -0.234 0.814 1.223
109 HB3 CYS 14 2HB CYS 14 -0.929 2.411 1.470
110 HG CYS 14 HG CYS 14 -1.254 1.947 -1.674
111 H LYS 15 H LYS 15 1.452 3.816 -1.766
112 HA LYS 15 HA LYS 15 0.940 6.371 -0.471
113 HB2 LYS 15 1HB LYS 15 1.883 7.319 -2.586
114 HB3 LYS 15 2HB LYS 15 2.978 6.244 -1.728
115 HG2 LYS 15 1HG LYS 15 3.150 4.900 -3.481
116 HG3 LYS 15 2HG LYS 15 1.396 4.780 -3.639
117 HD2 LYS 15 1HD LYS 15 1.321 6.312 -5.284
118 HD3 LYS 15 2HD LYS 15 2.516 7.349 -4.503
119 HE2 LYS 15 1HE LYS 15 3.244 4.778 -5.886
120 HE3 LYS 15 2HE LYS 15 3.178 6.326 -6.728
121 HZ1 LYS 15 3HZ LYS 15 4.697 6.964 -4.642
122 HZ2 LYS 15 1HZ LYS 15 5.325 6.408 -6.112
123 HZ3 LYS 15 2HZ LYS 15 5.127 5.337 -4.818
124 H TYR 16 H TYR 16 -1.416 5.162 -0.638
125 HA TYR 16 HA TYR 16 -2.767 5.841 -3.109
126 HB2 TYR 16 1HB TYR 16 -4.676 4.762 -2.193
127 HB3 TYR 16 2HB TYR 16 -3.290 3.793 -1.707
128 HD1 TYR 16 2HD TYR 16 -2.475 3.897 0.638
129 HD2 TYR 16 1HD TYR 16 -6.056 5.846 -0.579
130 HE1 TYR 16 2HE TYR 16 -3.169 4.079 2.991
131 HE2 TYR 16 1HE TYR 16 -6.759 6.035 1.771
132 HH TYR 16 HH TYR 16 -6.092 5.830 3.915
133 H LYS 17 H LYS 17 -5.080 6.880 -2.650
134 HA LYS 17 HA LYS 17 -4.664 9.282 -0.998
135 HB2 LYS 17 1HB LYS 17 -5.880 10.583 -2.715
136 HB3 LYS 17 2HB LYS 17 -4.371 9.910 -3.320
137 HG2 LYS 17 1HG LYS 17 -5.842 7.979 -4.189
138 HG3 LYS 17 2HG LYS 17 -7.181 9.105 -3.950
139 HD2 LYS 17 1HD LYS 17 -6.653 9.624 -6.107
140 HD3 LYS 17 2HD LYS 17 -5.552 10.727 -5.278
141 HE2 LYS 17 1HE LYS 17 -4.191 9.707 -6.861
142 HE3 LYS 17 2HE LYS 17 -3.867 8.780 -5.396
143 HZ1 LYS 17 3HZ LYS 17 -5.612 7.188 -6.226
144 HZ2 LYS 17 1HZ LYS 17 -4.169 7.221 -7.108
145 HZ3 LYS 17 2HZ LYS 17 -5.544 8.000 -7.708
146 H ASN 18 H ASN 18 -6.322 9.879 0.287
147 HA ASN 18 HA ASN 18 -8.850 8.388 0.009
148 HB2 ASN 18 1HB ASN 18 -8.981 8.050 2.291
149 HB3 ASN 18 2HB ASN 18 -7.239 7.956 2.046
150 HD21 ASN 18 2HD2 ASN 18 -6.163 10.204 2.149
151 HD22 ASN 18 1HD2 ASN 18 -6.632 11.181 3.493
152 H ASP 19 H ASP 19 -10.619 9.570 1.407
153 HA ASP 19 HA ASP 19 -11.939 11.400 1.748
154 HB2 ASP 19 1HB ASP 19 -9.678 12.371 2.574
155 HB3 ASP 19 2HB ASP 19 -9.659 13.221 1.032
156 H ALA 20 H ALA 20 -9.692 12.547 -0.770
157 HA ALA 20 HA ALA 20 -11.396 12.074 -2.949
158 HB1 ALA 20 1HB ALA 20 -12.495 14.026 -1.476
159 HB2 ALA 20 2HB ALA 20 -11.433 14.993 -2.500
160 HB3 ALA 20 3HB ALA 20 -12.644 13.939 -3.232
161 H GLY 21 H GLY 21 -8.653 11.821 -2.389
162 HA2 GLY 21 1HA GLY 21 -7.015 12.025 -4.196
163 HA3 GLY 21 2HA GLY 21 -7.534 13.693 -4.380
164 H LYS 22 H LYS 22 -7.337 12.674 -1.148
165 HA LYS 22 HA LYS 22 -5.097 14.432 -0.678
166 HB2 LYS 22 1HB LYS 22 -6.951 12.863 1.092
167 HB3 LYS 22 2HB LYS 22 -5.505 13.621 1.748
168 HG2 LYS 22 1HG LYS 22 -7.205 15.364 0.100
169 HG3 LYS 22 2HG LYS 22 -7.917 14.812 1.618
170 HD2 LYS 22 1HD LYS 22 -6.072 15.704 2.872
171 HD3 LYS 22 2HD LYS 22 -5.197 16.095 1.390
172 HE2 LYS 22 1HE LYS 22 -7.689 17.344 1.148
173 HE3 LYS 22 2HE LYS 22 -7.178 17.629 2.812
174 HZ1 LYS 22 3HZ LYS 22 -6.419 19.141 0.763
175 HZ2 LYS 22 1HZ LYS 22 -5.145 18.027 0.777
176 HZ3 LYS 22 2HZ LYS 22 -5.487 18.939 2.160
177 H ASP 23 H ASP 23 -3.067 13.776 -0.855
178 HA ASP 23 HA ASP 23 -2.186 11.191 -1.249
179 HB2 ASP 23 1HB ASP 23 -0.928 13.762 -0.554
180 HB3 ASP 23 2HB ASP 23 0.001 12.341 -0.086
181 H THR 24 H THR 24 -1.891 9.471 0.008
182 HA THR 24 HA THR 24 -1.580 9.844 2.902
183 HB THR 24 HB THR 24 -3.517 7.908 1.620
184 HG1 THR 24 1HG THR 24 -4.034 10.022 3.456
185 HG21 THR 24 3HG2 THR 24 -2.822 8.315 4.532
186 HG22 THR 24 1HG2 THR 24 -2.391 6.912 3.555
187 HG23 THR 24 2HG2 THR 24 -4.085 7.253 3.912
188 H PHE 25 H PHE 25 -0.075 8.564 3.803
189 HA PHE 25 HA PHE 25 0.908 6.270 2.244
190 HB2 PHE 25 1HB PHE 25 2.605 8.251 3.778
191 HB3 PHE 25 2HB PHE 25 3.201 6.817 2.948
192 HD1 PHE 25 2HD PHE 25 1.534 10.078 2.416
193 HD2 PHE 25 1HD PHE 25 3.718 6.871 0.667
194 HE1 PHE 25 2HE PHE 25 1.799 11.389 0.352
195 HE2 PHE 25 1HE PHE 25 3.988 8.177 -1.400
196 HZ PHE 25 HZ PHE 25 3.027 10.439 -1.561
197 H ILE 26 H ILE 26 1.780 4.534 3.452
198 HA ILE 26 HA ILE 26 1.963 4.498 6.266
199 HB ILE 26 HB ILE 26 -0.449 4.654 6.257
200 HG12 ILE 26 1HG1 ILE 26 -1.003 2.593 7.476
201 HG13 ILE 26 2HG1 ILE 26 0.438 1.817 6.828
202 HG21 ILE 26 1HG2 ILE 26 -1.886 3.157 5.096
203 HG22 ILE 26 2HG2 ILE 26 -0.706 3.752 3.929
204 HG23 ILE 26 3HG2 ILE 26 -0.533 2.135 4.611
205 HD11 ILE 26 3HD1 ILE 26 1.669 2.629 8.472
206 HD12 ILE 26 1HD1 ILE 26 1.147 4.275 8.116
207 HD13 ILE 26 2HD1 ILE 26 0.195 3.262 9.204
208 H LYS 27 H LYS 27 3.412 2.975 6.663
209 HA LYS 27 HA LYS 27 4.276 1.106 4.755
210 HB2 LYS 27 1HB LYS 27 5.543 0.091 6.659
211 HB3 LYS 27 2HB LYS 27 5.784 1.824 6.475
212 HG2 LYS 27 1HG LYS 27 5.258 2.071 8.609
213 HG3 LYS 27 2HG LYS 27 3.619 1.534 8.230
214 HD2 LYS 27 1HD LYS 27 4.850 -0.847 8.370
215 HD3 LYS 27 2HD LYS 27 5.859 0.070 9.491
216 HE2 LYS 27 1HE LYS 27 3.422 0.837 10.328
217 HE3 LYS 27 2HE LYS 27 3.036 -0.772 9.719
218 HZ1 LYS 27 3HZ LYS 27 3.845 -1.600 11.590
219 HZ2 LYS 27 1HZ LYS 27 4.308 -0.064 12.127
220 HZ3 LYS 27 2HZ LYS 27 5.375 -0.995 11.202
221 H CYS 28 H CYS 28 3.232 -0.628 4.054
222 HA CYS 28 HA CYS 28 1.018 -1.773 5.415
223 HB2 CYS 28 1HB CYS 28 2.589 -3.041 3.169
224 HB3 CYS 28 2HB CYS 28 0.907 -3.331 3.599
225 HG CYS 28 HG CYS 28 2.220 -1.001 1.626
226 HA PRO 29 HA PRO 29 2.891 -4.753 8.034
227 HB2 PRO 29 1HB PRO 29 1.046 -6.744 7.962
228 HB3 PRO 29 2HB PRO 29 0.779 -5.217 8.811
229 HG2 PRO 29 1HG PRO 29 -0.172 -6.069 6.104
230 HG3 PRO 29 2HG PRO 29 -1.054 -5.211 7.381
231 HD2 PRO 29 1HD PRO 29 0.007 -3.942 5.237
232 HD3 PRO 29 2HD PRO 29 -0.117 -3.177 6.834
233 H LYS 30 H LYS 30 4.628 -5.067 6.384
234 HA LYS 30 HA LYS 30 4.642 -7.858 5.525
235 HB2 LYS 30 1HB LYS 30 5.335 -5.557 3.687
236 HB3 LYS 30 2HB LYS 30 5.572 -7.259 3.316
237 HG2 LYS 30 1HG LYS 30 2.891 -6.033 3.913
238 HG3 LYS 30 2HG LYS 30 3.547 -6.239 2.287
239 HD2 LYS 30 1HD LYS 30 3.238 -8.491 2.304
240 HD3 LYS 30 2HD LYS 30 3.537 -8.628 4.038
241 HE2 LYS 30 1HE LYS 30 1.242 -7.248 4.094
242 HE3 LYS 30 2HE LYS 30 1.020 -8.104 2.570
243 HZ1 LYS 30 3HZ LYS 30 0.165 -9.613 4.026
244 HZ2 LYS 30 1HZ LYS 30 1.196 -9.169 5.292
245 HZ3 LYS 30 2HZ LYS 30 1.776 -10.127 4.026
246 H PHE 31 H PHE 31 5.988 -7.626 7.573
247 HA PHE 31 HA PHE 31 8.698 -6.661 6.990
248 HB2 PHE 31 1HB PHE 31 8.958 -7.164 9.535
249 HB3 PHE 31 2HB PHE 31 8.068 -5.732 9.027
250 HD1 PHE 31 1HD PHE 31 5.665 -5.603 9.280
251 HD2 PHE 31 2HD PHE 31 7.828 -9.049 10.531
252 HE1 PHE 31 1HE PHE 31 3.710 -6.358 10.568
253 HE2 PHE 31 2HE PHE 31 5.876 -9.810 11.820
254 HZ PHE 31 HZ PHE 31 3.814 -8.465 11.840
255 H ASP 32 H ASP 32 9.987 -8.153 6.143
256 HA ASP 32 HA ASP 32 10.994 -10.147 5.692
257 HB2 ASP 32 1HB ASP 32 10.475 -10.978 8.528
258 HB3 ASP 32 2HB ASP 32 11.902 -11.252 7.535
259 H ASN 33 H ASN 33 8.916 -10.549 4.458
260 HA ASN 33 HA ASN 33 8.145 -13.223 4.748
261 HB2 ASN 33 1HB ASN 33 6.851 -12.591 6.661
262 HB3 ASN 33 2HB ASN 33 6.168 -11.204 5.816
263 HD21 ASN 33 2HD2 ASN 33 6.546 -14.651 5.056
264 HD22 ASN 33 1HD2 ASN 33 4.885 -14.919 4.660
265 H LYS 34 H LYS 34 6.930 -10.051 3.706
266 HA LYS 34 HA LYS 34 6.896 -10.914 0.959
267 HB2 LYS 34 1HB LYS 34 4.375 -10.564 2.527
268 HB3 LYS 34 2HB LYS 34 4.399 -10.065 0.840
269 HG2 LYS 34 1HG LYS 34 3.900 -12.163 0.327
270 HG3 LYS 34 2HG LYS 34 5.544 -12.587 0.812
271 HD2 LYS 34 1HD LYS 34 4.873 -13.477 2.793
272 HD3 LYS 34 2HD LYS 34 3.533 -12.343 2.971
273 HE2 LYS 34 1HE LYS 34 3.004 -13.963 0.706
274 HE3 LYS 34 2HE LYS 34 3.489 -15.028 2.024
275 HZ1 LYS 34 3HZ LYS 34 1.722 -14.370 3.322
276 HZ2 LYS 34 1HZ LYS 34 1.025 -14.364 1.780
277 HZ3 LYS 34 2HZ LYS 34 1.501 -12.909 2.499
278 H LYS 35 H LYS 35 8.504 -9.052 1.727
279 HA LYS 35 HA LYS 35 7.335 -6.422 1.765
280 HB2 LYS 35 1HB LYS 35 10.244 -7.079 1.329
281 HB3 LYS 35 2HB LYS 35 9.555 -5.602 1.989
282 HG2 LYS 35 1HG LYS 35 9.881 -6.424 4.016
283 HG3 LYS 35 2HG LYS 35 8.676 -7.664 3.665
284 HD2 LYS 35 1HD LYS 35 10.341 -9.123 4.006
285 HD3 LYS 35 2HD LYS 35 10.905 -8.639 2.406
286 HE2 LYS 35 1HE LYS 35 12.374 -6.987 3.383
287 HE3 LYS 35 2HE LYS 35 11.744 -7.335 4.993
288 HZ1 LYS 35 3HZ LYS 35 13.209 -8.963 5.206
289 HZ2 LYS 35 1HZ LYS 35 13.879 -8.557 3.707
290 HZ3 LYS 35 2HZ LYS 35 12.655 -9.719 3.799
291 H CYS 36 H CYS 36 7.683 -4.786 0.180
292 HA CYS 36 HA CYS 36 7.069 -5.483 -2.419
293 HB2 CYS 36 1HB CYS 36 6.721 -3.231 -1.632
294 HB3 CYS 36 2HB CYS 36 8.446 -3.004 -1.375
295 HG CYS 36 HG CYS 36 6.914 -1.901 -3.832
296 H THR 37 H THR 37 8.185 -5.989 -4.228
297 HA THR 37 HA THR 37 11.115 -5.866 -4.159
298 HB THR 37 HB THR 37 11.357 -8.109 -5.023
299 HG1 THR 37 1HG THR 37 8.577 -8.536 -4.667
300 HG21 THR 37 3HG2 THR 37 9.541 -8.836 -2.859
301 HG22 THR 37 1HG2 THR 37 10.615 -7.502 -2.441
302 HG23 THR 37 2HG2 THR 37 11.288 -9.040 -2.985
303 H LYS 38 H LYS 38 9.555 -4.061 -5.494
304 HA LYS 38 HA LYS 38 10.550 -4.207 -8.114
305 HB2 LYS 38 1HB LYS 38 8.311 -5.784 -7.850
306 HB3 LYS 38 2HB LYS 38 7.636 -4.269 -8.433
307 HG2 LYS 38 1HG LYS 38 10.024 -5.223 -9.862
308 HG3 LYS 38 2HG LYS 38 8.577 -6.222 -10.028
309 HD2 LYS 38 1HD LYS 38 7.888 -3.446 -10.285
310 HD3 LYS 38 2HD LYS 38 9.198 -3.847 -11.399
311 HE2 LYS 38 1HE LYS 38 7.519 -4.520 -12.737
312 HE3 LYS 38 2HE LYS 38 7.577 -5.980 -11.751
313 HZ1 LYS 38 3HZ LYS 38 5.817 -3.663 -11.166
314 HZ2 LYS 38 1HZ LYS 38 5.791 -5.182 -10.420
315 HZ3 LYS 38 2HZ LYS 38 5.320 -5.025 -12.037
316 H ASP 39 H ASP 39 9.920 -2.360 -9.427
317 HA ASP 39 HA ASP 39 9.472 -0.034 -7.800
318 HB2 ASP 39 1HB ASP 39 10.156 -0.539 -10.666
319 HB3 ASP 39 2HB ASP 39 9.517 1.040 -10.216
320 H ASN 40 H ASN 40 7.553 0.760 -7.290
321 HA ASN 40 HA ASN 40 5.336 1.265 -7.321
322 HB2 ASN 40 1HB ASN 40 6.055 1.280 -10.227
323 HB3 ASN 40 2HB ASN 40 4.362 1.430 -9.763
324 HD21 ASN 40 2HD2 ASN 40 7.284 2.670 -8.206
325 HD22 ASN 40 1HD2 ASN 40 6.838 4.336 -8.301
326 H ASN 41 H ASN 41 5.614 -1.208 -6.556
327 HA ASN 41 HA ASN 41 4.535 -3.252 -8.142
328 HB2 ASN 41 1HB ASN 41 5.537 -3.014 -5.536
329 HB3 ASN 41 2HB ASN 41 3.888 -3.603 -5.343
330 HD21 ASN 41 2HD2 ASN 41 6.603 -4.845 -5.016
331 HD22 ASN 41 1HD2 ASN 41 6.520 -6.307 -5.933
332 H LYS 42 H LYS 42 2.473 -4.397 -6.732
333 HA LYS 42 HA LYS 42 0.284 -2.474 -7.168
334 HB2 LYS 42 1HB LYS 42 0.679 -4.805 -8.503
335 HB3 LYS 42 2HB LYS 42 -0.343 -5.360 -7.184
336 HG2 LYS 42 1HG LYS 42 -2.138 -4.064 -7.853
337 HG3 LYS 42 2HG LYS 42 -1.123 -2.960 -8.784
338 HD2 LYS 42 1HD LYS 42 -2.089 -4.186 -10.470
339 HD3 LYS 42 2HD LYS 42 -0.612 -5.113 -10.192
340 HE2 LYS 42 1HE LYS 42 -1.732 -6.830 -9.133
341 HE3 LYS 42 2HE LYS 42 -3.085 -5.799 -8.668
342 HZ1 LYS 42 3HZ LYS 42 -4.162 -6.583 -10.419
343 HZ2 LYS 42 1HZ LYS 42 -2.799 -7.427 -10.964
344 HZ3 LYS 42 2HZ LYS 42 -3.043 -5.819 -11.430
345 H CYS 43 H CYS 43 -0.565 -1.787 -5.323
346 HA CYS 43 HA CYS 43 -0.778 -3.689 -3.083
347 HB2 CYS 43 1HB CYS 43 0.574 -1.293 -3.093
348 HB3 CYS 43 2HB CYS 43 -0.981 -0.842 -2.403
349 HG CYS 43 HG CYS 43 -0.395 -1.604 -0.033
350 H THR 44 H THR 44 -2.477 -2.349 -1.442
351 HA THR 44 HA THR 44 -4.758 -1.231 -2.635
352 HB THR 44 HB THR 44 -6.054 -3.561 -1.888
353 HG1 THR 44 1HG THR 44 -3.802 -4.481 -2.090
354 HG21 THR 44 3HG2 THR 44 -6.141 -1.876 -3.963
355 HG22 THR 44 1HG2 THR 44 -6.925 -3.455 -3.989
356 HG23 THR 44 2HG2 THR 44 -5.349 -3.240 -4.751
357 H VAL 45 H VAL 45 -6.511 -0.920 -1.128
358 HA VAL 45 HA VAL 45 -6.089 -1.760 1.622
359 HB VAL 45 HB VAL 45 -6.150 1.165 0.864
360 HG11 VAL 45 1HG1 VAL 45 -6.565 -0.269 3.431
361 HG12 VAL 45 2HG1 VAL 45 -5.639 1.233 3.465
362 HG13 VAL 45 3HG1 VAL 45 -7.287 1.226 2.838
363 HG21 VAL 45 3HG2 VAL 45 -3.990 -0.514 2.139
364 HG22 VAL 45 1HG2 VAL 45 -3.965 0.164 0.512
365 HG23 VAL 45 2HG2 VAL 45 -3.925 1.233 1.913
366 H ASP 46 H ASP 46 -7.944 -1.742 2.855
367 HA ASP 46 HA ASP 46 -10.408 -0.952 1.443
368 HB2 ASP 46 1HB ASP 46 -9.751 -3.340 3.120
369 HB3 ASP 46 2HB ASP 46 -11.406 -2.739 3.104
370 H THR 47 H THR 47 -11.708 0.474 2.406
371 HA THR 47 HA THR 47 -10.898 1.728 4.842
372 HB THR 47 HB THR 47 -13.437 2.669 4.392
373 HG1 THR 47 1HG THR 47 -13.661 2.826 2.145
374 HG21 THR 47 3HG2 THR 47 -10.794 3.551 3.239
375 HG22 THR 47 1HG2 THR 47 -11.570 4.118 4.716
376 HG23 THR 47 2HG2 THR 47 -12.266 4.518 3.146
377 H TYR 48 H TYR 48 -12.939 -0.906 4.075
378 HA TYR 48 HA TYR 48 -14.894 -0.846 6.018
379 HB2 TYR 48 1HB TYR 48 -14.603 -2.572 4.200
380 HB3 TYR 48 2HB TYR 48 -13.386 -3.337 5.213
381 HD1 TYR 48 1HD TYR 48 -14.178 -3.911 7.659
382 HD2 TYR 48 2HD TYR 48 -16.797 -3.285 4.365
383 HE1 TYR 48 1HE TYR 48 -15.936 -5.176 8.824
384 HE2 TYR 48 2HE TYR 48 -18.563 -4.547 5.522
385 HH TYR 48 HH TYR 48 -19.103 -5.077 8.036
386 H ASN 49 H ASN 49 -11.664 -2.329 6.308
387 HA ASN 49 HA ASN 49 -11.583 -1.614 9.119
388 HB2 ASN 49 1HB ASN 49 -11.061 -3.925 9.844
389 HB3 ASN 49 2HB ASN 49 -12.699 -3.775 9.213
390 HD21 ASN 49 2HD2 ASN 49 -9.890 -5.538 9.110
391 HD22 ASN 49 1HD2 ASN 49 -10.174 -6.416 7.649
392 H ASN 50 H ASN 50 -10.091 -0.709 6.915
393 HA ASN 50 HA ASN 50 -7.961 -0.392 6.164
394 HB2 ASN 50 1HB ASN 50 -7.941 0.024 8.795
395 HB3 ASN 50 2HB ASN 50 -6.848 -1.356 8.755
396 HD21 ASN 50 2HD2 ASN 50 -7.385 1.561 6.801
397 HD22 ASN 50 1HD2 ASN 50 -5.726 2.040 6.757
398 H ALA 51 H ALA 51 -8.784 -2.659 5.132
399 HA ALA 51 HA ALA 51 -6.940 -4.814 5.797
400 HB1 ALA 51 1HB ALA 51 -9.536 -4.650 4.621
401 HB2 ALA 51 2HB ALA 51 -8.448 -5.480 3.510
402 HB3 ALA 51 3HB ALA 51 -8.648 -6.076 5.158
403 H VAL 52 H VAL 52 -4.954 -3.954 5.135
404 HA VAL 52 HA VAL 52 -4.594 -3.038 2.419
405 HB VAL 52 HB VAL 52 -2.453 -3.630 4.461
406 HG11 VAL 52 1HG1 VAL 52 -1.820 -1.464 2.754
407 HG12 VAL 52 2HG1 VAL 52 -1.044 -3.046 2.848
408 HG13 VAL 52 3HG1 VAL 52 -2.392 -2.789 1.740
409 HG21 VAL 52 3HG2 VAL 52 -3.662 -2.051 5.608
410 HG22 VAL 52 1HG2 VAL 52 -2.609 -1.014 4.646
411 HG23 VAL 52 2HG2 VAL 52 -4.275 -1.292 4.139
412 H ASP 53 H ASP 53 -3.579 -4.099 0.765
413 HA ASP 53 HA ASP 53 -2.783 -6.891 1.254
414 HB2 ASP 53 1HB ASP 53 -4.642 -5.779 -0.809
415 HB3 ASP 53 2HB ASP 53 -3.654 -7.180 -1.216
416 H CYS 54 H CYS 54 -0.934 -7.560 0.292
417 HA CYS 54 HA CYS 54 0.613 -5.520 -1.122
418 HB2 CYS 54 1HB CYS 54 2.563 -6.758 -0.540
419 HB3 CYS 54 2HB CYS 54 1.546 -6.727 0.895
420 HG CYS 54 HG CYS 54 2.826 -9.302 -0.625
421 H ASP 55 H ASP 55 1.857 -6.092 -3.013
422 HA ASP 55 HA ASP 55 0.386 -7.235 -5.051
423 HB2 ASP 55 1HB ASP 55 2.380 -5.745 -5.328
424 HB3 ASP 55 2HB ASP 55 3.406 -7.122 -4.934
Start of MODEL 5
1 H1 ALA 1 H ALA 1 -14.992 -0.488 1.515
2 HA ALA 1 HA ALA 1 -15.651 0.461 -1.010
3 HB1 ALA 1 1HB ALA 1 -13.859 2.540 0.031
4 HB2 ALA 1 2HB ALA 1 -15.210 2.662 -1.098
5 HB3 ALA 1 3HB ALA 1 -15.513 2.609 0.639
6 H LYS 2 H LYS 2 -13.329 1.442 -2.013
7 HA LYS 2 HA LYS 2 -11.161 -0.278 -1.075
8 HB2 LYS 2 1HB LYS 2 -12.178 -0.295 -3.923
9 HB3 LYS 2 2HB LYS 2 -10.738 -1.125 -3.349
10 HG2 LYS 2 1HG LYS 2 -12.254 -2.389 -1.771
11 HG3 LYS 2 2HG LYS 2 -13.606 -1.717 -2.686
12 HD2 LYS 2 1HD LYS 2 -13.197 -3.829 -3.642
13 HD3 LYS 2 2HD LYS 2 -12.473 -2.668 -4.757
14 HE2 LYS 2 1HE LYS 2 -10.381 -3.401 -4.358
15 HE3 LYS 2 2HE LYS 2 -10.684 -3.640 -2.638
16 HZ1 LYS 2 3HZ LYS 2 -12.156 -5.517 -4.155
17 HZ2 LYS 2 1HZ LYS 2 -10.968 -5.796 -2.984
18 HZ3 LYS 2 2HZ LYS 2 -10.526 -5.582 -4.602
19 H TYR 3 H TYR 3 -9.093 0.211 -2.242
20 HA TYR 3 HA TYR 3 -8.959 2.836 -3.485
21 HB2 TYR 3 1HB TYR 3 -7.769 2.188 -0.802
22 HB3 TYR 3 2HB TYR 3 -7.028 3.398 -1.844
23 HD1 TYR 3 2HD TYR 3 -9.997 2.563 0.154
24 HD2 TYR 3 1HD TYR 3 -8.073 5.537 -2.202
25 HE1 TYR 3 2HE TYR 3 -11.584 4.245 0.993
26 HE2 TYR 3 1HE TYR 3 -9.653 7.229 -1.369
27 HH TYR 3 HH TYR 3 -11.801 6.601 1.252
28 H THR 4 H THR 4 -7.084 3.179 -4.687
29 HA THR 4 HA THR 4 -5.531 0.742 -5.208
30 HB THR 4 HB THR 4 -4.795 2.188 -7.269
31 HG1 THR 4 1HG THR 4 -5.783 4.053 -7.320
32 HG21 THR 4 3HG2 THR 4 -6.989 1.475 -8.426
33 HG22 THR 4 1HG2 THR 4 -7.419 0.789 -6.860
34 HG23 THR 4 2HG2 THR 4 -5.978 0.222 -7.707
35 H GLY 5 H GLY 5 -3.292 0.742 -5.233
36 HA2 GLY 5 1HA GLY 5 -1.690 3.060 -4.961
37 HA3 GLY 5 2HA GLY 5 -1.959 2.341 -3.381
38 H LYS 6 H LYS 6 0.386 2.599 -5.391
39 HA LYS 6 HA LYS 6 1.125 -0.239 -5.521
40 HB2 LYS 6 1HB LYS 6 2.772 1.927 -6.758
41 HB3 LYS 6 2HB LYS 6 2.551 0.262 -7.276
42 HG2 LYS 6 1HG LYS 6 1.323 1.293 -8.874
43 HG3 LYS 6 2HG LYS 6 0.064 1.109 -7.651
44 HD2 LYS 6 1HD LYS 6 -0.238 3.314 -7.806
45 HD3 LYS 6 2HD LYS 6 1.313 3.491 -6.979
46 HE2 LYS 6 1HE LYS 6 2.395 4.107 -8.863
47 HE3 LYS 6 2HE LYS 6 1.458 3.017 -9.884
48 HZ1 LYS 6 3HZ LYS 6 -0.204 4.560 -10.158
49 HZ2 LYS 6 1HZ LYS 6 1.155 5.565 -10.102
50 HZ3 LYS 6 2HZ LYS 6 0.170 5.400 -8.738
51 H CYS 7 H CYS 7 3.609 -0.549 -5.264
52 HA CYS 7 HA CYS 7 4.531 0.993 -2.932
53 HB2 CYS 7 1HB CYS 7 4.872 -1.985 -3.337
54 HB3 CYS 7 2HB CYS 7 5.444 -1.052 -1.960
55 HG CYS 7 HG CYS 7 2.668 -2.632 -2.218
56 H THR 8 H THR 8 6.829 1.104 -2.653
57 HA THR 8 HA THR 8 8.275 0.828 -5.201
58 HB THR 8 HB THR 8 9.637 2.647 -4.620
59 HG1 THR 8 1HG THR 8 9.769 3.454 -2.506
60 HG21 THR 8 3HG2 THR 8 7.215 3.676 -3.250
61 HG22 THR 8 1HG2 THR 8 7.012 3.038 -4.880
62 HG23 THR 8 2HG2 THR 8 8.136 4.364 -4.586
63 H LYS 9 H LYS 9 10.308 -0.106 -5.264
64 HA LYS 9 HA LYS 9 10.818 -2.245 -3.554
65 HB2 LYS 9 1HB LYS 9 12.765 -0.755 -5.325
66 HB3 LYS 9 2HB LYS 9 13.038 -2.348 -4.628
67 HG2 LYS 9 1HG LYS 9 10.701 -2.781 -5.890
68 HG3 LYS 9 2HG LYS 9 11.401 -1.542 -6.936
69 HD2 LYS 9 1HD LYS 9 13.439 -3.417 -6.289
70 HD3 LYS 9 2HD LYS 9 12.013 -4.314 -6.817
71 HE2 LYS 9 1HE LYS 9 12.177 -3.572 -8.937
72 HE3 LYS 9 2HE LYS 9 12.668 -1.953 -8.440
73 HZ1 LYS 9 3HZ LYS 9 14.276 -3.994 -9.442
74 HZ2 LYS 9 1HZ LYS 9 14.725 -3.769 -7.826
75 HZ3 LYS 9 2HZ LYS 9 14.757 -2.465 -8.902
76 H SER 10 H SER 10 11.667 1.101 -3.285
77 HA SER 10 HA SER 10 13.506 0.539 -1.071
78 HB2 SER 10 1HB SER 10 14.305 2.773 -1.303
79 HB3 SER 10 2HB SER 10 14.140 2.141 -2.942
80 HG SER 10 HG SER 10 13.212 4.155 -2.913
81 H LYS 11 H LYS 11 10.442 0.453 -1.133
82 HA LYS 11 HA LYS 11 9.990 1.264 1.501
83 HB2 LYS 11 1HB LYS 11 9.754 3.386 -0.454
84 HB3 LYS 11 2HB LYS 11 8.217 3.102 0.351
85 HG2 LYS 11 1HG LYS 11 9.862 3.109 2.479
86 HG3 LYS 11 2HG LYS 11 10.733 4.206 1.404
87 HD2 LYS 11 1HD LYS 11 9.024 5.756 1.386
88 HD3 LYS 11 2HD LYS 11 7.792 4.557 1.783
89 HE2 LYS 11 1HE LYS 11 8.086 5.929 3.704
90 HE3 LYS 11 2HE LYS 11 8.839 4.374 4.054
91 HZ1 LYS 11 3HZ LYS 11 10.193 6.293 4.745
92 HZ2 LYS 11 1HZ LYS 11 10.311 6.781 3.130
93 HZ3 LYS 11 2HZ LYS 11 10.987 5.310 3.620
94 H ASN 12 H ASN 12 8.681 -0.390 1.946
95 HA ASN 12 HA ASN 12 6.655 -1.227 0.037
96 HB2 ASN 12 1HB ASN 12 7.910 -2.997 1.079
97 HB3 ASN 12 2HB ASN 12 7.550 -2.374 2.686
98 HD21 ASN 12 2HD2 ASN 12 5.962 -3.321 3.729
99 HD22 ASN 12 1HD2 ASN 12 4.676 -4.230 3.018
100 H GLU 13 H GLU 13 5.453 0.810 0.276
101 HA GLU 13 HA GLU 13 3.510 0.579 2.455
102 HB2 GLU 13 1HB GLU 13 3.573 2.921 2.962
103 HB3 GLU 13 2HB GLU 13 5.215 2.302 3.068
104 HG2 GLU 13 1HG GLU 13 5.709 3.209 0.861
105 HG3 GLU 13 2HG GLU 13 4.060 3.816 0.737
106 H CYS 14 H CYS 14 1.461 1.546 2.005
107 HA CYS 14 HA CYS 14 0.830 1.499 -0.829
108 HB2 CYS 14 1HB CYS 14 -0.511 0.408 1.142
109 HB3 CYS 14 2HB CYS 14 -1.197 2.018 1.316
110 HG CYS 14 HG CYS 14 -1.303 1.070 -1.845
111 H LYS 15 H LYS 15 1.343 3.359 -1.833
112 HA LYS 15 HA LYS 15 0.823 5.918 -0.557
113 HB2 LYS 15 1HB LYS 15 1.859 6.850 -2.637
114 HB3 LYS 15 2HB LYS 15 2.902 5.754 -1.739
115 HG2 LYS 15 1HG LYS 15 2.764 4.098 -3.336
116 HG3 LYS 15 2HG LYS 15 1.239 4.706 -3.984
117 HD2 LYS 15 1HD LYS 15 3.863 6.170 -4.221
118 HD3 LYS 15 2HD LYS 15 3.235 5.077 -5.456
119 HE2 LYS 15 1HE LYS 15 1.104 6.748 -4.933
120 HE3 LYS 15 2HE LYS 15 2.497 7.824 -4.835
121 HZ1 LYS 15 3HZ LYS 15 3.119 7.319 -7.022
122 HZ2 LYS 15 1HZ LYS 15 1.442 7.535 -7.095
123 HZ3 LYS 15 2HZ LYS 15 2.095 5.976 -7.110
124 H TYR 16 H TYR 16 -1.559 5.155 -0.623
125 HA TYR 16 HA TYR 16 -2.816 5.721 -3.204
126 HB2 TYR 16 1HB TYR 16 -4.798 4.740 -2.323
127 HB3 TYR 16 2HB TYR 16 -3.468 3.708 -1.812
128 HD1 TYR 16 2HD TYR 16 -2.755 3.672 0.538
129 HD2 TYR 16 1HD TYR 16 -6.090 5.994 -0.724
130 HE1 TYR 16 2HE TYR 16 -3.482 3.890 2.877
131 HE2 TYR 16 1HE TYR 16 -6.825 6.219 1.612
132 HH TYR 16 HH TYR 16 -5.256 4.461 4.208
133 H LYS 17 H LYS 17 -5.071 6.882 -2.841
134 HA LYS 17 HA LYS 17 -4.541 9.314 -1.263
135 HB2 LYS 17 1HB LYS 17 -5.840 9.000 -3.966
136 HB3 LYS 17 2HB LYS 17 -6.005 10.462 -3.002
137 HG2 LYS 17 1HG LYS 17 -3.750 11.002 -3.211
138 HG3 LYS 17 2HG LYS 17 -3.306 9.360 -3.687
139 HD2 LYS 17 1HD LYS 17 -5.239 10.606 -5.485
140 HD3 LYS 17 2HD LYS 17 -3.707 11.477 -5.395
141 HE2 LYS 17 1HE LYS 17 -2.505 9.411 -5.911
142 HE3 LYS 17 2HE LYS 17 -4.033 8.536 -5.986
143 HZ1 LYS 17 3HZ LYS 17 -4.325 9.186 -8.070
144 HZ2 LYS 17 1HZ LYS 17 -2.763 9.835 -8.055
145 HZ3 LYS 17 2HZ LYS 17 -4.088 10.814 -7.676
146 H ASN 18 H ASN 18 -6.182 10.154 -0.037
147 HA ASN 18 HA ASN 18 -8.727 8.673 -0.032
148 HB2 ASN 18 1HB ASN 18 -8.748 8.495 2.283
149 HB3 ASN 18 2HB ASN 18 -7.041 8.256 1.923
150 HD21 ASN 18 2HD2 ASN 18 -5.809 10.428 1.803
151 HD22 ASN 18 1HD2 ASN 18 -6.104 11.507 3.122
152 H ASP 19 H ASP 19 -10.467 9.929 1.181
153 HA ASP 19 HA ASP 19 -11.744 11.796 1.475
154 HB2 ASP 19 1HB ASP 19 -9.493 12.693 2.410
155 HB3 ASP 19 2HB ASP 19 -9.381 13.553 0.877
156 H ALA 20 H ALA 20 -9.347 12.884 -0.930
157 HA ALA 20 HA ALA 20 -11.015 12.500 -3.171
158 HB1 ALA 20 1HB ALA 20 -11.983 14.539 -3.575
159 HB2 ALA 20 2HB ALA 20 -12.088 14.472 -1.815
160 HB3 ALA 20 3HB ALA 20 -10.813 15.414 -2.587
161 H GLY 21 H GLY 21 -8.331 11.995 -2.555
162 HA2 GLY 21 1HA GLY 21 -6.623 12.047 -4.296
163 HA3 GLY 21 2HA GLY 21 -6.997 13.750 -4.520
164 H LYS 22 H LYS 22 -6.967 12.739 -1.270
165 HA LYS 22 HA LYS 22 -4.645 14.356 -0.730
166 HB2 LYS 22 1HB LYS 22 -6.920 13.528 0.711
167 HB3 LYS 22 2HB LYS 22 -5.539 12.831 1.548
168 HG2 LYS 22 1HG LYS 22 -5.759 15.742 0.818
169 HG3 LYS 22 2HG LYS 22 -6.245 15.072 2.377
170 HD2 LYS 22 1HD LYS 22 -4.016 14.396 2.872
171 HD3 LYS 22 2HD LYS 22 -3.480 14.740 1.225
172 HE2 LYS 22 1HE LYS 22 -2.728 16.615 2.304
173 HE3 LYS 22 2HE LYS 22 -4.329 17.160 1.804
174 HZ1 LYS 22 3HZ LYS 22 -3.870 15.928 4.452
175 HZ2 LYS 22 1HZ LYS 22 -5.168 16.890 3.949
176 HZ3 LYS 22 2HZ LYS 22 -3.645 17.585 4.197
177 H ASP 23 H ASP 23 -2.658 13.590 -0.963
178 HA ASP 23 HA ASP 23 -1.910 10.960 -1.342
179 HB2 ASP 23 1HB ASP 23 -0.528 13.476 -0.722
180 HB3 ASP 23 2HB ASP 23 0.338 12.036 -0.193
181 H THR 24 H THR 24 -1.642 9.241 -0.073
182 HA THR 24 HA THR 24 -1.289 9.625 2.813
183 HB THR 24 HB THR 24 -3.337 7.771 1.583
184 HG1 THR 24 1HG THR 24 -3.791 10.131 1.879
185 HG21 THR 24 3HG2 THR 24 -3.905 7.173 3.887
186 HG22 THR 24 1HG2 THR 24 -2.589 8.187 4.481
187 HG23 THR 24 2HG2 THR 24 -2.232 6.752 3.520
188 H PHE 25 H PHE 25 0.190 8.304 3.686
189 HA PHE 25 HA PHE 25 1.018 5.934 2.151
190 HB2 PHE 25 1HB PHE 25 2.855 7.842 3.615
191 HB3 PHE 25 2HB PHE 25 3.349 6.380 2.770
192 HD1 PHE 25 1HD PHE 25 1.859 9.731 2.296
193 HD2 PHE 25 2HD PHE 25 3.766 6.397 0.462
194 HE1 PHE 25 1HE PHE 25 2.122 11.027 0.222
195 HE2 PHE 25 2HE PHE 25 4.033 7.689 -1.616
196 HZ PHE 25 HZ PHE 25 3.211 10.007 -1.737
197 H ILE 26 H ILE 26 1.329 4.096 3.292
198 HA ILE 26 HA ILE 26 1.717 4.132 6.150
199 HB ILE 26 HB ILE 26 -0.688 4.382 6.105
200 HG12 ILE 26 1HG1 ILE 26 -1.334 2.354 7.345
201 HG13 ILE 26 2HG1 ILE 26 0.097 1.528 6.740
202 HG21 ILE 26 1HG2 ILE 26 -1.991 3.492 4.541
203 HG22 ILE 26 2HG2 ILE 26 -0.538 2.853 3.776
204 HG23 ILE 26 3HG2 ILE 26 -1.435 1.864 4.926
205 HD11 ILE 26 3HD1 ILE 26 0.073 2.577 9.122
206 HD12 ILE 26 1HD1 ILE 26 1.512 2.696 8.110
207 HD13 ILE 26 2HD1 ILE 26 0.416 4.071 8.252
208 H LYS 27 H LYS 27 3.085 2.547 6.599
209 HA LYS 27 HA LYS 27 3.958 0.651 4.745
210 HB2 LYS 27 1HB LYS 27 5.080 -0.434 6.673
211 HB3 LYS 27 2HB LYS 27 5.349 1.302 6.611
212 HG2 LYS 27 1HG LYS 27 3.483 1.541 8.281
213 HG3 LYS 27 2HG LYS 27 3.525 -0.215 8.454
214 HD2 LYS 27 1HD LYS 27 6.027 0.084 8.927
215 HD3 LYS 27 2HD LYS 27 5.648 1.794 9.148
216 HE2 LYS 27 1HE LYS 27 3.725 0.605 10.666
217 HE3 LYS 27 2HE LYS 27 5.073 -0.513 10.872
218 HZ1 LYS 27 3HZ LYS 27 6.437 1.533 11.400
219 HZ2 LYS 27 1HZ LYS 27 5.303 1.065 12.564
220 HZ3 LYS 27 2HZ LYS 27 4.972 2.368 11.538
221 H CYS 28 H CYS 28 3.306 -1.344 4.196
222 HA CYS 28 HA CYS 28 0.814 -2.318 5.317
223 HB2 CYS 28 1HB CYS 28 2.456 -3.574 3.116
224 HB3 CYS 28 2HB CYS 28 0.751 -3.836 3.464
225 HG CYS 28 HG CYS 28 2.136 -1.633 1.473
226 HA PRO 29 HA PRO 29 2.504 -5.393 7.952
227 HB2 PRO 29 1HB PRO 29 0.615 -7.334 7.765
228 HB3 PRO 29 2HB PRO 29 0.351 -5.818 8.633
229 HG2 PRO 29 1HG PRO 29 -0.508 -6.593 5.872
230 HG3 PRO 29 2HG PRO 29 -1.421 -5.736 7.129
231 HD2 PRO 29 1HD PRO 29 -0.240 -4.454 5.057
232 HD3 PRO 29 2HD PRO 29 -0.411 -3.717 6.663
233 H LYS 30 H LYS 30 4.278 -5.687 6.302
234 HA LYS 30 HA LYS 30 4.369 -8.484 5.537
235 HB2 LYS 30 1HB LYS 30 4.462 -6.223 3.565
236 HB3 LYS 30 2HB LYS 30 5.337 -7.715 3.246
237 HG2 LYS 30 1HG LYS 30 2.380 -7.525 3.779
238 HG3 LYS 30 2HG LYS 30 3.124 -7.663 2.184
239 HD2 LYS 30 1HD LYS 30 3.343 -9.872 2.396
240 HD3 LYS 30 2HD LYS 30 4.095 -9.708 3.984
241 HE2 LYS 30 1HE LYS 30 2.179 -10.153 5.068
242 HE3 LYS 30 2HE LYS 30 1.214 -9.181 3.957
243 HZ1 LYS 30 3HZ LYS 30 1.672 -11.151 2.351
244 HZ2 LYS 30 1HZ LYS 30 0.456 -11.283 3.519
245 HZ3 LYS 30 2HZ LYS 30 1.958 -12.018 3.775
246 H PHE 31 H PHE 31 5.729 -7.305 7.578
247 HA PHE 31 HA PHE 31 8.346 -6.463 6.715
248 HB2 PHE 31 1HB PHE 31 8.871 -6.292 9.071
249 HB3 PHE 31 2HB PHE 31 7.275 -5.602 8.793
250 HD1 PHE 31 2HD PHE 31 5.267 -6.770 9.554
251 HD2 PHE 31 1HD PHE 31 9.163 -8.269 10.382
252 HE1 PHE 31 2HE PHE 31 4.326 -8.249 11.280
253 HE2 PHE 31 1HE PHE 31 8.229 -9.751 12.110
254 HZ PHE 31 HZ PHE 31 5.809 -9.742 12.562
255 H ASP 32 H ASP 32 10.086 -7.696 6.397
256 HA ASP 32 HA ASP 32 11.345 -9.571 6.075
257 HB2 ASP 32 1HB ASP 32 10.230 -10.301 8.793
258 HB3 ASP 32 2HB ASP 32 11.682 -10.971 8.052
259 H ASN 33 H ASN 33 9.427 -9.940 4.465
260 HA ASN 33 HA ASN 33 8.986 -12.693 4.292
261 HB2 ASN 33 1HB ASN 33 7.280 -11.653 6.155
262 HB3 ASN 33 2HB ASN 33 6.302 -11.548 4.695
263 HD21 ASN 33 2HD2 ASN 33 5.615 -13.170 6.816
264 HD22 ASN 33 1HD2 ASN 33 5.750 -14.823 6.332
265 H LYS 34 H LYS 34 7.893 -9.464 3.462
266 HA LYS 34 HA LYS 34 8.187 -9.876 0.695
267 HB2 LYS 34 1HB LYS 34 5.983 -11.143 1.360
268 HB3 LYS 34 2HB LYS 34 5.291 -9.526 1.372
269 HG2 LYS 34 1HG LYS 34 4.870 -10.004 -0.785
270 HG3 LYS 34 2HG LYS 34 6.535 -9.458 -1.002
271 HD2 LYS 34 1HD LYS 34 6.864 -12.099 -0.354
272 HD3 LYS 34 2HD LYS 34 5.374 -12.127 -1.299
273 HE2 LYS 34 1HE LYS 34 6.486 -10.977 -3.126
274 HE3 LYS 34 2HE LYS 34 7.964 -10.851 -2.174
275 HZ1 LYS 34 3HZ LYS 34 8.442 -12.702 -3.365
276 HZ2 LYS 34 1HZ LYS 34 6.824 -13.167 -3.538
277 HZ3 LYS 34 2HZ LYS 34 7.635 -13.452 -2.081
278 H LYS 35 H LYS 35 9.252 -7.940 2.067
279 HA LYS 35 HA LYS 35 7.588 -5.596 2.236
280 HB2 LYS 35 1HB LYS 35 10.472 -6.206 2.739
281 HB3 LYS 35 2HB LYS 35 9.979 -4.531 2.539
282 HG2 LYS 35 1HG LYS 35 8.214 -5.061 4.335
283 HG3 LYS 35 2HG LYS 35 9.210 -6.479 4.677
284 HD2 LYS 35 1HD LYS 35 9.929 -4.771 6.160
285 HD3 LYS 35 2HD LYS 35 11.167 -4.903 4.908
286 HE2 LYS 35 1HE LYS 35 10.748 -2.840 4.099
287 HE3 LYS 35 2HE LYS 35 9.008 -2.987 4.343
288 HZ1 LYS 35 3HZ LYS 35 9.681 -1.346 5.832
289 HZ2 LYS 35 1HZ LYS 35 11.073 -2.186 6.298
290 HZ3 LYS 35 2HZ LYS 35 9.552 -2.728 6.799
291 H CYS 36 H CYS 36 7.144 -6.273 -0.227
292 HA CYS 36 HA CYS 36 7.156 -5.531 -2.376
293 HB2 CYS 36 1HB CYS 36 7.202 -3.293 -1.260
294 HB3 CYS 36 2HB CYS 36 8.958 -3.322 -1.368
295 HG CYS 36 HG CYS 36 6.994 -2.013 -3.467
296 H THR 37 H THR 37 8.339 -5.824 -4.252
297 HA THR 37 HA THR 37 11.219 -6.077 -4.147
298 HB THR 37 HB THR 37 11.048 -8.424 -5.204
299 HG1 THR 37 1HG THR 37 8.708 -8.654 -3.646
300 HG21 THR 37 3HG2 THR 37 10.276 -8.609 -2.349
301 HG22 THR 37 1HG2 THR 37 11.684 -7.620 -2.732
302 HG23 THR 37 2HG2 THR 37 11.647 -9.320 -3.199
303 H LYS 38 H LYS 38 9.457 -4.364 -5.563
304 HA LYS 38 HA LYS 38 10.532 -4.511 -8.145
305 HB2 LYS 38 1HB LYS 38 8.763 -5.263 -9.502
306 HB3 LYS 38 2HB LYS 38 8.855 -6.440 -8.198
307 HG2 LYS 38 1HG LYS 38 6.623 -6.124 -8.177
308 HG3 LYS 38 2HG LYS 38 7.063 -4.771 -7.132
309 HD2 LYS 38 1HD LYS 38 6.149 -3.353 -8.579
310 HD3 LYS 38 2HD LYS 38 7.258 -3.908 -9.835
311 HE2 LYS 38 1HE LYS 38 4.836 -5.527 -9.181
312 HE3 LYS 38 2HE LYS 38 4.671 -4.082 -10.176
313 HZ1 LYS 38 3HZ LYS 38 6.677 -5.210 -11.429
314 HZ2 LYS 38 1HZ LYS 38 5.072 -5.612 -11.783
315 HZ3 LYS 38 2HZ LYS 38 5.994 -6.616 -10.782
316 H ASP 39 H ASP 39 10.441 -2.534 -9.020
317 HA ASP 39 HA ASP 39 9.450 -0.333 -7.681
318 HB2 ASP 39 1HB ASP 39 10.503 -0.866 -10.372
319 HB3 ASP 39 2HB ASP 39 9.427 0.527 -10.284
320 H ASN 40 H ASN 40 7.461 0.346 -7.280
321 HA ASN 40 HA ASN 40 5.222 0.719 -7.436
322 HB2 ASN 40 1HB ASN 40 6.156 0.727 -10.233
323 HB3 ASN 40 2HB ASN 40 4.432 0.431 -10.028
324 HD21 ASN 40 2HD2 ASN 40 6.773 2.484 -8.328
325 HD22 ASN 40 1HD2 ASN 40 5.883 3.952 -8.524
326 H ASN 41 H ASN 41 5.072 -1.347 -6.260
327 HA ASN 41 HA ASN 41 4.383 -3.720 -7.732
328 HB2 ASN 41 1HB ASN 41 5.225 -3.145 -5.112
329 HB3 ASN 41 2HB ASN 41 3.606 -3.819 -4.952
330 HD21 ASN 41 2HD2 ASN 41 6.239 -4.908 -4.229
331 HD22 ASN 41 1HD2 ASN 41 6.351 -6.430 -5.040
332 H LYS 42 H LYS 42 2.301 -4.784 -6.262
333 HA LYS 42 HA LYS 42 0.062 -2.999 -6.961
334 HB2 LYS 42 1HB LYS 42 0.594 -5.332 -8.198
335 HB3 LYS 42 2HB LYS 42 -0.395 -5.928 -6.870
336 HG2 LYS 42 1HG LYS 42 -2.265 -4.705 -7.561
337 HG3 LYS 42 2HG LYS 42 -1.304 -3.662 -8.611
338 HD2 LYS 42 1HD LYS 42 -1.375 -5.121 -10.318
339 HD3 LYS 42 2HD LYS 42 -1.119 -6.512 -9.262
340 HE2 LYS 42 1HE LYS 42 -3.266 -6.830 -10.137
341 HE3 LYS 42 2HE LYS 42 -3.542 -6.172 -8.526
342 HZ1 LYS 42 3HZ LYS 42 -4.948 -5.132 -10.220
343 HZ2 LYS 42 1HZ LYS 42 -3.571 -4.584 -11.035
344 HZ3 LYS 42 2HZ LYS 42 -3.919 -4.009 -9.484
345 H CYS 43 H CYS 43 -0.939 -2.276 -5.210
346 HA CYS 43 HA CYS 43 -1.337 -4.126 -2.956
347 HB2 CYS 43 1HB CYS 43 0.207 -1.770 -2.926
348 HB3 CYS 43 2HB CYS 43 -1.281 -1.385 -2.069
349 HG CYS 43 HG CYS 43 1.069 -3.715 -1.265
350 H THR 44 H THR 44 -2.944 -2.677 -1.357
351 HA THR 44 HA THR 44 -5.012 -1.247 -2.636
352 HB THR 44 HB THR 44 -6.609 -3.404 -1.950
353 HG1 THR 44 1HG THR 44 -4.686 -4.488 -3.691
354 HG21 THR 44 3HG2 THR 44 -7.361 -2.381 -3.822
355 HG22 THR 44 1HG2 THR 44 -6.452 -3.652 -4.638
356 HG23 THR 44 2HG2 THR 44 -5.735 -2.055 -4.424
357 H VAL 45 H VAL 45 -6.857 -0.845 -1.199
358 HA VAL 45 HA VAL 45 -6.509 -1.633 1.585
359 HB VAL 45 HB VAL 45 -6.555 1.267 0.735
360 HG11 VAL 45 1HG1 VAL 45 -6.973 -0.090 3.347
361 HG12 VAL 45 2HG1 VAL 45 -6.080 1.432 3.329
362 HG13 VAL 45 3HG1 VAL 45 -7.725 1.367 2.695
363 HG21 VAL 45 3HG2 VAL 45 -4.406 -0.330 2.128
364 HG22 VAL 45 1HG2 VAL 45 -4.370 0.193 0.444
365 HG23 VAL 45 2HG2 VAL 45 -4.339 1.389 1.741
366 H ASP 46 H ASP 46 -8.385 -1.565 2.787
367 HA ASP 46 HA ASP 46 -10.818 -0.782 1.320
368 HB2 ASP 46 1HB ASP 46 -10.098 -3.310 2.384
369 HB3 ASP 46 2HB ASP 46 -11.403 -2.680 3.385
370 H THR 47 H THR 47 -12.417 0.312 2.419
371 HA THR 47 HA THR 47 -11.553 1.719 4.792
372 HB THR 47 HB THR 47 -14.004 2.685 4.491
373 HG1 THR 47 1HG THR 47 -14.887 1.650 2.841
374 HG21 THR 47 3HG2 THR 47 -12.410 4.282 4.190
375 HG22 THR 47 1HG2 THR 47 -12.897 4.094 2.506
376 HG23 THR 47 2HG2 THR 47 -11.452 3.278 3.103
377 H TYR 48 H TYR 48 -13.393 -1.057 4.088
378 HA TYR 48 HA TYR 48 -15.353 -1.111 6.026
379 HB2 TYR 48 1HB TYR 48 -15.238 -2.875 4.412
380 HB3 TYR 48 2HB TYR 48 -13.629 -3.344 4.949
381 HD1 TYR 48 2HD TYR 48 -17.118 -3.032 6.245
382 HD2 TYR 48 1HD TYR 48 -13.417 -5.125 6.414
383 HE1 TYR 48 2HE TYR 48 -18.115 -4.660 7.795
384 HE2 TYR 48 1HE TYR 48 -14.405 -6.759 7.962
385 HH TYR 48 HH TYR 48 -17.282 -6.258 9.574
386 H ASN 49 H ASN 49 -12.044 -2.403 6.363
387 HA ASN 49 HA ASN 49 -12.001 -1.577 9.146
388 HB2 ASN 49 1HB ASN 49 -11.358 -3.827 9.953
389 HB3 ASN 49 2HB ASN 49 -12.998 -3.793 9.309
390 HD21 ASN 49 2HD2 ASN 49 -12.045 -6.189 9.502
391 HD22 ASN 49 1HD2 ASN 49 -11.512 -6.826 7.987
392 H ASN 50 H ASN 50 -10.559 -0.670 6.908
393 HA ASN 50 HA ASN 50 -8.448 -0.262 6.145
394 HB2 ASN 50 1HB ASN 50 -8.442 0.298 8.724
395 HB3 ASN 50 2HB ASN 50 -7.339 -1.073 8.801
396 HD21 ASN 50 2HD2 ASN 50 -7.870 1.799 6.780
397 HD22 ASN 50 1HD2 ASN 50 -6.204 2.252 6.693
398 H ALA 51 H ALA 51 -9.108 -2.574 5.151
399 HA ALA 51 HA ALA 51 -7.319 -4.700 5.941
400 HB1 ALA 51 1HB ALA 51 -8.312 -5.639 3.669
401 HB2 ALA 51 2HB ALA 51 -9.239 -5.649 5.170
402 HB3 ALA 51 3HB ALA 51 -9.515 -4.385 3.972
403 H VAL 52 H VAL 52 -5.241 -3.911 5.616
404 HA VAL 52 HA VAL 52 -4.442 -2.814 3.074
405 HB VAL 52 HB VAL 52 -2.760 -3.676 5.432
406 HG11 VAL 52 1HG1 VAL 52 -1.339 -3.677 3.554
407 HG12 VAL 52 2HG1 VAL 52 -2.082 -2.220 2.891
408 HG13 VAL 52 3HG1 VAL 52 -1.079 -2.120 4.338
409 HG21 VAL 52 3HG2 VAL 52 -4.256 -1.217 4.784
410 HG22 VAL 52 1HG2 VAL 52 -3.791 -1.888 6.349
411 HG23 VAL 52 2HG2 VAL 52 -2.616 -0.986 5.391
412 H ASP 53 H ASP 53 -4.337 -4.132 1.372
413 HA ASP 53 HA ASP 53 -3.587 -6.915 1.676
414 HB2 ASP 53 1HB ASP 53 -5.334 -5.725 0.012
415 HB3 ASP 53 2HB ASP 53 -3.912 -5.738 -1.028
416 H CYS 54 H CYS 54 -2.200 -7.545 -0.535
417 HA CYS 54 HA CYS 54 0.091 -5.806 -0.840
418 HB2 CYS 54 1HB CYS 54 1.737 -7.306 0.019
419 HB3 CYS 54 2HB CYS 54 0.512 -7.128 1.268
420 HG CYS 54 HG CYS 54 -0.768 -9.591 0.411
421 H ASP 55 H ASP 55 1.576 -6.554 -2.491
422 HA ASP 55 HA ASP 55 0.248 -7.625 -4.732
423 HB2 ASP 55 1HB ASP 55 2.214 -6.067 -4.800
424 HB3 ASP 55 2HB ASP 55 3.237 -7.421 -4.329
Start of MODEL 6
1 H1 ALA 1 H ALA 1 -16.498 1.301 1.702
2 HA ALA 1 HA ALA 1 -15.802 2.486 -0.855
3 HB1 ALA 1 1HB ALA 1 -14.052 3.651 0.695
4 HB2 ALA 1 2HB ALA 1 -15.754 4.111 0.772
5 HB3 ALA 1 3HB ALA 1 -15.078 3.027 1.988
6 H LYS 2 H LYS 2 -13.234 2.852 -0.983
7 HA LYS 2 HA LYS 2 -11.531 0.763 -0.185
8 HB2 LYS 2 1HB LYS 2 -13.219 0.103 -2.376
9 HB3 LYS 2 2HB LYS 2 -11.587 0.293 -3.002
10 HG2 LYS 2 1HG LYS 2 -10.881 -1.241 -1.070
11 HG3 LYS 2 2HG LYS 2 -12.597 -1.636 -0.948
12 HD2 LYS 2 1HD LYS 2 -11.443 -1.739 -3.661
13 HD3 LYS 2 2HD LYS 2 -10.855 -2.959 -2.529
14 HE2 LYS 2 1HE LYS 2 -12.676 -4.063 -3.340
15 HE3 LYS 2 2HE LYS 2 -13.445 -3.191 -2.015
16 HZ1 LYS 2 3HZ LYS 2 -14.194 -3.116 -4.635
17 HZ2 LYS 2 1HZ LYS 2 -13.365 -1.656 -4.426
18 HZ3 LYS 2 2HZ LYS 2 -14.682 -2.031 -3.432
19 H TYR 3 H TYR 3 -9.386 1.008 -0.982
20 HA TYR 3 HA TYR 3 -8.928 3.442 -2.571
21 HB2 TYR 3 1HB TYR 3 -7.311 2.627 -0.149
22 HB3 TYR 3 2HB TYR 3 -7.091 4.078 -1.121
23 HD1 TYR 3 2HD TYR 3 -9.887 4.984 -1.439
24 HD2 TYR 3 1HD TYR 3 -7.867 3.432 1.969
25 HE1 TYR 3 2HE TYR 3 -11.435 6.207 0.029
26 HE2 TYR 3 1HE TYR 3 -9.410 4.649 3.447
27 HH TYR 3 HH TYR 3 -11.824 6.873 2.150
28 H THR 4 H THR 4 -7.232 3.385 -3.996
29 HA THR 4 HA THR 4 -5.697 0.875 -4.140
30 HB THR 4 HB THR 4 -6.573 2.374 -6.600
31 HG1 THR 4 1HG THR 4 -8.502 1.573 -6.318
32 HG21 THR 4 3HG2 THR 4 -5.081 0.927 -7.457
33 HG22 THR 4 1HG2 THR 4 -6.339 -0.283 -7.212
34 HG23 THR 4 2HG2 THR 4 -5.073 -0.070 -6.003
35 H GLY 5 H GLY 5 -3.641 1.043 -5.266
36 HA2 GLY 5 1HA GLY 5 -2.510 3.468 -6.120
37 HA3 GLY 5 2HA GLY 5 -2.117 3.248 -4.421
38 H LYS 6 H LYS 6 0.064 2.945 -4.686
39 HA LYS 6 HA LYS 6 0.834 0.335 -5.736
40 HB2 LYS 6 1HB LYS 6 2.653 2.555 -6.481
41 HB3 LYS 6 2HB LYS 6 2.295 1.059 -7.333
42 HG2 LYS 6 1HG LYS 6 0.072 2.038 -7.935
43 HG3 LYS 6 2HG LYS 6 0.637 3.567 -7.260
44 HD2 LYS 6 1HD LYS 6 1.098 3.770 -9.536
45 HD3 LYS 6 2HD LYS 6 2.646 3.280 -8.845
46 HE2 LYS 6 1HE LYS 6 2.192 0.961 -9.482
47 HE3 LYS 6 2HE LYS 6 0.646 1.452 -10.172
48 HZ1 LYS 6 3HZ LYS 6 3.102 2.755 -11.114
49 HZ2 LYS 6 1HZ LYS 6 1.651 2.475 -11.937
50 HZ3 LYS 6 2HZ LYS 6 2.735 1.203 -11.675
51 H CYS 7 H CYS 7 3.464 0.309 -5.424
52 HA CYS 7 HA CYS 7 4.139 1.489 -2.842
53 HB2 CYS 7 1HB CYS 7 4.010 -1.470 -3.399
54 HB3 CYS 7 2HB CYS 7 5.023 -0.809 -2.121
55 HG CYS 7 HG CYS 7 2.831 0.384 -0.774
56 H THR 8 H THR 8 6.448 1.196 -2.300
57 HA THR 8 HA THR 8 8.074 1.075 -4.755
58 HB THR 8 HB THR 8 9.574 2.662 -3.837
59 HG1 THR 8 1HG THR 8 8.128 2.488 -1.385
60 HG21 THR 8 3HG2 THR 8 7.251 3.463 -4.590
61 HG22 THR 8 1HG2 THR 8 8.244 4.583 -3.660
62 HG23 THR 8 2HG2 THR 8 6.928 3.710 -2.874
63 H LYS 9 H LYS 9 9.781 -0.275 -4.854
64 HA LYS 9 HA LYS 9 10.005 -2.442 -3.106
65 HB2 LYS 9 1HB LYS 9 12.205 -2.845 -4.263
66 HB3 LYS 9 2HB LYS 9 10.820 -2.677 -5.333
67 HG2 LYS 9 1HG LYS 9 11.571 -0.738 -6.231
68 HG3 LYS 9 2HG LYS 9 12.359 -0.222 -4.739
69 HD2 LYS 9 1HD LYS 9 14.214 -0.706 -5.969
70 HD3 LYS 9 2HD LYS 9 13.911 -2.308 -5.292
71 HE2 LYS 9 1HE LYS 9 12.687 -1.493 -7.902
72 HE3 LYS 9 2HE LYS 9 14.351 -2.070 -7.833
73 HZ1 LYS 9 3HZ LYS 9 12.716 -3.834 -8.308
74 HZ2 LYS 9 1HZ LYS 9 12.016 -3.576 -6.790
75 HZ3 LYS 9 2HZ LYS 9 13.610 -4.130 -6.901
76 H SER 10 H SER 10 11.538 0.692 -3.079
77 HA SER 10 HA SER 10 13.514 -0.035 -1.112
78 HB2 SER 10 1HB SER 10 14.064 2.368 -1.106
79 HB3 SER 10 2HB SER 10 13.990 1.731 -2.749
80 HG SER 10 HG SER 10 12.166 3.405 -1.408
81 H LYS 11 H LYS 11 10.268 1.144 -1.118
82 HA LYS 11 HA LYS 11 10.305 1.186 1.812
83 HB2 LYS 11 1HB LYS 11 10.320 3.527 0.473
84 HB3 LYS 11 2HB LYS 11 8.588 3.219 0.508
85 HG2 LYS 11 1HG LYS 11 9.033 4.528 2.400
86 HG3 LYS 11 2HG LYS 11 8.840 2.882 3.006
87 HD2 LYS 11 1HD LYS 11 10.744 3.516 4.120
88 HD3 LYS 11 2HD LYS 11 11.448 2.800 2.668
89 HE2 LYS 11 1HE LYS 11 12.540 4.895 3.114
90 HE3 LYS 11 2HE LYS 11 11.555 5.062 1.662
91 HZ1 LYS 11 3HZ LYS 11 10.612 6.803 2.626
92 HZ2 LYS 11 1HZ LYS 11 11.413 6.516 4.087
93 HZ3 LYS 11 2HZ LYS 11 9.928 5.770 3.777
94 H ASN 12 H ASN 12 9.027 -0.492 2.276
95 HA ASN 12 HA ASN 12 6.786 -1.210 0.618
96 HB2 ASN 12 1HB ASN 12 8.046 -2.995 1.638
97 HB3 ASN 12 2HB ASN 12 7.802 -2.312 3.243
98 HD21 ASN 12 2HD2 ASN 12 6.217 -3.127 4.403
99 HD22 ASN 12 1HD2 ASN 12 4.871 -4.024 3.796
100 H GLU 13 H GLU 13 5.709 0.907 0.886
101 HA GLU 13 HA GLU 13 3.920 0.827 3.209
102 HB2 GLU 13 1HB GLU 13 4.113 3.154 3.630
103 HB3 GLU 13 2HB GLU 13 5.756 2.537 3.519
104 HG2 GLU 13 1HG GLU 13 5.483 3.259 0.997
105 HG3 GLU 13 2HG GLU 13 4.276 4.340 1.688
106 H CYS 14 H CYS 14 1.822 1.184 2.745
107 HA CYS 14 HA CYS 14 0.999 1.230 0.021
108 HB2 CYS 14 1HB CYS 14 -0.206 0.748 2.581
109 HB3 CYS 14 2HB CYS 14 -1.202 1.881 1.677
110 HG CYS 14 HG CYS 14 -2.124 0.222 -0.106
111 H LYS 15 H LYS 15 1.362 3.032 -1.128
112 HA LYS 15 HA LYS 15 0.809 5.644 0.065
113 HB2 LYS 15 1HB LYS 15 1.893 6.555 -1.953
114 HB3 LYS 15 2HB LYS 15 2.927 5.412 -1.107
115 HG2 LYS 15 1HG LYS 15 2.942 3.954 -2.817
116 HG3 LYS 15 2HG LYS 15 1.252 4.258 -3.229
117 HD2 LYS 15 1HD LYS 15 2.078 6.529 -4.094
118 HD3 LYS 15 2HD LYS 15 3.693 5.819 -4.021
119 HE2 LYS 15 1HE LYS 15 3.348 4.593 -5.859
120 HE3 LYS 15 2HE LYS 15 1.745 4.089 -5.325
121 HZ1 LYS 15 3HZ LYS 15 1.620 5.376 -7.357
122 HZ2 LYS 15 1HZ LYS 15 2.407 6.679 -6.619
123 HZ3 LYS 15 2HZ LYS 15 0.869 6.212 -6.092
124 H TYR 16 H TYR 16 -1.524 4.478 -0.125
125 HA TYR 16 HA TYR 16 -2.778 4.846 -2.690
126 HB2 TYR 16 1HB TYR 16 -4.779 4.056 -1.646
127 HB3 TYR 16 2HB TYR 16 -3.452 3.089 -1.014
128 HD1 TYR 16 2HD TYR 16 -2.678 3.403 1.300
129 HD2 TYR 16 1HD TYR 16 -6.035 5.529 -0.222
130 HE1 TYR 16 2HE TYR 16 -3.354 3.969 3.596
131 HE2 TYR 16 1HE TYR 16 -6.719 6.101 2.071
132 HH TYR 16 HH TYR 16 -6.357 5.091 4.406
133 H LYS 17 H LYS 17 -5.068 6.035 -2.469
134 HA LYS 17 HA LYS 17 -4.528 8.700 -1.330
135 HB2 LYS 17 1HB LYS 17 -5.735 9.683 -3.216
136 HB3 LYS 17 2HB LYS 17 -4.358 8.740 -3.774
137 HG2 LYS 17 1HG LYS 17 -6.498 6.954 -3.751
138 HG3 LYS 17 2HG LYS 17 -7.152 8.458 -4.403
139 HD2 LYS 17 1HD LYS 17 -4.545 7.366 -5.395
140 HD3 LYS 17 2HD LYS 17 -6.075 6.750 -6.022
141 HE2 LYS 17 1HE LYS 17 -6.571 8.691 -7.103
142 HE3 LYS 17 2HE LYS 17 -5.735 9.693 -5.915
143 HZ1 LYS 17 3HZ LYS 17 -4.317 9.866 -7.668
144 HZ2 LYS 17 1HZ LYS 17 -4.669 8.326 -8.274
145 HZ3 LYS 17 2HZ LYS 17 -3.654 8.493 -6.933
146 H ASN 18 H ASN 18 -6.144 9.680 -0.206
147 HA ASN 18 HA ASN 18 -8.714 8.251 -0.029
148 HB2 ASN 18 1HB ASN 18 -8.743 8.369 2.283
149 HB3 ASN 18 2HB ASN 18 -7.027 8.113 1.978
150 HD21 ASN 18 2HD2 ASN 18 -5.839 10.282 1.566
151 HD22 ASN 18 1HD2 ASN 18 -6.162 11.518 2.730
152 H ASP 19 H ASP 19 -10.416 9.710 1.064
153 HA ASP 19 HA ASP 19 -11.661 11.623 1.095
154 HB2 ASP 19 1HB ASP 19 -9.372 12.617 1.811
155 HB3 ASP 19 2HB ASP 19 -9.296 13.220 0.158
156 H ALA 20 H ALA 20 -9.329 12.277 -1.521
157 HA ALA 20 HA ALA 20 -11.002 11.540 -3.642
158 HB1 ALA 20 1HB ALA 20 -11.571 13.865 -4.459
159 HB2 ALA 20 2HB ALA 20 -12.496 13.277 -3.076
160 HB3 ALA 20 3HB ALA 20 -11.183 14.431 -2.833
161 H GLY 21 H GLY 21 -8.278 11.313 -2.985
162 HA2 GLY 21 1HA GLY 21 -6.634 11.225 -4.826
163 HA3 GLY 21 2HA GLY 21 -7.054 12.899 -5.159
164 H LYS 22 H LYS 22 -6.980 12.246 -1.850
165 HA LYS 22 HA LYS 22 -4.560 13.811 -1.550
166 HB2 LYS 22 1HB LYS 22 -6.613 12.752 0.384
167 HB3 LYS 22 2HB LYS 22 -5.129 13.518 0.934
168 HG2 LYS 22 1HG LYS 22 -6.331 15.195 -1.022
169 HG3 LYS 22 2HG LYS 22 -7.557 14.738 0.162
170 HD2 LYS 22 1HD LYS 22 -6.618 16.644 1.099
171 HD3 LYS 22 2HD LYS 22 -5.749 15.340 1.913
172 HE2 LYS 22 1HE LYS 22 -4.068 15.637 -0.072
173 HE3 LYS 22 2HE LYS 22 -4.805 17.233 -0.194
174 HZ1 LYS 22 3HZ LYS 22 -4.280 16.878 2.478
175 HZ2 LYS 22 1HZ LYS 22 -3.419 17.857 1.401
176 HZ3 LYS 22 2HZ LYS 22 -2.911 16.271 1.693
177 H ASP 23 H ASP 23 -2.607 12.958 -1.349
178 HA ASP 23 HA ASP 23 -2.000 10.267 -1.411
179 HB2 ASP 23 1HB ASP 23 -0.434 12.639 -0.410
180 HB3 ASP 23 2HB ASP 23 0.250 11.015 -0.418
181 H THR 24 H THR 24 -1.517 8.703 0.092
182 HA THR 24 HA THR 24 -1.720 9.340 2.930
183 HB THR 24 HB THR 24 -3.407 7.098 1.841
184 HG1 THR 24 1HG THR 24 -4.008 9.848 2.073
185 HG21 THR 24 3HG2 THR 24 -4.625 7.853 4.074
186 HG22 THR 24 1HG2 THR 24 -3.013 8.451 4.462
187 HG23 THR 24 2HG2 THR 24 -3.256 6.743 4.097
188 H PHE 25 H PHE 25 -0.353 8.157 4.123
189 HA PHE 25 HA PHE 25 0.670 5.638 3.011
190 HB2 PHE 25 1HB PHE 25 2.447 7.647 4.392
191 HB3 PHE 25 2HB PHE 25 2.931 6.202 3.511
192 HD1 PHE 25 1HD PHE 25 1.606 9.619 3.171
193 HD2 PHE 25 2HD PHE 25 3.194 6.225 1.153
194 HE1 PHE 25 1HE PHE 25 1.870 10.963 1.127
195 HE2 PHE 25 2HE PHE 25 3.462 7.563 -0.894
196 HZ PHE 25 HZ PHE 25 2.800 9.935 -0.909
197 H ILE 26 H ILE 26 1.297 4.083 4.522
198 HA ILE 26 HA ILE 26 1.359 4.562 7.322
199 HB ILE 26 HB ILE 26 -1.107 4.706 6.879
200 HG12 ILE 26 1HG1 ILE 26 -0.680 2.272 8.547
201 HG13 ILE 26 2HG1 ILE 26 0.168 3.743 9.009
202 HG21 ILE 26 1HG2 ILE 26 -1.524 1.855 6.708
203 HG22 ILE 26 2HG2 ILE 26 -2.196 3.151 5.722
204 HG23 ILE 26 3HG2 ILE 26 -0.628 2.457 5.314
205 HD11 ILE 26 3HD1 ILE 26 -2.798 3.326 8.788
206 HD12 ILE 26 1HD1 ILE 26 -1.854 3.665 10.238
207 HD13 ILE 26 2HD1 ILE 26 -2.047 4.906 9.000
208 H LYS 27 H LYS 27 3.010 3.282 5.406
209 HA LYS 27 HA LYS 27 4.232 1.391 5.076
210 HB2 LYS 27 1HB LYS 27 3.585 1.518 7.889
211 HB3 LYS 27 2HB LYS 27 3.729 -0.155 7.366
212 HG2 LYS 27 1HG LYS 27 5.942 0.537 6.311
213 HG3 LYS 27 2HG LYS 27 5.793 2.019 7.261
214 HD2 LYS 27 1HD LYS 27 5.961 0.880 9.287
215 HD3 LYS 27 2HD LYS 27 5.531 -0.671 8.561
216 HE2 LYS 27 1HE LYS 27 7.644 -0.993 7.686
217 HE3 LYS 27 2HE LYS 27 8.022 0.730 7.690
218 HZ1 LYS 27 3HZ LYS 27 7.995 -1.139 9.984
219 HZ2 LYS 27 1HZ LYS 27 7.968 0.539 10.196
220 HZ3 LYS 27 2HZ LYS 27 9.278 -0.193 9.416
221 H CYS 28 H CYS 28 4.077 -1.163 5.305
222 HA CYS 28 HA CYS 28 1.335 -1.985 4.626
223 HB2 CYS 28 1HB CYS 28 3.644 -1.948 2.904
224 HB3 CYS 28 2HB CYS 28 3.091 -3.603 3.128
225 HG CYS 28 HG CYS 28 1.365 -0.987 1.781
226 HA PRO 29 HA PRO 29 1.961 -5.271 7.475
227 HB2 PRO 29 1HB PRO 29 0.221 -7.098 6.471
228 HB3 PRO 29 2HB PRO 29 -0.302 -5.642 7.326
229 HG2 PRO 29 1HG PRO 29 -0.157 -6.161 4.382
230 HG3 PRO 29 2HG PRO 29 -1.434 -5.361 5.315
231 HD2 PRO 29 1HD PRO 29 0.419 -3.982 3.902
232 HD3 PRO 29 2HD PRO 29 -0.289 -3.362 5.408
233 H LYS 30 H LYS 30 4.191 -5.435 6.360
234 HA LYS 30 HA LYS 30 4.463 -8.181 5.385
235 HB2 LYS 30 1HB LYS 30 5.953 -5.885 4.113
236 HB3 LYS 30 2HB LYS 30 5.940 -7.567 3.600
237 HG2 LYS 30 1HG LYS 30 3.532 -5.761 3.564
238 HG3 LYS 30 2HG LYS 30 4.577 -6.071 2.175
239 HD2 LYS 30 1HD LYS 30 3.814 -8.208 1.905
240 HD3 LYS 30 2HD LYS 30 3.458 -8.414 3.622
241 HE2 LYS 30 1HE LYS 30 1.678 -6.498 3.019
242 HE3 LYS 30 2HE LYS 30 1.791 -7.296 1.450
243 HZ1 LYS 30 3HZ LYS 30 1.114 -8.600 4.032
244 HZ2 LYS 30 1HZ LYS 30 1.284 -9.405 2.553
245 HZ3 LYS 30 2HZ LYS 30 0.042 -8.276 2.764
246 H PHE 31 H PHE 31 5.013 -8.092 7.805
247 HA PHE 31 HA PHE 31 7.585 -6.996 8.485
248 HB2 PHE 31 1HB PHE 31 5.499 -8.588 9.924
249 HB3 PHE 31 2HB PHE 31 7.124 -8.498 10.597
250 HD1 PHE 31 2HD PHE 31 4.218 -6.470 9.548
251 HD2 PHE 31 1HD PHE 31 7.858 -6.590 11.751
252 HE1 PHE 31 2HE PHE 31 3.673 -4.295 10.561
253 HE2 PHE 31 1HE PHE 31 7.317 -4.417 12.769
254 HZ PHE 31 HZ PHE 31 5.223 -3.265 12.174
255 H ASP 32 H ASP 32 8.980 -8.012 6.995
256 HA ASP 32 HA ASP 32 10.381 -9.623 6.196
257 HB2 ASP 32 1HB ASP 32 10.170 -10.990 8.863
258 HB3 ASP 32 2HB ASP 32 11.578 -10.809 7.821
259 H ASN 33 H ASN 33 8.878 -10.497 4.710
260 HA ASN 33 HA ASN 33 8.515 -13.261 4.856
261 HB2 ASN 33 1HB ASN 33 6.647 -12.049 6.447
262 HB3 ASN 33 2HB ASN 33 5.779 -12.178 4.919
263 HD21 ASN 33 2HD2 ASN 33 4.354 -13.718 5.608
264 HD22 ASN 33 1HD2 ASN 33 4.818 -15.342 5.974
265 H LYS 34 H LYS 34 7.397 -10.201 3.554
266 HA LYS 34 HA LYS 34 7.911 -10.934 0.888
267 HB2 LYS 34 1HB LYS 34 5.896 -12.323 1.188
268 HB3 LYS 34 2HB LYS 34 4.981 -10.890 1.638
269 HG2 LYS 34 1HG LYS 34 4.488 -10.557 -0.490
270 HG3 LYS 34 2HG LYS 34 6.204 -10.344 -0.846
271 HD2 LYS 34 1HD LYS 34 6.415 -12.796 -1.102
272 HD3 LYS 34 2HD LYS 34 4.675 -12.947 -0.844
273 HE2 LYS 34 1HE LYS 34 4.310 -12.546 -2.997
274 HE3 LYS 34 2HE LYS 34 5.119 -10.985 -2.855
275 HZ1 LYS 34 3HZ LYS 34 7.226 -12.066 -3.288
276 HZ2 LYS 34 1HZ LYS 34 6.141 -12.387 -4.546
277 HZ3 LYS 34 2HZ LYS 34 6.469 -13.576 -3.390
278 H LYS 35 H LYS 35 8.921 -8.836 1.699
279 HA LYS 35 HA LYS 35 7.217 -6.521 1.790
280 HB2 LYS 35 1HB LYS 35 10.206 -6.903 1.766
281 HB3 LYS 35 2HB LYS 35 9.468 -5.306 1.718
282 HG2 LYS 35 1HG LYS 35 8.291 -5.861 3.840
283 HG3 LYS 35 2HG LYS 35 9.220 -7.360 3.904
284 HD2 LYS 35 1HD LYS 35 11.150 -5.440 3.476
285 HD3 LYS 35 2HD LYS 35 10.015 -4.632 4.561
286 HE2 LYS 35 1HE LYS 35 10.184 -6.456 6.144
287 HE3 LYS 35 2HE LYS 35 11.228 -7.352 5.042
288 HZ1 LYS 35 3HZ LYS 35 12.181 -5.865 6.989
289 HZ2 LYS 35 1HZ LYS 35 12.085 -4.668 5.797
290 HZ3 LYS 35 2HZ LYS 35 13.005 -6.060 5.525
291 H CYS 36 H CYS 36 7.661 -4.629 0.333
292 HA CYS 36 HA CYS 36 6.998 -5.179 -2.282
293 HB2 CYS 36 1HB CYS 36 7.060 -2.926 -0.930
294 HB3 CYS 36 2HB CYS 36 8.643 -2.752 -1.677
295 HG CYS 36 HG CYS 36 7.852 -2.192 -4.102
296 H THR 37 H THR 37 8.054 -5.928 -3.996
297 HA THR 37 HA THR 37 10.986 -5.700 -4.066
298 HB THR 37 HB THR 37 11.125 -7.959 -5.056
299 HG1 THR 37 1HG THR 37 9.231 -9.302 -4.851
300 HG21 THR 37 3HG2 THR 37 10.623 -7.297 -2.348
301 HG22 THR 37 1HG2 THR 37 11.544 -8.659 -2.983
302 HG23 THR 37 2HG2 THR 37 9.816 -8.830 -2.674
303 H LYS 38 H LYS 38 9.180 -3.977 -5.354
304 HA LYS 38 HA LYS 38 10.152 -4.101 -8.014
305 HB2 LYS 38 1HB LYS 38 8.064 -5.764 -7.759
306 HB3 LYS 38 2HB LYS 38 7.186 -4.269 -8.050
307 HG2 LYS 38 1HG LYS 38 8.703 -3.979 -10.083
308 HG3 LYS 38 2HG LYS 38 9.132 -5.674 -9.845
309 HD2 LYS 38 1HD LYS 38 6.604 -6.111 -9.840
310 HD3 LYS 38 2HD LYS 38 6.454 -4.487 -10.515
311 HE2 LYS 38 1HE LYS 38 6.710 -5.480 -12.503
312 HE3 LYS 38 2HE LYS 38 8.417 -5.597 -12.073
313 HZ1 LYS 38 3HZ LYS 38 6.395 -7.690 -11.486
314 HZ2 LYS 38 1HZ LYS 38 8.066 -7.801 -11.246
315 HZ3 LYS 38 2HZ LYS 38 7.441 -7.719 -12.815
316 H ASP 39 H ASP 39 9.845 -2.175 -9.123
317 HA ASP 39 HA ASP 39 9.242 0.098 -7.519
318 HB2 ASP 39 1HB ASP 39 10.129 -0.377 -10.318
319 HB3 ASP 39 2HB ASP 39 9.377 1.176 -9.964
320 H ASN 40 H ASN 40 7.316 0.934 -7.103
321 HA ASN 40 HA ASN 40 5.108 1.461 -7.232
322 HB2 ASN 40 1HB ASN 40 5.948 1.470 -10.108
323 HB3 ASN 40 2HB ASN 40 4.244 1.662 -9.706
324 HD21 ASN 40 2HD2 ASN 40 7.144 2.825 -8.050
325 HD22 ASN 40 1HD2 ASN 40 6.743 4.503 -8.154
326 H ASN 41 H ASN 41 5.367 -1.044 -6.496
327 HA ASN 41 HA ASN 41 4.306 -3.046 -8.145
328 HB2 ASN 41 1HB ASN 41 5.200 -2.833 -5.473
329 HB3 ASN 41 2HB ASN 41 3.572 -3.498 -5.401
330 HD21 ASN 41 2HD2 ASN 41 6.500 -4.503 -5.164
331 HD22 ASN 41 1HD2 ASN 41 6.463 -5.983 -6.056
332 H LYS 42 H LYS 42 2.199 -4.206 -6.844
333 HA LYS 42 HA LYS 42 0.040 -2.252 -7.290
334 HB2 LYS 42 1HB LYS 42 0.449 -4.576 -8.639
335 HB3 LYS 42 2HB LYS 42 -0.620 -5.130 -7.356
336 HG2 LYS 42 1HG LYS 42 -2.375 -3.798 -8.066
337 HG3 LYS 42 2HG LYS 42 -1.315 -2.705 -8.962
338 HD2 LYS 42 1HD LYS 42 -2.384 -3.964 -10.621
339 HD3 LYS 42 2HD LYS 42 -0.802 -4.727 -10.450
340 HE2 LYS 42 1HE LYS 42 -1.841 -6.390 -8.919
341 HE3 LYS 42 2HE LYS 42 -3.411 -5.670 -9.269
342 HZ1 LYS 42 3HZ LYS 42 -1.922 -6.354 -11.628
343 HZ2 LYS 42 1HZ LYS 42 -3.524 -6.715 -11.218
344 HZ3 LYS 42 2HZ LYS 42 -2.267 -7.695 -10.655
345 H CYS 43 H CYS 43 -0.880 -1.590 -5.472
346 HA CYS 43 HA CYS 43 -1.232 -3.536 -3.289
347 HB2 CYS 43 1HB CYS 43 -0.817 -1.857 -1.668
348 HB3 CYS 43 2HB CYS 43 0.462 -1.687 -2.865
349 HG CYS 43 HG CYS 43 -2.343 0.260 -2.949
350 H THR 44 H THR 44 -2.931 -2.472 -1.651
351 HA THR 44 HA THR 44 -5.030 -0.914 -2.653
352 HB THR 44 HB THR 44 -6.561 -3.219 -2.548
353 HG1 THR 44 1HG THR 44 -5.543 -4.729 -3.793
354 HG21 THR 44 3HG2 THR 44 -6.103 -2.747 -5.254
355 HG22 THR 44 1HG2 THR 44 -5.808 -1.194 -4.474
356 HG23 THR 44 2HG2 THR 44 -7.353 -2.013 -4.252
357 H VAL 45 H VAL 45 -6.197 -0.231 -0.965
358 HA VAL 45 HA VAL 45 -6.218 -1.892 1.470
359 HB VAL 45 HB VAL 45 -6.037 1.118 1.297
360 HG11 VAL 45 1HG1 VAL 45 -7.339 0.809 3.178
361 HG12 VAL 45 2HG1 VAL 45 -6.588 -0.738 3.573
362 HG13 VAL 45 3HG1 VAL 45 -5.712 0.767 3.855
363 HG21 VAL 45 3HG2 VAL 45 -3.909 0.579 2.666
364 HG22 VAL 45 1HG2 VAL 45 -4.088 -1.044 1.997
365 HG23 VAL 45 2HG2 VAL 45 -3.882 0.336 0.919
366 H ASP 46 H ASP 46 -8.109 -2.005 2.634
367 HA ASP 46 HA ASP 46 -10.475 -0.839 1.324
368 HB2 ASP 46 1HB ASP 46 -10.115 -3.423 1.539
369 HB3 ASP 46 2HB ASP 46 -10.633 -3.169 3.204
370 H THR 47 H THR 47 -11.940 0.306 2.502
371 HA THR 47 HA THR 47 -11.055 1.365 5.018
372 HB THR 47 HB THR 47 -12.895 2.861 4.905
373 HG1 THR 47 1HG THR 47 -14.755 2.233 4.127
374 HG21 THR 47 3HG2 THR 47 -12.229 4.007 3.082
375 HG22 THR 47 1HG2 THR 47 -12.576 2.666 1.990
376 HG23 THR 47 2HG2 THR 47 -11.065 2.696 2.899
377 H TYR 48 H TYR 48 -12.850 -1.338 4.116
378 HA TYR 48 HA TYR 48 -14.867 -1.557 5.979
379 HB2 TYR 48 1HB TYR 48 -14.338 -3.177 4.125
380 HB3 TYR 48 2HB TYR 48 -13.065 -3.836 5.146
381 HD1 TYR 48 2HD TYR 48 -13.821 -4.633 7.521
382 HD2 TYR 48 1HD TYR 48 -16.465 -4.094 4.231
383 HE1 TYR 48 2HE TYR 48 -15.451 -6.132 8.592
384 HE2 TYR 48 1HE TYR 48 -18.102 -5.590 5.294
385 HH TYR 48 HH TYR 48 -17.367 -7.625 7.817
386 H ASN 49 H ASN 49 -11.511 -2.704 6.355
387 HA ASN 49 HA ASN 49 -11.597 -2.067 9.182
388 HB2 ASN 49 1HB ASN 49 -11.039 -4.284 9.959
389 HB3 ASN 49 2HB ASN 49 -12.528 -4.379 9.024
390 HD21 ASN 49 2HD2 ASN 49 -12.091 -4.781 6.605
391 HD22 ASN 49 1HD2 ASN 49 -10.962 -6.043 6.261
392 H ASN 50 H ASN 50 -10.116 -0.976 7.057
393 HA ASN 50 HA ASN 50 -7.999 -0.446 6.398
394 HB2 ASN 50 1HB ASN 50 -8.106 -0.135 9.050
395 HB3 ASN 50 2HB ASN 50 -6.874 -1.392 8.987
396 HD21 ASN 50 2HD2 ASN 50 -7.632 1.465 7.020
397 HD22 ASN 50 1HD2 ASN 50 -6.042 2.141 7.087
398 H ALA 51 H ALA 51 -8.758 -2.948 5.526
399 HA ALA 51 HA ALA 51 -6.642 -4.840 6.093
400 HB1 ALA 51 1HB ALA 51 -8.431 -5.355 3.813
401 HB2 ALA 51 2HB ALA 51 -7.975 -6.398 5.161
402 HB3 ALA 51 3HB ALA 51 -9.224 -5.173 5.378
403 H VAL 52 H VAL 52 -4.723 -4.053 5.335
404 HA VAL 52 HA VAL 52 -4.487 -2.902 2.705
405 HB VAL 52 HB VAL 52 -2.352 -3.711 4.683
406 HG11 VAL 52 1HG1 VAL 52 -1.084 -1.944 3.203
407 HG12 VAL 52 2HG1 VAL 52 -1.156 -3.642 2.727
408 HG13 VAL 52 3HG1 VAL 52 -2.239 -2.468 1.978
409 HG21 VAL 52 3HG2 VAL 52 -2.398 -1.584 5.533
410 HG22 VAL 52 1HG2 VAL 52 -3.046 -0.887 4.048
411 HG23 VAL 52 2HG2 VAL 52 -4.103 -1.791 5.132
412 H ASP 53 H ASP 53 -3.517 -3.792 0.906
413 HA ASP 53 HA ASP 53 -2.692 -6.601 1.039
414 HB2 ASP 53 1HB ASP 53 -5.086 -6.503 0.337
415 HB3 ASP 53 2HB ASP 53 -4.599 -5.537 -1.053
416 H CYS 54 H CYS 54 -0.613 -6.437 0.475
417 HA CYS 54 HA CYS 54 0.183 -4.587 -1.636
418 HB2 CYS 54 1HB CYS 54 1.390 -5.090 0.686
419 HB3 CYS 54 2HB CYS 54 2.156 -6.354 -0.268
420 HG CYS 54 HG CYS 54 4.063 -4.631 -0.686
421 H ASP 55 H ASP 55 1.863 -5.412 -3.211
422 HA ASP 55 HA ASP 55 0.754 -7.625 -4.638
423 HB2 ASP 55 1HB ASP 55 2.248 -5.422 -5.334
424 HB3 ASP 55 2HB ASP 55 3.415 -6.732 -5.486
Start of MODEL 7
1 H1 ALA 1 H ALA 1 -14.588 -0.691 1.846
2 HA ALA 1 HA ALA 1 -15.334 0.129 -0.804
3 HB1 ALA 1 1HB ALA 1 -13.504 2.113 0.373
4 HB2 ALA 1 2HB ALA 1 -14.807 2.319 -0.799
5 HB3 ALA 1 3HB ALA 1 -15.179 2.198 0.921
6 H LYS 2 H LYS 2 -13.116 0.917 -1.935
7 HA LYS 2 HA LYS 2 -10.855 -0.646 -0.972
8 HB2 LYS 2 1HB LYS 2 -12.138 -1.107 -3.671
9 HB3 LYS 2 2HB LYS 2 -10.581 -1.759 -3.180
10 HG2 LYS 2 1HG LYS 2 -11.879 -3.552 -2.705
11 HG3 LYS 2 2HG LYS 2 -12.032 -2.696 -1.168
12 HD2 LYS 2 1HD LYS 2 -14.063 -1.552 -2.413
13 HD3 LYS 2 2HD LYS 2 -14.012 -3.037 -3.365
14 HE2 LYS 2 1HE LYS 2 -13.769 -3.735 -0.622
15 HE3 LYS 2 2HE LYS 2 -15.121 -2.616 -0.782
16 HZ1 LYS 2 3HZ LYS 2 -14.764 -5.275 -1.996
17 HZ2 LYS 2 1HZ LYS 2 -15.773 -4.138 -2.741
18 HZ3 LYS 2 2HZ LYS 2 -16.098 -4.651 -1.162
19 H TYR 3 H TYR 3 -8.879 -0.234 -2.246
20 HA TYR 3 HA TYR 3 -8.909 2.123 -3.946
21 HB2 TYR 3 1HB TYR 3 -7.636 2.048 -1.224
22 HB3 TYR 3 2HB TYR 3 -6.992 3.085 -2.491
23 HD1 TYR 3 2HD TYR 3 -9.862 2.466 -0.282
24 HD2 TYR 3 1HD TYR 3 -8.176 5.057 -3.205
25 HE1 TYR 3 2HE TYR 3 -11.532 4.181 0.284
26 HE2 TYR 3 1HE TYR 3 -9.840 6.780 -2.647
27 HH TYR 3 HH TYR 3 -12.464 6.135 -0.386
28 H THR 4 H THR 4 -7.382 2.025 -5.482
29 HA THR 4 HA THR 4 -5.481 -0.203 -5.354
30 HB THR 4 HB THR 4 -5.184 0.640 -7.873
31 HG1 THR 4 1HG THR 4 -6.968 1.625 -8.648
32 HG21 THR 4 3HG2 THR 4 -7.561 -0.993 -6.977
33 HG22 THR 4 1HG2 THR 4 -5.912 -1.607 -7.099
34 HG23 THR 4 2HG2 THR 4 -6.761 -1.063 -8.547
35 H GLY 5 H GLY 5 -3.394 0.157 -4.982
36 HA2 GLY 5 1HA GLY 5 -2.250 2.760 -5.740
37 HA3 GLY 5 2HA GLY 5 -2.028 2.160 -4.103
38 H LYS 6 H LYS 6 0.218 2.101 -4.304
39 HA LYS 6 HA LYS 6 1.264 -0.337 -5.341
40 HB2 LYS 6 1HB LYS 6 3.005 1.183 -6.735
41 HB3 LYS 6 2HB LYS 6 1.585 0.429 -7.448
42 HG2 LYS 6 1HG LYS 6 0.335 2.482 -7.227
43 HG3 LYS 6 2HG LYS 6 1.691 3.249 -6.396
44 HD2 LYS 6 1HD LYS 6 2.802 2.286 -8.743
45 HD3 LYS 6 2HD LYS 6 1.216 2.883 -9.238
46 HE2 LYS 6 1HE LYS 6 3.367 4.409 -7.778
47 HE3 LYS 6 2HE LYS 6 2.815 4.667 -9.432
48 HZ1 LYS 6 3HZ LYS 6 0.602 5.218 -8.489
49 HZ2 LYS 6 1HZ LYS 6 1.820 6.307 -8.050
50 HZ3 LYS 6 2HZ LYS 6 1.279 5.150 -6.941
51 H CYS 7 H CYS 7 3.441 -0.713 -4.701
52 HA CYS 7 HA CYS 7 4.370 1.152 -2.620
53 HB2 CYS 7 1HB CYS 7 4.862 -1.824 -2.856
54 HB3 CYS 7 2HB CYS 7 5.452 -0.787 -1.563
55 HG CYS 7 HG CYS 7 2.655 -0.082 -0.938
56 H THR 8 H THR 8 6.677 1.373 -2.334
57 HA THR 8 HA THR 8 8.119 1.104 -4.885
58 HB THR 8 HB THR 8 9.399 2.998 -4.352
59 HG1 THR 8 1HG THR 8 9.934 3.450 -2.355
60 HG21 THR 8 3HG2 THR 8 7.824 4.692 -4.219
61 HG22 THR 8 1HG2 THR 8 6.842 3.828 -3.038
62 HG23 THR 8 2HG2 THR 8 6.837 3.322 -4.727
63 H LYS 9 H LYS 9 10.108 0.149 -4.975
64 HA LYS 9 HA LYS 9 10.752 -1.850 -3.144
65 HB2 LYS 9 1HB LYS 9 13.024 -1.806 -4.301
66 HB3 LYS 9 2HB LYS 9 11.620 -2.077 -5.325
67 HG2 LYS 9 1HG LYS 9 11.749 0.029 -6.280
68 HG3 LYS 9 2HG LYS 9 12.712 0.682 -4.952
69 HD2 LYS 9 1HD LYS 9 14.439 0.394 -6.365
70 HD3 LYS 9 2HD LYS 9 14.336 -1.297 -5.869
71 HE2 LYS 9 1HE LYS 9 12.667 -1.561 -7.792
72 HE3 LYS 9 2HE LYS 9 13.258 0.002 -8.352
73 HZ1 LYS 9 3HZ LYS 9 14.740 -2.542 -8.112
74 HZ2 LYS 9 1HZ LYS 9 15.549 -1.058 -8.199
75 HZ3 LYS 9 2HZ LYS 9 14.552 -1.554 -9.472
76 H SER 10 H SER 10 11.426 1.520 -3.073
77 HA SER 10 HA SER 10 13.667 1.346 -1.276
78 HB2 SER 10 1HB SER 10 13.675 3.718 -1.293
79 HB3 SER 10 2HB SER 10 13.198 3.245 -2.923
80 HG SER 10 HG SER 10 11.924 4.911 -1.530
81 H LYS 11 H LYS 11 10.240 1.391 -0.995
82 HA LYS 11 HA LYS 11 10.398 1.001 1.847
83 HB2 LYS 11 1HB LYS 11 8.732 2.895 2.282
84 HB3 LYS 11 2HB LYS 11 10.413 3.345 2.028
85 HG2 LYS 11 1HG LYS 11 9.868 3.868 -0.330
86 HG3 LYS 11 2HG LYS 11 8.173 3.532 0.026
87 HD2 LYS 11 1HD LYS 11 8.563 5.914 0.136
88 HD3 LYS 11 2HD LYS 11 8.223 5.299 1.754
89 HE2 LYS 11 1HE LYS 11 11.017 5.127 1.351
90 HE3 LYS 11 2HE LYS 11 10.508 6.729 0.820
91 HZ1 LYS 11 3HZ LYS 11 9.785 7.291 2.907
92 HZ2 LYS 11 1HZ LYS 11 11.104 6.306 3.295
93 HZ3 LYS 11 2HZ LYS 11 9.532 5.689 3.389
94 H ASN 12 H ASN 12 8.950 -0.507 2.321
95 HA ASN 12 HA ASN 12 6.890 -1.204 0.435
96 HB2 ASN 12 1HB ASN 12 8.103 -2.967 1.603
97 HB3 ASN 12 2HB ASN 12 7.560 -2.341 3.157
98 HD21 ASN 12 2HD2 ASN 12 5.829 -3.241 4.005
99 HD22 ASN 12 1HD2 ASN 12 4.644 -4.165 3.153
100 H GLU 13 H GLU 13 5.808 0.931 0.640
101 HA GLU 13 HA GLU 13 3.773 0.797 2.749
102 HB2 GLU 13 1HB GLU 13 3.876 3.216 3.075
103 HB3 GLU 13 2HB GLU 13 5.422 2.468 3.451
104 HG2 GLU 13 1HG GLU 13 6.039 4.340 2.259
105 HG3 GLU 13 2HG GLU 13 6.054 3.078 1.028
106 H CYS 14 H CYS 14 1.841 2.115 2.237
107 HA CYS 14 HA CYS 14 1.308 2.013 -0.648
108 HB2 CYS 14 1HB CYS 14 -0.132 0.657 0.880
109 HB3 CYS 14 2HB CYS 14 -0.680 2.153 1.627
110 HG CYS 14 HG CYS 14 -1.209 2.683 -1.467
111 H LYS 15 H LYS 15 1.745 3.934 -1.544
112 HA LYS 15 HA LYS 15 1.036 6.390 -0.129
113 HB2 LYS 15 1HB LYS 15 2.288 7.523 -1.938
114 HB3 LYS 15 2HB LYS 15 3.257 6.324 -1.091
115 HG2 LYS 15 1HG LYS 15 3.385 4.943 -2.896
116 HG3 LYS 15 2HG LYS 15 1.829 5.467 -3.546
117 HD2 LYS 15 1HD LYS 15 3.233 6.471 -5.045
118 HD3 LYS 15 2HD LYS 15 3.122 7.754 -3.838
119 HE2 LYS 15 1HE LYS 15 5.242 7.352 -3.025
120 HE3 LYS 15 2HE LYS 15 5.253 5.680 -3.582
121 HZ1 LYS 15 3HZ LYS 15 6.722 7.189 -4.863
122 HZ2 LYS 15 1HZ LYS 15 5.351 8.028 -5.395
123 HZ3 LYS 15 2HZ LYS 15 5.565 6.404 -5.816
124 H TYR 16 H TYR 16 -1.258 5.294 -0.652
125 HA TYR 16 HA TYR 16 -2.242 6.018 -3.281
126 HB2 TYR 16 1HB TYR 16 -4.250 4.922 -2.682
127 HB3 TYR 16 2HB TYR 16 -2.968 3.955 -1.962
128 HD1 TYR 16 2HD TYR 16 -2.462 4.301 0.512
129 HD2 TYR 16 1HD TYR 16 -5.977 5.799 -1.359
130 HE1 TYR 16 2HE TYR 16 -3.540 4.505 2.713
131 HE2 TYR 16 1HE TYR 16 -7.065 6.007 0.836
132 HH TYR 16 HH TYR 16 -5.976 6.306 3.408
133 H LYS 17 H LYS 17 -4.716 6.963 -2.920
134 HA LYS 17 HA LYS 17 -4.422 9.402 -1.300
135 HB2 LYS 17 1HB LYS 17 -5.407 10.730 -3.075
136 HB3 LYS 17 2HB LYS 17 -3.975 9.907 -3.679
137 HG2 LYS 17 1HG LYS 17 -6.036 8.152 -4.244
138 HG3 LYS 17 2HG LYS 17 -6.722 9.745 -4.571
139 HD2 LYS 17 1HD LYS 17 -4.614 10.220 -5.902
140 HD3 LYS 17 2HD LYS 17 -4.259 8.496 -5.769
141 HE2 LYS 17 1HE LYS 17 -5.603 8.082 -7.486
142 HE3 LYS 17 2HE LYS 17 -6.959 8.778 -6.601
143 HZ1 LYS 17 3HZ LYS 17 -5.077 10.200 -8.399
144 HZ2 LYS 17 1HZ LYS 17 -6.206 10.985 -7.415
145 HZ3 LYS 17 2HZ LYS 17 -6.731 9.945 -8.641
146 H ASN 18 H ASN 18 -6.121 9.868 -0.047
147 HA ASN 18 HA ASN 18 -8.640 8.422 -0.554
148 HB2 ASN 18 1HB ASN 18 -8.917 8.002 1.704
149 HB3 ASN 18 2HB ASN 18 -7.167 7.888 1.554
150 HD21 ASN 18 2HD2 ASN 18 -6.044 10.080 1.836
151 HD22 ASN 18 1HD2 ASN 18 -6.582 11.025 3.179
152 H ASP 19 H ASP 19 -10.519 9.539 0.679
153 HA ASP 19 HA ASP 19 -11.866 11.353 1.000
154 HB2 ASP 19 1HB ASP 19 -9.702 12.249 2.123
155 HB3 ASP 19 2HB ASP 19 -9.522 13.201 0.652
156 H ALA 20 H ALA 20 -9.361 12.644 -1.185
157 HA ALA 20 HA ALA 20 -10.849 12.339 -3.552
158 HB1 ALA 20 1HB ALA 20 -12.389 13.938 -2.681
159 HB2 ALA 20 2HB ALA 20 -11.082 15.033 -2.224
160 HB3 ALA 20 3HB ALA 20 -11.433 14.742 -3.928
161 H GLY 21 H GLY 21 -8.182 11.963 -2.746
162 HA2 GLY 21 1HA GLY 21 -6.371 12.226 -4.375
163 HA3 GLY 21 2HA GLY 21 -6.822 13.921 -4.491
164 H LYS 22 H LYS 22 -6.967 12.673 -1.334
165 HA LYS 22 HA LYS 22 -4.746 14.328 -0.525
166 HB2 LYS 22 1HB LYS 22 -7.083 13.229 0.709
167 HB3 LYS 22 2HB LYS 22 -5.674 12.755 1.647
168 HG2 LYS 22 1HG LYS 22 -5.298 15.459 1.067
169 HG3 LYS 22 2HG LYS 22 -7.002 15.298 1.498
170 HD2 LYS 22 1HD LYS 22 -6.225 13.986 3.521
171 HD3 LYS 22 2HD LYS 22 -4.590 14.525 3.127
172 HE2 LYS 22 1HE LYS 22 -4.962 16.573 3.944
173 HE3 LYS 22 2HE LYS 22 -6.527 16.699 3.142
174 HZ1 LYS 22 3HZ LYS 22 -6.148 16.452 5.811
175 HZ2 LYS 22 1HZ LYS 22 -6.529 14.868 5.354
176 HZ3 LYS 22 2HZ LYS 22 -7.596 16.131 4.997
177 H ASP 23 H ASP 23 -2.747 13.578 -0.799
178 HA ASP 23 HA ASP 23 -1.967 10.940 -1.133
179 HB2 ASP 23 1HB ASP 23 -0.661 13.494 -0.766
180 HB3 ASP 23 2HB ASP 23 0.217 12.222 0.079
181 H THR 24 H THR 24 -1.881 9.262 0.191
182 HA THR 24 HA THR 24 -1.514 9.746 3.073
183 HB THR 24 HB THR 24 -3.413 7.751 1.825
184 HG1 THR 24 1HG THR 24 -3.725 10.221 3.150
185 HG21 THR 24 3HG2 THR 24 -4.021 7.176 4.127
186 HG22 THR 24 1HG2 THR 24 -2.769 8.260 4.731
187 HG23 THR 24 2HG2 THR 24 -2.323 6.824 3.810
188 H PHE 25 H PHE 25 -0.042 8.489 4.066
189 HA PHE 25 HA PHE 25 1.065 6.219 2.547
190 HB2 PHE 25 1HB PHE 25 2.571 8.170 4.303
191 HB3 PHE 25 2HB PHE 25 3.271 6.756 3.520
192 HD1 PHE 25 2HD PHE 25 1.586 9.986 2.836
193 HD2 PHE 25 1HD PHE 25 4.075 6.877 1.335
194 HE1 PHE 25 2HE PHE 25 2.057 11.334 0.833
195 HE2 PHE 25 1HE PHE 25 4.551 8.221 -0.669
196 HZ PHE 25 HZ PHE 25 3.541 10.452 -0.925
197 H ILE 26 H ILE 26 1.366 4.337 3.621
198 HA ILE 26 HA ILE 26 1.442 4.200 6.490
199 HB ILE 26 HB ILE 26 -0.954 4.403 6.238
200 HG12 ILE 26 1HG1 ILE 26 -1.660 2.296 7.292
201 HG13 ILE 26 2HG1 ILE 26 -0.167 1.528 6.764
202 HG21 ILE 26 1HG2 ILE 26 -2.283 2.993 4.862
203 HG22 ILE 26 2HG2 ILE 26 -0.975 3.612 3.855
204 HG23 ILE 26 3HG2 ILE 26 -0.904 1.963 4.477
205 HD11 ILE 26 3HD1 ILE 26 1.063 2.497 8.385
206 HD12 ILE 26 1HD1 ILE 26 0.111 3.981 8.379
207 HD13 ILE 26 2HD1 ILE 26 -0.500 2.545 9.199
208 H LYS 27 H LYS 27 2.810 2.623 6.965
209 HA LYS 27 HA LYS 27 3.884 0.855 5.085
210 HB2 LYS 27 1HB LYS 27 4.200 1.406 7.899
211 HB3 LYS 27 2HB LYS 27 4.238 -0.329 7.612
212 HG2 LYS 27 1HG LYS 27 6.065 -0.121 6.105
213 HG3 LYS 27 2HG LYS 27 5.931 1.639 6.094
214 HD2 LYS 27 1HD LYS 27 7.701 1.281 7.547
215 HD3 LYS 27 2HD LYS 27 6.331 1.432 8.650
216 HE2 LYS 27 1HE LYS 27 6.857 -0.554 9.493
217 HE3 LYS 27 2HE LYS 27 6.459 -1.277 7.936
218 HZ1 LYS 27 3HZ LYS 27 8.738 -1.771 8.808
219 HZ2 LYS 27 1HZ LYS 27 9.128 -0.145 8.549
220 HZ3 LYS 27 2HZ LYS 27 8.696 -1.130 7.244
221 H CYS 28 H CYS 28 3.274 -1.074 4.331
222 HA CYS 28 HA CYS 28 0.734 -2.162 5.155
223 HB2 CYS 28 1HB CYS 28 2.670 -3.341 3.159
224 HB3 CYS 28 2HB CYS 28 0.939 -3.639 3.281
225 HG CYS 28 HG CYS 28 2.512 -1.399 1.499
226 HA PRO 29 HA PRO 29 2.131 -5.264 7.925
227 HB2 PRO 29 1HB PRO 29 0.323 -7.234 7.454
228 HB3 PRO 29 2HB PRO 29 -0.083 -5.743 8.311
229 HG2 PRO 29 1HG PRO 29 -0.560 -6.471 5.447
230 HG3 PRO 29 2HG PRO 29 -1.645 -5.661 6.591
231 HD2 PRO 29 1HD PRO 29 -0.233 -4.311 4.716
232 HD3 PRO 29 2HD PRO 29 -0.627 -3.613 6.300
233 H LYS 30 H LYS 30 4.154 -5.655 6.816
234 HA LYS 30 HA LYS 30 4.238 -8.333 5.655
235 HB2 LYS 30 1HB LYS 30 5.320 -5.850 4.334
236 HB3 LYS 30 2HB LYS 30 5.911 -7.457 3.937
237 HG2 LYS 30 1HG LYS 30 3.055 -6.536 3.672
238 HG3 LYS 30 2HG LYS 30 4.221 -6.669 2.353
239 HD2 LYS 30 1HD LYS 30 4.436 -9.088 2.851
240 HD3 LYS 30 2HD LYS 30 3.174 -8.917 4.072
241 HE2 LYS 30 1HE LYS 30 1.930 -7.804 1.967
242 HE3 LYS 30 2HE LYS 30 2.983 -8.938 1.123
243 HZ1 LYS 30 3HZ LYS 30 0.777 -9.858 1.702
244 HZ2 LYS 30 1HZ LYS 30 1.163 -9.698 3.342
245 HZ3 LYS 30 2HZ LYS 30 2.060 -10.742 2.361
246 H PHE 31 H PHE 31 4.990 -8.397 8.013
247 HA PHE 31 HA PHE 31 7.672 -7.434 8.492
248 HB2 PHE 31 1HB PHE 31 5.586 -8.841 10.090
249 HB3 PHE 31 2HB PHE 31 7.262 -8.995 10.607
250 HD1 PHE 31 2HD PHE 31 8.511 -7.048 11.375
251 HD2 PHE 31 1HD PHE 31 4.412 -6.760 10.267
252 HE1 PHE 31 2HE PHE 31 8.363 -4.867 12.502
253 HE2 PHE 31 1HE PHE 31 4.258 -4.576 11.392
254 HZ PHE 31 HZ PHE 31 6.236 -3.629 12.513
255 H ASP 32 H ASP 32 8.557 -8.623 6.615
256 HA ASP 32 HA ASP 32 9.871 -10.275 5.767
257 HB2 ASP 32 1HB ASP 32 9.804 -11.639 8.449
258 HB3 ASP 32 2HB ASP 32 11.096 -11.633 7.252
259 H ASN 33 H ASN 33 8.212 -11.026 4.406
260 HA ASN 33 HA ASN 33 7.612 -13.752 4.606
261 HB2 ASN 33 1HB ASN 33 5.956 -12.336 6.270
262 HB3 ASN 33 2HB ASN 33 4.997 -12.423 4.796
263 HD21 ASN 33 2HD2 ASN 33 4.452 -14.480 3.956
264 HD22 ASN 33 1HD2 ASN 33 4.416 -15.871 4.980
265 H LYS 34 H LYS 34 6.704 -10.611 3.326
266 HA LYS 34 HA LYS 34 7.009 -11.403 0.646
267 HB2 LYS 34 1HB LYS 34 4.744 -12.480 1.437
268 HB3 LYS 34 2HB LYS 34 4.122 -10.852 1.208
269 HG2 LYS 34 1HG LYS 34 5.520 -11.301 -1.111
270 HG3 LYS 34 2HG LYS 34 4.816 -12.881 -0.754
271 HD2 LYS 34 1HD LYS 34 3.080 -10.476 -0.517
272 HD3 LYS 34 2HD LYS 34 3.494 -11.050 -2.133
273 HE2 LYS 34 1HE LYS 34 2.615 -13.103 -0.202
274 HE3 LYS 34 2HE LYS 34 1.387 -11.951 -0.724
275 HZ1 LYS 34 3HZ LYS 34 2.610 -14.103 -2.180
276 HZ2 LYS 34 1HZ LYS 34 2.607 -12.646 -3.040
277 HZ3 LYS 34 2HZ LYS 34 1.153 -13.294 -2.469
278 H LYS 35 H LYS 35 8.158 -9.352 1.692
279 HA LYS 35 HA LYS 35 6.594 -6.935 1.576
280 HB2 LYS 35 1HB LYS 35 9.592 -7.298 1.751
281 HB3 LYS 35 2HB LYS 35 8.718 -5.794 2.012
282 HG2 LYS 35 1HG LYS 35 7.931 -6.442 4.061
283 HG3 LYS 35 2HG LYS 35 8.016 -8.161 3.672
284 HD2 LYS 35 1HD LYS 35 9.742 -7.758 5.238
285 HD3 LYS 35 2HD LYS 35 10.534 -7.901 3.667
286 HE2 LYS 35 1HE LYS 35 10.609 -5.457 3.493
287 HE3 LYS 35 2HE LYS 35 9.827 -5.323 5.067
288 HZ1 LYS 35 3HZ LYS 35 12.384 -5.155 4.899
289 HZ2 LYS 35 1HZ LYS 35 12.332 -6.843 4.804
290 HZ3 LYS 35 2HZ LYS 35 11.698 -6.053 6.159
291 H CYS 36 H CYS 36 7.120 -5.137 0.143
292 HA CYS 36 HA CYS 36 6.930 -5.758 -2.538
293 HB2 CYS 36 1HB CYS 36 7.340 -3.433 -2.996
294 HB3 CYS 36 2HB CYS 36 6.424 -3.538 -1.497
295 HG CYS 36 HG CYS 36 9.423 -3.558 -0.454
296 H THR 37 H THR 37 8.399 -5.566 -4.301
297 HA THR 37 HA THR 37 11.232 -5.402 -3.801
298 HB THR 37 HB THR 37 10.772 -7.757 -3.205
299 HG1 THR 37 1HG THR 37 12.577 -8.360 -4.191
300 HG21 THR 37 3HG2 THR 37 10.367 -8.870 -5.781
301 HG22 THR 37 1HG2 THR 37 9.126 -7.643 -5.530
302 HG23 THR 37 2HG2 THR 37 9.309 -8.963 -4.373
303 H LYS 38 H LYS 38 9.444 -3.896 -5.377
304 HA LYS 38 HA LYS 38 10.841 -3.700 -7.781
305 HB2 LYS 38 1HB LYS 38 9.881 -5.733 -8.535
306 HB3 LYS 38 2HB LYS 38 8.289 -5.295 -7.929
307 HG2 LYS 38 1HG LYS 38 7.909 -3.790 -9.669
308 HG3 LYS 38 2HG LYS 38 9.620 -3.711 -10.095
309 HD2 LYS 38 1HD LYS 38 8.224 -6.336 -10.276
310 HD3 LYS 38 2HD LYS 38 7.916 -5.128 -11.525
311 HE2 LYS 38 1HE LYS 38 10.377 -4.947 -11.860
312 HE3 LYS 38 2HE LYS 38 10.585 -6.282 -10.727
313 HZ1 LYS 38 3HZ LYS 38 10.500 -6.765 -13.243
314 HZ2 LYS 38 1HZ LYS 38 8.825 -6.597 -13.067
315 HZ3 LYS 38 2HZ LYS 38 9.653 -7.781 -12.187
316 H ASP 39 H ASP 39 10.576 -1.668 -8.426
317 HA ASP 39 HA ASP 39 8.909 0.162 -7.208
318 HB2 ASP 39 1HB ASP 39 9.292 1.509 -9.407
319 HB3 ASP 39 2HB ASP 39 10.672 1.117 -8.386
320 H ASN 40 H ASN 40 6.802 0.547 -7.283
321 HA ASN 40 HA ASN 40 4.618 0.515 -7.916
322 HB2 ASN 40 1HB ASN 40 5.996 0.645 -10.588
323 HB3 ASN 40 2HB ASN 40 4.240 0.568 -10.473
324 HD21 ASN 40 2HD2 ASN 40 6.589 2.228 -8.418
325 HD22 ASN 40 1HD2 ASN 40 5.959 3.815 -8.680
326 H ASN 41 H ASN 41 4.758 -1.696 -6.915
327 HA ASN 41 HA ASN 41 4.560 -3.897 -8.818
328 HB2 ASN 41 1HB ASN 41 5.288 -3.628 -6.030
329 HB3 ASN 41 2HB ASN 41 4.053 -4.868 -6.234
330 HD21 ASN 41 2HD2 ASN 41 6.400 -5.696 -5.345
331 HD22 ASN 41 1HD2 ASN 41 7.287 -6.531 -6.570
332 H LYS 42 H LYS 42 2.703 -3.377 -5.845
333 HA LYS 42 HA LYS 42 0.230 -2.796 -6.988
334 HB2 LYS 42 1HB LYS 42 0.202 -4.897 -8.083
335 HB3 LYS 42 2HB LYS 42 0.802 -5.734 -6.657
336 HG2 LYS 42 1HG LYS 42 -1.251 -5.700 -5.607
337 HG3 LYS 42 2HG LYS 42 -1.832 -4.332 -6.561
338 HD2 LYS 42 1HD LYS 42 -1.595 -5.984 -8.564
339 HD3 LYS 42 2HD LYS 42 -1.641 -7.222 -7.307
340 HE2 LYS 42 1HE LYS 42 -3.705 -5.164 -7.036
341 HE3 LYS 42 2HE LYS 42 -3.826 -6.110 -8.519
342 HZ1 LYS 42 3HZ LYS 42 -4.942 -7.519 -7.200
343 HZ2 LYS 42 1HZ LYS 42 -4.265 -6.914 -5.772
344 HZ3 LYS 42 2HZ LYS 42 -3.405 -8.028 -6.710
345 H CYS 43 H CYS 43 -1.318 -2.432 -5.437
346 HA CYS 43 HA CYS 43 -1.015 -3.514 -2.772
347 HB2 CYS 43 1HB CYS 43 0.441 -1.349 -3.093
348 HB3 CYS 43 2HB CYS 43 -1.106 -0.526 -2.933
349 HG CYS 43 HG CYS 43 0.588 -2.328 -0.602
350 H THR 44 H THR 44 -2.806 -2.820 -1.333
351 HA THR 44 HA THR 44 -5.141 -1.710 -2.671
352 HB THR 44 HB THR 44 -6.007 -4.051 -1.240
353 HG1 THR 44 1HG THR 44 -3.743 -4.559 -2.239
354 HG21 THR 44 3HG2 THR 44 -7.263 -2.761 -2.960
355 HG22 THR 44 1HG2 THR 44 -7.210 -4.494 -3.282
356 HG23 THR 44 2HG2 THR 44 -6.163 -3.397 -4.183
357 H VAL 45 H VAL 45 -6.769 -0.998 -1.240
358 HA VAL 45 HA VAL 45 -6.339 -1.285 1.620
359 HB VAL 45 HB VAL 45 -6.325 1.433 0.298
360 HG11 VAL 45 1HG1 VAL 45 -6.283 0.662 3.213
361 HG12 VAL 45 2HG1 VAL 45 -6.028 2.293 2.591
362 HG13 VAL 45 3HG1 VAL 45 -7.585 1.493 2.362
363 HG21 VAL 45 3HG2 VAL 45 -4.174 0.365 0.096
364 HG22 VAL 45 1HG2 VAL 45 -4.078 1.620 1.332
365 HG23 VAL 45 2HG2 VAL 45 -4.190 -0.076 1.804
366 H ASP 46 H ASP 46 -8.260 -1.723 2.456
367 HA ASP 46 HA ASP 46 -10.664 -0.701 1.114
368 HB2 ASP 46 1HB ASP 46 -10.191 -3.062 2.926
369 HB3 ASP 46 2HB ASP 46 -11.812 -2.472 2.569
370 H THR 47 H THR 47 -12.399 0.152 2.362
371 HA THR 47 HA THR 47 -11.465 1.663 4.667
372 HB THR 47 HB THR 47 -13.586 2.890 4.490
373 HG1 THR 47 1HG THR 47 -15.176 2.208 3.222
374 HG21 THR 47 3HG2 THR 47 -12.187 4.057 3.153
375 HG22 THR 47 1HG2 THR 47 -13.204 3.423 1.859
376 HG23 THR 47 2HG2 THR 47 -11.683 2.625 2.257
377 H TYR 48 H TYR 48 -13.225 -1.176 4.024
378 HA TYR 48 HA TYR 48 -15.129 -1.293 6.014
379 HB2 TYR 48 1HB TYR 48 -14.978 -3.055 4.391
380 HB3 TYR 48 2HB TYR 48 -13.351 -3.475 4.915
381 HD1 TYR 48 1HD TYR 48 -16.853 -3.292 6.191
382 HD2 TYR 48 2HD TYR 48 -13.057 -5.199 6.441
383 HE1 TYR 48 1HE TYR 48 -17.791 -4.940 7.757
384 HE2 TYR 48 2HE TYR 48 -13.985 -6.853 8.007
385 HH TYR 48 HH TYR 48 -15.890 -7.687 8.889
386 H ASN 49 H ASN 49 -11.747 -2.402 6.258
387 HA ASN 49 HA ASN 49 -11.694 -1.612 9.052
388 HB2 ASN 49 1HB ASN 49 -10.862 -3.824 9.798
389 HB3 ASN 49 2HB ASN 49 -12.520 -3.893 9.208
390 HD21 ASN 49 2HD2 ASN 49 -11.746 -6.226 9.191
391 HD22 ASN 49 1HD2 ASN 49 -11.086 -6.796 7.699
392 H ASN 50 H ASN 50 -10.377 -0.566 6.797
393 HA ASN 50 HA ASN 50 -8.322 0.004 5.990
394 HB2 ASN 50 1HB ASN 50 -7.893 -0.460 8.914
395 HB3 ASN 50 2HB ASN 50 -6.496 -0.134 7.892
396 HD21 ASN 50 2HD2 ASN 50 -6.341 1.866 6.835
397 HD22 ASN 50 1HD2 ASN 50 -7.237 3.241 7.378
398 H ALA 51 H ALA 51 -8.802 -2.304 4.942
399 HA ALA 51 HA ALA 51 -6.891 -4.337 5.677
400 HB1 ALA 51 1HB ALA 51 -8.555 -4.263 3.172
401 HB2 ALA 51 2HB ALA 51 -7.866 -5.669 3.985
402 HB3 ALA 51 3HB ALA 51 -9.193 -4.780 4.733
403 H VAL 52 H VAL 52 -4.931 -3.126 5.441
404 HA VAL 52 HA VAL 52 -4.179 -2.106 2.854
405 HB VAL 52 HB VAL 52 -2.436 -2.556 5.280
406 HG11 VAL 52 1HG1 VAL 52 -0.925 -0.976 4.260
407 HG12 VAL 52 2HG1 VAL 52 -1.240 -2.292 3.128
408 HG13 VAL 52 3HG1 VAL 52 -2.035 -0.732 2.911
409 HG21 VAL 52 3HG2 VAL 52 -2.966 0.171 4.970
410 HG22 VAL 52 1HG2 VAL 52 -4.524 -0.636 4.785
411 HG23 VAL 52 2HG2 VAL 52 -3.563 -0.896 6.241
412 H ASP 53 H ASP 53 -4.145 -3.769 1.385
413 HA ASP 53 HA ASP 53 -2.753 -6.233 1.948
414 HB2 ASP 53 1HB ASP 53 -4.688 -5.356 0.062
415 HB3 ASP 53 2HB ASP 53 -3.286 -5.917 -0.845
416 H CYS 54 H CYS 54 -1.408 -6.885 -0.280
417 HA CYS 54 HA CYS 54 0.353 -4.853 -1.217
418 HB2 CYS 54 1HB CYS 54 1.003 -5.901 1.296
419 HB3 CYS 54 2HB CYS 54 2.075 -6.726 0.171
420 HG CYS 54 HG CYS 54 3.314 -4.488 -0.781
421 H ASP 55 H ASP 55 1.584 -5.536 -2.945
422 HA ASP 55 HA ASP 55 0.716 -7.674 -4.454
423 HB2 ASP 55 1HB ASP 55 2.229 -6.975 -5.988
424 HB3 ASP 55 2HB ASP 55 2.443 -5.623 -4.879
Start of MODEL 8
1 H1 ALA 1 H ALA 1 -15.563 1.467 -1.072
2 HA ALA 1 HA ALA 1 -14.826 4.051 -1.395
3 HB1 ALA 1 1HB ALA 1 -14.148 4.707 0.980
4 HB2 ALA 1 2HB ALA 1 -15.854 4.841 0.553
5 HB3 ALA 1 3HB ALA 1 -15.290 3.473 1.513
6 H LYS 2 H LYS 2 -13.810 1.648 -2.150
7 HA LYS 2 HA LYS 2 -11.529 0.928 -0.546
8 HB2 LYS 2 1HB LYS 2 -12.079 0.118 -3.400
9 HB3 LYS 2 2HB LYS 2 -11.066 -0.711 -2.225
10 HG2 LYS 2 1HG LYS 2 -13.111 -1.144 -0.871
11 HG3 LYS 2 2HG LYS 2 -14.065 -0.470 -2.195
12 HD2 LYS 2 1HD LYS 2 -12.127 -2.724 -2.626
13 HD3 LYS 2 2HD LYS 2 -13.788 -3.014 -2.105
14 HE2 LYS 2 1HE LYS 2 -14.663 -2.019 -4.084
15 HE3 LYS 2 2HE LYS 2 -13.077 -1.409 -4.552
16 HZ1 LYS 2 3HZ LYS 2 -12.541 -3.344 -5.485
17 HZ2 LYS 2 1HZ LYS 2 -14.187 -3.729 -5.404
18 HZ3 LYS 2 2HZ LYS 2 -13.133 -4.257 -4.190
19 H TYR 3 H TYR 3 -9.345 0.756 -1.737
20 HA TYR 3 HA TYR 3 -8.834 3.000 -3.524
21 HB2 TYR 3 1HB TYR 3 -7.243 2.694 -0.976
22 HB3 TYR 3 2HB TYR 3 -7.147 4.000 -2.152
23 HD1 TYR 3 2HD TYR 3 -9.234 5.474 -2.442
24 HD2 TYR 3 1HD TYR 3 -8.653 2.876 0.877
25 HE1 TYR 3 2HE TYR 3 -10.888 6.760 -1.153
26 HE2 TYR 3 1HE TYR 3 -10.306 4.154 2.174
27 HH TYR 3 HH TYR 3 -12.383 6.442 0.757
28 H THR 4 H THR 4 -6.305 3.033 -3.938
29 HA THR 4 HA THR 4 -5.060 0.432 -3.865
30 HB THR 4 HB THR 4 -4.824 1.001 -6.582
31 HG1 THR 4 1HG THR 4 -7.591 0.971 -5.992
32 HG21 THR 4 3HG2 THR 4 -6.890 -0.949 -5.740
33 HG22 THR 4 1HG2 THR 4 -5.271 -1.170 -5.080
34 HG23 THR 4 2HG2 THR 4 -5.516 -1.152 -6.826
35 H GLY 5 H GLY 5 -2.848 0.475 -4.436
36 HA2 GLY 5 1HA GLY 5 -1.648 2.938 -5.360
37 HA3 GLY 5 2HA GLY 5 -1.332 2.577 -3.669
38 H LYS 6 H LYS 6 0.920 2.637 -4.592
39 HA LYS 6 HA LYS 6 1.735 -0.104 -5.158
40 HB2 LYS 6 1HB LYS 6 2.860 2.145 -6.816
41 HB3 LYS 6 2HB LYS 6 3.036 0.413 -7.068
42 HG2 LYS 6 1HG LYS 6 0.552 0.342 -7.491
43 HG3 LYS 6 2HG LYS 6 0.594 2.106 -7.515
44 HD2 LYS 6 1HD LYS 6 2.685 1.219 -9.185
45 HD3 LYS 6 2HD LYS 6 1.265 0.255 -9.593
46 HE2 LYS 6 1HE LYS 6 -0.027 2.394 -9.755
47 HE3 LYS 6 2HE LYS 6 1.497 3.260 -9.563
48 HZ1 LYS 6 3HZ LYS 6 1.731 3.092 -11.748
49 HZ2 LYS 6 1HZ LYS 6 0.399 2.058 -11.890
50 HZ3 LYS 6 2HZ LYS 6 1.932 1.421 -11.566
51 H CYS 7 H CYS 7 3.802 -0.609 -4.449
52 HA CYS 7 HA CYS 7 4.908 1.259 -2.520
53 HB2 CYS 7 1HB CYS 7 5.552 -1.623 -3.159
54 HB3 CYS 7 2HB CYS 7 6.397 -0.684 -1.935
55 HG CYS 7 HG CYS 7 3.546 -0.171 -0.899
56 H THR 8 H THR 8 7.422 1.187 -2.377
57 HA THR 8 HA THR 8 8.527 1.558 -5.084
58 HB THR 8 HB THR 8 9.746 3.480 -4.405
59 HG1 THR 8 1HG THR 8 10.405 3.506 -2.398
60 HG21 THR 8 3HG2 THR 8 7.038 3.491 -4.531
61 HG22 THR 8 1HG2 THR 8 8.026 4.942 -4.359
62 HG23 THR 8 2HG2 THR 8 7.296 4.198 -2.936
63 H LYS 9 H LYS 9 8.794 -0.862 -3.885
64 HA LYS 9 HA LYS 9 10.346 -2.442 -3.368
65 HB2 LYS 9 1HB LYS 9 11.936 -0.233 -4.505
66 HB3 LYS 9 2HB LYS 9 12.840 -1.359 -3.500
67 HG2 LYS 9 1HG LYS 9 12.140 -3.213 -4.882
68 HG3 LYS 9 2HG LYS 9 11.128 -2.139 -5.852
69 HD2 LYS 9 1HD LYS 9 12.860 -1.550 -7.122
70 HD3 LYS 9 2HD LYS 9 13.828 -1.141 -5.703
71 HE2 LYS 9 1HE LYS 9 14.439 -3.497 -5.447
72 HE3 LYS 9 2HE LYS 9 13.468 -3.905 -6.860
73 HZ1 LYS 9 3HZ LYS 9 15.404 -1.827 -7.339
74 HZ2 LYS 9 1HZ LYS 9 15.063 -3.219 -8.240
75 HZ3 LYS 9 2HZ LYS 9 16.098 -3.308 -6.905
76 H SER 10 H SER 10 12.302 0.267 -2.221
77 HA SER 10 HA SER 10 12.822 -0.918 0.276
78 HB2 SER 10 1HB SER 10 13.860 1.199 0.877
79 HB3 SER 10 2HB SER 10 14.268 0.800 -0.791
80 HG SER 10 HG SER 10 12.807 2.897 0.210
81 H LYS 11 H LYS 11 10.625 1.724 -0.630
82 HA LYS 11 HA LYS 11 9.492 1.775 2.046
83 HB2 LYS 11 1HB LYS 11 9.700 3.618 -0.124
84 HB3 LYS 11 2HB LYS 11 7.995 3.391 0.242
85 HG2 LYS 11 1HG LYS 11 10.139 4.221 2.186
86 HG3 LYS 11 2HG LYS 11 8.893 5.259 1.488
87 HD2 LYS 11 1HD LYS 11 7.490 4.687 3.115
88 HD3 LYS 11 2HD LYS 11 7.628 2.989 2.654
89 HE2 LYS 11 1HE LYS 11 9.918 4.023 4.162
90 HE3 LYS 11 2HE LYS 11 8.398 4.039 5.054
91 HZ1 LYS 11 3HZ LYS 11 8.285 1.612 4.028
92 HZ2 LYS 11 1HZ LYS 11 9.040 1.936 5.506
93 HZ3 LYS 11 2HZ LYS 11 9.967 1.777 4.100
94 H ASN 12 H ASN 12 8.441 -0.197 2.242
95 HA ASN 12 HA ASN 12 6.548 -1.086 0.269
96 HB2 ASN 12 1HB ASN 12 7.821 -2.694 1.633
97 HB3 ASN 12 2HB ASN 12 7.040 -2.079 3.087
98 HD21 ASN 12 2HD2 ASN 12 5.773 -3.659 3.767
99 HD22 ASN 12 1HD2 ASN 12 4.604 -4.496 2.810
100 H GLU 13 H GLU 13 5.607 1.276 0.619
101 HA GLU 13 HA GLU 13 3.391 1.036 2.548
102 HB2 GLU 13 1HB GLU 13 3.352 3.437 2.745
103 HB3 GLU 13 2HB GLU 13 4.987 2.871 3.060
104 HG2 GLU 13 1HG GLU 13 5.498 3.414 0.646
105 HG3 GLU 13 2HG GLU 13 3.942 4.241 0.603
106 H CYS 14 H CYS 14 1.331 1.779 1.895
107 HA CYS 14 HA CYS 14 0.871 1.479 -0.960
108 HB2 CYS 14 1HB CYS 14 -0.570 0.212 0.510
109 HB3 CYS 14 2HB CYS 14 -1.027 1.669 1.385
110 HG CYS 14 HG CYS 14 -1.854 2.444 -1.560
111 H LYS 15 H LYS 15 0.808 3.176 -2.259
112 HA LYS 15 HA LYS 15 0.202 5.816 -1.131
113 HB2 LYS 15 1HB LYS 15 2.282 5.853 -2.256
114 HB3 LYS 15 2HB LYS 15 1.656 4.930 -3.615
115 HG2 LYS 15 1HG LYS 15 0.236 7.433 -3.215
116 HG3 LYS 15 2HG LYS 15 1.962 7.658 -3.509
117 HD2 LYS 15 1HD LYS 15 0.718 5.683 -5.269
118 HD3 LYS 15 2HD LYS 15 0.046 7.308 -5.441
119 HE2 LYS 15 1HE LYS 15 1.872 7.054 -6.982
120 HE3 LYS 15 2HE LYS 15 2.354 8.177 -5.710
121 HZ1 LYS 15 3HZ LYS 15 3.983 6.347 -6.420
122 HZ2 LYS 15 1HZ LYS 15 3.009 5.309 -5.503
123 HZ3 LYS 15 2HZ LYS 15 3.768 6.629 -4.766
124 H TYR 16 H TYR 16 -1.971 6.054 -1.165
125 HA TYR 16 HA TYR 16 -3.273 5.891 -3.795
126 HB2 TYR 16 1HB TYR 16 -5.235 4.894 -2.876
127 HB3 TYR 16 2HB TYR 16 -3.871 3.938 -2.304
128 HD1 TYR 16 2HD TYR 16 -3.099 4.185 0.053
129 HD2 TYR 16 1HD TYR 16 -6.655 6.049 -1.356
130 HE1 TYR 16 2HE TYR 16 -3.847 4.497 2.374
131 HE2 TYR 16 1HE TYR 16 -7.413 6.368 0.962
132 HH TYR 16 HH TYR 16 -5.785 4.899 3.646
133 H LYS 17 H LYS 17 -5.572 6.984 -3.551
134 HA LYS 17 HA LYS 17 -5.091 9.593 -2.277
135 HB2 LYS 17 1HB LYS 17 -5.340 9.656 -4.722
136 HB3 LYS 17 2HB LYS 17 -6.913 8.883 -4.586
137 HG2 LYS 17 1HG LYS 17 -7.360 10.973 -3.002
138 HG3 LYS 17 2HG LYS 17 -6.113 11.677 -4.035
139 HD2 LYS 17 1HD LYS 17 -8.412 10.211 -5.262
140 HD3 LYS 17 2HD LYS 17 -8.625 11.872 -4.707
141 HE2 LYS 17 1HE LYS 17 -7.383 12.721 -6.382
142 HE3 LYS 17 2HE LYS 17 -6.213 11.404 -6.315
143 HZ1 LYS 17 3HZ LYS 17 -8.039 10.022 -7.392
144 HZ2 LYS 17 1HZ LYS 17 -7.256 11.163 -8.366
145 HZ3 LYS 17 2HZ LYS 17 -8.795 11.493 -7.747
146 H ASN 18 H ASN 18 -6.444 10.337 -0.752
147 HA ASN 18 HA ASN 18 -8.979 8.908 -0.321
148 HB2 ASN 18 1HB ASN 18 -8.619 8.679 1.966
149 HB3 ASN 18 2HB ASN 18 -7.014 8.370 1.308
150 HD21 ASN 18 2HD2 ASN 18 -5.729 10.504 1.000
151 HD22 ASN 18 1HD2 ASN 18 -5.729 11.553 2.372
152 H ASP 19 H ASP 19 -10.530 10.157 1.023
153 HA ASP 19 HA ASP 19 -11.713 12.038 1.536
154 HB2 ASP 19 1HB ASP 19 -9.391 12.783 2.396
155 HB3 ASP 19 2HB ASP 19 -9.304 13.730 0.913
156 H ALA 20 H ALA 20 -9.452 13.307 -0.906
157 HA ALA 20 HA ALA 20 -11.122 13.079 -3.123
158 HB1 ALA 20 1HB ALA 20 -11.526 15.574 -1.517
159 HB2 ALA 20 2HB ALA 20 -11.755 15.576 -3.266
160 HB3 ALA 20 3HB ALA 20 -12.728 14.512 -2.250
161 H GLY 21 H GLY 21 -8.378 12.860 -2.547
162 HA2 GLY 21 1HA GLY 21 -6.873 13.457 -4.498
163 HA3 GLY 21 2HA GLY 21 -7.233 15.122 -4.062
164 H LYS 22 H LYS 22 -7.152 13.517 -1.221
165 HA LYS 22 HA LYS 22 -4.549 14.560 -0.563
166 HB2 LYS 22 1HB LYS 22 -6.710 13.169 1.001
167 HB3 LYS 22 2HB LYS 22 -5.130 13.481 1.708
168 HG2 LYS 22 1HG LYS 22 -5.749 15.929 0.721
169 HG3 LYS 22 2HG LYS 22 -7.347 15.315 1.152
170 HD2 LYS 22 1HD LYS 22 -6.725 16.259 3.145
171 HD3 LYS 22 2HD LYS 22 -6.109 14.621 3.374
172 HE2 LYS 22 1HE LYS 22 -4.115 15.524 3.770
173 HE3 LYS 22 2HE LYS 22 -4.059 15.981 2.068
174 HZ1 LYS 22 3HZ LYS 22 -3.684 17.940 3.275
175 HZ2 LYS 22 1HZ LYS 22 -4.935 17.624 4.369
176 HZ3 LYS 22 2HZ LYS 22 -5.295 18.048 2.772
177 H ASP 23 H ASP 23 -2.683 13.482 -0.464
178 HA ASP 23 HA ASP 23 -2.565 10.759 -1.354
179 HB2 ASP 23 1HB ASP 23 -0.132 11.018 -1.136
180 HB3 ASP 23 2HB ASP 23 -0.842 12.374 -2.008
181 H THR 24 H THR 24 -1.928 8.945 -0.214
182 HA THR 24 HA THR 24 -1.620 9.213 2.693
183 HB THR 24 HB THR 24 -3.479 7.235 1.359
184 HG1 THR 24 1HG THR 24 -4.101 9.356 3.155
185 HG21 THR 24 3HG2 THR 24 -2.858 7.683 4.281
186 HG22 THR 24 1HG2 THR 24 -2.359 6.290 3.321
187 HG23 THR 24 2HG2 THR 24 -4.069 6.572 3.643
188 H PHE 25 H PHE 25 0.003 8.032 3.482
189 HA PHE 25 HA PHE 25 0.953 5.721 1.933
190 HB2 PHE 25 1HB PHE 25 2.748 7.774 3.241
191 HB3 PHE 25 2HB PHE 25 3.265 6.367 2.316
192 HD1 PHE 25 2HD PHE 25 1.581 9.642 2.086
193 HD2 PHE 25 1HD PHE 25 3.388 6.427 -0.038
194 HE1 PHE 25 2HE PHE 25 1.558 10.993 0.030
195 HE2 PHE 25 1HE PHE 25 3.370 7.772 -2.098
196 HZ PHE 25 HZ PHE 25 2.453 10.058 -2.066
197 H ILE 26 H ILE 26 1.031 3.939 3.119
198 HA ILE 26 HA ILE 26 1.789 4.081 5.929
199 HB ILE 26 HB ILE 26 -0.609 4.253 6.090
200 HG12 ILE 26 1HG1 ILE 26 -0.279 1.354 6.657
201 HG13 ILE 26 2HG1 ILE 26 0.864 2.451 7.425
202 HG21 ILE 26 1HG2 ILE 26 -0.590 2.653 3.774
203 HG22 ILE 26 2HG2 ILE 26 -1.445 1.739 5.015
204 HG23 ILE 26 3HG2 ILE 26 -1.981 3.364 4.590
205 HD11 ILE 26 3HD1 ILE 26 -1.593 1.759 8.397
206 HD12 ILE 26 1HD1 ILE 26 -0.650 3.165 8.888
207 HD13 ILE 26 2HD1 ILE 26 -1.900 3.329 7.655
208 H LYS 27 H LYS 27 3.322 2.618 6.215
209 HA LYS 27 HA LYS 27 4.042 0.652 4.377
210 HB2 LYS 27 1HB LYS 27 4.912 1.534 6.967
211 HB3 LYS 27 2HB LYS 27 4.890 -0.223 6.932
212 HG2 LYS 27 1HG LYS 27 6.067 0.823 4.524
213 HG3 LYS 27 2HG LYS 27 6.877 1.466 5.954
214 HD2 LYS 27 1HD LYS 27 6.279 -1.426 5.985
215 HD3 LYS 27 2HD LYS 27 7.501 -0.896 4.827
216 HE2 LYS 27 1HE LYS 27 8.933 -1.042 6.539
217 HE3 LYS 27 2HE LYS 27 8.209 0.465 7.096
218 HZ1 LYS 27 3HZ LYS 27 8.238 -1.137 8.871
219 HZ2 LYS 27 1HZ LYS 27 7.415 -2.274 7.924
220 HZ3 LYS 27 2HZ LYS 27 6.635 -0.854 8.410
221 H CYS 28 H CYS 28 3.192 -1.252 3.878
222 HA CYS 28 HA CYS 28 0.954 -2.293 5.334
223 HB2 CYS 28 1HB CYS 28 2.446 -3.719 3.137
224 HB3 CYS 28 2HB CYS 28 0.756 -3.894 3.594
225 HG CYS 28 HG CYS 28 2.085 -1.926 1.344
226 HA PRO 29 HA PRO 29 2.938 -5.122 8.037
227 HB2 PRO 29 1HB PRO 29 1.124 -7.141 8.109
228 HB3 PRO 29 2HB PRO 29 0.856 -5.579 8.893
229 HG2 PRO 29 1HG PRO 29 -0.154 -6.574 6.256
230 HG3 PRO 29 2HG PRO 29 -1.015 -5.667 7.514
231 HD2 PRO 29 1HD PRO 29 -0.030 -4.488 5.285
232 HD3 PRO 29 2HD PRO 29 -0.124 -3.649 6.847
233 H LYS 30 H LYS 30 4.765 -5.750 6.854
234 HA LYS 30 HA LYS 30 4.662 -8.470 5.856
235 HB2 LYS 30 1HB LYS 30 5.367 -6.113 4.126
236 HB3 LYS 30 2HB LYS 30 6.030 -7.710 3.801
237 HG2 LYS 30 1HG LYS 30 3.099 -7.022 3.914
238 HG3 LYS 30 2HG LYS 30 4.052 -7.241 2.445
239 HD2 LYS 30 1HD LYS 30 4.563 -9.563 3.223
240 HD3 LYS 30 2HD LYS 30 3.416 -9.313 4.541
241 HE2 LYS 30 1HE LYS 30 2.466 -8.712 1.803
242 HE3 LYS 30 2HE LYS 30 2.734 -10.409 2.197
243 HZ1 LYS 30 3HZ LYS 30 1.254 -8.843 4.153
244 HZ2 LYS 30 1HZ LYS 30 1.020 -10.438 3.640
245 HZ3 LYS 30 2HZ LYS 30 0.460 -9.155 2.691
246 H PHE 31 H PHE 31 5.824 -8.231 8.058
247 HA PHE 31 HA PHE 31 8.591 -7.362 7.803
248 HB2 PHE 31 1HB PHE 31 7.305 -8.636 10.218
249 HB3 PHE 31 2HB PHE 31 8.753 -7.636 10.165
250 HD1 PHE 31 1HD PHE 31 8.521 -5.197 9.610
251 HD2 PHE 31 2HD PHE 31 5.183 -7.684 10.493
252 HE1 PHE 31 1HE PHE 31 7.161 -3.200 10.075
253 HE2 PHE 31 2HE PHE 31 3.817 -5.692 10.960
254 HZ PHE 31 HZ PHE 31 4.805 -3.446 10.749
255 H ASP 32 H ASP 32 9.779 -8.779 6.658
256 HA ASP 32 HA ASP 32 10.784 -10.717 5.999
257 HB2 ASP 32 1HB ASP 32 10.402 -11.520 8.889
258 HB3 ASP 32 2HB ASP 32 11.619 -12.131 7.773
259 H ASN 33 H ASN 33 8.811 -11.186 4.749
260 HA ASN 33 HA ASN 33 7.998 -13.861 5.082
261 HB2 ASN 33 1HB ASN 33 6.633 -12.793 6.898
262 HB3 ASN 33 2HB ASN 33 5.811 -11.853 5.655
263 HD21 ASN 33 2HD2 ASN 33 5.063 -14.094 7.599
264 HD22 ASN 33 1HD2 ASN 33 4.183 -15.205 6.609
265 H LYS 34 H LYS 34 7.303 -10.698 3.711
266 HA LYS 34 HA LYS 34 7.431 -11.600 1.055
267 HB2 LYS 34 1HB LYS 34 5.114 -12.458 2.015
268 HB3 LYS 34 2HB LYS 34 4.617 -10.808 1.661
269 HG2 LYS 34 1HG LYS 34 5.802 -12.747 -0.315
270 HG3 LYS 34 2HG LYS 34 4.094 -12.327 -0.174
271 HD2 LYS 34 1HD LYS 34 4.645 -9.988 -0.690
272 HD3 LYS 34 2HD LYS 34 6.343 -10.435 -0.865
273 HE2 LYS 34 1HE LYS 34 5.014 -12.222 -2.504
274 HE3 LYS 34 2HE LYS 34 4.138 -10.711 -2.738
275 HZ1 LYS 34 3HZ LYS 34 6.536 -9.754 -2.958
276 HZ2 LYS 34 1HZ LYS 34 5.794 -10.509 -4.279
277 HZ3 LYS 34 2HZ LYS 34 6.934 -11.350 -3.354
278 H LYS 35 H LYS 35 8.804 -9.636 1.763
279 HA LYS 35 HA LYS 35 7.448 -7.097 1.798
280 HB2 LYS 35 1HB LYS 35 10.401 -7.593 1.412
281 HB3 LYS 35 2HB LYS 35 9.629 -6.120 1.984
282 HG2 LYS 35 1HG LYS 35 8.759 -7.946 3.811
283 HG3 LYS 35 2HG LYS 35 10.380 -8.540 3.440
284 HD2 LYS 35 1HD LYS 35 10.766 -5.831 3.686
285 HD3 LYS 35 2HD LYS 35 9.544 -6.163 4.915
286 HE2 LYS 35 1HE LYS 35 11.288 -6.723 6.207
287 HE3 LYS 35 2HE LYS 35 11.281 -8.228 5.290
288 HZ1 LYS 35 3HZ LYS 35 12.720 -6.420 3.780
289 HZ2 LYS 35 1HZ LYS 35 13.330 -7.733 4.657
290 HZ3 LYS 35 2HZ LYS 35 13.256 -6.202 5.371
291 H CYS 36 H CYS 36 8.279 -5.347 0.248
292 HA CYS 36 HA CYS 36 7.583 -6.139 -2.402
293 HB2 CYS 36 1HB CYS 36 7.113 -3.888 -1.311
294 HB3 CYS 36 2HB CYS 36 8.805 -3.501 -1.596
295 HG CYS 36 HG CYS 36 8.673 -3.140 -4.204
296 H THR 37 H THR 37 8.872 -5.922 -4.302
297 HA THR 37 HA THR 37 11.742 -5.661 -4.026
298 HB THR 37 HB THR 37 12.068 -7.888 -5.274
299 HG1 THR 37 1HG THR 37 9.814 -8.277 -5.624
300 HG21 THR 37 3HG2 THR 37 12.376 -7.231 -2.697
301 HG22 THR 37 1HG2 THR 37 12.691 -8.854 -3.311
302 HG23 THR 37 2HG2 THR 37 11.156 -8.492 -2.520
303 H LYS 38 H LYS 38 9.881 -4.097 -5.396
304 HA LYS 38 HA LYS 38 11.062 -3.855 -7.912
305 HB2 LYS 38 1HB LYS 38 9.970 -5.843 -8.623
306 HB3 LYS 38 2HB LYS 38 8.453 -5.364 -7.876
307 HG2 LYS 38 1HG LYS 38 7.902 -3.935 -9.576
308 HG3 LYS 38 2HG LYS 38 9.586 -3.647 -10.026
309 HD2 LYS 38 1HD LYS 38 9.747 -5.715 -11.145
310 HD3 LYS 38 2HD LYS 38 8.261 -6.320 -10.407
311 HE2 LYS 38 1HE LYS 38 8.389 -4.000 -12.328
312 HE3 LYS 38 2HE LYS 38 8.017 -5.658 -12.796
313 HZ1 LYS 38 3HZ LYS 38 5.920 -4.955 -12.459
314 HZ2 LYS 38 1HZ LYS 38 6.371 -3.711 -11.405
315 HZ3 LYS 38 2HZ LYS 38 6.259 -5.301 -10.838
316 H ASP 39 H ASP 39 10.889 -1.753 -8.276
317 HA ASP 39 HA ASP 39 9.297 0.023 -6.903
318 HB2 ASP 39 1HB ASP 39 9.950 1.681 -8.477
319 HB3 ASP 39 2HB ASP 39 11.291 0.544 -8.384
320 H ASN 40 H ASN 40 7.203 0.482 -6.902
321 HA ASN 40 HA ASN 40 5.006 0.572 -7.486
322 HB2 ASN 40 1HB ASN 40 6.432 0.995 -10.064
323 HB3 ASN 40 2HB ASN 40 4.708 0.643 -10.145
324 HD21 ASN 40 2HD2 ASN 40 6.708 2.526 -7.901
325 HD22 ASN 40 1HD2 ASN 40 5.802 3.989 -8.055
326 H ASN 41 H ASN 41 5.212 -1.741 -6.634
327 HA ASN 41 HA ASN 41 4.918 -3.821 -8.626
328 HB2 ASN 41 1HB ASN 41 5.544 -3.687 -5.811
329 HB3 ASN 41 2HB ASN 41 4.254 -4.853 -6.092
330 HD21 ASN 41 2HD2 ASN 41 6.720 -5.626 -5.167
331 HD22 ASN 41 1HD2 ASN 41 7.527 -6.551 -6.383
332 H LYS 42 H LYS 42 2.941 -3.327 -5.725
333 HA LYS 42 HA LYS 42 0.545 -2.643 -6.987
334 HB2 LYS 42 1HB LYS 42 0.537 -4.757 -8.083
335 HB3 LYS 42 2HB LYS 42 0.983 -5.602 -6.608
336 HG2 LYS 42 1HG LYS 42 -1.133 -5.672 -5.846
337 HG3 LYS 42 2HG LYS 42 -1.534 -4.079 -6.493
338 HD2 LYS 42 1HD LYS 42 -2.269 -4.921 -8.457
339 HD3 LYS 42 2HD LYS 42 -1.034 -6.181 -8.498
340 HE2 LYS 42 1HE LYS 42 -2.625 -6.905 -6.364
341 HE3 LYS 42 2HE LYS 42 -3.780 -6.281 -7.540
342 HZ1 LYS 42 3HZ LYS 42 -3.503 -8.055 -8.833
343 HZ2 LYS 42 1HZ LYS 42 -2.720 -8.784 -7.521
344 HZ3 LYS 42 2HZ LYS 42 -1.816 -8.002 -8.718
345 H CYS 43 H CYS 43 -0.983 -2.118 -5.498
346 HA CYS 43 HA CYS 43 -0.843 -3.234 -2.816
347 HB2 CYS 43 1HB CYS 43 0.271 -0.676 -3.470
348 HB3 CYS 43 2HB CYS 43 -1.132 -0.439 -2.435
349 HG CYS 43 HG CYS 43 0.865 -2.861 -1.326
350 H THR 44 H THR 44 -2.711 -2.701 -1.507
351 HA THR 44 HA THR 44 -4.956 -1.405 -2.804
352 HB THR 44 HB THR 44 -5.963 -3.915 -1.853
353 HG1 THR 44 1HG THR 44 -4.902 -5.075 -3.746
354 HG21 THR 44 3HG2 THR 44 -6.764 -2.150 -3.635
355 HG22 THR 44 1HG2 THR 44 -7.194 -3.852 -3.794
356 HG23 THR 44 2HG2 THR 44 -5.865 -3.185 -4.744
357 H VAL 45 H VAL 45 -6.655 -0.896 -1.378
358 HA VAL 45 HA VAL 45 -6.403 -1.663 1.418
359 HB VAL 45 HB VAL 45 -6.218 1.206 0.501
360 HG11 VAL 45 1HG1 VAL 45 -6.038 1.409 3.159
361 HG12 VAL 45 2HG1 VAL 45 -7.567 1.556 2.290
362 HG13 VAL 45 3HG1 VAL 45 -7.130 0.029 3.058
363 HG21 VAL 45 3HG2 VAL 45 -4.392 -0.434 2.255
364 HG22 VAL 45 1HG2 VAL 45 -4.109 -0.070 0.553
365 HG23 VAL 45 2HG2 VAL 45 -4.137 1.234 1.741
366 H ASP 46 H ASP 46 -8.315 -1.605 2.526
367 HA ASP 46 HA ASP 46 -10.666 -0.616 1.047
368 HB2 ASP 46 1HB ASP 46 -10.139 -3.252 1.616
369 HB3 ASP 46 2HB ASP 46 -11.174 -2.781 2.961
370 H THR 47 H THR 47 -12.501 -0.001 2.387
371 HA THR 47 HA THR 47 -11.593 1.296 4.846
372 HB THR 47 HB THR 47 -13.848 2.466 4.697
373 HG1 THR 47 1HG THR 47 -15.082 1.378 3.305
374 HG21 THR 47 3HG2 THR 47 -12.090 3.816 4.045
375 HG22 THR 47 1HG2 THR 47 -13.060 3.781 2.574
376 HG23 THR 47 2HG2 THR 47 -11.632 2.756 2.711
377 H TYR 48 H TYR 48 -13.147 -1.506 3.935
378 HA TYR 48 HA TYR 48 -15.279 -1.820 5.654
379 HB2 TYR 48 1HB TYR 48 -14.817 -3.515 4.032
380 HB3 TYR 48 2HB TYR 48 -13.228 -3.829 4.717
381 HD1 TYR 48 1HD TYR 48 -16.843 -3.934 5.646
382 HD2 TYR 48 2HD TYR 48 -12.968 -5.607 6.179
383 HE1 TYR 48 1HE TYR 48 -17.808 -5.705 7.053
384 HE2 TYR 48 2HE TYR 48 -13.921 -7.383 7.588
385 HH TYR 48 HH TYR 48 -16.978 -7.247 8.898
386 H ASN 49 H ASN 49 -11.872 -2.637 6.309
387 HA ASN 49 HA ASN 49 -12.263 -1.995 9.114
388 HB2 ASN 49 1HB ASN 49 -11.507 -4.113 9.962
389 HB3 ASN 49 2HB ASN 49 -12.849 -4.424 8.865
390 HD21 ASN 49 2HD2 ASN 49 -10.978 -6.349 9.616
391 HD22 ASN 49 1HD2 ASN 49 -10.069 -6.807 8.221
392 H ASN 50 H ASN 50 -10.780 -0.707 7.101
393 HA ASN 50 HA ASN 50 -8.709 0.103 6.604
394 HB2 ASN 50 1HB ASN 50 -9.078 0.353 9.264
395 HB3 ASN 50 2HB ASN 50 -7.627 -0.644 9.261
396 HD21 ASN 50 2HD2 ASN 50 -6.347 0.304 7.020
397 HD22 ASN 50 1HD2 ASN 50 -5.878 1.947 7.282
398 H ALA 51 H ALA 51 -8.975 -2.390 5.605
399 HA ALA 51 HA ALA 51 -6.691 -3.999 6.408
400 HB1 ALA 51 1HB ALA 51 -8.344 -5.467 5.900
401 HB2 ALA 51 2HB ALA 51 -9.071 -4.406 4.693
402 HB3 ALA 51 3HB ALA 51 -7.622 -5.330 4.297
403 H VAL 52 H VAL 52 -4.742 -3.561 5.632
404 HA VAL 52 HA VAL 52 -4.509 -2.284 2.994
405 HB VAL 52 HB VAL 52 -2.369 -2.500 5.112
406 HG11 VAL 52 1HG1 VAL 52 -2.492 -0.478 2.908
407 HG12 VAL 52 2HG1 VAL 52 -1.096 -1.055 3.821
408 HG13 VAL 52 3HG1 VAL 52 -1.847 -2.091 2.608
409 HG21 VAL 52 3HG2 VAL 52 -4.542 -0.500 4.704
410 HG22 VAL 52 1HG2 VAL 52 -3.874 -1.150 6.201
411 HG23 VAL 52 2HG2 VAL 52 -2.968 0.049 5.278
412 H ASP 53 H ASP 53 -4.356 -3.838 1.484
413 HA ASP 53 HA ASP 53 -2.953 -6.307 1.965
414 HB2 ASP 53 1HB ASP 53 -4.745 -5.232 -0.068
415 HB3 ASP 53 2HB ASP 53 -3.415 -6.152 -0.768
416 H CYS 54 H CYS 54 -1.335 -7.064 0.267
417 HA CYS 54 HA CYS 54 0.451 -4.882 -0.555
418 HB2 CYS 54 1HB CYS 54 1.750 -7.359 0.425
419 HB3 CYS 54 2HB CYS 54 2.271 -5.684 0.561
420 HG CYS 54 HG CYS 54 -0.025 -5.375 2.505
421 H ASP 55 H ASP 55 2.099 -5.599 -2.146
422 HA ASP 55 HA ASP 55 0.911 -6.895 -4.322
423 HB2 ASP 55 1HB ASP 55 3.374 -7.021 -5.143
424 HB3 ASP 55 2HB ASP 55 2.638 -5.440 -4.899
Start of MODEL 9
1 H1 ALA 1 H ALA 1 -16.175 1.331 1.045
2 HA ALA 1 HA ALA 1 -15.584 2.833 -1.383
3 HB1 ALA 1 1HB ALA 1 -15.735 4.110 1.110
4 HB2 ALA 1 2HB ALA 1 -14.016 3.950 0.744
5 HB3 ALA 1 3HB ALA 1 -15.089 4.759 -0.399
6 H LYS 2 H LYS 2 -13.525 2.500 -2.185
7 HA LYS 2 HA LYS 2 -11.646 0.905 -0.625
8 HB2 LYS 2 1HB LYS 2 -12.517 0.037 -3.383
9 HB3 LYS 2 2HB LYS 2 -11.394 -0.795 -2.315
10 HG2 LYS 2 1HG LYS 2 -13.404 -0.913 -0.691
11 HG3 LYS 2 2HG LYS 2 -14.369 -0.578 -2.131
12 HD2 LYS 2 1HD LYS 2 -13.474 -2.534 -3.233
13 HD3 LYS 2 2HD LYS 2 -12.384 -2.838 -1.878
14 HE2 LYS 2 1HE LYS 2 -14.091 -3.550 -0.496
15 HE3 LYS 2 2HE LYS 2 -15.327 -2.674 -1.397
16 HZ1 LYS 2 3HZ LYS 2 -14.500 -4.391 -3.246
17 HZ2 LYS 2 1HZ LYS 2 -15.770 -4.722 -2.178
18 HZ3 LYS 2 2HZ LYS 2 -14.220 -5.319 -1.860
19 H TYR 3 H TYR 3 -9.532 0.667 -1.791
20 HA TYR 3 HA TYR 3 -9.028 2.697 -3.820
21 HB2 TYR 3 1HB TYR 3 -7.402 2.635 -1.276
22 HB3 TYR 3 2HB TYR 3 -7.287 3.798 -2.592
23 HD1 TYR 3 1HD TYR 3 -9.360 2.675 0.246
24 HD2 TYR 3 2HD TYR 3 -8.764 5.670 -2.718
25 HE1 TYR 3 1HE TYR 3 -10.966 4.134 1.404
26 HE2 TYR 3 2HE TYR 3 -10.367 7.137 -1.566
27 HH TYR 3 HH TYR 3 -12.554 6.316 0.361
28 H THR 4 H THR 4 -7.037 2.421 -4.932
29 HA THR 4 HA THR 4 -5.557 -0.043 -4.362
30 HB THR 4 HB THR 4 -7.297 -0.578 -6.063
31 HG1 THR 4 1HG THR 4 -5.744 -1.497 -7.553
32 HG21 THR 4 3HG2 THR 4 -5.809 0.939 -8.131
33 HG22 THR 4 1HG2 THR 4 -6.889 1.859 -7.086
34 HG23 THR 4 2HG2 THR 4 -7.519 0.520 -8.046
35 H GLY 5 H GLY 5 -3.405 0.035 -4.855
36 HA2 GLY 5 1HA GLY 5 -2.352 2.142 -6.547
37 HA3 GLY 5 2HA GLY 5 -1.958 2.302 -4.842
38 H LYS 6 H LYS 6 0.238 2.005 -5.102
39 HA LYS 6 HA LYS 6 1.050 -0.766 -5.502
40 HB2 LYS 6 1HB LYS 6 2.550 1.439 -6.903
41 HB3 LYS 6 2HB LYS 6 2.727 -0.298 -7.112
42 HG2 LYS 6 1HG LYS 6 0.332 -0.270 -7.982
43 HG3 LYS 6 2HG LYS 6 0.517 1.484 -8.077
44 HD2 LYS 6 1HD LYS 6 2.816 0.333 -9.254
45 HD3 LYS 6 2HD LYS 6 1.416 -0.521 -9.905
46 HE2 LYS 6 1HE LYS 6 1.714 2.479 -9.829
47 HE3 LYS 6 2HE LYS 6 2.079 1.473 -11.229
48 HZ1 LYS 6 3HZ LYS 6 -0.269 0.685 -11.111
49 HZ2 LYS 6 1HZ LYS 6 -0.101 2.323 -11.503
50 HZ3 LYS 6 2HZ LYS 6 -0.561 1.871 -9.940
51 H CYS 7 H CYS 7 3.446 -1.016 -4.955
52 HA CYS 7 HA CYS 7 4.122 0.797 -2.731
53 HB2 CYS 7 1HB CYS 7 4.728 -2.160 -2.925
54 HB3 CYS 7 2HB CYS 7 5.115 -1.106 -1.571
55 HG CYS 7 HG CYS 7 2.528 -2.943 -1.886
56 H THR 8 H THR 8 6.372 1.124 -2.303
57 HA THR 8 HA THR 8 8.032 0.797 -4.712
58 HB THR 8 HB THR 8 7.786 3.113 -4.298
59 HG1 THR 8 1HG THR 8 9.959 3.688 -3.643
60 HG21 THR 8 3HG2 THR 8 8.494 2.558 -1.413
61 HG22 THR 8 1HG2 THR 8 6.894 2.977 -2.023
62 HG23 THR 8 2HG2 THR 8 8.208 4.150 -2.115
63 H LYS 9 H LYS 9 10.072 -0.049 -4.570
64 HA LYS 9 HA LYS 9 10.627 -1.892 -2.536
65 HB2 LYS 9 1HB LYS 9 12.903 -2.004 -3.559
66 HB3 LYS 9 2HB LYS 9 11.591 -2.187 -4.717
67 HG2 LYS 9 1HG LYS 9 11.871 0.086 -5.464
68 HG3 LYS 9 2HG LYS 9 13.091 0.378 -4.222
69 HD2 LYS 9 1HD LYS 9 13.332 -1.639 -6.456
70 HD3 LYS 9 2HD LYS 9 14.076 -0.039 -6.448
71 HE2 LYS 9 1HE LYS 9 14.624 -2.312 -4.545
72 HE3 LYS 9 2HE LYS 9 15.711 -1.674 -5.778
73 HZ1 LYS 9 3HZ LYS 9 14.814 -0.330 -3.293
74 HZ2 LYS 9 1HZ LYS 9 15.615 0.481 -4.543
75 HZ3 LYS 9 2HZ LYS 9 16.390 -0.775 -3.717
76 H SER 10 H SER 10 11.273 1.491 -2.780
77 HA SER 10 HA SER 10 13.362 1.529 -0.801
78 HB2 SER 10 1HB SER 10 13.189 3.968 -0.969
79 HB3 SER 10 2HB SER 10 13.245 3.242 -2.575
80 HG SER 10 HG SER 10 11.590 4.653 -2.678
81 H LYS 11 H LYS 11 9.952 1.450 -0.768
82 HA LYS 11 HA LYS 11 9.899 1.490 2.103
83 HB2 LYS 11 1HB LYS 11 9.617 3.951 0.914
84 HB3 LYS 11 2HB LYS 11 7.947 3.433 1.096
85 HG2 LYS 11 1HG LYS 11 7.997 3.596 3.345
86 HG3 LYS 11 2HG LYS 11 9.682 3.080 3.455
87 HD2 LYS 11 1HD LYS 11 9.592 5.587 2.109
88 HD3 LYS 11 2HD LYS 11 8.629 5.710 3.584
89 HE2 LYS 11 1HE LYS 11 10.622 6.148 4.540
90 HE3 LYS 11 2HE LYS 11 10.789 4.392 4.521
91 HZ1 LYS 11 3HZ LYS 11 11.737 6.117 2.306
92 HZ2 LYS 11 1HZ LYS 11 12.107 4.489 2.587
93 HZ3 LYS 11 2HZ LYS 11 12.719 5.686 3.615
94 H ASN 12 H ASN 12 8.609 -0.151 2.582
95 HA ASN 12 HA ASN 12 6.660 -1.123 0.701
96 HB2 ASN 12 1HB ASN 12 8.058 -2.633 2.116
97 HB3 ASN 12 2HB ASN 12 7.185 -2.052 3.532
98 HD21 ASN 12 2HD2 ASN 12 5.738 -3.449 4.191
99 HD22 ASN 12 1HD2 ASN 12 4.753 -4.454 3.190
100 H GLU 13 H GLU 13 5.717 1.249 1.048
101 HA GLU 13 HA GLU 13 3.464 0.931 2.916
102 HB2 GLU 13 1HB GLU 13 3.549 3.217 3.545
103 HB3 GLU 13 2HB GLU 13 5.192 2.608 3.693
104 HG2 GLU 13 1HG GLU 13 5.638 3.563 1.413
105 HG3 GLU 13 2HG GLU 13 4.064 4.347 1.519
106 H CYS 14 H CYS 14 1.492 1.277 2.076
107 HA CYS 14 HA CYS 14 1.094 1.401 -0.685
108 HB2 CYS 14 1HB CYS 14 -1.187 1.356 -0.229
109 HB3 CYS 14 2HB CYS 14 -0.503 0.642 1.226
110 HG CYS 14 HG CYS 14 -2.208 2.143 2.510
111 H LYS 15 H LYS 15 0.356 3.034 -2.058
112 HA LYS 15 HA LYS 15 0.525 5.781 -1.026
113 HB2 LYS 15 1HB LYS 15 1.660 6.409 -3.185
114 HB3 LYS 15 2HB LYS 15 2.635 5.443 -2.084
115 HG2 LYS 15 1HG LYS 15 2.907 3.860 -3.608
116 HG3 LYS 15 2HG LYS 15 1.168 3.750 -3.891
117 HD2 LYS 15 1HD LYS 15 1.974 4.387 -5.969
118 HD3 LYS 15 2HD LYS 15 1.508 5.933 -5.254
119 HE2 LYS 15 1HE LYS 15 4.268 5.057 -4.713
120 HE3 LYS 15 2HE LYS 15 3.911 5.448 -6.395
121 HZ1 LYS 15 3HZ LYS 15 3.755 7.203 -4.026
122 HZ2 LYS 15 1HZ LYS 15 2.908 7.575 -5.442
123 HZ3 LYS 15 2HZ LYS 15 4.594 7.451 -5.473
124 H TYR 16 H TYR 16 -1.794 5.696 -1.042
125 HA TYR 16 HA TYR 16 -2.928 5.949 -3.750
126 HB2 TYR 16 1HB TYR 16 -4.944 4.936 -3.043
127 HB3 TYR 16 2HB TYR 16 -3.663 3.918 -2.396
128 HD1 TYR 16 1HD TYR 16 -2.900 4.537 0.059
129 HD2 TYR 16 2HD TYR 16 -6.664 5.571 -1.636
130 HE1 TYR 16 1HE TYR 16 -3.845 4.776 2.317
131 HE2 TYR 16 2HE TYR 16 -7.618 5.815 0.618
132 HH TYR 16 HH TYR 16 -7.220 5.773 2.801
133 H LYS 17 H LYS 17 -5.384 6.945 -3.166
134 HA LYS 17 HA LYS 17 -4.831 9.445 -1.708
135 HB2 LYS 17 1HB LYS 17 -6.378 10.539 -3.400
136 HB3 LYS 17 2HB LYS 17 -4.789 10.068 -3.990
137 HG2 LYS 17 1HG LYS 17 -5.821 7.991 -4.901
138 HG3 LYS 17 2HG LYS 17 -7.398 8.640 -4.448
139 HD2 LYS 17 1HD LYS 17 -6.802 10.676 -5.839
140 HD3 LYS 17 2HD LYS 17 -5.442 9.735 -6.457
141 HE2 LYS 17 1HE LYS 17 -7.591 8.022 -6.718
142 HE3 LYS 17 2HE LYS 17 -8.271 9.597 -7.124
143 HZ1 LYS 17 3HZ LYS 17 -7.330 8.375 -9.044
144 HZ2 LYS 17 1HZ LYS 17 -5.797 8.500 -8.339
145 HZ3 LYS 17 2HZ LYS 17 -6.630 9.896 -8.806
146 H ASN 18 H ASN 18 -6.125 9.663 -0.017
147 HA ASN 18 HA ASN 18 -8.773 8.381 -0.092
148 HB2 ASN 18 1HB ASN 18 -8.626 7.957 2.178
149 HB3 ASN 18 2HB ASN 18 -6.939 7.803 1.698
150 HD21 ASN 18 2HD2 ASN 18 -5.687 9.903 1.813
151 HD22 ASN 18 1HD2 ASN 18 -5.955 10.877 3.215
152 H ASP 19 H ASP 19 -10.521 9.498 1.049
153 HA ASP 19 HA ASP 19 -11.808 11.311 1.556
154 HB2 ASP 19 1HB ASP 19 -9.633 11.997 2.798
155 HB3 ASP 19 2HB ASP 19 -9.396 13.101 1.445
156 H ALA 20 H ALA 20 -9.229 12.752 -0.439
157 HA ALA 20 HA ALA 20 -10.678 12.765 -2.845
158 HB1 ALA 20 1HB ALA 20 -10.635 15.552 -1.839
159 HB2 ALA 20 2HB ALA 20 -11.756 14.763 -2.948
160 HB3 ALA 20 3HB ALA 20 -11.888 14.481 -1.213
161 H GLY 21 H GLY 21 -8.111 12.121 -2.334
162 HA2 GLY 21 1HA GLY 21 -6.209 12.518 -3.711
163 HA3 GLY 21 2HA GLY 21 -6.666 14.214 -3.800
164 H LYS 22 H LYS 22 -6.803 12.719 -0.708
165 HA LYS 22 HA LYS 22 -4.742 14.472 0.280
166 HB2 LYS 22 1HB LYS 22 -6.985 13.155 1.369
167 HB3 LYS 22 2HB LYS 22 -5.582 12.506 2.209
168 HG2 LYS 22 1HG LYS 22 -5.890 15.458 1.881
169 HG3 LYS 22 2HG LYS 22 -6.789 14.603 3.137
170 HD2 LYS 22 1HD LYS 22 -4.868 13.998 4.280
171 HD3 LYS 22 2HD LYS 22 -3.845 14.161 2.851
172 HE2 LYS 22 1HE LYS 22 -5.211 16.557 4.013
173 HE3 LYS 22 2HE LYS 22 -3.721 15.949 4.734
174 HZ1 LYS 22 3HZ LYS 22 -2.743 16.098 2.442
175 HZ2 LYS 22 1HZ LYS 22 -3.099 17.579 3.176
176 HZ3 LYS 22 2HZ LYS 22 -4.121 16.961 1.979
177 H ASP 23 H ASP 23 -2.677 13.992 0.700
178 HA ASP 23 HA ASP 23 -1.546 11.561 -0.222
179 HB2 ASP 23 1HB ASP 23 0.570 12.444 0.604
180 HB3 ASP 23 2HB ASP 23 -0.327 13.710 -0.229
181 H THR 24 H THR 24 -1.394 9.671 0.773
182 HA THR 24 HA THR 24 -1.056 9.551 3.663
183 HB THR 24 HB THR 24 -3.330 8.139 2.256
184 HG1 THR 24 1HG THR 24 -3.821 10.293 2.783
185 HG21 THR 24 3HG2 THR 24 -3.260 6.616 3.879
186 HG22 THR 24 1HG2 THR 24 -3.488 7.894 5.072
187 HG23 THR 24 2HG2 THR 24 -1.859 7.414 4.595
188 H PHE 25 H PHE 25 0.356 8.014 4.215
189 HA PHE 25 HA PHE 25 0.738 5.718 2.432
190 HB2 PHE 25 1HB PHE 25 2.988 7.416 3.532
191 HB3 PHE 25 2HB PHE 25 3.179 5.939 2.593
192 HD1 PHE 25 1HD PHE 25 1.807 9.382 2.429
193 HD2 PHE 25 2HD PHE 25 3.263 6.016 0.268
194 HE1 PHE 25 1HE PHE 25 1.778 10.705 0.355
195 HE2 PHE 25 2HE PHE 25 3.236 7.334 -1.809
196 HZ PHE 25 HZ PHE 25 2.494 9.682 -1.768
197 H ILE 26 H ILE 26 0.784 3.856 3.506
198 HA ILE 26 HA ILE 26 1.657 3.841 6.309
199 HB ILE 26 HB ILE 26 -0.731 3.911 6.479
200 HG12 ILE 26 1HG1 ILE 26 -0.336 0.979 6.774
201 HG13 ILE 26 2HG1 ILE 26 0.772 2.026 7.654
202 HG21 ILE 26 1HG2 ILE 26 -1.551 3.348 4.378
203 HG22 ILE 26 2HG2 ILE 26 -0.648 1.834 4.324
204 HG23 ILE 26 3HG2 ILE 26 -2.051 1.988 5.384
205 HD11 ILE 26 3HD1 ILE 26 -1.700 3.117 8.184
206 HD12 ILE 26 1HD1 ILE 26 -1.998 1.379 8.190
207 HD13 ILE 26 2HD1 ILE 26 -0.767 2.067 9.250
208 H LYS 27 H LYS 27 2.833 2.095 6.898
209 HA LYS 27 HA LYS 27 3.878 0.400 4.874
210 HB2 LYS 27 1HB LYS 27 4.107 0.186 7.883
211 HB3 LYS 27 2HB LYS 27 5.086 -0.701 6.721
212 HG2 LYS 27 1HG LYS 27 6.502 0.989 6.517
213 HG3 LYS 27 2HG LYS 27 5.192 2.126 6.189
214 HD2 LYS 27 1HD LYS 27 6.149 2.971 8.134
215 HD3 LYS 27 2HD LYS 27 4.781 2.034 8.739
216 HE2 LYS 27 1HE LYS 27 6.110 0.450 9.681
217 HE3 LYS 27 2HE LYS 27 7.357 0.606 8.446
218 HZ1 LYS 27 3HZ LYS 27 7.378 3.003 9.770
219 HZ2 LYS 27 1HZ LYS 27 8.501 1.750 9.946
220 HZ3 LYS 27 2HZ LYS 27 7.182 1.858 11.000
221 H CYS 28 H CYS 28 3.340 -1.620 4.272
222 HA CYS 28 HA CYS 28 0.862 -2.720 5.281
223 HB2 CYS 28 1HB CYS 28 2.671 -3.933 3.192
224 HB3 CYS 28 2HB CYS 28 0.953 -4.226 3.432
225 HG CYS 28 HG CYS 28 1.298 -1.035 2.910
226 HA PRO 29 HA PRO 29 2.522 -5.718 8.022
227 HB2 PRO 29 1HB PRO 29 0.744 -7.745 7.718
228 HB3 PRO 29 2HB PRO 29 0.354 -6.244 8.566
229 HG2 PRO 29 1HG PRO 29 -0.292 -7.057 5.758
230 HG3 PRO 29 2HG PRO 29 -1.321 -6.246 6.952
231 HD2 PRO 29 1HD PRO 29 -0.075 -4.908 4.956
232 HD3 PRO 29 2HD PRO 29 -0.382 -4.181 6.546
233 H LYS 30 H LYS 30 4.294 -5.803 6.185
234 HA LYS 30 HA LYS 30 4.592 -8.637 5.507
235 HB2 LYS 30 1HB LYS 30 4.989 -6.344 3.580
236 HB3 LYS 30 2HB LYS 30 5.540 -7.987 3.282
237 HG2 LYS 30 1HG LYS 30 3.562 -8.071 2.183
238 HG3 LYS 30 2HG LYS 30 2.997 -8.533 3.790
239 HD2 LYS 30 1HD LYS 30 2.470 -6.126 4.209
240 HD3 LYS 30 2HD LYS 30 2.866 -5.800 2.520
241 HE2 LYS 30 1HE LYS 30 0.438 -6.081 2.927
242 HE3 LYS 30 2HE LYS 30 1.093 -7.243 1.774
243 HZ1 LYS 30 3HZ LYS 30 -0.409 -7.851 3.950
244 HZ2 LYS 30 1HZ LYS 30 1.162 -8.188 4.481
245 HZ3 LYS 30 2HZ LYS 30 0.559 -8.940 3.090
246 H PHE 31 H PHE 31 5.766 -7.435 7.662
247 HA PHE 31 HA PHE 31 8.390 -6.461 7.020
248 HB2 PHE 31 1HB PHE 31 7.439 -7.464 9.705
249 HB3 PHE 31 2HB PHE 31 8.746 -6.329 9.380
250 HD1 PHE 31 2HD PHE 31 8.208 -4.044 8.556
251 HD2 PHE 31 1HD PHE 31 5.205 -6.740 9.908
252 HE1 PHE 31 2HE PHE 31 6.640 -2.165 8.812
253 HE2 PHE 31 1HE PHE 31 3.632 -4.865 10.164
254 HZ PHE 31 HZ PHE 31 4.349 -2.574 9.618
255 H ASP 32 H ASP 32 9.565 -7.955 5.909
256 HA ASP 32 HA ASP 32 10.934 -9.744 5.585
257 HB2 ASP 32 1HB ASP 32 11.236 -9.141 8.222
258 HB3 ASP 32 2HB ASP 32 10.697 -10.816 8.323
259 H ASN 33 H ASN 33 8.235 -10.052 4.975
260 HA ASN 33 HA ASN 33 7.923 -12.940 5.398
261 HB2 ASN 33 1HB ASN 33 6.373 -11.848 6.939
262 HB3 ASN 33 2HB ASN 33 5.707 -10.890 5.619
263 HD21 ASN 33 2HD2 ASN 33 4.111 -11.714 4.417
264 HD22 ASN 33 1HD2 ASN 33 3.482 -13.314 4.577
265 H LYS 34 H LYS 34 6.737 -10.126 3.570
266 HA LYS 34 HA LYS 34 7.347 -11.205 1.055
267 HB2 LYS 34 1HB LYS 34 5.269 -12.585 1.983
268 HB3 LYS 34 2HB LYS 34 4.382 -11.198 1.362
269 HG2 LYS 34 1HG LYS 34 4.571 -11.916 -0.727
270 HG3 LYS 34 2HG LYS 34 6.314 -12.139 -0.562
271 HD2 LYS 34 1HD LYS 34 5.806 -14.297 0.640
272 HD3 LYS 34 2HD LYS 34 4.124 -14.084 0.147
273 HE2 LYS 34 1HE LYS 34 4.631 -14.338 -2.115
274 HE3 LYS 34 2HE LYS 34 6.344 -14.003 -1.865
275 HZ1 LYS 34 3HZ LYS 34 5.511 -16.427 -2.238
276 HZ2 LYS 34 1HZ LYS 34 5.160 -16.363 -0.585
277 HZ3 LYS 34 2HZ LYS 34 6.744 -16.114 -1.123
278 H LYS 35 H LYS 35 7.922 -8.807 1.923
279 HA LYS 35 HA LYS 35 5.895 -6.854 1.313
280 HB2 LYS 35 1HB LYS 35 7.844 -5.242 1.589
281 HB3 LYS 35 2HB LYS 35 7.419 -6.205 2.997
282 HG2 LYS 35 1HG LYS 35 9.316 -7.509 2.847
283 HG3 LYS 35 2HG LYS 35 9.545 -7.160 1.132
284 HD2 LYS 35 1HD LYS 35 11.233 -5.995 2.385
285 HD3 LYS 35 2HD LYS 35 10.092 -4.811 1.745
286 HE2 LYS 35 1HE LYS 35 8.971 -4.709 3.908
287 HE3 LYS 35 2HE LYS 35 10.074 -5.926 4.549
288 HZ1 LYS 35 3HZ LYS 35 10.440 -3.250 4.694
289 HZ2 LYS 35 1HZ LYS 35 11.417 -3.672 3.379
290 HZ3 LYS 35 2HZ LYS 35 11.655 -4.411 4.882
291 H CYS 36 H CYS 36 6.602 -4.985 -0.204
292 HA CYS 36 HA CYS 36 6.549 -5.871 -2.819
293 HB2 CYS 36 1HB CYS 36 6.003 -3.556 -2.004
294 HB3 CYS 36 2HB CYS 36 7.732 -3.240 -1.918
295 HG CYS 36 HG CYS 36 7.325 -2.039 -4.221
296 H THR 37 H THR 37 8.100 -5.891 -4.505
297 HA THR 37 HA THR 37 10.915 -5.909 -3.687
298 HB THR 37 HB THR 37 10.138 -8.250 -3.586
299 HG1 THR 37 1HG THR 37 11.803 -7.923 -5.863
300 HG21 THR 37 3HG2 THR 37 8.710 -9.048 -5.095
301 HG22 THR 37 1HG2 THR 37 9.927 -8.842 -6.353
302 HG23 THR 37 2HG2 THR 37 8.800 -7.533 -5.995
303 H LYS 38 H LYS 38 9.544 -3.926 -5.132
304 HA LYS 38 HA LYS 38 11.247 -3.541 -7.312
305 HB2 LYS 38 1HB LYS 38 9.098 -5.277 -7.920
306 HB3 LYS 38 2HB LYS 38 8.734 -3.738 -8.691
307 HG2 LYS 38 1HG LYS 38 11.269 -3.954 -9.446
308 HG3 LYS 38 2HG LYS 38 10.912 -5.669 -9.234
309 HD2 LYS 38 1HD LYS 38 8.858 -5.270 -10.671
310 HD3 LYS 38 2HD LYS 38 9.557 -3.695 -11.058
311 HE2 LYS 38 1HE LYS 38 10.503 -4.822 -12.762
312 HE3 LYS 38 2HE LYS 38 11.675 -5.300 -11.533
313 HZ1 LYS 38 3HZ LYS 38 10.751 -7.155 -12.900
314 HZ2 LYS 38 1HZ LYS 38 9.250 -6.884 -12.168
315 HZ3 LYS 38 2HZ LYS 38 10.575 -7.358 -11.230
316 H ASP 39 H ASP 39 10.355 -1.720 -8.796
317 HA ASP 39 HA ASP 39 9.384 0.356 -7.036
318 HB2 ASP 39 1HB ASP 39 9.784 0.861 -9.943
319 HB3 ASP 39 2HB ASP 39 10.218 1.859 -8.558
320 H ASN 40 H ASN 40 7.250 0.264 -6.636
321 HA ASN 40 HA ASN 40 5.006 0.422 -6.972
322 HB2 ASN 40 1HB ASN 40 5.458 1.038 -9.875
323 HB3 ASN 40 2HB ASN 40 4.227 1.671 -8.785
324 HD21 ASN 40 2HD2 ASN 40 5.762 2.458 -6.650
325 HD22 ASN 40 1HD2 ASN 40 6.791 3.760 -7.130
326 H ASN 41 H ASN 41 5.033 -1.922 -6.667
327 HA ASN 41 HA ASN 41 4.812 -3.567 -9.046
328 HB2 ASN 41 1HB ASN 41 5.152 -4.030 -6.153
329 HB3 ASN 41 2HB ASN 41 4.165 -5.228 -6.985
330 HD21 ASN 41 2HD2 ASN 41 6.231 -6.343 -6.042
331 HD22 ASN 41 1HD2 ASN 41 7.502 -6.569 -7.190
332 H LYS 42 H LYS 42 2.780 -3.705 -6.150
333 HA LYS 42 HA LYS 42 0.407 -2.752 -7.279
334 HB2 LYS 42 1HB LYS 42 0.425 -4.578 -8.809
335 HB3 LYS 42 2HB LYS 42 0.842 -5.725 -7.542
336 HG2 LYS 42 1HG LYS 42 -1.302 -5.769 -6.689
337 HG3 LYS 42 2HG LYS 42 -1.724 -4.205 -7.390
338 HD2 LYS 42 1HD LYS 42 -2.406 -5.132 -9.311
339 HD3 LYS 42 2HD LYS 42 -1.004 -6.202 -9.390
340 HE2 LYS 42 1HE LYS 42 -2.055 -7.886 -8.241
341 HE3 LYS 42 2HE LYS 42 -3.126 -6.779 -7.384
342 HZ1 LYS 42 3HZ LYS 42 -4.261 -6.403 -9.556
343 HZ2 LYS 42 1HZ LYS 42 -4.427 -7.971 -8.943
344 HZ3 LYS 42 2HZ LYS 42 -3.342 -7.667 -10.205
345 H CYS 43 H CYS 43 -1.237 -2.678 -5.784
346 HA CYS 43 HA CYS 43 -1.380 -4.368 -3.507
347 HB2 CYS 43 1HB CYS 43 -0.709 -2.875 -1.769
348 HB3 CYS 43 2HB CYS 43 0.605 -2.918 -2.938
349 HG CYS 43 HG CYS 43 0.380 -0.308 -2.002
350 H THR 44 H THR 44 -3.005 -3.478 -1.880
351 HA THR 44 HA THR 44 -4.891 -1.583 -3.057
352 HB THR 44 HB THR 44 -6.398 -3.764 -1.949
353 HG1 THR 44 1HG THR 44 -5.007 -4.550 -4.276
354 HG21 THR 44 3HG2 THR 44 -7.451 -2.233 -3.405
355 HG22 THR 44 1HG2 THR 44 -7.339 -3.738 -4.316
356 HG23 THR 44 2HG2 THR 44 -6.205 -2.426 -4.638
357 H VAL 45 H VAL 45 -6.655 -1.018 -1.508
358 HA VAL 45 HA VAL 45 -6.097 -1.552 1.294
359 HB VAL 45 HB VAL 45 -6.041 1.261 0.192
360 HG11 VAL 45 1HG1 VAL 45 -7.128 1.446 2.248
361 HG12 VAL 45 2HG1 VAL 45 -6.145 0.181 2.989
362 HG13 VAL 45 3HG1 VAL 45 -5.437 1.759 2.638
363 HG21 VAL 45 3HG2 VAL 45 -3.896 -0.410 1.499
364 HG22 VAL 45 1HG2 VAL 45 -3.948 0.104 -0.187
365 HG23 VAL 45 2HG2 VAL 45 -3.744 1.300 1.093
366 H ASP 46 H ASP 46 -7.860 -1.270 2.624
367 HA ASP 46 HA ASP 46 -10.346 -0.380 1.315
368 HB2 ASP 46 1HB ASP 46 -9.741 -2.847 2.848
369 HB3 ASP 46 2HB ASP 46 -11.299 -2.087 3.164
370 H THR 47 H THR 47 -12.037 0.339 2.845
371 HA THR 47 HA THR 47 -10.813 1.784 5.098
372 HB THR 47 HB THR 47 -13.208 3.007 4.809
373 HG1 THR 47 1HG THR 47 -13.995 2.726 2.867
374 HG21 THR 47 3HG2 THR 47 -11.119 4.189 4.912
375 HG22 THR 47 1HG2 THR 47 -11.985 4.724 3.473
376 HG23 THR 47 2HG2 THR 47 -10.645 3.586 3.324
377 H TYR 48 H TYR 48 -13.043 -0.663 4.280
378 HA TYR 48 HA TYR 48 -14.967 -0.539 6.249
379 HB2 TYR 48 1HB TYR 48 -15.202 -2.218 4.602
380 HB3 TYR 48 2HB TYR 48 -13.612 -2.891 4.942
381 HD1 TYR 48 2HD TYR 48 -16.285 -1.995 7.365
382 HD2 TYR 48 1HD TYR 48 -14.089 -5.117 5.488
383 HE1 TYR 48 2HE TYR 48 -17.307 -3.626 8.897
384 HE2 TYR 48 1HE TYR 48 -15.106 -6.757 7.013
385 HH TYR 48 HH TYR 48 -17.772 -6.299 8.693
386 H ASN 49 H ASN 49 -11.809 -2.177 6.449
387 HA ASN 49 HA ASN 49 -11.685 -1.597 9.289
388 HB2 ASN 49 1HB ASN 49 -12.910 -3.814 8.997
389 HB3 ASN 49 2HB ASN 49 -11.390 -4.462 8.389
390 HD21 ASN 49 2HD2 ASN 49 -10.463 -5.643 9.886
391 HD22 ASN 49 1HD2 ASN 49 -10.347 -5.255 11.566
392 H ASN 50 H ASN 50 -10.171 -0.650 7.115
393 HA ASN 50 HA ASN 50 -8.036 -0.381 6.363
394 HB2 ASN 50 1HB ASN 50 -7.956 -0.006 8.961
395 HB3 ASN 50 2HB ASN 50 -7.027 -1.502 8.952
396 HD21 ASN 50 2HD2 ASN 50 -7.184 1.476 7.022
397 HD22 ASN 50 1HD2 ASN 50 -5.478 1.753 7.003
398 H ALA 51 H ALA 51 -8.523 -2.245 4.906
399 HA ALA 51 HA ALA 51 -6.876 -4.598 5.557
400 HB1 ALA 51 1HB ALA 51 -8.399 -5.922 4.586
401 HB2 ALA 51 2HB ALA 51 -9.485 -4.543 4.770
402 HB3 ALA 51 3HB ALA 51 -8.651 -4.810 3.240
403 H VAL 52 H VAL 52 -4.882 -4.244 4.778
404 HA VAL 52 HA VAL 52 -4.607 -3.123 2.072
405 HB VAL 52 HB VAL 52 -2.430 -3.439 4.137
406 HG11 VAL 52 1HG1 VAL 52 -2.616 -2.018 1.494
407 HG12 VAL 52 2HG1 VAL 52 -1.369 -1.648 2.687
408 HG13 VAL 52 3HG1 VAL 52 -1.472 -3.264 1.990
409 HG21 VAL 52 3HG2 VAL 52 -4.303 -1.154 3.598
410 HG22 VAL 52 1HG2 VAL 52 -3.919 -1.927 5.135
411 HG23 VAL 52 2HG2 VAL 52 -2.722 -0.908 4.338
412 H ASP 53 H ASP 53 -3.225 -4.114 0.559
413 HA ASP 53 HA ASP 53 -2.368 -6.852 1.185
414 HB2 ASP 53 1HB ASP 53 -4.107 -5.957 -1.099
415 HB3 ASP 53 2HB ASP 53 -3.119 -7.408 -1.226
416 H CYS 54 H CYS 54 -1.177 -7.662 -1.011
417 HA CYS 54 HA CYS 54 0.482 -5.548 -2.122
418 HB2 CYS 54 1HB CYS 54 2.569 -6.453 -1.405
419 HB3 CYS 54 2HB CYS 54 1.563 -6.304 0.031
420 HG CYS 54 HG CYS 54 0.867 -9.062 0.013
421 H ASP 55 H ASP 55 1.995 -6.423 -3.799
422 HA ASP 55 HA ASP 55 0.561 -8.120 -5.572
423 HB2 ASP 55 1HB ASP 55 2.193 -6.214 -6.151
424 HB3 ASP 55 2HB ASP 55 3.468 -7.400 -5.879
Start of MODEL 10
1 H1 ALA 1 H ALA 1 -15.375 1.363 2.249
2 HA ALA 1 HA ALA 1 -15.580 2.295 -0.474
3 HB1 ALA 1 1HB ALA 1 -15.390 4.450 0.344
4 HB2 ALA 1 2HB ALA 1 -14.322 3.966 1.662
5 HB3 ALA 1 3HB ALA 1 -13.711 4.025 0.009
6 H LYS 2 H LYS 2 -13.165 2.554 -1.335
7 HA LYS 2 HA LYS 2 -11.295 0.734 -0.095
8 HB2 LYS 2 1HB LYS 2 -12.863 0.006 -2.533
9 HB3 LYS 2 2HB LYS 2 -11.186 -0.512 -2.421
10 HG2 LYS 2 1HG LYS 2 -11.939 -2.284 -1.319
11 HG3 LYS 2 2HG LYS 2 -12.242 -1.195 0.037
12 HD2 LYS 2 1HD LYS 2 -14.503 -1.003 -0.461
13 HD3 LYS 2 2HD LYS 2 -14.278 -1.507 -2.137
14 HE2 LYS 2 1HE LYS 2 -13.495 -3.750 -1.022
15 HE3 LYS 2 2HE LYS 2 -14.437 -3.155 0.344
16 HZ1 LYS 2 3HZ LYS 2 -16.059 -4.249 -0.765
17 HZ2 LYS 2 1HZ LYS 2 -15.335 -4.054 -2.282
18 HZ3 LYS 2 2HZ LYS 2 -16.187 -2.772 -1.580
19 H TYR 3 H TYR 3 -9.305 0.481 -1.551
20 HA TYR 3 HA TYR 3 -8.896 2.736 -3.353
21 HB2 TYR 3 1HB TYR 3 -6.971 2.267 -1.079
22 HB3 TYR 3 2HB TYR 3 -7.016 3.625 -2.199
23 HD1 TYR 3 1HD TYR 3 -9.051 5.182 -2.084
24 HD2 TYR 3 2HD TYR 3 -8.078 2.390 0.976
25 HE1 TYR 3 1HE TYR 3 -10.433 6.451 -0.496
26 HE2 TYR 3 2HE TYR 3 -9.459 3.652 2.572
27 HH TYR 3 HH TYR 3 -11.160 6.614 1.592
28 H THR 4 H THR 4 -6.770 2.601 -4.468
29 HA THR 4 HA THR 4 -5.510 -0.022 -4.465
30 HB THR 4 HB THR 4 -6.260 0.948 -7.169
31 HG1 THR 4 1HG THR 4 -8.289 1.052 -6.381
32 HG21 THR 4 3HG2 THR 4 -4.931 -1.204 -6.318
33 HG22 THR 4 1HG2 THR 4 -5.922 -1.222 -7.777
34 HG23 THR 4 2HG2 THR 4 -6.567 -1.861 -6.264
35 H GLY 5 H GLY 5 -3.403 0.009 -5.149
36 HA2 GLY 5 1HA GLY 5 -2.266 2.043 -6.758
37 HA3 GLY 5 2HA GLY 5 -1.975 2.399 -5.062
38 H LYS 6 H LYS 6 0.287 2.179 -5.534
39 HA LYS 6 HA LYS 6 1.158 -0.603 -5.321
40 HB2 LYS 6 1HB LYS 6 2.551 1.295 -7.202
41 HB3 LYS 6 2HB LYS 6 2.785 -0.441 -7.042
42 HG2 LYS 6 1HG LYS 6 1.530 -0.415 -8.930
43 HG3 LYS 6 2HG LYS 6 0.231 -0.478 -7.736
44 HD2 LYS 6 1HD LYS 6 -0.580 1.440 -8.513
45 HD3 LYS 6 2HD LYS 6 0.942 2.246 -8.124
46 HE2 LYS 6 1HE LYS 6 0.963 2.628 -10.353
47 HE3 LYS 6 2HE LYS 6 1.661 1.010 -10.392
48 HZ1 LYS 6 3HZ LYS 6 -1.043 1.884 -11.121
49 HZ2 LYS 6 1HZ LYS 6 -0.832 0.313 -10.528
50 HZ3 LYS 6 2HZ LYS 6 -0.008 0.810 -11.919
51 H CYS 7 H CYS 7 3.495 -0.744 -4.697
52 HA CYS 7 HA CYS 7 4.205 1.527 -2.958
53 HB2 CYS 7 1HB CYS 7 5.407 -0.193 -1.568
54 HB3 CYS 7 2HB CYS 7 3.656 -0.355 -1.588
55 HG CYS 7 HG CYS 7 4.257 -2.926 -1.721
56 H THR 8 H THR 8 6.523 1.817 -2.552
57 HA THR 8 HA THR 8 8.072 1.247 -4.987
58 HB THR 8 HB THR 8 9.326 3.195 -4.622
59 HG1 THR 8 1HG THR 8 9.824 3.807 -2.664
60 HG21 THR 8 3HG2 THR 8 6.888 3.552 -5.229
61 HG22 THR 8 1HG2 THR 8 7.732 4.946 -4.554
62 HG23 THR 8 2HG2 THR 8 6.634 4.006 -3.543
63 H LYS 9 H LYS 9 10.398 0.872 -4.723
64 HA LYS 9 HA LYS 9 10.912 -1.200 -2.869
65 HB2 LYS 9 1HB LYS 9 13.033 0.358 -4.337
66 HB3 LYS 9 2HB LYS 9 13.079 -1.324 -3.824
67 HG2 LYS 9 1HG LYS 9 11.177 -1.728 -5.442
68 HG3 LYS 9 2HG LYS 9 11.501 -0.112 -6.073
69 HD2 LYS 9 1HD LYS 9 12.716 -1.567 -7.465
70 HD3 LYS 9 2HD LYS 9 13.913 -0.885 -6.361
71 HE2 LYS 9 1HE LYS 9 12.864 -3.197 -5.125
72 HE3 LYS 9 2HE LYS 9 13.214 -3.623 -6.800
73 HZ1 LYS 9 3HZ LYS 9 15.275 -2.083 -5.477
74 HZ2 LYS 9 1HZ LYS 9 15.409 -3.446 -6.470
75 HZ3 LYS 9 2HZ LYS 9 15.028 -3.628 -4.833
76 H SER 10 H SER 10 11.497 2.240 -2.829
77 HA SER 10 HA SER 10 13.401 2.297 -0.742
78 HB2 SER 10 1HB SER 10 13.112 4.626 -0.730
79 HB3 SER 10 2HB SER 10 12.713 4.175 -2.388
80 HG SER 10 HG SER 10 11.185 5.621 -1.390
81 H LYS 11 H LYS 11 10.012 1.766 -0.777
82 HA LYS 11 HA LYS 11 9.909 1.101 1.960
83 HB2 LYS 11 1HB LYS 11 9.734 3.844 1.544
84 HB3 LYS 11 2HB LYS 11 8.059 3.338 1.723
85 HG2 LYS 11 1HG LYS 11 10.225 2.623 3.682
86 HG3 LYS 11 2HG LYS 11 9.196 4.049 3.833
87 HD2 LYS 11 1HD LYS 11 7.291 2.787 4.232
88 HD3 LYS 11 2HD LYS 11 7.971 1.341 3.483
89 HE2 LYS 11 1HE LYS 11 9.177 0.776 5.352
90 HE3 LYS 11 2HE LYS 11 9.278 2.441 5.923
91 HZ1 LYS 11 3HZ LYS 11 7.009 0.561 6.140
92 HZ2 LYS 11 1HZ LYS 11 6.787 2.231 6.301
93 HZ3 LYS 11 2HZ LYS 11 7.802 1.406 7.373
94 H ASN 12 H ASN 12 8.329 -0.345 2.182
95 HA ASN 12 HA ASN 12 6.469 -0.767 0.024
96 HB2 ASN 12 1HB ASN 12 7.496 -2.686 1.124
97 HB3 ASN 12 2HB ASN 12 6.803 -2.200 2.667
98 HD21 ASN 12 2HD2 ASN 12 6.127 -4.562 2.299
99 HD22 ASN 12 1HD2 ASN 12 4.567 -4.784 1.590
100 H GLU 13 H GLU 13 5.565 1.487 0.484
101 HA GLU 13 HA GLU 13 3.369 1.261 2.436
102 HB2 GLU 13 1HB GLU 13 3.473 3.593 2.851
103 HB3 GLU 13 2HB GLU 13 5.130 3.009 2.931
104 HG2 GLU 13 1HG GLU 13 5.073 3.698 0.362
105 HG3 GLU 13 2HG GLU 13 3.841 4.804 0.968
106 H CYS 14 H CYS 14 1.320 1.816 1.793
107 HA CYS 14 HA CYS 14 0.818 1.746 -1.037
108 HB2 CYS 14 1HB CYS 14 -0.681 0.538 0.415
109 HB3 CYS 14 2HB CYS 14 -1.025 1.990 1.346
110 HG CYS 14 HG CYS 14 -1.769 2.591 -1.782
111 H LYS 15 H LYS 15 1.239 3.545 -2.161
112 HA LYS 15 HA LYS 15 0.624 6.160 -1.030
113 HB2 LYS 15 1HB LYS 15 1.721 7.005 -3.123
114 HB3 LYS 15 2HB LYS 15 2.756 6.020 -2.099
115 HG2 LYS 15 1HG LYS 15 2.948 4.384 -3.634
116 HG3 LYS 15 2HG LYS 15 1.289 4.577 -4.207
117 HD2 LYS 15 1HD LYS 15 1.862 6.356 -5.616
118 HD3 LYS 15 2HD LYS 15 3.388 6.645 -4.777
119 HE2 LYS 15 1HE LYS 15 3.750 4.099 -5.607
120 HE3 LYS 15 2HE LYS 15 2.721 4.713 -6.899
121 HZ1 LYS 15 3HZ LYS 15 4.357 5.986 -7.694
122 HZ2 LYS 15 1HZ LYS 15 5.395 5.008 -6.784
123 HZ3 LYS 15 2HZ LYS 15 4.867 6.489 -6.162
124 H TYR 16 H TYR 16 -1.721 5.573 -1.101
125 HA TYR 16 HA TYR 16 -2.877 5.869 -3.785
126 HB2 TYR 16 1HB TYR 16 -4.855 4.868 -2.964
127 HB3 TYR 16 2HB TYR 16 -3.542 3.933 -2.259
128 HD1 TYR 16 1HD TYR 16 -2.820 4.551 0.137
129 HD2 TYR 16 2HD TYR 16 -6.504 5.789 -1.595
130 HE1 TYR 16 1HE TYR 16 -3.735 4.951 2.384
131 HE2 TYR 16 2HE TYR 16 -7.429 6.194 0.647
132 HH TYR 16 HH TYR 16 -7.028 6.207 2.830
133 H LYS 17 H LYS 17 -5.337 6.863 -3.233
134 HA LYS 17 HA LYS 17 -4.893 9.405 -1.833
135 HB2 LYS 17 1HB LYS 17 -6.075 10.589 -3.678
136 HB3 LYS 17 2HB LYS 17 -4.519 9.919 -4.155
137 HG2 LYS 17 1HG LYS 17 -5.815 7.930 -5.050
138 HG3 LYS 17 2HG LYS 17 -7.265 8.913 -4.834
139 HD2 LYS 17 1HD LYS 17 -5.568 10.622 -6.153
140 HD3 LYS 17 2HD LYS 17 -5.182 9.060 -6.877
141 HE2 LYS 17 1HE LYS 17 -7.194 8.887 -7.887
142 HE3 LYS 17 2HE LYS 17 -8.051 9.627 -6.536
143 HZ1 LYS 17 3HZ LYS 17 -6.455 11.592 -7.703
144 HZ2 LYS 17 1HZ LYS 17 -8.144 11.495 -7.690
145 HZ3 LYS 17 2HZ LYS 17 -7.267 10.804 -8.961
146 H ASN 18 H ASN 18 -6.496 9.904 -0.486
147 HA ASN 18 HA ASN 18 -9.075 8.520 -0.829
148 HB2 ASN 18 1HB ASN 18 -9.260 8.236 1.457
149 HB3 ASN 18 2HB ASN 18 -7.517 8.097 1.250
150 HD21 ASN 18 2HD2 ASN 18 -6.362 10.277 1.370
151 HD22 ASN 18 1HD2 ASN 18 -6.846 11.312 2.666
152 H ASP 19 H ASP 19 -10.943 9.707 0.181
153 HA ASP 19 HA ASP 19 -12.275 11.546 0.408
154 HB2 ASP 19 1HB ASP 19 -10.172 12.412 1.661
155 HB3 ASP 19 2HB ASP 19 -9.882 13.351 0.199
156 H ALA 20 H ALA 20 -9.617 12.781 -1.621
157 HA ALA 20 HA ALA 20 -10.917 12.474 -4.083
158 HB1 ALA 20 1HB ALA 20 -11.481 14.901 -4.489
159 HB2 ALA 20 2HB ALA 20 -12.562 14.032 -3.399
160 HB3 ALA 20 3HB ALA 20 -11.349 15.134 -2.745
161 H GLY 21 H GLY 21 -8.462 11.879 -3.731
162 HA2 GLY 21 1HA GLY 21 -6.490 12.255 -4.953
163 HA3 GLY 21 2HA GLY 21 -6.976 13.928 -5.179
164 H LYS 22 H LYS 22 -7.195 12.670 -1.991
165 HA LYS 22 HA LYS 22 -5.193 14.527 -1.074
166 HB2 LYS 22 1HB LYS 22 -7.478 13.524 0.030
167 HB3 LYS 22 2HB LYS 22 -6.254 12.562 0.848
168 HG2 LYS 22 1HG LYS 22 -6.185 15.566 0.724
169 HG3 LYS 22 2HG LYS 22 -6.951 14.657 2.031
170 HD2 LYS 22 1HD LYS 22 -4.828 13.589 2.555
171 HD3 LYS 22 2HD LYS 22 -4.053 14.433 1.213
172 HE2 LYS 22 1HE LYS 22 -5.293 16.427 2.724
173 HE3 LYS 22 2HE LYS 22 -4.570 15.336 3.905
174 HZ1 LYS 22 3HZ LYS 22 -3.277 17.301 2.517
175 HZ2 LYS 22 1HZ LYS 22 -2.806 15.881 1.727
176 HZ3 LYS 22 2HZ LYS 22 -2.546 16.050 3.390
177 H ASP 23 H ASP 23 -3.105 14.099 -0.869
178 HA ASP 23 HA ASP 23 -1.934 11.634 -1.458
179 HB2 ASP 23 1HB ASP 23 -1.014 14.223 -0.375
180 HB3 ASP 23 2HB ASP 23 -0.000 12.839 0.023
181 H THR 24 H THR 24 -1.990 9.810 -0.342
182 HA THR 24 HA THR 24 -1.739 9.918 2.580
183 HB THR 24 HB THR 24 -3.765 8.237 1.091
184 HG1 THR 24 1HG THR 24 -4.362 10.063 3.154
185 HG21 THR 24 3HG2 THR 24 -2.806 6.981 2.941
186 HG22 THR 24 1HG2 THR 24 -4.454 7.471 3.333
187 HG23 THR 24 2HG2 THR 24 -3.086 8.337 4.034
188 H PHE 25 H PHE 25 -0.307 8.508 3.379
189 HA PHE 25 HA PHE 25 0.494 6.221 1.712
190 HB2 PHE 25 1HB PHE 25 2.384 8.028 3.235
191 HB3 PHE 25 2HB PHE 25 2.840 6.596 2.320
192 HD1 PHE 25 1HD PHE 25 1.392 9.986 2.008
193 HD2 PHE 25 2HD PHE 25 3.247 6.715 0.016
194 HE1 PHE 25 1HE PHE 25 1.656 11.370 -0.010
195 HE2 PHE 25 2HE PHE 25 3.515 8.093 -2.005
196 HZ PHE 25 HZ PHE 25 2.719 10.423 -2.019
197 H ILE 26 H ILE 26 0.545 4.337 2.760
198 HA ILE 26 HA ILE 26 0.887 4.309 5.667
199 HB ILE 26 HB ILE 26 -1.515 4.301 5.386
200 HG12 ILE 26 1HG1 ILE 26 -0.796 1.429 5.919
201 HG13 ILE 26 2HG1 ILE 26 -0.285 2.707 7.018
202 HG21 ILE 26 1HG2 ILE 26 -1.441 3.441 3.027
203 HG22 ILE 26 2HG2 ILE 26 -1.232 1.824 3.698
204 HG23 ILE 26 3HG2 ILE 26 -2.700 2.738 4.042
205 HD11 ILE 26 3HD1 ILE 26 -2.608 3.337 7.375
206 HD12 ILE 26 1HD1 ILE 26 -3.128 2.076 6.257
207 HD13 ILE 26 2HD1 ILE 26 -2.335 1.640 7.772
208 H LYS 27 H LYS 27 2.382 2.872 6.199
209 HA LYS 27 HA LYS 27 3.658 1.170 4.408
210 HB2 LYS 27 1HB LYS 27 4.691 0.131 6.380
211 HB3 LYS 27 2HB LYS 27 4.685 1.886 6.502
212 HG2 LYS 27 1HG LYS 27 2.590 1.646 7.900
213 HG3 LYS 27 2HG LYS 27 2.947 -0.082 7.959
214 HD2 LYS 27 1HD LYS 27 5.027 1.938 8.716
215 HD3 LYS 27 2HD LYS 27 3.791 1.440 9.874
216 HE2 LYS 27 1HE LYS 27 4.773 -0.922 8.722
217 HE3 LYS 27 2HE LYS 27 6.188 0.076 9.058
218 HZ1 LYS 27 3HZ LYS 27 4.542 0.264 11.277
219 HZ2 LYS 27 1HZ LYS 27 6.022 -0.548 11.161
220 HZ3 LYS 27 2HZ LYS 27 4.577 -1.376 10.866
221 H CYS 28 H CYS 28 3.461 -0.960 3.869
222 HA CYS 28 HA CYS 28 0.972 -2.271 4.715
223 HB2 CYS 28 1HB CYS 28 2.695 -3.014 2.349
224 HB3 CYS 28 2HB CYS 28 1.038 -3.511 2.672
225 HG CYS 28 HG CYS 28 0.558 -0.455 2.606
226 HA PRO 29 HA PRO 29 3.099 -5.436 6.886
227 HB2 PRO 29 1HB PRO 29 1.464 -7.557 6.446
228 HB3 PRO 29 2HB PRO 29 1.033 -6.221 7.518
229 HG2 PRO 29 1HG PRO 29 0.210 -6.716 4.682
230 HG3 PRO 29 2HG PRO 29 -0.771 -6.163 6.052
231 HD2 PRO 29 1HD PRO 29 0.187 -4.469 4.168
232 HD3 PRO 29 2HD PRO 29 -0.035 -3.986 5.862
233 H LYS 30 H LYS 30 4.874 -6.545 6.386
234 HA LYS 30 HA LYS 30 4.881 -8.370 4.120
235 HB2 LYS 30 1HB LYS 30 6.912 -7.443 3.150
236 HB3 LYS 30 2HB LYS 30 5.639 -6.230 3.169
237 HG2 LYS 30 1HG LYS 30 7.646 -6.358 5.382
238 HG3 LYS 30 2HG LYS 30 8.032 -5.559 3.856
239 HD2 LYS 30 1HD LYS 30 5.845 -4.270 4.191
240 HD3 LYS 30 2HD LYS 30 5.897 -4.862 5.853
241 HE2 LYS 30 1HE LYS 30 8.443 -3.912 5.474
242 HE3 LYS 30 2HE LYS 30 7.468 -2.770 4.550
243 HZ1 LYS 30 3HZ LYS 30 6.422 -2.015 6.405
244 HZ2 LYS 30 1HZ LYS 30 7.900 -2.447 7.104
245 HZ3 LYS 30 2HZ LYS 30 6.567 -3.477 7.242
246 H PHE 31 H PHE 31 4.855 -9.066 6.756
247 HA PHE 31 HA PHE 31 7.525 -9.464 7.750
248 HB2 PHE 31 1HB PHE 31 4.978 -10.781 8.703
249 HB3 PHE 31 2HB PHE 31 6.485 -10.604 9.597
250 HD1 PHE 31 1HD PHE 31 7.280 -7.975 9.591
251 HD2 PHE 31 2HD PHE 31 3.284 -9.436 9.433
252 HE1 PHE 31 1HE PHE 31 6.469 -5.854 10.538
253 HE2 PHE 31 2HE PHE 31 2.469 -7.317 10.378
254 HZ PHE 31 HZ PHE 31 4.062 -5.521 10.931
255 H ASP 32 H ASP 32 8.493 -10.596 5.999
256 HA ASP 32 HA ASP 32 9.141 -12.424 4.802
257 HB2 ASP 32 1HB ASP 32 9.277 -13.076 7.405
258 HB3 ASP 32 2HB ASP 32 8.117 -14.291 6.873
259 H ASN 33 H ASN 33 6.571 -11.484 4.155
260 HA ASN 33 HA ASN 33 5.248 -14.001 3.385
261 HB2 ASN 33 1HB ASN 33 4.015 -12.599 5.124
262 HB3 ASN 33 2HB ASN 33 3.784 -11.404 3.851
263 HD21 ASN 33 2HD2 ASN 33 3.454 -14.913 4.289
264 HD22 ASN 33 1HD2 ASN 33 1.920 -15.036 3.503
265 H LYS 34 H LYS 34 6.069 -10.696 2.525
266 HA LYS 34 HA LYS 34 6.528 -11.236 -0.166
267 HB2 LYS 34 1HB LYS 34 3.730 -10.822 0.487
268 HB3 LYS 34 2HB LYS 34 4.308 -9.618 -0.657
269 HG2 LYS 34 1HG LYS 34 4.965 -12.471 -1.165
270 HG3 LYS 34 2HG LYS 34 3.313 -11.919 -1.455
271 HD2 LYS 34 1HD LYS 34 4.699 -9.945 -2.663
272 HD3 LYS 34 2HD LYS 34 5.808 -11.297 -2.903
273 HE2 LYS 34 1HE LYS 34 4.111 -12.577 -4.004
274 HE3 LYS 34 2HE LYS 34 2.876 -11.388 -3.593
275 HZ1 LYS 34 3HZ LYS 34 5.213 -10.644 -5.234
276 HZ2 LYS 34 1HZ LYS 34 3.710 -9.876 -5.122
277 HZ3 LYS 34 2HZ LYS 34 3.848 -11.352 -5.938
278 H LYS 35 H LYS 35 8.259 -9.922 0.814
279 HA LYS 35 HA LYS 35 7.754 -7.150 1.368
280 HB2 LYS 35 1HB LYS 35 9.906 -8.991 1.733
281 HB3 LYS 35 2HB LYS 35 10.518 -7.599 0.850
282 HG2 LYS 35 1HG LYS 35 9.752 -6.109 2.584
283 HG3 LYS 35 2HG LYS 35 8.998 -7.453 3.446
284 HD2 LYS 35 1HD LYS 35 11.318 -8.491 3.540
285 HD3 LYS 35 2HD LYS 35 11.927 -6.919 3.017
286 HE2 LYS 35 1HE LYS 35 10.056 -6.985 5.321
287 HE3 LYS 35 2HE LYS 35 11.698 -7.570 5.582
288 HZ1 LYS 35 3HZ LYS 35 10.763 -4.896 5.319
289 HZ2 LYS 35 1HZ LYS 35 11.985 -5.219 4.195
290 HZ3 LYS 35 2HZ LYS 35 12.270 -5.457 5.845
291 H CYS 36 H CYS 36 7.830 -5.466 0.012
292 HA CYS 36 HA CYS 36 7.684 -5.716 -2.728
293 HB2 CYS 36 1HB CYS 36 7.859 -3.351 -2.857
294 HB3 CYS 36 2HB CYS 36 7.087 -3.696 -1.313
295 HG CYS 36 HG CYS 36 10.452 -3.284 -1.356
296 H THR 37 H THR 37 9.109 -5.443 -4.439
297 HA THR 37 HA THR 37 11.932 -5.051 -3.937
298 HB THR 37 HB THR 37 12.469 -7.184 -5.273
299 HG1 THR 37 1HG THR 37 10.645 -8.120 -5.877
300 HG21 THR 37 3HG2 THR 37 11.364 -7.714 -2.528
301 HG22 THR 37 1HG2 THR 37 12.811 -6.736 -2.773
302 HG23 THR 37 2HG2 THR 37 12.785 -8.419 -3.300
303 H LYS 38 H LYS 38 10.027 -3.551 -5.372
304 HA LYS 38 HA LYS 38 11.379 -3.026 -7.743
305 HB2 LYS 38 1HB LYS 38 9.640 -5.270 -7.968
306 HB3 LYS 38 2HB LYS 38 8.935 -3.948 -8.890
307 HG2 LYS 38 1HG LYS 38 10.614 -3.930 -10.418
308 HG3 LYS 38 2HG LYS 38 11.827 -4.476 -9.257
309 HD2 LYS 38 1HD LYS 38 11.427 -6.659 -9.670
310 HD3 LYS 38 2HD LYS 38 9.691 -6.411 -9.861
311 HE2 LYS 38 1HE LYS 38 10.903 -5.097 -12.022
312 HE3 LYS 38 2HE LYS 38 11.737 -6.643 -11.869
313 HZ1 LYS 38 3HZ LYS 38 8.790 -6.304 -12.045
314 HZ2 LYS 38 1HZ LYS 38 9.624 -7.775 -11.972
315 HZ3 LYS 38 2HZ LYS 38 9.794 -6.773 -13.323
316 H ASP 39 H ASP 39 10.906 -0.988 -8.244
317 HA ASP 39 HA ASP 39 9.142 0.606 -6.880
318 HB2 ASP 39 1HB ASP 39 11.024 1.126 -8.690
319 HB3 ASP 39 2HB ASP 39 9.621 1.270 -9.746
320 H ASN 40 H ASN 40 7.010 0.860 -6.840
321 HA ASN 40 HA ASN 40 4.801 0.661 -7.343
322 HB2 ASN 40 1HB ASN 40 5.263 0.419 -10.261
323 HB3 ASN 40 2HB ASN 40 4.175 1.486 -9.376
324 HD21 ASN 40 2HD2 ASN 40 4.993 3.417 -8.500
325 HD22 ASN 40 1HD2 ASN 40 6.448 4.128 -9.103
326 H ASN 41 H ASN 41 5.133 -1.537 -6.389
327 HA ASN 41 HA ASN 41 5.071 -3.739 -8.289
328 HB2 ASN 41 1HB ASN 41 5.666 -3.419 -5.448
329 HB3 ASN 41 2HB ASN 41 4.642 -4.815 -5.771
330 HD21 ASN 41 2HD2 ASN 41 6.591 -5.916 -4.941
331 HD22 ASN 41 1HD2 ASN 41 7.831 -6.330 -6.072
332 H LYS 42 H LYS 42 3.160 -3.376 -5.330
333 HA LYS 42 HA LYS 42 0.659 -2.968 -6.490
334 HB2 LYS 42 1HB LYS 42 0.802 -5.063 -7.593
335 HB3 LYS 42 2HB LYS 42 1.440 -5.859 -6.161
336 HG2 LYS 42 1HG LYS 42 -0.604 -6.128 -5.227
337 HG3 LYS 42 2HG LYS 42 -1.242 -4.638 -5.924
338 HD2 LYS 42 1HD LYS 42 -0.567 -6.809 -7.819
339 HD3 LYS 42 2HD LYS 42 -1.961 -7.079 -6.769
340 HE2 LYS 42 1HE LYS 42 -3.207 -5.528 -7.820
341 HE3 LYS 42 2HE LYS 42 -1.849 -4.419 -8.005
342 HZ1 LYS 42 3HZ LYS 42 -2.944 -6.247 -9.887
343 HZ2 LYS 42 1HZ LYS 42 -1.289 -6.527 -9.671
344 HZ3 LYS 42 2HZ LYS 42 -1.835 -4.995 -10.132
345 H CYS 43 H CYS 43 -0.954 -2.790 -4.953
346 HA CYS 43 HA CYS 43 -0.799 -3.926 -2.359
347 HB2 CYS 43 1HB CYS 43 -0.348 -1.937 -1.047
348 HB3 CYS 43 2HB CYS 43 0.995 -2.224 -2.148
349 HG CYS 43 HG CYS 43 -1.472 -0.039 -3.005
350 H THR 44 H THR 44 -2.664 -3.567 -1.144
351 HA THR 44 HA THR 44 -4.723 -1.875 -2.389
352 HB THR 44 HB THR 44 -6.275 -3.850 -1.426
353 HG1 THR 44 1HG THR 44 -5.105 -5.820 -2.268
354 HG21 THR 44 3HG2 THR 44 -5.966 -4.836 -3.872
355 HG22 THR 44 1HG2 THR 44 -5.051 -3.345 -4.090
356 HG23 THR 44 2HG2 THR 44 -6.742 -3.278 -3.591
357 H VAL 45 H VAL 45 -6.486 -1.289 -0.942
358 HA VAL 45 HA VAL 45 -6.047 -1.678 1.905
359 HB VAL 45 HB VAL 45 -6.031 1.079 0.670
360 HG11 VAL 45 1HG1 VAL 45 -7.339 1.061 2.716
361 HG12 VAL 45 2HG1 VAL 45 -6.026 0.246 3.570
362 HG13 VAL 45 3HG1 VAL 45 -5.806 1.893 2.977
363 HG21 VAL 45 3HG2 VAL 45 -3.923 -0.423 2.220
364 HG22 VAL 45 1HG2 VAL 45 -3.880 -0.033 0.501
365 HG23 VAL 45 2HG2 VAL 45 -3.805 1.259 1.700
366 H ASP 46 H ASP 46 -7.903 -1.609 3.067
367 HA ASP 46 HA ASP 46 -10.348 -0.808 1.626
368 HB2 ASP 46 1HB ASP 46 -9.880 -3.319 2.275
369 HB3 ASP 46 2HB ASP 46 -10.425 -2.790 3.865
370 H THR 47 H THR 47 -12.100 0.011 2.943
371 HA THR 47 HA THR 47 -11.084 1.588 5.194
372 HB THR 47 HB THR 47 -12.946 3.056 4.891
373 HG1 THR 47 1HG THR 47 -14.761 2.340 4.085
374 HG21 THR 47 3HG2 THR 47 -11.960 4.025 3.144
375 HG22 THR 47 1HG2 THR 47 -12.631 2.818 2.049
376 HG23 THR 47 2HG2 THR 47 -11.085 2.523 2.846
377 H TYR 48 H TYR 48 -12.824 -1.213 4.614
378 HA TYR 48 HA TYR 48 -14.907 -1.209 6.422
379 HB2 TYR 48 1HB TYR 48 -14.601 -3.082 4.955
380 HB3 TYR 48 2HB TYR 48 -13.024 -3.441 5.647
381 HD1 TYR 48 2HD TYR 48 -16.627 -3.228 6.586
382 HD2 TYR 48 1HD TYR 48 -12.848 -5.041 7.322
383 HE1 TYR 48 2HE TYR 48 -17.684 -4.774 8.181
384 HE2 TYR 48 1HE TYR 48 -13.895 -6.591 8.917
385 HH TYR 48 HH TYR 48 -15.776 -7.231 9.899
386 H ASN 49 H ASN 49 -11.523 -2.129 7.043
387 HA ASN 49 HA ASN 49 -11.798 -1.234 9.794
388 HB2 ASN 49 1HB ASN 49 -10.824 -3.370 10.670
389 HB3 ASN 49 2HB ASN 49 -12.457 -3.536 10.034
390 HD21 ASN 49 2HD2 ASN 49 -11.758 -5.823 10.019
391 HD22 ASN 49 1HD2 ASN 49 -10.957 -6.412 8.605
392 H ASN 50 H ASN 50 -10.348 -0.170 7.629
393 HA ASN 50 HA ASN 50 -8.271 0.528 6.997
394 HB2 ASN 50 1HB ASN 50 -8.528 1.181 9.524
395 HB3 ASN 50 2HB ASN 50 -7.289 -0.045 9.769
396 HD21 ASN 50 2HD2 ASN 50 -7.828 2.409 7.266
397 HD22 ASN 50 1HD2 ASN 50 -6.274 3.148 7.416
398 H ALA 51 H ALA 51 -8.440 -1.808 5.967
399 HA ALA 51 HA ALA 51 -6.358 -3.586 6.964
400 HB1 ALA 51 1HB ALA 51 -8.572 -3.825 4.997
401 HB2 ALA 51 2HB ALA 51 -7.167 -4.875 4.806
402 HB3 ALA 51 3HB ALA 51 -8.096 -4.909 6.305
403 H VAL 52 H VAL 52 -4.448 -4.007 5.937
404 HA VAL 52 HA VAL 52 -3.881 -2.544 3.450
405 HB VAL 52 HB VAL 52 -1.908 -2.730 5.723
406 HG11 VAL 52 1HG1 VAL 52 -0.834 -0.860 4.401
407 HG12 VAL 52 2HG1 VAL 52 -0.788 -2.460 3.657
408 HG13 VAL 52 3HG1 VAL 52 -1.954 -1.259 3.099
409 HG21 VAL 52 3HG2 VAL 52 -4.008 -0.705 5.136
410 HG22 VAL 52 1HG2 VAL 52 -3.400 -1.287 6.685
411 HG23 VAL 52 2HG2 VAL 52 -2.447 -0.148 5.736
412 H ASP 53 H ASP 53 -2.959 -3.761 1.932
413 HA ASP 53 HA ASP 53 -1.681 -6.286 2.757
414 HB2 ASP 53 1HB ASP 53 -3.401 -5.723 0.336
415 HB3 ASP 53 2HB ASP 53 -2.448 -7.191 0.537
416 H CYS 54 H CYS 54 -0.218 -7.161 0.960
417 HA CYS 54 HA CYS 54 1.240 -4.946 -0.319
418 HB2 CYS 54 1HB CYS 54 3.348 -5.951 0.260
419 HB3 CYS 54 2HB CYS 54 2.399 -5.787 1.733
420 HG CYS 54 HG CYS 54 3.526 -8.167 2.169
421 H ASP 55 H ASP 55 2.730 -5.733 -2.071
422 HA ASP 55 HA ASP 55 1.266 -7.196 -3.981
423 HB2 ASP 55 1HB ASP 55 2.835 -5.577 -4.762
424 HB3 ASP 55 2HB ASP 55 4.158 -6.334 -3.877
Start of MODEL 11
1 H1 ALA 1 H ALA 1 -15.973 0.969 1.749
2 HA ALA 1 HA ALA 1 -15.775 2.023 -0.715
3 HB1 ALA 1 1HB ALA 1 -13.944 3.914 0.370
4 HB2 ALA 1 2HB ALA 1 -15.367 4.201 -0.633
5 HB3 ALA 1 3HB ALA 1 -15.520 4.157 1.124
6 H LYS 2 H LYS 2 -13.257 2.542 -1.303
7 HA LYS 2 HA LYS 2 -11.437 0.913 0.250
8 HB2 LYS 2 1HB LYS 2 -12.348 0.115 -2.513
9 HB3 LYS 2 2HB LYS 2 -10.848 -0.465 -1.802
10 HG2 LYS 2 1HG LYS 2 -12.334 -1.242 0.154
11 HG3 LYS 2 2HG LYS 2 -13.666 -1.044 -0.987
12 HD2 LYS 2 1HD LYS 2 -12.982 -3.314 -1.119
13 HD3 LYS 2 2HD LYS 2 -12.378 -2.517 -2.574
14 HE2 LYS 2 1HE LYS 2 -10.171 -2.342 -1.602
15 HE3 LYS 2 2HE LYS 2 -10.756 -3.012 -0.079
16 HZ1 LYS 2 3HZ LYS 2 -11.450 -4.982 -1.618
17 HZ2 LYS 2 1HZ LYS 2 -9.859 -4.854 -1.056
18 HZ3 LYS 2 2HZ LYS 2 -10.241 -4.366 -2.629
19 H TYR 3 H TYR 3 -9.253 0.775 -0.993
20 HA TYR 3 HA TYR 3 -8.784 3.147 -2.635
21 HB2 TYR 3 1HB TYR 3 -7.063 2.573 -0.223
22 HB3 TYR 3 2HB TYR 3 -7.027 3.994 -1.260
23 HD1 TYR 3 2HD TYR 3 -9.256 5.384 -1.327
24 HD2 TYR 3 1HD TYR 3 -8.214 2.674 1.784
25 HE1 TYR 3 2HE TYR 3 -10.817 6.533 0.188
26 HE2 TYR 3 1HE TYR 3 -9.773 3.815 3.307
27 HH TYR 3 HH TYR 3 -10.766 6.337 3.375
28 H THR 4 H THR 4 -7.781 2.441 -4.385
29 HA THR 4 HA THR 4 -5.993 0.119 -4.174
30 HB THR 4 HB THR 4 -7.879 -0.034 -5.794
31 HG1 THR 4 1HG THR 4 -6.421 -1.340 -6.609
32 HG21 THR 4 3HG2 THR 4 -7.844 2.384 -6.432
33 HG22 THR 4 1HG2 THR 4 -7.884 1.279 -7.805
34 HG23 THR 4 2HG2 THR 4 -6.373 2.068 -7.351
35 H GLY 5 H GLY 5 -3.876 0.221 -4.754
36 HA2 GLY 5 1HA GLY 5 -2.803 2.437 -6.244
37 HA3 GLY 5 2HA GLY 5 -2.398 2.501 -4.536
38 H LYS 6 H LYS 6 -0.178 2.300 -5.115
39 HA LYS 6 HA LYS 6 0.601 -0.491 -5.544
40 HB2 LYS 6 1HB LYS 6 2.074 1.752 -6.909
41 HB3 LYS 6 2HB LYS 6 2.211 0.023 -7.199
42 HG2 LYS 6 1HG LYS 6 -0.081 0.022 -8.106
43 HG3 LYS 6 2HG LYS 6 -0.141 1.773 -7.886
44 HD2 LYS 6 1HD LYS 6 0.470 1.561 -10.114
45 HD3 LYS 6 2HD LYS 6 2.025 1.780 -9.308
46 HE2 LYS 6 1HE LYS 6 2.330 -0.001 -10.823
47 HE3 LYS 6 2HE LYS 6 2.186 -0.745 -9.232
48 HZ1 LYS 6 3HZ LYS 6 0.594 -1.998 -10.103
49 HZ2 LYS 6 1HZ LYS 6 0.556 -1.097 -11.535
50 HZ3 LYS 6 2HZ LYS 6 -0.378 -0.618 -10.210
51 H CYS 7 H CYS 7 3.280 -0.323 -5.441
52 HA CYS 7 HA CYS 7 3.856 1.127 -2.943
53 HB2 CYS 7 1HB CYS 7 3.769 -1.669 -3.306
54 HB3 CYS 7 2HB CYS 7 5.473 -1.244 -3.196
55 HG CYS 7 HG CYS 7 3.387 -1.689 -0.780
56 H THR 8 H THR 8 6.450 0.791 -2.607
57 HA THR 8 HA THR 8 7.847 1.280 -5.120
58 HB THR 8 HB THR 8 7.245 3.520 -4.600
59 HG1 THR 8 1HG THR 8 9.299 3.797 -5.108
60 HG21 THR 8 3HG2 THR 8 6.550 3.171 -2.276
61 HG22 THR 8 1HG2 THR 8 7.645 4.547 -2.413
62 HG23 THR 8 2HG2 THR 8 8.238 3.006 -1.793
63 H LYS 9 H LYS 9 9.933 0.619 -5.094
64 HA LYS 9 HA LYS 9 10.852 -1.146 -3.167
65 HB2 LYS 9 1HB LYS 9 12.517 0.525 -5.060
66 HB3 LYS 9 2HB LYS 9 13.054 -0.933 -4.235
67 HG2 LYS 9 1HG LYS 9 11.791 -2.317 -5.568
68 HG3 LYS 9 2HG LYS 9 10.644 -1.043 -5.987
69 HD2 LYS 9 1HD LYS 9 12.071 -1.625 -7.889
70 HD3 LYS 9 2HD LYS 9 12.338 0.041 -7.370
71 HE2 LYS 9 1HE LYS 9 14.086 -1.827 -6.001
72 HE3 LYS 9 2HE LYS 9 14.273 -1.908 -7.752
73 HZ1 LYS 9 3HZ LYS 9 14.135 0.787 -6.934
74 HZ2 LYS 9 1HZ LYS 9 15.400 -0.020 -7.716
75 HZ3 LYS 9 2HZ LYS 9 15.322 -0.007 -6.027
76 H SER 10 H SER 10 11.130 2.327 -3.321
77 HA SER 10 HA SER 10 13.219 2.720 -1.499
78 HB2 SER 10 1HB SER 10 12.579 4.970 -1.449
79 HB3 SER 10 2HB SER 10 11.972 4.426 -3.013
80 HG SER 10 HG SER 10 10.581 5.108 -0.694
81 H LYS 11 H LYS 11 9.943 1.749 -1.023
82 HA LYS 11 HA LYS 11 10.349 1.027 1.663
83 HB2 LYS 11 1HB LYS 11 9.876 3.745 1.407
84 HB3 LYS 11 2HB LYS 11 8.290 3.092 1.801
85 HG2 LYS 11 1HG LYS 11 10.582 2.165 3.433
86 HG3 LYS 11 2HG LYS 11 10.039 3.829 3.657
87 HD2 LYS 11 1HD LYS 11 8.036 3.201 4.542
88 HD3 LYS 11 2HD LYS 11 7.957 1.717 3.590
89 HE2 LYS 11 1HE LYS 11 9.355 0.561 5.058
90 HE3 LYS 11 2HE LYS 11 9.980 2.044 5.777
91 HZ1 LYS 11 3HZ LYS 11 7.913 2.407 6.880
92 HZ2 LYS 11 1HZ LYS 11 8.393 0.818 7.206
93 HZ3 LYS 11 2HZ LYS 11 7.177 1.118 6.070
94 H ASN 12 H ASN 12 8.925 -0.525 2.149
95 HA ASN 12 HA ASN 12 6.830 -1.143 0.278
96 HB2 ASN 12 1HB ASN 12 8.248 -2.880 1.388
97 HB3 ASN 12 2HB ASN 12 7.457 -2.490 2.912
98 HD21 ASN 12 2HD2 ASN 12 5.462 -3.280 3.333
99 HD22 ASN 12 1HD2 ASN 12 4.606 -4.349 2.280
100 H GLU 13 H GLU 13 5.749 0.991 0.753
101 HA GLU 13 HA GLU 13 3.820 0.623 2.947
102 HB2 GLU 13 1HB GLU 13 3.864 2.919 3.488
103 HB3 GLU 13 2HB GLU 13 5.551 2.449 3.337
104 HG2 GLU 13 1HG GLU 13 5.625 3.402 1.094
105 HG3 GLU 13 2HG GLU 13 3.928 3.862 1.231
106 H CYS 14 H CYS 14 1.703 1.002 2.482
107 HA CYS 14 HA CYS 14 0.843 0.839 -0.179
108 HB2 CYS 14 1HB CYS 14 -0.575 0.040 1.596
109 HB3 CYS 14 2HB CYS 14 -0.639 1.638 2.329
110 HG CYS 14 HG CYS 14 -1.796 2.416 -0.424
111 H LYS 15 H LYS 15 0.259 2.315 -1.674
112 HA LYS 15 HA LYS 15 0.367 5.156 -0.894
113 HB2 LYS 15 1HB LYS 15 2.342 4.750 -2.155
114 HB3 LYS 15 2HB LYS 15 1.469 3.797 -3.350
115 HG2 LYS 15 1HG LYS 15 0.369 5.757 -4.191
116 HG3 LYS 15 2HG LYS 15 1.065 6.747 -2.907
117 HD2 LYS 15 1HD LYS 15 2.569 7.226 -4.540
118 HD3 LYS 15 2HD LYS 15 3.320 5.749 -3.931
119 HE2 LYS 15 1HE LYS 15 3.165 4.900 -5.979
120 HE3 LYS 15 2HE LYS 15 1.411 4.914 -5.801
121 HZ1 LYS 15 3HZ LYS 15 2.121 7.495 -6.455
122 HZ2 LYS 15 1HZ LYS 15 1.364 6.363 -7.459
123 HZ3 LYS 15 2HZ LYS 15 3.049 6.514 -7.473
124 H TYR 16 H TYR 16 -1.799 5.544 -0.762
125 HA TYR 16 HA TYR 16 -3.326 5.217 -3.258
126 HB2 TYR 16 1HB TYR 16 -5.293 4.622 -2.054
127 HB3 TYR 16 2HB TYR 16 -4.000 3.604 -1.430
128 HD1 TYR 16 2HD TYR 16 -2.911 4.258 0.768
129 HD2 TYR 16 1HD TYR 16 -6.526 6.020 -0.621
130 HE1 TYR 16 2HE TYR 16 -3.412 5.015 3.053
131 HE2 TYR 16 1HE TYR 16 -7.036 6.784 1.660
132 HH TYR 16 HH TYR 16 -6.308 5.905 4.102
133 H LYS 17 H LYS 17 -5.444 6.620 -3.039
134 HA LYS 17 HA LYS 17 -4.651 9.264 -2.006
135 HB2 LYS 17 1HB LYS 17 -5.745 8.444 -4.646
136 HB3 LYS 17 2HB LYS 17 -6.321 9.966 -3.976
137 HG2 LYS 17 1HG LYS 17 -4.537 10.860 -4.967
138 HG3 LYS 17 2HG LYS 17 -3.623 10.176 -3.621
139 HD2 LYS 17 1HD LYS 17 -3.758 8.039 -5.277
140 HD3 LYS 17 2HD LYS 17 -3.738 9.359 -6.449
141 HE2 LYS 17 1HE LYS 17 -1.798 9.682 -4.291
142 HE3 LYS 17 2HE LYS 17 -1.534 8.232 -5.260
143 HZ1 LYS 17 3HZ LYS 17 -1.147 9.456 -7.146
144 HZ2 LYS 17 1HZ LYS 17 -0.482 10.476 -5.970
145 HZ3 LYS 17 2HZ LYS 17 -2.015 10.802 -6.604
146 H ASN 18 H ASN 18 -6.026 10.206 -0.638
147 HA ASN 18 HA ASN 18 -8.765 9.130 -0.469
148 HB2 ASN 18 1HB ASN 18 -8.690 9.116 1.831
149 HB3 ASN 18 2HB ASN 18 -7.000 8.773 1.473
150 HD21 ASN 18 2HD2 ASN 18 -5.712 10.907 1.094
151 HD22 ASN 18 1HD2 ASN 18 -5.927 12.100 2.324
152 H ASP 19 H ASP 19 -10.307 10.700 0.600
153 HA ASP 19 HA ASP 19 -11.345 12.729 0.714
154 HB2 ASP 19 1HB ASP 19 -8.990 13.428 1.557
155 HB3 ASP 19 2HB ASP 19 -8.794 14.119 -0.051
156 H ALA 20 H ALA 20 -8.866 13.289 -1.785
157 HA ALA 20 HA ALA 20 -10.633 12.922 -3.967
158 HB1 ALA 20 1HB ALA 20 -10.968 15.190 -4.688
159 HB2 ALA 20 2HB ALA 20 -11.580 15.019 -3.043
160 HB3 ALA 20 3HB ALA 20 -10.028 15.804 -3.329
161 H GLY 21 H GLY 21 -8.056 12.046 -3.345
162 HA2 GLY 21 1HA GLY 21 -6.388 11.644 -5.061
163 HA3 GLY 21 2HA GLY 21 -6.524 13.337 -5.511
164 H LYS 22 H LYS 22 -6.532 12.709 -2.153
165 HA LYS 22 HA LYS 22 -3.981 14.038 -1.864
166 HB2 LYS 22 1HB LYS 22 -6.325 13.762 -0.297
167 HB3 LYS 22 2HB LYS 22 -5.005 13.057 0.628
168 HG2 LYS 22 1HG LYS 22 -4.864 15.794 -0.605
169 HG3 LYS 22 2HG LYS 22 -5.454 15.496 1.032
170 HD2 LYS 22 1HD LYS 22 -3.222 14.249 1.370
171 HD3 LYS 22 2HD LYS 22 -2.697 15.104 -0.082
172 HE2 LYS 22 1HE LYS 22 -3.367 17.239 1.042
173 HE3 LYS 22 2HE LYS 22 -3.646 16.308 2.512
174 HZ1 LYS 22 3HZ LYS 22 -1.435 15.974 2.834
175 HZ2 LYS 22 1HZ LYS 22 -1.355 17.464 2.037
176 HZ3 LYS 22 2HZ LYS 22 -1.052 16.033 1.187
177 H ASP 23 H ASP 23 -2.158 12.920 -2.018
178 HA ASP 23 HA ASP 23 -1.885 10.160 -1.939
179 HB2 ASP 23 1HB ASP 23 0.301 12.071 -1.118
180 HB3 ASP 23 2HB ASP 23 0.469 10.505 -1.907
181 H THR 24 H THR 24 -1.981 8.723 -0.354
182 HA THR 24 HA THR 24 -1.303 9.569 2.380
183 HB THR 24 HB THR 24 -3.670 7.838 1.636
184 HG1 THR 24 1HG THR 24 -4.808 9.667 2.620
185 HG21 THR 24 3HG2 THR 24 -2.902 7.029 3.701
186 HG22 THR 24 1HG2 THR 24 -4.165 8.182 4.129
187 HG23 THR 24 2HG2 THR 24 -2.468 8.639 4.271
188 H PHE 25 H PHE 25 -0.348 8.016 3.684
189 HA PHE 25 HA PHE 25 0.121 5.364 2.539
190 HB2 PHE 25 1HB PHE 25 2.390 6.990 3.682
191 HB3 PHE 25 2HB PHE 25 2.485 5.461 2.815
192 HD1 PHE 25 2HD PHE 25 1.858 9.072 2.469
193 HD2 PHE 25 1HD PHE 25 2.525 5.388 0.444
194 HE1 PHE 25 2HE PHE 25 2.198 10.296 0.362
195 HE2 PHE 25 1HE PHE 25 2.867 6.606 -1.666
196 HZ PHE 25 HZ PHE 25 2.702 9.063 -1.709
197 H ILE 26 H ILE 26 1.007 3.829 4.125
198 HA ILE 26 HA ILE 26 1.107 4.454 6.890
199 HB ILE 26 HB ILE 26 -1.363 4.588 6.497
200 HG12 ILE 26 1HG1 ILE 26 -1.105 2.234 8.249
201 HG13 ILE 26 2HG1 ILE 26 0.023 3.538 8.604
202 HG21 ILE 26 1HG2 ILE 26 -1.434 1.617 6.284
203 HG22 ILE 26 2HG2 ILE 26 -2.626 2.813 5.776
204 HG23 ILE 26 3HG2 ILE 26 -1.158 2.574 4.828
205 HD11 ILE 26 3HD1 ILE 26 -1.577 4.844 9.452
206 HD12 ILE 26 1HD1 ILE 26 -2.734 4.415 8.193
207 HD13 ILE 26 2HD1 ILE 26 -2.500 3.347 9.577
208 H LYS 27 H LYS 27 2.754 3.087 5.071
209 HA LYS 27 HA LYS 27 3.990 1.190 4.849
210 HB2 LYS 27 1HB LYS 27 4.694 0.328 6.818
211 HB3 LYS 27 2HB LYS 27 3.718 1.618 7.509
212 HG2 LYS 27 1HG LYS 27 1.836 -0.268 7.285
213 HG3 LYS 27 2HG LYS 27 3.259 -1.296 7.466
214 HD2 LYS 27 1HD LYS 27 3.799 -0.345 9.561
215 HD3 LYS 27 2HD LYS 27 2.674 0.995 9.326
216 HE2 LYS 27 1HE LYS 27 1.553 -1.748 9.270
217 HE3 LYS 27 2HE LYS 27 2.097 -1.132 10.830
218 HZ1 LYS 27 3HZ LYS 27 0.288 0.431 9.090
219 HZ2 LYS 27 1HZ LYS 27 0.579 0.621 10.746
220 HZ3 LYS 27 2HZ LYS 27 -0.305 -0.710 10.189
221 H CYS 28 H CYS 28 3.860 -1.307 4.949
222 HA CYS 28 HA CYS 28 1.118 -2.200 4.378
223 HB2 CYS 28 1HB CYS 28 3.425 -2.136 2.571
224 HB3 CYS 28 2HB CYS 28 2.647 -3.711 2.660
225 HG CYS 28 HG CYS 28 1.728 -1.064 0.981
226 HA PRO 29 HA PRO 29 2.033 -5.611 6.990
227 HB2 PRO 29 1HB PRO 29 0.371 -7.486 5.945
228 HB3 PRO 29 2HB PRO 29 -0.207 -6.111 6.894
229 HG2 PRO 29 1HG PRO 29 -0.137 -6.463 3.922
230 HG3 PRO 29 2HG PRO 29 -1.426 -5.793 4.940
231 HD2 PRO 29 1HD PRO 29 0.290 -4.230 3.546
232 HD3 PRO 29 2HD PRO 29 -0.399 -3.737 5.107
233 H LYS 30 H LYS 30 4.237 -5.834 6.176
234 HA LYS 30 HA LYS 30 4.624 -8.415 4.924
235 HB2 LYS 30 1HB LYS 30 5.565 -5.847 3.659
236 HB3 LYS 30 2HB LYS 30 6.327 -7.394 3.314
237 HG2 LYS 30 1HG LYS 30 3.434 -6.707 2.835
238 HG3 LYS 30 2HG LYS 30 4.698 -6.802 1.606
239 HD2 LYS 30 1HD LYS 30 5.043 -9.197 2.308
240 HD3 LYS 30 2HD LYS 30 3.581 -9.041 3.284
241 HE2 LYS 30 1HE LYS 30 3.571 -8.343 0.370
242 HE3 LYS 30 2HE LYS 30 3.398 -10.017 0.897
243 HZ1 LYS 30 3HZ LYS 30 1.398 -9.559 1.952
244 HZ2 LYS 30 1HZ LYS 30 1.293 -8.643 0.534
245 HZ3 LYS 30 2HZ LYS 30 1.672 -7.891 1.999
246 H PHE 31 H PHE 31 5.178 -8.232 7.399
247 HA PHE 31 HA PHE 31 7.773 -7.125 7.978
248 HB2 PHE 31 1HB PHE 31 6.155 -9.028 9.680
249 HB3 PHE 31 2HB PHE 31 7.441 -7.949 10.213
250 HD1 PHE 31 2HD PHE 31 7.055 -5.527 10.335
251 HD2 PHE 31 1HD PHE 31 3.930 -8.247 9.356
252 HE1 PHE 31 2HE PHE 31 5.389 -3.782 10.819
253 HE2 PHE 31 1HE PHE 31 2.259 -6.505 9.838
254 HZ PHE 31 HZ PHE 31 2.988 -4.270 10.572
255 H ASP 32 H ASP 32 9.262 -8.148 6.673
256 HA ASP 32 HA ASP 32 10.665 -9.780 5.920
257 HB2 ASP 32 1HB ASP 32 10.330 -10.185 8.808
258 HB3 ASP 32 2HB ASP 32 10.905 -11.612 7.950
259 H ASN 33 H ASN 33 9.136 -10.520 4.343
260 HA ASN 33 HA ASN 33 8.750 -13.283 4.323
261 HB2 ASN 33 1HB ASN 33 7.019 -13.159 5.905
262 HB3 ASN 33 2HB ASN 33 6.374 -11.672 5.217
263 HD21 ASN 33 2HD2 ASN 33 4.483 -11.990 4.320
264 HD22 ASN 33 1HD2 ASN 33 4.002 -13.380 3.413
265 H LYS 34 H LYS 34 7.678 -10.143 3.187
266 HA LYS 34 HA LYS 34 8.164 -10.812 0.472
267 HB2 LYS 34 1HB LYS 34 5.422 -11.114 1.511
268 HB3 LYS 34 2HB LYS 34 5.554 -10.162 0.038
269 HG2 LYS 34 1HG LYS 34 5.764 -11.998 -1.176
270 HG3 LYS 34 2HG LYS 34 7.150 -12.519 -0.216
271 HD2 LYS 34 1HD LYS 34 5.539 -13.413 1.476
272 HD3 LYS 34 2HD LYS 34 4.234 -13.046 0.346
273 HE2 LYS 34 1HE LYS 34 5.933 -14.442 -1.245
274 HE3 LYS 34 2HE LYS 34 6.220 -15.214 0.314
275 HZ1 LYS 34 3HZ LYS 34 4.210 -16.165 0.295
276 HZ2 LYS 34 1HZ LYS 34 4.220 -15.850 -1.367
277 HZ3 LYS 34 2HZ LYS 34 3.435 -14.789 -0.311
278 H LYS 35 H LYS 35 9.394 -8.862 1.366
279 HA LYS 35 HA LYS 35 7.945 -6.390 1.568
280 HB2 LYS 35 1HB LYS 35 10.624 -7.314 2.073
281 HB3 LYS 35 2HB LYS 35 10.673 -5.848 1.103
282 HG2 LYS 35 1HG LYS 35 9.146 -4.796 2.797
283 HG3 LYS 35 2HG LYS 35 9.402 -6.226 3.801
284 HD2 LYS 35 1HD LYS 35 11.939 -5.290 2.919
285 HD3 LYS 35 2HD LYS 35 11.036 -3.916 3.561
286 HE2 LYS 35 1HE LYS 35 11.939 -4.674 5.503
287 HE3 LYS 35 2HE LYS 35 10.487 -5.674 5.476
288 HZ1 LYS 35 3HZ LYS 35 12.583 -6.895 5.958
289 HZ2 LYS 35 1HZ LYS 35 13.101 -6.553 4.385
290 HZ3 LYS 35 2HZ LYS 35 11.723 -7.500 4.634
291 H CYS 36 H CYS 36 8.173 -4.581 0.142
292 HA CYS 36 HA CYS 36 7.661 -5.087 -2.516
293 HB2 CYS 36 1HB CYS 36 7.192 -2.938 -1.411
294 HB3 CYS 36 2HB CYS 36 8.916 -2.591 -1.352
295 HG CYS 36 HG CYS 36 6.900 -2.692 -4.103
296 H THR 37 H THR 37 8.851 -5.037 -4.415
297 HA THR 37 HA THR 37 11.724 -4.695 -4.329
298 HB THR 37 HB THR 37 12.033 -6.967 -5.498
299 HG1 THR 37 1HG THR 37 10.450 -8.528 -4.733
300 HG21 THR 37 3HG2 THR 37 12.722 -7.907 -3.515
301 HG22 THR 37 1HG2 THR 37 11.296 -7.358 -2.633
302 HG23 THR 37 2HG2 THR 37 12.580 -6.215 -3.035
303 H LYS 38 H LYS 38 9.712 -3.256 -5.648
304 HA LYS 38 HA LYS 38 10.739 -3.063 -8.230
305 HB2 LYS 38 1HB LYS 38 8.755 -5.133 -7.930
306 HB3 LYS 38 2HB LYS 38 8.160 -3.878 -9.009
307 HG2 LYS 38 1HG LYS 38 10.923 -4.794 -9.479
308 HG3 LYS 38 2HG LYS 38 9.638 -5.955 -9.824
309 HD2 LYS 38 1HD LYS 38 9.608 -3.133 -10.870
310 HD3 LYS 38 2HD LYS 38 10.360 -4.467 -11.747
311 HE2 LYS 38 1HE LYS 38 8.387 -5.163 -12.500
312 HE3 LYS 38 2HE LYS 38 7.721 -5.200 -10.868
313 HZ1 LYS 38 3HZ LYS 38 7.906 -2.773 -12.568
314 HZ2 LYS 38 1HZ LYS 38 7.189 -2.873 -11.039
315 HZ3 LYS 38 2HZ LYS 38 6.505 -3.697 -12.349
316 H ASP 39 H ASP 39 10.420 -0.996 -8.688
317 HA ASP 39 HA ASP 39 8.823 0.759 -7.300
318 HB2 ASP 39 1HB ASP 39 10.385 1.852 -8.589
319 HB3 ASP 39 2HB ASP 39 10.105 0.824 -9.991
320 H ASN 40 H ASN 40 6.711 1.130 -7.188
321 HA ASN 40 HA ASN 40 4.477 1.028 -7.599
322 HB2 ASN 40 1HB ASN 40 5.582 1.295 -10.388
323 HB3 ASN 40 2HB ASN 40 3.849 1.192 -10.094
324 HD21 ASN 40 2HD2 ASN 40 6.507 2.838 -8.418
325 HD22 ASN 40 1HD2 ASN 40 5.794 4.411 -8.475
326 H ASN 41 H ASN 41 4.824 -1.232 -6.722
327 HA ASN 41 HA ASN 41 4.593 -3.383 -8.642
328 HB2 ASN 41 1HB ASN 41 5.100 -3.134 -5.759
329 HB3 ASN 41 2HB ASN 41 4.098 -4.517 -6.191
330 HD21 ASN 41 2HD2 ASN 41 6.733 -4.584 -5.111
331 HD22 ASN 41 1HD2 ASN 41 7.746 -5.363 -6.274
332 H LYS 42 H LYS 42 2.666 -2.995 -5.700
333 HA LYS 42 HA LYS 42 0.202 -2.435 -6.887
334 HB2 LYS 42 1HB LYS 42 0.277 -4.527 -8.018
335 HB3 LYS 42 2HB LYS 42 0.824 -5.368 -6.575
336 HG2 LYS 42 1HG LYS 42 -1.276 -5.360 -5.611
337 HG3 LYS 42 2HG LYS 42 -1.834 -4.006 -6.597
338 HD2 LYS 42 1HD LYS 42 -1.076 -6.561 -7.938
339 HD3 LYS 42 2HD LYS 42 -2.629 -6.457 -7.105
340 HE2 LYS 42 1HE LYS 42 -2.352 -4.102 -8.635
341 HE3 LYS 42 2HE LYS 42 -1.884 -5.446 -9.676
342 HZ1 LYS 42 3HZ LYS 42 -3.961 -6.457 -9.412
343 HZ2 LYS 42 1HZ LYS 42 -4.320 -4.819 -9.636
344 HZ3 LYS 42 2HZ LYS 42 -4.378 -5.494 -8.087
345 H CYS 43 H CYS 43 -1.407 -2.175 -5.367
346 HA CYS 43 HA CYS 43 -1.063 -3.253 -2.696
347 HB2 CYS 43 1HB CYS 43 -0.738 -0.353 -3.364
348 HB3 CYS 43 2HB CYS 43 -1.456 -0.807 -1.824
349 HG CYS 43 HG CYS 43 0.983 -2.630 -1.583
350 H THR 44 H THR 44 -2.910 -2.247 -1.248
351 HA THR 44 HA THR 44 -5.280 -1.322 -2.420
352 HB THR 44 HB THR 44 -6.345 -3.800 -1.793
353 HG1 THR 44 1HG THR 44 -5.045 -5.324 -2.596
354 HG21 THR 44 3HG2 THR 44 -5.939 -2.143 -4.165
355 HG22 THR 44 1HG2 THR 44 -7.374 -3.014 -3.627
356 HG23 THR 44 2HG2 THR 44 -6.116 -3.859 -4.530
357 H VAL 45 H VAL 45 -6.884 -0.930 -0.901
358 HA VAL 45 HA VAL 45 -6.581 -2.019 1.785
359 HB VAL 45 HB VAL 45 -6.497 0.949 1.223
360 HG11 VAL 45 1HG1 VAL 45 -6.212 0.999 3.784
361 HG12 VAL 45 2HG1 VAL 45 -7.834 0.788 3.122
362 HG13 VAL 45 3HG1 VAL 45 -6.947 -0.603 3.747
363 HG21 VAL 45 3HG2 VAL 45 -4.492 -0.903 2.510
364 HG22 VAL 45 1HG2 VAL 45 -4.345 -0.137 0.929
365 HG23 VAL 45 2HG2 VAL 45 -4.334 0.849 2.390
366 H ASP 46 H ASP 46 -8.469 -2.077 2.945
367 HA ASP 46 HA ASP 46 -10.871 -1.119 1.533
368 HB2 ASP 46 1HB ASP 46 -10.538 -3.633 1.844
369 HB3 ASP 46 2HB ASP 46 -10.811 -3.351 3.561
370 H THR 47 H THR 47 -12.190 0.271 2.533
371 HA THR 47 HA THR 47 -11.403 1.552 4.921
372 HB THR 47 HB THR 47 -13.517 2.770 4.789
373 HG1 THR 47 1HG THR 47 -15.178 1.794 3.936
374 HG21 THR 47 3HG2 THR 47 -11.643 2.508 2.592
375 HG22 THR 47 1HG2 THR 47 -12.369 3.958 3.283
376 HG23 THR 47 2HG2 THR 47 -13.227 3.049 2.040
377 H TYR 48 H TYR 48 -13.120 -1.327 4.381
378 HA TYR 48 HA TYR 48 -14.970 -1.449 6.421
379 HB2 TYR 48 1HB TYR 48 -14.798 -3.235 4.813
380 HB3 TYR 48 2HB TYR 48 -13.165 -3.621 5.342
381 HD1 TYR 48 2HD TYR 48 -16.688 -3.517 6.547
382 HD2 TYR 48 1HD TYR 48 -12.825 -5.249 6.977
383 HE1 TYR 48 2HE TYR 48 -17.601 -5.142 8.152
384 HE2 TYR 48 1HE TYR 48 -13.727 -6.880 8.582
385 HH TYR 48 HH TYR 48 -16.619 -6.553 10.104
386 H ASN 49 H ASN 49 -11.579 -2.549 6.608
387 HA ASN 49 HA ASN 49 -11.424 -1.636 9.358
388 HB2 ASN 49 1HB ASN 49 -10.762 -3.776 10.279
389 HB3 ASN 49 2HB ASN 49 -12.339 -3.947 9.515
390 HD21 ASN 49 2HD2 ASN 49 -10.983 -6.181 9.991
391 HD22 ASN 49 1HD2 ASN 49 -10.342 -6.850 8.533
392 H ASN 50 H ASN 50 -10.145 -0.749 7.016
393 HA ASN 50 HA ASN 50 -8.098 -0.284 6.125
394 HB2 ASN 50 1HB ASN 50 -7.974 0.360 8.683
395 HB3 ASN 50 2HB ASN 50 -6.810 -0.960 8.737
396 HD21 ASN 50 2HD2 ASN 50 -7.588 1.982 6.932
397 HD22 ASN 50 1HD2 ASN 50 -5.949 2.440 6.634
398 H ALA 51 H ALA 51 -8.859 -2.818 5.493
399 HA ALA 51 HA ALA 51 -6.791 -4.716 6.141
400 HB1 ALA 51 1HB ALA 51 -8.218 -5.676 3.939
401 HB2 ALA 51 2HB ALA 51 -8.461 -6.091 5.636
402 HB3 ALA 51 3HB ALA 51 -9.391 -4.782 4.907
403 H VAL 52 H VAL 52 -4.833 -4.017 5.390
404 HA VAL 52 HA VAL 52 -4.509 -2.999 2.715
405 HB VAL 52 HB VAL 52 -2.335 -3.846 4.631
406 HG11 VAL 52 1HG1 VAL 52 -1.066 -2.074 3.356
407 HG12 VAL 52 2HG1 VAL 52 -1.449 -3.542 2.456
408 HG13 VAL 52 3HG1 VAL 52 -2.396 -2.077 2.197
409 HG21 VAL 52 3HG2 VAL 52 -2.565 -1.061 4.659
410 HG22 VAL 52 1HG2 VAL 52 -4.212 -1.669 4.820
411 HG23 VAL 52 2HG2 VAL 52 -2.969 -2.179 5.962
412 H ASP 53 H ASP 53 -3.318 -3.973 1.038
413 HA ASP 53 HA ASP 53 -2.613 -6.787 1.304
414 HB2 ASP 53 1HB ASP 53 -4.857 -5.746 -0.364
415 HB3 ASP 53 2HB ASP 53 -3.876 -7.055 -1.017
416 H CYS 54 H CYS 54 -0.477 -6.182 0.966
417 HA CYS 54 HA CYS 54 0.419 -4.502 -1.104
418 HB2 CYS 54 1HB CYS 54 1.599 -5.671 1.046
419 HB3 CYS 54 2HB CYS 54 2.244 -6.664 -0.256
420 HG CYS 54 HG CYS 54 4.133 -5.041 -0.833
421 H ASP 55 H ASP 55 2.136 -5.479 -2.729
422 HA ASP 55 HA ASP 55 0.654 -6.947 -4.640
423 HB2 ASP 55 1HB ASP 55 2.377 -5.358 -5.315
424 HB3 ASP 55 2HB ASP 55 3.614 -6.330 -4.523
Start of MODEL 12
1 H1 ALA 1 H ALA 1 -16.089 2.470 1.213
2 HA ALA 1 HA ALA 1 -15.838 3.083 -1.659
3 HB1 ALA 1 1HB ALA 1 -13.910 4.615 -0.353
4 HB2 ALA 1 2HB ALA 1 -15.394 5.191 -1.113
5 HB3 ALA 1 3HB ALA 1 -15.378 4.804 0.607
6 H LYS 2 H LYS 2 -13.450 3.144 -2.318
7 HA LYS 2 HA LYS 2 -11.734 1.351 -0.812
8 HB2 LYS 2 1HB LYS 2 -12.819 0.666 -3.543
9 HB3 LYS 2 2HB LYS 2 -11.368 -0.075 -2.882
10 HG2 LYS 2 1HG LYS 2 -12.842 -1.637 -2.203
11 HG3 LYS 2 2HG LYS 2 -13.041 -0.526 -0.846
12 HD2 LYS 2 1HD LYS 2 -15.174 -0.176 -1.377
13 HD3 LYS 2 2HD LYS 2 -14.740 0.252 -3.034
14 HE2 LYS 2 1HE LYS 2 -14.437 -2.439 -3.104
15 HE3 LYS 2 2HE LYS 2 -15.739 -2.287 -1.926
16 HZ1 LYS 2 3HZ LYS 2 -16.936 -2.334 -3.842
17 HZ2 LYS 2 1HZ LYS 2 -15.720 -1.613 -4.773
18 HZ3 LYS 2 2HZ LYS 2 -16.675 -0.665 -3.747
19 H TYR 3 H TYR 3 -9.590 1.065 -1.989
20 HA TYR 3 HA TYR 3 -8.938 3.268 -3.787
21 HB2 TYR 3 1HB TYR 3 -7.288 2.835 -1.302
22 HB3 TYR 3 2HB TYR 3 -7.218 4.180 -2.436
23 HD1 TYR 3 1HD TYR 3 -8.945 5.928 -2.398
24 HD2 TYR 3 2HD TYR 3 -8.924 2.775 0.460
25 HE1 TYR 3 1HE TYR 3 -10.494 7.210 -0.980
26 HE2 TYR 3 2HE TYR 3 -10.474 4.047 1.884
27 HH TYR 3 HH TYR 3 -12.299 6.480 0.901
28 H THR 4 H THR 4 -6.540 3.112 -4.423
29 HA THR 4 HA THR 4 -5.451 0.420 -4.322
30 HB THR 4 HB THR 4 -5.227 1.026 -7.039
31 HG1 THR 4 1HG THR 4 -7.519 1.203 -7.580
32 HG21 THR 4 3HG2 THR 4 -7.274 -0.836 -5.854
33 HG22 THR 4 1HG2 THR 4 -5.547 -1.186 -5.828
34 HG23 THR 4 2HG2 THR 4 -6.388 -1.008 -7.368
35 H GLY 5 H GLY 5 -3.310 0.311 -5.481
36 HA2 GLY 5 1HA GLY 5 -1.855 2.463 -6.394
37 HA3 GLY 5 2HA GLY 5 -1.698 2.517 -4.645
38 H LYS 6 H LYS 6 0.598 2.256 -5.836
39 HA LYS 6 HA LYS 6 1.234 -0.621 -5.777
40 HB2 LYS 6 1HB LYS 6 2.912 1.500 -7.108
41 HB3 LYS 6 2HB LYS 6 3.006 -0.244 -7.312
42 HG2 LYS 6 1HG LYS 6 0.440 0.283 -8.085
43 HG3 LYS 6 2HG LYS 6 1.305 1.716 -8.646
44 HD2 LYS 6 1HD LYS 6 2.915 -0.507 -9.285
45 HD3 LYS 6 2HD LYS 6 1.266 -0.924 -9.757
46 HE2 LYS 6 1HE LYS 6 2.527 1.703 -10.492
47 HE3 LYS 6 2HE LYS 6 2.721 0.261 -11.488
48 HZ1 LYS 6 3HZ LYS 6 0.071 1.330 -10.702
49 HZ2 LYS 6 1HZ LYS 6 0.410 0.165 -11.882
50 HZ3 LYS 6 2HZ LYS 6 0.856 1.777 -12.133
51 H CYS 7 H CYS 7 3.584 -1.024 -5.137
52 HA CYS 7 HA CYS 7 4.118 0.522 -2.703
53 HB2 CYS 7 1HB CYS 7 4.259 -2.282 -3.386
54 HB3 CYS 7 2HB CYS 7 5.807 -1.721 -2.765
55 HG CYS 7 HG CYS 7 4.967 -2.386 -0.406
56 H THR 8 H THR 8 6.650 0.263 -2.153
57 HA THR 8 HA THR 8 8.197 1.017 -4.534
58 HB THR 8 HB THR 8 9.241 2.615 -2.508
59 HG1 THR 8 1HG THR 8 6.395 2.817 -2.541
60 HG21 THR 8 3HG2 THR 8 8.527 2.908 -5.095
61 HG22 THR 8 1HG2 THR 8 8.975 4.254 -4.048
62 HG23 THR 8 2HG2 THR 8 7.273 3.871 -4.315
63 H LYS 9 H LYS 9 10.171 0.133 -4.619
64 HA LYS 9 HA LYS 9 10.972 -1.918 -2.940
65 HB2 LYS 9 1HB LYS 9 12.745 -0.148 -4.635
66 HB3 LYS 9 2HB LYS 9 13.176 -1.733 -4.008
67 HG2 LYS 9 1HG LYS 9 10.981 -2.437 -5.311
68 HG3 LYS 9 2HG LYS 9 11.388 -1.001 -6.253
69 HD2 LYS 9 1HD LYS 9 13.222 -3.336 -5.711
70 HD3 LYS 9 2HD LYS 9 12.370 -3.023 -7.226
71 HE2 LYS 9 1HE LYS 9 13.596 -0.687 -7.003
72 HE3 LYS 9 2HE LYS 9 14.721 -1.641 -6.037
73 HZ1 LYS 9 3HZ LYS 9 14.834 -3.204 -7.962
74 HZ2 LYS 9 1HZ LYS 9 15.491 -1.673 -8.258
75 HZ3 LYS 9 2HZ LYS 9 13.966 -2.071 -8.871
76 H SER 10 H SER 10 11.553 1.521 -2.695
77 HA SER 10 HA SER 10 13.511 1.250 -0.594
78 HB2 SER 10 1HB SER 10 13.306 3.748 -0.467
79 HB3 SER 10 2HB SER 10 13.726 3.145 -2.070
80 HG SER 10 HG SER 10 12.094 4.661 -2.278
81 H LYS 11 H LYS 11 10.080 1.566 -0.851
82 HA LYS 11 HA LYS 11 9.838 1.313 2.036
83 HB2 LYS 11 1HB LYS 11 9.526 3.814 0.820
84 HB3 LYS 11 2HB LYS 11 7.888 3.239 1.096
85 HG2 LYS 11 1HG LYS 11 8.217 4.239 3.091
86 HG3 LYS 11 2HG LYS 11 8.931 2.673 3.484
87 HD2 LYS 11 1HD LYS 11 11.014 4.083 2.324
88 HD3 LYS 11 2HD LYS 11 10.174 5.293 3.299
89 HE2 LYS 11 1HE LYS 11 10.942 2.593 4.377
90 HE3 LYS 11 2HE LYS 11 12.030 3.979 4.439
91 HZ1 LYS 11 3HZ LYS 11 9.729 3.388 6.052
92 HZ2 LYS 11 1HZ LYS 11 9.710 4.963 5.435
93 HZ3 LYS 11 2HZ LYS 11 11.025 4.433 6.358
94 H ASN 12 H ASN 12 8.603 -0.422 2.280
95 HA ASN 12 HA ASN 12 6.755 -1.262 0.237
96 HB2 ASN 12 1HB ASN 12 8.023 -2.958 1.410
97 HB3 ASN 12 2HB ASN 12 7.403 -2.403 2.962
98 HD21 ASN 12 2HD2 ASN 12 5.966 -3.737 3.760
99 HD22 ASN 12 1HD2 ASN 12 4.780 -4.620 2.866
100 H GLU 13 H GLU 13 5.459 0.754 0.417
101 HA GLU 13 HA GLU 13 3.293 0.346 2.351
102 HB2 GLU 13 1HB GLU 13 3.165 2.714 2.856
103 HB3 GLU 13 2HB GLU 13 4.771 2.114 3.245
104 HG2 GLU 13 1HG GLU 13 5.428 2.963 0.913
105 HG3 GLU 13 2HG GLU 13 3.921 3.875 0.981
106 H CYS 14 H CYS 14 1.265 1.289 1.712
107 HA CYS 14 HA CYS 14 0.958 1.304 -1.183
108 HB2 CYS 14 1HB CYS 14 -0.580 -0.100 0.039
109 HB3 CYS 14 2HB CYS 14 -1.058 1.243 1.069
110 HG CYS 14 HG CYS 14 -3.086 1.870 -0.357
111 H LYS 15 H LYS 15 1.119 3.167 -2.225
112 HA LYS 15 HA LYS 15 0.418 5.656 -0.847
113 HB2 LYS 15 1HB LYS 15 1.549 6.732 -2.824
114 HB3 LYS 15 2HB LYS 15 2.591 5.734 -1.820
115 HG2 LYS 15 1HG LYS 15 3.072 4.366 -3.505
116 HG3 LYS 15 2HG LYS 15 1.381 4.235 -3.991
117 HD2 LYS 15 1HD LYS 15 2.490 6.849 -4.588
118 HD3 LYS 15 2HD LYS 15 3.396 5.549 -5.367
119 HE2 LYS 15 1HE LYS 15 1.013 4.679 -6.004
120 HE3 LYS 15 2HE LYS 15 0.540 6.352 -5.711
121 HZ1 LYS 15 3HZ LYS 15 1.274 5.616 -8.066
122 HZ2 LYS 15 1HZ LYS 15 2.842 5.779 -7.449
123 HZ3 LYS 15 2HZ LYS 15 1.796 7.107 -7.462
124 H TYR 16 H TYR 16 -1.742 5.948 -1.010
125 HA TYR 16 HA TYR 16 -2.845 6.138 -3.728
126 HB2 TYR 16 1HB TYR 16 -4.885 5.074 -3.082
127 HB3 TYR 16 2HB TYR 16 -3.573 4.020 -2.570
128 HD1 TYR 16 1HD TYR 16 -2.973 3.870 -0.169
129 HD2 TYR 16 2HD TYR 16 -6.362 6.074 -1.493
130 HE1 TYR 16 1HE TYR 16 -3.862 3.868 2.124
131 HE2 TYR 16 2HE TYR 16 -7.260 6.080 0.797
132 HH TYR 16 HH TYR 16 -6.741 5.696 2.979
133 H LYS 17 H LYS 17 -5.139 7.236 -3.525
134 HA LYS 17 HA LYS 17 -4.749 9.639 -1.871
135 HB2 LYS 17 1HB LYS 17 -4.760 10.108 -4.255
136 HB3 LYS 17 2HB LYS 17 -6.292 9.263 -4.444
137 HG2 LYS 17 1HG LYS 17 -6.705 11.226 -2.475
138 HG3 LYS 17 2HG LYS 17 -5.807 11.998 -3.784
139 HD2 LYS 17 1HD LYS 17 -8.103 10.249 -4.500
140 HD3 LYS 17 2HD LYS 17 -8.451 11.836 -3.810
141 HE2 LYS 17 1HE LYS 17 -6.557 12.467 -5.649
142 HE3 LYS 17 2HE LYS 17 -7.355 11.108 -6.441
143 HZ1 LYS 17 3HZ LYS 17 -8.358 13.255 -7.008
144 HZ2 LYS 17 1HZ LYS 17 -8.749 13.507 -5.382
145 HZ3 LYS 17 2HZ LYS 17 -9.459 12.231 -6.234
146 H ASN 18 H ASN 18 -6.250 10.229 -0.411
147 HA ASN 18 HA ASN 18 -8.826 8.810 -0.411
148 HB2 ASN 18 1HB ASN 18 -8.680 8.222 1.829
149 HB3 ASN 18 2HB ASN 18 -7.017 7.997 1.296
150 HD21 ASN 18 2HD2 ASN 18 -5.750 10.186 1.418
151 HD22 ASN 18 1HD2 ASN 18 -5.877 10.995 2.938
152 H ASP 19 H ASP 19 -10.259 9.908 1.415
153 HA ASP 19 HA ASP 19 -11.452 11.737 2.056
154 HB2 ASP 19 1HB ASP 19 -9.448 12.489 3.177
155 HB3 ASP 19 2HB ASP 19 -8.782 13.103 1.666
156 H ALA 20 H ALA 20 -9.306 13.500 -0.132
157 HA ALA 20 HA ALA 20 -11.037 13.438 -2.374
158 HB1 ALA 20 1HB ALA 20 -12.437 14.814 -0.891
159 HB2 ALA 20 2HB ALA 20 -11.124 15.986 -0.763
160 HB3 ALA 20 3HB ALA 20 -11.902 15.700 -2.320
161 H GLY 21 H GLY 21 -8.370 12.985 -2.188
162 HA2 GLY 21 1HA GLY 21 -6.832 13.704 -3.957
163 HA3 GLY 21 2HA GLY 21 -7.227 15.361 -3.522
164 H LYS 22 H LYS 22 -6.982 13.427 -0.788
165 HA LYS 22 HA LYS 22 -4.458 14.673 -0.077
166 HB2 LYS 22 1HB LYS 22 -6.073 14.768 1.646
167 HB3 LYS 22 2HB LYS 22 -6.502 13.074 1.447
168 HG2 LYS 22 1HG LYS 22 -4.531 12.340 2.494
169 HG3 LYS 22 2HG LYS 22 -3.779 13.933 2.370
170 HD2 LYS 22 1HD LYS 22 -5.078 14.815 4.086
171 HD3 LYS 22 2HD LYS 22 -6.309 13.560 3.931
172 HE2 LYS 22 1HE LYS 22 -5.030 13.196 5.946
173 HE3 LYS 22 2HE LYS 22 -4.691 11.909 4.790
174 HZ1 LYS 22 3HZ LYS 22 -2.610 12.863 4.271
175 HZ2 LYS 22 1HZ LYS 22 -2.712 12.861 5.959
176 HZ3 LYS 22 2HZ LYS 22 -2.962 14.296 5.099
177 H ASP 23 H ASP 23 -2.563 13.610 0.393
178 HA ASP 23 HA ASP 23 -2.276 10.983 -0.810
179 HB2 ASP 23 1HB ASP 23 0.148 11.347 -0.452
180 HB3 ASP 23 2HB ASP 23 -0.606 12.664 -1.347
181 H THR 24 H THR 24 -1.636 9.130 0.240
182 HA THR 24 HA THR 24 -1.206 9.207 3.124
183 HB THR 24 HB THR 24 -3.402 7.555 1.859
184 HG1 THR 24 1HG THR 24 -4.648 8.827 3.459
185 HG21 THR 24 3HG2 THR 24 -3.850 6.774 4.147
186 HG22 THR 24 1HG2 THR 24 -2.427 7.645 4.717
187 HG23 THR 24 2HG2 THR 24 -2.244 6.295 3.597
188 H PHE 25 H PHE 25 0.207 7.697 3.806
189 HA PHE 25 HA PHE 25 0.885 5.508 1.958
190 HB2 PHE 25 1HB PHE 25 2.846 7.144 3.581
191 HB3 PHE 25 2HB PHE 25 3.252 5.777 2.548
192 HD1 PHE 25 2HD PHE 25 1.900 9.219 2.534
193 HD2 PHE 25 1HD PHE 25 3.603 6.059 0.247
194 HE1 PHE 25 2HE PHE 25 2.162 10.748 0.623
195 HE2 PHE 25 1HE PHE 25 3.868 7.582 -1.667
196 HZ PHE 25 HZ PHE 25 3.145 9.930 -1.481
197 H ILE 26 H ILE 26 0.492 3.619 2.880
198 HA ILE 26 HA ILE 26 0.940 3.346 5.781
199 HB ILE 26 HB ILE 26 -1.445 3.291 5.363
200 HG12 ILE 26 1HG1 ILE 26 -1.970 1.089 6.310
201 HG13 ILE 26 2HG1 ILE 26 -0.374 0.502 5.852
202 HG21 ILE 26 1HG2 ILE 26 -1.643 0.845 3.864
203 HG22 ILE 26 2HG2 ILE 26 -2.347 2.426 3.528
204 HG23 ILE 26 3HG2 ILE 26 -0.719 2.050 2.966
205 HD11 ILE 26 3HD1 ILE 26 -0.965 1.392 8.294
206 HD12 ILE 26 1HD1 ILE 26 0.643 1.525 7.583
207 HD13 ILE 26 2HD1 ILE 26 -0.452 2.908 7.555
208 H LYS 27 H LYS 27 2.418 1.890 6.310
209 HA LYS 27 HA LYS 27 3.591 0.188 4.316
210 HB2 LYS 27 1HB LYS 27 4.104 0.257 7.294
211 HB3 LYS 27 2HB LYS 27 5.129 -0.487 6.076
212 HG2 LYS 27 1HG LYS 27 5.484 1.753 5.077
213 HG3 LYS 27 2HG LYS 27 4.562 2.451 6.411
214 HD2 LYS 27 1HD LYS 27 6.242 1.220 7.929
215 HD3 LYS 27 2HD LYS 27 7.232 1.080 6.475
216 HE2 LYS 27 1HE LYS 27 8.045 3.066 7.180
217 HE3 LYS 27 2HE LYS 27 6.614 3.695 6.363
218 HZ1 LYS 27 3HZ LYS 27 5.700 4.311 8.290
219 HZ2 LYS 27 1HZ LYS 27 7.256 4.165 8.937
220 HZ3 LYS 27 2HZ LYS 27 6.153 2.893 9.093
221 H CYS 28 H CYS 28 2.812 -1.722 3.743
222 HA CYS 28 HA CYS 28 0.764 -3.055 5.186
223 HB2 CYS 28 1HB CYS 28 2.494 -4.251 3.019
224 HB3 CYS 28 2HB CYS 28 0.862 -4.728 3.474
225 HG CYS 28 HG CYS 28 1.233 -1.546 2.426
226 HA PRO 29 HA PRO 29 3.000 -5.590 7.983
227 HB2 PRO 29 1HB PRO 29 1.425 -7.801 8.054
228 HB3 PRO 29 2HB PRO 29 0.964 -6.267 8.805
229 HG2 PRO 29 1HG PRO 29 0.132 -7.411 6.167
230 HG3 PRO 29 2HG PRO 29 -0.854 -6.589 7.390
231 HD2 PRO 29 1HD PRO 29 0.039 -5.339 5.160
232 HD3 PRO 29 2HD PRO 29 -0.184 -4.493 6.705
233 H LYS 30 H LYS 30 4.603 -5.694 6.021
234 HA LYS 30 HA LYS 30 5.158 -8.528 5.588
235 HB2 LYS 30 1HB LYS 30 5.231 -6.535 3.319
236 HB3 LYS 30 2HB LYS 30 5.568 -8.258 3.222
237 HG2 LYS 30 1HG LYS 30 2.897 -7.124 4.014
238 HG3 LYS 30 2HG LYS 30 3.329 -7.566 2.361
239 HD2 LYS 30 1HD LYS 30 3.448 -9.834 2.867
240 HD3 LYS 30 2HD LYS 30 3.639 -9.537 4.596
241 HE2 LYS 30 1HE LYS 30 1.445 -10.313 4.385
242 HE3 LYS 30 2HE LYS 30 1.275 -8.562 4.499
243 HZ1 LYS 30 3HZ LYS 30 0.211 -8.590 2.574
244 HZ2 LYS 30 1HZ LYS 30 0.408 -10.265 2.449
245 HZ3 LYS 30 2HZ LYS 30 1.575 -9.227 1.803
246 H PHE 31 H PHE 31 6.503 -7.219 7.418
247 HA PHE 31 HA PHE 31 8.936 -6.138 6.195
248 HB2 PHE 31 1HB PHE 31 9.504 -5.538 8.596
249 HB3 PHE 31 2HB PHE 31 8.112 -4.710 7.906
250 HD1 PHE 31 1HD PHE 31 9.233 -7.206 10.328
251 HD2 PHE 31 2HD PHE 31 5.878 -5.160 8.694
252 HE1 PHE 31 1HE PHE 31 7.850 -7.975 12.214
253 HE2 PHE 31 2HE PHE 31 4.491 -5.923 10.577
254 HZ PHE 31 HZ PHE 31 5.476 -7.332 12.340
255 H ASP 32 H ASP 32 8.529 -8.875 5.875
256 HA ASP 32 HA ASP 32 10.960 -9.956 6.623
257 HB2 ASP 32 1HB ASP 32 9.116 -9.940 8.801
258 HB3 ASP 32 2HB ASP 32 9.357 -11.610 8.296
259 H ASN 33 H ASN 33 7.637 -10.390 5.750
260 HA ASN 33 HA ASN 33 8.220 -13.017 4.577
261 HB2 ASN 33 1HB ASN 33 5.490 -11.771 4.624
262 HB3 ASN 33 2HB ASN 33 5.932 -13.476 4.617
263 HD21 ASN 33 2HD2 ASN 33 6.509 -14.477 6.532
264 HD22 ASN 33 1HD2 ASN 33 6.203 -13.766 8.076
265 H LYS 34 H LYS 34 7.815 -9.732 3.776
266 HA LYS 34 HA LYS 34 8.501 -10.062 1.088
267 HB2 LYS 34 1HB LYS 34 5.658 -10.346 1.663
268 HB3 LYS 34 2HB LYS 34 5.979 -9.044 0.524
269 HG2 LYS 34 1HG LYS 34 7.480 -11.443 -0.106
270 HG3 LYS 34 2HG LYS 34 5.737 -11.726 -0.070
271 HD2 LYS 34 1HD LYS 34 5.392 -10.530 -1.937
272 HD3 LYS 34 2HD LYS 34 6.503 -9.254 -1.434
273 HE2 LYS 34 1HE LYS 34 8.316 -10.259 -2.417
274 HE3 LYS 34 2HE LYS 34 7.633 -11.878 -2.271
275 HZ1 LYS 34 3HZ LYS 34 6.602 -9.818 -4.141
276 HZ2 LYS 34 1HZ LYS 34 6.167 -11.452 -4.077
277 HZ3 LYS 34 2HZ LYS 34 7.721 -11.010 -4.577
278 H LYS 35 H LYS 35 9.799 -8.391 2.247
279 HA LYS 35 HA LYS 35 8.567 -5.838 2.746
280 HB2 LYS 35 1HB LYS 35 10.980 -7.098 3.461
281 HB3 LYS 35 2HB LYS 35 11.435 -5.701 2.493
282 HG2 LYS 35 1HG LYS 35 9.389 -5.168 4.524
283 HG3 LYS 35 2HG LYS 35 10.964 -5.650 5.160
284 HD2 LYS 35 1HD LYS 35 10.999 -3.286 4.991
285 HD3 LYS 35 2HD LYS 35 11.976 -3.897 3.654
286 HE2 LYS 35 1HE LYS 35 9.357 -3.746 2.675
287 HE3 LYS 35 2HE LYS 35 9.605 -2.263 3.595
288 HZ1 LYS 35 3HZ LYS 35 11.514 -1.746 2.292
289 HZ2 LYS 35 1HZ LYS 35 10.254 -2.110 1.223
290 HZ3 LYS 35 2HZ LYS 35 11.473 -3.246 1.509
291 H CYS 36 H CYS 36 7.879 -6.427 0.228
292 HA CYS 36 HA CYS 36 7.831 -5.596 -1.887
293 HB2 CYS 36 1HB CYS 36 8.078 -3.434 -0.526
294 HB3 CYS 36 2HB CYS 36 9.773 -3.470 -0.999
295 HG CYS 36 HG CYS 36 9.372 -3.104 -3.664
296 H THR 37 H THR 37 9.107 -5.349 -3.855
297 HA THR 37 HA THR 37 11.901 -5.714 -3.935
298 HB THR 37 HB THR 37 11.336 -7.963 -3.072
299 HG1 THR 37 1HG THR 37 13.146 -8.007 -4.295
300 HG21 THR 37 3HG2 THR 37 9.545 -9.050 -3.823
301 HG22 THR 37 1HG2 THR 37 10.291 -9.167 -5.416
302 HG23 THR 37 2HG2 THR 37 9.263 -7.789 -5.023
303 H LYS 38 H LYS 38 9.983 -4.102 -5.231
304 HA LYS 38 HA LYS 38 10.865 -4.159 -7.862
305 HB2 LYS 38 1HB LYS 38 8.868 -6.112 -7.396
306 HB3 LYS 38 2HB LYS 38 8.114 -4.825 -8.328
307 HG2 LYS 38 1HG LYS 38 9.924 -5.009 -9.991
308 HG3 LYS 38 2HG LYS 38 10.597 -6.357 -9.072
309 HD2 LYS 38 1HD LYS 38 7.735 -6.478 -9.887
310 HD3 LYS 38 2HD LYS 38 8.974 -6.761 -11.112
311 HE2 LYS 38 1HE LYS 38 9.904 -8.316 -9.113
312 HE3 LYS 38 2HE LYS 38 8.170 -8.410 -8.804
313 HZ1 LYS 38 3HZ LYS 38 7.775 -9.354 -10.877
314 HZ2 LYS 38 1HZ LYS 38 9.194 -10.120 -10.366
315 HZ3 LYS 38 2HZ LYS 38 9.270 -8.873 -11.505
316 H ASP 39 H ASP 39 10.749 -2.078 -8.343
317 HA ASP 39 HA ASP 39 9.321 -0.143 -7.014
318 HB2 ASP 39 1HB ASP 39 9.961 0.065 -9.953
319 HB3 ASP 39 2HB ASP 39 9.902 1.359 -8.760
320 H ASN 40 H ASN 40 7.202 0.022 -6.733
321 HA ASN 40 HA ASN 40 4.969 0.141 -7.148
322 HB2 ASN 40 1HB ASN 40 5.457 0.124 -10.106
323 HB3 ASN 40 2HB ASN 40 4.256 1.020 -9.181
324 HD21 ASN 40 2HD2 ASN 40 5.763 2.235 -7.280
325 HD22 ASN 40 1HD2 ASN 40 6.862 3.348 -8.015
326 H ASN 41 H ASN 41 5.145 -2.150 -6.378
327 HA ASN 41 HA ASN 41 4.877 -4.225 -8.365
328 HB2 ASN 41 1HB ASN 41 5.328 -4.077 -5.494
329 HB3 ASN 41 2HB ASN 41 4.143 -5.311 -5.909
330 HD21 ASN 41 2HD2 ASN 41 6.752 -5.723 -4.831
331 HD22 ASN 41 1HD2 ASN 41 7.641 -6.653 -5.985
332 H LYS 42 H LYS 42 2.803 -3.756 -5.533
333 HA LYS 42 HA LYS 42 0.450 -3.053 -6.864
334 HB2 LYS 42 1HB LYS 42 0.476 -5.149 -7.993
335 HB3 LYS 42 2HB LYS 42 0.880 -6.017 -6.518
336 HG2 LYS 42 1HG LYS 42 -1.271 -5.894 -5.696
337 HG3 LYS 42 2HG LYS 42 -1.684 -4.499 -6.695
338 HD2 LYS 42 1HD LYS 42 -1.092 -6.409 -8.568
339 HD3 LYS 42 2HD LYS 42 -1.856 -7.357 -7.291
340 HE2 LYS 42 1HE LYS 42 -3.864 -6.228 -7.475
341 HE3 LYS 42 2HE LYS 42 -3.116 -4.804 -8.195
342 HZ1 LYS 42 3HZ LYS 42 -3.491 -5.605 -10.213
343 HZ2 LYS 42 1HZ LYS 42 -4.388 -6.861 -9.518
344 HZ3 LYS 42 2HZ LYS 42 -2.744 -7.078 -9.848
345 H CYS 43 H CYS 43 -1.227 -2.695 -5.443
346 HA CYS 43 HA CYS 43 -1.149 -3.808 -2.773
347 HB2 CYS 43 1HB CYS 43 -0.205 -1.097 -3.375
348 HB3 CYS 43 2HB CYS 43 -1.441 -1.152 -2.123
349 HG CYS 43 HG CYS 43 1.280 -3.190 -1.928
350 H THR 44 H THR 44 -3.005 -2.838 -1.432
351 HA THR 44 HA THR 44 -5.217 -1.757 -2.929
352 HB THR 44 HB THR 44 -6.331 -4.075 -1.710
353 HG1 THR 44 1HG THR 44 -4.014 -4.765 -2.208
354 HG21 THR 44 3HG2 THR 44 -5.966 -3.396 -4.630
355 HG22 THR 44 1HG2 THR 44 -7.261 -2.786 -3.601
356 HG23 THR 44 2HG2 THR 44 -7.153 -4.510 -3.955
357 H VAL 45 H VAL 45 -6.935 -1.054 -1.607
358 HA VAL 45 HA VAL 45 -6.731 -1.461 1.267
359 HB VAL 45 HB VAL 45 -6.585 1.295 0.036
360 HG11 VAL 45 1HG1 VAL 45 -8.025 1.340 1.969
361 HG12 VAL 45 2HG1 VAL 45 -6.838 0.441 2.917
362 HG13 VAL 45 3HG1 VAL 45 -6.479 2.083 2.379
363 HG21 VAL 45 3HG2 VAL 45 -4.613 -0.210 1.754
364 HG22 VAL 45 1HG2 VAL 45 -4.446 0.120 0.030
365 HG23 VAL 45 2HG2 VAL 45 -4.431 1.449 1.187
366 H ASP 46 H ASP 46 -8.669 -1.366 2.283
367 HA ASP 46 HA ASP 46 -10.975 -0.425 0.709
368 HB2 ASP 46 1HB ASP 46 -10.609 -3.008 1.127
369 HB3 ASP 46 2HB ASP 46 -11.294 -2.628 2.705
370 H THR 47 H THR 47 -12.831 0.262 1.982
371 HA THR 47 HA THR 47 -11.964 1.667 4.389
372 HB THR 47 HB THR 47 -14.001 2.976 4.182
373 HG1 THR 47 1HG THR 47 -14.609 1.162 2.070
374 HG21 THR 47 3HG2 THR 47 -13.535 3.328 1.444
375 HG22 THR 47 1HG2 THR 47 -12.001 2.776 2.115
376 HG23 THR 47 2HG2 THR 47 -12.787 4.209 2.776
377 H TYR 48 H TYR 48 -13.506 -1.192 3.597
378 HA TYR 48 HA TYR 48 -15.611 -1.449 5.358
379 HB2 TYR 48 1HB TYR 48 -15.236 -3.221 3.837
380 HB3 TYR 48 2HB TYR 48 -13.580 -3.451 4.387
381 HD1 TYR 48 2HD TYR 48 -16.651 -3.120 6.455
382 HD2 TYR 48 1HD TYR 48 -13.561 -5.693 5.064
383 HE1 TYR 48 2HE TYR 48 -17.415 -4.868 8.008
384 HE2 TYR 48 1HE TYR 48 -14.317 -7.448 6.613
385 HH TYR 48 HH TYR 48 -16.210 -8.105 7.868
386 H ASN 49 H ASN 49 -12.221 -2.361 5.998
387 HA ASN 49 HA ASN 49 -12.503 -1.513 8.758
388 HB2 ASN 49 1HB ASN 49 -13.205 -4.023 8.433
389 HB3 ASN 49 2HB ASN 49 -11.468 -4.294 8.344
390 HD21 ASN 49 2HD2 ASN 49 -10.396 -4.534 10.177
391 HD22 ASN 49 1HD2 ASN 49 -10.997 -4.157 11.752
392 H ASN 50 H ASN 50 -10.968 -0.494 6.633
393 HA ASN 50 HA ASN 50 -8.850 0.112 6.046
394 HB2 ASN 50 1HB ASN 50 -9.126 0.647 8.638
395 HB3 ASN 50 2HB ASN 50 -7.850 -0.559 8.774
396 HD21 ASN 50 2HD2 ASN 50 -6.180 -0.154 6.821
397 HD22 ASN 50 1HD2 ASN 50 -5.551 1.455 6.809
398 H ALA 51 H ALA 51 -9.189 -2.255 5.032
399 HA ALA 51 HA ALA 51 -7.192 -4.133 5.996
400 HB1 ALA 51 1HB ALA 51 -9.282 -4.233 3.850
401 HB2 ALA 51 2HB ALA 51 -8.015 -5.456 3.955
402 HB3 ALA 51 3HB ALA 51 -9.132 -5.223 5.301
403 H VAL 52 H VAL 52 -5.140 -3.684 5.504
404 HA VAL 52 HA VAL 52 -4.519 -2.536 2.874
405 HB VAL 52 HB VAL 52 -2.665 -2.813 5.241
406 HG11 VAL 52 1HG1 VAL 52 -2.367 -0.827 3.034
407 HG12 VAL 52 2HG1 VAL 52 -1.137 -1.548 4.073
408 HG13 VAL 52 3HG1 VAL 52 -1.861 -2.495 2.772
409 HG21 VAL 52 3HG2 VAL 52 -4.162 -1.325 6.121
410 HG22 VAL 52 1HG2 VAL 52 -3.128 -0.212 5.225
411 HG23 VAL 52 2HG2 VAL 52 -4.669 -0.729 4.540
412 H ASP 53 H ASP 53 -4.026 -3.973 1.359
413 HA ASP 53 HA ASP 53 -2.638 -6.446 2.139
414 HB2 ASP 53 1HB ASP 53 -4.299 -5.791 -0.301
415 HB3 ASP 53 2HB ASP 53 -3.402 -7.293 -0.097
416 H CYS 54 H CYS 54 -1.322 -7.314 0.112
417 HA CYS 54 HA CYS 54 0.195 -5.146 -1.130
418 HB2 CYS 54 1HB CYS 54 1.146 -6.401 1.140
419 HB3 CYS 54 2HB CYS 54 1.934 -7.288 -0.159
420 HG CYS 54 HG CYS 54 3.883 -5.587 0.048
421 H ASP 55 H ASP 55 1.979 -6.240 -2.593
422 HA ASP 55 HA ASP 55 0.557 -7.802 -4.505
423 HB2 ASP 55 1HB ASP 55 2.315 -6.126 -5.085
424 HB3 ASP 55 2HB ASP 55 3.522 -7.216 -4.409
Start of MODEL 13
1 H1 ALA 1 H ALA 1 -14.471 0.920 2.012
2 HA ALA 1 HA ALA 1 -14.939 0.443 -0.855
3 HB1 ALA 1 1HB ALA 1 -15.525 2.682 0.389
4 HB2 ALA 1 2HB ALA 1 -13.808 3.008 0.149
5 HB3 ALA 1 3HB ALA 1 -14.850 2.700 -1.241
6 H LYS 2 H LYS 2 -13.307 -0.246 -2.066
7 HA LYS 2 HA LYS 2 -10.681 -0.559 -0.923
8 HB2 LYS 2 1HB LYS 2 -11.846 -1.256 -3.619
9 HB3 LYS 2 2HB LYS 2 -10.164 -1.554 -3.197
10 HG2 LYS 2 1HG LYS 2 -10.665 -3.366 -1.994
11 HG3 LYS 2 2HG LYS 2 -12.063 -2.594 -1.239
12 HD2 LYS 2 1HD LYS 2 -13.061 -4.267 -2.479
13 HD3 LYS 2 2HD LYS 2 -13.152 -2.896 -3.588
14 HE2 LYS 2 1HE LYS 2 -10.808 -4.756 -3.660
15 HE3 LYS 2 2HE LYS 2 -12.316 -5.195 -4.459
16 HZ1 LYS 2 3HZ LYS 2 -11.842 -2.628 -5.261
17 HZ2 LYS 2 1HZ LYS 2 -11.567 -4.025 -6.174
18 HZ3 LYS 2 2HZ LYS 2 -10.307 -3.339 -5.278
19 H TYR 3 H TYR 3 -8.717 0.143 -2.043
20 HA TYR 3 HA TYR 3 -9.044 2.569 -3.656
21 HB2 TYR 3 1HB TYR 3 -7.570 2.333 -1.047
22 HB3 TYR 3 2HB TYR 3 -7.086 3.525 -2.249
23 HD1 TYR 3 1HD TYR 3 -9.780 2.487 0.037
24 HD2 TYR 3 2HD TYR 3 -8.406 5.486 -2.650
25 HE1 TYR 3 1HE TYR 3 -11.509 4.022 0.876
26 HE2 TYR 3 2HE TYR 3 -10.130 7.030 -1.817
27 HH TYR 3 HH TYR 3 -11.812 6.563 1.001
28 H THR 4 H THR 4 -7.642 2.717 -5.302
29 HA THR 4 HA THR 4 -5.749 0.553 -5.684
30 HB THR 4 HB THR 4 -5.363 1.975 -7.891
31 HG1 THR 4 1HG THR 4 -8.053 2.658 -7.380
32 HG21 THR 4 3HG2 THR 4 -7.494 0.823 -8.804
33 HG22 THR 4 1HG2 THR 4 -7.641 0.161 -7.177
34 HG23 THR 4 2HG2 THR 4 -6.206 -0.182 -8.142
35 H GLY 5 H GLY 5 -3.616 0.677 -5.378
36 HA2 GLY 5 1HA GLY 5 -2.202 3.190 -5.609
37 HA3 GLY 5 2HA GLY 5 -2.286 2.560 -3.969
38 H LYS 6 H LYS 6 0.161 2.889 -4.918
39 HA LYS 6 HA LYS 6 1.072 0.138 -5.356
40 HB2 LYS 6 1HB LYS 6 2.416 2.402 -6.799
41 HB3 LYS 6 2HB LYS 6 2.501 0.677 -7.130
42 HG2 LYS 6 1HG LYS 6 1.132 1.271 -8.826
43 HG3 LYS 6 2HG LYS 6 -0.096 1.037 -7.579
44 HD2 LYS 6 1HD LYS 6 -0.752 3.116 -8.099
45 HD3 LYS 6 2HD LYS 6 0.657 3.638 -7.172
46 HE2 LYS 6 1HE LYS 6 1.984 3.550 -9.282
47 HE3 LYS 6 2HE LYS 6 0.488 3.215 -10.153
48 HZ1 LYS 6 3HZ LYS 6 -0.231 5.388 -8.834
49 HZ2 LYS 6 1HZ LYS 6 0.504 5.449 -10.356
50 HZ3 LYS 6 2HZ LYS 6 1.427 5.701 -8.961
51 H CYS 7 H CYS 7 3.515 -0.001 -5.020
52 HA CYS 7 HA CYS 7 4.462 1.953 -3.050
53 HB2 CYS 7 1HB CYS 7 5.348 -0.009 -1.691
54 HB3 CYS 7 2HB CYS 7 3.609 0.259 -1.632
55 HG CYS 7 HG CYS 7 5.141 -2.487 -2.275
56 H THR 8 H THR 8 6.770 1.920 -2.721
57 HA THR 8 HA THR 8 8.183 1.072 -5.142
58 HB THR 8 HB THR 8 8.485 3.399 -4.648
59 HG1 THR 8 1HG THR 8 10.464 2.989 -5.274
60 HG21 THR 8 3HG2 THR 8 8.613 2.448 -1.909
61 HG22 THR 8 1HG2 THR 8 8.255 4.060 -2.525
62 HG23 THR 8 2HG2 THR 8 9.929 3.560 -2.284
63 H LYS 9 H LYS 9 10.119 -0.093 -5.069
64 HA LYS 9 HA LYS 9 10.264 -2.180 -3.229
65 HB2 LYS 9 1HB LYS 9 12.627 -2.468 -4.150
66 HB3 LYS 9 2HB LYS 9 11.308 -2.524 -5.314
67 HG2 LYS 9 1HG LYS 9 12.172 -0.841 -6.461
68 HG3 LYS 9 2HG LYS 9 12.247 0.171 -5.017
69 HD2 LYS 9 1HD LYS 9 14.473 0.067 -5.415
70 HD3 LYS 9 2HD LYS 9 14.329 -1.458 -4.536
71 HE2 LYS 9 1HE LYS 9 13.692 -2.100 -7.165
72 HE3 LYS 9 2HE LYS 9 15.037 -0.969 -7.302
73 HZ1 LYS 9 3HZ LYS 9 16.155 -2.415 -5.560
74 HZ2 LYS 9 1HZ LYS 9 16.024 -3.057 -7.120
75 HZ3 LYS 9 2HZ LYS 9 14.967 -3.571 -5.903
76 H SER 10 H SER 10 11.426 1.048 -3.020
77 HA SER 10 HA SER 10 13.330 0.458 -0.909
78 HB2 SER 10 1HB SER 10 13.457 3.043 -0.862
79 HB3 SER 10 2HB SER 10 14.075 2.208 -2.287
80 HG SER 10 HG SER 10 12.268 4.083 -2.239
81 H LYS 11 H LYS 11 10.025 1.289 -1.229
82 HA LYS 11 HA LYS 11 9.763 1.387 1.674
83 HB2 LYS 11 1HB LYS 11 9.797 3.743 0.284
84 HB3 LYS 11 2HB LYS 11 8.077 3.377 0.314
85 HG2 LYS 11 1HG LYS 11 8.582 4.754 2.192
86 HG3 LYS 11 2HG LYS 11 8.236 3.127 2.782
87 HD2 LYS 11 1HD LYS 11 10.130 3.648 3.985
88 HD3 LYS 11 2HD LYS 11 10.828 2.824 2.588
89 HE2 LYS 11 1HE LYS 11 11.508 4.844 1.604
90 HE3 LYS 11 2HE LYS 11 10.460 5.804 2.647
91 HZ1 LYS 11 3HZ LYS 11 11.860 5.222 4.528
92 HZ2 LYS 11 1HZ LYS 11 12.771 5.975 3.319
93 HZ3 LYS 11 2HZ LYS 11 12.865 4.299 3.528
94 H ASN 12 H ASN 12 8.400 -0.219 2.089
95 HA ASN 12 HA ASN 12 6.431 -1.067 0.158
96 HB2 ASN 12 1HB ASN 12 7.679 -2.705 1.526
97 HB3 ASN 12 2HB ASN 12 6.929 -2.049 2.978
98 HD21 ASN 12 2HD2 ASN 12 5.707 -3.694 3.649
99 HD22 ASN 12 1HD2 ASN 12 4.464 -4.449 2.715
100 H GLU 13 H GLU 13 5.665 1.380 0.554
101 HA GLU 13 HA GLU 13 3.452 1.241 2.496
102 HB2 GLU 13 1HB GLU 13 3.581 3.624 2.776
103 HB3 GLU 13 2HB GLU 13 5.184 2.950 3.034
104 HG2 GLU 13 1HG GLU 13 5.367 3.504 0.426
105 HG3 GLU 13 2HG GLU 13 4.197 4.734 0.904
106 H CYS 14 H CYS 14 1.419 1.806 1.827
107 HA CYS 14 HA CYS 14 0.983 1.802 -1.034
108 HB2 CYS 14 1HB CYS 14 -0.408 0.450 0.554
109 HB3 CYS 14 2HB CYS 14 -1.066 1.955 1.184
110 HG CYS 14 HG CYS 14 -2.754 0.452 -0.701
111 H LYS 15 H LYS 15 1.042 3.627 -2.151
112 HA LYS 15 HA LYS 15 0.379 6.153 -0.829
113 HB2 LYS 15 1HB LYS 15 1.351 7.171 -2.913
114 HB3 LYS 15 2HB LYS 15 2.479 6.218 -1.958
115 HG2 LYS 15 1HG LYS 15 2.909 4.897 -3.681
116 HG3 LYS 15 2HG LYS 15 1.193 4.559 -3.915
117 HD2 LYS 15 1HD LYS 15 1.533 5.602 -5.889
118 HD3 LYS 15 2HD LYS 15 1.329 7.060 -4.916
119 HE2 LYS 15 1HE LYS 15 3.642 7.432 -4.795
120 HE3 LYS 15 2HE LYS 15 4.021 5.788 -5.302
121 HZ1 LYS 15 3HZ LYS 15 2.690 6.628 -7.426
122 HZ2 LYS 15 1HZ LYS 15 4.362 6.825 -7.259
123 HZ3 LYS 15 2HZ LYS 15 3.320 8.111 -6.909
124 H TYR 16 H TYR 16 -1.923 5.558 -0.840
125 HA TYR 16 HA TYR 16 -3.187 5.827 -3.478
126 HB2 TYR 16 1HB TYR 16 -5.159 4.840 -2.512
127 HB3 TYR 16 2HB TYR 16 -3.777 3.839 -2.083
128 HD1 TYR 16 1HD TYR 16 -2.954 3.770 0.221
129 HD2 TYR 16 2HD TYR 16 -6.378 6.068 -0.828
130 HE1 TYR 16 1HE TYR 16 -3.559 3.945 2.598
131 HE2 TYR 16 2HE TYR 16 -6.991 6.251 1.547
132 HH TYR 16 HH TYR 16 -5.521 4.359 3.974
133 H LYS 17 H LYS 17 -5.452 6.926 -3.266
134 HA LYS 17 HA LYS 17 -5.003 9.507 -1.935
135 HB2 LYS 17 1HB LYS 17 -5.266 9.791 -4.287
136 HB3 LYS 17 2HB LYS 17 -6.667 8.727 -4.326
137 HG2 LYS 17 1HG LYS 17 -6.952 11.064 -2.577
138 HG3 LYS 17 2HG LYS 17 -6.781 11.433 -4.294
139 HD2 LYS 17 1HD LYS 17 -8.641 9.243 -3.616
140 HD3 LYS 17 2HD LYS 17 -9.134 10.863 -3.116
141 HE2 LYS 17 1HE LYS 17 -10.020 10.792 -5.228
142 HE3 LYS 17 2HE LYS 17 -8.432 11.479 -5.572
143 HZ1 LYS 17 3HZ LYS 17 -9.034 8.580 -5.750
144 HZ2 LYS 17 1HZ LYS 17 -7.640 9.376 -6.289
145 HZ3 LYS 17 2HZ LYS 17 -9.118 9.634 -7.071
146 H ASN 18 H ASN 18 -6.394 10.277 -0.441
147 HA ASN 18 HA ASN 18 -8.914 8.834 -0.004
148 HB2 ASN 18 1HB ASN 18 -8.521 8.431 2.233
149 HB3 ASN 18 2HB ASN 18 -6.892 8.246 1.587
150 HD21 ASN 18 2HD2 ASN 18 -5.854 10.605 1.346
151 HD22 ASN 18 1HD2 ASN 18 -5.873 11.501 2.823
152 H ASP 19 H ASP 19 -10.411 10.057 1.447
153 HA ASP 19 HA ASP 19 -11.543 11.940 2.058
154 HB2 ASP 19 1HB ASP 19 -9.181 12.616 2.868
155 HB3 ASP 19 2HB ASP 19 -9.126 13.614 1.417
156 H ALA 20 H ALA 20 -9.331 13.238 -0.415
157 HA ALA 20 HA ALA 20 -11.080 13.120 -2.581
158 HB1 ALA 20 1HB ALA 20 -11.352 15.582 -0.896
159 HB2 ALA 20 2HB ALA 20 -11.655 15.628 -2.633
160 HB3 ALA 20 3HB ALA 20 -12.613 14.569 -1.600
161 H GLY 21 H GLY 21 -8.327 12.807 -2.108
162 HA2 GLY 21 1HA GLY 21 -6.864 13.411 -4.081
163 HA3 GLY 21 2HA GLY 21 -7.175 15.075 -3.610
164 H LYS 22 H LYS 22 -7.044 13.422 -0.798
165 HA LYS 22 HA LYS 22 -4.404 14.403 -0.199
166 HB2 LYS 22 1HB LYS 22 -6.578 13.073 1.385
167 HB3 LYS 22 2HB LYS 22 -4.963 13.235 2.062
168 HG2 LYS 22 1HG LYS 22 -5.736 15.752 0.998
169 HG3 LYS 22 2HG LYS 22 -7.050 15.141 2.004
170 HD2 LYS 22 1HD LYS 22 -5.127 14.599 3.685
171 HD3 LYS 22 2HD LYS 22 -4.231 15.799 2.751
172 HE2 LYS 22 1HE LYS 22 -5.205 17.031 4.481
173 HE3 LYS 22 2HE LYS 22 -6.267 17.313 3.102
174 HZ1 LYS 22 3HZ LYS 22 -6.810 15.974 5.597
175 HZ2 LYS 22 1HZ LYS 22 -7.363 15.133 4.237
176 HZ3 LYS 22 2HZ LYS 22 -7.875 16.720 4.515
177 H ASP 23 H ASP 23 -2.590 13.304 -0.487
178 HA ASP 23 HA ASP 23 -2.613 10.532 -1.214
179 HB2 ASP 23 1HB ASP 23 -0.205 12.236 -0.559
180 HB3 ASP 23 2HB ASP 23 -0.243 10.765 -1.527
181 H THR 24 H THR 24 -2.656 8.886 0.149
182 HA THR 24 HA THR 24 -1.733 9.304 2.910
183 HB THR 24 HB THR 24 -3.464 7.044 1.897
184 HG1 THR 24 1HG THR 24 -4.281 9.385 1.836
185 HG21 THR 24 3HG2 THR 24 -2.132 6.863 4.088
186 HG22 THR 24 1HG2 THR 24 -3.861 6.520 4.147
187 HG23 THR 24 2HG2 THR 24 -3.251 8.075 4.711
188 H PHE 25 H PHE 25 -0.072 8.167 3.726
189 HA PHE 25 HA PHE 25 0.986 5.920 2.148
190 HB2 PHE 25 1HB PHE 25 2.666 8.033 3.514
191 HB3 PHE 25 2HB PHE 25 3.260 6.674 2.566
192 HD1 PHE 25 2HD PHE 25 1.409 9.861 2.386
193 HD2 PHE 25 1HD PHE 25 3.403 6.790 0.215
194 HE1 PHE 25 2HE PHE 25 1.335 11.251 0.359
195 HE2 PHE 25 1HE PHE 25 3.332 8.176 -1.816
196 HZ PHE 25 HZ PHE 25 2.296 10.409 -1.747
197 H ILE 26 H ILE 26 1.115 4.119 3.298
198 HA ILE 26 HA ILE 26 1.956 4.183 6.072
199 HB ILE 26 HB ILE 26 -0.415 4.461 6.381
200 HG12 ILE 26 1HG1 ILE 26 -0.934 2.438 7.671
201 HG13 ILE 26 2HG1 ILE 26 0.355 1.571 6.846
202 HG21 ILE 26 1HG2 ILE 26 -1.909 3.683 4.938
203 HG22 ILE 26 2HG2 ILE 26 -0.607 2.901 4.042
204 HG23 ILE 26 3HG2 ILE 26 -1.450 2.022 5.317
205 HD11 ILE 26 3HD1 ILE 26 1.255 4.030 8.113
206 HD12 ILE 26 1HD1 ILE 26 0.571 2.864 9.244
207 HD13 ILE 26 2HD1 ILE 26 1.915 2.397 8.200
208 H LYS 27 H LYS 27 3.450 2.660 6.218
209 HA LYS 27 HA LYS 27 4.015 0.718 4.336
210 HB2 LYS 27 1HB LYS 27 5.198 1.576 6.640
211 HB3 LYS 27 2HB LYS 27 4.670 -0.035 7.108
212 HG2 LYS 27 1HG LYS 27 6.178 -1.056 5.794
213 HG3 LYS 27 2HG LYS 27 6.020 0.136 4.502
214 HD2 LYS 27 1HD LYS 27 7.332 1.727 5.904
215 HD3 LYS 27 2HD LYS 27 7.593 0.420 7.062
216 HE2 LYS 27 1HE LYS 27 8.314 -0.703 4.645
217 HE3 LYS 27 2HE LYS 27 8.901 0.956 4.517
218 HZ1 LYS 27 3HZ LYS 27 9.445 -0.491 6.999
219 HZ2 LYS 27 1HZ LYS 27 10.386 0.659 6.189
220 HZ3 LYS 27 2HZ LYS 27 10.330 -0.935 5.628
221 H CYS 28 H CYS 28 3.200 -1.215 3.832
222 HA CYS 28 HA CYS 28 0.859 -2.164 5.211
223 HB2 CYS 28 1HB CYS 28 2.322 -3.616 3.012
224 HB3 CYS 28 2HB CYS 28 0.616 -3.709 3.430
225 HG CYS 28 HG CYS 28 2.224 -1.499 1.487
226 HA PRO 29 HA PRO 29 2.674 -5.135 7.881
227 HB2 PRO 29 1HB PRO 29 0.778 -7.077 7.875
228 HB3 PRO 29 2HB PRO 29 0.559 -5.524 8.689
229 HG2 PRO 29 1HG PRO 29 -0.441 -6.418 6.013
230 HG3 PRO 29 2HG PRO 29 -1.287 -5.505 7.274
231 HD2 PRO 29 1HD PRO 29 -0.214 -4.318 5.090
232 HD3 PRO 29 2HD PRO 29 -0.304 -3.511 6.669
233 H LYS 30 H LYS 30 4.444 -5.627 6.407
234 HA LYS 30 HA LYS 30 4.335 -8.400 5.534
235 HB2 LYS 30 1HB LYS 30 5.002 -6.101 3.695
236 HB3 LYS 30 2HB LYS 30 5.464 -7.764 3.356
237 HG2 LYS 30 1HG LYS 30 2.618 -6.929 3.835
238 HG3 LYS 30 2HG LYS 30 3.366 -6.940 2.235
239 HD2 LYS 30 1HD LYS 30 3.299 -9.188 2.086
240 HD3 LYS 30 2HD LYS 30 3.718 -9.413 3.786
241 HE2 LYS 30 1HE LYS 30 1.213 -8.354 3.968
242 HE3 LYS 30 2HE LYS 30 1.092 -9.296 2.482
243 HZ1 LYS 30 3HZ LYS 30 1.828 -10.267 5.184
244 HZ2 LYS 30 1HZ LYS 30 2.044 -11.193 3.784
245 HZ3 LYS 30 2HZ LYS 30 0.490 -10.715 4.250
246 H PHE 31 H PHE 31 5.669 -8.341 7.545
247 HA PHE 31 HA PHE 31 8.249 -7.120 7.479
248 HB2 PHE 31 1HB PHE 31 7.327 -9.390 9.248
249 HB3 PHE 31 2HB PHE 31 8.664 -8.287 9.550
250 HD1 PHE 31 1HD PHE 31 5.036 -8.696 9.570
251 HD2 PHE 31 2HD PHE 31 8.267 -6.027 10.309
252 HE1 PHE 31 1HE PHE 31 3.513 -7.195 10.789
253 HE2 PHE 31 2HE PHE 31 6.752 -4.522 11.529
254 HZ PHE 31 HZ PHE 31 4.371 -5.105 11.771
255 H ASP 32 H ASP 32 9.929 -9.134 8.408
256 HA ASP 32 HA ASP 32 11.071 -10.132 6.120
257 HB2 ASP 32 1HB ASP 32 12.097 -10.073 8.419
258 HB3 ASP 32 2HB ASP 32 11.173 -11.524 8.801
259 H ASN 33 H ASN 33 9.566 -11.018 4.708
260 HA ASN 33 HA ASN 33 9.210 -13.773 4.761
261 HB2 ASN 33 1HB ASN 33 7.434 -12.593 6.523
262 HB3 ASN 33 2HB ASN 33 6.469 -12.803 5.065
263 HD21 ASN 33 2HD2 ASN 33 8.810 -14.592 7.042
264 HD22 ASN 33 1HD2 ASN 33 7.982 -16.106 6.955
265 H LYS 34 H LYS 34 7.419 -10.838 3.827
266 HA LYS 34 HA LYS 34 7.836 -11.454 1.030
267 HB2 LYS 34 1HB LYS 34 5.088 -11.420 2.273
268 HB3 LYS 34 2HB LYS 34 5.357 -11.191 0.550
269 HG2 LYS 34 1HG LYS 34 6.124 -13.625 2.149
270 HG3 LYS 34 2HG LYS 34 4.746 -13.489 1.054
271 HD2 LYS 34 1HD LYS 34 7.065 -12.668 -0.360
272 HD3 LYS 34 2HD LYS 34 7.438 -14.191 0.452
273 HE2 LYS 34 1HE LYS 34 4.908 -13.825 -1.120
274 HE3 LYS 34 2HE LYS 34 6.419 -14.291 -1.902
275 HZ1 LYS 34 3HZ LYS 34 5.205 -16.255 -1.383
276 HZ2 LYS 34 1HZ LYS 34 4.974 -15.775 0.223
277 HZ3 LYS 34 2HZ LYS 34 6.521 -16.184 -0.323
278 H LYS 35 H LYS 35 9.044 -9.423 1.989
279 HA LYS 35 HA LYS 35 7.460 -7.028 2.149
280 HB2 LYS 35 1HB LYS 35 10.112 -7.797 2.812
281 HB3 LYS 35 2HB LYS 35 10.225 -6.456 1.680
282 HG2 LYS 35 1HG LYS 35 8.328 -5.514 3.345
283 HG3 LYS 35 2HG LYS 35 9.263 -6.515 4.458
284 HD2 LYS 35 1HD LYS 35 10.500 -4.464 2.629
285 HD3 LYS 35 2HD LYS 35 10.002 -4.116 4.287
286 HE2 LYS 35 1HE LYS 35 12.149 -4.681 4.725
287 HE3 LYS 35 2HE LYS 35 11.473 -6.310 4.725
288 HZ1 LYS 35 3HZ LYS 35 13.467 -6.203 3.383
289 HZ2 LYS 35 1HZ LYS 35 12.800 -4.977 2.426
290 HZ3 LYS 35 2HZ LYS 35 12.129 -6.530 2.402
291 H CYS 36 H CYS 36 7.952 -5.130 0.739
292 HA CYS 36 HA CYS 36 7.284 -5.596 -1.893
293 HB2 CYS 36 1HB CYS 36 7.854 -3.291 -2.333
294 HB3 CYS 36 2HB CYS 36 7.141 -3.397 -0.727
295 HG CYS 36 HG CYS 36 9.301 -1.516 -0.870
296 H THR 37 H THR 37 8.372 -5.857 -3.798
297 HA THR 37 HA THR 37 11.273 -5.758 -3.852
298 HB THR 37 HB THR 37 11.350 -8.081 -4.905
299 HG1 THR 37 1HG THR 37 9.623 -9.357 -4.706
300 HG21 THR 37 3HG2 THR 37 11.629 -9.174 -2.786
301 HG22 THR 37 1HG2 THR 37 10.597 -7.991 -1.984
302 HG23 THR 37 2HG2 THR 37 12.170 -7.505 -2.614
303 H LYS 38 H LYS 38 9.576 -4.083 -5.159
304 HA LYS 38 HA LYS 38 10.395 -4.320 -7.836
305 HB2 LYS 38 1HB LYS 38 8.122 -5.861 -7.269
306 HB3 LYS 38 2HB LYS 38 7.515 -4.424 -8.080
307 HG2 LYS 38 1HG LYS 38 8.287 -5.090 -10.057
308 HG3 LYS 38 2HG LYS 38 9.858 -5.535 -9.389
309 HD2 LYS 38 1HD LYS 38 9.131 -7.604 -10.006
310 HD3 LYS 38 2HD LYS 38 8.435 -7.540 -8.386
311 HE2 LYS 38 1HE LYS 38 6.301 -7.268 -9.166
312 HE3 LYS 38 2HE LYS 38 6.827 -6.467 -10.644
313 HZ1 LYS 38 3HZ LYS 38 7.797 -9.095 -10.663
314 HZ2 LYS 38 1HZ LYS 38 6.667 -8.386 -11.704
315 HZ3 LYS 38 2HZ LYS 38 6.148 -9.152 -10.288
316 H ASP 39 H ASP 39 9.986 -2.454 -9.022
317 HA ASP 39 HA ASP 39 9.389 -0.130 -7.486
318 HB2 ASP 39 1HB ASP 39 9.483 -0.102 -10.482
319 HB3 ASP 39 2HB ASP 39 10.073 1.100 -9.338
320 H ASN 40 H ASN 40 7.452 0.651 -7.023
321 HA ASN 40 HA ASN 40 5.232 1.135 -7.106
322 HB2 ASN 40 1HB ASN 40 5.997 1.059 -9.996
323 HB3 ASN 40 2HB ASN 40 4.290 1.174 -9.576
324 HD21 ASN 40 2HD2 ASN 40 7.148 2.559 -8.019
325 HD22 ASN 40 1HD2 ASN 40 6.651 4.206 -8.179
326 H ASN 41 H ASN 41 5.495 -1.278 -6.216
327 HA ASN 41 HA ASN 41 4.492 -3.417 -7.726
328 HB2 ASN 41 1HB ASN 41 5.363 -2.996 -5.072
329 HB3 ASN 41 2HB ASN 41 3.745 -3.685 -4.961
330 HD21 ASN 41 2HD2 ASN 41 6.461 -4.763 -4.376
331 HD22 ASN 41 1HD2 ASN 41 6.548 -6.246 -5.258
332 H LYS 42 H LYS 42 2.401 -4.510 -6.307
333 HA LYS 42 HA LYS 42 0.202 -2.665 -6.966
334 HB2 LYS 42 1HB LYS 42 0.666 -5.117 -8.038
335 HB3 LYS 42 2HB LYS 42 -0.393 -5.544 -6.700
336 HG2 LYS 42 1HG LYS 42 -2.180 -4.369 -7.562
337 HG3 LYS 42 2HG LYS 42 -1.152 -3.326 -8.548
338 HD2 LYS 42 1HD LYS 42 -1.036 -4.822 -10.246
339 HD3 LYS 42 2HD LYS 42 -1.054 -6.215 -9.162
340 HE2 LYS 42 1HE LYS 42 -3.521 -4.566 -9.407
341 HE3 LYS 42 2HE LYS 42 -3.104 -5.656 -10.729
342 HZ1 LYS 42 3HZ LYS 42 -4.465 -6.347 -8.491
343 HZ2 LYS 42 1HZ LYS 42 -2.898 -6.881 -8.141
344 HZ3 LYS 42 2HZ LYS 42 -3.685 -7.428 -9.534
345 H CYS 43 H CYS 43 -0.694 -1.798 -5.220
346 HA CYS 43 HA CYS 43 -1.148 -3.523 -2.879
347 HB2 CYS 43 1HB CYS 43 0.207 -0.905 -3.044
348 HB3 CYS 43 2HB CYS 43 -0.969 -1.059 -1.743
349 HG CYS 43 HG CYS 43 1.408 -3.458 -2.135
350 H THR 44 H THR 44 -2.802 -2.411 -1.357
351 HA THR 44 HA THR 44 -4.751 -0.704 -2.564
352 HB THR 44 HB THR 44 -6.480 -2.766 -2.037
353 HG1 THR 44 1HG THR 44 -5.456 -4.475 -3.431
354 HG21 THR 44 3HG2 THR 44 -5.964 -2.978 -4.763
355 HG22 THR 44 1HG2 THR 44 -5.485 -1.332 -4.350
356 HG23 THR 44 2HG2 THR 44 -7.119 -1.890 -3.991
357 H VAL 45 H VAL 45 -6.684 -0.431 -1.131
358 HA VAL 45 HA VAL 45 -6.337 -1.308 1.619
359 HB VAL 45 HB VAL 45 -6.261 1.606 0.835
360 HG11 VAL 45 1HG1 VAL 45 -7.306 0.335 3.222
361 HG12 VAL 45 2HG1 VAL 45 -5.993 1.457 3.585
362 HG13 VAL 45 3HG1 VAL 45 -7.412 2.015 2.699
363 HG21 VAL 45 3HG2 VAL 45 -4.164 1.627 2.081
364 HG22 VAL 45 1HG2 VAL 45 -4.353 -0.088 2.445
365 HG23 VAL 45 2HG2 VAL 45 -4.107 0.439 0.780
366 H ASP 46 H ASP 46 -8.251 -1.726 2.515
367 HA ASP 46 HA ASP 46 -10.657 -0.679 1.185
368 HB2 ASP 46 1HB ASP 46 -10.190 -3.169 2.828
369 HB3 ASP 46 2HB ASP 46 -11.800 -2.602 2.394
370 H THR 47 H THR 47 -11.858 0.769 2.212
371 HA THR 47 HA THR 47 -11.195 1.649 4.845
372 HB THR 47 HB THR 47 -13.487 2.941 4.451
373 HG1 THR 47 1HG THR 47 -12.673 2.503 1.773
374 HG21 THR 47 3HG2 THR 47 -10.869 3.471 3.050
375 HG22 THR 47 1HG2 THR 47 -11.395 4.087 4.616
376 HG23 THR 47 2HG2 THR 47 -12.185 4.641 3.140
377 H TYR 48 H TYR 48 -13.179 -0.817 3.661
378 HA TYR 48 HA TYR 48 -15.369 -0.858 5.337
379 HB2 TYR 48 1HB TYR 48 -15.000 -2.454 3.487
380 HB3 TYR 48 2HB TYR 48 -13.746 -3.247 4.433
381 HD1 TYR 48 1HD TYR 48 -17.357 -2.692 4.091
382 HD2 TYR 48 2HD TYR 48 -14.310 -4.699 6.280
383 HE1 TYR 48 1HE TYR 48 -19.057 -4.151 5.108
384 HE2 TYR 48 2HE TYR 48 -16.001 -6.164 7.302
385 HH TYR 48 HH TYR 48 -18.236 -6.959 6.897
386 H ASN 49 H ASN 49 -12.113 -2.130 5.958
387 HA ASN 49 HA ASN 49 -12.594 -1.869 8.820
388 HB2 ASN 49 1HB ASN 49 -11.986 -4.458 7.421
389 HB3 ASN 49 2HB ASN 49 -11.473 -4.197 9.085
390 HD21 ASN 49 2HD2 ASN 49 -13.356 -6.127 8.078
391 HD22 ASN 49 1HD2 ASN 49 -14.863 -5.809 8.861
392 H ASN 50 H ASN 50 -11.000 -0.341 7.055
393 HA ASN 50 HA ASN 50 -8.881 0.442 6.721
394 HB2 ASN 50 1HB ASN 50 -9.417 0.443 9.376
395 HB3 ASN 50 2HB ASN 50 -7.958 -0.543 9.354
396 HD21 ASN 50 2HD2 ASN 50 -6.571 0.618 7.286
397 HD22 ASN 50 1HD2 ASN 50 -6.134 2.231 7.725
398 H ALA 51 H ALA 51 -9.178 -2.027 5.566
399 HA ALA 51 HA ALA 51 -6.983 -3.741 6.349
400 HB1 ALA 51 1HB ALA 51 -9.176 -4.582 5.451
401 HB2 ALA 51 2HB ALA 51 -8.678 -3.974 3.872
402 HB3 ALA 51 3HB ALA 51 -7.739 -5.237 4.668
403 H VAL 52 H VAL 52 -5.158 -4.212 5.079
404 HA VAL 52 HA VAL 52 -4.570 -2.316 2.909
405 HB VAL 52 HB VAL 52 -2.554 -3.096 5.015
406 HG11 VAL 52 1HG1 VAL 52 -1.072 -1.648 3.974
407 HG12 VAL 52 2HG1 VAL 52 -1.898 -2.397 2.607
408 HG13 VAL 52 3HG1 VAL 52 -2.354 -0.777 3.134
409 HG21 VAL 52 3HG2 VAL 52 -3.889 -1.734 6.280
410 HG22 VAL 52 1HG2 VAL 52 -2.857 -0.525 5.517
411 HG23 VAL 52 2HG2 VAL 52 -4.476 -0.827 4.886
412 H ASP 53 H ASP 53 -4.451 -3.587 1.170
413 HA ASP 53 HA ASP 53 -3.460 -6.291 1.323
414 HB2 ASP 53 1HB ASP 53 -4.976 -4.696 -0.562
415 HB3 ASP 53 2HB ASP 53 -3.692 -5.586 -1.376
416 H CYS 54 H CYS 54 -1.675 -7.110 0.108
417 HA CYS 54 HA CYS 54 0.316 -5.116 -0.712
418 HB2 CYS 54 1HB CYS 54 1.364 -7.497 0.706
419 HB3 CYS 54 2HB CYS 54 1.944 -5.837 0.712
420 HG CYS 54 HG CYS 54 -0.425 -5.119 2.348
421 H ASP 55 H ASP 55 1.499 -5.662 -2.473
422 HA ASP 55 HA ASP 55 0.596 -7.549 -4.274
423 HB2 ASP 55 1HB ASP 55 2.205 -5.578 -4.647
424 HB3 ASP 55 2HB ASP 55 3.482 -6.697 -4.176
Start of MODEL 14
1 H1 ALA 1 H ALA 1 -16.649 0.343 1.388
2 HA ALA 1 HA ALA 1 -15.864 0.334 -1.423
3 HB1 ALA 1 1HB ALA 1 -16.551 2.352 0.394
4 HB2 ALA 1 2HB ALA 1 -14.834 2.571 0.053
5 HB3 ALA 1 3HB ALA 1 -16.000 2.544 -1.270
6 H LYS 2 H LYS 2 -13.602 0.981 -1.952
7 HA LYS 2 HA LYS 2 -11.546 0.412 -0.020
8 HB2 LYS 2 1HB LYS 2 -10.580 -1.500 -1.171
9 HB3 LYS 2 2HB LYS 2 -12.228 -1.864 -0.676
10 HG2 LYS 2 1HG LYS 2 -11.669 -0.853 -3.432
11 HG3 LYS 2 2HG LYS 2 -11.427 -2.555 -3.031
12 HD2 LYS 2 1HD LYS 2 -13.890 -2.094 -1.968
13 HD3 LYS 2 2HD LYS 2 -13.911 -1.027 -3.375
14 HE2 LYS 2 1HE LYS 2 -13.233 -2.938 -4.787
15 HE3 LYS 2 2HE LYS 2 -13.313 -3.985 -3.370
16 HZ1 LYS 2 3HZ LYS 2 -15.710 -3.116 -3.199
17 HZ2 LYS 2 1HZ LYS 2 -15.357 -4.286 -4.371
18 HZ3 LYS 2 2HZ LYS 2 -15.514 -2.661 -4.817
19 H TYR 3 H TYR 3 -9.332 0.360 -1.201
20 HA TYR 3 HA TYR 3 -9.395 2.204 -3.494
21 HB2 TYR 3 1HB TYR 3 -7.511 2.384 -1.134
22 HB3 TYR 3 2HB TYR 3 -7.494 3.429 -2.549
23 HD1 TYR 3 2HD TYR 3 -9.568 2.422 0.362
24 HD2 TYR 3 1HD TYR 3 -8.835 5.355 -2.631
25 HE1 TYR 3 2HE TYR 3 -11.146 3.945 1.477
26 HE2 TYR 3 1HE TYR 3 -10.410 6.886 -1.524
27 HH TYR 3 HH TYR 3 -11.821 6.131 1.594
28 H THR 4 H THR 4 -7.265 2.290 -4.646
29 HA THR 4 HA THR 4 -5.645 -0.123 -4.384
30 HB THR 4 HB THR 4 -7.458 -0.708 -5.977
31 HG1 THR 4 1HG THR 4 -5.064 -0.479 -7.459
32 HG21 THR 4 3HG2 THR 4 -7.556 0.347 -8.157
33 HG22 THR 4 1HG2 THR 4 -6.235 1.431 -7.722
34 HG23 THR 4 2HG2 THR 4 -7.790 1.564 -6.901
35 H GLY 5 H GLY 5 -3.542 0.229 -4.827
36 HA2 GLY 5 1HA GLY 5 -2.764 2.457 -6.540
37 HA3 GLY 5 2HA GLY 5 -2.268 2.558 -4.857
38 H LYS 6 H LYS 6 -0.106 2.313 -5.016
39 HA LYS 6 HA LYS 6 0.854 -0.304 -5.881
40 HB2 LYS 6 1HB LYS 6 2.445 2.078 -6.733
41 HB3 LYS 6 2HB LYS 6 2.408 0.457 -7.416
42 HG2 LYS 6 1HG LYS 6 0.098 0.963 -8.249
43 HG3 LYS 6 2HG LYS 6 0.359 2.634 -7.742
44 HD2 LYS 6 1HD LYS 6 2.397 1.331 -9.481
45 HD3 LYS 6 2HD LYS 6 0.877 1.858 -10.207
46 HE2 LYS 6 1HE LYS 6 2.662 3.629 -8.545
47 HE3 LYS 6 2HE LYS 6 2.720 3.545 -10.305
48 HZ1 LYS 6 3HZ LYS 6 0.083 3.993 -9.225
49 HZ2 LYS 6 1HZ LYS 6 0.880 4.774 -10.498
50 HZ3 LYS 6 2HZ LYS 6 1.178 5.241 -8.900
51 H CYS 7 H CYS 7 3.242 -0.548 -5.293
52 HA CYS 7 HA CYS 7 3.928 1.006 -2.901
53 HB2 CYS 7 1HB CYS 7 4.739 -1.240 -1.918
54 HB3 CYS 7 2HB CYS 7 3.015 -0.891 -1.877
55 HG CYS 7 HG CYS 7 2.784 -2.387 -4.444
56 H THR 8 H THR 8 6.150 1.100 -2.413
57 HA THR 8 HA THR 8 7.852 0.732 -4.742
58 HB THR 8 HB THR 8 9.391 1.748 -2.612
59 HG1 THR 8 1HG THR 8 8.120 3.369 -1.771
60 HG21 THR 8 3HG2 THR 8 8.661 3.938 -4.093
61 HG22 THR 8 1HG2 THR 8 8.364 2.608 -5.212
62 HG23 THR 8 2HG2 THR 8 9.964 2.822 -4.499
63 H LYS 9 H LYS 9 9.765 -0.458 -4.760
64 HA LYS 9 HA LYS 9 9.755 -2.928 -3.492
65 HB2 LYS 9 1HB LYS 9 11.647 -1.388 -5.129
66 HB3 LYS 9 2HB LYS 9 12.413 -2.545 -4.048
67 HG2 LYS 9 1HG LYS 9 10.669 -4.208 -5.015
68 HG3 LYS 9 2HG LYS 9 10.545 -3.031 -6.324
69 HD2 LYS 9 1HD LYS 9 13.259 -3.891 -5.462
70 HD3 LYS 9 2HD LYS 9 12.285 -5.025 -6.401
71 HE2 LYS 9 1HE LYS 9 12.708 -3.914 -8.279
72 HE3 LYS 9 2HE LYS 9 12.146 -2.404 -7.565
73 HZ1 LYS 9 3HZ LYS 9 14.863 -3.449 -7.802
74 HZ2 LYS 9 1HZ LYS 9 14.499 -2.540 -6.423
75 HZ3 LYS 9 2HZ LYS 9 14.298 -1.863 -7.959
76 H SER 10 H SER 10 12.333 -0.548 -2.910
77 HA SER 10 HA SER 10 13.127 -1.631 -0.460
78 HB2 SER 10 1HB SER 10 14.504 0.295 -0.202
79 HB3 SER 10 2HB SER 10 14.415 -0.005 -1.938
80 HG SER 10 HG SER 10 13.672 2.176 -0.564
81 H LYS 11 H LYS 11 10.719 0.799 -1.235
82 HA LYS 11 HA LYS 11 10.094 1.078 1.626
83 HB2 LYS 11 1HB LYS 11 10.137 2.943 -0.603
84 HB3 LYS 11 2HB LYS 11 8.591 2.965 0.235
85 HG2 LYS 11 1HG LYS 11 9.469 4.235 1.815
86 HG3 LYS 11 2HG LYS 11 10.626 2.959 2.201
87 HD2 LYS 11 1HD LYS 11 11.735 4.020 -0.041
88 HD3 LYS 11 2HD LYS 11 10.987 5.448 0.679
89 HE2 LYS 11 1HE LYS 11 12.122 4.448 2.867
90 HE3 LYS 11 2HE LYS 11 13.215 3.755 1.670
91 HZ1 LYS 11 3HZ LYS 11 12.578 6.594 1.423
92 HZ2 LYS 11 1HZ LYS 11 14.023 5.777 1.097
93 HZ3 LYS 11 2HZ LYS 11 13.598 6.138 2.693
94 H ASN 12 H ASN 12 8.810 -0.720 1.930
95 HA ASN 12 HA ASN 12 6.631 -1.325 0.150
96 HB2 ASN 12 1HB ASN 12 7.745 -3.155 1.277
97 HB3 ASN 12 2HB ASN 12 7.397 -2.448 2.852
98 HD21 ASN 12 2HD2 ASN 12 6.173 -4.037 3.698
99 HD22 ASN 12 1HD2 ASN 12 4.654 -4.545 3.051
100 H GLU 13 H GLU 13 5.721 0.901 0.370
101 HA GLU 13 HA GLU 13 3.737 0.915 2.529
102 HB2 GLU 13 1HB GLU 13 4.106 3.164 3.105
103 HB3 GLU 13 2HB GLU 13 5.715 2.463 3.006
104 HG2 GLU 13 1HG GLU 13 5.366 3.364 0.468
105 HG3 GLU 13 2HG GLU 13 4.473 4.567 1.398
106 H CYS 14 H CYS 14 1.744 1.739 1.981
107 HA CYS 14 HA CYS 14 1.231 1.955 -0.865
108 HB2 CYS 14 1HB CYS 14 -0.259 0.593 0.522
109 HB3 CYS 14 2HB CYS 14 -0.662 2.002 1.495
110 HG CYS 14 HG CYS 14 -2.804 2.377 0.130
111 H LYS 15 H LYS 15 1.325 3.835 -1.879
112 HA LYS 15 HA LYS 15 0.867 6.305 -0.354
113 HB2 LYS 15 1HB LYS 15 2.019 7.432 -2.243
114 HB3 LYS 15 2HB LYS 15 3.023 6.233 -1.440
115 HG2 LYS 15 1HG LYS 15 1.509 5.183 -3.709
116 HG3 LYS 15 2HG LYS 15 2.669 6.444 -4.130
117 HD2 LYS 15 1HD LYS 15 4.336 5.104 -2.707
118 HD3 LYS 15 2HD LYS 15 3.167 3.786 -2.825
119 HE2 LYS 15 1HE LYS 15 4.644 3.406 -4.595
120 HE3 LYS 15 2HE LYS 15 3.254 4.183 -5.351
121 HZ1 LYS 15 3HZ LYS 15 5.107 5.261 -6.237
122 HZ2 LYS 15 1HZ LYS 15 5.902 5.350 -4.745
123 HZ3 LYS 15 2HZ LYS 15 4.553 6.326 -5.044
124 H TYR 16 H TYR 16 -1.477 5.340 -0.696
125 HA TYR 16 HA TYR 16 -2.600 6.110 -3.272
126 HB2 TYR 16 1HB TYR 16 -4.544 4.958 -2.643
127 HB3 TYR 16 2HB TYR 16 -3.243 3.999 -1.947
128 HD1 TYR 16 2HD TYR 16 -2.669 4.435 0.530
129 HD2 TYR 16 1HD TYR 16 -6.293 5.713 -1.298
130 HE1 TYR 16 2HE TYR 16 -3.716 4.616 2.748
131 HE2 TYR 16 1HE TYR 16 -7.350 5.900 0.916
132 HH TYR 16 HH TYR 16 -6.739 4.605 3.361
133 H LYS 17 H LYS 17 -5.053 7.034 -2.716
134 HA LYS 17 HA LYS 17 -4.626 9.436 -1.066
135 HB2 LYS 17 1HB LYS 17 -6.047 9.314 -3.733
136 HB3 LYS 17 2HB LYS 17 -5.897 10.741 -2.715
137 HG2 LYS 17 1HG LYS 17 -3.492 10.737 -3.015
138 HG3 LYS 17 2HG LYS 17 -3.596 9.257 -3.972
139 HD2 LYS 17 1HD LYS 17 -5.289 10.734 -5.382
140 HD3 LYS 17 2HD LYS 17 -4.335 12.048 -4.687
141 HE2 LYS 17 1HE LYS 17 -3.022 11.688 -6.483
142 HE3 LYS 17 2HE LYS 17 -2.362 10.395 -5.484
143 HZ1 LYS 17 3HZ LYS 17 -4.387 10.165 -7.636
144 HZ2 LYS 17 1HZ LYS 17 -4.064 8.915 -6.542
145 HZ3 LYS 17 2HZ LYS 17 -2.848 9.464 -7.581
146 H ASN 18 H ASN 18 -6.129 9.753 0.439
147 HA ASN 18 HA ASN 18 -8.693 8.327 0.162
148 HB2 ASN 18 1HB ASN 18 -8.707 7.851 2.428
149 HB3 ASN 18 2HB ASN 18 -6.985 7.755 2.072
150 HD21 ASN 18 2HD2 ASN 18 -5.826 9.914 2.307
151 HD22 ASN 18 1HD2 ASN 18 -6.216 10.833 3.716
152 H ASP 19 H ASP 19 -10.488 9.371 1.471
153 HA ASP 19 HA ASP 19 -11.834 11.145 1.963
154 HB2 ASP 19 1HB ASP 19 -9.645 11.976 3.078
155 HB3 ASP 19 2HB ASP 19 -9.509 13.028 1.671
156 H ALA 20 H ALA 20 -9.419 12.634 -0.195
157 HA ALA 20 HA ALA 20 -10.917 12.463 -2.552
158 HB1 ALA 20 1HB ALA 20 -12.576 13.861 -1.644
159 HB2 ALA 20 2HB ALA 20 -11.386 14.956 -0.940
160 HB3 ALA 20 3HB ALA 20 -11.608 14.903 -2.689
161 H GLY 21 H GLY 21 -8.221 12.221 -1.784
162 HA2 GLY 21 1HA GLY 21 -6.515 12.813 -3.501
163 HA3 GLY 21 2HA GLY 21 -7.002 14.482 -3.247
164 H LYS 22 H LYS 22 -7.075 12.815 -0.349
165 HA LYS 22 HA LYS 22 -4.759 14.228 0.617
166 HB2 LYS 22 1HB LYS 22 -7.101 13.001 1.752
167 HB3 LYS 22 2HB LYS 22 -5.666 12.422 2.588
168 HG2 LYS 22 1HG LYS 22 -5.788 15.326 2.118
169 HG3 LYS 22 2HG LYS 22 -6.980 14.671 3.244
170 HD2 LYS 22 1HD LYS 22 -4.250 13.662 3.626
171 HD3 LYS 22 2HD LYS 22 -4.440 15.394 3.911
172 HE2 LYS 22 1HE LYS 22 -6.610 14.419 5.206
173 HE3 LYS 22 2HE LYS 22 -5.471 13.093 5.431
174 HZ1 LYS 22 3HZ LYS 22 -3.955 14.506 6.511
175 HZ2 LYS 22 1HZ LYS 22 -5.462 14.874 7.186
176 HZ3 LYS 22 2HZ LYS 22 -4.775 15.907 6.036
177 H ASP 23 H ASP 23 -2.808 13.445 0.136
178 HA ASP 23 HA ASP 23 -2.178 10.824 -0.548
179 HB2 ASP 23 1HB ASP 23 0.159 11.452 -0.196
180 HB3 ASP 23 2HB ASP 23 -0.712 12.746 -1.015
181 H THR 24 H THR 24 -1.853 9.009 0.570
182 HA THR 24 HA THR 24 -1.465 9.203 3.482
183 HB THR 24 HB THR 24 -3.253 7.237 2.037
184 HG1 THR 24 1HG THR 24 -3.923 9.152 4.035
185 HG21 THR 24 3HG2 THR 24 -3.779 6.366 4.268
186 HG22 THR 24 1HG2 THR 24 -2.583 7.452 4.976
187 HG23 THR 24 2HG2 THR 24 -2.069 6.162 3.888
188 H PHE 25 H PHE 25 0.169 8.030 4.275
189 HA PHE 25 HA PHE 25 1.288 5.882 2.604
190 HB2 PHE 25 1HB PHE 25 2.880 7.913 4.184
191 HB3 PHE 25 2HB PHE 25 3.548 6.576 3.253
192 HD1 PHE 25 1HD PHE 25 1.659 9.742 2.980
193 HD2 PHE 25 2HD PHE 25 3.943 6.780 0.950
194 HE1 PHE 25 1HE PHE 25 1.750 11.183 0.987
195 HE2 PHE 25 2HE PHE 25 4.039 8.216 -1.045
196 HZ PHE 25 HZ PHE 25 2.942 10.421 -1.029
197 H ILE 26 H ILE 26 1.203 4.009 3.636
198 HA ILE 26 HA ILE 26 1.907 3.875 6.460
199 HB ILE 26 HB ILE 26 -0.466 4.097 6.642
200 HG12 ILE 26 1HG1 ILE 26 0.133 1.138 6.803
201 HG13 ILE 26 2HG1 ILE 26 0.690 2.311 7.992
202 HG21 ILE 26 1HG2 ILE 26 -1.786 3.567 4.940
203 HG22 ILE 26 2HG2 ILE 26 -0.469 2.701 4.151
204 HG23 ILE 26 3HG2 ILE 26 -1.518 1.860 5.291
205 HD11 ILE 26 3HD1 ILE 26 -1.933 2.881 7.972
206 HD12 ILE 26 1HD1 ILE 26 -1.984 1.166 7.566
207 HD13 ILE 26 2HD1 ILE 26 -1.192 1.700 9.050
208 H LYS 27 H LYS 27 3.555 2.492 6.396
209 HA LYS 27 HA LYS 27 4.130 0.612 4.464
210 HB2 LYS 27 1HB LYS 27 5.477 -0.526 6.318
211 HB3 LYS 27 2HB LYS 27 5.860 1.152 5.961
212 HG2 LYS 27 1HG LYS 27 3.827 0.813 8.035
213 HG3 LYS 27 2HG LYS 27 5.404 0.133 8.444
214 HD2 LYS 27 1HD LYS 27 6.394 2.165 8.555
215 HD3 LYS 27 2HD LYS 27 5.439 2.819 7.223
216 HE2 LYS 27 1HE LYS 27 3.682 2.307 9.390
217 HE3 LYS 27 2HE LYS 27 5.077 3.177 10.022
218 HZ1 LYS 27 3HZ LYS 27 4.343 5.040 9.110
219 HZ2 LYS 27 1HZ LYS 27 2.924 4.238 8.656
220 HZ3 LYS 27 2HZ LYS 27 4.227 4.325 7.580
221 H CYS 28 H CYS 28 3.444 -1.383 3.972
222 HA CYS 28 HA CYS 28 1.122 -2.431 5.269
223 HB2 CYS 28 1HB CYS 28 2.833 -3.883 3.255
224 HB3 CYS 28 2HB CYS 28 1.117 -4.101 3.575
225 HG CYS 28 HG CYS 28 1.316 -1.026 2.742
226 HA PRO 29 HA PRO 29 2.908 -5.124 8.238
227 HB2 PRO 29 1HB PRO 29 1.098 -7.147 8.252
228 HB3 PRO 29 2HB PRO 29 0.766 -5.558 8.949
229 HG2 PRO 29 1HG PRO 29 -0.035 -6.662 6.284
230 HG3 PRO 29 2HG PRO 29 -0.992 -5.712 7.435
231 HD2 PRO 29 1HD PRO 29 0.158 -4.617 5.242
232 HD3 PRO 29 2HD PRO 29 -0.058 -3.717 6.757
233 H LYS 30 H LYS 30 4.546 -5.422 6.272
234 HA LYS 30 HA LYS 30 4.846 -8.314 5.968
235 HB2 LYS 30 1HB LYS 30 5.036 -6.350 3.677
236 HB3 LYS 30 2HB LYS 30 5.499 -8.045 3.591
237 HG2 LYS 30 1HG LYS 30 3.410 -8.212 2.739
238 HG3 LYS 30 2HG LYS 30 3.008 -8.370 4.450
239 HD2 LYS 30 1HD LYS 30 2.548 -5.948 4.536
240 HD3 LYS 30 2HD LYS 30 2.888 -5.840 2.807
241 HE2 LYS 30 1HE LYS 30 0.458 -5.977 3.393
242 HE3 LYS 30 2HE LYS 30 1.019 -7.221 2.277
243 HZ1 LYS 30 3HZ LYS 30 0.558 -8.831 3.733
244 HZ2 LYS 30 1HZ LYS 30 -0.394 -7.680 4.527
245 HZ3 LYS 30 2HZ LYS 30 1.186 -7.978 5.051
246 H PHE 31 H PHE 31 6.191 -6.766 7.781
247 HA PHE 31 HA PHE 31 8.714 -5.888 6.716
248 HB2 PHE 31 1HB PHE 31 8.071 -6.407 9.618
249 HB3 PHE 31 2HB PHE 31 9.289 -5.321 8.957
250 HD1 PHE 31 2HD PHE 31 8.651 -3.175 7.994
251 HD2 PHE 31 1HD PHE 31 5.765 -5.766 9.749
252 HE1 PHE 31 2HE PHE 31 7.043 -1.316 8.086
253 HE2 PHE 31 1HE PHE 31 4.151 -3.910 9.842
254 HZ PHE 31 HZ PHE 31 4.790 -1.681 9.011
255 H ASP 32 H ASP 32 10.360 -7.159 6.220
256 HA ASP 32 HA ASP 32 11.824 -8.901 6.186
257 HB2 ASP 32 1HB ASP 32 11.274 -8.463 8.893
258 HB3 ASP 32 2HB ASP 32 11.111 -10.204 8.676
259 H ASN 33 H ASN 33 8.786 -9.161 5.627
260 HA ASN 33 HA ASN 33 8.824 -12.093 5.367
261 HB2 ASN 33 1HB ASN 33 6.841 -10.384 6.661
262 HB3 ASN 33 2HB ASN 33 6.137 -11.424 5.425
263 HD21 ASN 33 2HD2 ASN 33 7.401 -11.230 8.570
264 HD22 ASN 33 1HD2 ASN 33 7.287 -12.907 8.975
265 H LYS 34 H LYS 34 7.773 -9.001 4.070
266 HA LYS 34 HA LYS 34 8.146 -9.779 1.394
267 HB2 LYS 34 1HB LYS 34 5.934 -10.974 2.169
268 HB3 LYS 34 2HB LYS 34 5.228 -9.382 1.926
269 HG2 LYS 34 1HG LYS 34 5.425 -9.483 -0.328
270 HG3 LYS 34 2HG LYS 34 6.901 -10.450 -0.267
271 HD2 LYS 34 1HD LYS 34 4.239 -11.583 0.540
272 HD3 LYS 34 2HD LYS 34 4.768 -11.571 -1.144
273 HE2 LYS 34 1HE LYS 34 6.785 -12.816 -0.504
274 HE3 LYS 34 2HE LYS 34 6.228 -12.845 1.168
275 HZ1 LYS 34 3HZ LYS 34 4.414 -13.879 -0.873
276 HZ2 LYS 34 1HZ LYS 34 4.659 -14.397 0.719
277 HZ3 LYS 34 2HZ LYS 34 5.764 -14.822 -0.489
278 H LYS 35 H LYS 35 9.223 -7.687 2.265
279 HA LYS 35 HA LYS 35 7.571 -5.336 2.310
280 HB2 LYS 35 1HB LYS 35 10.524 -5.853 2.425
281 HB3 LYS 35 2HB LYS 35 9.924 -4.220 2.167
282 HG2 LYS 35 1HG LYS 35 8.459 -4.774 4.276
283 HG3 LYS 35 2HG LYS 35 9.738 -5.954 4.574
284 HD2 LYS 35 1HD LYS 35 10.468 -4.054 5.711
285 HD3 LYS 35 2HD LYS 35 11.352 -3.986 4.185
286 HE2 LYS 35 1HE LYS 35 9.835 -2.354 3.308
287 HE3 LYS 35 2HE LYS 35 8.761 -2.534 4.695
288 HZ1 LYS 35 3HZ LYS 35 10.348 -0.549 4.644
289 HZ2 LYS 35 1HZ LYS 35 11.559 -1.661 5.044
290 HZ3 LYS 35 2HZ LYS 35 10.241 -1.435 6.081
291 H CYS 36 H CYS 36 6.759 -6.285 0.067
292 HA CYS 36 HA CYS 36 6.457 -5.843 -2.143
293 HB2 CYS 36 1HB CYS 36 6.745 -3.473 -1.322
294 HB3 CYS 36 2HB CYS 36 8.439 -3.591 -1.784
295 HG CYS 36 HG CYS 36 6.380 -2.276 -3.601
296 H THR 37 H THR 37 7.431 -6.158 -4.209
297 HA THR 37 HA THR 37 10.276 -6.768 -4.290
298 HB THR 37 HB THR 37 9.800 -8.998 -5.390
299 HG1 THR 37 1HG THR 37 7.701 -9.188 -5.776
300 HG21 THR 37 3HG2 THR 37 10.011 -10.120 -3.395
301 HG22 THR 37 1HG2 THR 37 8.806 -9.122 -2.580
302 HG23 THR 37 2HG2 THR 37 10.423 -8.484 -2.882
303 H LYS 38 H LYS 38 8.792 -4.711 -5.514
304 HA LYS 38 HA LYS 38 9.714 -4.821 -8.135
305 HB2 LYS 38 1HB LYS 38 7.410 -6.361 -7.865
306 HB3 LYS 38 2HB LYS 38 6.835 -4.845 -8.546
307 HG2 LYS 38 1HG LYS 38 8.919 -5.237 -10.153
308 HG3 LYS 38 2HG LYS 38 8.585 -6.918 -9.726
309 HD2 LYS 38 1HD LYS 38 6.083 -5.861 -10.260
310 HD3 LYS 38 2HD LYS 38 7.123 -5.114 -11.475
311 HE2 LYS 38 1HE LYS 38 6.385 -7.099 -12.473
312 HE3 LYS 38 2HE LYS 38 8.012 -7.470 -11.904
313 HZ1 LYS 38 3HZ LYS 38 5.867 -8.984 -11.407
314 HZ2 LYS 38 1HZ LYS 38 5.890 -8.024 -10.014
315 HZ3 LYS 38 2HZ LYS 38 7.244 -8.950 -10.424
316 H ASP 39 H ASP 39 9.860 -2.786 -8.840
317 HA ASP 39 HA ASP 39 9.151 -0.587 -7.344
318 HB2 ASP 39 1HB ASP 39 10.690 -0.017 -8.941
319 HB3 ASP 39 2HB ASP 39 9.928 -1.007 -10.183
320 H ASN 40 H ASN 40 7.288 0.363 -6.878
321 HA ASN 40 HA ASN 40 5.054 0.826 -6.851
322 HB2 ASN 40 1HB ASN 40 5.038 0.914 -9.839
323 HB3 ASN 40 2HB ASN 40 4.315 2.028 -8.683
324 HD21 ASN 40 2HD2 ASN 40 6.462 2.595 -7.073
325 HD22 ASN 40 1HD2 ASN 40 7.657 3.447 -7.986
326 H ASN 41 H ASN 41 5.316 -1.780 -6.493
327 HA ASN 41 HA ASN 41 4.175 -3.506 -8.380
328 HB2 ASN 41 1HB ASN 41 5.161 -3.708 -5.752
329 HB3 ASN 41 2HB ASN 41 3.510 -4.316 -5.691
330 HD21 ASN 41 2HD2 ASN 41 5.856 -5.844 -5.291
331 HD22 ASN 41 1HD2 ASN 41 5.930 -7.032 -6.543
332 H LYS 42 H LYS 42 2.080 -4.816 -7.247
333 HA LYS 42 HA LYS 42 -0.066 -2.823 -7.463
334 HB2 LYS 42 1HB LYS 42 0.314 -5.249 -8.761
335 HB3 LYS 42 2HB LYS 42 -0.899 -5.614 -7.541
336 HG2 LYS 42 1HG LYS 42 -2.486 -4.382 -8.555
337 HG3 LYS 42 2HG LYS 42 -1.342 -3.145 -9.081
338 HD2 LYS 42 1HD LYS 42 -0.596 -4.527 -10.899
339 HD3 LYS 42 2HD LYS 42 -1.556 -5.889 -10.315
340 HE2 LYS 42 1HE LYS 42 -3.554 -4.929 -10.980
341 HE3 LYS 42 2HE LYS 42 -2.890 -3.296 -10.975
342 HZ1 LYS 42 3HZ LYS 42 -1.659 -3.786 -12.957
343 HZ2 LYS 42 1HZ LYS 42 -3.282 -4.181 -13.222
344 HZ3 LYS 42 2HZ LYS 42 -2.151 -5.404 -12.932
345 H CYS 43 H CYS 43 -0.807 -2.152 -5.560
346 HA CYS 43 HA CYS 43 -1.156 -4.148 -3.420
347 HB2 CYS 43 1HB CYS 43 -0.668 -2.489 -1.782
348 HB3 CYS 43 2HB CYS 43 0.595 -2.371 -3.001
349 HG CYS 43 HG CYS 43 0.172 0.219 -2.412
350 H THR 44 H THR 44 -2.679 -2.741 -1.667
351 HA THR 44 HA THR 44 -4.877 -1.392 -2.858
352 HB THR 44 HB THR 44 -6.279 -3.596 -1.845
353 HG1 THR 44 1HG THR 44 -4.548 -4.580 -3.840
354 HG21 THR 44 3HG2 THR 44 -6.578 -3.902 -4.487
355 HG22 THR 44 1HG2 THR 44 -5.847 -2.297 -4.474
356 HG23 THR 44 2HG2 THR 44 -7.343 -2.593 -3.587
357 H VAL 45 H VAL 45 -6.559 -0.864 -1.304
358 HA VAL 45 HA VAL 45 -6.045 -1.510 1.482
359 HB VAL 45 HB VAL 45 -5.960 1.342 0.488
360 HG11 VAL 45 1HG1 VAL 45 -7.052 1.569 2.499
361 HG12 VAL 45 2HG1 VAL 45 -6.265 0.157 3.209
362 HG13 VAL 45 3HG1 VAL 45 -5.368 1.664 3.015
363 HG21 VAL 45 3HG2 VAL 45 -3.692 1.298 1.564
364 HG22 VAL 45 1HG2 VAL 45 -3.871 -0.451 1.711
365 HG23 VAL 45 2HG2 VAL 45 -3.848 0.303 0.116
366 H ASP 46 H ASP 46 -8.028 -2.316 1.875
367 HA ASP 46 HA ASP 46 -10.404 -0.975 0.889
368 HB2 ASP 46 1HB ASP 46 -10.778 -3.238 0.776
369 HB3 ASP 46 2HB ASP 46 -9.816 -3.578 2.213
370 H THR 47 H THR 47 -11.910 0.093 2.111
371 HA THR 47 HA THR 47 -10.984 1.066 4.689
372 HB THR 47 HB THR 47 -13.459 2.228 4.227
373 HG1 THR 47 1HG THR 47 -13.117 2.938 1.967
374 HG21 THR 47 3HG2 THR 47 -12.157 4.221 3.638
375 HG22 THR 47 1HG2 THR 47 -10.728 3.218 3.400
376 HG23 THR 47 2HG2 THR 47 -11.442 3.369 5.005
377 H TYR 48 H TYR 48 -13.237 -1.200 3.427
378 HA TYR 48 HA TYR 48 -15.271 -1.287 5.256
379 HB2 TYR 48 1HB TYR 48 -14.992 -2.776 3.252
380 HB3 TYR 48 2HB TYR 48 -13.860 -3.740 4.194
381 HD1 TYR 48 1HD TYR 48 -14.764 -4.663 6.462
382 HD2 TYR 48 2HD TYR 48 -17.248 -3.320 3.278
383 HE1 TYR 48 1HE TYR 48 -16.634 -5.975 7.374
384 HE2 TYR 48 2HE TYR 48 -19.124 -4.627 4.183
385 HH TYR 48 HH TYR 48 -19.854 -5.611 6.255
386 H ASN 49 H ASN 49 -12.065 -2.783 5.575
387 HA ASN 49 HA ASN 49 -12.252 -2.584 8.458
388 HB2 ASN 49 1HB ASN 49 -13.307 -4.788 7.871
389 HB3 ASN 49 2HB ASN 49 -11.760 -5.285 7.190
390 HD21 ASN 49 2HD2 ASN 49 -10.456 -6.347 8.487
391 HD22 ASN 49 1HD2 ASN 49 -10.496 -6.322 10.213
392 H ASN 50 H ASN 50 -10.611 -1.306 6.545
393 HA ASN 50 HA ASN 50 -8.435 -0.878 5.996
394 HB2 ASN 50 1HB ASN 50 -8.668 -0.640 8.611
395 HB3 ASN 50 2HB ASN 50 -7.602 -2.041 8.624
396 HD21 ASN 50 2HD2 ASN 50 -7.790 0.881 6.621
397 HD22 ASN 50 1HD2 ASN 50 -6.151 1.365 6.875
398 H ALA 51 H ALA 51 -8.722 -2.781 4.468
399 HA ALA 51 HA ALA 51 -7.050 -5.072 5.200
400 HB1 ALA 51 1HB ALA 51 -8.268 -5.156 2.559
401 HB2 ALA 51 2HB ALA 51 -8.354 -6.316 3.885
402 HB3 ALA 51 3HB ALA 51 -9.445 -4.931 3.852
403 H VAL 52 H VAL 52 -4.951 -4.592 4.891
404 HA VAL 52 HA VAL 52 -4.146 -3.142 2.477
405 HB VAL 52 HB VAL 52 -2.384 -3.995 4.774
406 HG11 VAL 52 1HG1 VAL 52 -0.704 -2.991 3.702
407 HG12 VAL 52 2HG1 VAL 52 -1.740 -3.027 2.274
408 HG13 VAL 52 3HG1 VAL 52 -1.693 -1.589 3.296
409 HG21 VAL 52 3HG2 VAL 52 -4.200 -1.657 4.465
410 HG22 VAL 52 1HG2 VAL 52 -3.789 -2.586 5.906
411 HG23 VAL 52 2HG2 VAL 52 -2.642 -1.414 5.255
412 H ASP 53 H ASP 53 -3.169 -4.097 0.805
413 HA ASP 53 HA ASP 53 -2.098 -6.814 1.160
414 HB2 ASP 53 1HB ASP 53 -3.984 -5.828 -0.974
415 HB3 ASP 53 2HB ASP 53 -2.976 -7.252 -1.211
416 H CYS 54 H CYS 54 -0.688 -7.462 -0.723
417 HA CYS 54 HA CYS 54 0.552 -5.276 -2.168
418 HB2 CYS 54 1HB CYS 54 2.752 -5.562 -1.289
419 HB3 CYS 54 2HB CYS 54 1.677 -5.368 0.089
420 HG CYS 54 HG CYS 54 3.708 -7.284 0.616
421 H ASP 55 H ASP 55 2.290 -6.090 -3.646
422 HA ASP 55 HA ASP 55 1.558 -8.769 -4.617
423 HB2 ASP 55 1HB ASP 55 1.684 -6.307 -5.948
424 HB3 ASP 55 2HB ASP 55 3.101 -7.198 -6.495
Start of MODEL 15
1 H1 ALA 1 H ALA 1 -16.059 0.082 1.316
2 HA ALA 1 HA ALA 1 -15.342 0.073 -1.529
3 HB1 ALA 1 1HB ALA 1 -16.199 2.103 0.272
4 HB2 ALA 1 2HB ALA 1 -14.583 2.508 -0.307
5 HB3 ALA 1 3HB ALA 1 -15.887 2.221 -1.459
6 H LYS 2 H LYS 2 -13.229 0.326 -2.227
7 HA LYS 2 HA LYS 2 -11.103 0.363 -0.221
8 HB2 LYS 2 1HB LYS 2 -10.002 -1.491 -1.738
9 HB3 LYS 2 2HB LYS 2 -11.104 -1.926 -0.439
10 HG2 LYS 2 1HG LYS 2 -12.676 -2.693 -1.849
11 HG3 LYS 2 2HG LYS 2 -12.367 -1.435 -3.048
12 HD2 LYS 2 1HD LYS 2 -10.266 -2.640 -3.660
13 HD3 LYS 2 2HD LYS 2 -10.760 -3.945 -2.579
14 HE2 LYS 2 1HE LYS 2 -12.864 -4.145 -3.907
15 HE3 LYS 2 2HE LYS 2 -12.202 -2.968 -5.041
16 HZ1 LYS 2 3HZ LYS 2 -11.692 -5.754 -4.852
17 HZ2 LYS 2 1HZ LYS 2 -10.248 -4.880 -4.735
18 HZ3 LYS 2 2HZ LYS 2 -11.258 -4.669 -6.075
19 H TYR 3 H TYR 3 -8.922 0.601 -1.277
20 HA TYR 3 HA TYR 3 -9.158 2.207 -3.738
21 HB2 TYR 3 1HB TYR 3 -7.351 2.635 -1.353
22 HB3 TYR 3 2HB TYR 3 -7.200 3.512 -2.871
23 HD1 TYR 3 2HD TYR 3 -9.483 2.881 -0.018
24 HD2 TYR 3 1HD TYR 3 -8.542 5.397 -3.318
25 HE1 TYR 3 2HE TYR 3 -11.125 4.529 0.779
26 HE2 TYR 3 1HE TYR 3 -10.181 7.053 -2.529
27 HH TYR 3 HH TYR 3 -11.624 6.877 0.574
28 H THR 4 H THR 4 -7.548 2.011 -5.284
29 HA THR 4 HA THR 4 -5.777 -0.319 -4.944
30 HB THR 4 HB THR 4 -6.692 0.831 -7.581
31 HG1 THR 4 1HG THR 4 -8.561 0.006 -6.955
32 HG21 THR 4 3HG2 THR 4 -6.056 -1.441 -8.390
33 HG22 THR 4 1HG2 THR 4 -5.416 -1.787 -6.784
34 HG23 THR 4 2HG2 THR 4 -4.699 -0.507 -7.763
35 H GLY 5 H GLY 5 -3.660 0.051 -4.893
36 HA2 GLY 5 1HA GLY 5 -2.554 2.307 -6.400
37 HA3 GLY 5 2HA GLY 5 -2.267 2.265 -4.667
38 H LYS 6 H LYS 6 -0.120 1.898 -4.574
39 HA LYS 6 HA LYS 6 0.823 -0.736 -5.193
40 HB2 LYS 6 1HB LYS 6 2.784 0.272 -6.575
41 HB3 LYS 6 2HB LYS 6 1.249 -0.052 -7.370
42 HG2 LYS 6 1HG LYS 6 1.414 2.627 -6.232
43 HG3 LYS 6 2HG LYS 6 2.639 2.305 -7.462
44 HD2 LYS 6 1HD LYS 6 -0.317 1.811 -7.820
45 HD3 LYS 6 2HD LYS 6 0.529 3.259 -8.372
46 HE2 LYS 6 1HE LYS 6 1.162 2.216 -10.227
47 HE3 LYS 6 2HE LYS 6 1.943 0.950 -9.280
48 HZ1 LYS 6 3HZ LYS 6 -0.480 0.083 -9.050
49 HZ2 LYS 6 1HZ LYS 6 0.401 -0.238 -10.458
50 HZ3 LYS 6 2HZ LYS 6 -0.752 1.000 -10.445
51 H CYS 7 H CYS 7 3.342 -0.762 -4.805
52 HA CYS 7 HA CYS 7 3.871 0.932 -2.452
53 HB2 CYS 7 1HB CYS 7 3.950 -1.949 -2.786
54 HB3 CYS 7 2HB CYS 7 5.502 -1.328 -2.239
55 HG CYS 7 HG CYS 7 4.419 -0.035 0.012
56 H THR 8 H THR 8 6.432 0.600 -1.961
57 HA THR 8 HA THR 8 7.835 1.212 -4.481
58 HB THR 8 HB THR 8 9.180 2.570 -2.410
59 HG1 THR 8 1HG THR 8 7.038 2.344 -1.341
60 HG21 THR 8 3HG2 THR 8 8.479 3.043 -4.977
61 HG22 THR 8 1HG2 THR 8 9.110 4.279 -3.889
62 HG23 THR 8 2HG2 THR 8 7.370 4.129 -4.140
63 H LYS 9 H LYS 9 9.756 0.236 -4.791
64 HA LYS 9 HA LYS 9 10.507 -2.009 -3.353
65 HB2 LYS 9 1HB LYS 9 12.766 -1.672 -4.504
66 HB3 LYS 9 2HB LYS 9 11.353 -1.826 -5.540
67 HG2 LYS 9 1HG LYS 9 11.321 0.490 -6.003
68 HG3 LYS 9 2HG LYS 9 12.482 0.835 -4.719
69 HD2 LYS 9 1HD LYS 9 13.644 0.944 -6.805
70 HD3 LYS 9 2HD LYS 9 14.158 -0.527 -5.978
71 HE2 LYS 9 1HE LYS 9 12.964 -1.902 -7.420
72 HE3 LYS 9 2HE LYS 9 11.895 -0.599 -7.935
73 HZ1 LYS 9 3HZ LYS 9 13.650 -1.342 -9.570
74 HZ2 LYS 9 1HZ LYS 9 14.788 -0.601 -8.561
75 HZ3 LYS 9 2HZ LYS 9 13.563 0.321 -9.276
76 H SER 10 H SER 10 11.524 1.339 -2.978
77 HA SER 10 HA SER 10 13.332 0.587 -0.803
78 HB2 SER 10 1HB SER 10 13.767 3.164 -0.882
79 HB3 SER 10 2HB SER 10 14.424 2.137 -2.155
80 HG SER 10 HG SER 10 12.647 4.154 -2.345
81 H LYS 11 H LYS 11 10.308 0.583 -0.727
82 HA LYS 11 HA LYS 11 9.970 1.393 1.924
83 HB2 LYS 11 1HB LYS 11 10.041 3.612 0.342
84 HB3 LYS 11 2HB LYS 11 8.317 3.262 0.356
85 HG2 LYS 11 1HG LYS 11 8.724 4.775 2.122
86 HG3 LYS 11 2HG LYS 11 8.454 3.195 2.863
87 HD2 LYS 11 1HD LYS 11 10.312 3.971 4.009
88 HD3 LYS 11 2HD LYS 11 11.040 2.981 2.739
89 HE2 LYS 11 1HE LYS 11 11.986 4.755 1.731
90 HE3 LYS 11 2HE LYS 11 10.580 5.784 2.001
91 HZ1 LYS 11 3HZ LYS 11 12.025 6.788 3.399
92 HZ2 LYS 11 1HZ LYS 11 12.943 5.391 3.664
93 HZ3 LYS 11 2HZ LYS 11 11.473 5.604 4.473
94 H ASN 12 H ASN 12 8.723 -0.329 2.343
95 HA ASN 12 HA ASN 12 6.655 -1.193 0.536
96 HB2 ASN 12 1HB ASN 12 7.956 -2.830 1.824
97 HB3 ASN 12 2HB ASN 12 7.344 -2.142 3.326
98 HD21 ASN 12 2HD2 ASN 12 6.224 -3.834 4.099
99 HD22 ASN 12 1HD2 ASN 12 4.873 -4.559 3.302
100 H GLU 13 H GLU 13 5.763 1.151 0.822
101 HA GLU 13 HA GLU 13 3.623 0.994 2.833
102 HB2 GLU 13 1HB GLU 13 3.855 3.244 3.453
103 HB3 GLU 13 2HB GLU 13 5.506 2.642 3.394
104 HG2 GLU 13 1HG GLU 13 5.719 3.605 1.119
105 HG3 GLU 13 2HG GLU 13 4.116 4.310 1.313
106 H CYS 14 H CYS 14 1.617 1.476 2.119
107 HA CYS 14 HA CYS 14 1.088 1.521 -0.640
108 HB2 CYS 14 1HB CYS 14 -1.169 1.547 -0.072
109 HB3 CYS 14 2HB CYS 14 -0.431 0.822 1.350
110 HG CYS 14 HG CYS 14 -2.192 2.399 2.559
111 H LYS 15 H LYS 15 0.334 3.152 -2.002
112 HA LYS 15 HA LYS 15 0.582 5.908 -1.017
113 HB2 LYS 15 1HB LYS 15 1.692 6.492 -3.200
114 HB3 LYS 15 2HB LYS 15 2.670 5.527 -2.102
115 HG2 LYS 15 1HG LYS 15 2.608 3.682 -3.441
116 HG3 LYS 15 2HG LYS 15 1.047 4.110 -4.148
117 HD2 LYS 15 1HD LYS 15 3.573 5.655 -4.691
118 HD3 LYS 15 2HD LYS 15 3.048 4.293 -5.683
119 HE2 LYS 15 1HE LYS 15 1.457 6.803 -5.159
120 HE3 LYS 15 2HE LYS 15 2.361 6.453 -6.632
121 HZ1 LYS 15 3HZ LYS 15 0.931 4.445 -6.880
122 HZ2 LYS 15 1HZ LYS 15 0.100 5.912 -7.024
123 HZ3 LYS 15 2HZ LYS 15 -0.015 5.012 -5.597
124 H TYR 16 H TYR 16 -1.788 5.618 -0.999
125 HA TYR 16 HA TYR 16 -2.936 5.967 -3.691
126 HB2 TYR 16 1HB TYR 16 -4.920 4.897 -2.997
127 HB3 TYR 16 2HB TYR 16 -3.624 3.904 -2.340
128 HD1 TYR 16 1HD TYR 16 -2.908 4.486 0.121
129 HD2 TYR 16 2HD TYR 16 -6.649 5.549 -1.603
130 HE1 TYR 16 1HE TYR 16 -3.874 4.707 2.371
131 HE2 TYR 16 2HE TYR 16 -7.626 5.774 0.643
132 HH TYR 16 HH TYR 16 -6.401 4.513 3.315
133 H LYS 17 H LYS 17 -5.383 6.938 -3.113
134 HA LYS 17 HA LYS 17 -4.860 9.414 -1.604
135 HB2 LYS 17 1HB LYS 17 -6.014 9.013 -4.328
136 HB3 LYS 17 2HB LYS 17 -6.625 10.339 -3.346
137 HG2 LYS 17 1HG LYS 17 -4.562 11.424 -3.310
138 HG3 LYS 17 2HG LYS 17 -3.688 9.971 -3.802
139 HD2 LYS 17 1HD LYS 17 -5.400 10.322 -5.895
140 HD3 LYS 17 2HD LYS 17 -5.062 11.990 -5.427
141 HE2 LYS 17 1HE LYS 17 -2.680 11.594 -5.624
142 HE3 LYS 17 2HE LYS 17 -2.967 9.893 -5.987
143 HZ1 LYS 17 3HZ LYS 17 -3.105 10.435 -8.113
144 HZ2 LYS 17 1HZ LYS 17 -2.917 12.077 -7.756
145 HZ3 LYS 17 2HZ LYS 17 -4.463 11.391 -7.792
146 H ASN 18 H ASN 18 -6.172 9.645 0.073
147 HA ASN 18 HA ASN 18 -8.792 8.303 0.005
148 HB2 ASN 18 1HB ASN 18 -8.642 7.898 2.285
149 HB3 ASN 18 2HB ASN 18 -6.961 7.732 1.786
150 HD21 ASN 18 2HD2 ASN 18 -5.683 9.805 1.899
151 HD22 ASN 18 1HD2 ASN 18 -5.934 10.793 3.293
152 H ASP 19 H ASP 19 -10.546 9.387 1.187
153 HA ASP 19 HA ASP 19 -11.863 11.178 1.705
154 HB2 ASP 19 1HB ASP 19 -9.684 11.911 2.911
155 HB3 ASP 19 2HB ASP 19 -9.485 13.010 1.549
156 H ALA 20 H ALA 20 -9.344 12.660 -0.335
157 HA ALA 20 HA ALA 20 -10.799 12.624 -2.729
158 HB1 ALA 20 1HB ALA 20 -12.401 14.073 -1.769
159 HB2 ALA 20 2HB ALA 20 -11.156 15.107 -1.068
160 HB3 ALA 20 3HB ALA 20 -11.395 15.077 -2.815
161 H GLY 21 H GLY 21 -8.134 12.224 -1.929
162 HA2 GLY 21 1HA GLY 21 -6.293 12.698 -3.454
163 HA3 GLY 21 2HA GLY 21 -6.807 14.379 -3.449
164 H LYS 22 H LYS 22 -6.944 12.821 -0.416
165 HA LYS 22 HA LYS 22 -4.867 14.530 0.614
166 HB2 LYS 22 1HB LYS 22 -6.886 12.670 1.774
167 HB3 LYS 22 2HB LYS 22 -5.473 13.058 2.745
168 HG2 LYS 22 1HG LYS 22 -7.387 14.511 3.235
169 HG3 LYS 22 2HG LYS 22 -5.993 15.412 2.635
170 HD2 LYS 22 1HD LYS 22 -6.990 15.541 0.428
171 HD3 LYS 22 2HD LYS 22 -8.353 14.553 0.960
172 HE2 LYS 22 1HE LYS 22 -9.333 16.557 1.288
173 HE3 LYS 22 2HE LYS 22 -8.436 16.517 2.805
174 HZ1 LYS 22 3HZ LYS 22 -8.242 18.609 1.437
175 HZ2 LYS 22 1HZ LYS 22 -7.317 17.715 0.340
176 HZ3 LYS 22 2HZ LYS 22 -6.783 17.911 1.932
177 H ASP 23 H ASP 23 -2.800 14.001 0.365
178 HA ASP 23 HA ASP 23 -1.767 11.528 -0.318
179 HB2 ASP 23 1HB ASP 23 -0.530 13.893 1.082
180 HB3 ASP 23 2HB ASP 23 0.408 12.454 0.688
181 H THR 24 H THR 24 -1.428 9.685 0.733
182 HA THR 24 HA THR 24 -1.005 9.675 3.612
183 HB THR 24 HB THR 24 -3.287 8.155 2.335
184 HG1 THR 24 1HG THR 24 -3.389 10.043 4.458
185 HG21 THR 24 3HG2 THR 24 -2.149 6.795 4.018
186 HG22 THR 24 1HG2 THR 24 -3.734 7.310 4.595
187 HG23 THR 24 2HG2 THR 24 -2.278 8.113 5.182
188 H PHE 25 H PHE 25 0.477 8.207 4.159
189 HA PHE 25 HA PHE 25 0.876 5.871 2.426
190 HB2 PHE 25 1HB PHE 25 3.092 7.656 3.456
191 HB3 PHE 25 2HB PHE 25 3.316 6.160 2.555
192 HD1 PHE 25 2HD PHE 25 1.828 9.551 2.311
193 HD2 PHE 25 1HD PHE 25 3.386 6.179 0.232
194 HE1 PHE 25 2HE PHE 25 1.736 10.813 0.202
195 HE2 PHE 25 1HE PHE 25 3.297 7.437 -1.880
196 HZ PHE 25 HZ PHE 25 2.471 9.756 -1.898
197 H ILE 26 H ILE 26 0.901 4.046 3.552
198 HA ILE 26 HA ILE 26 1.899 4.074 6.312
199 HB ILE 26 HB ILE 26 -0.452 4.205 6.646
200 HG12 ILE 26 1HG1 ILE 26 -0.939 2.090 7.760
201 HG13 ILE 26 2HG1 ILE 26 0.322 1.285 6.832
202 HG21 ILE 26 1HG2 ILE 26 -1.315 3.707 4.498
203 HG22 ILE 26 2HG2 ILE 26 -0.648 2.076 4.532
204 HG23 ILE 26 3HG2 ILE 26 -1.987 2.503 5.598
205 HD11 ILE 26 3HD1 ILE 26 0.558 2.475 9.335
206 HD12 ILE 26 1HD1 ILE 26 1.858 1.863 8.312
207 HD13 ILE 26 2HD1 ILE 26 1.388 3.562 8.222
208 H LYS 27 H LYS 27 3.252 2.451 6.719
209 HA LYS 27 HA LYS 27 4.060 0.637 4.735
210 HB2 LYS 27 1HB LYS 27 4.562 0.849 7.687
211 HB3 LYS 27 2HB LYS 27 5.153 -0.540 6.786
212 HG2 LYS 27 1HG LYS 27 6.728 0.667 5.683
213 HG3 LYS 27 2HG LYS 27 5.765 2.146 5.698
214 HD2 LYS 27 1HD LYS 27 6.575 2.808 7.707
215 HD3 LYS 27 2HD LYS 27 6.671 1.159 8.330
216 HE2 LYS 27 1HE LYS 27 8.604 0.941 6.574
217 HE3 LYS 27 2HE LYS 27 8.643 2.700 6.702
218 HZ1 LYS 27 3HZ LYS 27 8.843 0.860 9.023
219 HZ2 LYS 27 1HZ LYS 27 9.056 2.537 9.033
220 HZ3 LYS 27 2HZ LYS 27 10.176 1.549 8.241
221 H CYS 28 H CYS 28 3.508 -1.423 4.264
222 HA CYS 28 HA CYS 28 1.089 -2.460 5.493
223 HB2 CYS 28 1HB CYS 28 2.653 -3.731 3.249
224 HB3 CYS 28 2HB CYS 28 0.954 -3.952 3.648
225 HG CYS 28 HG CYS 28 2.245 -1.001 2.498
226 HA PRO 29 HA PRO 29 3.108 -5.339 8.135
227 HB2 PRO 29 1HB PRO 29 1.124 -7.175 8.382
228 HB3 PRO 29 2HB PRO 29 1.071 -5.593 9.168
229 HG2 PRO 29 1HG PRO 29 -0.247 -6.496 6.636
230 HG3 PRO 29 2HG PRO 29 -0.909 -5.508 7.951
231 HD2 PRO 29 1HD PRO 29 -0.010 -4.436 5.633
232 HD3 PRO 29 2HD PRO 29 0.108 -3.586 7.188
233 H LYS 30 H LYS 30 4.379 -5.708 5.925
234 HA LYS 30 HA LYS 30 4.360 -8.598 5.519
235 HB2 LYS 30 1HB LYS 30 4.448 -6.678 3.188
236 HB3 LYS 30 2HB LYS 30 4.445 -8.435 3.113
237 HG2 LYS 30 1HG LYS 30 2.175 -6.816 4.242
238 HG3 LYS 30 2HG LYS 30 2.268 -7.342 2.560
239 HD2 LYS 30 1HD LYS 30 2.070 -9.598 3.132
240 HD3 LYS 30 2HD LYS 30 2.524 -9.306 4.813
241 HE2 LYS 30 1HE LYS 30 0.289 -9.512 5.120
242 HE3 LYS 30 2HE LYS 30 0.321 -7.799 4.702
243 HZ1 LYS 30 3HZ LYS 30 -0.777 -8.173 2.814
244 HZ2 LYS 30 1HZ LYS 30 -1.169 -9.687 3.462
245 HZ3 LYS 30 2HZ LYS 30 0.150 -9.531 2.415
246 H PHE 31 H PHE 31 6.165 -7.473 7.087
247 HA PHE 31 HA PHE 31 8.542 -6.887 5.478
248 HB2 PHE 31 1HB PHE 31 9.559 -6.310 7.715
249 HB3 PHE 31 2HB PHE 31 8.204 -5.296 7.228
250 HD1 PHE 31 1HD PHE 31 6.079 -5.418 8.379
251 HD2 PHE 31 2HD PHE 31 9.366 -7.849 9.563
252 HE1 PHE 31 1HE PHE 31 4.937 -5.922 10.499
253 HE2 PHE 31 2HE PHE 31 8.229 -8.358 11.686
254 HZ PHE 31 HZ PHE 31 6.012 -7.395 12.156
255 H ASP 32 H ASP 32 7.592 -9.523 5.394
256 HA ASP 32 HA ASP 32 9.887 -11.006 5.817
257 HB2 ASP 32 1HB ASP 32 8.471 -10.573 8.252
258 HB3 ASP 32 2HB ASP 32 8.306 -12.273 7.823
259 H ASN 33 H ASN 33 6.440 -10.857 5.513
260 HA ASN 33 HA ASN 33 6.358 -13.577 4.413
261 HB2 ASN 33 1HB ASN 33 3.991 -11.794 4.988
262 HB3 ASN 33 2HB ASN 33 3.994 -13.537 4.735
263 HD21 ASN 33 2HD2 ASN 33 2.890 -12.137 6.954
264 HD22 ASN 33 1HD2 ASN 33 3.737 -12.661 8.367
265 H LYS 34 H LYS 34 6.408 -10.304 3.502
266 HA LYS 34 HA LYS 34 6.471 -10.863 0.750
267 HB2 LYS 34 1HB LYS 34 3.945 -11.098 1.454
268 HB3 LYS 34 2HB LYS 34 3.980 -9.340 1.398
269 HG2 LYS 34 1HG LYS 34 3.534 -9.521 -0.766
270 HG3 LYS 34 2HG LYS 34 5.189 -10.096 -0.969
271 HD2 LYS 34 1HD LYS 34 4.457 -12.392 -0.726
272 HD3 LYS 34 2HD LYS 34 2.807 -11.858 -0.397
273 HE2 LYS 34 1HE LYS 34 2.408 -11.298 -2.585
274 HE3 LYS 34 2HE LYS 34 4.108 -10.979 -2.925
275 HZ1 LYS 34 3HZ LYS 34 4.483 -13.411 -2.767
276 HZ2 LYS 34 1HZ LYS 34 3.476 -12.962 -4.050
277 HZ3 LYS 34 2HZ LYS 34 2.810 -13.631 -2.647
278 H LYS 35 H LYS 35 8.335 -9.540 1.615
279 HA LYS 35 HA LYS 35 7.865 -6.750 2.114
280 HB2 LYS 35 1HB LYS 35 10.439 -8.227 1.533
281 HB3 LYS 35 2HB LYS 35 10.323 -6.569 2.106
282 HG2 LYS 35 1HG LYS 35 10.170 -7.234 4.213
283 HG3 LYS 35 2HG LYS 35 8.851 -8.343 3.829
284 HD2 LYS 35 1HD LYS 35 10.754 -9.540 4.777
285 HD3 LYS 35 2HD LYS 35 10.474 -10.024 3.102
286 HE2 LYS 35 1HE LYS 35 12.268 -7.791 3.178
287 HE3 LYS 35 2HE LYS 35 12.854 -9.057 4.256
288 HZ1 LYS 35 3HZ LYS 35 13.736 -9.846 2.359
289 HZ2 LYS 35 1HZ LYS 35 12.629 -9.045 1.363
290 HZ3 LYS 35 2HZ LYS 35 12.192 -10.493 2.118
291 H CYS 36 H CYS 36 7.102 -5.555 0.479
292 HA CYS 36 HA CYS 36 7.362 -6.007 -2.231
293 HB2 CYS 36 1HB CYS 36 6.703 -3.656 -0.551
294 HB3 CYS 36 2HB CYS 36 7.175 -3.316 -2.212
295 HG CYS 36 HG CYS 36 4.800 -5.676 -1.686
296 H THR 37 H THR 37 8.905 -5.711 -3.718
297 HA THR 37 HA THR 37 11.216 -4.027 -3.069
298 HB THR 37 HB THR 37 12.821 -5.668 -3.709
299 HG1 THR 37 1HG THR 37 10.554 -7.077 -4.621
300 HG21 THR 37 3HG2 THR 37 11.324 -5.913 -1.450
301 HG22 THR 37 1HG2 THR 37 12.764 -6.869 -1.800
302 HG23 THR 37 2HG2 THR 37 11.164 -7.525 -2.145
303 H LYS 38 H LYS 38 9.070 -3.424 -4.777
304 HA LYS 38 HA LYS 38 10.521 -3.126 -7.290
305 HB2 LYS 38 1HB LYS 38 8.191 -4.836 -6.929
306 HB3 LYS 38 2HB LYS 38 7.926 -3.605 -8.156
307 HG2 LYS 38 1HG LYS 38 9.400 -4.522 -9.592
308 HG3 LYS 38 2HG LYS 38 10.491 -5.048 -8.308
309 HD2 LYS 38 1HD LYS 38 9.603 -7.019 -9.280
310 HD3 LYS 38 2HD LYS 38 8.773 -6.809 -7.736
311 HE2 LYS 38 1HE LYS 38 6.814 -6.813 -8.781
312 HE3 LYS 38 2HE LYS 38 7.307 -5.413 -9.731
313 HZ1 LYS 38 3HZ LYS 38 6.691 -7.230 -11.170
314 HZ2 LYS 38 1HZ LYS 38 7.806 -8.258 -10.421
315 HZ3 LYS 38 2HZ LYS 38 8.349 -6.932 -11.319
316 H ASP 39 H ASP 39 9.729 -1.405 -8.618
317 HA ASP 39 HA ASP 39 8.545 0.726 -7.048
318 HB2 ASP 39 1HB ASP 39 8.963 1.996 -9.290
319 HB3 ASP 39 2HB ASP 39 10.335 1.540 -8.286
320 H ASN 40 H ASN 40 6.419 0.965 -6.953
321 HA ASN 40 HA ASN 40 4.229 1.118 -7.553
322 HB2 ASN 40 1HB ASN 40 5.680 1.589 -10.064
323 HB3 ASN 40 2HB ASN 40 4.039 0.990 -10.288
324 HD21 ASN 40 2HD2 ASN 40 5.551 3.190 -7.949
325 HD22 ASN 40 1HD2 ASN 40 4.456 4.499 -8.218
326 H ASN 41 H ASN 41 5.556 -1.461 -7.153
327 HA ASN 41 HA ASN 41 4.836 -3.451 -8.918
328 HB2 ASN 41 1HB ASN 41 4.523 -4.803 -6.650
329 HB3 ASN 41 2HB ASN 41 6.113 -4.286 -7.204
330 HD21 ASN 41 2HD2 ASN 41 7.060 -4.116 -5.233
331 HD22 ASN 41 1HD2 ASN 41 6.595 -2.953 -4.043
332 H LYS 42 H LYS 42 3.011 -3.048 -5.902
333 HA LYS 42 HA LYS 42 0.509 -2.514 -7.014
334 HB2 LYS 42 1HB LYS 42 0.551 -4.625 -8.114
335 HB3 LYS 42 2HB LYS 42 1.140 -5.443 -6.673
336 HG2 LYS 42 1HG LYS 42 -0.932 -5.407 -5.647
337 HG3 LYS 42 2HG LYS 42 -1.518 -4.078 -6.648
338 HD2 LYS 42 1HD LYS 42 -2.613 -5.772 -7.690
339 HD3 LYS 42 2HD LYS 42 -1.085 -5.890 -8.565
340 HE2 LYS 42 1HE LYS 42 -0.688 -7.923 -7.747
341 HE3 LYS 42 2HE LYS 42 -0.997 -7.388 -6.097
342 HZ1 LYS 42 3HZ LYS 42 -2.591 -9.024 -7.672
343 HZ2 LYS 42 1HZ LYS 42 -3.432 -7.566 -7.506
344 HZ3 LYS 42 2HZ LYS 42 -2.939 -8.420 -6.132
345 H CYS 43 H CYS 43 -1.128 -2.386 -5.453
346 HA CYS 43 HA CYS 43 -0.773 -3.426 -2.809
347 HB2 CYS 43 1HB CYS 43 0.652 -1.172 -3.186
348 HB3 CYS 43 2HB CYS 43 -0.899 -0.463 -2.752
349 HG CYS 43 HG CYS 43 -0.707 -2.570 -0.478
350 H THR 44 H THR 44 -2.500 -2.425 -1.302
351 HA THR 44 HA THR 44 -4.823 -1.327 -2.601
352 HB THR 44 HB THR 44 -5.899 -3.612 -1.334
353 HG1 THR 44 1HG THR 44 -4.168 -4.491 -3.375
354 HG21 THR 44 3HG2 THR 44 -6.169 -4.076 -4.017
355 HG22 THR 44 1HG2 THR 44 -5.875 -2.339 -3.973
356 HG23 THR 44 2HG2 THR 44 -7.217 -3.029 -3.060
357 H VAL 45 H VAL 45 -6.513 -0.771 -1.108
358 HA VAL 45 HA VAL 45 -5.998 -1.131 1.727
359 HB VAL 45 HB VAL 45 -6.013 1.601 0.444
360 HG11 VAL 45 1HG1 VAL 45 -7.385 1.793 2.369
361 HG12 VAL 45 2HG1 VAL 45 -6.291 0.798 3.332
362 HG13 VAL 45 3HG1 VAL 45 -5.797 2.412 2.821
363 HG21 VAL 45 3HG2 VAL 45 -3.840 1.844 1.552
364 HG22 VAL 45 1HG2 VAL 45 -3.971 0.195 2.162
365 HG23 VAL 45 2HG2 VAL 45 -3.845 0.486 0.427
366 H ASP 46 H ASP 46 -7.924 -1.988 2.234
367 HA ASP 46 HA ASP 46 -10.370 -0.909 1.092
368 HB2 ASP 46 1HB ASP 46 -10.302 -3.064 3.177
369 HB3 ASP 46 2HB ASP 46 -11.443 -2.832 1.856
370 H THR 47 H THR 47 -11.488 0.657 2.028
371 HA THR 47 HA THR 47 -10.808 1.657 4.615
372 HB THR 47 HB THR 47 -13.075 2.978 4.130
373 HG1 THR 47 1HG THR 47 -13.263 1.496 2.171
374 HG21 THR 47 3HG2 THR 47 -11.676 4.556 2.703
375 HG22 THR 47 1HG2 THR 47 -10.379 3.370 2.849
376 HG23 THR 47 2HG2 THR 47 -11.028 4.148 4.291
377 H TYR 48 H TYR 48 -12.888 -0.789 3.532
378 HA TYR 48 HA TYR 48 -15.074 -0.685 5.200
379 HB2 TYR 48 1HB TYR 48 -15.028 -2.398 3.571
380 HB3 TYR 48 2HB TYR 48 -13.489 -3.024 4.153
381 HD1 TYR 48 2HD TYR 48 -16.505 -2.154 6.146
382 HD2 TYR 48 1HD TYR 48 -13.994 -5.253 4.665
383 HE1 TYR 48 2HE TYR 48 -17.702 -3.785 7.545
384 HE2 TYR 48 1HE TYR 48 -15.186 -6.894 6.058
385 HH TYR 48 HH TYR 48 -17.014 -6.169 8.592
386 H ASN 49 H ASN 49 -11.894 -2.117 5.900
387 HA ASN 49 HA ASN 49 -12.274 -1.568 8.724
388 HB2 ASN 49 1HB ASN 49 -13.084 -4.011 7.919
389 HB3 ASN 49 2HB ASN 49 -11.375 -4.343 8.185
390 HD21 ASN 49 2HD2 ASN 49 -10.537 -4.244 10.250
391 HD22 ASN 49 1HD2 ASN 49 -11.539 -4.184 11.657
392 H ASN 50 H ASN 50 -10.523 -0.470 6.809
393 HA ASN 50 HA ASN 50 -8.325 -0.025 6.392
394 HB2 ASN 50 1HB ASN 50 -8.723 0.346 8.983
395 HB3 ASN 50 2HB ASN 50 -7.609 -1.013 9.120
396 HD21 ASN 50 2HD2 ASN 50 -7.786 1.772 6.930
397 HD22 ASN 50 1HD2 ASN 50 -6.186 2.339 7.248
398 H ALA 51 H ALA 51 -8.720 -2.195 5.095
399 HA ALA 51 HA ALA 51 -6.786 -4.219 5.990
400 HB1 ALA 51 1HB ALA 51 -7.919 -5.451 3.941
401 HB2 ALA 51 2HB ALA 51 -8.665 -5.429 5.540
402 HB3 ALA 51 3HB ALA 51 -9.221 -4.313 4.293
403 H VAL 52 H VAL 52 -4.807 -3.723 5.265
404 HA VAL 52 HA VAL 52 -4.501 -2.676 2.542
405 HB VAL 52 HB VAL 52 -2.336 -2.923 4.626
406 HG11 VAL 52 1HG1 VAL 52 -1.520 -2.628 2.374
407 HG12 VAL 52 2HG1 VAL 52 -2.607 -1.261 2.123
408 HG13 VAL 52 3HG1 VAL 52 -1.283 -1.135 3.281
409 HG21 VAL 52 3HG2 VAL 52 -4.448 -0.850 4.274
410 HG22 VAL 52 1HG2 VAL 52 -3.746 -1.505 5.752
411 HG23 VAL 52 2HG2 VAL 52 -2.835 -0.350 4.781
412 H ASP 53 H ASP 53 -3.313 -3.710 0.987
413 HA ASP 53 HA ASP 53 -2.393 -6.432 1.645
414 HB2 ASP 53 1HB ASP 53 -4.332 -5.603 -0.249
415 HB3 ASP 53 2HB ASP 53 -2.925 -6.148 -1.158
416 H CYS 54 H CYS 54 -1.059 -7.105 -0.600
417 HA CYS 54 HA CYS 54 0.781 -5.021 -1.375
418 HB2 CYS 54 1HB CYS 54 1.436 -6.952 0.739
419 HB3 CYS 54 2HB CYS 54 2.626 -6.879 -0.554
420 HG CYS 54 HG CYS 54 2.154 -3.812 -0.016
421 H ASP 55 H ASP 55 2.401 -5.813 -2.943
422 HA ASP 55 HA ASP 55 1.171 -7.548 -4.842
423 HB2 ASP 55 1HB ASP 55 2.668 -5.558 -5.354
424 HB3 ASP 55 2HB ASP 55 4.029 -6.582 -4.903
Start of MODEL 16
1 H1 ALA 1 H ALA 1 -15.932 1.654 1.110
2 HA ALA 1 HA ALA 1 -15.563 2.811 -1.497
3 HB1 ALA 1 1HB ALA 1 -15.392 4.507 0.803
4 HB2 ALA 1 2HB ALA 1 -13.805 4.371 0.044
5 HB3 ALA 1 3HB ALA 1 -15.190 4.914 -0.901
6 H LYS 2 H LYS 2 -13.211 2.878 -2.088
7 HA LYS 2 HA LYS 2 -11.479 1.186 -0.476
8 HB2 LYS 2 1HB LYS 2 -12.433 0.448 -3.241
9 HB3 LYS 2 2HB LYS 2 -10.964 -0.218 -2.539
10 HG2 LYS 2 1HG LYS 2 -12.313 -1.847 -1.818
11 HG3 LYS 2 2HG LYS 2 -12.752 -0.694 -0.555
12 HD2 LYS 2 1HD LYS 2 -14.679 0.020 -1.806
13 HD3 LYS 2 2HD LYS 2 -14.196 -0.961 -3.191
14 HE2 LYS 2 1HE LYS 2 -14.594 -2.291 -0.555
15 HE3 LYS 2 2HE LYS 2 -16.014 -1.805 -1.481
16 HZ1 LYS 2 3HZ LYS 2 -13.958 -3.236 -2.954
17 HZ2 LYS 2 1HZ LYS 2 -15.643 -3.367 -3.038
18 HZ3 LYS 2 2HZ LYS 2 -14.796 -4.140 -1.794
19 H TYR 3 H TYR 3 -9.287 0.939 -1.639
20 HA TYR 3 HA TYR 3 -8.654 3.244 -3.319
21 HB2 TYR 3 1HB TYR 3 -6.988 2.644 -0.881
22 HB3 TYR 3 2HB TYR 3 -6.931 4.067 -1.916
23 HD1 TYR 3 2HD TYR 3 -9.107 5.514 -1.970
24 HD2 TYR 3 1HD TYR 3 -8.171 2.734 1.112
25 HE1 TYR 3 2HE TYR 3 -10.651 6.684 -0.455
26 HE2 TYR 3 1HE TYR 3 -9.714 3.896 2.636
27 HH TYR 3 HH TYR 3 -10.648 6.373 2.773
28 H THR 4 H THR 4 -6.517 3.101 -4.306
29 HA THR 4 HA THR 4 -5.268 0.460 -4.248
30 HB THR 4 HB THR 4 -6.965 0.398 -6.069
31 HG1 THR 4 1HG THR 4 -5.160 -0.900 -6.335
32 HG21 THR 4 3HG2 THR 4 -6.330 2.961 -6.565
33 HG22 THR 4 1HG2 THR 4 -7.061 1.900 -7.769
34 HG23 THR 4 2HG2 THR 4 -5.318 2.169 -7.772
35 H GLY 5 H GLY 5 -3.096 0.480 -4.658
36 HA2 GLY 5 1HA GLY 5 -1.813 2.729 -5.922
37 HA3 GLY 5 2HA GLY 5 -1.553 2.669 -4.185
38 H LYS 6 H LYS 6 0.722 2.481 -4.846
39 HA LYS 6 HA LYS 6 1.462 -0.330 -5.034
40 HB2 LYS 6 1HB LYS 6 2.560 1.765 -6.919
41 HB3 LYS 6 2HB LYS 6 3.132 0.106 -6.793
42 HG2 LYS 6 1HG LYS 6 1.748 -0.091 -8.587
43 HG3 LYS 6 2HG LYS 6 0.605 -0.445 -7.289
44 HD2 LYS 6 1HD LYS 6 -0.653 1.149 -8.251
45 HD3 LYS 6 2HD LYS 6 0.441 2.272 -7.439
46 HE2 LYS 6 1HE LYS 6 1.895 1.997 -9.569
47 HE3 LYS 6 2HE LYS 6 0.411 1.388 -10.300
48 HZ1 LYS 6 3HZ LYS 6 0.859 3.841 -10.548
49 HZ2 LYS 6 1HZ LYS 6 0.529 3.991 -8.895
50 HZ3 LYS 6 2HZ LYS 6 -0.668 3.427 -9.950
51 H CYS 7 H CYS 7 3.651 -0.751 -4.369
52 HA CYS 7 HA CYS 7 4.744 1.401 -2.682
53 HB2 CYS 7 1HB CYS 7 5.080 -1.578 -2.294
54 HB3 CYS 7 2HB CYS 7 5.599 -0.308 -1.194
55 HG CYS 7 HG CYS 7 2.642 0.464 -1.197
56 H THR 8 H THR 8 7.039 1.559 -2.484
57 HA THR 8 HA THR 8 8.421 0.702 -4.925
58 HB THR 8 HB THR 8 8.393 3.134 -4.367
59 HG1 THR 8 1HG THR 8 10.107 2.800 -5.599
60 HG21 THR 8 3HG2 THR 8 10.370 2.525 -2.194
61 HG22 THR 8 1HG2 THR 8 8.645 2.620 -1.846
62 HG23 THR 8 2HG2 THR 8 9.489 4.020 -2.507
63 H LYS 9 H LYS 9 10.763 0.169 -4.693
64 HA LYS 9 HA LYS 9 11.100 -1.978 -2.880
65 HB2 LYS 9 1HB LYS 9 13.341 -0.596 -4.343
66 HB3 LYS 9 2HB LYS 9 13.236 -2.284 -3.859
67 HG2 LYS 9 1HG LYS 9 11.238 -2.412 -5.461
68 HG3 LYS 9 2HG LYS 9 11.841 -0.885 -6.109
69 HD2 LYS 9 1HD LYS 9 12.743 -2.664 -7.433
70 HD3 LYS 9 2HD LYS 9 14.051 -1.990 -6.458
71 HE2 LYS 9 1HE LYS 9 14.320 -3.890 -5.279
72 HE3 LYS 9 2HE LYS 9 12.588 -4.212 -5.211
73 HZ1 LYS 9 3HZ LYS 9 13.273 -5.892 -6.565
74 HZ2 LYS 9 1HZ LYS 9 14.547 -5.006 -7.237
75 HZ3 LYS 9 2HZ LYS 9 12.959 -4.716 -7.739
76 H SER 10 H SER 10 11.868 1.400 -2.733
77 HA SER 10 HA SER 10 13.512 1.003 -0.339
78 HB2 SER 10 1HB SER 10 14.025 3.435 -0.584
79 HB3 SER 10 2HB SER 10 14.489 2.480 -1.992
80 HG SER 10 HG SER 10 13.041 3.485 -3.160
81 H LYS 11 H LYS 11 10.489 0.791 -0.608
82 HA LYS 11 HA LYS 11 9.799 1.769 1.913
83 HB2 LYS 11 1HB LYS 11 9.773 3.789 -0.084
84 HB3 LYS 11 2HB LYS 11 8.099 3.429 0.318
85 HG2 LYS 11 1HG LYS 11 10.116 3.920 2.473
86 HG3 LYS 11 2HG LYS 11 9.331 5.262 1.636
87 HD2 LYS 11 1HD LYS 11 7.553 5.033 2.949
88 HD3 LYS 11 2HD LYS 11 7.321 3.391 2.348
89 HE2 LYS 11 1HE LYS 11 7.495 3.304 4.736
90 HE3 LYS 11 2HE LYS 11 8.960 2.603 4.046
91 HZ1 LYS 11 3HZ LYS 11 9.559 5.246 4.342
92 HZ2 LYS 11 1HZ LYS 11 10.050 3.995 5.371
93 HZ3 LYS 11 2HZ LYS 11 8.663 4.892 5.732
94 H ASN 12 H ASN 12 8.426 0.209 2.443
95 HA ASN 12 HA ASN 12 6.612 -0.878 0.432
96 HB2 ASN 12 1HB ASN 12 7.951 -2.449 1.783
97 HB3 ASN 12 2HB ASN 12 7.191 -1.829 3.246
98 HD21 ASN 12 2HD2 ASN 12 5.815 -3.257 3.997
99 HD22 ASN 12 1HD2 ASN 12 4.695 -4.185 3.063
100 H GLU 13 H GLU 13 5.602 1.424 0.708
101 HA GLU 13 HA GLU 13 3.408 1.157 2.652
102 HB2 GLU 13 1HB GLU 13 3.440 3.492 3.114
103 HB3 GLU 13 2HB GLU 13 5.091 2.917 3.291
104 HG2 GLU 13 1HG GLU 13 5.619 3.770 1.056
105 HG3 GLU 13 2HG GLU 13 3.970 4.372 0.907
106 H CYS 14 H CYS 14 1.374 1.716 1.950
107 HA CYS 14 HA CYS 14 1.000 1.748 -0.908
108 HB2 CYS 14 1HB CYS 14 -0.443 0.454 0.717
109 HB3 CYS 14 2HB CYS 14 -1.123 1.994 1.227
110 HG CYS 14 HG CYS 14 -1.273 1.715 -2.059
111 H LYS 15 H LYS 15 1.242 3.590 -1.985
112 HA LYS 15 HA LYS 15 0.633 6.137 -0.718
113 HB2 LYS 15 1HB LYS 15 1.557 7.096 -2.839
114 HB3 LYS 15 2HB LYS 15 2.683 6.074 -1.955
115 HG2 LYS 15 1HG LYS 15 2.824 4.580 -3.613
116 HG3 LYS 15 2HG LYS 15 1.095 4.654 -3.962
117 HD2 LYS 15 1HD LYS 15 1.844 7.086 -4.833
118 HD3 LYS 15 2HD LYS 15 3.337 6.189 -5.122
119 HE2 LYS 15 1HE LYS 15 1.198 4.566 -6.004
120 HE3 LYS 15 2HE LYS 15 0.913 6.188 -6.634
121 HZ1 LYS 15 3HZ LYS 15 3.575 5.760 -7.055
122 HZ2 LYS 15 1HZ LYS 15 2.354 5.649 -8.220
123 HZ3 LYS 15 2HZ LYS 15 2.876 4.261 -7.408
124 H TYR 16 H TYR 16 -1.703 5.381 -0.665
125 HA TYR 16 HA TYR 16 -3.055 5.860 -3.230
126 HB2 TYR 16 1HB TYR 16 -4.942 4.708 -2.353
127 HB3 TYR 16 2HB TYR 16 -3.534 3.752 -1.906
128 HD1 TYR 16 1HD TYR 16 -2.789 3.650 0.423
129 HD2 TYR 16 2HD TYR 16 -6.270 5.832 -0.679
130 HE1 TYR 16 1HE TYR 16 -3.480 3.726 2.782
131 HE2 TYR 16 2HE TYR 16 -6.971 5.916 1.676
132 HH TYR 16 HH TYR 16 -5.749 5.786 3.966
133 H LYS 17 H LYS 17 -5.373 6.849 -2.781
134 HA LYS 17 HA LYS 17 -4.998 9.222 -1.074
135 HB2 LYS 17 1HB LYS 17 -6.003 8.971 -3.880
136 HB3 LYS 17 2HB LYS 17 -6.649 10.247 -2.857
137 HG2 LYS 17 1HG LYS 17 -4.692 11.405 -2.820
138 HG3 LYS 17 2HG LYS 17 -3.702 9.954 -2.996
139 HD2 LYS 17 1HD LYS 17 -4.443 9.785 -5.352
140 HD3 LYS 17 2HD LYS 17 -5.327 11.299 -5.154
141 HE2 LYS 17 1HE LYS 17 -3.479 12.426 -5.647
142 HE3 LYS 17 2HE LYS 17 -2.692 11.736 -4.229
143 HZ1 LYS 17 3HZ LYS 17 -2.687 9.794 -6.228
144 HZ2 LYS 17 1HZ LYS 17 -1.362 10.619 -5.577
145 HZ3 LYS 17 2HZ LYS 17 -2.155 11.235 -6.937
146 H ASN 18 H ASN 18 -6.681 9.848 0.201
147 HA ASN 18 HA ASN 18 -9.140 8.231 0.051
148 HB2 ASN 18 1HB ASN 18 -9.191 7.931 2.352
149 HB3 ASN 18 2HB ASN 18 -7.465 7.828 2.020
150 HD21 ASN 18 2HD2 ASN 18 -6.367 10.059 2.061
151 HD22 ASN 18 1HD2 ASN 18 -6.767 11.055 3.415
152 H ASP 19 H ASP 19 -10.976 9.309 1.302
153 HA ASP 19 HA ASP 19 -12.379 11.073 1.661
154 HB2 ASP 19 1HB ASP 19 -10.205 12.070 2.673
155 HB3 ASP 19 2HB ASP 19 -10.130 13.007 1.183
156 H ALA 20 H ALA 20 -10.029 12.428 -0.652
157 HA ALA 20 HA ALA 20 -11.612 12.033 -2.943
158 HB1 ALA 20 1HB ALA 20 -13.172 13.586 -2.040
159 HB2 ALA 20 2HB ALA 20 -11.891 14.728 -1.630
160 HB3 ALA 20 3HB ALA 20 -12.288 14.418 -3.320
161 H GLY 21 H GLY 21 -8.911 11.739 -2.297
162 HA2 GLY 21 1HA GLY 21 -7.196 12.058 -4.017
163 HA3 GLY 21 2HA GLY 21 -7.696 13.741 -4.100
164 H LYS 22 H LYS 22 -7.655 12.506 -0.943
165 HA LYS 22 HA LYS 22 -5.440 14.207 -0.241
166 HB2 LYS 22 1HB LYS 22 -7.692 13.147 1.088
167 HB3 LYS 22 2HB LYS 22 -6.282 12.499 1.916
168 HG2 LYS 22 1HG LYS 22 -6.791 15.418 1.382
169 HG3 LYS 22 2HG LYS 22 -7.081 14.590 2.914
170 HD2 LYS 22 1HD LYS 22 -4.957 14.877 3.499
171 HD3 LYS 22 2HD LYS 22 -4.420 14.029 2.047
172 HE2 LYS 22 1HE LYS 22 -3.501 16.322 2.246
173 HE3 LYS 22 2HE LYS 22 -4.449 16.073 0.781
174 HZ1 LYS 22 3HZ LYS 22 -5.748 17.174 3.178
175 HZ2 LYS 22 1HZ LYS 22 -6.150 17.388 1.550
176 HZ3 LYS 22 2HZ LYS 22 -4.811 18.188 2.202
177 H ASP 23 H ASP 23 -3.412 13.561 -0.505
178 HA ASP 23 HA ASP 23 -2.518 10.999 -1.016
179 HB2 ASP 23 1HB ASP 23 -0.968 13.205 0.357
180 HB3 ASP 23 2HB ASP 23 -0.275 11.814 -0.472
181 H THR 24 H THR 24 -2.116 9.236 0.161
182 HA THR 24 HA THR 24 -1.846 9.482 3.070
183 HB THR 24 HB THR 24 -3.740 7.561 1.702
184 HG1 THR 24 1HG THR 24 -4.137 9.814 3.397
185 HG21 THR 24 3HG2 THR 24 -2.416 7.471 4.282
186 HG22 THR 24 1HG2 THR 24 -3.384 6.241 3.470
187 HG23 THR 24 2HG2 THR 24 -4.172 7.483 4.443
188 H PHE 25 H PHE 25 -0.254 8.263 3.872
189 HA PHE 25 HA PHE 25 0.706 5.981 2.283
190 HB2 PHE 25 1HB PHE 25 2.473 7.989 3.696
191 HB3 PHE 25 2HB PHE 25 3.016 6.590 2.775
192 HD1 PHE 25 2HD PHE 25 1.328 9.864 2.511
193 HD2 PHE 25 1HD PHE 25 3.263 6.690 0.439
194 HE1 PHE 25 2HE PHE 25 1.392 11.239 0.472
195 HE2 PHE 25 1HE PHE 25 3.333 8.061 -1.604
196 HZ PHE 25 HZ PHE 25 2.394 10.338 -1.589
197 H ILE 26 H ILE 26 1.072 4.160 3.405
198 HA ILE 26 HA ILE 26 1.641 4.211 6.235
199 HB ILE 26 HB ILE 26 -0.765 4.376 6.344
200 HG12 ILE 26 1HG1 ILE 26 0.075 1.520 6.882
201 HG13 ILE 26 2HG1 ILE 26 0.413 2.880 7.947
202 HG21 ILE 26 1HG2 ILE 26 -1.560 1.873 5.212
203 HG22 ILE 26 2HG2 ILE 26 -2.103 3.501 4.807
204 HG23 ILE 26 3HG2 ILE 26 -0.689 2.817 4.003
205 HD11 ILE 26 3HD1 ILE 26 -1.522 1.483 8.630
206 HD12 ILE 26 1HD1 ILE 26 -1.906 3.188 8.398
207 HD13 ILE 26 2HD1 ILE 26 -2.355 2.008 7.167
208 H LYS 27 H LYS 27 3.125 2.704 6.555
209 HA LYS 27 HA LYS 27 3.906 0.815 4.653
210 HB2 LYS 27 1HB LYS 27 4.657 1.546 7.354
211 HB3 LYS 27 2HB LYS 27 4.737 -0.196 7.126
212 HG2 LYS 27 1HG LYS 27 5.922 1.310 4.930
213 HG3 LYS 27 2HG LYS 27 6.703 1.595 6.487
214 HD2 LYS 27 1HD LYS 27 6.570 -1.028 6.660
215 HD3 LYS 27 2HD LYS 27 6.478 -0.919 4.900
216 HE2 LYS 27 1HE LYS 27 8.547 0.452 4.934
217 HE3 LYS 27 2HE LYS 27 8.655 0.183 6.673
218 HZ1 LYS 27 3HZ LYS 27 9.322 -1.940 6.395
219 HZ2 LYS 27 1HZ LYS 27 9.868 -1.358 4.904
220 HZ3 LYS 27 2HZ LYS 27 8.397 -2.187 5.001
221 H CYS 28 H CYS 28 3.213 -1.165 4.144
222 HA CYS 28 HA CYS 28 0.881 -2.222 5.470
223 HB2 CYS 28 1HB CYS 28 2.467 -3.534 3.262
224 HB3 CYS 28 2HB CYS 28 0.783 -3.814 3.690
225 HG CYS 28 HG CYS 28 1.799 -1.994 1.328
226 HA PRO 29 HA PRO 29 2.831 -5.076 8.177
227 HB2 PRO 29 1HB PRO 29 0.978 -7.058 8.236
228 HB3 PRO 29 2HB PRO 29 0.740 -5.497 9.029
229 HG2 PRO 29 1HG PRO 29 -0.289 -6.453 6.387
230 HG3 PRO 29 2HG PRO 29 -1.132 -5.539 7.650
231 HD2 PRO 29 1HD PRO 29 -0.124 -4.364 5.429
232 HD3 PRO 29 2HD PRO 29 -0.202 -3.534 6.995
233 H LYS 30 H LYS 30 4.433 -5.384 6.297
234 HA LYS 30 HA LYS 30 4.487 -8.239 5.663
235 HB2 LYS 30 1HB LYS 30 4.864 -6.021 3.647
236 HB3 LYS 30 2HB LYS 30 5.305 -7.698 3.354
237 HG2 LYS 30 1HG LYS 30 3.242 -7.652 2.392
238 HG3 LYS 30 2HG LYS 30 2.802 -8.132 4.034
239 HD2 LYS 30 1HD LYS 30 2.596 -5.567 4.435
240 HD3 LYS 30 2HD LYS 30 2.474 -5.485 2.676
241 HE2 LYS 30 1HE LYS 30 0.775 -7.571 3.582
242 HE3 LYS 30 2HE LYS 30 0.461 -6.147 4.572
243 HZ1 LYS 30 3HZ LYS 30 0.670 -5.305 1.924
244 HZ2 LYS 30 1HZ LYS 30 -0.706 -5.313 2.906
245 HZ3 LYS 30 2HZ LYS 30 -0.354 -6.651 1.934
246 H PHE 31 H PHE 31 5.982 -7.861 7.571
247 HA PHE 31 HA PHE 31 8.465 -6.530 7.116
248 HB2 PHE 31 1HB PHE 31 7.848 -8.626 9.204
249 HB3 PHE 31 2HB PHE 31 9.143 -7.435 9.249
250 HD1 PHE 31 1HD PHE 31 5.559 -8.003 9.671
251 HD2 PHE 31 2HD PHE 31 8.692 -5.126 9.799
252 HE1 PHE 31 1HE PHE 31 4.076 -6.447 10.865
253 HE2 PHE 31 2HE PHE 31 7.214 -3.564 10.994
254 HZ PHE 31 HZ PHE 31 4.903 -4.223 11.529
255 H ASP 32 H ASP 32 10.336 -8.348 8.095
256 HA ASP 32 HA ASP 32 11.355 -9.523 5.845
257 HB2 ASP 32 1HB ASP 32 11.711 -10.078 8.762
258 HB3 ASP 32 2HB ASP 32 12.449 -11.169 7.592
259 H ASN 33 H ASN 33 9.809 -10.588 4.616
260 HA ASN 33 HA ASN 33 9.574 -13.332 4.906
261 HB2 ASN 33 1HB ASN 33 8.144 -13.181 6.755
262 HB3 ASN 33 2HB ASN 33 7.299 -11.779 6.104
263 HD21 ASN 33 2HD2 ASN 33 5.300 -12.247 5.586
264 HD22 ASN 33 1HD2 ASN 33 4.744 -13.722 4.878
265 H LYS 34 H LYS 34 7.541 -10.574 3.932
266 HA LYS 34 HA LYS 34 7.731 -11.426 1.159
267 HB2 LYS 34 1HB LYS 34 5.700 -12.540 2.258
268 HB3 LYS 34 2HB LYS 34 5.004 -10.928 2.340
269 HG2 LYS 34 1HG LYS 34 4.332 -11.066 0.238
270 HG3 LYS 34 2HG LYS 34 5.977 -11.405 -0.306
271 HD2 LYS 34 1HD LYS 34 4.659 -13.244 -1.002
272 HD3 LYS 34 2HD LYS 34 5.576 -13.802 0.399
273 HE2 LYS 34 1HE LYS 34 3.699 -13.693 1.806
274 HE3 LYS 34 2HE LYS 34 2.796 -12.699 0.664
275 HZ1 LYS 34 3HZ LYS 34 2.586 -14.561 -0.804
276 HZ2 LYS 34 1HZ LYS 34 2.059 -15.034 0.731
277 HZ3 LYS 34 2HZ LYS 34 3.579 -15.520 0.172
278 H LYS 35 H LYS 35 9.005 -9.297 1.947
279 HA LYS 35 HA LYS 35 7.401 -6.908 1.912
280 HB2 LYS 35 1HB LYS 35 10.077 -7.595 2.598
281 HB3 LYS 35 2HB LYS 35 10.144 -6.339 1.368
282 HG2 LYS 35 1HG LYS 35 8.254 -5.319 3.000
283 HG3 LYS 35 2HG LYS 35 9.240 -6.209 4.162
284 HD2 LYS 35 1HD LYS 35 10.519 -4.402 2.143
285 HD3 LYS 35 2HD LYS 35 9.834 -3.744 3.632
286 HE2 LYS 35 1HE LYS 35 11.343 -5.942 4.442
287 HE3 LYS 35 2HE LYS 35 12.322 -5.154 3.206
288 HZ1 LYS 35 3HZ LYS 35 11.462 -4.146 5.818
289 HZ2 LYS 35 1HZ LYS 35 11.656 -3.031 4.560
290 HZ3 LYS 35 2HZ LYS 35 12.959 -3.996 5.044
291 H CYS 36 H CYS 36 8.193 -5.103 0.340
292 HA CYS 36 HA CYS 36 7.476 -5.918 -2.277
293 HB2 CYS 36 1HB CYS 36 7.121 -3.629 -1.204
294 HB3 CYS 36 2HB CYS 36 8.812 -3.309 -1.566
295 HG CYS 36 HG CYS 36 7.960 -2.105 -3.708
296 H THR 37 H THR 37 8.707 -5.915 -4.188
297 HA THR 37 HA THR 37 11.609 -5.765 -3.951
298 HB THR 37 HB THR 37 11.879 -7.943 -5.157
299 HG1 THR 37 1HG THR 37 9.764 -8.222 -5.924
300 HG21 THR 37 3HG2 THR 37 12.137 -7.644 -2.662
301 HG22 THR 37 1HG2 THR 37 11.781 -9.286 -3.197
302 HG23 THR 37 2HG2 THR 37 10.504 -8.290 -2.498
303 H LYS 38 H LYS 38 9.816 -4.035 -5.248
304 HA LYS 38 HA LYS 38 11.005 -3.749 -7.751
305 HB2 LYS 38 1HB LYS 38 8.867 -5.657 -7.731
306 HB3 LYS 38 2HB LYS 38 8.373 -4.257 -8.673
307 HG2 LYS 38 1HG LYS 38 11.040 -4.930 -9.394
308 HG3 LYS 38 2HG LYS 38 10.053 -6.393 -9.443
309 HD2 LYS 38 1HD LYS 38 8.474 -5.337 -10.923
310 HD3 LYS 38 2HD LYS 38 9.311 -3.789 -10.775
311 HE2 LYS 38 1HE LYS 38 10.481 -4.363 -12.579
312 HE3 LYS 38 2HE LYS 38 11.281 -5.576 -11.580
313 HZ1 LYS 38 3HZ LYS 38 9.049 -5.912 -13.471
314 HZ2 LYS 38 1HZ LYS 38 9.238 -7.003 -12.190
315 HZ3 LYS 38 2HZ LYS 38 10.474 -6.813 -13.328
316 H ASP 39 H ASP 39 10.885 -1.642 -8.118
317 HA ASP 39 HA ASP 39 9.410 0.167 -6.653
318 HB2 ASP 39 1HB ASP 39 9.780 1.688 -8.744
319 HB3 ASP 39 2HB ASP 39 11.173 1.120 -7.828
320 H ASN 40 H ASN 40 7.286 0.371 -6.476
321 HA ASN 40 HA ASN 40 5.075 0.535 -6.984
322 HB2 ASN 40 1HB ASN 40 6.448 1.454 -9.428
323 HB3 ASN 40 2HB ASN 40 4.784 0.928 -9.667
324 HD21 ASN 40 2HD2 ASN 40 6.820 3.054 -7.728
325 HD22 ASN 40 1HD2 ASN 40 5.608 4.250 -7.441
326 H ASN 41 H ASN 41 5.073 -1.789 -6.455
327 HA ASN 41 HA ASN 41 4.896 -3.625 -8.699
328 HB2 ASN 41 1HB ASN 41 5.323 -3.842 -5.826
329 HB3 ASN 41 2HB ASN 41 4.145 -5.015 -6.411
330 HD21 ASN 41 2HD2 ASN 41 6.525 -5.838 -5.369
331 HD22 ASN 41 1HD2 ASN 41 7.515 -6.501 -6.620
332 H LYS 42 H LYS 42 2.810 -3.499 -5.840
333 HA LYS 42 HA LYS 42 0.469 -2.621 -7.084
334 HB2 LYS 42 1HB LYS 42 0.487 -4.559 -8.464
335 HB3 LYS 42 2HB LYS 42 0.880 -5.608 -7.107
336 HG2 LYS 42 1HG LYS 42 -1.276 -5.576 -6.285
337 HG3 LYS 42 2HG LYS 42 -1.675 -4.063 -7.102
338 HD2 LYS 42 1HD LYS 42 -1.045 -5.805 -9.166
339 HD3 LYS 42 2HD LYS 42 -1.948 -6.802 -8.023
340 HE2 LYS 42 1HE LYS 42 -3.712 -5.042 -7.991
341 HE3 LYS 42 2HE LYS 42 -2.831 -4.200 -9.265
342 HZ1 LYS 42 3HZ LYS 42 -3.577 -7.018 -9.644
343 HZ2 LYS 42 1HZ LYS 42 -3.331 -5.809 -10.802
344 HZ3 LYS 42 2HZ LYS 42 -4.744 -5.815 -9.871
345 H CYS 43 H CYS 43 -0.940 -2.101 -5.528
346 HA CYS 43 HA CYS 43 -0.942 -3.629 -3.029
347 HB2 CYS 43 1HB CYS 43 0.404 -1.260 -3.181
348 HB3 CYS 43 2HB CYS 43 -1.188 -0.716 -2.667
349 HG CYS 43 HG CYS 43 -1.251 -2.113 -0.320
350 H THR 44 H THR 44 -2.762 -2.519 -1.552
351 HA THR 44 HA THR 44 -5.004 -1.393 -2.857
352 HB THR 44 HB THR 44 -6.182 -3.835 -2.100
353 HG1 THR 44 1HG THR 44 -4.934 -5.083 -3.850
354 HG21 THR 44 3HG2 THR 44 -5.645 -3.220 -4.964
355 HG22 THR 44 1HG2 THR 44 -6.580 -2.061 -4.020
356 HG23 THR 44 2HG2 THR 44 -7.142 -3.724 -4.180
357 H VAL 45 H VAL 45 -6.690 -0.896 -1.426
358 HA VAL 45 HA VAL 45 -6.518 -1.835 1.322
359 HB VAL 45 HB VAL 45 -6.279 1.094 0.623
360 HG11 VAL 45 1HG1 VAL 45 -5.991 1.145 3.233
361 HG12 VAL 45 2HG1 VAL 45 -7.595 1.185 2.500
362 HG13 VAL 45 3HG1 VAL 45 -6.961 -0.326 3.152
363 HG21 VAL 45 3HG2 VAL 45 -4.174 -0.122 0.427
364 HG22 VAL 45 1HG2 VAL 45 -4.145 0.966 1.815
365 HG23 VAL 45 2HG2 VAL 45 -4.382 -0.765 2.056
366 H ASP 46 H ASP 46 -8.456 -1.842 2.356
367 HA ASP 46 HA ASP 46 -10.744 -0.721 0.873
368 HB2 ASP 46 1HB ASP 46 -10.463 -3.299 1.191
369 HB3 ASP 46 2HB ASP 46 -11.020 -2.977 2.831
370 H THR 47 H THR 47 -12.377 0.318 2.013
371 HA THR 47 HA THR 47 -11.526 1.551 4.481
372 HB THR 47 HB THR 47 -13.501 2.943 4.289
373 HG1 THR 47 1HG THR 47 -15.204 2.162 3.321
374 HG21 THR 47 3HG2 THR 47 -13.067 3.259 1.540
375 HG22 THR 47 1HG2 THR 47 -11.545 2.648 2.191
376 HG23 THR 47 2HG2 THR 47 -12.261 4.117 2.854
377 H TYR 48 H TYR 48 -13.317 -1.187 3.629
378 HA TYR 48 HA TYR 48 -15.347 -1.339 5.488
379 HB2 TYR 48 1HB TYR 48 -15.212 -3.063 3.875
380 HB3 TYR 48 2HB TYR 48 -13.559 -3.465 4.323
381 HD1 TYR 48 1HD TYR 48 -16.480 -2.963 6.568
382 HD2 TYR 48 2HD TYR 48 -13.707 -5.729 4.905
383 HE1 TYR 48 1HE TYR 48 -17.320 -4.709 8.084
384 HE2 TYR 48 2HE TYR 48 -14.540 -7.482 6.415
385 HH TYR 48 HH TYR 48 -17.201 -7.618 7.784
386 H ASN 49 H ASN 49 -12.012 -2.537 5.903
387 HA ASN 49 HA ASN 49 -12.098 -1.828 8.714
388 HB2 ASN 49 1HB ASN 49 -12.930 -4.323 8.167
389 HB3 ASN 49 2HB ASN 49 -11.195 -4.614 8.223
390 HD21 ASN 49 2HD2 ASN 49 -10.477 -5.211 10.123
391 HD22 ASN 49 1HD2 ASN 49 -11.141 -4.768 11.655
392 H ASN 50 H ASN 50 -10.600 -0.799 6.570
393 HA ASN 50 HA ASN 50 -8.475 -0.308 5.904
394 HB2 ASN 50 1HB ASN 50 -8.602 0.002 8.589
395 HB3 ASN 50 2HB ASN 50 -7.296 -1.175 8.478
396 HD21 ASN 50 2HD2 ASN 50 -6.092 -0.411 6.133
397 HD22 ASN 50 1HD2 ASN 50 -5.398 1.159 6.328
398 H ALA 51 H ALA 51 -9.212 -2.782 5.031
399 HA ALA 51 HA ALA 51 -7.174 -4.722 5.700
400 HB1 ALA 51 1HB ALA 51 -8.294 -6.098 3.948
401 HB2 ALA 51 2HB ALA 51 -9.364 -5.570 5.249
402 HB3 ALA 51 3HB ALA 51 -9.412 -4.759 3.683
403 H VAL 52 H VAL 52 -5.180 -4.372 4.955
404 HA VAL 52 HA VAL 52 -4.822 -3.224 2.281
405 HB VAL 52 HB VAL 52 -2.691 -3.730 4.356
406 HG11 VAL 52 1HG1 VAL 52 -1.695 -1.751 2.947
407 HG12 VAL 52 2HG1 VAL 52 -1.548 -3.419 2.388
408 HG13 VAL 52 3HG1 VAL 52 -2.790 -2.365 1.709
409 HG21 VAL 52 3HG2 VAL 52 -2.952 -1.110 4.516
410 HG22 VAL 52 1HG2 VAL 52 -4.605 -1.476 4.021
411 HG23 VAL 52 2HG2 VAL 52 -3.948 -2.188 5.494
412 H ASP 53 H ASP 53 -3.441 -4.191 0.748
413 HA ASP 53 HA ASP 53 -2.801 -7.023 1.235
414 HB2 ASP 53 1HB ASP 53 -4.415 -5.806 -0.942
415 HB3 ASP 53 2HB ASP 53 -3.308 -7.098 -1.399
416 H CYS 54 H CYS 54 -1.355 -7.829 -0.690
417 HA CYS 54 HA CYS 54 0.572 -5.754 -1.448
418 HB2 CYS 54 1HB CYS 54 2.451 -7.023 -0.706
419 HB3 CYS 54 2HB CYS 54 1.324 -6.950 0.644
420 HG CYS 54 HG CYS 54 0.315 -9.605 -0.531
421 H ASP 55 H ASP 55 1.950 -6.343 -3.231
422 HA ASP 55 HA ASP 55 0.577 -7.657 -5.305
423 HB2 ASP 55 1HB ASP 55 2.254 -5.882 -5.682
424 HB3 ASP 55 2HB ASP 55 3.521 -6.979 -5.140
Start of MODEL 17
1 H1 ALA 1 H ALA 1 -14.403 1.530 2.846
2 HA ALA 1 HA ALA 1 -14.719 0.537 0.136
3 HB1 ALA 1 1HB ALA 1 -14.743 3.079 1.338
4 HB2 ALA 1 2HB ALA 1 -13.355 3.050 0.250
5 HB3 ALA 1 3HB ALA 1 -14.965 2.684 -0.367
6 H LYS 2 H LYS 2 -12.933 0.722 -1.424
7 HA LYS 2 HA LYS 2 -10.352 0.045 -0.173
8 HB2 LYS 2 1HB LYS 2 -11.545 -0.938 -2.770
9 HB3 LYS 2 2HB LYS 2 -9.903 -1.280 -2.242
10 HG2 LYS 2 1HG LYS 2 -11.242 -2.130 -0.085
11 HG3 LYS 2 2HG LYS 2 -12.466 -2.412 -1.325
12 HD2 LYS 2 1HD LYS 2 -10.712 -3.632 -2.642
13 HD3 LYS 2 2HD LYS 2 -9.657 -3.502 -1.232
14 HE2 LYS 2 1HE LYS 2 -10.657 -5.630 -1.083
15 HE3 LYS 2 2HE LYS 2 -11.514 -4.622 0.082
16 HZ1 LYS 2 3HZ LYS 2 -12.620 -4.769 -2.613
17 HZ2 LYS 2 1HZ LYS 2 -13.412 -4.682 -1.121
18 HZ3 LYS 2 2HZ LYS 2 -12.766 -6.153 -1.651
19 H TYR 3 H TYR 3 -8.453 0.448 -1.664
20 HA TYR 3 HA TYR 3 -8.840 2.735 -3.443
21 HB2 TYR 3 1HB TYR 3 -7.022 2.718 -1.032
22 HB3 TYR 3 2HB TYR 3 -6.861 3.872 -2.351
23 HD1 TYR 3 2HD TYR 3 -8.657 5.531 -2.765
24 HD2 TYR 3 1HD TYR 3 -8.737 2.947 0.614
25 HE1 TYR 3 2HE TYR 3 -10.323 6.990 -1.696
26 HE2 TYR 3 1HE TYR 3 -10.404 4.398 1.692
27 HH TYR 3 HH TYR 3 -11.345 7.477 0.284
28 H THR 4 H THR 4 -7.681 2.536 -5.243
29 HA THR 4 HA THR 4 -5.860 0.317 -5.528
30 HB THR 4 HB THR 4 -7.455 0.943 -7.329
31 HG1 THR 4 1HG THR 4 -6.014 -0.035 -8.517
32 HG21 THR 4 3HG2 THR 4 -7.225 3.406 -7.046
33 HG22 THR 4 1HG2 THR 4 -7.048 2.871 -8.718
34 HG23 THR 4 2HG2 THR 4 -5.621 3.299 -7.773
35 H GLY 5 H GLY 5 -3.683 0.370 -5.622
36 HA2 GLY 5 1HA GLY 5 -2.178 2.711 -6.231
37 HA3 GLY 5 2HA GLY 5 -2.206 2.420 -4.498
38 H LYS 6 H LYS 6 0.181 2.300 -5.022
39 HA LYS 6 HA LYS 6 0.901 -0.507 -5.212
40 HB2 LYS 6 1HB LYS 6 1.980 1.585 -7.106
41 HB3 LYS 6 2HB LYS 6 2.739 0.019 -6.853
42 HG2 LYS 6 1HG LYS 6 1.496 -0.488 -8.673
43 HG3 LYS 6 2HG LYS 6 0.291 -0.829 -7.431
44 HD2 LYS 6 1HD LYS 6 -1.049 0.618 -8.468
45 HD3 LYS 6 2HD LYS 6 0.042 1.899 -7.933
46 HE2 LYS 6 1HE LYS 6 1.219 1.891 -9.966
47 HE3 LYS 6 2HE LYS 6 0.541 0.337 -10.450
48 HZ1 LYS 6 3HZ LYS 6 -1.262 2.617 -10.024
49 HZ2 LYS 6 1HZ LYS 6 -1.440 1.285 -11.052
50 HZ3 LYS 6 2HZ LYS 6 -0.372 2.532 -11.460
51 H CYS 7 H CYS 7 3.319 -0.772 -4.794
52 HA CYS 7 HA CYS 7 4.187 1.256 -2.841
53 HB2 CYS 7 1HB CYS 7 4.272 -1.740 -2.743
54 HB3 CYS 7 2HB CYS 7 5.453 -0.798 -1.841
55 HG CYS 7 HG CYS 7 3.650 -1.387 0.070
56 H THR 8 H THR 8 6.595 1.182 -2.430
57 HA THR 8 HA THR 8 8.025 0.724 -4.969
58 HB THR 8 HB THR 8 9.324 2.659 -4.654
59 HG1 THR 8 1HG THR 8 9.453 3.750 -2.710
60 HG21 THR 8 3HG2 THR 8 6.642 3.526 -3.593
61 HG22 THR 8 1HG2 THR 8 6.892 3.033 -5.268
62 HG23 THR 8 2HG2 THR 8 7.751 4.432 -4.623
63 H LYS 9 H LYS 9 10.131 -0.066 -4.873
64 HA LYS 9 HA LYS 9 10.706 -1.937 -2.891
65 HB2 LYS 9 1HB LYS 9 13.065 -1.840 -3.869
66 HB3 LYS 9 2HB LYS 9 11.758 -2.251 -4.971
67 HG2 LYS 9 1HG LYS 9 11.971 -0.337 -6.162
68 HG3 LYS 9 2HG LYS 9 12.478 0.610 -4.761
69 HD2 LYS 9 1HD LYS 9 14.419 0.503 -6.022
70 HD3 LYS 9 2HD LYS 9 14.633 -0.830 -4.885
71 HE2 LYS 9 1HE LYS 9 13.263 -1.965 -7.010
72 HE3 LYS 9 2HE LYS 9 14.408 -0.868 -7.778
73 HZ1 LYS 9 3HZ LYS 9 15.235 -3.179 -7.362
74 HZ2 LYS 9 1HZ LYS 9 15.202 -2.831 -5.706
75 HZ3 LYS 9 2HZ LYS 9 16.211 -1.949 -6.735
76 H SER 10 H SER 10 11.341 1.460 -3.021
77 HA SER 10 HA SER 10 13.123 1.285 -0.695
78 HB2 SER 10 1HB SER 10 13.351 3.831 -1.222
79 HB3 SER 10 2HB SER 10 14.166 2.663 -2.262
80 HG SER 10 HG SER 10 12.770 4.441 -3.219
81 H LYS 11 H LYS 11 10.062 1.088 -0.888
82 HA LYS 11 HA LYS 11 9.460 2.227 1.591
83 HB2 LYS 11 1HB LYS 11 9.332 4.086 -0.596
84 HB3 LYS 11 2HB LYS 11 7.716 3.829 0.049
85 HG2 LYS 11 1HG LYS 11 10.128 4.639 1.659
86 HG3 LYS 11 2HG LYS 11 8.845 5.720 1.112
87 HD2 LYS 11 1HD LYS 11 7.227 4.604 2.468
88 HD3 LYS 11 2HD LYS 11 8.365 3.314 2.861
89 HE2 LYS 11 1HE LYS 11 8.638 4.537 4.744
90 HE3 LYS 11 2HE LYS 11 9.775 5.420 3.727
91 HZ1 LYS 11 3HZ LYS 11 8.496 7.230 3.757
92 HZ2 LYS 11 1HZ LYS 11 7.697 6.515 5.066
93 HZ3 LYS 11 2HZ LYS 11 7.067 6.359 3.504
94 H ASN 12 H ASN 12 8.404 0.323 1.976
95 HA ASN 12 HA ASN 12 6.400 -0.684 0.170
96 HB2 ASN 12 1HB ASN 12 7.778 -2.235 1.472
97 HB3 ASN 12 2HB ASN 12 7.149 -1.555 2.970
98 HD21 ASN 12 2HD2 ASN 12 6.174 -3.344 3.755
99 HD22 ASN 12 1HD2 ASN 12 4.834 -4.128 2.995
100 H GLU 13 H GLU 13 5.334 1.571 0.387
101 HA GLU 13 HA GLU 13 3.167 1.293 2.345
102 HB2 GLU 13 1HB GLU 13 3.262 3.560 3.018
103 HB3 GLU 13 2HB GLU 13 4.912 2.962 3.117
104 HG2 GLU 13 1HG GLU 13 5.442 4.019 0.994
105 HG3 GLU 13 2HG GLU 13 3.781 4.590 0.853
106 H CYS 14 H CYS 14 1.185 1.678 1.541
107 HA CYS 14 HA CYS 14 0.880 2.028 -1.275
108 HB2 CYS 14 1HB CYS 14 -0.616 0.748 0.482
109 HB3 CYS 14 2HB CYS 14 -1.425 2.306 0.609
110 HG CYS 14 HG CYS 14 -1.611 2.248 -2.387
111 H LYS 15 H LYS 15 1.555 4.013 -1.957
112 HA LYS 15 HA LYS 15 0.733 6.428 -0.611
113 HB2 LYS 15 1HB LYS 15 2.000 6.288 -3.337
114 HB3 LYS 15 2HB LYS 15 2.095 7.585 -2.154
115 HG2 LYS 15 1HG LYS 15 3.274 5.774 -0.691
116 HG3 LYS 15 2HG LYS 15 3.561 4.993 -2.247
117 HD2 LYS 15 1HD LYS 15 4.173 7.768 -2.487
118 HD3 LYS 15 2HD LYS 15 4.994 7.129 -1.061
119 HE2 LYS 15 1HE LYS 15 6.362 5.808 -2.280
120 HE3 LYS 15 2HE LYS 15 5.116 5.440 -3.472
121 HZ1 LYS 15 3HZ LYS 15 7.226 7.234 -3.713
122 HZ2 LYS 15 1HZ LYS 15 5.811 8.160 -3.660
123 HZ3 LYS 15 2HZ LYS 15 5.983 6.945 -4.823
124 H TYR 16 H TYR 16 -1.597 5.500 -0.990
125 HA TYR 16 HA TYR 16 -2.641 6.297 -3.603
126 HB2 TYR 16 1HB TYR 16 -4.615 5.098 -3.056
127 HB3 TYR 16 2HB TYR 16 -3.277 4.098 -2.500
128 HD1 TYR 16 1HD TYR 16 -2.813 3.870 -0.096
129 HD2 TYR 16 2HD TYR 16 -6.169 6.075 -1.505
130 HE1 TYR 16 1HE TYR 16 -3.802 3.791 2.155
131 HE2 TYR 16 2HE TYR 16 -7.166 6.003 0.742
132 HH TYR 16 HH TYR 16 -6.640 5.631 2.980
133 H LYS 17 H LYS 17 -5.012 7.259 -3.320
134 HA LYS 17 HA LYS 17 -4.811 9.501 -1.418
135 HB2 LYS 17 1HB LYS 17 -6.119 10.805 -3.167
136 HB3 LYS 17 2HB LYS 17 -4.438 10.458 -3.547
137 HG2 LYS 17 1HG LYS 17 -5.217 8.517 -4.902
138 HG3 LYS 17 2HG LYS 17 -6.873 9.060 -4.627
139 HD2 LYS 17 1HD LYS 17 -6.479 10.112 -6.609
140 HD3 LYS 17 2HD LYS 17 -5.859 11.351 -5.515
141 HE2 LYS 17 1HE LYS 17 -3.645 10.815 -5.964
142 HE3 LYS 17 2HE LYS 17 -4.051 9.206 -6.557
143 HZ1 LYS 17 3HZ LYS 17 -5.037 11.561 -8.010
144 HZ2 LYS 17 1HZ LYS 17 -4.677 10.013 -8.592
145 HZ3 LYS 17 2HZ LYS 17 -3.426 11.087 -8.212
146 H ASN 18 H ASN 18 -6.614 10.049 -0.278
147 HA ASN 18 HA ASN 18 -9.063 8.505 -0.817
148 HB2 ASN 18 1HB ASN 18 -9.292 7.859 1.376
149 HB3 ASN 18 2HB ASN 18 -7.535 7.894 1.266
150 HD21 ASN 18 2HD2 ASN 18 -6.739 10.321 1.592
151 HD22 ASN 18 1HD2 ASN 18 -7.325 11.040 3.050
152 H ASP 19 H ASP 19 -10.995 9.484 0.345
153 HA ASP 19 HA ASP 19 -12.394 11.233 0.777
154 HB2 ASP 19 1HB ASP 19 -10.330 12.017 2.143
155 HB3 ASP 19 2HB ASP 19 -10.065 13.133 0.807
156 H ALA 20 H ALA 20 -9.774 12.802 -1.063
157 HA ALA 20 HA ALA 20 -11.042 12.743 -3.559
158 HB1 ALA 20 1HB ALA 20 -11.609 15.193 -1.910
159 HB2 ALA 20 2HB ALA 20 -11.704 15.180 -3.671
160 HB3 ALA 20 3HB ALA 20 -12.759 14.133 -2.724
161 H GLY 21 H GLY 21 -8.527 12.241 -3.097
162 HA2 GLY 21 1HA GLY 21 -6.567 12.833 -4.273
163 HA3 GLY 21 2HA GLY 21 -7.134 14.495 -4.336
164 H LYS 22 H LYS 22 -7.337 12.883 -1.307
165 HA LYS 22 HA LYS 22 -5.467 14.739 -0.143
166 HB2 LYS 22 1HB LYS 22 -7.691 13.369 0.777
167 HB3 LYS 22 2HB LYS 22 -6.355 12.561 1.586
168 HG2 LYS 22 1HG LYS 22 -6.489 15.540 1.596
169 HG3 LYS 22 2HG LYS 22 -7.518 14.611 2.691
170 HD2 LYS 22 1HD LYS 22 -5.049 13.418 2.978
171 HD3 LYS 22 2HD LYS 22 -4.653 15.129 2.804
172 HE2 LYS 22 1HE LYS 22 -6.820 15.119 4.524
173 HE3 LYS 22 2HE LYS 22 -5.880 13.715 5.026
174 HZ1 LYS 22 3HZ LYS 22 -4.685 16.400 4.643
175 HZ2 LYS 22 1HZ LYS 22 -3.993 15.056 5.403
176 HZ3 LYS 22 2HZ LYS 22 -5.287 15.864 6.131
177 H ASP 23 H ASP 23 -3.652 14.106 1.183
178 HA ASP 23 HA ASP 23 -2.160 11.926 -0.037
179 HB2 ASP 23 1HB ASP 23 -1.147 13.799 2.095
180 HB3 ASP 23 2HB ASP 23 -0.216 12.898 0.902
181 H THR 24 H THR 24 -2.373 9.961 0.792
182 HA THR 24 HA THR 24 -2.270 9.647 3.709
183 HB THR 24 HB THR 24 -4.246 8.235 1.906
184 HG1 THR 24 1HG THR 24 -4.608 10.089 4.045
185 HG21 THR 24 3HG2 THR 24 -5.077 7.352 4.155
186 HG22 THR 24 1HG2 THR 24 -3.511 7.847 4.798
187 HG23 THR 24 2HG2 THR 24 -3.596 6.641 3.514
188 H PHE 25 H PHE 25 -0.746 8.252 4.287
189 HA PHE 25 HA PHE 25 0.039 6.152 2.377
190 HB2 PHE 25 1HB PHE 25 1.908 7.649 4.226
191 HB3 PHE 25 2HB PHE 25 2.358 6.419 3.049
192 HD1 PHE 25 2HD PHE 25 0.967 9.829 3.401
193 HD2 PHE 25 1HD PHE 25 2.794 6.982 0.817
194 HE1 PHE 25 2HE PHE 25 1.277 11.578 1.700
195 HE2 PHE 25 1HE PHE 25 3.109 8.728 -0.889
196 HZ PHE 25 HZ PHE 25 2.349 11.029 -0.449
197 H ILE 26 H ILE 26 0.656 4.160 3.241
198 HA ILE 26 HA ILE 26 0.690 3.731 6.089
199 HB ILE 26 HB ILE 26 -1.694 3.718 5.813
200 HG12 ILE 26 1HG1 ILE 26 -2.226 1.433 6.528
201 HG13 ILE 26 2HG1 ILE 26 -0.677 0.868 5.912
202 HG21 ILE 26 1HG2 ILE 26 -1.080 2.618 3.265
203 HG22 ILE 26 2HG2 ILE 26 -2.161 1.508 4.105
204 HG23 ILE 26 3HG2 ILE 26 -2.632 3.191 3.873
205 HD11 ILE 26 3HD1 ILE 26 -1.077 2.818 8.169
206 HD12 ILE 26 1HD1 ILE 26 -0.628 1.119 8.323
207 HD13 ILE 26 2HD1 ILE 26 0.477 2.258 7.552
208 H LYS 27 H LYS 27 2.358 2.410 6.318
209 HA LYS 27 HA LYS 27 3.419 0.807 4.254
210 HB2 LYS 27 1HB LYS 27 4.695 1.699 6.216
211 HB3 LYS 27 2HB LYS 27 3.889 0.504 7.224
212 HG2 LYS 27 1HG LYS 27 4.852 -1.150 5.398
213 HG3 LYS 27 2HG LYS 27 6.025 0.154 5.196
214 HD2 LYS 27 1HD LYS 27 5.344 -0.966 7.900
215 HD3 LYS 27 2HD LYS 27 6.584 -1.693 6.877
216 HE2 LYS 27 1HE LYS 27 6.781 1.222 7.204
217 HE3 LYS 27 2HE LYS 27 7.036 0.287 8.676
218 HZ1 LYS 27 3HZ LYS 27 8.438 -0.886 6.519
219 HZ2 LYS 27 1HZ LYS 27 9.045 -0.278 7.977
220 HZ3 LYS 27 2HZ LYS 27 8.855 0.748 6.645
221 H CYS 28 H CYS 28 2.468 -0.928 3.423
222 HA CYS 28 HA CYS 28 0.374 -2.371 4.491
223 HB2 CYS 28 1HB CYS 28 2.506 -3.464 2.646
224 HB3 CYS 28 2HB CYS 28 0.873 -4.087 2.841
225 HG CYS 28 HG CYS 28 1.598 -0.982 1.597
226 HA PRO 29 HA PRO 29 1.992 -4.963 7.641
227 HB2 PRO 29 1HB PRO 29 0.395 -7.143 7.384
228 HB3 PRO 29 2HB PRO 29 -0.175 -5.608 8.049
229 HG2 PRO 29 1HG PRO 29 -0.506 -6.714 5.287
230 HG3 PRO 29 2HG PRO 29 -1.693 -5.884 6.309
231 HD2 PRO 29 1HD PRO 29 -0.368 -4.634 4.306
232 HD3 PRO 29 2HD PRO 29 -0.867 -3.795 5.789
233 H LYS 30 H LYS 30 4.008 -5.142 6.249
234 HA LYS 30 HA LYS 30 4.493 -7.972 5.717
235 HB2 LYS 30 1HB LYS 30 5.343 -5.840 3.755
236 HB3 LYS 30 2HB LYS 30 5.531 -7.580 3.584
237 HG2 LYS 30 1HG LYS 30 2.857 -6.216 3.753
238 HG3 LYS 30 2HG LYS 30 3.689 -6.555 2.233
239 HD2 LYS 30 1HD LYS 30 3.396 -8.828 2.423
240 HD3 LYS 30 2HD LYS 30 3.295 -8.774 4.184
241 HE2 LYS 30 1HE LYS 30 1.078 -8.760 4.060
242 HE3 LYS 30 2HE LYS 30 1.135 -7.261 3.136
243 HZ1 LYS 30 3HZ LYS 30 0.604 -8.335 1.282
244 HZ2 LYS 30 1HZ LYS 30 0.250 -9.686 2.237
245 HZ3 LYS 30 2HZ LYS 30 1.778 -9.529 1.528
246 H PHE 31 H PHE 31 5.477 -7.378 7.892
247 HA PHE 31 HA PHE 31 8.058 -6.027 7.642
248 HB2 PHE 31 1HB PHE 31 8.024 -6.538 10.222
249 HB3 PHE 31 2HB PHE 31 7.055 -5.225 9.563
250 HD1 PHE 31 2HD PHE 31 6.993 -8.567 11.033
251 HD2 PHE 31 1HD PHE 31 4.648 -5.387 9.451
252 HE1 PHE 31 2HE PHE 31 4.973 -9.575 12.011
253 HE2 PHE 31 1HE PHE 31 2.624 -6.390 10.427
254 HZ PHE 31 HZ PHE 31 2.785 -8.488 11.708
255 H ASP 32 H ASP 32 9.210 -7.597 6.491
256 HA ASP 32 HA ASP 32 10.632 -9.360 6.265
257 HB2 ASP 32 1HB ASP 32 11.183 -8.539 8.682
258 HB3 ASP 32 2HB ASP 32 10.341 -10.003 9.181
259 H ASN 33 H ASN 33 8.589 -10.184 5.172
260 HA ASN 33 HA ASN 33 8.193 -12.906 5.975
261 HB2 ASN 33 1HB ASN 33 6.486 -11.238 7.225
262 HB3 ASN 33 2HB ASN 33 5.590 -11.503 5.732
263 HD21 ASN 33 2HD2 ASN 33 4.001 -12.818 6.342
264 HD22 ASN 33 1HD2 ASN 33 4.217 -14.349 7.112
265 H LYS 34 H LYS 34 6.838 -10.278 3.995
266 HA LYS 34 HA LYS 34 7.542 -11.448 1.543
267 HB2 LYS 34 1HB LYS 34 5.542 -12.901 2.534
268 HB3 LYS 34 2HB LYS 34 4.580 -11.610 1.825
269 HG2 LYS 34 1HG LYS 34 6.446 -12.336 -0.133
270 HG3 LYS 34 2HG LYS 34 5.842 -13.846 0.554
271 HD2 LYS 34 1HD LYS 34 3.906 -11.688 -0.153
272 HD3 LYS 34 2HD LYS 34 4.590 -12.686 -1.438
273 HE2 LYS 34 1HE LYS 34 3.457 -14.531 -0.785
274 HE3 LYS 34 2HE LYS 34 3.585 -14.134 0.927
275 HZ1 LYS 34 3HZ LYS 34 1.328 -13.930 0.404
276 HZ2 LYS 34 1HZ LYS 34 1.632 -13.108 -1.043
277 HZ3 LYS 34 2HZ LYS 34 1.895 -12.336 0.439
278 H LYS 35 H LYS 35 7.964 -8.977 2.273
279 HA LYS 35 HA LYS 35 5.824 -7.188 1.558
280 HB2 LYS 35 1HB LYS 35 7.633 -5.437 1.770
281 HB3 LYS 35 2HB LYS 35 7.330 -6.393 3.216
282 HG2 LYS 35 1HG LYS 35 9.398 -7.228 3.236
283 HG3 LYS 35 2HG LYS 35 9.396 -7.521 1.495
284 HD2 LYS 35 1HD LYS 35 10.562 -5.661 1.103
285 HD3 LYS 35 2HD LYS 35 9.470 -4.691 2.095
286 HE2 LYS 35 1HE LYS 35 10.694 -5.714 4.101
287 HE3 LYS 35 2HE LYS 35 11.917 -6.217 2.934
288 HZ1 LYS 35 3HZ LYS 35 12.714 -4.156 2.796
289 HZ2 LYS 35 1HZ LYS 35 11.822 -3.814 4.192
290 HZ3 LYS 35 2HZ LYS 35 11.179 -3.457 2.669
291 H CYS 36 H CYS 36 6.479 -5.344 -0.046
292 HA CYS 36 HA CYS 36 6.433 -6.345 -2.614
293 HB2 CYS 36 1HB CYS 36 5.841 -4.014 -1.939
294 HB3 CYS 36 2HB CYS 36 7.558 -3.656 -1.808
295 HG CYS 36 HG CYS 36 7.550 -2.705 -4.197
296 H THR 37 H THR 37 7.961 -6.499 -4.287
297 HA THR 37 HA THR 37 10.786 -6.418 -3.494
298 HB THR 37 HB THR 37 11.168 -8.550 -4.760
299 HG1 THR 37 1HG THR 37 9.172 -8.569 -5.909
300 HG21 THR 37 3HG2 THR 37 10.098 -10.015 -2.942
301 HG22 THR 37 1HG2 THR 37 9.505 -8.503 -2.258
302 HG23 THR 37 2HG2 THR 37 11.239 -8.773 -2.427
303 H LYS 38 H LYS 38 9.390 -4.513 -5.016
304 HA LYS 38 HA LYS 38 11.076 -4.230 -7.234
305 HB2 LYS 38 1HB LYS 38 8.698 -5.821 -7.708
306 HB3 LYS 38 2HB LYS 38 8.710 -4.378 -8.715
307 HG2 LYS 38 1HG LYS 38 11.229 -5.196 -9.098
308 HG3 LYS 38 2HG LYS 38 10.461 -6.752 -8.775
309 HD2 LYS 38 1HD LYS 38 9.256 -6.704 -10.694
310 HD3 LYS 38 2HD LYS 38 9.039 -4.954 -10.639
311 HE2 LYS 38 1HE LYS 38 10.579 -4.814 -12.241
312 HE3 LYS 38 2HE LYS 38 11.767 -5.308 -11.035
313 HZ1 LYS 38 3HZ LYS 38 10.231 -7.169 -12.767
314 HZ2 LYS 38 1HZ LYS 38 11.440 -7.595 -11.663
315 HZ3 LYS 38 2HZ LYS 38 11.831 -6.690 -13.038
316 H ASP 39 H ASP 39 10.028 -2.515 -8.839
317 HA ASP 39 HA ASP 39 9.119 -0.350 -7.116
318 HB2 ASP 39 1HB ASP 39 10.399 -0.538 -9.799
319 HB3 ASP 39 2HB ASP 39 9.398 0.873 -9.470
320 H ASN 40 H ASN 40 7.035 0.088 -6.906
321 HA ASN 40 HA ASN 40 4.791 0.179 -7.281
322 HB2 ASN 40 1HB ASN 40 6.043 0.941 -9.867
323 HB3 ASN 40 2HB ASN 40 4.318 0.587 -9.892
324 HD21 ASN 40 2HD2 ASN 40 6.649 2.352 -7.879
325 HD22 ASN 40 1HD2 ASN 40 5.653 3.746 -7.653
326 H ASN 41 H ASN 41 4.910 -2.188 -6.729
327 HA ASN 41 HA ASN 41 4.597 -4.063 -8.892
328 HB2 ASN 41 1HB ASN 41 4.834 -4.187 -5.958
329 HB3 ASN 41 2HB ASN 41 3.806 -5.429 -6.666
330 HD21 ASN 41 2HD2 ASN 41 5.705 -6.618 -5.600
331 HD22 ASN 41 1HD2 ASN 41 7.022 -7.006 -6.648
332 H LYS 42 H LYS 42 2.467 -3.877 -6.081
333 HA LYS 42 HA LYS 42 0.173 -2.892 -7.301
334 HB2 LYS 42 1HB LYS 42 0.087 -4.698 -8.811
335 HB3 LYS 42 2HB LYS 42 0.555 -5.863 -7.579
336 HG2 LYS 42 1HG LYS 42 -1.552 -6.082 -6.786
337 HG3 LYS 42 2HG LYS 42 -1.978 -4.405 -7.136
338 HD2 LYS 42 1HD LYS 42 -2.155 -4.933 -9.509
339 HD3 LYS 42 2HD LYS 42 -1.682 -6.602 -9.185
340 HE2 LYS 42 1HE LYS 42 -3.689 -7.093 -8.119
341 HE3 LYS 42 2HE LYS 42 -4.049 -5.396 -7.804
342 HZ1 LYS 42 3HZ LYS 42 -3.848 -5.943 -10.598
343 HZ2 LYS 42 1HZ LYS 42 -5.110 -5.222 -9.731
344 HZ3 LYS 42 2HZ LYS 42 -5.028 -6.906 -9.861
345 H CYS 43 H CYS 43 -0.932 -2.215 -5.597
346 HA CYS 43 HA CYS 43 -1.424 -4.036 -3.373
347 HB2 CYS 43 1HB CYS 43 -0.254 -1.274 -2.975
348 HB3 CYS 43 2HB CYS 43 -0.773 -2.365 -1.697
349 HG CYS 43 HG CYS 43 1.574 -3.334 -1.377
350 H THR 44 H THR 44 -3.072 -3.151 -1.859
351 HA THR 44 HA THR 44 -4.730 -0.996 -2.851
352 HB THR 44 HB THR 44 -6.792 -2.517 -2.778
353 HG1 THR 44 1HG THR 44 -6.147 -4.454 -2.082
354 HG21 THR 44 3HG2 THR 44 -6.741 -2.723 -5.061
355 HG22 THR 44 1HG2 THR 44 -5.075 -3.298 -5.082
356 HG23 THR 44 2HG2 THR 44 -5.414 -1.585 -4.834
357 H VAL 45 H VAL 45 -5.173 0.137 -1.086
358 HA VAL 45 HA VAL 45 -5.219 -1.140 1.520
359 HB VAL 45 HB VAL 45 -5.366 1.738 0.646
360 HG11 VAL 45 1HG1 VAL 45 -6.827 1.626 2.520
361 HG12 VAL 45 2HG1 VAL 45 -5.710 0.587 3.408
362 HG13 VAL 45 3HG1 VAL 45 -5.292 2.273 3.097
363 HG21 VAL 45 3HG2 VAL 45 -3.358 0.497 2.492
364 HG22 VAL 45 1HG2 VAL 45 -3.189 0.358 0.742
365 HG23 VAL 45 2HG2 VAL 45 -3.212 1.949 1.503
366 H ASP 46 H ASP 46 -6.971 -1.323 2.854
367 HA ASP 46 HA ASP 46 -9.583 -0.627 1.679
368 HB2 ASP 46 1HB ASP 46 -9.118 -3.078 1.822
369 HB3 ASP 46 2HB ASP 46 -8.997 -2.911 3.572
370 H THR 47 H THR 47 -10.377 1.093 2.690
371 HA THR 47 HA THR 47 -9.613 1.895 5.301
372 HB THR 47 HB THR 47 -11.898 3.298 4.904
373 HG1 THR 47 1HG THR 47 -12.365 3.462 2.795
374 HG21 THR 47 3HG2 THR 47 -9.738 4.307 5.274
375 HG22 THR 47 1HG2 THR 47 -10.458 5.020 3.831
376 HG23 THR 47 2HG2 THR 47 -9.187 3.807 3.675
377 H TYR 48 H TYR 48 -11.785 -0.442 4.224
378 HA TYR 48 HA TYR 48 -13.941 -0.305 5.937
379 HB2 TYR 48 1HB TYR 48 -13.925 -1.972 4.232
380 HB3 TYR 48 2HB TYR 48 -12.450 -2.699 4.861
381 HD1 TYR 48 2HD TYR 48 -15.934 -1.929 5.979
382 HD2 TYR 48 1HD TYR 48 -12.649 -4.630 6.106
383 HE1 TYR 48 2HE TYR 48 -17.282 -3.496 7.314
384 HE2 TYR 48 1HE TYR 48 -13.988 -6.205 7.439
385 HH TYR 48 HH TYR 48 -15.955 -6.123 8.957
386 H ASN 49 H ASN 49 -10.889 -2.055 6.524
387 HA ASN 49 HA ASN 49 -11.075 -1.435 9.353
388 HB2 ASN 49 1HB ASN 49 -10.749 -3.841 9.989
389 HB3 ASN 49 2HB ASN 49 -12.335 -3.483 9.312
390 HD21 ASN 49 2HD2 ASN 49 -12.164 -5.906 9.107
391 HD22 ASN 49 1HD2 ASN 49 -11.529 -6.514 7.620
392 H ASN 50 H ASN 50 -9.275 -0.565 7.386
393 HA ASN 50 HA ASN 50 -7.056 -0.368 6.912
394 HB2 ASN 50 1HB ASN 50 -7.155 -1.133 9.796
395 HB3 ASN 50 2HB ASN 50 -5.585 -1.089 9.001
396 HD21 ASN 50 2HD2 ASN 50 -5.728 1.005 7.351
397 HD22 ASN 50 1HD2 ASN 50 -6.001 2.468 8.228
398 H ALA 51 H ALA 51 -7.814 -2.402 5.542
399 HA ALA 51 HA ALA 51 -5.854 -4.536 6.083
400 HB1 ALA 51 1HB ALA 51 -7.520 -5.991 4.748
401 HB2 ALA 51 2HB ALA 51 -7.870 -5.625 6.437
402 HB3 ALA 51 3HB ALA 51 -8.692 -4.737 5.154
403 H VAL 52 H VAL 52 -4.315 -3.469 4.768
404 HA VAL 52 HA VAL 52 -4.957 -2.990 1.976
405 HB VAL 52 HB VAL 52 -3.528 -1.379 3.119
406 HG11 VAL 52 1HG1 VAL 52 -1.150 -3.074 3.224
407 HG12 VAL 52 2HG1 VAL 52 -1.768 -1.909 4.399
408 HG13 VAL 52 3HG1 VAL 52 -2.413 -3.551 4.359
409 HG21 VAL 52 3HG2 VAL 52 -2.000 -2.940 1.035
410 HG22 VAL 52 1HG2 VAL 52 -3.248 -1.737 0.704
411 HG23 VAL 52 2HG2 VAL 52 -1.737 -1.253 1.476
412 H ASP 53 H ASP 53 -4.012 -4.049 0.230
413 HA ASP 53 HA ASP 53 -2.899 -6.698 0.866
414 HB2 ASP 53 1HB ASP 53 -5.063 -6.660 -0.373
415 HB3 ASP 53 2HB ASP 53 -4.254 -5.810 -1.687
416 H CYS 54 H CYS 54 -1.362 -7.577 -0.769
417 HA CYS 54 HA CYS 54 0.185 -5.549 -2.190
418 HB2 CYS 54 1HB CYS 54 1.134 -5.796 0.131
419 HB3 CYS 54 2HB CYS 54 1.508 -7.469 -0.268
420 HG CYS 54 HG CYS 54 3.704 -7.030 -1.549
421 H ASP 55 H ASP 55 1.610 -6.416 -3.786
422 HA ASP 55 HA ASP 55 0.600 -8.851 -4.955
423 HB2 ASP 55 1HB ASP 55 1.571 -6.545 -6.025
424 HB3 ASP 55 2HB ASP 55 2.982 -7.591 -6.159
Start of MODEL 18
1 H1 ALA 1 H ALA 1 -14.468 -1.249 1.077
2 HA ALA 1 HA ALA 1 -14.400 -2.381 -1.639
3 HB1 ALA 1 1HB ALA 1 -15.514 -0.563 -2.314
4 HB2 ALA 1 2HB ALA 1 -15.210 0.298 -0.804
5 HB3 ALA 1 3HB ALA 1 -13.988 0.287 -2.075
6 H LYS 2 H LYS 2 -12.413 -2.842 -2.305
7 HA LYS 2 HA LYS 2 -10.135 -1.979 -0.737
8 HB2 LYS 2 1HB LYS 2 -10.500 -3.913 -3.013
9 HB3 LYS 2 2HB LYS 2 -8.898 -3.445 -2.457
10 HG2 LYS 2 1HG LYS 2 -9.316 -4.348 -0.284
11 HG3 LYS 2 2HG LYS 2 -11.009 -4.646 -0.681
12 HD2 LYS 2 1HD LYS 2 -9.683 -5.977 -2.680
13 HD3 LYS 2 2HD LYS 2 -8.629 -6.231 -1.286
14 HE2 LYS 2 1HE LYS 2 -11.226 -6.619 -0.335
15 HE3 LYS 2 2HE LYS 2 -11.183 -7.421 -1.904
16 HZ1 LYS 2 3HZ LYS 2 -10.388 -8.588 0.328
17 HZ2 LYS 2 1HZ LYS 2 -8.917 -7.894 -0.140
18 HZ3 LYS 2 2HZ LYS 2 -9.719 -8.958 -1.182
19 H TYR 3 H TYR 3 -8.519 -0.630 -1.389
20 HA TYR 3 HA TYR 3 -9.057 0.938 -3.808
21 HB2 TYR 3 1HB TYR 3 -7.521 1.506 -1.284
22 HB3 TYR 3 2HB TYR 3 -7.301 2.490 -2.727
23 HD1 TYR 3 2HD TYR 3 -10.614 1.285 -2.592
24 HD2 TYR 3 1HD TYR 3 -8.054 4.257 -0.945
25 HE1 TYR 3 2HE TYR 3 -12.580 2.628 -1.973
26 HE2 TYR 3 1HE TYR 3 -10.012 5.608 -0.321
27 HH TYR 3 HH TYR 3 -13.268 4.677 -1.286
28 H THR 4 H THR 4 -7.660 1.043 -5.478
29 HA THR 4 HA THR 4 -5.553 -0.916 -5.601
30 HB THR 4 HB THR 4 -6.283 1.172 -7.662
31 HG1 THR 4 1HG THR 4 -7.098 -1.537 -7.721
32 HG21 THR 4 3HG2 THR 4 -5.209 -0.356 -9.238
33 HG22 THR 4 1HG2 THR 4 -4.811 -1.454 -7.916
34 HG23 THR 4 2HG2 THR 4 -4.076 0.148 -7.985
35 H GLY 5 H GLY 5 -3.898 -0.310 -4.244
36 HA2 GLY 5 1HA GLY 5 -2.632 2.297 -4.801
37 HA3 GLY 5 2HA GLY 5 -2.512 1.442 -3.272
38 H LYS 6 H LYS 6 -0.190 2.197 -4.132
39 HA LYS 6 HA LYS 6 1.068 -0.275 -5.045
40 HB2 LYS 6 1HB LYS 6 2.092 2.261 -6.233
41 HB3 LYS 6 2HB LYS 6 2.173 0.619 -6.858
42 HG2 LYS 6 1HG LYS 6 -0.275 0.747 -7.310
43 HG3 LYS 6 2HG LYS 6 -0.214 2.451 -6.852
44 HD2 LYS 6 1HD LYS 6 -0.017 2.500 -9.174
45 HD3 LYS 6 2HD LYS 6 1.652 2.636 -8.618
46 HE2 LYS 6 1HE LYS 6 1.959 0.232 -8.973
47 HE3 LYS 6 2HE LYS 6 0.292 0.104 -9.534
48 HZ1 LYS 6 3HZ LYS 6 2.542 0.703 -11.040
49 HZ2 LYS 6 1HZ LYS 6 1.628 2.126 -10.976
50 HZ3 LYS 6 2HZ LYS 6 0.931 0.697 -11.554
51 H CYS 7 H CYS 7 3.358 -0.372 -4.577
52 HA CYS 7 HA CYS 7 4.228 1.564 -2.538
53 HB2 CYS 7 1HB CYS 7 5.373 -0.414 -1.415
54 HB3 CYS 7 2HB CYS 7 3.621 -0.341 -1.271
55 HG CYS 7 HG CYS 7 3.310 -2.188 -3.480
56 H THR 8 H THR 8 6.525 1.789 -2.302
57 HA THR 8 HA THR 8 7.924 1.329 -4.831
58 HB THR 8 HB THR 8 9.611 2.828 -3.202
59 HG1 THR 8 1HG THR 8 6.919 3.730 -2.905
60 HG21 THR 8 3HG2 THR 8 7.654 4.205 -4.982
61 HG22 THR 8 1HG2 THR 8 8.749 3.017 -5.688
62 HG23 THR 8 2HG2 THR 8 9.399 4.423 -4.843
63 H LYS 9 H LYS 9 9.963 0.373 -4.941
64 HA LYS 9 HA LYS 9 10.423 -1.867 -3.384
65 HB2 LYS 9 1HB LYS 9 12.312 -0.220 -5.061
66 HB3 LYS 9 2HB LYS 9 12.791 -1.732 -4.301
67 HG2 LYS 9 1HG LYS 9 10.416 -2.313 -5.640
68 HG3 LYS 9 2HG LYS 9 11.335 -1.284 -6.741
69 HD2 LYS 9 1HD LYS 9 12.364 -3.784 -5.399
70 HD3 LYS 9 2HD LYS 9 11.840 -3.661 -7.080
71 HE2 LYS 9 1HE LYS 9 13.596 -1.920 -7.420
72 HE3 LYS 9 2HE LYS 9 14.172 -2.255 -5.788
73 HZ1 LYS 9 3HZ LYS 9 15.000 -3.513 -8.040
74 HZ2 LYS 9 1HZ LYS 9 13.893 -4.617 -7.393
75 HZ3 LYS 9 2HZ LYS 9 15.206 -4.092 -6.465
76 H SER 10 H SER 10 12.462 1.060 -3.312
77 HA SER 10 HA SER 10 13.837 0.415 -0.976
78 HB2 SER 10 1HB SER 10 13.998 3.074 -0.869
79 HB3 SER 10 2HB SER 10 14.871 2.142 -2.084
80 HG SER 10 HG SER 10 13.754 3.839 -3.066
81 H LYS 11 H LYS 11 10.936 2.422 -1.404
82 HA LYS 11 HA LYS 11 10.506 2.296 1.507
83 HB2 LYS 11 1HB LYS 11 10.329 4.455 -0.382
84 HB3 LYS 11 2HB LYS 11 8.754 4.191 0.353
85 HG2 LYS 11 1HG LYS 11 10.076 5.849 1.569
86 HG3 LYS 11 2HG LYS 11 9.708 4.438 2.564
87 HD2 LYS 11 1HD LYS 11 11.939 3.551 2.162
88 HD3 LYS 11 2HD LYS 11 12.309 4.917 1.107
89 HE2 LYS 11 1HE LYS 11 11.363 5.596 3.817
90 HE3 LYS 11 2HE LYS 11 12.942 4.817 3.728
91 HZ1 LYS 11 3HZ LYS 11 13.625 6.530 2.136
92 HZ2 LYS 11 1HZ LYS 11 13.181 7.197 3.625
93 HZ3 LYS 11 2HZ LYS 11 12.125 7.294 2.308
94 H ASN 12 H ASN 12 9.363 0.419 1.714
95 HA ASN 12 HA ASN 12 7.181 -0.231 -0.045
96 HB2 ASN 12 1HB ASN 12 8.620 -1.962 1.027
97 HB3 ASN 12 2HB ASN 12 7.939 -1.513 2.587
98 HD21 ASN 12 2HD2 ASN 12 6.987 -3.453 3.008
99 HD22 ASN 12 1HD2 ASN 12 5.648 -4.073 2.108
100 H GLU 13 H GLU 13 6.002 1.796 0.317
101 HA GLU 13 HA GLU 13 4.242 1.561 2.660
102 HB2 GLU 13 1HB GLU 13 4.271 3.895 3.062
103 HB3 GLU 13 2HB GLU 13 5.954 3.417 2.885
104 HG2 GLU 13 1HG GLU 13 5.613 4.104 0.404
105 HG3 GLU 13 2HG GLU 13 4.235 5.004 1.037
106 H CYS 14 H CYS 14 2.097 2.252 2.358
107 HA CYS 14 HA CYS 14 1.151 1.951 -0.343
108 HB2 CYS 14 1HB CYS 14 0.103 1.407 2.163
109 HB3 CYS 14 2HB CYS 14 -0.842 2.788 1.617
110 HG CYS 14 HG CYS 14 -0.952 1.073 -0.979
111 H LYS 15 H LYS 15 1.039 3.571 -1.734
112 HA LYS 15 HA LYS 15 0.474 6.275 -0.705
113 HB2 LYS 15 1HB LYS 15 2.716 6.232 -1.558
114 HB3 LYS 15 2HB LYS 15 2.202 5.413 -3.025
115 HG2 LYS 15 1HG LYS 15 0.884 7.431 -3.623
116 HG3 LYS 15 2HG LYS 15 1.573 8.243 -2.215
117 HD2 LYS 15 1HD LYS 15 3.846 7.481 -3.289
118 HD3 LYS 15 2HD LYS 15 2.881 7.414 -4.766
119 HE2 LYS 15 1HE LYS 15 2.184 9.830 -3.581
120 HE3 LYS 15 2HE LYS 15 3.925 9.705 -3.333
121 HZ1 LYS 15 3HZ LYS 15 3.073 8.985 -5.986
122 HZ2 LYS 15 1HZ LYS 15 4.326 10.008 -5.493
123 HZ3 LYS 15 2HZ LYS 15 2.742 10.595 -5.586
124 H TYR 16 H TYR 16 -1.752 6.148 -0.968
125 HA TYR 16 HA TYR 16 -2.658 6.073 -3.770
126 HB2 TYR 16 1HB TYR 16 -4.730 5.006 -3.059
127 HB3 TYR 16 2HB TYR 16 -3.351 4.024 -2.578
128 HD1 TYR 16 1HD TYR 16 -2.490 4.404 -0.136
129 HD2 TYR 16 2HD TYR 16 -6.369 5.501 -1.497
130 HE1 TYR 16 1HE TYR 16 -3.299 4.401 2.186
131 HE2 TYR 16 2HE TYR 16 -7.189 5.502 0.822
132 HH TYR 16 HH TYR 16 -6.240 5.757 3.110
133 H LYS 17 H LYS 17 -5.004 7.029 -3.856
134 HA LYS 17 HA LYS 17 -4.862 9.637 -2.522
135 HB2 LYS 17 1HB LYS 17 -4.978 9.887 -4.877
136 HB3 LYS 17 2HB LYS 17 -6.255 8.685 -5.018
137 HG2 LYS 17 1HG LYS 17 -7.874 10.143 -4.139
138 HG3 LYS 17 2HG LYS 17 -6.650 11.269 -3.545
139 HD2 LYS 17 1HD LYS 17 -7.275 12.378 -5.436
140 HD3 LYS 17 2HD LYS 17 -6.018 11.347 -6.122
141 HE2 LYS 17 1HE LYS 17 -7.497 10.093 -7.283
142 HE3 LYS 17 2HE LYS 17 -8.722 10.178 -6.018
143 HZ1 LYS 17 3HZ LYS 17 -8.063 12.392 -7.885
144 HZ2 LYS 17 1HZ LYS 17 -9.298 12.387 -6.729
145 HZ3 LYS 17 2HZ LYS 17 -9.379 11.342 -8.057
146 H ASN 18 H ASN 18 -6.071 9.897 -0.773
147 HA ASN 18 HA ASN 18 -8.648 8.475 -0.622
148 HB2 ASN 18 1HB ASN 18 -8.348 8.064 1.638
149 HB3 ASN 18 2HB ASN 18 -6.699 7.909 1.036
150 HD21 ASN 18 2HD2 ASN 18 -5.480 10.057 1.020
151 HD22 ASN 18 1HD2 ASN 18 -5.630 11.017 2.450
152 H ASP 19 H ASP 19 -10.353 9.565 0.560
153 HA ASP 19 HA ASP 19 -11.643 11.355 1.141
154 HB2 ASP 19 1HB ASP 19 -9.447 12.034 2.341
155 HB3 ASP 19 2HB ASP 19 -9.243 13.161 1.002
156 H ALA 20 H ALA 20 -9.144 12.902 -0.873
157 HA ALA 20 HA ALA 20 -10.588 12.923 -3.265
158 HB1 ALA 20 1HB ALA 20 -11.832 14.570 -1.493
159 HB2 ALA 20 2HB ALA 20 -10.757 15.694 -2.326
160 HB3 ALA 20 3HB ALA 20 -11.914 14.733 -3.248
161 H GLY 21 H GLY 21 -7.924 12.553 -2.491
162 HA2 GLY 21 1HA GLY 21 -6.085 13.130 -3.977
163 HA3 GLY 21 2HA GLY 21 -6.644 14.795 -3.923
164 H LYS 22 H LYS 22 -6.745 13.128 -0.945
165 HA LYS 22 HA LYS 22 -4.731 14.865 0.157
166 HB2 LYS 22 1HB LYS 22 -6.705 12.914 1.232
167 HB3 LYS 22 2HB LYS 22 -5.298 13.275 2.224
168 HG2 LYS 22 1HG LYS 22 -6.553 15.669 1.160
169 HG3 LYS 22 2HG LYS 22 -7.650 14.701 2.148
170 HD2 LYS 22 1HD LYS 22 -5.745 14.622 3.856
171 HD3 LYS 22 2HD LYS 22 -5.018 15.929 2.918
172 HE2 LYS 22 1HE LYS 22 -7.010 17.291 3.251
173 HE3 LYS 22 2HE LYS 22 -7.774 15.977 4.146
174 HZ1 LYS 22 3HZ LYS 22 -5.412 16.331 5.433
175 HZ2 LYS 22 1HZ LYS 22 -6.907 16.944 5.937
176 HZ3 LYS 22 2HZ LYS 22 -5.855 17.914 5.034
177 H ASP 23 H ASP 23 -2.656 14.405 -0.196
178 HA ASP 23 HA ASP 23 -1.614 11.885 -0.830
179 HB2 ASP 23 1HB ASP 23 -0.523 14.536 -0.144
180 HB3 ASP 23 2HB ASP 23 0.547 13.184 0.212
181 H THR 24 H THR 24 -2.128 10.260 0.566
182 HA THR 24 HA THR 24 -1.113 10.521 3.323
183 HB THR 24 HB THR 24 -3.456 8.882 2.339
184 HG1 THR 24 1HG THR 24 -3.193 11.232 3.904
185 HG21 THR 24 3HG2 THR 24 -3.761 8.267 4.705
186 HG22 THR 24 1HG2 THR 24 -2.248 9.079 5.101
187 HG23 THR 24 2HG2 THR 24 -2.239 7.659 4.056
188 H PHE 25 H PHE 25 0.343 9.068 4.005
189 HA PHE 25 HA PHE 25 0.843 6.716 2.300
190 HB2 PHE 25 1HB PHE 25 2.882 8.403 3.767
191 HB3 PHE 25 2HB PHE 25 3.239 6.925 2.880
192 HD1 PHE 25 2HD PHE 25 1.865 10.348 2.471
193 HD2 PHE 25 1HD PHE 25 3.713 6.998 0.604
194 HE1 PHE 25 2HE PHE 25 2.161 11.663 0.413
195 HE2 PHE 25 1HE PHE 25 4.013 8.308 -1.456
196 HZ PHE 25 HZ PHE 25 3.237 10.643 -1.554
197 H ILE 26 H ILE 26 1.327 4.784 3.309
198 HA ILE 26 HA ILE 26 1.640 4.646 6.175
199 HB ILE 26 HB ILE 26 -0.767 4.793 6.085
200 HG12 ILE 26 1HG1 ILE 26 -0.694 1.904 6.469
201 HG13 ILE 26 2HG1 ILE 26 0.661 2.714 7.248
202 HG21 ILE 26 1HG2 ILE 26 -2.156 3.393 4.770
203 HG22 ILE 26 2HG2 ILE 26 -0.918 4.036 3.691
204 HG23 ILE 26 3HG2 ILE 26 -0.795 2.381 4.289
205 HD11 ILE 26 3HD1 ILE 26 -1.230 2.444 8.757
206 HD12 ILE 26 1HD1 ILE 26 -0.877 4.146 8.462
207 HD13 ILE 26 2HD1 ILE 26 -2.245 3.376 7.657
208 H LYS 27 H LYS 27 3.126 3.142 6.505
209 HA LYS 27 HA LYS 27 4.188 1.440 4.623
210 HB2 LYS 27 1HB LYS 27 4.191 1.487 7.603
211 HB3 LYS 27 2HB LYS 27 4.791 0.041 6.803
212 HG2 LYS 27 1HG LYS 27 6.231 1.714 5.434
213 HG3 LYS 27 2HG LYS 27 5.888 2.815 6.770
214 HD2 LYS 27 1HD LYS 27 6.987 1.459 8.324
215 HD3 LYS 27 2HD LYS 27 6.924 0.045 7.269
216 HE2 LYS 27 1HE LYS 27 8.886 0.562 6.356
217 HE3 LYS 27 2HE LYS 27 8.342 2.199 5.990
218 HZ1 LYS 27 3HZ LYS 27 10.133 2.503 7.410
219 HZ2 LYS 27 1HZ LYS 27 9.703 1.211 8.416
220 HZ3 LYS 27 2HZ LYS 27 8.805 2.643 8.448
221 H CYS 28 H CYS 28 4.036 -0.818 4.255
222 HA CYS 28 HA CYS 28 1.404 -1.945 4.952
223 HB2 CYS 28 1HB CYS 28 3.076 -2.202 2.461
224 HB3 CYS 28 2HB CYS 28 1.807 -3.360 2.841
225 HG CYS 28 HG CYS 28 -0.209 -1.927 2.088
226 HA PRO 29 HA PRO 29 3.315 -5.360 6.931
227 HB2 PRO 29 1HB PRO 29 1.639 -7.391 6.276
228 HB3 PRO 29 2HB PRO 29 1.203 -6.118 7.423
229 HG2 PRO 29 1HG PRO 29 0.486 -6.388 4.528
230 HG3 PRO 29 2HG PRO 29 -0.535 -5.899 5.894
231 HD2 PRO 29 1HD PRO 29 0.551 -4.112 4.175
232 HD3 PRO 29 2HD PRO 29 0.273 -3.741 5.888
233 H LYS 30 H LYS 30 4.819 -6.927 6.570
234 HA LYS 30 HA LYS 30 4.939 -8.442 4.146
235 HB2 LYS 30 1HB LYS 30 7.075 -7.571 3.329
236 HB3 LYS 30 2HB LYS 30 5.838 -6.321 3.316
237 HG2 LYS 30 1HG LYS 30 7.677 -6.571 5.655
238 HG3 LYS 30 2HG LYS 30 8.221 -5.774 4.176
239 HD2 LYS 30 1HD LYS 30 5.972 -4.463 4.402
240 HD3 LYS 30 2HD LYS 30 6.074 -4.966 6.091
241 HE2 LYS 30 1HE LYS 30 8.062 -3.789 6.441
242 HE3 LYS 30 2HE LYS 30 8.400 -3.664 4.715
243 HZ1 LYS 30 3HZ LYS 30 6.061 -2.367 4.915
244 HZ2 LYS 30 1HZ LYS 30 7.575 -1.613 4.958
245 HZ3 LYS 30 2HZ LYS 30 6.769 -1.977 6.401
246 H PHE 31 H PHE 31 4.757 -9.368 6.654
247 HA PHE 31 HA PHE 31 7.343 -9.900 7.798
248 HB2 PHE 31 1HB PHE 31 5.874 -11.577 9.177
249 HB3 PHE 31 2HB PHE 31 5.714 -9.844 9.444
250 HD1 PHE 31 1HD PHE 31 4.170 -12.790 7.866
251 HD2 PHE 31 2HD PHE 31 3.698 -8.700 8.943
252 HE1 PHE 31 1HE PHE 31 1.763 -12.943 7.381
253 HE2 PHE 31 2HE PHE 31 1.290 -8.847 8.461
254 HZ PHE 31 HZ PHE 31 0.319 -10.971 7.680
255 H ASP 32 H ASP 32 7.916 -10.729 5.481
256 HA ASP 32 HA ASP 32 8.696 -12.485 4.260
257 HB2 ASP 32 1HB ASP 32 7.802 -14.331 6.468
258 HB3 ASP 32 2HB ASP 32 9.125 -14.555 5.328
259 H ASN 33 H ASN 33 6.592 -11.754 3.128
260 HA ASN 33 HA ASN 33 5.355 -13.994 2.018
261 HB2 ASN 33 1HB ASN 33 4.271 -13.529 4.489
262 HB3 ASN 33 2HB ASN 33 3.180 -12.621 3.447
263 HD21 ASN 33 2HD2 ASN 33 4.553 -15.778 4.087
264 HD22 ASN 33 1HD2 ASN 33 3.307 -16.688 3.310
265 H LYS 34 H LYS 34 5.196 -10.579 2.767
266 HA LYS 34 HA LYS 34 4.317 -10.072 0.011
267 HB2 LYS 34 1HB LYS 34 3.308 -8.438 2.333
268 HB3 LYS 34 2HB LYS 34 2.741 -8.424 0.669
269 HG2 LYS 34 1HG LYS 34 1.115 -9.762 1.386
270 HG3 LYS 34 2HG LYS 34 2.341 -11.031 1.412
271 HD2 LYS 34 1HD LYS 34 1.571 -11.207 3.556
272 HD3 LYS 34 2HD LYS 34 2.834 -9.999 3.801
273 HE2 LYS 34 1HE LYS 34 1.336 -8.294 4.094
274 HE3 LYS 34 2HE LYS 34 0.107 -9.055 3.084
275 HZ1 LYS 34 3HZ LYS 34 -0.816 -10.001 4.852
276 HZ2 LYS 34 1HZ LYS 34 0.169 -9.024 5.819
277 HZ3 LYS 34 2HZ LYS 34 0.663 -10.591 5.423
278 H LYS 35 H LYS 35 6.925 -10.011 0.636
279 HA LYS 35 HA LYS 35 7.772 -7.393 1.480
280 HB2 LYS 35 1HB LYS 35 9.001 -9.956 0.986
281 HB3 LYS 35 2HB LYS 35 9.907 -8.683 0.178
282 HG2 LYS 35 1HG LYS 35 10.601 -7.752 2.116
283 HG3 LYS 35 2HG LYS 35 9.116 -8.165 2.975
284 HD2 LYS 35 1HD LYS 35 9.824 -10.417 3.280
285 HD3 LYS 35 2HD LYS 35 11.181 -10.206 2.172
286 HE2 LYS 35 1HE LYS 35 12.267 -10.008 4.174
287 HE3 LYS 35 2HE LYS 35 11.846 -8.320 3.887
288 HZ1 LYS 35 3HZ LYS 35 10.779 -8.336 5.811
289 HZ2 LYS 35 1HZ LYS 35 11.080 -9.987 6.025
290 HZ3 LYS 35 2HZ LYS 35 9.693 -9.481 5.200
291 H CYS 36 H CYS 36 8.161 -5.659 0.250
292 HA CYS 36 HA CYS 36 7.311 -5.529 -2.421
293 HB2 CYS 36 1HB CYS 36 7.563 -3.628 -0.710
294 HB3 CYS 36 2HB CYS 36 9.256 -3.588 -1.187
295 HG CYS 36 HG CYS 36 7.455 -1.591 -2.407
296 H THR 37 H THR 37 8.344 -5.682 -4.343
297 HA THR 37 HA THR 37 11.232 -5.788 -4.492
298 HB THR 37 HB THR 37 11.079 -8.012 -5.790
299 HG1 THR 37 1HG THR 37 9.214 -9.000 -5.736
300 HG21 THR 37 3HG2 THR 37 10.566 -8.384 -2.866
301 HG22 THR 37 1HG2 THR 37 12.003 -7.515 -3.402
302 HG23 THR 37 2HG2 THR 37 11.743 -9.185 -3.905
303 H LYS 38 H LYS 38 9.398 -3.978 -5.568
304 HA LYS 38 HA LYS 38 10.219 -3.832 -8.232
305 HB2 LYS 38 1HB LYS 38 8.787 -5.656 -8.767
306 HB3 LYS 38 2HB LYS 38 7.467 -4.993 -7.813
307 HG2 LYS 38 1HG LYS 38 7.072 -4.739 -10.206
308 HG3 LYS 38 2HG LYS 38 7.203 -3.175 -9.400
309 HD2 LYS 38 1HD LYS 38 8.922 -2.585 -10.687
310 HD3 LYS 38 2HD LYS 38 9.787 -4.075 -10.305
311 HE2 LYS 38 1HE LYS 38 7.540 -4.431 -12.148
312 HE3 LYS 38 2HE LYS 38 8.822 -3.392 -12.770
313 HZ1 LYS 38 3HZ LYS 38 9.771 -5.314 -13.354
314 HZ2 LYS 38 1HZ LYS 38 8.827 -6.237 -12.296
315 HZ3 LYS 38 2HZ LYS 38 10.208 -5.446 -11.724
316 H ASP 39 H ASP 39 10.160 -1.740 -8.711
317 HA ASP 39 HA ASP 39 9.137 0.232 -7.084
318 HB2 ASP 39 1HB ASP 39 9.199 1.643 -9.280
319 HB3 ASP 39 2HB ASP 39 10.700 0.996 -8.623
320 H ASN 40 H ASN 40 7.149 0.864 -6.602
321 HA ASN 40 HA ASN 40 4.904 1.212 -6.691
322 HB2 ASN 40 1HB ASN 40 5.745 1.494 -9.537
323 HB3 ASN 40 2HB ASN 40 4.020 1.376 -9.200
324 HD21 ASN 40 2HD2 ASN 40 6.642 2.903 -7.379
325 HD22 ASN 40 1HD2 ASN 40 5.961 4.492 -7.397
326 H ASN 41 H ASN 41 5.185 -1.189 -5.947
327 HA ASN 41 HA ASN 41 4.325 -3.236 -7.725
328 HB2 ASN 41 1HB ASN 41 5.429 -3.151 -5.180
329 HB3 ASN 41 2HB ASN 41 3.802 -3.770 -4.907
330 HD21 ASN 41 2HD2 ASN 41 6.770 -4.798 -5.176
331 HD22 ASN 41 1HD2 ASN 41 6.552 -6.289 -6.022
332 H LYS 42 H LYS 42 2.396 -4.608 -6.262
333 HA LYS 42 HA LYS 42 0.052 -2.886 -6.697
334 HB2 LYS 42 1HB LYS 42 0.642 -5.377 -7.738
335 HB3 LYS 42 2HB LYS 42 -0.460 -5.751 -6.419
336 HG2 LYS 42 1HG LYS 42 -2.232 -4.808 -7.449
337 HG3 LYS 42 2HG LYS 42 -1.261 -3.538 -8.196
338 HD2 LYS 42 1HD LYS 42 -1.999 -4.894 -9.976
339 HD3 LYS 42 2HD LYS 42 -0.316 -5.354 -9.703
340 HE2 LYS 42 1HE LYS 42 -1.095 -7.266 -8.351
341 HE3 LYS 42 2HE LYS 42 -2.761 -6.823 -8.718
342 HZ1 LYS 42 3HZ LYS 42 -2.606 -7.615 -10.808
343 HZ2 LYS 42 1HZ LYS 42 -1.380 -8.573 -10.144
344 HZ3 LYS 42 2HZ LYS 42 -0.985 -7.167 -10.996
345 H CYS 43 H CYS 43 -0.687 -2.055 -4.856
346 HA CYS 43 HA CYS 43 -0.637 -3.723 -2.434
347 HB2 CYS 43 1HB CYS 43 -0.306 -0.825 -2.929
348 HB3 CYS 43 2HB CYS 43 -1.248 -1.252 -1.504
349 HG CYS 43 HG CYS 43 1.614 -2.958 -1.767
350 H THR 44 H THR 44 -2.491 -2.721 -0.859
351 HA THR 44 HA THR 44 -4.986 -2.260 -2.231
352 HB THR 44 HB THR 44 -5.678 -4.425 -0.592
353 HG1 THR 44 1HG THR 44 -3.270 -4.856 -0.947
354 HG21 THR 44 3HG2 THR 44 -5.866 -5.500 -3.026
355 HG22 THR 44 1HG2 THR 44 -5.611 -3.820 -3.496
356 HG23 THR 44 2HG2 THR 44 -6.973 -4.250 -2.460
357 H VAL 45 H VAL 45 -6.551 -1.392 -0.909
358 HA VAL 45 HA VAL 45 -6.140 -1.378 1.975
359 HB VAL 45 HB VAL 45 -6.234 1.157 0.336
360 HG11 VAL 45 1HG1 VAL 45 -6.385 0.772 3.323
361 HG12 VAL 45 2HG1 VAL 45 -6.137 2.323 2.518
362 HG13 VAL 45 3HG1 VAL 45 -7.640 1.432 2.275
363 HG21 VAL 45 3HG2 VAL 45 -4.141 0.062 2.213
364 HG22 VAL 45 1HG2 VAL 45 -4.025 0.138 0.456
365 HG23 VAL 45 2HG2 VAL 45 -4.076 1.627 1.402
366 H ASP 46 H ASP 46 -8.048 -2.189 2.584
367 HA ASP 46 HA ASP 46 -10.491 -1.567 1.188
368 HB2 ASP 46 1HB ASP 46 -9.776 -3.765 2.465
369 HB3 ASP 46 2HB ASP 46 -10.472 -2.928 3.850
370 H THR 47 H THR 47 -12.230 -0.383 1.949
371 HA THR 47 HA THR 47 -11.543 1.677 3.890
372 HB THR 47 HB THR 47 -13.416 2.907 3.097
373 HG1 THR 47 1HG THR 47 -15.098 2.000 2.060
374 HG21 THR 47 3HG2 THR 47 -11.370 2.418 1.516
375 HG22 THR 47 1HG2 THR 47 -12.769 3.313 0.925
376 HG23 THR 47 2HG2 THR 47 -12.593 1.600 0.543
377 H TYR 48 H TYR 48 -13.372 -1.216 3.705
378 HA TYR 48 HA TYR 48 -15.444 -0.818 5.479
379 HB2 TYR 48 1HB TYR 48 -15.036 -2.904 4.184
380 HB3 TYR 48 2HB TYR 48 -13.733 -3.306 5.297
381 HD1 TYR 48 1HD TYR 48 -14.319 -3.633 7.754
382 HD2 TYR 48 2HD TYR 48 -17.256 -3.479 4.679
383 HE1 TYR 48 1HE TYR 48 -15.931 -4.741 9.245
384 HE2 TYR 48 2HE TYR 48 -18.876 -4.584 6.162
385 HH TYR 48 HH TYR 48 -18.593 -6.230 8.294
386 H ASN 49 H ASN 49 -12.095 -1.748 6.220
387 HA ASN 49 HA ASN 49 -12.290 -0.466 8.805
388 HB2 ASN 49 1HB ASN 49 -11.515 -2.513 10.027
389 HB3 ASN 49 2HB ASN 49 -13.163 -2.624 9.415
390 HD21 ASN 49 2HD2 ASN 49 -12.483 -4.945 9.892
391 HD22 ASN 49 1HD2 ASN 49 -11.833 -5.830 8.557
392 H ASN 50 H ASN 50 -10.759 0.102 6.522
393 HA ASN 50 HA ASN 50 -8.631 0.501 5.809
394 HB2 ASN 50 1HB ASN 50 -8.476 0.605 8.790
395 HB3 ASN 50 2HB ASN 50 -6.975 0.686 7.870
396 HD21 ASN 50 2HD2 ASN 50 -6.408 2.550 6.937
397 HD22 ASN 50 1HD2 ASN 50 -7.375 3.981 6.925
398 H ALA 51 H ALA 51 -9.047 -1.936 5.132
399 HA ALA 51 HA ALA 51 -7.229 -3.801 6.401
400 HB1 ALA 51 1HB ALA 51 -9.570 -4.188 5.163
401 HB2 ALA 51 2HB ALA 51 -8.477 -4.488 3.812
402 HB3 ALA 51 3HB ALA 51 -8.330 -5.436 5.291
403 H VAL 52 H VAL 52 -5.176 -2.961 6.059
404 HA VAL 52 HA VAL 52 -4.278 -2.268 3.407
405 HB VAL 52 HB VAL 52 -2.575 -2.651 5.867
406 HG11 VAL 52 1HG1 VAL 52 -1.925 -2.119 3.204
407 HG12 VAL 52 2HG1 VAL 52 -1.778 -0.572 4.040
408 HG13 VAL 52 3HG1 VAL 52 -0.871 -1.973 4.610
409 HG21 VAL 52 3HG2 VAL 52 -2.811 -0.064 5.914
410 HG22 VAL 52 1HG2 VAL 52 -4.301 -0.362 5.019
411 HG23 VAL 52 2HG2 VAL 52 -4.080 -1.064 6.622
412 H ASP 53 H ASP 53 -3.066 -3.466 2.036
413 HA ASP 53 HA ASP 53 -1.890 -5.973 2.913
414 HB2 ASP 53 1HB ASP 53 -4.267 -5.791 1.116
415 HB3 ASP 53 2HB ASP 53 -3.050 -7.017 0.769
416 H CYS 54 H CYS 54 0.039 -6.177 2.001
417 HA CYS 54 HA CYS 54 0.770 -4.444 -0.205
418 HB2 CYS 54 1HB CYS 54 2.156 -5.113 1.958
419 HB3 CYS 54 2HB CYS 54 2.667 -6.447 0.931
420 HG CYS 54 HG CYS 54 3.489 -3.197 0.785
421 H ASP 55 H ASP 55 2.168 -5.384 -1.972
422 HA ASP 55 HA ASP 55 0.701 -7.245 -3.461
423 HB2 ASP 55 1HB ASP 55 2.119 -6.699 -5.126
424 HB3 ASP 55 2HB ASP 55 2.763 -5.517 -3.990
Start of MODEL 19
1 H1 ALA 1 H ALA 1 -13.987 1.509 2.834
2 HA ALA 1 HA ALA 1 -14.993 0.594 0.218
3 HB1 ALA 1 1HB ALA 1 -13.367 2.926 -0.068
4 HB2 ALA 1 2HB ALA 1 -15.061 2.691 -0.503
5 HB3 ALA 1 3HB ALA 1 -14.635 3.242 1.117
6 H LYS 2 H LYS 2 -12.951 1.262 -1.405
7 HA LYS 2 HA LYS 2 -10.545 0.025 -0.259
8 HB2 LYS 2 1HB LYS 2 -11.902 -0.758 -2.843
9 HB3 LYS 2 2HB LYS 2 -10.276 -1.261 -2.397
10 HG2 LYS 2 1HG LYS 2 -11.366 -2.214 -0.280
11 HG3 LYS 2 2HG LYS 2 -12.888 -2.035 -1.155
12 HD2 LYS 2 1HD LYS 2 -10.692 -3.351 -2.626
13 HD3 LYS 2 2HD LYS 2 -11.354 -4.249 -1.258
14 HE2 LYS 2 1HE LYS 2 -13.597 -4.036 -2.196
15 HE3 LYS 2 2HE LYS 2 -12.955 -3.103 -3.546
16 HZ1 LYS 2 3HZ LYS 2 -11.840 -4.965 -4.386
17 HZ2 LYS 2 1HZ LYS 2 -13.366 -5.547 -3.947
18 HZ3 LYS 2 2HZ LYS 2 -12.030 -5.851 -2.957
19 H TYR 3 H TYR 3 -8.608 0.344 -1.640
20 HA TYR 3 HA TYR 3 -8.764 2.598 -3.485
21 HB2 TYR 3 1HB TYR 3 -7.076 2.597 -0.979
22 HB3 TYR 3 2HB TYR 3 -6.861 3.732 -2.308
23 HD1 TYR 3 1HD TYR 3 -8.568 5.441 -2.769
24 HD2 TYR 3 2HD TYR 3 -8.904 2.819 0.566
25 HE1 TYR 3 1HE TYR 3 -10.261 6.926 -1.780
26 HE2 TYR 3 2HE TYR 3 -10.599 4.296 1.563
27 HH TYR 3 HH TYR 3 -11.941 6.063 1.209
28 H THR 4 H THR 4 -7.526 2.241 -5.201
29 HA THR 4 HA THR 4 -5.501 0.122 -5.047
30 HB THR 4 HB THR 4 -7.284 -0.115 -6.760
31 HG1 THR 4 1HG THR 4 -5.794 -0.576 -8.463
32 HG21 THR 4 3HG2 THR 4 -7.557 2.296 -7.248
33 HG22 THR 4 1HG2 THR 4 -7.306 1.335 -8.704
34 HG23 THR 4 2HG2 THR 4 -5.982 2.291 -8.041
35 H GLY 5 H GLY 5 -3.383 0.508 -5.377
36 HA2 GLY 5 1HA GLY 5 -2.512 2.972 -6.652
37 HA3 GLY 5 2HA GLY 5 -2.102 2.814 -4.950
38 H LYS 6 H LYS 6 0.001 2.384 -4.833
39 HA LYS 6 HA LYS 6 1.041 -0.073 -5.800
40 HB2 LYS 6 1HB LYS 6 2.907 1.410 -7.096
41 HB3 LYS 6 2HB LYS 6 1.542 0.632 -7.888
42 HG2 LYS 6 1HG LYS 6 0.384 2.607 -8.132
43 HG3 LYS 6 2HG LYS 6 1.240 3.396 -6.806
44 HD2 LYS 6 1HD LYS 6 3.043 2.603 -8.932
45 HD3 LYS 6 2HD LYS 6 1.764 3.668 -9.520
46 HE2 LYS 6 1HE LYS 6 2.424 4.972 -7.275
47 HE3 LYS 6 2HE LYS 6 3.972 4.205 -7.624
48 HZ1 LYS 6 3HZ LYS 6 3.083 5.231 -10.023
49 HZ2 LYS 6 1HZ LYS 6 4.334 5.836 -9.058
50 HZ3 LYS 6 2HZ LYS 6 2.764 6.439 -8.882
51 H CYS 7 H CYS 7 3.228 -0.456 -5.101
52 HA CYS 7 HA CYS 7 4.197 1.489 -3.114
53 HB2 CYS 7 1HB CYS 7 5.005 -0.622 -1.852
54 HB3 CYS 7 2HB CYS 7 3.306 -0.178 -1.742
55 HG CYS 7 HG CYS 7 3.202 -2.874 -1.936
56 H THR 8 H THR 8 6.445 1.580 -2.798
57 HA THR 8 HA THR 8 7.974 0.730 -5.129
58 HB THR 8 HB THR 8 9.626 2.294 -4.510
59 HG1 THR 8 1HG THR 8 8.413 2.770 -1.998
60 HG21 THR 8 3HG2 THR 8 8.469 4.308 -4.531
61 HG22 THR 8 1HG2 THR 8 7.205 3.709 -3.458
62 HG23 THR 8 2HG2 THR 8 7.262 3.176 -5.138
63 H LYS 9 H LYS 9 9.736 -0.613 -5.074
64 HA LYS 9 HA LYS 9 9.808 -2.729 -3.311
65 HB2 LYS 9 1HB LYS 9 12.232 -2.992 -4.121
66 HB3 LYS 9 2HB LYS 9 10.957 -3.032 -5.331
67 HG2 LYS 9 1HG LYS 9 11.430 -0.787 -6.002
68 HG3 LYS 9 2HG LYS 9 12.566 -0.577 -4.667
69 HD2 LYS 9 1HD LYS 9 12.887 -2.555 -6.923
70 HD3 LYS 9 2HD LYS 9 13.692 -0.987 -6.828
71 HE2 LYS 9 1HE LYS 9 14.687 -1.729 -4.655
72 HE3 LYS 9 2HE LYS 9 14.017 -3.331 -4.960
73 HZ1 LYS 9 3HZ LYS 9 15.980 -3.683 -5.949
74 HZ2 LYS 9 1HZ LYS 9 16.313 -2.035 -6.144
75 HZ3 LYS 9 2HZ LYS 9 15.315 -2.833 -7.253
76 H SER 10 H SER 10 11.482 0.360 -3.112
77 HA SER 10 HA SER 10 13.075 -0.378 -0.849
78 HB2 SER 10 1HB SER 10 13.544 2.093 -0.735
79 HB3 SER 10 2HB SER 10 13.911 1.353 -2.292
80 HG SER 10 HG SER 10 12.772 3.141 -2.796
81 H LYS 11 H LYS 11 9.944 1.081 -1.346
82 HA LYS 11 HA LYS 11 9.533 1.066 1.567
83 HB2 LYS 11 1HB LYS 11 9.607 3.360 -0.065
84 HB3 LYS 11 2HB LYS 11 7.909 3.082 0.300
85 HG2 LYS 11 1HG LYS 11 8.178 3.479 2.530
86 HG3 LYS 11 2HG LYS 11 9.863 2.953 2.534
87 HD2 LYS 11 1HD LYS 11 9.414 5.303 0.873
88 HD3 LYS 11 2HD LYS 11 8.973 5.565 2.562
89 HE2 LYS 11 1HE LYS 11 11.536 4.177 2.063
90 HE3 LYS 11 2HE LYS 11 11.466 5.881 1.616
91 HZ1 LYS 11 3HZ LYS 11 10.452 5.105 4.249
92 HZ2 LYS 11 1HZ LYS 11 11.217 6.534 3.766
93 HZ3 LYS 11 2HZ LYS 11 12.128 5.133 4.023
94 H ASN 12 H ASN 12 8.211 -0.636 1.808
95 HA ASN 12 HA ASN 12 6.186 -1.289 -0.130
96 HB2 ASN 12 1HB ASN 12 7.288 -3.104 1.020
97 HB3 ASN 12 2HB ASN 12 6.832 -2.444 2.589
98 HD21 ASN 12 2HD2 ASN 12 5.647 -4.128 3.317
99 HD22 ASN 12 1HD2 ASN 12 4.176 -4.663 2.587
100 H GLU 13 H GLU 13 5.146 0.872 0.059
101 HA GLU 13 HA GLU 13 3.007 0.740 2.052
102 HB2 GLU 13 1HB GLU 13 3.227 3.002 2.722
103 HB3 GLU 13 2HB GLU 13 4.839 2.306 2.826
104 HG2 GLU 13 1HG GLU 13 4.922 3.269 0.323
105 HG3 GLU 13 2HG GLU 13 3.793 4.409 1.050
106 H CYS 14 H CYS 14 1.083 1.843 1.451
107 HA CYS 14 HA CYS 14 0.798 2.093 -1.447
108 HB2 CYS 14 1HB CYS 14 -0.801 0.628 -0.389
109 HB3 CYS 14 2HB CYS 14 -1.241 1.874 0.773
110 HG CYS 14 HG CYS 14 -1.712 2.555 -2.510
111 H LYS 15 H LYS 15 0.968 4.036 -2.325
112 HA LYS 15 HA LYS 15 0.386 6.404 -0.701
113 HB2 LYS 15 1HB LYS 15 1.537 7.634 -2.553
114 HB3 LYS 15 2HB LYS 15 2.553 6.463 -1.723
115 HG2 LYS 15 1HG LYS 15 1.278 5.187 -3.933
116 HG3 LYS 15 2HG LYS 15 2.039 6.682 -4.481
117 HD2 LYS 15 1HD LYS 15 3.481 4.689 -2.752
118 HD3 LYS 15 2HD LYS 15 3.466 4.569 -4.513
119 HE2 LYS 15 1HE LYS 15 4.237 7.140 -3.199
120 HE3 LYS 15 2HE LYS 15 5.405 5.824 -3.301
121 HZ1 LYS 15 3HZ LYS 15 4.583 7.636 -5.317
122 HZ2 LYS 15 1HZ LYS 15 4.290 6.045 -5.814
123 HZ3 LYS 15 2HZ LYS 15 5.846 6.513 -5.345
124 H TYR 16 H TYR 16 -1.951 5.672 -1.014
125 HA TYR 16 HA TYR 16 -3.048 6.428 -3.613
126 HB2 TYR 16 1HB TYR 16 -5.070 5.386 -2.934
127 HB3 TYR 16 2HB TYR 16 -3.776 4.332 -2.375
128 HD1 TYR 16 1HD TYR 16 -3.069 4.507 0.070
129 HD2 TYR 16 2HD TYR 16 -6.662 6.222 -1.431
130 HE1 TYR 16 1HE TYR 16 -3.970 4.605 2.356
131 HE2 TYR 16 2HE TYR 16 -7.572 6.326 0.851
132 HH TYR 16 HH TYR 16 -7.290 5.446 2.988
133 H LYS 17 H LYS 17 -5.505 7.386 -2.987
134 HA LYS 17 HA LYS 17 -5.004 9.778 -1.349
135 HB2 LYS 17 1HB LYS 17 -6.463 9.755 -3.996
136 HB3 LYS 17 2HB LYS 17 -6.157 11.161 -2.984
137 HG2 LYS 17 1HG LYS 17 -4.157 11.472 -3.885
138 HG3 LYS 17 2HG LYS 17 -3.702 9.787 -3.620
139 HD2 LYS 17 1HD LYS 17 -4.171 9.204 -5.741
140 HD3 LYS 17 2HD LYS 17 -5.634 10.190 -5.788
141 HE2 LYS 17 1HE LYS 17 -4.058 12.197 -5.928
142 HE3 LYS 17 2HE LYS 17 -2.790 11.026 -6.284
143 HZ1 LYS 17 3HZ LYS 17 -3.467 11.444 -8.383
144 HZ2 LYS 17 1HZ LYS 17 -5.032 11.894 -7.927
145 HZ3 LYS 17 2HZ LYS 17 -4.619 10.257 -8.027
146 H ASN 18 H ASN 18 -6.549 10.223 0.093
147 HA ASN 18 HA ASN 18 -9.154 8.878 -0.217
148 HB2 ASN 18 1HB ASN 18 -9.202 8.296 2.019
149 HB3 ASN 18 2HB ASN 18 -7.481 8.146 1.678
150 HD21 ASN 18 2HD2 ASN 18 -6.283 10.316 1.969
151 HD22 ASN 18 1HD2 ASN 18 -6.639 11.158 3.436
152 H ASP 19 H ASP 19 -10.880 9.962 1.185
153 HA ASP 19 HA ASP 19 -12.125 11.787 1.756
154 HB2 ASP 19 1HB ASP 19 -9.871 12.476 2.843
155 HB3 ASP 19 2HB ASP 19 -9.716 13.560 1.463
156 H ALA 20 H ALA 20 -9.684 13.210 -0.416
157 HA ALA 20 HA ALA 20 -11.242 13.185 -2.738
158 HB1 ALA 20 1HB ALA 20 -12.798 14.646 -1.741
159 HB2 ALA 20 2HB ALA 20 -11.528 15.660 -1.058
160 HB3 ALA 20 3HB ALA 20 -11.810 15.654 -2.799
161 H GLY 21 H GLY 21 -8.800 12.558 -2.799
162 HA2 GLY 21 1HA GLY 21 -6.979 13.100 -4.182
163 HA3 GLY 21 2HA GLY 21 -7.444 14.792 -4.094
164 H LYS 22 H LYS 22 -7.327 13.084 -1.122
165 HA LYS 22 HA LYS 22 -5.174 14.754 -0.191
166 HB2 LYS 22 1HB LYS 22 -7.339 13.692 1.034
167 HB3 LYS 22 2HB LYS 22 -6.116 12.517 1.502
168 HG2 LYS 22 1HG LYS 22 -4.822 14.838 2.025
169 HG3 LYS 22 2HG LYS 22 -6.494 15.295 2.360
170 HD2 LYS 22 1HD LYS 22 -6.614 13.150 3.746
171 HD3 LYS 22 2HD LYS 22 -4.853 13.122 3.631
172 HE2 LYS 22 1HE LYS 22 -4.796 15.396 4.605
173 HE3 LYS 22 2HE LYS 22 -6.548 15.329 4.796
174 HZ1 LYS 22 3HZ LYS 22 -6.031 14.537 6.813
175 HZ2 LYS 22 1HZ LYS 22 -4.470 14.064 6.363
176 HZ3 LYS 22 2HZ LYS 22 -5.790 13.068 6.010
177 H ASP 23 H ASP 23 -3.577 13.478 1.391
178 HA ASP 23 HA ASP 23 -2.353 11.353 -0.245
179 HB2 ASP 23 1HB ASP 23 -0.881 13.173 1.661
180 HB3 ASP 23 2HB ASP 23 -0.195 12.109 0.436
181 H THR 24 H THR 24 -2.057 9.422 0.663
182 HA THR 24 HA THR 24 -1.937 9.186 3.576
183 HB THR 24 HB THR 24 -3.884 7.622 1.868
184 HG1 THR 24 1HG THR 24 -4.470 9.820 2.548
185 HG21 THR 24 3HG2 THR 24 -3.057 7.351 4.749
186 HG22 THR 24 1HG2 THR 24 -3.085 6.110 3.496
187 HG23 THR 24 2HG2 THR 24 -4.598 6.737 4.149
188 H PHE 25 H PHE 25 -0.393 7.814 4.187
189 HA PHE 25 HA PHE 25 0.482 5.744 2.287
190 HB2 PHE 25 1HB PHE 25 2.297 7.390 4.062
191 HB3 PHE 25 2HB PHE 25 2.800 6.131 2.937
192 HD1 PHE 25 2HD PHE 25 1.261 9.486 3.156
193 HD2 PHE 25 1HD PHE 25 3.176 6.608 0.671
194 HE1 PHE 25 2HE PHE 25 1.474 11.170 1.374
195 HE2 PHE 25 1HE PHE 25 3.392 8.288 -1.114
196 HZ PHE 25 HZ PHE 25 2.539 10.572 -0.764
197 H ILE 26 H ILE 26 0.261 3.781 3.110
198 HA ILE 26 HA ILE 26 0.740 3.376 5.980
199 HB ILE 26 HB ILE 26 -1.647 3.435 5.823
200 HG12 ILE 26 1HG1 ILE 26 -2.234 1.173 6.549
201 HG13 ILE 26 2HG1 ILE 26 -0.752 0.544 5.837
202 HG21 ILE 26 1HG2 ILE 26 -2.309 1.279 4.128
203 HG22 ILE 26 2HG2 ILE 26 -2.675 2.990 3.909
204 HG23 ILE 26 3HG2 ILE 26 -1.190 2.314 3.241
205 HD11 ILE 26 3HD1 ILE 26 -0.723 0.853 8.321
206 HD12 ILE 26 1HD1 ILE 26 0.588 1.644 7.446
207 HD13 ILE 26 2HD1 ILE 26 -0.780 2.592 8.033
208 H LYS 27 H LYS 27 2.477 2.109 6.032
209 HA LYS 27 HA LYS 27 3.354 0.417 3.988
210 HB2 LYS 27 1HB LYS 27 4.132 1.048 6.709
211 HB3 LYS 27 2HB LYS 27 4.363 -0.661 6.363
212 HG2 LYS 27 1HG LYS 27 6.255 -0.174 5.333
213 HG3 LYS 27 2HG LYS 27 5.351 0.763 4.141
214 HD2 LYS 27 1HD LYS 27 6.760 2.384 4.925
215 HD3 LYS 27 2HD LYS 27 5.414 2.589 6.048
216 HE2 LYS 27 1HE LYS 27 6.780 0.760 7.407
217 HE3 LYS 27 2HE LYS 27 8.122 1.456 6.499
218 HZ1 LYS 27 3HZ LYS 27 7.493 3.642 7.350
219 HZ2 LYS 27 1HZ LYS 27 7.853 2.571 8.610
220 HZ3 LYS 27 2HZ LYS 27 6.243 2.946 8.252
221 H CYS 28 H CYS 28 2.421 -1.357 3.236
222 HA CYS 28 HA CYS 28 0.296 -2.716 4.366
223 HB2 CYS 28 1HB CYS 28 2.383 -3.919 2.536
224 HB3 CYS 28 2HB CYS 28 0.731 -4.483 2.759
225 HG CYS 28 HG CYS 28 1.875 -2.304 0.615
226 HA PRO 29 HA PRO 29 1.894 -5.252 7.572
227 HB2 PRO 29 1HB PRO 29 0.254 -7.408 7.390
228 HB3 PRO 29 2HB PRO 29 -0.281 -5.844 8.017
229 HG2 PRO 29 1HG PRO 29 -0.657 -7.020 5.290
230 HG3 PRO 29 2HG PRO 29 -1.819 -6.139 6.299
231 HD2 PRO 29 1HD PRO 29 -0.491 -4.971 4.249
232 HD3 PRO 29 2HD PRO 29 -0.961 -4.083 5.713
233 H LYS 30 H LYS 30 3.921 -5.545 6.293
234 HA LYS 30 HA LYS 30 4.331 -8.385 5.786
235 HB2 LYS 30 1HB LYS 30 5.103 -6.263 3.774
236 HB3 LYS 30 2HB LYS 30 5.501 -7.972 3.666
237 HG2 LYS 30 1HG LYS 30 2.691 -6.900 3.715
238 HG3 LYS 30 2HG LYS 30 3.591 -7.266 2.242
239 HD2 LYS 30 1HD LYS 30 3.506 -9.534 2.591
240 HD3 LYS 30 2HD LYS 30 3.371 -9.367 4.343
241 HE2 LYS 30 1HE LYS 30 1.076 -8.157 3.410
242 HE3 LYS 30 2HE LYS 30 1.291 -9.518 2.309
243 HZ1 LYS 30 3HZ LYS 30 -0.032 -10.156 4.213
244 HZ2 LYS 30 1HZ LYS 30 1.196 -9.676 5.273
245 HZ3 LYS 30 2HZ LYS 30 1.441 -10.987 4.233
246 H PHE 31 H PHE 31 5.265 -7.565 7.990
247 HA PHE 31 HA PHE 31 7.870 -6.310 7.733
248 HB2 PHE 31 1HB PHE 31 6.674 -7.459 10.251
249 HB3 PHE 31 2HB PHE 31 7.905 -6.208 10.106
250 HD1 PHE 31 1HD PHE 31 7.274 -3.944 9.330
251 HD2 PHE 31 2HD PHE 31 4.367 -6.939 10.160
252 HE1 PHE 31 1HE PHE 31 5.529 -2.213 9.445
253 HE2 PHE 31 2HE PHE 31 2.617 -5.214 10.276
254 HZ PHE 31 HZ PHE 31 3.197 -2.848 9.917
255 H ASP 32 H ASP 32 9.282 -7.688 6.776
256 HA ASP 32 HA ASP 32 10.682 -9.460 6.494
257 HB2 ASP 32 1HB ASP 32 11.154 -8.735 8.923
258 HB3 ASP 32 2HB ASP 32 10.218 -10.154 9.387
259 H ASN 33 H ASN 33 8.873 -10.362 5.199
260 HA ASN 33 HA ASN 33 8.524 -13.091 5.710
261 HB2 ASN 33 1HB ASN 33 6.807 -11.658 7.289
262 HB3 ASN 33 2HB ASN 33 5.811 -11.964 5.870
263 HD21 ASN 33 2HD2 ASN 33 7.182 -13.262 8.696
264 HD22 ASN 33 1HD2 ASN 33 6.608 -14.881 8.514
265 H LYS 34 H LYS 34 6.883 -10.290 4.259
266 HA LYS 34 HA LYS 34 7.240 -11.404 1.622
267 HB2 LYS 34 1HB LYS 34 4.553 -11.262 2.939
268 HB3 LYS 34 2HB LYS 34 4.684 -11.008 1.203
269 HG2 LYS 34 1HG LYS 34 4.498 -13.215 1.019
270 HG3 LYS 34 2HG LYS 34 6.160 -13.293 1.607
271 HD2 LYS 34 1HD LYS 34 5.539 -14.022 3.661
272 HD3 LYS 34 2HD LYS 34 4.054 -13.066 3.668
273 HE2 LYS 34 1HE LYS 34 2.903 -14.659 2.371
274 HE3 LYS 34 2HE LYS 34 4.393 -15.481 1.912
275 HZ1 LYS 34 3HZ LYS 34 2.720 -15.987 4.115
276 HZ2 LYS 34 1HZ LYS 34 4.240 -15.517 4.691
277 HZ3 LYS 34 2HZ LYS 34 4.106 -16.826 3.628
278 H LYS 35 H LYS 35 8.490 -9.258 2.249
279 HA LYS 35 HA LYS 35 6.952 -6.844 1.955
280 HB2 LYS 35 1HB LYS 35 9.645 -7.554 2.701
281 HB3 LYS 35 2HB LYS 35 9.668 -6.272 1.498
282 HG2 LYS 35 1HG LYS 35 7.708 -5.462 3.258
283 HG3 LYS 35 2HG LYS 35 8.934 -6.183 4.303
284 HD2 LYS 35 1HD LYS 35 10.505 -4.738 2.656
285 HD3 LYS 35 2HD LYS 35 9.045 -3.745 2.640
286 HE2 LYS 35 1HE LYS 35 9.801 -2.852 4.541
287 HE3 LYS 35 2HE LYS 35 9.363 -4.378 5.307
288 HZ1 LYS 35 3HZ LYS 35 12.016 -3.867 4.083
289 HZ2 LYS 35 1HZ LYS 35 11.568 -5.175 5.057
290 HZ3 LYS 35 2HZ LYS 35 11.683 -3.625 5.725
291 H CYS 36 H CYS 36 6.385 -5.890 0.115
292 HA CYS 36 HA CYS 36 6.730 -7.005 -2.394
293 HB2 CYS 36 1HB CYS 36 5.716 -4.479 -1.321
294 HB3 CYS 36 2HB CYS 36 6.398 -4.316 -2.935
295 HG CYS 36 HG CYS 36 4.217 -6.851 -2.416
296 H THR 37 H THR 37 8.176 -6.784 -4.034
297 HA THR 37 HA THR 37 10.447 -4.962 -3.643
298 HB THR 37 HB THR 37 11.287 -7.085 -2.897
299 HG1 THR 37 1HG THR 37 13.026 -6.685 -4.019
300 HG21 THR 37 3HG2 THR 37 9.501 -8.145 -4.810
301 HG22 THR 37 1HG2 THR 37 10.511 -9.026 -3.666
302 HG23 THR 37 2HG2 THR 37 11.120 -8.660 -5.280
303 H LYS 38 H LYS 38 8.693 -4.020 -5.248
304 HA LYS 38 HA LYS 38 9.889 -4.175 -7.854
305 HB2 LYS 38 1HB LYS 38 7.755 -5.908 -7.359
306 HB3 LYS 38 2HB LYS 38 7.039 -4.562 -8.235
307 HG2 LYS 38 1HG LYS 38 9.560 -5.719 -9.289
308 HG3 LYS 38 2HG LYS 38 8.071 -6.648 -9.477
309 HD2 LYS 38 1HD LYS 38 7.034 -4.899 -10.704
310 HD3 LYS 38 2HD LYS 38 8.315 -3.758 -10.288
311 HE2 LYS 38 1HE LYS 38 9.643 -4.474 -11.946
312 HE3 LYS 38 2HE LYS 38 9.276 -6.169 -11.630
313 HZ1 LYS 38 3HZ LYS 38 6.973 -5.338 -12.682
314 HZ2 LYS 38 1HZ LYS 38 8.229 -6.010 -13.594
315 HZ3 LYS 38 2HZ LYS 38 8.053 -4.331 -13.507
316 H ASP 39 H ASP 39 10.105 -2.086 -8.291
317 HA ASP 39 HA ASP 39 8.789 0.032 -7.137
318 HB2 ASP 39 1HB ASP 39 10.828 -0.130 -8.851
319 HB3 ASP 39 2HB ASP 39 9.570 0.329 -9.996
320 H ASN 40 H ASN 40 6.827 0.903 -7.291
321 HA ASN 40 HA ASN 40 4.698 1.326 -7.970
322 HB2 ASN 40 1HB ASN 40 6.131 0.926 -10.560
323 HB3 ASN 40 2HB ASN 40 4.372 1.009 -10.581
324 HD21 ASN 40 2HD2 ASN 40 6.723 2.711 -8.562
325 HD22 ASN 40 1HD2 ASN 40 6.258 4.300 -9.056
326 H ASN 41 H ASN 41 5.278 -1.238 -6.962
327 HA ASN 41 HA ASN 41 4.282 -3.358 -8.498
328 HB2 ASN 41 1HB ASN 41 5.217 -2.982 -5.855
329 HB3 ASN 41 2HB ASN 41 3.630 -3.736 -5.724
330 HD21 ASN 41 2HD2 ASN 41 6.078 -4.937 -5.004
331 HD22 ASN 41 1HD2 ASN 41 6.321 -6.305 -6.031
332 H LYS 42 H LYS 42 2.264 -4.575 -7.144
333 HA LYS 42 HA LYS 42 -0.003 -2.760 -7.623
334 HB2 LYS 42 1HB LYS 42 0.522 -5.180 -8.797
335 HB3 LYS 42 2HB LYS 42 -0.567 -5.640 -7.495
336 HG2 LYS 42 1HG LYS 42 -2.347 -4.600 -8.426
337 HG3 LYS 42 2HG LYS 42 -1.366 -3.314 -9.133
338 HD2 LYS 42 1HD LYS 42 -1.566 -4.355 -11.092
339 HD3 LYS 42 2HD LYS 42 -0.555 -5.644 -10.435
340 HE2 LYS 42 1HE LYS 42 -2.570 -6.771 -9.592
341 HE3 LYS 42 2HE LYS 42 -3.565 -5.492 -10.288
342 HZ1 LYS 42 3HZ LYS 42 -1.922 -6.422 -12.318
343 HZ2 LYS 42 1HZ LYS 42 -3.591 -6.644 -12.162
344 HZ3 LYS 42 2HZ LYS 42 -2.523 -7.797 -11.538
345 H CYS 43 H CYS 43 -0.713 -1.964 -5.748
346 HA CYS 43 HA CYS 43 -1.234 -3.861 -3.562
347 HB2 CYS 43 1HB CYS 43 -0.403 -2.392 -1.920
348 HB3 CYS 43 2HB CYS 43 0.804 -2.349 -3.199
349 HG CYS 43 HG CYS 43 -1.074 0.023 -4.077
350 H THR 44 H THR 44 -2.977 -3.279 -2.155
351 HA THR 44 HA THR 44 -4.715 -1.100 -3.006
352 HB THR 44 HB THR 44 -6.707 -2.628 -3.049
353 HG1 THR 44 1HG THR 44 -6.373 -4.815 -3.161
354 HG21 THR 44 3HG2 THR 44 -4.535 -2.969 -5.111
355 HG22 THR 44 1HG2 THR 44 -5.885 -1.836 -5.141
356 HG23 THR 44 2HG2 THR 44 -6.181 -3.564 -5.331
357 H VAL 45 H VAL 45 -5.269 -0.052 -1.221
358 HA VAL 45 HA VAL 45 -5.231 -1.436 1.347
359 HB VAL 45 HB VAL 45 -5.456 1.491 0.645
360 HG11 VAL 45 1HG1 VAL 45 -6.699 1.392 2.597
361 HG12 VAL 45 2HG1 VAL 45 -5.735 0.073 3.267
362 HG13 VAL 45 3HG1 VAL 45 -5.072 1.707 3.199
363 HG21 VAL 45 3HG2 VAL 45 -3.276 0.175 2.226
364 HG22 VAL 45 1HG2 VAL 45 -3.242 0.184 0.463
365 HG23 VAL 45 2HG2 VAL 45 -3.247 1.707 1.352
366 H ASP 46 H ASP 46 -6.978 -1.630 2.702
367 HA ASP 46 HA ASP 46 -9.596 -1.014 1.501
368 HB2 ASP 46 1HB ASP 46 -8.899 -3.457 1.966
369 HB3 ASP 46 2HB ASP 46 -9.155 -3.061 3.663
370 H THR 47 H THR 47 -10.855 0.413 2.496
371 HA THR 47 HA THR 47 -9.995 1.573 5.002
372 HB THR 47 HB THR 47 -12.472 2.691 4.341
373 HG1 THR 47 1HG THR 47 -12.391 3.021 2.149
374 HG21 THR 47 3HG2 THR 47 -11.128 4.639 3.687
375 HG22 THR 47 1HG2 THR 47 -9.686 3.625 3.636
376 HG23 THR 47 2HG2 THR 47 -10.517 3.901 5.167
377 H TYR 48 H TYR 48 -12.001 -0.960 4.090
378 HA TYR 48 HA TYR 48 -14.199 -0.823 5.748
379 HB2 TYR 48 1HB TYR 48 -14.104 -2.630 4.233
380 HB3 TYR 48 2HB TYR 48 -12.537 -3.162 4.832
381 HD1 TYR 48 2HD TYR 48 -15.580 -2.298 6.788
382 HD2 TYR 48 1HD TYR 48 -12.934 -5.369 5.498
383 HE1 TYR 48 2HE TYR 48 -16.701 -3.888 8.293
384 HE2 TYR 48 1HE TYR 48 -14.047 -6.968 6.998
385 HH TYR 48 HH TYR 48 -17.016 -6.373 8.439
386 H ASN 49 H ASN 49 -11.087 -2.382 6.538
387 HA ASN 49 HA ASN 49 -11.271 -1.458 9.269
388 HB2 ASN 49 1HB ASN 49 -12.616 -3.654 9.051
389 HB3 ASN 49 2HB ASN 49 -11.047 -4.433 8.874
390 HD21 ASN 49 2HD2 ASN 49 -10.236 -5.203 10.672
391 HD22 ASN 49 1HD2 ASN 49 -10.524 -4.600 12.264
392 H ASN 50 H ASN 50 -9.444 -0.926 7.206
393 HA ASN 50 HA ASN 50 -7.209 -0.779 6.811
394 HB2 ASN 50 1HB ASN 50 -7.369 -1.499 9.692
395 HB3 ASN 50 2HB ASN 50 -5.797 -1.656 8.915
396 HD21 ASN 50 2HD2 ASN 50 -5.660 0.398 7.229
397 HD22 ASN 50 1HD2 ASN 50 -5.777 1.904 8.067
398 H ALA 51 H ALA 51 -7.797 -2.588 5.277
399 HA ALA 51 HA ALA 51 -6.082 -4.905 5.861
400 HB1 ALA 51 1HB ALA 51 -8.777 -5.031 4.513
401 HB2 ALA 51 2HB ALA 51 -7.671 -6.386 4.746
402 HB3 ALA 51 3HB ALA 51 -8.407 -5.598 6.142
403 H VAL 52 H VAL 52 -4.466 -3.807 4.629
404 HA VAL 52 HA VAL 52 -5.003 -3.315 1.812
405 HB VAL 52 HB VAL 52 -3.633 -1.699 3.054
406 HG11 VAL 52 1HG1 VAL 52 -2.544 -3.793 4.333
407 HG12 VAL 52 2HG1 VAL 52 -1.286 -3.489 3.134
408 HG13 VAL 52 3HG1 VAL 52 -1.778 -2.207 4.242
409 HG21 VAL 52 3HG2 VAL 52 -3.310 -1.904 0.656
410 HG22 VAL 52 1HG2 VAL 52 -1.775 -1.551 1.449
411 HG23 VAL 52 2HG2 VAL 52 -2.129 -3.190 0.904
412 H ASP 53 H ASP 53 -4.012 -4.386 0.112
413 HA ASP 53 HA ASP 53 -3.018 -7.063 0.772
414 HB2 ASP 53 1HB ASP 53 -4.225 -5.868 -1.716
415 HB3 ASP 53 2HB ASP 53 -3.381 -7.414 -1.750
416 H CYS 54 H CYS 54 -1.541 -7.810 -1.291
417 HA CYS 54 HA CYS 54 0.463 -5.783 -1.874
418 HB2 CYS 54 1HB CYS 54 2.301 -6.951 -0.925
419 HB3 CYS 54 2HB CYS 54 1.067 -6.887 0.328
420 HG CYS 54 HG CYS 54 2.445 -9.527 -1.167
421 H ASP 55 H ASP 55 1.864 -6.341 -3.595
422 HA ASP 55 HA ASP 55 0.671 -7.886 -5.626
423 HB2 ASP 55 1HB ASP 55 2.359 -5.937 -5.820
424 HB3 ASP 55 2HB ASP 55 3.593 -7.173 -5.599
Start of MODEL 20
1 H1 ALA 1 H ALA 1 -14.357 0.634 2.167
2 HA ALA 1 HA ALA 1 -15.059 0.440 -0.598
3 HB1 ALA 1 1HB ALA 1 -14.401 2.673 -1.289
4 HB2 ALA 1 2HB ALA 1 -15.756 2.753 -0.162
5 HB3 ALA 1 3HB ALA 1 -14.125 3.132 0.391
6 H LYS 2 H LYS 2 -13.270 0.145 -1.929
7 HA LYS 2 HA LYS 2 -10.750 -0.288 -0.488
8 HB2 LYS 2 1HB LYS 2 -11.943 -1.471 -2.975
9 HB3 LYS 2 2HB LYS 2 -10.208 -1.556 -2.698
10 HG2 LYS 2 1HG LYS 2 -10.412 -3.030 -0.973
11 HG3 LYS 2 2HG LYS 2 -12.010 -2.439 -0.511
12 HD2 LYS 2 1HD LYS 2 -13.047 -3.593 -2.315
13 HD3 LYS 2 2HD LYS 2 -11.489 -3.970 -3.053
14 HE2 LYS 2 1HE LYS 2 -10.974 -5.260 -0.919
15 HE3 LYS 2 2HE LYS 2 -12.688 -5.100 -0.538
16 HZ1 LYS 2 3HZ LYS 2 -12.130 -6.073 -3.201
17 HZ2 LYS 2 1HZ LYS 2 -13.246 -6.626 -2.056
18 HZ3 LYS 2 2HZ LYS 2 -11.629 -7.110 -1.962
19 H TYR 3 H TYR 3 -8.742 0.035 -1.876
20 HA TYR 3 HA TYR 3 -8.929 2.140 -3.856
21 HB2 TYR 3 1HB TYR 3 -7.594 2.572 -1.181
22 HB3 TYR 3 2HB TYR 3 -7.281 3.578 -2.591
23 HD1 TYR 3 1HD TYR 3 -9.115 4.970 -3.541
24 HD2 TYR 3 2HD TYR 3 -9.563 2.855 0.124
25 HE1 TYR 3 1HE TYR 3 -11.051 6.376 -2.974
26 HE2 TYR 3 2HE TYR 3 -11.502 4.254 0.700
27 HH TYR 3 HH TYR 3 -12.394 7.038 -1.213
28 H THR 4 H THR 4 -7.483 1.758 -5.392
29 HA THR 4 HA THR 4 -5.294 -0.103 -4.834
30 HB THR 4 HB THR 4 -6.095 0.922 -7.553
31 HG1 THR 4 1HG THR 4 -7.862 -0.209 -7.332
32 HG21 THR 4 3HG2 THR 4 -3.996 -0.178 -7.607
33 HG22 THR 4 1HG2 THR 4 -5.174 -1.348 -8.198
34 HG23 THR 4 2HG2 THR 4 -4.563 -1.470 -6.549
35 H GLY 5 H GLY 5 -3.144 0.327 -5.495
36 HA2 GLY 5 1HA GLY 5 -2.433 2.955 -6.460
37 HA3 GLY 5 2HA GLY 5 -2.006 2.676 -4.779
38 H LYS 6 H LYS 6 0.157 2.519 -4.826
39 HA LYS 6 HA LYS 6 1.339 0.173 -5.959
40 HB2 LYS 6 1HB LYS 6 3.084 1.893 -7.124
41 HB3 LYS 6 2HB LYS 6 1.771 1.093 -7.976
42 HG2 LYS 6 1HG LYS 6 0.354 3.049 -7.650
43 HG3 LYS 6 2HG LYS 6 1.657 3.852 -6.773
44 HD2 LYS 6 1HD LYS 6 1.591 4.643 -9.063
45 HD3 LYS 6 2HD LYS 6 3.067 3.714 -8.790
46 HE2 LYS 6 1HE LYS 6 2.536 2.373 -10.477
47 HE3 LYS 6 2HE LYS 6 1.048 1.915 -9.648
48 HZ1 LYS 6 3HZ LYS 6 1.422 3.651 -11.899
49 HZ2 LYS 6 1HZ LYS 6 0.473 4.355 -10.688
50 HZ3 LYS 6 2HZ LYS 6 0.022 2.870 -11.359
51 H CYS 7 H CYS 7 3.267 -0.341 -4.989
52 HA CYS 7 HA CYS 7 4.094 1.443 -2.814
53 HB2 CYS 7 1HB CYS 7 4.509 -1.515 -3.258
54 HB3 CYS 7 2HB CYS 7 5.264 -0.618 -1.946
55 HG CYS 7 HG CYS 7 2.217 -1.883 -2.143
56 H THR 8 H THR 8 6.525 1.141 -2.247
57 HA THR 8 HA THR 8 8.066 1.408 -4.747
58 HB THR 8 HB THR 8 9.373 3.113 -3.823
59 HG1 THR 8 1HG THR 8 9.750 3.319 -1.715
60 HG21 THR 8 3HG2 THR 8 7.862 4.815 -3.358
61 HG22 THR 8 1HG2 THR 8 6.801 3.759 -2.429
62 HG23 THR 8 2HG2 THR 8 6.852 3.631 -4.188
63 H LYS 9 H LYS 9 9.899 0.251 -4.977
64 HA LYS 9 HA LYS 9 10.377 -2.007 -3.406
65 HB2 LYS 9 1HB LYS 9 12.617 -2.043 -4.610
66 HB3 LYS 9 2HB LYS 9 11.182 -2.041 -5.628
67 HG2 LYS 9 1HG LYS 9 11.886 -0.222 -6.668
68 HG3 LYS 9 2HG LYS 9 11.976 0.655 -5.139
69 HD2 LYS 9 1HD LYS 9 14.141 0.691 -6.191
70 HD3 LYS 9 2HD LYS 9 14.219 -0.339 -4.760
71 HE2 LYS 9 1HE LYS 9 15.093 -1.908 -6.076
72 HE3 LYS 9 2HE LYS 9 13.493 -2.069 -6.799
73 HZ1 LYS 9 3HZ LYS 9 15.697 -1.468 -8.177
74 HZ2 LYS 9 1HZ LYS 9 15.118 0.089 -7.848
75 HZ3 LYS 9 2HZ LYS 9 14.138 -1.024 -8.662
76 H SER 10 H SER 10 11.344 1.260 -2.966
77 HA SER 10 HA SER 10 13.385 0.502 -1.002
78 HB2 SER 10 1HB SER 10 14.046 2.865 -1.042
79 HB3 SER 10 2HB SER 10 14.026 2.196 -2.674
80 HG SER 10 HG SER 10 12.890 3.982 -2.965
81 H LYS 11 H LYS 11 10.303 0.498 -0.804
82 HA LYS 11 HA LYS 11 10.148 1.116 1.938
83 HB2 LYS 11 1HB LYS 11 9.949 3.386 0.345
84 HB3 LYS 11 2HB LYS 11 8.278 2.982 0.716
85 HG2 LYS 11 1HG LYS 11 8.583 3.263 3.000
86 HG3 LYS 11 2HG LYS 11 10.338 3.108 2.882
87 HD2 LYS 11 1HD LYS 11 9.298 5.324 1.309
88 HD3 LYS 11 2HD LYS 11 8.914 5.469 3.027
89 HE2 LYS 11 1HE LYS 11 11.434 4.832 3.333
90 HE3 LYS 11 2HE LYS 11 11.574 5.396 1.669
91 HZ1 LYS 11 3HZ LYS 11 11.224 7.527 2.265
92 HZ2 LYS 11 1HZ LYS 11 11.804 6.997 3.763
93 HZ3 LYS 11 2HZ LYS 11 10.139 7.138 3.504
94 H ASN 12 H ASN 12 8.923 -0.583 2.440
95 HA ASN 12 HA ASN 12 6.775 -1.450 0.706
96 HB2 ASN 12 1HB ASN 12 8.149 -3.157 1.738
97 HB3 ASN 12 2HB ASN 12 7.796 -2.524 3.343
98 HD21 ASN 12 2HD2 ASN 12 6.294 -3.555 4.427
99 HD22 ASN 12 1HD2 ASN 12 5.013 -4.499 3.751
100 H GLU 13 H GLU 13 5.548 0.568 0.966
101 HA GLU 13 HA GLU 13 3.781 0.390 3.304
102 HB2 GLU 13 1HB GLU 13 3.753 2.784 3.582
103 HB3 GLU 13 2HB GLU 13 5.419 2.228 3.649
104 HG2 GLU 13 1HG GLU 13 5.102 2.800 0.994
105 HG3 GLU 13 2HG GLU 13 4.118 4.038 1.774
106 H CYS 14 H CYS 14 1.650 0.649 2.877
107 HA CYS 14 HA CYS 14 0.777 0.491 0.180
108 HB2 CYS 14 1HB CYS 14 -0.327 -0.011 2.717
109 HB3 CYS 14 2HB CYS 14 -1.346 1.226 1.992
110 HG CYS 14 HG CYS 14 -1.892 -0.280 -0.314
111 H LYS 15 H LYS 15 0.891 2.177 -1.151
112 HA LYS 15 HA LYS 15 0.224 4.849 -0.121
113 HB2 LYS 15 1HB LYS 15 2.326 5.024 -1.096
114 HB3 LYS 15 2HB LYS 15 1.944 3.875 -2.371
115 HG2 LYS 15 1HG LYS 15 2.160 6.147 -3.231
116 HG3 LYS 15 2HG LYS 15 0.527 5.517 -3.460
117 HD2 LYS 15 1HD LYS 15 0.520 6.771 -0.951
118 HD3 LYS 15 2HD LYS 15 1.398 7.858 -2.031
119 HE2 LYS 15 1HE LYS 15 -1.197 6.640 -2.890
120 HE3 LYS 15 2HE LYS 15 -1.185 8.052 -1.834
121 HZ1 LYS 15 3HZ LYS 15 0.428 8.093 -4.288
122 HZ2 LYS 15 1HZ LYS 15 -0.304 9.375 -3.461
123 HZ3 LYS 15 2HZ LYS 15 -1.242 8.332 -4.404
124 H TYR 16 H TYR 16 -1.864 5.301 -0.400
125 HA TYR 16 HA TYR 16 -3.015 4.913 -3.071
126 HB2 TYR 16 1HB TYR 16 -5.095 4.092 -2.167
127 HB3 TYR 16 2HB TYR 16 -3.788 3.079 -1.566
128 HD1 TYR 16 2HD TYR 16 -2.868 3.661 0.787
129 HD2 TYR 16 1HD TYR 16 -6.624 5.019 -0.678
130 HE1 TYR 16 2HE TYR 16 -3.617 4.057 3.095
131 HE2 TYR 16 1HE TYR 16 -7.383 5.422 1.626
132 HH TYR 16 HH TYR 16 -6.901 4.773 3.864
133 H LYS 17 H LYS 17 -5.222 6.111 -3.161
134 HA LYS 17 HA LYS 17 -4.828 8.754 -1.923
135 HB2 LYS 17 1HB LYS 17 -5.822 7.887 -4.598
136 HB3 LYS 17 2HB LYS 17 -6.481 9.364 -3.906
137 HG2 LYS 17 1HG LYS 17 -4.383 10.418 -3.886
138 HG3 LYS 17 2HG LYS 17 -3.527 8.898 -4.149
139 HD2 LYS 17 1HD LYS 17 -4.013 8.854 -6.391
140 HD3 LYS 17 2HD LYS 17 -5.496 9.792 -6.196
141 HE2 LYS 17 1HE LYS 17 -4.357 11.571 -6.895
142 HE3 LYS 17 2HE LYS 17 -3.458 11.504 -5.381
143 HZ1 LYS 17 3HZ LYS 17 -2.538 11.023 -8.004
144 HZ2 LYS 17 1HZ LYS 17 -2.318 9.627 -7.074
145 HZ3 LYS 17 2HZ LYS 17 -1.650 11.095 -6.566
146 H ASN 18 H ASN 18 -6.247 9.344 -0.429
147 HA ASN 18 HA ASN 18 -8.877 8.018 -0.393
148 HB2 ASN 18 1HB ASN 18 -8.860 8.030 1.922
149 HB3 ASN 18 2HB ASN 18 -7.149 7.802 1.573
150 HD21 ASN 18 2HD2 ASN 18 -5.909 9.908 1.349
151 HD22 ASN 18 1HD2 ASN 18 -6.248 11.122 2.531
152 H ASP 19 H ASP 19 -10.631 9.361 0.623
153 HA ASP 19 HA ASP 19 -11.916 11.243 0.742
154 HB2 ASP 19 1HB ASP 19 -9.699 12.204 1.693
155 HB3 ASP 19 2HB ASP 19 -9.531 12.957 0.109
156 H ALA 20 H ALA 20 -9.436 12.167 -1.645
157 HA ALA 20 HA ALA 20 -11.027 11.627 -3.912
158 HB1 ALA 20 1HB ALA 20 -12.402 13.454 -3.117
159 HB2 ALA 20 2HB ALA 20 -10.992 14.511 -3.031
160 HB3 ALA 20 3HB ALA 20 -11.565 13.929 -4.594
161 H GLY 21 H GLY 21 -8.393 11.112 -3.243
162 HA2 GLY 21 1HA GLY 21 -6.635 11.073 -4.929
163 HA3 GLY 21 2HA GLY 21 -6.971 12.772 -5.226
164 H LYS 22 H LYS 22 -7.059 11.914 -1.941
165 HA LYS 22 HA LYS 22 -4.624 13.416 -1.457
166 HB2 LYS 22 1HB LYS 22 -7.053 12.932 -0.040
167 HB3 LYS 22 2HB LYS 22 -5.715 12.380 0.960
168 HG2 LYS 22 1HG LYS 22 -5.827 15.108 -0.301
169 HG3 LYS 22 2HG LYS 22 -6.416 14.753 1.324
170 HD2 LYS 22 1HD LYS 22 -3.867 13.641 1.241
171 HD3 LYS 22 2HD LYS 22 -3.709 15.179 0.390
172 HE2 LYS 22 1HE LYS 22 -4.882 16.253 2.337
173 HE3 LYS 22 2HE LYS 22 -4.736 14.714 3.183
174 HZ1 LYS 22 3HZ LYS 22 -2.922 16.052 3.845
175 HZ2 LYS 22 1HZ LYS 22 -2.543 16.475 2.250
176 HZ3 LYS 22 2HZ LYS 22 -2.289 14.892 2.789
177 H ASP 23 H ASP 23 -2.732 12.409 -1.462
178 HA ASP 23 HA ASP 23 -2.284 9.686 -1.465
179 HB2 ASP 23 1HB ASP 23 0.059 10.357 -0.593
180 HB3 ASP 23 2HB ASP 23 -0.472 10.997 -2.146
181 H THR 24 H THR 24 -1.625 8.182 0.088
182 HA THR 24 HA THR 24 -1.723 8.924 2.899
183 HB THR 24 HB THR 24 -3.528 6.725 1.887
184 HG1 THR 24 1HG THR 24 -4.419 8.661 1.192
185 HG21 THR 24 3HG2 THR 24 -3.994 8.033 4.483
186 HG22 THR 24 1HG2 THR 24 -2.510 7.088 4.375
187 HG23 THR 24 2HG2 THR 24 -4.067 6.327 4.044
188 H PHE 25 H PHE 25 -0.396 7.704 4.126
189 HA PHE 25 HA PHE 25 0.622 5.188 2.998
190 HB2 PHE 25 1HB PHE 25 2.375 7.200 4.412
191 HB3 PHE 25 2HB PHE 25 2.881 5.741 3.565
192 HD1 PHE 25 2HD PHE 25 1.532 9.143 3.131
193 HD2 PHE 25 1HD PHE 25 3.228 5.736 1.225
194 HE1 PHE 25 2HE PHE 25 1.844 10.454 1.072
195 HE2 PHE 25 1HE PHE 25 3.543 7.042 -0.837
196 HZ PHE 25 HZ PHE 25 2.849 9.403 -0.915
197 H ILE 26 H ILE 26 0.828 3.541 4.414
198 HA ILE 26 HA ILE 26 0.937 4.023 7.267
199 HB ILE 26 HB ILE 26 -1.504 4.084 6.705
200 HG12 ILE 26 1HG1 ILE 26 -1.515 1.697 8.314
201 HG13 ILE 26 2HG1 ILE 26 -0.148 2.711 8.766
202 HG21 ILE 26 1HG2 ILE 26 -1.004 2.101 4.978
203 HG22 ILE 26 2HG2 ILE 26 -1.546 1.150 6.360
204 HG23 ILE 26 3HG2 ILE 26 -2.598 2.390 5.676
205 HD11 ILE 26 3HD1 ILE 26 -2.303 4.458 8.538
206 HD12 ILE 26 1HD1 ILE 26 -2.943 3.030 9.352
207 HD13 ILE 26 2HD1 ILE 26 -1.547 3.875 10.021
208 H LYS 27 H LYS 27 2.747 2.842 5.450
209 HA LYS 27 HA LYS 27 4.054 1.001 5.158
210 HB2 LYS 27 1HB LYS 27 3.363 1.156 7.911
211 HB3 LYS 27 2HB LYS 27 3.352 -0.544 7.457
212 HG2 LYS 27 1HG LYS 27 5.539 -0.408 7.949
213 HG3 LYS 27 2HG LYS 27 5.656 0.226 6.306
214 HD2 LYS 27 1HD LYS 27 5.081 2.489 7.670
215 HD3 LYS 27 2HD LYS 27 5.980 1.593 8.897
216 HE2 LYS 27 1HE LYS 27 7.839 1.314 7.353
217 HE3 LYS 27 2HE LYS 27 6.935 2.145 6.089
218 HZ1 LYS 27 3HZ LYS 27 6.846 4.060 7.771
219 HZ2 LYS 27 1HZ LYS 27 8.299 3.785 6.949
220 HZ3 LYS 27 2HZ LYS 27 8.119 3.263 8.548
221 H CYS 28 H CYS 28 3.968 -1.576 5.395
222 HA CYS 28 HA CYS 28 1.308 -2.490 4.547
223 HB2 CYS 28 1HB CYS 28 3.815 -2.495 3.008
224 HB3 CYS 28 2HB CYS 28 2.973 -4.039 3.025
225 HG CYS 28 HG CYS 28 1.085 -3.421 1.376
226 HA PRO 29 HA PRO 29 1.987 -5.765 7.404
227 HB2 PRO 29 1HB PRO 29 0.256 -7.596 6.391
228 HB3 PRO 29 2HB PRO 29 -0.273 -6.154 7.266
229 HG2 PRO 29 1HG PRO 29 -0.143 -6.638 4.314
230 HG3 PRO 29 2HG PRO 29 -1.421 -5.859 5.265
231 HD2 PRO 29 1HD PRO 29 0.411 -4.449 3.856
232 HD3 PRO 29 2HD PRO 29 -0.293 -3.853 5.373
233 H LYS 30 H LYS 30 4.210 -5.891 6.259
234 HA LYS 30 HA LYS 30 4.494 -8.623 5.243
235 HB2 LYS 30 1HB LYS 30 6.014 -6.324 4.022
236 HB3 LYS 30 2HB LYS 30 5.931 -7.986 3.455
237 HG2 LYS 30 1HG LYS 30 3.591 -6.094 3.511
238 HG3 LYS 30 2HG LYS 30 4.609 -6.391 2.100
239 HD2 LYS 30 1HD LYS 30 3.754 -8.477 1.753
240 HD3 LYS 30 2HD LYS 30 3.438 -8.752 3.467
241 HE2 LYS 30 1HE LYS 30 1.695 -6.777 3.029
242 HE3 LYS 30 2HE LYS 30 1.759 -7.450 1.401
243 HZ1 LYS 30 3HZ LYS 30 0.024 -8.392 2.953
244 HZ2 LYS 30 1HZ LYS 30 1.292 -9.140 3.786
245 HZ3 LYS 30 2HZ LYS 30 1.007 -9.520 2.163
246 H PHE 31 H PHE 31 5.038 -8.560 7.674
247 HA PHE 31 HA PHE 31 7.620 -7.485 8.357
248 HB2 PHE 31 1HB PHE 31 5.514 -9.050 9.794
249 HB3 PHE 31 2HB PHE 31 7.141 -8.997 10.464
250 HD1 PHE 31 2HD PHE 31 4.258 -6.920 9.459
251 HD2 PHE 31 1HD PHE 31 7.932 -7.094 11.602
252 HE1 PHE 31 2HE PHE 31 3.757 -4.742 10.488
253 HE2 PHE 31 1HE PHE 31 7.436 -4.917 12.635
254 HZ PHE 31 HZ PHE 31 5.347 -3.737 12.077
255 H ASP 32 H ASP 32 9.006 -8.509 6.868
256 HA ASP 32 HA ASP 32 10.388 -10.134 6.063
257 HB2 ASP 32 1HB ASP 32 11.057 -9.930 8.516
258 HB3 ASP 32 2HB ASP 32 10.126 -11.400 8.788
259 H ASN 33 H ASN 33 8.897 -11.001 4.570
260 HA ASN 33 HA ASN 33 8.489 -13.759 4.731
261 HB2 ASN 33 1HB ASN 33 6.626 -12.521 6.290
262 HB3 ASN 33 2HB ASN 33 5.775 -12.606 4.750
263 HD21 ASN 33 2HD2 ASN 33 4.524 -14.307 4.614
264 HD22 ASN 33 1HD2 ASN 33 4.847 -15.872 5.271
265 H LYS 34 H LYS 34 7.264 -10.723 3.412
266 HA LYS 34 HA LYS 34 7.905 -11.397 0.757
267 HB2 LYS 34 1HB LYS 34 5.976 -12.920 1.004
268 HB3 LYS 34 2HB LYS 34 4.958 -11.548 1.415
269 HG2 LYS 34 1HG LYS 34 5.962 -10.710 -0.942
270 HG3 LYS 34 2HG LYS 34 5.949 -12.456 -1.199
271 HD2 LYS 34 1HD LYS 34 3.520 -12.235 -0.187
272 HD3 LYS 34 2HD LYS 34 3.680 -10.576 -0.768
273 HE2 LYS 34 1HE LYS 34 2.661 -11.814 -2.515
274 HE3 LYS 34 2HE LYS 34 4.333 -11.539 -3.001
275 HZ1 LYS 34 3HZ LYS 34 3.745 -13.797 -3.458
276 HZ2 LYS 34 1HZ LYS 34 3.203 -14.043 -1.874
277 HZ3 LYS 34 2HZ LYS 34 4.848 -13.791 -2.176
278 H LYS 35 H LYS 35 8.735 -9.237 1.654
279 HA LYS 35 HA LYS 35 6.865 -7.051 1.667
280 HB2 LYS 35 1HB LYS 35 9.875 -6.877 1.525
281 HB3 LYS 35 2HB LYS 35 8.755 -5.648 2.100
282 HG2 LYS 35 1HG LYS 35 9.073 -6.408 4.153
283 HG3 LYS 35 2HG LYS 35 8.267 -7.905 3.677
284 HD2 LYS 35 1HD LYS 35 10.382 -8.500 4.598
285 HD3 LYS 35 2HD LYS 35 10.490 -8.727 2.851
286 HE2 LYS 35 1HE LYS 35 11.603 -6.554 2.645
287 HE3 LYS 35 2HE LYS 35 11.498 -6.336 4.392
288 HZ1 LYS 35 3HZ LYS 35 13.137 -7.840 4.772
289 HZ2 LYS 35 1HZ LYS 35 13.638 -7.314 3.245
290 HZ3 LYS 35 2HZ LYS 35 12.786 -8.766 3.401
291 H CYS 36 H CYS 36 7.662 -5.036 0.297
292 HA CYS 36 HA CYS 36 6.949 -5.460 -2.330
293 HB2 CYS 36 1HB CYS 36 7.937 -3.231 -2.797
294 HB3 CYS 36 2HB CYS 36 6.933 -3.241 -1.352
295 HG CYS 36 HG CYS 36 10.355 -3.351 -1.347
296 H THR 37 H THR 37 8.158 -5.376 -4.309
297 HA THR 37 HA THR 37 11.004 -5.796 -4.272
298 HB THR 37 HB THR 37 10.199 -8.058 -3.690
299 HG1 THR 37 1HG THR 37 11.128 -8.128 -6.365
300 HG21 THR 37 3HG2 THR 37 8.366 -8.895 -4.635
301 HG22 THR 37 1HG2 THR 37 9.180 -8.902 -6.200
302 HG23 THR 37 2HG2 THR 37 8.255 -7.488 -5.693
303 H LYS 38 H LYS 38 9.341 -3.876 -5.480
304 HA LYS 38 HA LYS 38 10.353 -3.811 -8.080
305 HB2 LYS 38 1HB LYS 38 8.156 -5.524 -7.907
306 HB3 LYS 38 2HB LYS 38 7.503 -4.034 -8.576
307 HG2 LYS 38 1HG LYS 38 10.019 -4.987 -9.775
308 HG3 LYS 38 2HG LYS 38 8.593 -5.988 -10.058
309 HD2 LYS 38 1HD LYS 38 7.402 -4.105 -10.983
310 HD3 LYS 38 2HD LYS 38 8.732 -3.018 -10.576
311 HE2 LYS 38 1HE LYS 38 10.191 -4.203 -12.123
312 HE3 LYS 38 2HE LYS 38 8.895 -5.338 -12.498
313 HZ1 LYS 38 3HZ LYS 38 8.555 -2.435 -12.921
314 HZ2 LYS 38 1HZ LYS 38 7.695 -3.713 -13.619
315 HZ3 LYS 38 2HZ LYS 38 9.290 -3.409 -14.094
316 H ASP 39 H ASP 39 9.824 -1.884 -9.189
317 HA ASP 39 HA ASP 39 9.005 0.251 -7.463
318 HB2 ASP 39 1HB ASP 39 9.334 0.621 -10.413
319 HB3 ASP 39 2HB ASP 39 9.802 1.690 -9.093
320 H ASN 40 H ASN 40 6.907 0.417 -6.968
321 HA ASN 40 HA ASN 40 4.682 0.833 -7.217
322 HB2 ASN 40 1HB ASN 40 4.950 1.006 -10.196
323 HB3 ASN 40 2HB ASN 40 3.932 1.949 -9.111
324 HD21 ASN 40 2HD2 ASN 40 5.595 2.950 -7.297
325 HD22 ASN 40 1HD2 ASN 40 6.797 3.952 -8.032
326 H ASN 41 H ASN 41 5.525 -1.801 -7.083
327 HA ASN 41 HA ASN 41 4.640 -3.537 -9.056
328 HB2 ASN 41 1HB ASN 41 4.170 -5.065 -6.950
329 HB3 ASN 41 2HB ASN 41 5.817 -4.634 -7.406
330 HD21 ASN 41 2HD2 ASN 41 6.516 -4.959 -5.284
331 HD22 ASN 41 1HD2 ASN 41 6.186 -3.812 -4.035
332 H LYS 42 H LYS 42 2.840 -3.142 -6.018
333 HA LYS 42 HA LYS 42 0.429 -2.251 -7.079
334 HB2 LYS 42 1HB LYS 42 0.199 -4.226 -8.363
335 HB3 LYS 42 2HB LYS 42 0.742 -5.247 -7.037
336 HG2 LYS 42 1HG LYS 42 -1.289 -5.109 -5.929
337 HG3 LYS 42 2HG LYS 42 -1.771 -3.645 -6.789
338 HD2 LYS 42 1HD LYS 42 -2.938 -4.951 -8.166
339 HD3 LYS 42 2HD LYS 42 -1.398 -5.552 -8.784
340 HE2 LYS 42 1HE LYS 42 -1.487 -7.472 -7.520
341 HE3 LYS 42 2HE LYS 42 -2.525 -6.745 -6.295
342 HZ1 LYS 42 3HZ LYS 42 -3.257 -8.263 -8.562
343 HZ2 LYS 42 1HZ LYS 42 -3.965 -6.729 -8.659
344 HZ3 LYS 42 2HZ LYS 42 -4.233 -7.700 -7.301
345 H CYS 43 H CYS 43 -1.167 -2.021 -5.506
346 HA CYS 43 HA CYS 43 -0.805 -3.279 -2.916
347 HB2 CYS 43 1HB CYS 43 -0.426 -1.354 -1.659
348 HB3 CYS 43 2HB CYS 43 0.586 -1.093 -3.073
349 HG CYS 43 HG CYS 43 -2.362 0.427 -2.293
350 H THR 44 H THR 44 -2.554 -2.279 -1.353
351 HA THR 44 HA THR 44 -4.942 -1.290 -2.562
352 HB THR 44 HB THR 44 -5.878 -3.731 -1.458
353 HG1 THR 44 1HG THR 44 -4.796 -5.251 -2.674
354 HG21 THR 44 3HG2 THR 44 -6.725 -2.152 -3.354
355 HG22 THR 44 1HG2 THR 44 -7.069 -3.879 -3.440
356 HG23 THR 44 2HG2 THR 44 -5.758 -3.192 -4.399
357 H VAL 45 H VAL 45 -6.430 -0.593 -1.052
358 HA VAL 45 HA VAL 45 -5.922 -1.233 1.765
359 HB VAL 45 HB VAL 45 -6.136 1.554 0.628
360 HG11 VAL 45 1HG1 VAL 45 -6.327 0.588 3.471
361 HG12 VAL 45 2HG1 VAL 45 -5.925 2.253 3.046
362 HG13 VAL 45 3HG1 VAL 45 -7.483 1.573 2.576
363 HG21 VAL 45 3HG2 VAL 45 -3.964 -0.055 1.888
364 HG22 VAL 45 1HG2 VAL 45 -3.906 1.017 0.489
365 HG23 VAL 45 2HG2 VAL 45 -3.982 1.694 2.115
366 H ASP 46 H ASP 46 -7.717 -1.307 3.044
367 HA ASP 46 HA ASP 46 -10.289 -0.678 1.750
368 HB2 ASP 46 1HB ASP 46 -9.639 -3.168 2.148
369 HB3 ASP 46 2HB ASP 46 -10.015 -2.821 3.834
370 H THR 47 H THR 47 -10.629 1.303 2.675
371 HA THR 47 HA THR 47 -10.109 1.992 5.342
372 HB THR 47 HB THR 47 -10.440 3.792 3.856
373 HG1 THR 47 1HG THR 47 -11.396 4.696 5.519
374 HG21 THR 47 3HG2 THR 47 -11.681 2.829 2.088
375 HG22 THR 47 1HG2 THR 47 -12.693 4.123 2.727
376 HG23 THR 47 2HG2 THR 47 -13.038 2.445 3.147
377 H TYR 48 H TYR 48 -12.541 0.024 4.006
378 HA TYR 48 HA TYR 48 -14.745 0.437 5.609
379 HB2 TYR 48 1HB TYR 48 -14.778 -1.143 3.765
380 HB3 TYR 48 2HB TYR 48 -13.626 -2.184 4.594
381 HD1 TYR 48 2HD TYR 48 -17.081 -0.854 4.746
382 HD2 TYR 48 1HD TYR 48 -14.354 -3.801 6.152
383 HE1 TYR 48 2HE TYR 48 -18.944 -2.069 5.795
384 HE2 TYR 48 1HE TYR 48 -16.209 -5.024 7.205
385 HH TYR 48 HH TYR 48 -19.326 -4.624 6.470
386 H ASN 49 H ASN 49 -11.809 -1.389 6.332
387 HA ASN 49 HA ASN 49 -12.420 -1.186 9.173
388 HB2 ASN 49 1HB ASN 49 -13.238 -3.440 8.119
389 HB3 ASN 49 2HB ASN 49 -11.528 -3.860 8.149
390 HD21 ASN 49 2HD2 ASN 49 -11.188 -5.168 9.788
391 HD22 ASN 49 1HD2 ASN 49 -11.787 -4.964 11.395
392 H ASN 50 H ASN 50 -10.512 0.149 7.559
393 HA ASN 50 HA ASN 50 -8.285 0.622 7.384
394 HB2 ASN 50 1HB ASN 50 -8.933 0.748 9.945
395 HB3 ASN 50 2HB ASN 50 -7.834 -0.623 10.064
396 HD21 ASN 50 2HD2 ASN 50 -7.801 2.352 8.134
397 HD22 ASN 50 1HD2 ASN 50 -6.244 2.881 8.663
398 H ALA 51 H ALA 51 -8.508 -1.394 5.843
399 HA ALA 51 HA ALA 51 -6.736 -3.554 6.737
400 HB1 ALA 51 1HB ALA 51 -7.800 -4.945 5.309
401 HB2 ALA 51 2HB ALA 51 -9.087 -3.748 5.461
402 HB3 ALA 51 3HB ALA 51 -8.000 -3.703 4.073
403 H VAL 52 H VAL 52 -5.056 -4.315 5.282
404 HA VAL 52 HA VAL 52 -4.125 -2.416 3.271
405 HB VAL 52 HB VAL 52 -2.301 -3.325 5.499
406 HG11 VAL 52 1HG1 VAL 52 -0.629 -2.063 4.509
407 HG12 VAL 52 2HG1 VAL 52 -1.450 -2.766 3.113
408 HG13 VAL 52 3HG1 VAL 52 -1.771 -1.094 3.578
409 HG21 VAL 52 3HG2 VAL 52 -3.715 -1.811 6.569
410 HG22 VAL 52 1HG2 VAL 52 -2.357 -0.813 6.049
411 HG23 VAL 52 2HG2 VAL 52 -3.866 -0.793 5.137
412 H ASP 53 H ASP 53 -3.135 -3.381 1.589
413 HA ASP 53 HA ASP 53 -2.251 -6.166 1.896
414 HB2 ASP 53 1HB ASP 53 -4.481 -5.219 0.334
415 HB3 ASP 53 2HB ASP 53 -3.259 -5.923 -0.723
416 H CYS 54 H CYS 54 -1.262 -6.763 -0.478
417 HA CYS 54 HA CYS 54 0.205 -4.652 -1.719
418 HB2 CYS 54 1HB CYS 54 1.354 -5.294 0.593
419 HB3 CYS 54 2HB CYS 54 2.028 -6.595 -0.381
420 HG CYS 54 HG CYS 54 3.621 -5.136 -1.905
421 H ASP 55 H ASP 55 1.817 -5.544 -3.317
422 HA ASP 55 HA ASP 55 0.573 -7.525 -4.896
423 HB2 ASP 55 1HB ASP 55 2.206 -5.601 -5.565
424 HB3 ASP 55 2HB ASP 55 3.462 -6.790 -5.235