Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
641104 | 6mjv RC | 30520 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 LYS 1 1H LYS 1 25.161 10.017 -6.491
2 H2 LYS 1 2H LYS 1 24.546 8.725 -7.404
3 H3 LYS 1 3H LYS 1 25.971 9.507 -7.892
4 HA LYS 1 HA LYS 1 27.010 7.827 -6.869
5 HB2 LYS 1 1HB LYS 1 27.600 8.376 -4.626
6 HB3 LYS 1 2HB LYS 1 27.279 9.901 -5.437
7 HG2 LYS 1 1HG LYS 1 24.797 9.430 -4.501
8 HG3 LYS 1 2HG LYS 1 25.693 8.491 -3.319
9 HD2 LYS 1 1HD LYS 1 25.633 10.580 -2.291
10 HD3 LYS 1 2HD LYS 1 27.182 10.655 -3.125
11 HE2 LYS 1 1HE LYS 1 26.136 11.868 -4.995
12 HE3 LYS 1 2HE LYS 1 24.563 11.739 -4.212
13 HZ1 LYS 1 1HZ LYS 1 26.659 12.858 -2.567
14 HZ2 LYS 1 2HZ LYS 1 25.050 13.366 -2.782
15 HZ3 LYS 1 3HZ LYS 1 26.238 13.802 -3.915
16 H LYS 2 H LYS 2 24.253 7.210 -7.474
17 HA LYS 2 HA LYS 2 23.063 5.849 -5.253
18 HB2 LYS 2 1HB LYS 2 22.463 5.172 -8.125
19 HB3 LYS 2 2HB LYS 2 21.382 5.195 -6.740
20 HG2 LYS 2 1HG LYS 2 22.018 7.791 -6.723
21 HG3 LYS 2 2HG LYS 2 22.406 7.475 -8.406
22 HD2 LYS 2 1HD LYS 2 20.163 8.077 -8.562
23 HD3 LYS 2 2HD LYS 2 20.036 6.326 -8.457
24 HE2 LYS 2 1HE LYS 2 19.872 6.725 -5.879
25 HE3 LYS 2 2HE LYS 2 19.506 8.388 -6.325
26 HZ1 LYS 2 1HZ LYS 2 18.062 6.019 -7.379
27 HZ2 LYS 2 2HZ LYS 2 17.658 7.652 -7.621
28 HZ3 LYS 2 3HZ LYS 2 17.525 6.964 -6.074
29 H CYS 3 H CYS 3 22.771 3.535 -5.075
30 HA CYS 3 HA CYS 3 25.274 2.134 -5.666
31 HB2 CYS 3 1HB CYS 3 22.863 1.370 -4.003
32 HB3 CYS 3 2HB CYS 3 24.289 0.355 -4.216
33 H TRP 4 H TRP 4 24.519 -0.426 -5.814
34 HA TRP 4 HA TRP 4 23.379 -0.508 -8.552
35 HB2 TRP 4 1HB TRP 4 25.643 -2.310 -7.802
36 HB3 TRP 4 2HB TRP 4 25.248 -1.602 -9.367
37 HD1 TRP 4 HD1 TRP 4 26.600 -0.552 -5.914
38 HE1 TRP 4 HE1 TRP 4 28.266 1.384 -6.250
39 HE3 TRP 4 HE3 TRP 4 26.169 0.112 -10.954
40 HZ2 TRP 4 HZ2 TRP 4 29.533 2.746 -8.444
41 HZ3 TRP 4 HZ3 TRP 4 27.625 1.722 -12.138
42 HH2 TRP 4 HH2 TRP 4 29.169 3.180 -10.866
43 H ASN 5 H ASN 5 22.902 -2.854 -9.163
44 HA ASN 5 HA ASN 5 21.438 -4.601 -8.749
45 HB2 ASN 5 1HB ASN 5 23.666 -4.972 -6.740
46 HB3 ASN 5 2HB ASN 5 22.418 -6.188 -7.015
47 HD21 ASN 5 1HD2 ASN 5 25.521 -5.394 -7.929
48 HD22 ASN 5 2HD2 ASN 5 25.555 -6.275 -9.378
49 H GLY 6 H GLY 6 20.724 -2.144 -7.380
50 HA2 GLY 6 1HA GLY 6 18.990 -1.517 -6.033
51 HA3 GLY 6 2HA GLY 6 18.655 -3.226 -5.759
52 H GLY 7 H GLY 7 21.826 -2.737 -4.927
53 HA2 GLY 7 1HA GLY 7 21.574 -2.935 -2.215
54 HA3 GLY 7 2HA GLY 7 22.995 -2.259 -3.016
55 H ARG 8 H ARG 8 22.817 -1.148 -0.738
56 HA ARG 8 HA ARG 8 21.771 1.550 -1.343
57 HB2 ARG 8 1HB ARG 8 21.230 1.808 1.055
58 HB3 ARG 8 2HB ARG 8 20.250 0.575 0.274
59 HG2 ARG 8 1HG ARG 8 21.331 -1.184 1.356
60 HG3 ARG 8 2HG ARG 8 22.802 -0.263 1.631
61 HD2 ARG 8 1HD ARG 8 21.661 -0.521 3.744
62 HD3 ARG 8 2HD ARG 8 21.573 1.164 3.258
63 HE ARG 8 HE ARG 8 19.318 -0.669 2.699
64 HH11 ARG 8 1HH1 ARG 8 19.645 0.289 5.576
65 HH12 ARG 8 2HH1 ARG 8 18.620 1.687 5.609
66 HH21 ARG 8 1HH2 ARG 8 18.413 1.941 2.159
67 HH22 ARG 8 2HH2 ARG 8 17.904 2.610 3.675
68 H CYS 9 H CYS 9 22.734 3.132 0.388
69 HA CYS 9 HA CYS 9 25.631 2.583 0.669
70 HB2 CYS 9 1HB CYS 9 24.064 5.100 0.253
71 HB3 CYS 9 2HB CYS 9 25.606 5.176 1.100
72 H ARG 10 H ARG 10 26.248 2.034 2.660
73 HA ARG 10 HA ARG 10 25.570 3.761 4.879
74 HB2 ARG 10 1HB ARG 10 24.297 1.168 4.476
75 HB3 ARG 10 2HB ARG 10 25.166 1.197 5.998
76 HG2 ARG 10 1HG ARG 10 23.299 3.447 5.240
77 HG3 ARG 10 2HG ARG 10 22.699 1.970 5.984
78 HD2 ARG 10 1HD ARG 10 24.930 3.652 7.155
79 HD3 ARG 10 2HD ARG 10 23.239 3.809 7.621
80 HE ARG 10 HE ARG 10 24.326 1.118 7.824
81 HH11 ARG 10 1HH1 ARG 10 25.982 1.783 9.833
82 HH12 ARG 10 2HH1 ARG 10 25.042 2.191 11.228
83 HH21 ARG 10 1HH2 ARG 10 22.065 2.418 9.473
84 HH22 ARG 10 2HH2 ARG 10 22.822 2.544 11.024
85 H LYS 11 H LYS 11 27.025 3.457 6.703
86 HA LYS 11 HA LYS 11 29.649 2.648 6.064
87 HB2 LYS 11 1HB LYS 11 28.234 3.097 8.686
88 HB3 LYS 11 2HB LYS 11 29.901 2.528 8.641
89 HG2 LYS 11 1HG LYS 11 30.441 4.523 7.174
90 HG3 LYS 11 2HG LYS 11 28.807 5.104 7.506
91 HD2 LYS 11 1HD LYS 11 29.249 5.285 9.852
92 HD3 LYS 11 2HD LYS 11 30.778 4.420 9.696
93 HE2 LYS 11 1HE LYS 11 31.213 6.821 9.880
94 HE3 LYS 11 2HE LYS 11 31.640 6.267 8.263
95 HZ1 LYS 11 1HZ LYS 11 30.399 8.252 8.031
96 HZ2 LYS 11 2HZ LYS 11 29.183 7.707 9.084
97 HZ3 LYS 11 3HZ LYS 11 29.374 6.980 7.561
98 H LYS 12 H LYS 12 26.872 0.856 6.842
99 HA LYS 12 HA LYS 12 28.484 -1.627 6.968
100 HB2 LYS 12 1HB LYS 12 27.160 -0.713 9.095
101 HB3 LYS 12 2HB LYS 12 25.786 -1.441 8.280
102 HG2 LYS 12 1HG LYS 12 26.927 -3.605 8.218
103 HG3 LYS 12 2HG LYS 12 28.372 -2.888 8.928
104 HD2 LYS 12 1HD LYS 12 27.095 -2.305 10.956
105 HD3 LYS 12 2HD LYS 12 25.644 -3.012 10.247
106 HE2 LYS 12 1HE LYS 12 27.030 -5.177 10.015
107 HE3 LYS 12 2HE LYS 12 28.172 -4.414 11.121
108 HZ1 LYS 12 1HZ LYS 12 26.865 -4.938 12.807
109 HZ2 LYS 12 2HZ LYS 12 25.788 -5.717 11.748
110 HZ3 LYS 12 3HZ LYS 12 25.573 -4.073 12.120
111 H CYS 13 H CYS 13 26.971 -3.554 6.412
112 HA CYS 13 HA CYS 13 25.515 -2.833 3.929
113 HB2 CYS 13 1HB CYS 13 26.703 -5.511 4.719
114 HB3 CYS 13 2HB CYS 13 26.051 -5.063 3.163
115 H LYS 14 H LYS 14 23.429 -2.974 3.941
116 HA LYS 14 HA LYS 14 21.772 -3.609 5.959
117 HB2 LYS 14 1HB LYS 14 20.768 -2.640 4.092
118 HB3 LYS 14 2HB LYS 14 21.409 -3.847 2.987
119 HG2 LYS 14 1HG LYS 14 19.855 -5.513 3.818
120 HG3 LYS 14 2HG LYS 14 19.359 -4.450 5.133
121 HD2 LYS 14 1HD LYS 14 18.398 -2.868 3.560
122 HD3 LYS 14 2HD LYS 14 18.977 -3.819 2.197
123 HE2 LYS 14 1HE LYS 14 17.186 -5.100 4.252
124 HE3 LYS 14 2HE LYS 14 16.493 -4.102 2.977
125 HZ1 LYS 14 1HZ LYS 14 16.769 -6.579 2.525
126 HZ2 LYS 14 2HZ LYS 14 18.426 -6.245 2.362
127 HZ3 LYS 14 3HZ LYS 14 17.304 -5.497 1.330
128 H GLU 15 H GLU 15 20.291 -5.439 6.315
129 HA GLU 15 HA GLU 15 21.365 -7.656 7.217
130 HB2 GLU 15 1HB GLU 15 18.798 -7.607 5.614
131 HB3 GLU 15 2HB GLU 15 19.264 -8.895 6.722
132 HG2 GLU 15 1HG GLU 15 17.888 -7.527 8.050
133 HG3 GLU 15 2HG GLU 15 19.509 -7.001 8.485
134 H ASN 16 H ASN 16 22.989 -8.779 6.357
135 HA ASN 16 HA ASN 16 24.050 -10.356 5.082
136 HB2 ASN 16 1HB ASN 16 21.416 -10.873 3.702
137 HB3 ASN 16 2HB ASN 16 22.753 -11.993 3.960
138 HD21 ASN 16 1HD2 ASN 16 20.599 -13.154 4.897
139 HD22 ASN 16 2HD2 ASN 16 20.309 -12.899 6.549
140 H GLU 17 H GLU 17 24.413 -7.838 4.202
141 HA GLU 17 HA GLU 17 24.290 -8.098 1.250
142 HB2 GLU 17 1HB GLU 17 24.060 -5.708 3.086
143 HB3 GLU 17 2HB GLU 17 24.401 -5.534 1.372
144 HG2 GLU 17 1HG GLU 17 22.172 -7.258 1.524
145 HG3 GLU 17 2HG GLU 17 21.877 -6.091 2.773
146 H LYS 18 H LYS 18 25.997 -7.399 0.011
147 HA LYS 18 HA LYS 18 28.517 -7.985 1.360
148 HB2 LYS 18 1HB LYS 18 28.362 -7.689 -1.604
149 HB3 LYS 18 2HB LYS 18 29.294 -8.809 -0.632
150 HG2 LYS 18 1HG LYS 18 26.786 -9.653 0.002
151 HG3 LYS 18 2HG LYS 18 26.479 -9.002 -1.599
152 HD2 LYS 18 1HD LYS 18 28.648 -10.413 -2.216
153 HD3 LYS 18 2HD LYS 18 28.219 -11.292 -0.753
154 HE2 LYS 18 1HE LYS 18 25.846 -11.449 -1.758
155 HE3 LYS 18 2HE LYS 18 26.601 -10.977 -3.279
156 HZ1 LYS 18 1HZ LYS 18 26.624 -13.314 -3.232
157 HZ2 LYS 18 2HZ LYS 18 27.173 -13.367 -1.626
158 HZ3 LYS 18 3HZ LYS 18 28.214 -12.842 -2.862
159 HA PRO 19 HA PRO 19 29.476 -3.578 1.017
160 HB2 PRO 19 1HB PRO 19 32.337 -4.162 1.255
161 HB3 PRO 19 2HB PRO 19 31.281 -3.326 2.390
162 HG2 PRO 19 1HG PRO 19 32.333 -5.791 2.851
163 HG3 PRO 19 2HG PRO 19 30.804 -5.237 3.544
164 HD2 PRO 19 1HD PRO 19 31.268 -7.043 1.172
165 HD3 PRO 19 2HD PRO 19 30.077 -7.163 2.484
166 H ILE 20 H ILE 20 29.373 -2.674 -1.023
167 HA ILE 20 HA ILE 20 31.878 -2.921 -2.542
168 HB ILE 20 HB ILE 20 30.943 -3.408 -4.533
169 HG12 ILE 20 1HG1 ILE 20 28.095 -2.814 -3.792
170 HG13 ILE 20 2HG1 ILE 20 29.109 -1.488 -4.342
171 HG21 ILE 20 1HG2 ILE 20 29.208 -5.125 -4.230
172 HG22 ILE 20 2HG2 ILE 20 29.025 -4.644 -2.549
173 HG23 ILE 20 3HG2 ILE 20 30.559 -5.320 -3.105
174 HD11 ILE 20 1HD1 ILE 20 27.978 -2.416 -6.243
175 HD12 ILE 20 2HD1 ILE 20 28.537 -4.042 -5.844
176 HD13 ILE 20 3HD1 ILE 20 29.683 -2.811 -6.372
177 H GLY 21 H GLY 21 31.481 -1.393 -4.579
178 HA2 GLY 21 1HA GLY 21 32.008 0.829 -5.122
179 HA3 GLY 21 2HA GLY 21 30.292 0.917 -4.745
180 H TYR 22 H TYR 22 31.152 3.210 -4.384
181 HA TYR 22 HA TYR 22 32.043 3.537 -1.581
182 HB2 TYR 22 1HB TYR 22 33.761 3.879 -3.591
183 HB3 TYR 22 2HB TYR 22 32.983 5.453 -3.689
184 HD1 TYR 22 HD1 TYR 22 33.119 7.042 -1.785
185 HD2 TYR 22 HD2 TYR 22 35.066 3.217 -1.667
186 HE1 TYR 22 HE1 TYR 22 34.434 7.768 0.189
187 HE2 TYR 22 HE2 TYR 22 36.551 4.035 0.148
188 HH TYR 22 HH TYR 22 35.747 6.976 1.919
189 H CYS 23 H CYS 23 31.546 5.609 -0.663
190 HA CYS 23 HA CYS 23 29.419 7.178 -1.835
191 HB2 CYS 23 1HB CYS 23 28.743 4.818 -0.448
192 HB3 CYS 23 2HB CYS 23 28.394 6.131 0.666
193 H ARG 24 H ARG 24 28.435 8.422 0.361
194 HA ARG 24 HA ARG 24 30.652 10.187 0.856
195 HB2 ARG 24 1HB ARG 24 27.806 10.247 1.901
196 HB3 ARG 24 2HB ARG 24 28.969 11.564 2.021
197 HG2 ARG 24 1HG ARG 24 29.110 11.623 -0.468
198 HG3 ARG 24 2HG ARG 24 27.866 10.374 -0.540
199 HD2 ARG 24 1HD ARG 24 27.556 13.083 0.786
200 HD3 ARG 24 2HD ARG 24 26.909 12.657 -0.795
201 HE ARG 24 HE ARG 24 25.633 10.848 0.474
202 HH11 ARG 24 1HH1 ARG 24 26.977 12.685 2.862
203 HH12 ARG 24 2HH1 ARG 24 25.492 13.262 3.545
204 HH21 ARG 24 1HH2 ARG 24 23.525 12.064 0.956
205 HH22 ARG 24 2HH2 ARG 24 23.541 12.922 2.461
206 H ASN 25 H ASN 25 31.165 11.043 2.921
207 HA ASN 25 HA ASN 25 32.250 10.610 4.926
208 HB2 ASN 25 1HB ASN 25 29.480 9.966 5.900
209 HB3 ASN 25 2HB ASN 25 30.733 10.942 6.660
210 HD21 ASN 25 1HD2 ASN 25 31.386 12.605 4.387
211 HD22 ASN 25 2HD2 ASN 25 30.060 13.655 4.191
212 H GLY 26 H GLY 26 32.793 8.358 3.633
213 HA2 GLY 26 1HA GLY 26 33.770 6.376 4.383
214 HA3 GLY 26 2HA GLY 26 32.783 6.460 5.840
215 H LYS 27 H LYS 27 30.314 6.862 4.117
216 HA LYS 27 HA LYS 27 29.630 4.112 4.236
217 HB2 LYS 27 1HB LYS 27 27.825 6.017 2.799
218 HB3 LYS 27 2HB LYS 27 27.446 4.766 3.965
219 HG2 LYS 27 1HG LYS 27 28.809 6.359 5.610
220 HG3 LYS 27 2HG LYS 27 28.413 7.578 4.409
221 HD2 LYS 27 1HD LYS 27 26.054 7.200 4.670
222 HD3 LYS 27 2HD LYS 27 26.336 5.794 5.702
223 HE2 LYS 27 1HE LYS 27 27.485 7.271 7.344
224 HE3 LYS 27 2HE LYS 27 27.065 8.663 6.347
225 HZ1 LYS 27 1HZ LYS 27 25.526 7.811 8.309
226 HZ2 LYS 27 2HZ LYS 27 24.904 6.838 7.063
227 HZ3 LYS 27 3HZ LYS 27 24.888 8.530 6.908
228 H LYS 28 H LYS 28 29.201 2.651 2.680
229 HA LYS 28 HA LYS 28 30.344 3.217 -0.001
230 HB2 LYS 28 1HB LYS 28 30.442 0.502 1.287
231 HB3 LYS 28 2HB LYS 28 31.481 1.182 0.039
232 HG2 LYS 28 1HG LYS 28 32.336 2.828 1.741
233 HG3 LYS 28 2HG LYS 28 31.415 1.956 2.968
234 HD2 LYS 28 1HD LYS 28 32.647 -0.127 2.334
235 HD3 LYS 28 2HD LYS 28 33.633 0.833 1.233
236 HE2 LYS 28 1HE LYS 28 34.914 0.722 3.235
237 HE3 LYS 28 2HE LYS 28 34.173 2.320 3.264
238 HZ1 LYS 28 1HZ LYS 28 33.522 -0.061 4.852
239 HZ2 LYS 28 2HZ LYS 28 32.292 1.059 4.509
240 HZ3 LYS 28 3HZ LYS 28 33.681 1.555 5.348
241 H CYS 29 H CYS 29 29.429 1.672 -1.710
242 HA CYS 29 HA CYS 29 26.611 1.126 -1.176
243 HB2 CYS 29 1HB CYS 29 28.354 0.783 -3.617
244 HB3 CYS 29 2HB CYS 29 26.723 0.132 -3.541
245 H CYS 30 H CYS 30 26.249 -0.577 0.065
246 HA CYS 30 HA CYS 30 27.732 -3.071 -0.382
247 HB2 CYS 30 1HB CYS 30 25.437 -2.391 1.483
248 HB3 CYS 30 2HB CYS 30 26.204 -3.972 1.346
249 H VAL 31 H VAL 31 27.160 -4.093 -2.203
250 HA VAL 31 HA VAL 31 24.401 -4.036 -3.139
251 HB VAL 31 HB VAL 31 27.020 -4.966 -4.182
252 HG11 VAL 31 1HG1 VAL 31 25.717 -6.129 -6.091
253 HG12 VAL 31 2HG1 VAL 31 24.397 -6.236 -4.927
254 HG13 VAL 31 3HG1 VAL 31 25.938 -7.014 -4.583
255 HG21 VAL 31 1HG2 VAL 31 26.149 -2.788 -4.864
256 HG22 VAL 31 2HG2 VAL 31 24.650 -3.522 -5.382
257 HG23 VAL 31 3HG2 VAL 31 26.146 -3.893 -6.242
258 H ASN 32 H ASN 32 22.949 -5.289 -2.445
259 HA ASN 32 HA ASN 32 23.178 -7.183 -0.508
260 HB2 ASN 32 1HB ASN 32 21.079 -6.079 -1.548
261 HB3 ASN 32 2HB ASN 32 21.092 -7.435 -2.671
262 HD21 ASN 32 1HD2 ASN 32 19.721 -6.477 0.200
263 HD22 ASN 32 2HD2 ASN 32 19.515 -7.985 0.948
Start of MODEL 2
1 H1 LYS 1 1H LYS 1 26.265 9.694 -6.049
2 H2 LYS 1 2H LYS 1 25.398 9.462 -7.491
3 H3 LYS 1 3H LYS 1 27.014 9.981 -7.546
4 HA LYS 1 HA LYS 1 26.969 7.677 -8.109
5 HB2 LYS 1 1HB LYS 1 27.893 8.125 -5.254
6 HB3 LYS 1 2HB LYS 1 28.386 6.782 -6.285
7 HG2 LYS 1 1HG LYS 1 29.338 8.389 -7.909
8 HG3 LYS 1 2HG LYS 1 28.842 9.721 -6.871
9 HD2 LYS 1 1HD LYS 1 31.057 9.458 -6.211
10 HD3 LYS 1 2HD LYS 1 30.240 8.439 -5.034
11 HE2 LYS 1 1HE LYS 1 31.935 7.021 -5.773
12 HE3 LYS 1 2HE LYS 1 30.630 6.556 -6.861
13 HZ1 LYS 1 1HZ LYS 1 32.895 7.095 -7.864
14 HZ2 LYS 1 2HZ LYS 1 32.510 8.721 -7.562
15 HZ3 LYS 1 3HZ LYS 1 31.527 7.793 -8.590
16 H LYS 2 H LYS 2 25.178 6.451 -8.321
17 HA LYS 2 HA LYS 2 23.541 5.775 -5.976
18 HB2 LYS 2 1HB LYS 2 22.359 6.469 -7.996
19 HB3 LYS 2 2HB LYS 2 23.160 5.202 -8.922
20 HG2 LYS 2 1HG LYS 2 22.074 3.474 -7.612
21 HG3 LYS 2 2HG LYS 2 21.405 4.677 -6.506
22 HD2 LYS 2 1HD LYS 2 20.093 5.646 -8.356
23 HD3 LYS 2 2HD LYS 2 20.774 4.458 -9.468
24 HE2 LYS 2 1HE LYS 2 19.771 2.636 -8.167
25 HE3 LYS 2 2HE LYS 2 19.139 3.796 -6.998
26 HZ1 LYS 2 1HZ LYS 2 17.616 4.611 -8.495
27 HZ2 LYS 2 2HZ LYS 2 17.632 2.963 -8.904
28 HZ3 LYS 2 3HZ LYS 2 18.487 4.083 -9.854
29 H CYS 3 H CYS 3 23.162 3.633 -5.339
30 HA CYS 3 HA CYS 3 25.382 1.822 -5.786
31 HB2 CYS 3 1HB CYS 3 22.811 1.368 -4.254
32 HB3 CYS 3 2HB CYS 3 24.244 0.341 -4.225
33 H TRP 4 H TRP 4 24.241 -0.610 -5.737
34 HA TRP 4 HA TRP 4 23.095 -0.820 -8.456
35 HB2 TRP 4 1HB TRP 4 25.200 -2.763 -7.679
36 HB3 TRP 4 2HB TRP 4 24.885 -2.025 -9.242
37 HD1 TRP 4 HD1 TRP 4 26.108 -0.758 -5.772
38 HE1 TRP 4 HE1 TRP 4 28.232 0.611 -6.145
39 HE3 TRP 4 HE3 TRP 4 26.505 -1.135 -10.845
40 HZ2 TRP 4 HZ2 TRP 4 30.082 1.108 -8.294
41 HZ3 TRP 4 HZ3 TRP 4 28.374 -0.035 -12.033
42 HH2 TRP 4 HH2 TRP 4 30.062 1.273 -10.781
43 H ASN 5 H ASN 5 22.292 -3.065 -8.883
44 HA ASN 5 HA ASN 5 20.787 -4.712 -8.272
45 HB2 ASN 5 1HB ASN 5 22.845 -5.155 -6.095
46 HB3 ASN 5 2HB ASN 5 21.723 -6.349 -6.752
47 HD21 ASN 5 1HD2 ASN 5 24.900 -5.625 -6.887
48 HD22 ASN 5 2HD2 ASN 5 25.249 -6.044 -8.495
49 H GLY 6 H GLY 6 20.243 -2.117 -7.096
50 HA2 GLY 6 1HA GLY 6 18.667 -1.272 -5.651
51 HA3 GLY 6 2HA GLY 6 18.249 -2.937 -5.244
52 H GLY 7 H GLY 7 21.465 -2.789 -4.725
53 HA2 GLY 7 1HA GLY 7 21.423 -2.791 -1.968
54 HA3 GLY 7 2HA GLY 7 22.853 -2.388 -2.923
55 H ARG 8 H ARG 8 22.658 -1.112 -0.561
56 HA ARG 8 HA ARG 8 21.758 1.626 -1.254
57 HB2 ARG 8 1HB ARG 8 21.242 1.900 1.182
58 HB3 ARG 8 2HB ARG 8 20.150 0.825 0.319
59 HG2 ARG 8 1HG ARG 8 20.990 -1.095 1.326
60 HG3 ARG 8 2HG ARG 8 22.558 -0.376 1.663
61 HD2 ARG 8 1HD ARG 8 21.458 -0.561 3.763
62 HD3 ARG 8 2HD ARG 8 21.360 1.137 3.332
63 HE ARG 8 HE ARG 8 19.040 -0.277 2.454
64 HH11 ARG 8 1HH1 ARG 8 19.913 2.291 4.312
65 HH12 ARG 8 2HH1 ARG 8 18.869 1.984 5.659
66 HH21 ARG 8 1HH2 ARG 8 17.918 -1.157 4.556
67 HH22 ARG 8 2HH2 ARG 8 17.688 0.066 5.760
68 H CYS 9 H CYS 9 22.764 3.220 0.397
69 HA CYS 9 HA CYS 9 25.622 2.543 0.779
70 HB2 CYS 9 1HB CYS 9 24.151 5.134 0.371
71 HB3 CYS 9 2HB CYS 9 25.742 5.119 1.124
72 H ARG 10 H ARG 10 26.167 2.021 2.790
73 HA ARG 10 HA ARG 10 25.499 3.868 4.923
74 HB2 ARG 10 1HB ARG 10 24.584 1.002 4.922
75 HB3 ARG 10 2HB ARG 10 24.906 1.846 6.434
76 HG2 ARG 10 1HG ARG 10 23.326 3.679 5.582
77 HG3 ARG 10 2HG ARG 10 22.862 2.540 4.322
78 HD2 ARG 10 1HD ARG 10 21.309 2.350 6.191
79 HD3 ARG 10 2HD ARG 10 22.282 0.883 6.098
80 HE ARG 10 HE ARG 10 23.239 1.440 8.138
81 HH11 ARG 10 1HH1 ARG 10 21.167 2.628 9.524
82 HH12 ARG 10 2HH1 ARG 10 21.578 4.299 9.719
83 HH21 ARG 10 1HH2 ARG 10 24.006 4.266 7.245
84 HH22 ARG 10 2HH2 ARG 10 23.154 5.237 8.399
85 H LYS 11 H LYS 11 26.716 3.371 6.920
86 HA LYS 11 HA LYS 11 29.452 2.822 6.468
87 HB2 LYS 11 1HB LYS 11 27.836 2.720 9.024
88 HB3 LYS 11 2HB LYS 11 29.587 2.728 8.946
89 HG2 LYS 11 1HG LYS 11 28.417 4.934 7.391
90 HG3 LYS 11 2HG LYS 11 27.904 4.987 9.064
91 HD2 LYS 11 1HD LYS 11 30.804 4.626 8.335
92 HD3 LYS 11 2HD LYS 11 30.071 6.221 8.456
93 HE2 LYS 11 1HE LYS 11 29.883 6.093 10.752
94 HE3 LYS 11 2HE LYS 11 29.574 4.360 10.741
95 HZ1 LYS 11 1HZ LYS 11 32.217 5.335 9.937
96 HZ2 LYS 11 2HZ LYS 11 31.778 3.858 10.651
97 HZ3 LYS 11 3HZ LYS 11 31.826 5.274 11.588
98 H LYS 12 H LYS 12 26.751 0.825 6.812
99 HA LYS 12 HA LYS 12 28.414 -1.603 7.059
100 HB2 LYS 12 1HB LYS 12 26.231 -2.446 8.356
101 HB3 LYS 12 2HB LYS 12 27.545 -1.642 9.208
102 HG2 LYS 12 1HG LYS 12 26.401 0.468 9.161
103 HG3 LYS 12 2HG LYS 12 25.174 -0.155 8.058
104 HD2 LYS 12 1HD LYS 12 24.323 -1.653 9.766
105 HD3 LYS 12 2HD LYS 12 25.641 -1.225 10.857
106 HE2 LYS 12 1HE LYS 12 24.825 1.008 11.116
107 HE3 LYS 12 2HE LYS 12 23.698 0.826 9.772
108 HZ1 LYS 12 1HZ LYS 12 23.105 0.434 12.385
109 HZ2 LYS 12 2HZ LYS 12 23.354 -1.150 11.827
110 HZ3 LYS 12 3HZ LYS 12 22.202 -0.157 11.074
111 H CYS 13 H CYS 13 26.987 -3.554 6.425
112 HA CYS 13 HA CYS 13 25.520 -2.799 3.961
113 HB2 CYS 13 1HB CYS 13 26.845 -5.437 4.657
114 HB3 CYS 13 2HB CYS 13 26.134 -4.997 3.125
115 H LYS 14 H LYS 14 23.470 -3.078 3.856
116 HA LYS 14 HA LYS 14 21.794 -3.743 5.882
117 HB2 LYS 14 1HB LYS 14 20.781 -2.771 4.029
118 HB3 LYS 14 2HB LYS 14 21.491 -3.917 2.901
119 HG2 LYS 14 1HG LYS 14 19.984 -5.670 3.667
120 HG3 LYS 14 2HG LYS 14 19.394 -4.640 4.970
121 HD2 LYS 14 1HD LYS 14 18.480 -3.061 3.322
122 HD3 LYS 14 2HD LYS 14 19.104 -4.057 2.008
123 HE2 LYS 14 1HE LYS 14 17.242 -5.217 4.082
124 HE3 LYS 14 2HE LYS 14 16.616 -4.354 2.678
125 HZ1 LYS 14 1HZ LYS 14 16.722 -6.468 1.869
126 HZ2 LYS 14 2HZ LYS 14 18.074 -6.895 2.802
127 HZ3 LYS 14 3HZ LYS 14 18.265 -5.918 1.426
128 H GLU 15 H GLU 15 20.337 -5.607 6.135
129 HA GLU 15 HA GLU 15 21.413 -7.858 7.017
130 HB2 GLU 15 1HB GLU 15 18.884 -7.734 5.354
131 HB3 GLU 15 2HB GLU 15 19.302 -9.032 6.472
132 HG2 GLU 15 1HG GLU 15 19.143 -7.613 8.360
133 HG3 GLU 15 2HG GLU 15 19.207 -6.150 7.382
134 H ASN 16 H ASN 16 23.014 -9.015 6.167
135 HA ASN 16 HA ASN 16 24.113 -10.506 4.810
136 HB2 ASN 16 1HB ASN 16 21.387 -10.841 3.539
137 HB3 ASN 16 2HB ASN 16 22.763 -11.921 3.327
138 HD21 ASN 16 1HD2 ASN 16 20.671 -13.256 4.325
139 HD22 ASN 16 2HD2 ASN 16 20.833 -13.527 5.992
140 H GLU 17 H GLU 17 24.505 -7.918 4.090
141 HA GLU 17 HA GLU 17 24.530 -8.060 1.128
142 HB2 GLU 17 1HB GLU 17 24.193 -5.704 2.989
143 HB3 GLU 17 2HB GLU 17 24.557 -5.540 1.275
144 HG2 GLU 17 1HG GLU 17 22.365 -7.303 1.419
145 HG3 GLU 17 2HG GLU 17 22.025 -6.132 2.650
146 H LYS 18 H LYS 18 26.328 -7.458 0.032
147 HA LYS 18 HA LYS 18 28.793 -7.662 1.590
148 HB2 LYS 18 1HB LYS 18 28.726 -7.677 -1.404
149 HB3 LYS 18 2HB LYS 18 29.791 -8.545 -0.305
150 HG2 LYS 18 1HG LYS 18 26.853 -9.124 -0.788
151 HG3 LYS 18 2HG LYS 18 28.211 -10.085 -1.357
152 HD2 LYS 18 1HD LYS 18 28.872 -10.546 0.970
153 HD3 LYS 18 2HD LYS 18 27.517 -9.589 1.551
154 HE2 LYS 18 1HE LYS 18 26.346 -11.422 -0.234
155 HE3 LYS 18 2HE LYS 18 27.515 -12.357 0.691
156 HZ1 LYS 18 1HZ LYS 18 25.209 -10.801 1.644
157 HZ2 LYS 18 2HZ LYS 18 26.524 -11.085 2.681
158 HZ3 LYS 18 3HZ LYS 18 25.663 -12.392 2.024
159 HA PRO 19 HA PRO 19 29.497 -3.274 1.028
160 HB2 PRO 19 1HB PRO 19 32.399 -3.776 1.133
161 HB3 PRO 19 2HB PRO 19 31.396 -2.829 2.222
162 HG2 PRO 19 1HG PRO 19 32.476 -5.350 2.735
163 HG3 PRO 19 2HG PRO 19 31.229 -4.539 3.676
164 HD2 PRO 19 1HD PRO 19 30.960 -6.869 1.959
165 HD3 PRO 19 2HD PRO 19 29.750 -6.136 3.022
166 H ILE 20 H ILE 20 29.316 -2.360 -0.955
167 HA ILE 20 HA ILE 20 31.584 -2.758 -2.764
168 HB ILE 20 HB ILE 20 29.348 -4.079 -3.232
169 HG12 ILE 20 1HG1 ILE 20 30.623 -2.643 -5.526
170 HG13 ILE 20 2HG1 ILE 20 31.490 -3.887 -4.634
171 HG21 ILE 20 1HG2 ILE 20 27.602 -2.604 -3.540
172 HG22 ILE 20 2HG2 ILE 20 28.181 -2.695 -5.183
173 HG23 ILE 20 3HG2 ILE 20 28.618 -1.325 -4.201
174 HD11 ILE 20 1HD1 ILE 20 28.896 -4.197 -6.160
175 HD12 ILE 20 2HD1 ILE 20 29.555 -5.449 -5.105
176 HD13 ILE 20 3HD1 ILE 20 30.447 -4.946 -6.541
177 H GLY 21 H GLY 21 31.245 -1.175 -4.742
178 HA2 GLY 21 1HA GLY 21 31.683 1.015 -5.295
179 HA3 GLY 21 2HA GLY 21 30.015 1.216 -4.807
180 H TYR 22 H TYR 22 30.973 3.438 -4.378
181 HA TYR 22 HA TYR 22 31.928 3.589 -1.593
182 HB2 TYR 22 1HB TYR 22 33.594 3.924 -3.777
183 HB3 TYR 22 2HB TYR 22 33.141 5.582 -3.409
184 HD1 TYR 22 HD1 TYR 22 33.817 6.640 -1.314
185 HD2 TYR 22 HD2 TYR 22 34.759 2.528 -2.127
186 HE1 TYR 22 HE1 TYR 22 35.385 6.617 0.608
187 HE2 TYR 22 HE2 TYR 22 36.322 2.505 -0.203
188 HH TYR 22 HH TYR 22 37.438 5.265 1.293
189 H CYS 23 H CYS 23 31.159 5.228 -0.430
190 HA CYS 23 HA CYS 23 29.373 7.199 -1.689
191 HB2 CYS 23 1HB CYS 23 28.549 4.912 -0.115
192 HB3 CYS 23 2HB CYS 23 28.105 6.403 0.709
193 H ARG 24 H ARG 24 28.469 8.464 0.513
194 HA ARG 24 HA ARG 24 30.791 10.090 0.976
195 HB2 ARG 24 1HB ARG 24 27.892 10.262 1.828
196 HB3 ARG 24 2HB ARG 24 29.086 11.472 2.291
197 HG2 ARG 24 1HG ARG 24 29.511 12.043 -0.010
198 HG3 ARG 24 2HG ARG 24 28.535 10.688 -0.581
199 HD2 ARG 24 1HD ARG 24 26.523 11.671 0.318
200 HD3 ARG 24 2HD ARG 24 27.438 12.930 1.139
201 HE ARG 24 HE ARG 24 26.776 12.826 -1.700
202 HH11 ARG 24 1HH1 ARG 24 27.374 14.664 -2.896
203 HH12 ARG 24 2HH1 ARG 24 28.280 15.926 -2.131
204 HH21 ARG 24 1HH2 ARG 24 28.663 14.217 0.854
205 HH22 ARG 24 2HH2 ARG 24 28.917 15.713 0.021
206 H ASN 25 H ASN 25 31.369 10.919 3.070
207 HA ASN 25 HA ASN 25 32.427 10.395 5.066
208 HB2 ASN 25 1HB ASN 25 29.631 11.013 5.221
209 HB3 ASN 25 2HB ASN 25 30.009 9.945 6.559
210 HD21 ASN 25 1HD2 ASN 25 29.729 13.127 5.935
211 HD22 ASN 25 2HD2 ASN 25 30.928 13.751 6.971
212 H GLY 26 H GLY 26 32.783 8.185 3.695
213 HA2 GLY 26 1HA GLY 26 33.774 6.187 4.433
214 HA3 GLY 26 2HA GLY 26 32.815 6.283 5.911
215 H LYS 27 H LYS 27 30.336 6.789 4.288
216 HA LYS 27 HA LYS 27 29.547 4.074 4.309
217 HB2 LYS 27 1HB LYS 27 27.833 6.101 2.928
218 HB3 LYS 27 2HB LYS 27 27.390 4.826 4.044
219 HG2 LYS 27 1HG LYS 27 28.901 6.379 5.698
220 HG3 LYS 27 2HG LYS 27 28.333 7.607 4.582
221 HD2 LYS 27 1HD LYS 27 26.025 7.054 5.029
222 HD3 LYS 27 2HD LYS 27 26.505 5.670 6.018
223 HE2 LYS 27 1HE LYS 27 27.699 7.230 7.553
224 HE3 LYS 27 2HE LYS 27 27.083 8.585 6.609
225 HZ1 LYS 27 1HZ LYS 27 25.762 7.926 8.640
226 HZ2 LYS 27 2HZ LYS 27 25.295 6.538 7.780
227 HZ3 LYS 27 3HZ LYS 27 24.887 8.078 7.193
228 H LYS 28 H LYS 28 29.215 2.629 2.734
229 HA LYS 28 HA LYS 28 30.199 3.316 0.017
230 HB2 LYS 28 1HB LYS 28 30.425 0.573 1.231
231 HB3 LYS 28 2HB LYS 28 31.341 1.283 -0.097
232 HG2 LYS 28 1HG LYS 28 32.324 2.919 1.539
233 HG3 LYS 28 2HG LYS 28 31.515 2.038 2.834
234 HD2 LYS 28 1HD LYS 28 32.719 -0.054 1.906
235 HD3 LYS 28 2HD LYS 28 33.727 1.084 1.012
236 HE2 LYS 28 1HE LYS 28 34.851 0.597 3.095
237 HE3 LYS 28 2HE LYS 28 34.215 2.239 3.208
238 HZ1 LYS 28 1HZ LYS 28 33.464 -0.137 4.669
239 HZ2 LYS 28 2HZ LYS 28 32.150 0.778 4.102
240 HZ3 LYS 28 3HZ LYS 28 33.316 1.498 5.104
241 H CYS 29 H CYS 29 29.276 1.804 -1.684
242 HA CYS 29 HA CYS 29 26.458 1.285 -1.154
243 HB2 CYS 29 1HB CYS 29 28.245 0.978 -3.567
244 HB3 CYS 29 2HB CYS 29 26.625 0.301 -3.559
245 H CYS 30 H CYS 30 25.974 -0.579 -0.047
246 HA CYS 30 HA CYS 30 27.720 -2.936 -0.454
247 HB2 CYS 30 1HB CYS 30 25.350 -2.435 1.383
248 HB3 CYS 30 2HB CYS 30 26.236 -3.949 1.265
249 H VAL 31 H VAL 31 27.296 -4.054 -2.205
250 HA VAL 31 HA VAL 31 24.610 -4.134 -3.321
251 HB VAL 31 HB VAL 31 27.338 -4.846 -4.211
252 HG11 VAL 31 1HG1 VAL 31 26.421 -6.374 -6.020
253 HG12 VAL 31 2HG1 VAL 31 24.955 -6.509 -5.048
254 HG13 VAL 31 3HG1 VAL 31 26.495 -7.083 -4.409
255 HG21 VAL 31 1HG2 VAL 31 25.866 -2.923 -5.015
256 HG22 VAL 31 2HG2 VAL 31 24.892 -4.136 -5.832
257 HG23 VAL 31 3HG2 VAL 31 26.584 -3.932 -6.280
258 H ASN 32 H ASN 32 23.159 -5.458 -2.689
259 HA ASN 32 HA ASN 32 23.363 -7.183 -0.612
260 HB2 ASN 32 1HB ASN 32 21.280 -6.336 -1.890
261 HB3 ASN 32 2HB ASN 32 21.469 -7.782 -2.878
262 HD21 ASN 32 1HD2 ASN 32 19.934 -6.637 -0.121
263 HD22 ASN 32 2HD2 ASN 32 19.689 -8.113 0.679
Start of MODEL 3
1 H1 LYS 1 1H LYS 1 25.190 9.167 -9.303
2 H2 LYS 1 2H LYS 1 23.572 8.977 -8.826
3 H3 LYS 1 3H LYS 1 24.546 7.611 -9.086
4 HA LYS 1 HA LYS 1 26.004 8.382 -7.238
5 HB2 LYS 1 1HB LYS 1 23.647 10.239 -6.787
6 HB3 LYS 1 2HB LYS 1 25.018 10.033 -5.697
7 HG2 LYS 1 1HG LYS 1 26.541 10.797 -7.510
8 HG3 LYS 1 2HG LYS 1 25.140 11.064 -8.549
9 HD2 LYS 1 1HD LYS 1 24.234 12.664 -6.880
10 HD3 LYS 1 2HD LYS 1 25.674 12.427 -5.892
11 HE2 LYS 1 1HE LYS 1 26.166 14.378 -7.123
12 HE3 LYS 1 2HE LYS 1 26.992 13.109 -8.028
13 HZ1 LYS 1 1HZ LYS 1 24.304 14.221 -8.633
14 HZ2 LYS 1 2HZ LYS 1 25.063 12.969 -9.492
15 HZ3 LYS 1 3HZ LYS 1 25.730 14.530 -9.502
16 H LYS 2 H LYS 2 24.240 6.311 -8.067
17 HA LYS 2 HA LYS 2 22.931 5.609 -5.501
18 HB2 LYS 2 1HB LYS 2 21.990 5.187 -8.330
19 HB3 LYS 2 2HB LYS 2 21.433 4.144 -7.023
20 HG2 LYS 2 1HG LYS 2 20.726 6.235 -5.781
21 HG3 LYS 2 2HG LYS 2 21.089 7.145 -7.244
22 HD2 LYS 2 1HD LYS 2 19.207 4.773 -7.234
23 HD3 LYS 2 2HD LYS 2 18.655 6.412 -6.911
24 HE2 LYS 2 1HE LYS 2 19.692 7.100 -9.115
25 HE3 LYS 2 2HE LYS 2 19.961 5.387 -9.443
26 HZ1 LYS 2 1HZ LYS 2 17.291 6.034 -8.566
27 HZ2 LYS 2 2HZ LYS 2 17.808 5.038 -9.841
28 HZ3 LYS 2 3HZ LYS 2 17.719 6.720 -10.060
29 H CYS 3 H CYS 3 22.934 3.392 -4.965
30 HA CYS 3 HA CYS 3 25.386 2.052 -5.690
31 HB2 CYS 3 1HB CYS 3 23.058 1.178 -3.960
32 HB3 CYS 3 2HB CYS 3 24.583 0.307 -4.116
33 H TRP 4 H TRP 4 24.696 -0.581 -5.673
34 HA TRP 4 HA TRP 4 23.567 -0.817 -8.404
35 HB2 TRP 4 1HB TRP 4 25.796 -2.614 -7.577
36 HB3 TRP 4 2HB TRP 4 25.440 -1.925 -9.156
37 HD1 TRP 4 HD1 TRP 4 26.669 -0.821 -5.692
38 HE1 TRP 4 HE1 TRP 4 28.536 0.918 -5.992
39 HE3 TRP 4 HE3 TRP 4 26.873 -0.691 -10.767
40 HZ2 TRP 4 HZ2 TRP 4 30.246 1.786 -8.136
41 HZ3 TRP 4 HZ3 TRP 4 28.581 0.681 -11.914
42 HH2 TRP 4 HH2 TRP 4 30.162 2.066 -10.609
43 H ASN 5 H ASN 5 22.845 -3.038 -8.908
44 HA ASN 5 HA ASN 5 21.489 -4.838 -8.393
45 HB2 ASN 5 1HB ASN 5 23.559 -4.962 -6.184
46 HB3 ASN 5 2HB ASN 5 22.393 -6.249 -6.504
47 HD21 ASN 5 1HD2 ASN 5 25.078 -4.420 -8.021
48 HD22 ASN 5 2HD2 ASN 5 25.544 -5.684 -9.054
49 H GLY 6 H GLY 6 20.694 -2.248 -7.327
50 HA2 GLY 6 1HA GLY 6 18.984 -1.449 -6.020
51 HA3 GLY 6 2HA GLY 6 18.584 -3.124 -5.639
52 H GLY 7 H GLY 7 21.800 -2.590 -4.932
53 HA2 GLY 7 1HA GLY 7 21.494 -2.875 -2.156
54 HA3 GLY 7 2HA GLY 7 22.980 -2.382 -2.967
55 H ARG 8 H ARG 8 22.809 -1.149 -0.684
56 HA ARG 8 HA ARG 8 21.866 1.579 -1.354
57 HB2 ARG 8 1HB ARG 8 21.296 1.857 1.048
58 HB3 ARG 8 2HB ARG 8 20.284 0.670 0.229
59 HG2 ARG 8 1HG ARG 8 21.423 -1.159 1.217
60 HG3 ARG 8 2HG ARG 8 22.773 -0.156 1.734
61 HD2 ARG 8 1HD ARG 8 21.492 -0.553 3.689
62 HD3 ARG 8 2HD ARG 8 21.104 1.093 3.213
63 HE ARG 8 HE ARG 8 19.365 -1.274 2.840
64 HH11 ARG 8 1HH1 ARG 8 19.774 2.072 2.206
65 HH12 ARG 8 2HH1 ARG 8 18.091 2.440 2.381
66 HH21 ARG 8 1HH2 ARG 8 17.266 -0.682 3.642
67 HH22 ARG 8 2HH2 ARG 8 16.678 0.891 3.221
68 H CYS 9 H CYS 9 22.839 3.151 0.382
69 HA CYS 9 HA CYS 9 25.711 2.521 0.734
70 HB2 CYS 9 1HB CYS 9 24.217 5.013 0.124
71 HB3 CYS 9 2HB CYS 9 25.612 5.177 1.182
72 H ARG 10 H ARG 10 26.248 1.949 2.748
73 HA ARG 10 HA ARG 10 25.562 3.787 4.894
74 HB2 ARG 10 1HB ARG 10 24.789 0.870 4.936
75 HB3 ARG 10 2HB ARG 10 24.956 1.827 6.404
76 HG2 ARG 10 1HG ARG 10 23.288 3.459 5.275
77 HG3 ARG 10 2HG ARG 10 22.972 2.138 4.152
78 HD2 ARG 10 1HD ARG 10 22.697 0.718 6.366
79 HD3 ARG 10 2HD ARG 10 22.401 2.292 7.092
80 HE ARG 10 HE ARG 10 20.718 2.358 5.004
81 HH11 ARG 10 1HH1 ARG 10 21.449 -0.726 5.960
82 HH12 ARG 10 2HH1 ARG 10 19.902 -1.135 6.622
83 HH21 ARG 10 1HH2 ARG 10 18.660 2.092 6.422
84 HH22 ARG 10 2HH2 ARG 10 18.315 0.450 6.852
85 H LYS 11 H LYS 11 26.849 3.361 6.859
86 HA LYS 11 HA LYS 11 29.560 2.804 6.409
87 HB2 LYS 11 1HB LYS 11 27.781 3.084 8.779
88 HB3 LYS 11 2HB LYS 11 29.312 2.275 9.066
89 HG2 LYS 11 1HG LYS 11 29.250 4.889 7.581
90 HG3 LYS 11 2HG LYS 11 29.170 4.870 9.338
91 HD2 LYS 11 1HD LYS 11 31.267 3.540 9.400
92 HD3 LYS 11 2HD LYS 11 31.364 3.642 7.641
93 HE2 LYS 11 1HE LYS 11 31.527 6.067 7.744
94 HE3 LYS 11 2HE LYS 11 31.272 6.046 9.488
95 HZ1 LYS 11 1HZ LYS 11 33.682 5.905 8.179
96 HZ2 LYS 11 2HZ LYS 11 33.404 4.324 8.732
97 HZ3 LYS 11 3HZ LYS 11 33.406 5.619 9.831
98 H LYS 12 H LYS 12 26.852 0.776 7.017
99 HA LYS 12 HA LYS 12 28.550 -1.652 7.005
100 HB2 LYS 12 1HB LYS 12 26.053 -1.128 8.640
101 HB3 LYS 12 2HB LYS 12 26.811 -2.710 8.455
102 HG2 LYS 12 1HG LYS 12 28.885 -1.861 9.449
103 HG3 LYS 12 2HG LYS 12 28.184 -0.246 9.576
104 HD2 LYS 12 1HD LYS 12 26.429 -1.134 11.076
105 HD3 LYS 12 2HD LYS 12 27.145 -2.741 10.958
106 HE2 LYS 12 1HE LYS 12 29.236 -1.894 11.942
107 HE3 LYS 12 2HE LYS 12 28.549 -0.273 12.030
108 HZ1 LYS 12 1HZ LYS 12 26.775 -1.204 13.450
109 HZ2 LYS 12 2HZ LYS 12 28.319 -1.325 14.146
110 HZ3 LYS 12 3HZ LYS 12 27.589 -2.694 13.454
111 H CYS 13 H CYS 13 27.071 -3.597 6.390
112 HA CYS 13 HA CYS 13 25.464 -2.759 4.037
113 HB2 CYS 13 1HB CYS 13 26.781 -5.433 4.589
114 HB3 CYS 13 2HB CYS 13 26.023 -4.923 3.100
115 H LYS 14 H LYS 14 23.402 -3.009 4.071
116 HA LYS 14 HA LYS 14 21.868 -3.729 6.191
117 HB2 LYS 14 1HB LYS 14 20.734 -2.661 4.467
118 HB3 LYS 14 2HB LYS 14 21.356 -3.750 3.236
119 HG2 LYS 14 1HG LYS 14 19.896 -5.538 4.018
120 HG3 LYS 14 2HG LYS 14 19.384 -4.561 5.393
121 HD2 LYS 14 1HD LYS 14 18.388 -2.917 3.844
122 HD3 LYS 14 2HD LYS 14 18.930 -3.880 2.469
123 HE2 LYS 14 1HE LYS 14 17.563 -5.780 3.271
124 HE3 LYS 14 2HE LYS 14 17.013 -4.804 4.632
125 HZ1 LYS 14 1HZ LYS 14 15.393 -4.743 2.876
126 HZ2 LYS 14 2HZ LYS 14 16.561 -4.229 1.755
127 HZ3 LYS 14 3HZ LYS 14 16.102 -3.207 3.032
128 H GLU 15 H GLU 15 20.377 -5.625 6.460
129 HA GLU 15 HA GLU 15 21.619 -7.917 7.061
130 HB2 GLU 15 1HB GLU 15 18.829 -7.516 5.995
131 HB3 GLU 15 2HB GLU 15 19.389 -9.104 6.521
132 HG2 GLU 15 1HG GLU 15 19.889 -8.245 8.739
133 HG3 GLU 15 2HG GLU 15 19.500 -6.603 8.232
134 H ASN 16 H ASN 16 22.967 -9.141 5.987
135 HA ASN 16 HA ASN 16 23.776 -10.631 4.443
136 HB2 ASN 16 1HB ASN 16 20.974 -10.550 3.299
137 HB3 ASN 16 2HB ASN 16 22.197 -11.780 2.990
138 HD21 ASN 16 1HD2 ASN 16 20.781 -10.214 5.932
139 HD22 ASN 16 2HD2 ASN 16 20.550 -11.675 6.764
140 H GLU 17 H GLU 17 24.342 -7.980 3.964
141 HA GLU 17 HA GLU 17 24.240 -7.823 1.004
142 HB2 GLU 17 1HB GLU 17 24.070 -5.669 3.112
143 HB3 GLU 17 2HB GLU 17 24.360 -5.334 1.412
144 HG2 GLU 17 1HG GLU 17 22.116 -7.056 1.506
145 HG3 GLU 17 2HG GLU 17 21.867 -5.951 2.824
146 H LYS 18 H LYS 18 26.073 -7.538 -0.062
147 HA LYS 18 HA LYS 18 28.544 -7.856 1.426
148 HB2 LYS 18 1HB LYS 18 27.757 -8.005 -1.469
149 HB3 LYS 18 2HB LYS 18 29.458 -7.928 -1.013
150 HG2 LYS 18 1HG LYS 18 28.718 -10.262 -1.247
151 HG3 LYS 18 2HG LYS 18 29.173 -9.910 0.418
152 HD2 LYS 18 1HD LYS 18 26.901 -9.772 1.120
153 HD3 LYS 18 2HD LYS 18 26.315 -9.696 -0.542
154 HE2 LYS 18 1HE LYS 18 26.906 -11.988 -0.942
155 HE3 LYS 18 2HE LYS 18 27.815 -12.082 0.566
156 HZ1 LYS 18 1HZ LYS 18 25.974 -12.706 1.587
157 HZ2 LYS 18 2HZ LYS 18 25.088 -12.579 0.143
158 HZ3 LYS 18 3HZ LYS 18 25.227 -11.237 1.175
159 HA PRO 19 HA PRO 19 29.374 -3.406 1.090
160 HB2 PRO 19 1HB PRO 19 32.221 -4.058 1.511
161 HB3 PRO 19 2HB PRO 19 31.153 -3.054 2.484
162 HG2 PRO 19 1HG PRO 19 32.040 -5.576 3.171
163 HG3 PRO 19 2HG PRO 19 30.642 -4.762 3.869
164 HD2 PRO 19 1HD PRO 19 30.712 -7.046 2.012
165 HD3 PRO 19 2HD PRO 19 29.376 -6.450 3.012
166 H ILE 20 H ILE 20 29.375 -2.546 -0.959
167 HA ILE 20 HA ILE 20 31.978 -2.797 -2.297
168 HB ILE 20 HB ILE 20 31.185 -3.399 -4.294
169 HG12 ILE 20 1HG1 ILE 20 28.314 -2.681 -4.142
170 HG13 ILE 20 2HG1 ILE 20 29.376 -1.305 -4.254
171 HG21 ILE 20 1HG2 ILE 20 29.294 -4.939 -4.120
172 HG22 ILE 20 2HG2 ILE 20 28.951 -4.344 -2.498
173 HG23 ILE 20 3HG2 ILE 20 30.482 -5.166 -2.828
174 HD11 ILE 20 1HD1 ILE 20 29.687 -3.655 -6.100
175 HD12 ILE 20 2HD1 ILE 20 30.335 -2.026 -6.274
176 HD13 ILE 20 3HD1 ILE 20 28.605 -2.311 -6.453
177 H GLY 21 H GLY 21 31.738 -1.294 -4.355
178 HA2 GLY 21 1HA GLY 21 32.159 0.925 -4.977
179 HA3 GLY 21 2HA GLY 21 30.448 0.971 -4.580
180 H TYR 22 H TYR 22 31.313 3.322 -4.246
181 HA TYR 22 HA TYR 22 32.203 3.644 -1.442
182 HB2 TYR 22 1HB TYR 22 33.921 3.951 -3.473
183 HB3 TYR 22 2HB TYR 22 33.196 5.555 -3.523
184 HD1 TYR 22 HD1 TYR 22 33.328 7.051 -1.527
185 HD2 TYR 22 HD2 TYR 22 35.213 3.195 -1.567
186 HE1 TYR 22 HE1 TYR 22 34.728 7.714 0.410
187 HE2 TYR 22 HE2 TYR 22 36.642 3.870 0.344
188 HH TYR 22 HH TYR 22 37.359 6.527 1.288
189 H CYS 23 H CYS 23 31.776 5.745 -0.551
190 HA CYS 23 HA CYS 23 29.596 7.286 -1.669
191 HB2 CYS 23 1HB CYS 23 29.008 4.920 -0.234
192 HB3 CYS 23 2HB CYS 23 28.647 6.250 0.857
193 H ARG 24 H ARG 24 28.671 8.547 0.525
194 HA ARG 24 HA ARG 24 30.918 10.252 1.103
195 HB2 ARG 24 1HB ARG 24 28.003 10.288 1.902
196 HB3 ARG 24 2HB ARG 24 29.150 11.505 2.454
197 HG2 ARG 24 1HG ARG 24 29.666 12.103 0.137
198 HG3 ARG 24 2HG ARG 24 28.573 10.854 -0.447
199 HD2 ARG 24 1HD ARG 24 26.757 12.204 -0.141
200 HD3 ARG 24 2HD ARG 24 27.273 12.668 1.473
201 HE ARG 24 HE ARG 24 28.639 13.887 -0.827
202 HH11 ARG 24 1HH1 ARG 24 25.885 14.179 1.168
203 HH12 ARG 24 2HH1 ARG 24 26.136 15.847 1.558
204 HH21 ARG 24 1HH2 ARG 24 29.199 16.039 -0.051
205 HH22 ARG 24 2HH2 ARG 24 28.000 16.907 0.848
206 H ASN 25 H ASN 25 31.434 11.007 3.207
207 HA ASN 25 HA ASN 25 32.525 10.428 5.190
208 HB2 ASN 25 1HB ASN 25 29.544 10.385 5.576
209 HB3 ASN 25 2HB ASN 25 30.622 10.144 6.949
210 HD21 ASN 25 1HD2 ASN 25 30.713 12.382 4.114
211 HD22 ASN 25 2HD2 ASN 25 30.886 13.785 5.063
212 H GLY 26 H GLY 26 32.888 8.222 3.727
213 HA2 GLY 26 1HA GLY 26 33.913 6.230 4.426
214 HA3 GLY 26 2HA GLY 26 32.958 6.276 5.906
215 H LYS 27 H LYS 27 30.450 6.751 4.270
216 HA LYS 27 HA LYS 27 29.745 4.010 4.314
217 HB2 LYS 27 1HB LYS 27 27.954 5.963 2.919
218 HB3 LYS 27 2HB LYS 27 27.561 4.697 4.063
219 HG2 LYS 27 1HG LYS 27 28.937 6.209 5.745
220 HG3 LYS 27 2HG LYS 27 28.618 7.468 4.563
221 HD2 LYS 27 1HD LYS 27 26.227 7.149 4.760
222 HD3 LYS 27 2HD LYS 27 26.463 5.755 5.823
223 HE2 LYS 27 1HE LYS 27 27.510 7.161 7.510
224 HE3 LYS 27 2HE LYS 27 27.433 8.560 6.440
225 HZ1 LYS 27 1HZ LYS 27 25.610 8.674 7.947
226 HZ2 LYS 27 2HZ LYS 27 25.147 7.073 7.615
227 HZ3 LYS 27 3HZ LYS 27 24.982 8.270 6.421
228 H LYS 28 H LYS 28 29.264 2.591 2.713
229 HA LYS 28 HA LYS 28 30.469 3.185 0.060
230 HB2 LYS 28 1HB LYS 28 30.556 0.627 1.677
231 HB3 LYS 28 2HB LYS 28 31.243 0.854 0.069
232 HG2 LYS 28 1HG LYS 28 32.716 2.620 0.907
233 HG3 LYS 28 2HG LYS 28 32.006 2.487 2.510
234 HD2 LYS 28 1HD LYS 28 33.277 0.094 1.182
235 HD3 LYS 28 2HD LYS 28 34.264 1.275 2.038
236 HE2 LYS 28 1HE LYS 28 32.786 0.935 4.055
237 HE3 LYS 28 2HE LYS 28 32.003 -0.387 3.187
238 HZ1 LYS 28 1HZ LYS 28 33.978 -0.897 4.728
239 HZ2 LYS 28 2HZ LYS 28 34.935 -0.313 3.453
240 HZ3 LYS 28 3HZ LYS 28 33.914 -1.648 3.206
241 H CYS 29 H CYS 29 29.473 1.833 -1.734
242 HA CYS 29 HA CYS 29 26.711 1.201 -1.213
243 HB2 CYS 29 1HB CYS 29 28.462 0.953 -3.649
244 HB3 CYS 29 2HB CYS 29 26.846 0.271 -3.614
245 H CYS 30 H CYS 30 26.277 -0.487 -0.049
246 HA CYS 30 HA CYS 30 27.701 -3.016 -0.442
247 HB2 CYS 30 1HB CYS 30 25.286 -2.350 1.271
248 HB3 CYS 30 2HB CYS 30 26.145 -3.889 1.231
249 H VAL 31 H VAL 31 27.170 -4.307 -2.022
250 HA VAL 31 HA VAL 31 24.628 -4.024 -3.442
251 HB VAL 31 HB VAL 31 27.209 -5.451 -3.812
252 HG11 VAL 31 1HG1 VAL 31 26.064 -6.648 -5.844
253 HG12 VAL 31 2HG1 VAL 31 24.612 -6.491 -4.860
254 HG13 VAL 31 3HG1 VAL 31 26.004 -7.367 -4.239
255 HG21 VAL 31 1HG2 VAL 31 26.186 -3.172 -4.926
256 HG22 VAL 31 2HG2 VAL 31 25.730 -4.360 -6.139
257 HG23 VAL 31 3HG2 VAL 31 27.415 -4.170 -5.697
258 H ASN 32 H ASN 32 22.919 -4.992 -2.715
259 HA ASN 32 HA ASN 32 22.909 -6.894 -0.663
260 HB2 ASN 32 1HB ASN 32 21.021 -5.326 -1.524
261 HB3 ASN 32 2HB ASN 32 20.655 -6.631 -2.649
262 HD21 ASN 32 1HD2 ASN 32 19.375 -5.506 0.035
263 HD22 ASN 32 2HD2 ASN 32 19.160 -6.892 0.992
Start of MODEL 4
1 H1 LYS 1 1H LYS 1 21.576 8.475 -1.822
2 H2 LYS 1 2H LYS 1 22.811 7.571 -2.557
3 H3 LYS 1 3H LYS 1 21.927 6.911 -1.266
4 HA LYS 1 HA LYS 1 20.414 6.094 -2.628
5 HB2 LYS 1 1HB LYS 1 19.210 7.665 -4.204
6 HB3 LYS 1 2HB LYS 1 19.207 8.168 -2.516
7 HG2 LYS 1 1HG LYS 1 20.934 9.771 -2.886
8 HG3 LYS 1 2HG LYS 1 21.294 9.128 -4.483
9 HD2 LYS 1 1HD LYS 1 18.526 10.174 -3.917
10 HD3 LYS 1 2HD LYS 1 19.828 11.318 -4.213
11 HE2 LYS 1 1HE LYS 1 20.261 10.419 -6.383
12 HE3 LYS 1 2HE LYS 1 19.230 9.020 -6.088
13 HZ1 LYS 1 1HZ LYS 1 17.413 10.780 -5.726
14 HZ2 LYS 1 2HZ LYS 1 17.886 10.417 -7.316
15 HZ3 LYS 1 3HZ LYS 1 18.461 11.825 -6.560
16 H LYS 2 H LYS 2 23.209 5.960 -3.309
17 HA LYS 2 HA LYS 2 22.999 5.487 -6.218
18 HB2 LYS 2 1HB LYS 2 25.153 6.992 -4.731
19 HB3 LYS 2 2HB LYS 2 25.442 6.280 -6.311
20 HG2 LYS 2 1HG LYS 2 23.050 8.065 -5.923
21 HG3 LYS 2 2HG LYS 2 24.641 8.790 -6.106
22 HD2 LYS 2 1HD LYS 2 24.952 7.812 -8.259
23 HD3 LYS 2 2HD LYS 2 23.558 6.751 -8.063
24 HE2 LYS 2 1HE LYS 2 22.026 8.577 -8.204
25 HE3 LYS 2 2HE LYS 2 23.317 9.766 -8.014
26 HZ1 LYS 2 1HZ LYS 2 24.210 8.540 -10.148
27 HZ2 LYS 2 2HZ LYS 2 23.087 9.810 -10.256
28 HZ3 LYS 2 3HZ LYS 2 22.559 8.197 -10.360
29 H CYS 3 H CYS 3 23.327 3.432 -6.538
30 HA CYS 3 HA CYS 3 25.725 2.117 -5.849
31 HB2 CYS 3 1HB CYS 3 23.279 1.377 -4.235
32 HB3 CYS 3 2HB CYS 3 24.637 0.277 -4.453
33 H TRP 4 H TRP 4 24.990 -0.507 -5.964
34 HA TRP 4 HA TRP 4 23.946 -0.659 -8.731
35 HB2 TRP 4 1HB TRP 4 26.105 -2.533 -7.881
36 HB3 TRP 4 2HB TRP 4 25.799 -1.816 -9.458
37 HD1 TRP 4 HD1 TRP 4 27.108 -0.835 -5.974
38 HE1 TRP 4 HE1 TRP 4 28.889 1.002 -6.265
39 HE3 TRP 4 HE3 TRP 4 26.857 -0.167 -11.028
40 HZ2 TRP 4 HZ2 TRP 4 30.202 2.396 -8.407
41 HZ3 TRP 4 HZ3 TRP 4 28.335 1.464 -12.154
42 HH2 TRP 4 HH2 TRP 4 29.963 2.793 -10.846
43 H ASN 5 H ASN 5 23.530 -3.067 -9.283
44 HA ASN 5 HA ASN 5 22.048 -4.791 -8.898
45 HB2 ASN 5 1HB ASN 5 23.948 -5.159 -6.570
46 HB3 ASN 5 2HB ASN 5 22.895 -6.399 -7.251
47 HD21 ASN 5 1HD2 ASN 5 25.794 -4.448 -7.847
48 HD22 ASN 5 2HD2 ASN 5 26.380 -5.425 -9.106
49 H GLY 6 H GLY 6 21.151 -2.307 -7.770
50 HA2 GLY 6 1HA GLY 6 19.383 -1.591 -6.497
51 HA3 GLY 6 2HA GLY 6 18.981 -3.291 -6.256
52 H GLY 7 H GLY 7 22.041 -1.847 -5.335
53 HA2 GLY 7 1HA GLY 7 21.676 -2.814 -2.584
54 HA3 GLY 7 2HA GLY 7 23.177 -2.219 -3.301
55 H ARG 8 H ARG 8 22.904 -1.081 -1.028
56 HA ARG 8 HA ARG 8 22.023 1.658 -1.719
57 HB2 ARG 8 1HB ARG 8 21.424 1.990 0.650
58 HB3 ARG 8 2HB ARG 8 20.418 0.772 -0.130
59 HG2 ARG 8 1HG ARG 8 21.545 -1.017 0.938
60 HG3 ARG 8 2HG ARG 8 22.894 0.003 1.423
61 HD2 ARG 8 1HD ARG 8 21.649 -0.273 3.398
62 HD3 ARG 8 2HD ARG 8 21.168 1.314 2.822
63 HE ARG 8 HE ARG 8 19.385 -0.623 1.791
64 HH11 ARG 8 1HH1 ARG 8 20.369 0.901 4.736
65 HH12 ARG 8 2HH1 ARG 8 18.782 0.902 5.427
66 HH21 ARG 8 1HH2 ARG 8 17.348 -0.846 2.799
67 HH22 ARG 8 2HH2 ARG 8 17.133 -0.289 4.425
68 H CYS 9 H CYS 9 23.074 3.289 -0.202
69 HA CYS 9 HA CYS 9 25.897 2.539 0.308
70 HB2 CYS 9 1HB CYS 9 24.546 4.994 -0.638
71 HB3 CYS 9 2HB CYS 9 25.832 5.267 0.531
72 H ARG 10 H ARG 10 26.308 2.102 2.388
73 HA ARG 10 HA ARG 10 25.627 4.101 4.394
74 HB2 ARG 10 1HB ARG 10 24.682 1.237 4.561
75 HB3 ARG 10 2HB ARG 10 24.785 2.312 5.956
76 HG2 ARG 10 1HG ARG 10 23.323 3.936 4.571
77 HG3 ARG 10 2HG ARG 10 23.017 2.552 3.520
78 HD2 ARG 10 1HD ARG 10 22.168 1.266 5.429
79 HD3 ARG 10 2HD ARG 10 22.474 2.636 6.495
80 HE ARG 10 HE ARG 10 20.769 3.239 4.228
81 HH11 ARG 10 1HH1 ARG 10 21.060 2.465 7.587
82 HH12 ARG 10 2HH1 ARG 10 19.432 2.928 7.954
83 HH21 ARG 10 1HH2 ARG 10 18.526 3.395 4.645
84 HH22 ARG 10 2HH2 ARG 10 17.966 3.294 6.280
85 H LYS 11 H LYS 11 26.778 3.638 6.468
86 HA LYS 11 HA LYS 11 29.476 2.834 6.073
87 HB2 LYS 11 1HB LYS 11 27.825 3.277 8.565
88 HB3 LYS 11 2HB LYS 11 29.544 2.889 8.607
89 HG2 LYS 11 1HG LYS 11 30.023 4.871 7.212
90 HG3 LYS 11 2HG LYS 11 28.309 5.268 7.189
91 HD2 LYS 11 1HD LYS 11 29.797 4.946 9.796
92 HD3 LYS 11 2HD LYS 11 29.827 6.471 8.919
93 HE2 LYS 11 1HE LYS 11 27.309 6.449 8.929
94 HE3 LYS 11 2HE LYS 11 27.378 5.039 9.986
95 HZ1 LYS 11 1HZ LYS 11 27.157 7.188 11.163
96 HZ2 LYS 11 2HZ LYS 11 28.697 7.621 10.596
97 HZ3 LYS 11 3HZ LYS 11 28.517 6.286 11.631
98 H LYS 12 H LYS 12 26.618 1.105 6.545
99 HA LYS 12 HA LYS 12 28.111 -1.401 7.024
100 HB2 LYS 12 1HB LYS 12 26.268 -2.244 8.374
101 HB3 LYS 12 2HB LYS 12 26.908 -0.768 9.094
102 HG2 LYS 12 1HG LYS 12 25.088 0.530 8.022
103 HG3 LYS 12 2HG LYS 12 24.430 -0.960 7.346
104 HD2 LYS 12 1HD LYS 12 24.816 -0.440 10.303
105 HD3 LYS 12 2HD LYS 12 23.289 -0.263 9.446
106 HE2 LYS 12 1HE LYS 12 22.998 -2.440 10.125
107 HE3 LYS 12 2HE LYS 12 23.966 -2.804 8.702
108 HZ1 LYS 12 1HZ LYS 12 25.394 -3.742 10.088
109 HZ2 LYS 12 2HZ LYS 12 24.613 -3.108 11.459
110 HZ3 LYS 12 3HZ LYS 12 25.788 -2.187 10.647
111 H CYS 13 H CYS 13 26.640 -3.314 6.360
112 HA CYS 13 HA CYS 13 25.319 -2.622 3.797
113 HB2 CYS 13 1HB CYS 13 26.419 -5.293 4.719
114 HB3 CYS 13 2HB CYS 13 25.864 -4.887 3.115
115 H LYS 14 H LYS 14 23.247 -2.735 3.669
116 HA LYS 14 HA LYS 14 21.457 -3.229 5.623
117 HB2 LYS 14 1HB LYS 14 20.559 -2.303 3.697
118 HB3 LYS 14 2HB LYS 14 21.294 -3.502 2.646
119 HG2 LYS 14 1HG LYS 14 19.679 -5.188 3.414
120 HG3 LYS 14 2HG LYS 14 19.013 -4.038 4.567
121 HD2 LYS 14 1HD LYS 14 18.018 -2.742 2.897
122 HD3 LYS 14 2HD LYS 14 19.111 -3.316 1.643
123 HE2 LYS 14 1HE LYS 14 18.054 -5.555 1.765
124 HE3 LYS 14 2HE LYS 14 16.938 -4.949 2.989
125 HZ1 LYS 14 1HZ LYS 14 16.333 -3.199 1.285
126 HZ2 LYS 14 2HZ LYS 14 15.803 -4.782 0.968
127 HZ3 LYS 14 3HZ LYS 14 17.153 -4.158 0.148
128 H GLU 15 H GLU 15 19.839 -5.033 5.823
129 HA GLU 15 HA GLU 15 20.714 -7.307 6.883
130 HB2 GLU 15 1HB GLU 15 18.377 -7.055 4.977
131 HB3 GLU 15 2HB GLU 15 18.623 -8.405 6.088
132 HG2 GLU 15 1HG GLU 15 18.468 -6.958 8.004
133 HG3 GLU 15 2HG GLU 15 18.508 -5.517 6.990
134 H ASN 16 H ASN 16 22.374 -8.510 6.218
135 HA ASN 16 HA ASN 16 23.547 -10.082 5.032
136 HB2 ASN 16 1HB ASN 16 20.961 -10.509 3.525
137 HB3 ASN 16 2HB ASN 16 22.288 -11.653 3.706
138 HD21 ASN 16 1HD2 ASN 16 21.875 -13.210 5.271
139 HD22 ASN 16 2HD2 ASN 16 20.930 -12.970 6.659
140 H GLU 17 H GLU 17 24.056 -7.585 4.119
141 HA GLU 17 HA GLU 17 24.088 -7.882 1.168
142 HB2 GLU 17 1HB GLU 17 23.855 -5.474 2.966
143 HB3 GLU 17 2HB GLU 17 24.314 -5.325 1.277
144 HG2 GLU 17 1HG GLU 17 22.011 -6.978 1.318
145 HG3 GLU 17 2HG GLU 17 21.688 -5.767 2.512
146 H LYS 18 H LYS 18 25.902 -7.614 0.047
147 HA LYS 18 HA LYS 18 28.339 -7.991 1.528
148 HB2 LYS 18 1HB LYS 18 27.339 -8.520 -1.136
149 HB3 LYS 18 2HB LYS 18 28.925 -7.772 -1.243
150 HG2 LYS 18 1HG LYS 18 29.245 -10.143 -1.142
151 HG3 LYS 18 2HG LYS 18 29.767 -9.467 0.395
152 HD2 LYS 18 1HD LYS 18 27.218 -9.980 1.067
153 HD3 LYS 18 2HD LYS 18 27.365 -11.154 -0.234
154 HE2 LYS 18 1HE LYS 18 29.028 -10.959 2.284
155 HE3 LYS 18 2HE LYS 18 27.990 -12.292 1.777
156 HZ1 LYS 18 1HZ LYS 18 30.174 -12.938 1.266
157 HZ2 LYS 18 2HZ LYS 18 30.563 -11.427 0.596
158 HZ3 LYS 18 3HZ LYS 18 29.498 -12.467 -0.218
159 HA PRO 19 HA PRO 19 29.403 -3.571 1.245
160 HB2 PRO 19 1HB PRO 19 32.195 -4.423 1.722
161 HB3 PRO 19 2HB PRO 19 31.192 -3.309 2.647
162 HG2 PRO 19 1HG PRO 19 31.850 -5.799 3.504
163 HG3 PRO 19 2HG PRO 19 30.372 -4.961 3.984
164 HD2 PRO 19 1HD PRO 19 30.721 -7.210 2.047
165 HD3 PRO 19 2HD PRO 19 29.344 -6.804 3.094
166 H ILE 20 H ILE 20 29.486 -2.756 -0.860
167 HA ILE 20 HA ILE 20 32.090 -3.186 -2.153
168 HB ILE 20 HB ILE 20 31.291 -3.743 -4.186
169 HG12 ILE 20 1HG1 ILE 20 28.427 -2.992 -3.701
170 HG13 ILE 20 2HG1 ILE 20 29.538 -1.747 -4.244
171 HG21 ILE 20 1HG2 ILE 20 29.472 -5.377 -3.932
172 HG22 ILE 20 2HG2 ILE 20 29.158 -4.780 -2.309
173 HG23 ILE 20 3HG2 ILE 20 30.708 -5.550 -2.677
174 HD11 ILE 20 1HD1 ILE 20 28.526 -2.712 -6.175
175 HD12 ILE 20 2HD1 ILE 20 28.901 -4.348 -5.641
176 HD13 ILE 20 3HD1 ILE 20 30.195 -3.260 -6.143
177 H GLY 21 H GLY 21 31.902 -1.767 -4.305
178 HA2 GLY 21 1HA GLY 21 32.565 0.398 -4.941
179 HA3 GLY 21 2HA GLY 21 30.838 0.579 -4.649
180 H TYR 22 H TYR 22 31.858 2.852 -4.383
181 HA TYR 22 HA TYR 22 32.557 3.274 -1.541
182 HB2 TYR 22 1HB TYR 22 34.412 3.386 -3.503
183 HB3 TYR 22 2HB TYR 22 33.818 5.040 -3.598
184 HD1 TYR 22 HD1 TYR 22 34.100 6.586 -1.709
185 HD2 TYR 22 HD2 TYR 22 35.488 2.529 -1.492
186 HE1 TYR 22 HE1 TYR 22 35.382 7.132 0.344
187 HE2 TYR 22 HE2 TYR 22 36.920 3.124 0.446
188 HH TYR 22 HH TYR 22 36.773 6.376 1.900
189 H CYS 23 H CYS 23 32.127 5.415 -0.765
190 HA CYS 23 HA CYS 23 30.136 6.990 -2.174
191 HB2 CYS 23 1HB CYS 23 29.318 4.813 -0.534
192 HB3 CYS 23 2HB CYS 23 28.934 6.287 0.339
193 H ARG 24 H ARG 24 29.129 8.446 -0.163
194 HA ARG 24 HA ARG 24 31.384 10.148 0.386
195 HB2 ARG 24 1HB ARG 24 28.481 10.365 1.244
196 HB3 ARG 24 2HB ARG 24 29.673 11.663 1.289
197 HG2 ARG 24 1HG ARG 24 29.851 11.701 -1.101
198 HG3 ARG 24 2HG ARG 24 28.936 10.199 -1.257
199 HD2 ARG 24 1HD ARG 24 26.948 11.327 -0.305
200 HD3 ARG 24 2HD ARG 24 27.866 12.826 -0.180
201 HE ARG 24 HE ARG 24 26.725 11.705 -2.588
202 HH11 ARG 24 1HH1 ARG 24 27.834 14.519 -1.247
203 HH12 ARG 24 2HH1 ARG 24 28.627 15.128 -2.661
204 HH21 ARG 24 1HH2 ARG 24 28.427 12.124 -4.386
205 HH22 ARG 24 2HH2 ARG 24 28.996 13.759 -4.425
206 H ASN 25 H ASN 25 31.848 11.051 2.445
207 HA ASN 25 HA ASN 25 32.718 10.636 4.575
208 HB2 ASN 25 1HB ASN 25 29.710 10.718 4.751
209 HB3 ASN 25 2HB ASN 25 30.736 10.722 6.185
210 HD21 ASN 25 1HD2 ASN 25 29.029 12.938 5.402
211 HD22 ASN 25 2HD2 ASN 25 30.047 14.261 5.072
212 H GLY 26 H GLY 26 33.054 8.261 3.394
213 HA2 GLY 26 1HA GLY 26 33.930 6.342 4.447
214 HA3 GLY 26 2HA GLY 26 32.802 6.576 5.782
215 H LYS 27 H LYS 27 30.513 6.957 3.903
216 HA LYS 27 HA LYS 27 29.747 4.242 4.041
217 HB2 LYS 27 1HB LYS 27 28.085 6.084 2.381
218 HB3 LYS 27 2HB LYS 27 27.613 4.953 3.632
219 HG2 LYS 27 1HG LYS 27 28.848 6.596 5.250
220 HG3 LYS 27 2HG LYS 27 28.742 7.732 3.912
221 HD2 LYS 27 1HD LYS 27 26.335 7.572 3.855
222 HD3 LYS 27 2HD LYS 27 26.346 6.280 5.060
223 HE2 LYS 27 1HE LYS 27 27.336 7.824 6.706
224 HE3 LYS 27 2HE LYS 27 27.331 9.113 5.504
225 HZ1 LYS 27 1HZ LYS 27 24.776 7.882 5.711
226 HZ2 LYS 27 2HZ LYS 27 25.200 9.516 5.896
227 HZ3 LYS 27 3HZ LYS 27 25.290 8.461 7.223
228 H LYS 28 H LYS 28 29.401 2.729 2.533
229 HA LYS 28 HA LYS 28 30.706 3.131 -0.108
230 HB2 LYS 28 1HB LYS 28 30.747 0.652 1.613
231 HB3 LYS 28 2HB LYS 28 31.533 0.868 0.050
232 HG2 LYS 28 1HG LYS 28 32.766 2.847 1.052
233 HG3 LYS 28 2HG LYS 28 32.120 2.364 2.620
234 HD2 LYS 28 1HD LYS 28 33.161 0.111 2.286
235 HD3 LYS 28 2HD LYS 28 33.914 0.722 0.814
236 HE2 LYS 28 1HE LYS 28 34.868 2.616 2.273
237 HE3 LYS 28 2HE LYS 28 34.398 1.629 3.657
238 HZ1 LYS 28 1HZ LYS 28 35.767 -0.148 2.869
239 HZ2 LYS 28 2HZ LYS 28 36.708 1.266 2.932
240 HZ3 LYS 28 3HZ LYS 28 36.134 0.692 1.440
241 H CYS 29 H CYS 29 29.812 1.583 -1.809
242 HA CYS 29 HA CYS 29 26.989 1.095 -1.354
243 HB2 CYS 29 1HB CYS 29 28.799 0.596 -3.721
244 HB3 CYS 29 2HB CYS 29 27.156 -0.028 -3.664
245 H CYS 30 H CYS 30 26.477 -0.475 -0.083
246 HA CYS 30 HA CYS 30 27.800 -3.084 -0.303
247 HB2 CYS 30 1HB CYS 30 25.408 -2.159 1.319
248 HB3 CYS 30 2HB CYS 30 26.087 -3.785 1.333
249 H VAL 31 H VAL 31 27.330 -4.126 -2.128
250 HA VAL 31 HA VAL 31 24.657 -3.978 -3.289
251 HB VAL 31 HB VAL 31 27.316 -5.007 -4.064
252 HG11 VAL 31 1HG1 VAL 31 26.396 -7.061 -4.561
253 HG12 VAL 31 2HG1 VAL 31 26.086 -6.211 -6.066
254 HG13 VAL 31 3HG1 VAL 31 24.795 -6.406 -4.884
255 HG21 VAL 31 1HG2 VAL 31 26.572 -2.875 -4.932
256 HG22 VAL 31 2HG2 VAL 31 25.090 -3.582 -5.529
257 HG23 VAL 31 3HG2 VAL 31 26.631 -4.044 -6.255
258 H ASN 32 H ASN 32 23.110 -5.127 -2.658
259 HA ASN 32 HA ASN 32 23.087 -7.005 -0.681
260 HB2 ASN 32 1HB ASN 32 21.194 -5.766 -2.113
261 HB3 ASN 32 2HB ASN 32 21.101 -7.334 -2.900
262 HD21 ASN 32 1HD2 ASN 32 21.645 -9.000 -0.616
263 HD22 ASN 32 2HD2 ASN 32 20.421 -8.781 0.539
Start of MODEL 5
1 H1 LYS 1 1H LYS 1 26.908 8.283 -3.052
2 H2 LYS 1 2H LYS 1 27.056 7.816 -4.677
3 H3 LYS 1 3H LYS 1 26.278 6.793 -3.569
4 HA LYS 1 HA LYS 1 24.649 8.710 -3.223
5 HB2 LYS 1 1HB LYS 1 25.672 9.417 -5.978
6 HB3 LYS 1 2HB LYS 1 24.495 10.299 -5.004
7 HG2 LYS 1 1HG LYS 1 26.342 10.612 -3.278
8 HG3 LYS 1 2HG LYS 1 27.464 10.000 -4.489
9 HD2 LYS 1 1HD LYS 1 25.620 12.357 -4.958
10 HD3 LYS 1 2HD LYS 1 27.284 12.519 -4.401
11 HE2 LYS 1 1HE LYS 1 27.976 11.180 -6.453
12 HE3 LYS 1 2HE LYS 1 26.322 11.376 -7.035
13 HZ1 LYS 1 1HZ LYS 1 27.097 13.880 -6.242
14 HZ2 LYS 1 2HZ LYS 1 26.961 13.318 -7.837
15 HZ3 LYS 1 3HZ LYS 1 28.458 13.250 -7.039
16 H LYS 2 H LYS 2 25.852 6.327 -5.335
17 HA LYS 2 HA LYS 2 23.141 5.393 -5.936
18 HB2 LYS 2 1HB LYS 2 24.036 6.862 -7.847
19 HB3 LYS 2 2HB LYS 2 25.196 5.569 -8.143
20 HG2 LYS 2 1HG LYS 2 23.376 3.965 -8.455
21 HG3 LYS 2 2HG LYS 2 22.186 5.201 -8.062
22 HD2 LYS 2 1HD LYS 2 24.114 5.348 -10.398
23 HD3 LYS 2 2HD LYS 2 22.435 4.831 -10.519
24 HE2 LYS 2 1HE LYS 2 21.961 7.154 -9.325
25 HE3 LYS 2 2HE LYS 2 23.536 7.571 -9.998
26 HZ1 LYS 2 1HZ LYS 2 22.340 6.368 -12.074
27 HZ2 LYS 2 2HZ LYS 2 22.367 8.046 -11.818
28 HZ3 LYS 2 3HZ LYS 2 21.021 7.135 -11.331
29 H CYS 3 H CYS 3 22.994 3.199 -6.041
30 HA CYS 3 HA CYS 3 25.508 1.626 -5.919
31 HB2 CYS 3 1HB CYS 3 22.977 1.096 -4.348
32 HB3 CYS 3 2HB CYS 3 24.453 0.129 -4.331
33 H TRP 4 H TRP 4 24.404 -0.850 -5.848
34 HA TRP 4 HA TRP 4 23.246 -1.068 -8.559
35 HB2 TRP 4 1HB TRP 4 25.314 -3.047 -7.749
36 HB3 TRP 4 2HB TRP 4 24.975 -2.377 -9.334
37 HD1 TRP 4 HD1 TRP 4 26.317 -0.966 -5.962
38 HE1 TRP 4 HE1 TRP 4 28.447 0.355 -6.469
39 HE3 TRP 4 HE3 TRP 4 26.678 -1.819 -10.967
40 HZ2 TRP 4 HZ2 TRP 4 30.289 0.650 -8.660
41 HZ3 TRP 4 HZ3 TRP 4 28.549 -0.857 -12.270
42 HH2 TRP 4 HH2 TRP 4 30.299 0.486 -11.145
43 H ASN 5 H ASN 5 22.511 -3.400 -8.926
44 HA ASN 5 HA ASN 5 20.969 -5.004 -8.289
45 HB2 ASN 5 1HB ASN 5 23.067 -5.280 -6.121
46 HB3 ASN 5 2HB ASN 5 21.827 -6.478 -6.480
47 HD21 ASN 5 1HD2 ASN 5 25.015 -5.625 -7.206
48 HD22 ASN 5 2HD2 ASN 5 25.177 -6.457 -8.677
49 H GLY 6 H GLY 6 20.360 -2.365 -7.287
50 HA2 GLY 6 1HA GLY 6 18.790 -1.417 -5.899
51 HA3 GLY 6 2HA GLY 6 18.325 -3.059 -5.447
52 H GLY 7 H GLY 7 21.519 -2.973 -4.831
53 HA2 GLY 7 1HA GLY 7 21.478 -2.897 -2.130
54 HA3 GLY 7 2HA GLY 7 22.899 -2.414 -3.056
55 H ARG 8 H ARG 8 22.874 -1.108 -0.826
56 HA ARG 8 HA ARG 8 21.871 1.591 -1.496
57 HB2 ARG 8 1HB ARG 8 21.282 1.895 0.890
58 HB3 ARG 8 2HB ARG 8 20.274 0.713 0.075
59 HG2 ARG 8 1HG ARG 8 20.979 -0.989 1.414
60 HG3 ARG 8 2HG ARG 8 22.665 -0.516 1.290
61 HD2 ARG 8 1HD ARG 8 21.968 -0.321 3.593
62 HD3 ARG 8 2HD ARG 8 22.240 1.295 2.950
63 HE ARG 8 HE ARG 8 19.588 0.956 2.543
64 HH11 ARG 8 1HH1 ARG 8 19.001 -0.829 4.666
65 HH12 ARG 8 2HH1 ARG 8 19.032 0.112 6.121
66 HH21 ARG 8 1HH2 ARG 8 20.722 2.774 4.684
67 HH22 ARG 8 2HH2 ARG 8 20.017 2.140 6.135
68 H CYS 9 H CYS 9 22.824 3.193 0.183
69 HA CYS 9 HA CYS 9 25.699 2.599 0.564
70 HB2 CYS 9 1HB CYS 9 24.163 5.090 -0.029
71 HB3 CYS 9 2HB CYS 9 25.644 5.234 0.913
72 H ARG 10 H ARG 10 26.293 2.152 2.587
73 HA ARG 10 HA ARG 10 25.504 3.901 4.740
74 HB2 ARG 10 1HB ARG 10 24.194 1.343 4.335
75 HB3 ARG 10 2HB ARG 10 25.036 1.341 5.874
76 HG2 ARG 10 1HG ARG 10 23.219 3.613 5.066
77 HG3 ARG 10 2HG ARG 10 22.614 2.169 5.874
78 HD2 ARG 10 1HD ARG 10 24.240 2.553 7.718
79 HD3 ARG 10 2HD ARG 10 24.756 4.038 6.928
80 HE ARG 10 HE ARG 10 21.904 3.830 7.500
81 HH11 ARG 10 1HH1 ARG 10 22.009 4.227 10.062
82 HH12 ARG 10 2HH1 ARG 10 22.704 5.773 10.416
83 HH21 ARG 10 1HH2 ARG 10 24.137 6.153 7.286
84 HH22 ARG 10 2HH2 ARG 10 23.929 6.846 8.860
85 H LYS 11 H LYS 11 26.791 3.469 6.713
86 HA LYS 11 HA LYS 11 29.484 2.817 6.151
87 HB2 LYS 11 1HB LYS 11 28.030 2.947 8.807
88 HB3 LYS 11 2HB LYS 11 29.781 2.835 8.625
89 HG2 LYS 11 1HG LYS 11 29.718 4.949 7.275
90 HG3 LYS 11 2HG LYS 11 27.997 5.080 7.639
91 HD2 LYS 11 1HD LYS 11 28.517 5.097 10.059
92 HD3 LYS 11 2HD LYS 11 30.237 4.986 9.685
93 HE2 LYS 11 1HE LYS 11 30.066 7.120 8.410
94 HE3 LYS 11 2HE LYS 11 28.372 7.240 8.886
95 HZ1 LYS 11 1HZ LYS 11 30.051 6.757 11.129
96 HZ2 LYS 11 2HZ LYS 11 28.944 8.017 10.864
97 HZ3 LYS 11 3HZ LYS 11 30.538 8.154 10.296
98 H LYS 12 H LYS 12 26.759 0.920 6.747
99 HA LYS 12 HA LYS 12 28.398 -1.535 6.939
100 HB2 LYS 12 1HB LYS 12 25.739 -1.198 8.328
101 HB3 LYS 12 2HB LYS 12 26.903 -2.509 8.508
102 HG2 LYS 12 1HG LYS 12 28.545 -0.681 9.327
103 HG3 LYS 12 2HG LYS 12 27.114 0.336 9.496
104 HD2 LYS 12 1HD LYS 12 26.094 -1.342 10.989
105 HD3 LYS 12 2HD LYS 12 27.516 -2.370 10.807
106 HE2 LYS 12 1HE LYS 12 27.505 0.437 11.964
107 HE3 LYS 12 2HE LYS 12 27.641 -1.055 12.895
108 HZ1 LYS 12 1HZ LYS 12 29.822 -0.777 12.619
109 HZ2 LYS 12 2HZ LYS 12 29.632 0.332 11.347
110 HZ3 LYS 12 3HZ LYS 12 29.574 -1.337 11.034
111 H CYS 13 H CYS 13 26.854 -3.469 6.393
112 HA CYS 13 HA CYS 13 25.520 -2.706 3.854
113 HB2 CYS 13 1HB CYS 13 26.684 -5.387 4.674
114 HB3 CYS 13 2HB CYS 13 26.061 -4.952 3.102
115 H LYS 14 H LYS 14 23.482 -2.881 3.680
116 HA LYS 14 HA LYS 14 21.691 -3.381 5.646
117 HB2 LYS 14 1HB LYS 14 20.849 -2.379 3.719
118 HB3 LYS 14 2HB LYS 14 21.525 -3.609 2.660
119 HG2 LYS 14 1HG LYS 14 19.866 -5.214 3.365
120 HG3 LYS 14 2HG LYS 14 19.275 -4.127 4.613
121 HD2 LYS 14 1HD LYS 14 18.058 -2.867 3.134
122 HD3 LYS 14 2HD LYS 14 19.274 -2.977 1.871
123 HE2 LYS 14 1HE LYS 14 16.976 -4.177 1.536
124 HE3 LYS 14 2HE LYS 14 18.459 -5.006 1.065
125 HZ1 LYS 14 1HZ LYS 14 18.365 -6.404 2.847
126 HZ2 LYS 14 2HZ LYS 14 16.708 -6.194 2.544
127 HZ3 LYS 14 3HZ LYS 14 17.456 -5.333 3.802
128 H GLU 15 H GLU 15 20.065 -5.169 5.832
129 HA GLU 15 HA GLU 15 20.860 -7.479 6.779
130 HB2 GLU 15 1HB GLU 15 18.560 -7.099 4.851
131 HB3 GLU 15 2HB GLU 15 18.784 -8.553 5.828
132 HG2 GLU 15 1HG GLU 15 18.610 -7.298 7.875
133 HG3 GLU 15 2HG GLU 15 18.683 -5.765 7.008
134 H ASN 16 H ASN 16 22.546 -8.652 6.120
135 HA ASN 16 HA ASN 16 23.734 -10.208 4.928
136 HB2 ASN 16 1HB ASN 16 21.136 -10.642 3.439
137 HB3 ASN 16 2HB ASN 16 22.477 -11.775 3.589
138 HD21 ASN 16 1HD2 ASN 16 22.531 -13.107 5.447
139 HD22 ASN 16 2HD2 ASN 16 21.386 -13.010 6.697
140 H GLU 17 H GLU 17 24.271 -7.740 4.064
141 HA GLU 17 HA GLU 17 24.367 -7.984 1.110
142 HB2 GLU 17 1HB GLU 17 24.067 -5.604 2.942
143 HB3 GLU 17 2HB GLU 17 24.500 -5.439 1.246
144 HG2 GLU 17 1HG GLU 17 22.239 -7.159 1.352
145 HG3 GLU 17 2HG GLU 17 21.895 -5.893 2.489
146 H LYS 18 H LYS 18 26.212 -7.497 0.025
147 HA LYS 18 HA LYS 18 28.644 -7.765 1.622
148 HB2 LYS 18 1HB LYS 18 27.930 -8.178 -1.262
149 HB3 LYS 18 2HB LYS 18 29.619 -7.973 -0.809
150 HG2 LYS 18 1HG LYS 18 29.128 -10.331 -0.835
151 HG3 LYS 18 2HG LYS 18 29.348 -9.841 0.841
152 HD2 LYS 18 1HD LYS 18 26.948 -9.772 1.192
153 HD3 LYS 18 2HD LYS 18 26.648 -10.062 -0.522
154 HE2 LYS 18 1HE LYS 18 27.947 -11.971 1.446
155 HE3 LYS 18 2HE LYS 18 26.372 -12.159 0.679
156 HZ1 LYS 18 1HZ LYS 18 27.757 -11.969 -1.486
157 HZ2 LYS 18 2HZ LYS 18 27.703 -13.444 -0.648
158 HZ3 LYS 18 3HZ LYS 18 29.054 -12.430 -0.490
159 HA PRO 19 HA PRO 19 29.582 -3.425 1.048
160 HB2 PRO 19 1HB PRO 19 32.457 -4.057 1.141
161 HB3 PRO 19 2HB PRO 19 31.499 -3.076 2.240
162 HG2 PRO 19 1HG PRO 19 32.466 -5.655 2.719
163 HG3 PRO 19 2HG PRO 19 31.279 -4.786 3.685
164 HD2 PRO 19 1HD PRO 19 30.857 -7.092 1.973
165 HD3 PRO 19 2HD PRO 19 29.697 -6.284 3.037
166 H ILE 20 H ILE 20 29.477 -2.461 -0.919
167 HA ILE 20 HA ILE 20 31.750 -2.929 -2.695
168 HB ILE 20 HB ILE 20 29.520 -4.230 -3.201
169 HG12 ILE 20 1HG1 ILE 20 30.815 -2.830 -5.507
170 HG13 ILE 20 2HG1 ILE 20 31.693 -4.038 -4.579
171 HG21 ILE 20 1HG2 ILE 20 27.794 -2.726 -3.548
172 HG22 ILE 20 2HG2 ILE 20 28.393 -2.867 -5.181
173 HG23 ILE 20 3HG2 ILE 20 28.841 -1.482 -4.227
174 HD11 ILE 20 1HD1 ILE 20 29.092 -4.432 -6.081
175 HD12 ILE 20 2HD1 ILE 20 29.811 -5.650 -5.026
176 HD13 ILE 20 3HD1 ILE 20 30.658 -5.138 -6.484
177 H GLY 21 H GLY 21 31.452 -1.367 -4.713
178 HA2 GLY 21 1HA GLY 21 31.871 0.815 -5.308
179 HA3 GLY 21 2HA GLY 21 30.190 0.994 -4.863
180 H TYR 22 H TYR 22 31.027 3.240 -4.464
181 HA TYR 22 HA TYR 22 32.001 3.513 -1.686
182 HB2 TYR 22 1HB TYR 22 33.841 3.733 -3.474
183 HB3 TYR 22 2HB TYR 22 33.034 5.233 -3.941
184 HD1 TYR 22 HD1 TYR 22 32.862 7.120 -2.344
185 HD2 TYR 22 HD2 TYR 22 35.040 3.543 -1.389
186 HE1 TYR 22 HE1 TYR 22 34.053 8.325 -0.531
187 HE2 TYR 22 HE2 TYR 22 36.252 4.763 0.401
188 HH TYR 22 HH TYR 22 36.703 7.058 1.129
189 H CYS 23 H CYS 23 31.426 5.428 -0.658
190 HA CYS 23 HA CYS 23 29.513 7.215 -1.948
191 HB2 CYS 23 1HB CYS 23 28.696 5.037 -0.234
192 HB3 CYS 23 2HB CYS 23 28.303 6.574 0.528
193 H ARG 24 H ARG 24 28.630 8.605 0.142
194 HA ARG 24 HA ARG 24 30.951 10.238 0.625
195 HB2 ARG 24 1HB ARG 24 28.131 10.570 1.680
196 HB3 ARG 24 2HB ARG 24 29.360 11.822 1.550
197 HG2 ARG 24 1HG ARG 24 28.290 10.305 -0.846
198 HG3 ARG 24 2HG ARG 24 27.582 11.812 -0.276
199 HD2 ARG 24 1HD ARG 24 30.398 11.383 -1.301
200 HD3 ARG 24 2HD ARG 24 29.129 12.363 -2.025
201 HE ARG 24 HE ARG 24 29.339 13.613 0.289
202 HH11 ARG 24 1HH1 ARG 24 31.414 13.290 -2.341
203 HH12 ARG 24 2HH1 ARG 24 32.798 13.986 -1.568
204 HH21 ARG 24 1HH2 ARG 24 31.322 14.085 1.569
205 HH22 ARG 24 2HH2 ARG 24 32.749 14.432 0.651
206 H ASN 25 H ASN 25 31.492 11.119 2.666
207 HA ASN 25 HA ASN 25 32.470 10.657 4.736
208 HB2 ASN 25 1HB ASN 25 29.481 10.805 5.060
209 HB3 ASN 25 2HB ASN 25 30.555 10.700 6.455
210 HD21 ASN 25 1HD2 ASN 25 29.299 12.968 6.612
211 HD22 ASN 25 2HD2 ASN 25 30.232 14.281 6.062
212 H GLY 26 H GLY 26 32.742 8.303 3.513
213 HA2 GLY 26 1HA GLY 26 33.675 6.389 4.524
214 HA3 GLY 26 2HA GLY 26 32.572 6.581 5.885
215 H LYS 27 H LYS 27 30.232 6.947 4.067
216 HA LYS 27 HA LYS 27 29.531 4.197 4.165
217 HB2 LYS 27 1HB LYS 27 27.751 6.026 2.630
218 HB3 LYS 27 2HB LYS 27 27.373 4.890 3.908
219 HG2 LYS 27 1HG LYS 27 28.669 6.579 5.443
220 HG3 LYS 27 2HG LYS 27 28.415 7.705 4.115
221 HD2 LYS 27 1HD LYS 27 26.000 7.360 4.222
222 HD3 LYS 27 2HD LYS 27 26.210 6.170 5.511
223 HE2 LYS 27 1HE LYS 27 27.253 7.915 6.929
224 HE3 LYS 27 2HE LYS 27 26.995 9.098 5.649
225 HZ1 LYS 27 1HZ LYS 27 25.153 8.093 7.579
226 HZ2 LYS 27 2HZ LYS 27 24.559 7.901 5.999
227 HZ3 LYS 27 3HZ LYS 27 25.012 9.440 6.555
228 H LYS 28 H LYS 28 29.144 2.733 2.563
229 HA LYS 28 HA LYS 28 30.203 3.370 -0.137
230 HB2 LYS 28 1HB LYS 28 30.643 0.749 1.276
231 HB3 LYS 28 2HB LYS 28 31.388 1.334 -0.212
232 HG2 LYS 28 1HG LYS 28 32.338 3.263 1.161
233 HG3 LYS 28 2HG LYS 28 31.816 2.382 2.597
234 HD2 LYS 28 1HD LYS 28 33.190 0.450 1.909
235 HD3 LYS 28 2HD LYS 28 33.712 1.333 0.475
236 HE2 LYS 28 1HE LYS 28 34.663 3.107 1.932
237 HE3 LYS 28 2HE LYS 28 34.191 2.173 3.350
238 HZ1 LYS 28 1HZ LYS 28 35.535 0.309 2.249
239 HZ2 LYS 28 2HZ LYS 28 36.380 1.567 3.015
240 HZ3 LYS 28 3HZ LYS 28 36.237 1.549 1.322
241 H CYS 29 H CYS 29 29.411 1.695 -1.776
242 HA CYS 29 HA CYS 29 26.580 1.187 -1.279
243 HB2 CYS 29 1HB CYS 29 28.396 0.843 -3.666
244 HB3 CYS 29 2HB CYS 29 26.784 0.148 -3.657
245 H CYS 30 H CYS 30 26.095 -0.658 -0.132
246 HA CYS 30 HA CYS 30 27.858 -3.010 -0.478
247 HB2 CYS 30 1HB CYS 30 25.452 -2.540 1.312
248 HB3 CYS 30 2HB CYS 30 26.372 -4.037 1.203
249 H VAL 31 H VAL 31 27.468 -4.163 -2.213
250 HA VAL 31 HA VAL 31 24.812 -4.238 -3.385
251 HB VAL 31 HB VAL 31 27.553 -4.958 -4.217
252 HG11 VAL 31 1HG1 VAL 31 26.698 -6.523 -6.013
253 HG12 VAL 31 2HG1 VAL 31 25.205 -6.656 -5.085
254 HG13 VAL 31 3HG1 VAL 31 26.728 -7.209 -4.389
255 HG21 VAL 31 1HG2 VAL 31 26.075 -3.063 -5.061
256 HG22 VAL 31 2HG2 VAL 31 25.108 -4.295 -5.856
257 HG23 VAL 31 3HG2 VAL 31 26.797 -4.082 -6.318
258 H ASN 32 H ASN 32 23.339 -5.524 -2.804
259 HA ASN 32 HA ASN 32 23.262 -7.181 -0.722
260 HB2 ASN 32 1HB ASN 32 21.357 -6.526 -2.266
261 HB3 ASN 32 2HB ASN 32 21.818 -7.896 -3.275
262 HD21 ASN 32 1HD2 ASN 32 20.502 -6.999 -0.097
263 HD22 ASN 32 2HD2 ASN 32 20.056 -8.570 0.362
Start of MODEL 6
1 H1 LYS 1 1H LYS 1 21.276 5.867 -2.200
2 H2 LYS 1 2H LYS 1 21.651 6.974 -0.968
3 H3 LYS 1 3H LYS 1 22.881 6.042 -1.674
4 HA LYS 1 HA LYS 1 21.334 8.243 -2.920
5 HB2 LYS 1 1HB LYS 1 24.282 7.787 -2.358
6 HB3 LYS 1 2HB LYS 1 23.631 9.169 -3.241
7 HG2 LYS 1 1HG LYS 1 22.315 9.828 -1.277
8 HG3 LYS 1 2HG LYS 1 22.891 8.411 -0.397
9 HD2 LYS 1 1HD LYS 1 25.225 9.253 -0.639
10 HD3 LYS 1 2HD LYS 1 24.595 10.700 -1.428
11 HE2 LYS 1 1HE LYS 1 23.351 11.307 0.572
12 HE3 LYS 1 2HE LYS 1 23.810 9.797 1.359
13 HZ1 LYS 1 1HZ LYS 1 26.195 10.618 0.868
14 HZ2 LYS 1 2HZ LYS 1 25.349 11.266 2.190
15 HZ3 LYS 1 3HZ LYS 1 25.469 12.147 0.744
16 H LYS 2 H LYS 2 24.296 6.450 -3.695
17 HA LYS 2 HA LYS 2 23.101 5.555 -6.263
18 HB2 LYS 2 1HB LYS 2 25.861 6.736 -5.816
19 HB3 LYS 2 2HB LYS 2 25.275 6.040 -7.328
20 HG2 LYS 2 1HG LYS 2 23.562 7.739 -7.522
21 HG3 LYS 2 2HG LYS 2 23.930 8.354 -5.910
22 HD2 LYS 2 1HD LYS 2 24.975 9.810 -7.553
23 HD3 LYS 2 2HD LYS 2 26.234 8.918 -6.702
24 HE2 LYS 2 1HE LYS 2 26.629 7.490 -8.537
25 HE3 LYS 2 2HE LYS 2 25.085 7.882 -9.294
26 HZ1 LYS 2 1HZ LYS 2 26.597 10.232 -8.921
27 HZ2 LYS 2 2HZ LYS 2 26.040 9.543 -10.370
28 HZ3 LYS 2 3HZ LYS 2 27.546 9.082 -9.732
29 H CYS 3 H CYS 3 23.438 3.463 -6.672
30 HA CYS 3 HA CYS 3 25.825 2.066 -5.965
31 HB2 CYS 3 1HB CYS 3 23.303 1.461 -4.405
32 HB3 CYS 3 2HB CYS 3 24.661 0.347 -4.527
33 H TRP 4 H TRP 4 25.029 -0.488 -6.014
34 HA TRP 4 HA TRP 4 23.985 -0.725 -8.775
35 HB2 TRP 4 1HB TRP 4 25.986 -2.711 -7.861
36 HB3 TRP 4 2HB TRP 4 25.832 -1.909 -9.418
37 HD1 TRP 4 HD1 TRP 4 26.944 -1.138 -5.816
38 HE1 TRP 4 HE1 TRP 4 28.868 0.564 -5.898
39 HE3 TRP 4 HE3 TRP 4 27.443 -0.698 -10.849
40 HZ2 TRP 4 HZ2 TRP 4 30.830 1.323 -7.871
41 HZ3 TRP 4 HZ3 TRP 4 29.354 0.551 -11.803
42 HH2 TRP 4 HH2 TRP 4 30.941 1.740 -10.323
43 H ASN 5 H ASN 5 23.379 -3.059 -9.267
44 HA ASN 5 HA ASN 5 21.762 -4.675 -8.851
45 HB2 ASN 5 1HB ASN 5 23.782 -5.002 -6.631
46 HB3 ASN 5 2HB ASN 5 22.499 -6.175 -6.933
47 HD21 ASN 5 1HD2 ASN 5 25.595 -4.983 -8.069
48 HD22 ASN 5 2HD2 ASN 5 25.774 -6.107 -9.326
49 H GLY 6 H GLY 6 21.174 -2.049 -7.688
50 HA2 GLY 6 1HA GLY 6 19.403 -1.196 -6.508
51 HA3 GLY 6 2HA GLY 6 18.888 -2.850 -6.178
52 H GLY 7 H GLY 7 22.002 -2.778 -5.166
53 HA2 GLY 7 1HA GLY 7 21.522 -2.839 -2.461
54 HA3 GLY 7 2HA GLY 7 23.085 -2.400 -3.155
55 H ARG 8 H ARG 8 22.890 -1.081 -0.984
56 HA ARG 8 HA ARG 8 22.023 1.638 -1.772
57 HB2 ARG 8 1HB ARG 8 21.415 2.006 0.618
58 HB3 ARG 8 2HB ARG 8 20.377 0.844 -0.204
59 HG2 ARG 8 1HG ARG 8 21.351 -1.002 0.871
60 HG3 ARG 8 2HG ARG 8 22.792 -0.107 1.330
61 HD2 ARG 8 1HD ARG 8 21.598 -0.282 3.339
62 HD3 ARG 8 2HD ARG 8 21.184 1.331 2.779
63 HE ARG 8 HE ARG 8 19.259 -0.495 1.812
64 HH11 ARG 8 1HH1 ARG 8 20.477 -0.291 4.931
65 HH12 ARG 8 2HH1 ARG 8 19.017 0.245 5.696
66 HH21 ARG 8 1HH2 ARG 8 17.285 0.632 2.720
67 HH22 ARG 8 2HH2 ARG 8 17.191 0.699 4.448
68 H CYS 9 H CYS 9 23.031 3.287 -0.166
69 HA CYS 9 HA CYS 9 25.861 2.558 0.318
70 HB2 CYS 9 1HB CYS 9 24.506 5.074 -0.493
71 HB3 CYS 9 2HB CYS 9 25.882 5.237 0.590
72 H ARG 10 H ARG 10 26.313 2.109 2.354
73 HA ARG 10 HA ARG 10 25.604 4.022 4.431
74 HB2 ARG 10 1HB ARG 10 24.715 1.142 4.498
75 HB3 ARG 10 2HB ARG 10 24.876 2.128 5.951
76 HG2 ARG 10 1HG ARG 10 23.339 3.823 4.717
77 HG3 ARG 10 2HG ARG 10 23.002 2.494 3.612
78 HD2 ARG 10 1HD ARG 10 21.322 2.567 5.410
79 HD3 ARG 10 2HD ARG 10 22.284 1.095 5.525
80 HE ARG 10 HE ARG 10 23.472 3.127 7.101
81 HH11 ARG 10 1HH1 ARG 10 21.044 3.756 8.359
82 HH12 ARG 10 2HH1 ARG 10 20.724 2.464 9.469
83 HH21 ARG 10 1HH2 ARG 10 23.058 0.328 8.044
84 HH22 ARG 10 2HH2 ARG 10 21.858 0.509 9.280
85 H LYS 11 H LYS 11 26.922 3.778 6.335
86 HA LYS 11 HA LYS 11 29.592 2.992 5.877
87 HB2 LYS 11 1HB LYS 11 28.172 3.249 8.543
88 HB3 LYS 11 2HB LYS 11 29.915 3.316 8.268
89 HG2 LYS 11 1HG LYS 11 29.564 5.286 6.785
90 HG3 LYS 11 2HG LYS 11 27.848 5.261 7.195
91 HD2 LYS 11 1HD LYS 11 28.500 5.509 9.611
92 HD3 LYS 11 2HD LYS 11 30.173 5.703 9.090
93 HE2 LYS 11 1HE LYS 11 29.200 7.585 7.539
94 HE3 LYS 11 2HE LYS 11 27.834 7.542 8.652
95 HZ1 LYS 11 1HZ LYS 11 29.017 8.503 10.257
96 HZ2 LYS 11 2HZ LYS 11 30.097 8.954 9.026
97 HZ3 LYS 11 3HZ LYS 11 30.399 7.563 9.954
98 H LYS 12 H LYS 12 26.854 1.178 6.313
99 HA LYS 12 HA LYS 12 28.380 -1.280 6.887
100 HB2 LYS 12 1HB LYS 12 25.794 -0.397 8.194
101 HB3 LYS 12 2HB LYS 12 26.411 -2.043 8.262
102 HG2 LYS 12 1HG LYS 12 28.270 -1.446 9.556
103 HG3 LYS 12 2HG LYS 12 28.168 0.252 9.117
104 HD2 LYS 12 1HD LYS 12 25.920 -1.047 10.647
105 HD3 LYS 12 2HD LYS 12 27.366 -0.509 11.491
106 HE2 LYS 12 1HE LYS 12 27.045 1.765 10.479
107 HE3 LYS 12 2HE LYS 12 25.514 1.207 9.811
108 HZ1 LYS 12 1HZ LYS 12 24.723 1.964 11.747
109 HZ2 LYS 12 2HZ LYS 12 26.216 1.842 12.549
110 HZ3 LYS 12 3HZ LYS 12 25.247 0.463 12.343
111 H CYS 13 H CYS 13 26.885 -3.218 6.332
112 HA CYS 13 HA CYS 13 25.415 -2.581 3.833
113 HB2 CYS 13 1HB CYS 13 26.561 -5.246 4.704
114 HB3 CYS 13 2HB CYS 13 25.931 -4.830 3.129
115 H LYS 14 H LYS 14 23.345 -2.734 3.813
116 HA LYS 14 HA LYS 14 21.686 -3.257 5.906
117 HB2 LYS 14 1HB LYS 14 20.666 -2.302 4.050
118 HB3 LYS 14 2HB LYS 14 21.307 -3.502 2.939
119 HG2 LYS 14 1HG LYS 14 19.769 -5.184 3.808
120 HG3 LYS 14 2HG LYS 14 19.234 -4.083 5.077
121 HD2 LYS 14 1HD LYS 14 18.352 -2.547 3.343
122 HD3 LYS 14 2HD LYS 14 18.881 -3.672 2.090
123 HE2 LYS 14 1HE LYS 14 17.412 -5.410 2.985
124 HE3 LYS 14 2HE LYS 14 16.930 -4.351 4.311
125 HZ1 LYS 14 1HZ LYS 14 16.421 -2.803 2.200
126 HZ2 LYS 14 2HZ LYS 14 15.269 -3.820 2.922
127 HZ3 LYS 14 3HZ LYS 14 16.102 -4.332 1.533
128 H GLU 15 H GLU 15 20.149 -5.086 6.234
129 HA GLU 15 HA GLU 15 21.250 -7.339 7.138
130 HB2 GLU 15 1HB GLU 15 18.597 -6.994 5.748
131 HB3 GLU 15 2HB GLU 15 19.056 -8.514 6.517
132 HG2 GLU 15 1HG GLU 15 19.142 -5.854 7.957
133 HG3 GLU 15 2HG GLU 15 17.729 -6.908 7.978
134 H ASN 16 H ASN 16 22.726 -8.608 6.267
135 HA ASN 16 HA ASN 16 23.655 -10.231 4.935
136 HB2 ASN 16 1HB ASN 16 20.914 -10.376 3.662
137 HB3 ASN 16 2HB ASN 16 22.164 -11.615 3.617
138 HD21 ASN 16 1HD2 ASN 16 22.888 -11.075 6.518
139 HD22 ASN 16 2HD2 ASN 16 21.637 -11.783 7.420
140 H GLU 17 H GLU 17 24.187 -7.664 4.127
141 HA GLU 17 HA GLU 17 24.069 -7.847 1.169
142 HB2 GLU 17 1HB GLU 17 23.959 -5.478 3.033
143 HB3 GLU 17 2HB GLU 17 24.307 -5.306 1.318
144 HG2 GLU 17 1HG GLU 17 21.997 -6.926 1.487
145 HG3 GLU 17 2HG GLU 17 21.762 -5.722 2.713
146 H LYS 18 H LYS 18 25.848 -7.754 0.031
147 HA LYS 18 HA LYS 18 28.326 -8.113 1.408
148 HB2 LYS 18 1HB LYS 18 27.278 -8.441 -1.308
149 HB3 LYS 18 2HB LYS 18 28.945 -7.884 -1.303
150 HG2 LYS 18 1HG LYS 18 28.957 -10.289 -1.331
151 HG3 LYS 18 2HG LYS 18 29.515 -9.758 0.253
152 HD2 LYS 18 1HD LYS 18 27.314 -10.186 1.218
153 HD3 LYS 18 2HD LYS 18 26.660 -10.567 -0.375
154 HE2 LYS 18 1HE LYS 18 27.176 -12.642 0.813
155 HE3 LYS 18 2HE LYS 18 28.288 -12.453 -0.544
156 HZ1 LYS 18 1HZ LYS 18 28.853 -11.769 2.290
157 HZ2 LYS 18 2HZ LYS 18 29.916 -11.510 0.993
158 HZ3 LYS 18 3HZ LYS 18 29.484 -13.092 1.434
159 HA PRO 19 HA PRO 19 29.383 -3.692 1.150
160 HB2 PRO 19 1HB PRO 19 32.185 -4.445 1.638
161 HB3 PRO 19 2HB PRO 19 31.114 -3.463 2.635
162 HG2 PRO 19 1HG PRO 19 31.938 -5.961 3.320
163 HG3 PRO 19 2HG PRO 19 30.409 -5.253 3.857
164 HD2 PRO 19 1HD PRO 19 30.901 -7.280 1.694
165 HD3 PRO 19 2HD PRO 19 29.563 -7.146 2.859
166 H ILE 20 H ILE 20 29.502 -2.821 -0.880
167 HA ILE 20 HA ILE 20 32.113 -3.231 -2.155
168 HB ILE 20 HB ILE 20 31.341 -3.864 -4.149
169 HG12 ILE 20 1HG1 ILE 20 28.521 -2.961 -4.106
170 HG13 ILE 20 2HG1 ILE 20 29.672 -1.661 -4.238
171 HG21 ILE 20 1HG2 ILE 20 29.319 -5.270 -3.989
172 HG22 ILE 20 2HG2 ILE 20 29.012 -4.621 -2.385
173 HG23 ILE 20 3HG2 ILE 20 30.485 -5.551 -2.689
174 HD11 ILE 20 1HD1 ILE 20 29.696 -4.098 -6.011
175 HD12 ILE 20 2HD1 ILE 20 30.712 -2.666 -6.163
176 HD13 ILE 20 3HD1 ILE 20 28.975 -2.548 -6.437
177 H GLY 21 H GLY 21 32.055 -1.757 -4.216
178 HA2 GLY 21 1HA GLY 21 32.486 0.431 -4.919
179 HA3 GLY 21 2HA GLY 21 30.770 0.508 -4.564
180 H TYR 22 H TYR 22 31.870 2.848 -4.344
181 HA TYR 22 HA TYR 22 32.476 3.285 -1.477
182 HB2 TYR 22 1HB TYR 22 34.476 3.332 -3.147
183 HB3 TYR 22 2HB TYR 22 33.802 4.876 -3.667
184 HD1 TYR 22 HD1 TYR 22 33.529 6.740 -2.001
185 HD2 TYR 22 HD2 TYR 22 35.548 3.082 -1.010
186 HE1 TYR 22 HE1 TYR 22 34.605 7.856 -0.067
187 HE2 TYR 22 HE2 TYR 22 36.607 4.192 0.936
188 HH TYR 22 HH TYR 22 36.715 6.033 2.164
189 H CYS 23 H CYS 23 32.070 5.487 -0.773
190 HA CYS 23 HA CYS 23 30.073 7.000 -2.237
191 HB2 CYS 23 1HB CYS 23 29.261 4.795 -0.663
192 HB3 CYS 23 2HB CYS 23 28.854 6.234 0.260
193 H ARG 24 H ARG 24 28.996 8.472 -0.310
194 HA ARG 24 HA ARG 24 31.198 10.140 0.491
195 HB2 ARG 24 1HB ARG 24 28.215 10.334 0.996
196 HB3 ARG 24 2HB ARG 24 29.385 11.600 1.372
197 HG2 ARG 24 1HG ARG 24 30.005 11.772 -0.987
198 HG3 ARG 24 2HG ARG 24 28.932 10.429 -1.391
199 HD2 ARG 24 1HD ARG 24 26.999 11.741 -0.577
200 HD3 ARG 24 2HD ARG 24 28.074 13.088 -0.206
201 HE ARG 24 HE ARG 24 27.208 12.227 -2.859
202 HH11 ARG 24 1HH1 ARG 24 27.789 13.627 -4.545
203 HH12 ARG 24 2HH1 ARG 24 28.879 14.937 -4.240
204 HH21 ARG 24 1HH2 ARG 24 29.451 14.024 -0.938
205 HH22 ARG 24 2HH2 ARG 24 29.799 15.184 -2.177
206 H ASN 25 H ASN 25 31.395 11.020 2.615
207 HA ASN 25 HA ASN 25 32.101 10.594 4.787
208 HB2 ASN 25 1HB ASN 25 29.236 9.967 5.384
209 HB3 ASN 25 2HB ASN 25 30.328 11.106 6.166
210 HD21 ASN 25 1HD2 ASN 25 30.853 13.128 4.824
211 HD22 ASN 25 2HD2 ASN 25 29.582 13.752 3.879
212 H GLY 26 H GLY 26 32.755 8.288 3.542
213 HA2 GLY 26 1HA GLY 26 33.605 6.309 4.486
214 HA3 GLY 26 2HA GLY 26 32.452 6.470 5.811
215 H LYS 27 H LYS 27 30.225 6.938 3.832
216 HA LYS 27 HA LYS 27 29.370 4.251 3.951
217 HB2 LYS 27 1HB LYS 27 27.937 6.229 2.206
218 HB3 LYS 27 2HB LYS 27 27.285 5.017 3.293
219 HG2 LYS 27 1HG LYS 27 28.387 6.438 5.174
220 HG3 LYS 27 2HG LYS 27 28.513 7.694 3.948
221 HD2 LYS 27 1HD LYS 27 26.104 7.660 3.595
222 HD3 LYS 27 2HD LYS 27 25.931 6.325 4.743
223 HE2 LYS 27 1HE LYS 27 26.847 7.731 6.537
224 HE3 LYS 27 2HE LYS 27 27.072 9.060 5.402
225 HZ1 LYS 27 1HZ LYS 27 24.409 8.032 5.333
226 HZ2 LYS 27 2HZ LYS 27 24.944 9.626 5.572
227 HZ3 LYS 27 3HZ LYS 27 24.832 8.561 6.890
228 H LYS 28 H LYS 28 29.289 2.672 2.540
229 HA LYS 28 HA LYS 28 30.586 3.059 -0.108
230 HB2 LYS 28 1HB LYS 28 30.499 0.600 1.652
231 HB3 LYS 28 2HB LYS 28 31.319 0.742 0.099
232 HG2 LYS 28 1HG LYS 28 32.666 2.634 1.036
233 HG3 LYS 28 2HG LYS 28 31.907 2.354 2.603
234 HD2 LYS 28 1HD LYS 28 32.765 -0.013 2.500
235 HD3 LYS 28 2HD LYS 28 33.674 0.438 1.058
236 HE2 LYS 28 1HE LYS 28 34.794 2.247 2.355
237 HE3 LYS 28 2HE LYS 28 33.950 1.698 3.803
238 HZ1 LYS 28 1HZ LYS 28 35.956 0.604 3.937
239 HZ2 LYS 28 2HZ LYS 28 36.060 0.341 2.262
240 HZ3 LYS 28 3HZ LYS 28 34.974 -0.569 3.198
241 H CYS 29 H CYS 29 29.745 1.493 -1.804
242 HA CYS 29 HA CYS 29 26.874 1.020 -1.457
243 HB2 CYS 29 1HB CYS 29 28.735 0.599 -3.792
244 HB3 CYS 29 2HB CYS 29 27.072 0.020 -3.783
245 H CYS 30 H CYS 30 26.392 -0.569 -0.224
246 HA CYS 30 HA CYS 30 27.775 -3.149 -0.457
247 HB2 CYS 30 1HB CYS 30 25.392 -2.312 1.222
248 HB3 CYS 30 2HB CYS 30 26.167 -3.894 1.233
249 H VAL 31 H VAL 31 27.247 -4.316 -2.179
250 HA VAL 31 HA VAL 31 24.610 -4.121 -3.400
251 HB VAL 31 HB VAL 31 27.139 -5.597 -4.017
252 HG11 VAL 31 1HG1 VAL 31 25.658 -6.307 -6.149
253 HG12 VAL 31 2HG1 VAL 31 24.396 -6.314 -4.919
254 HG13 VAL 31 3HG1 VAL 31 25.818 -7.321 -4.726
255 HG21 VAL 31 1HG2 VAL 31 26.342 -3.100 -4.721
256 HG22 VAL 31 2HG2 VAL 31 25.631 -4.002 -6.034
257 HG23 VAL 31 3HG2 VAL 31 27.358 -4.100 -5.758
258 H ASN 32 H ASN 32 22.978 -5.193 -2.737
259 HA ASN 32 HA ASN 32 22.979 -6.949 -0.598
260 HB2 ASN 32 1HB ASN 32 21.043 -5.613 -1.645
261 HB3 ASN 32 2HB ASN 32 20.849 -6.989 -2.729
262 HD21 ASN 32 1HD2 ASN 32 19.300 -5.852 -0.203
263 HD22 ASN 32 2HD2 ASN 32 19.052 -7.237 0.746
Start of MODEL 7
1 H1 LYS 1 1H LYS 1 25.667 10.238 -7.226
2 H2 LYS 1 2H LYS 1 27.296 9.804 -7.021
3 H3 LYS 1 3H LYS 1 26.159 9.426 -5.818
4 HA LYS 1 HA LYS 1 25.399 8.366 -8.354
5 HB2 LYS 1 1HB LYS 1 27.187 6.649 -8.438
6 HB3 LYS 1 2HB LYS 1 27.826 8.271 -8.705
7 HG2 LYS 1 1HG LYS 1 28.431 8.384 -6.282
8 HG3 LYS 1 2HG LYS 1 27.895 6.713 -6.104
9 HD2 LYS 1 1HD LYS 1 29.555 5.995 -7.780
10 HD3 LYS 1 2HD LYS 1 30.087 7.666 -7.972
11 HE2 LYS 1 1HE LYS 1 30.535 7.639 -5.439
12 HE3 LYS 1 2HE LYS 1 30.360 5.887 -5.544
13 HZ1 LYS 1 1HZ LYS 1 32.057 6.010 -7.386
14 HZ2 LYS 1 2HZ LYS 1 32.634 6.323 -5.820
15 HZ3 LYS 1 3HZ LYS 1 32.354 7.608 -6.895
16 H LYS 2 H LYS 2 24.007 6.771 -7.896
17 HA LYS 2 HA LYS 2 23.569 6.017 -5.118
18 HB2 LYS 2 1HB LYS 2 22.111 5.509 -7.709
19 HB3 LYS 2 2HB LYS 2 21.671 4.661 -6.227
20 HG2 LYS 2 1HG LYS 2 21.247 6.767 -5.088
21 HG3 LYS 2 2HG LYS 2 21.825 7.679 -6.484
22 HD2 LYS 2 1HD LYS 2 19.985 6.877 -7.843
23 HD3 LYS 2 2HD LYS 2 19.467 5.774 -6.569
24 HE2 LYS 2 1HE LYS 2 18.783 7.567 -5.156
25 HE3 LYS 2 2HE LYS 2 19.632 8.763 -6.134
26 HZ1 LYS 2 1HZ LYS 2 17.951 7.551 -7.894
27 HZ2 LYS 2 2HZ LYS 2 17.694 9.056 -7.152
28 HZ3 LYS 2 3HZ LYS 2 17.017 7.651 -6.480
29 H CYS 3 H CYS 3 22.834 3.533 -4.999
30 HA CYS 3 HA CYS 3 25.291 2.042 -5.554
31 HB2 CYS 3 1HB CYS 3 22.801 1.341 -3.976
32 HB3 CYS 3 2HB CYS 3 24.202 0.286 -4.150
33 H TRP 4 H TRP 4 24.489 -0.467 -5.733
34 HA TRP 4 HA TRP 4 23.351 -0.546 -8.470
35 HB2 TRP 4 1HB TRP 4 25.582 -2.382 -7.702
36 HB3 TRP 4 2HB TRP 4 25.200 -1.679 -9.270
37 HD1 TRP 4 HD1 TRP 4 26.588 -0.634 -5.831
38 HE1 TRP 4 HE1 TRP 4 28.224 1.325 -6.174
39 HE3 TRP 4 HE3 TRP 4 26.243 -0.092 -10.889
40 HZ2 TRP 4 HZ2 TRP 4 29.454 2.729 -8.354
41 HZ3 TRP 4 HZ3 TRP 4 27.737 1.474 -12.084
42 HH2 TRP 4 HH2 TRP 4 29.273 2.950 -10.822
43 H ASN 5 H ASN 5 22.803 -2.857 -9.091
44 HA ASN 5 HA ASN 5 21.318 -4.591 -8.668
45 HB2 ASN 5 1HB ASN 5 23.536 -4.991 -6.649
46 HB3 ASN 5 2HB ASN 5 22.293 -6.201 -6.975
47 HD21 ASN 5 1HD2 ASN 5 25.316 -4.939 -8.027
48 HD22 ASN 5 2HD2 ASN 5 25.426 -5.806 -9.481
49 H GLY 6 H GLY 6 20.653 -2.115 -7.302
50 HA2 GLY 6 1HA GLY 6 18.966 -1.444 -5.911
51 HA3 GLY 6 2HA GLY 6 18.577 -3.146 -5.668
52 H GLY 7 H GLY 7 21.766 -1.959 -4.962
53 HA2 GLY 7 1HA GLY 7 21.562 -2.865 -2.207
54 HA3 GLY 7 2HA GLY 7 22.995 -2.206 -2.998
55 H ARG 8 H ARG 8 22.941 -1.102 -0.721
56 HA ARG 8 HA ARG 8 21.896 1.616 -1.234
57 HB2 ARG 8 1HB ARG 8 21.390 1.713 1.227
58 HB3 ARG 8 2HB ARG 8 20.342 0.669 0.287
59 HG2 ARG 8 1HG ARG 8 20.862 -1.075 1.634
60 HG3 ARG 8 2HG ARG 8 22.544 -0.954 1.150
61 HD2 ARG 8 1HD ARG 8 22.279 -0.802 3.592
62 HD3 ARG 8 2HD ARG 8 22.967 0.673 2.917
63 HE ARG 8 HE ARG 8 21.103 1.794 3.695
64 HH11 ARG 8 1HH1 ARG 8 19.209 0.085 1.986
65 HH12 ARG 8 2HH1 ARG 8 18.120 -0.509 3.193
66 HH21 ARG 8 1HH2 ARG 8 20.182 0.334 5.848
67 HH22 ARG 8 2HH2 ARG 8 18.657 -0.342 5.381
68 H CYS 9 H CYS 9 22.942 3.194 0.446
69 HA CYS 9 HA CYS 9 25.805 2.470 0.769
70 HB2 CYS 9 1HB CYS 9 24.614 5.245 0.824
71 HB3 CYS 9 2HB CYS 9 26.317 4.830 0.961
72 H ARG 10 H ARG 10 26.349 1.947 2.729
73 HA ARG 10 HA ARG 10 25.754 3.763 4.901
74 HB2 ARG 10 1HB ARG 10 24.814 0.901 4.900
75 HB3 ARG 10 2HB ARG 10 25.217 1.709 6.411
76 HG2 ARG 10 1HG ARG 10 23.599 3.559 5.688
77 HG3 ARG 10 2HG ARG 10 23.065 2.453 4.422
78 HD2 ARG 10 1HD ARG 10 21.631 2.246 6.406
79 HD3 ARG 10 2HD ARG 10 22.535 0.757 6.141
80 HE ARG 10 HE ARG 10 23.736 1.175 8.099
81 HH11 ARG 10 1HH1 ARG 10 22.134 4.041 7.026
82 HH12 ARG 10 2HH1 ARG 10 22.351 4.885 8.521
83 HH21 ARG 10 1HH2 ARG 10 23.843 2.203 10.129
84 HH22 ARG 10 2HH2 ARG 10 23.263 3.825 10.296
85 H LYS 11 H LYS 11 27.183 3.367 6.760
86 HA LYS 11 HA LYS 11 29.821 2.642 6.045
87 HB2 LYS 11 1HB LYS 11 28.496 2.852 8.754
88 HB3 LYS 11 2HB LYS 11 30.225 2.608 8.523
89 HG2 LYS 11 1HG LYS 11 30.184 4.711 7.063
90 HG3 LYS 11 2HG LYS 11 28.557 4.990 7.675
91 HD2 LYS 11 1HD LYS 11 30.869 4.559 9.567
92 HD3 LYS 11 2HD LYS 11 30.538 6.144 8.883
93 HE2 LYS 11 1HE LYS 11 28.390 6.254 9.897
94 HE3 LYS 11 2HE LYS 11 28.403 4.538 10.303
95 HZ1 LYS 11 1HZ LYS 11 30.104 4.877 11.886
96 HZ2 LYS 11 2HZ LYS 11 28.925 6.064 12.179
97 HZ3 LYS 11 3HZ LYS 11 30.366 6.477 11.379
98 H LYS 12 H LYS 12 27.099 0.784 6.677
99 HA LYS 12 HA LYS 12 28.718 -1.682 6.834
100 HB2 LYS 12 1HB LYS 12 26.217 -1.128 8.459
101 HB3 LYS 12 2HB LYS 12 27.132 -2.637 8.436
102 HG2 LYS 12 1HG LYS 12 29.126 -1.407 9.278
103 HG3 LYS 12 2HG LYS 12 28.160 0.066 9.360
104 HD2 LYS 12 1HD LYS 12 26.594 -1.097 10.919
105 HD3 LYS 12 2HD LYS 12 27.660 -2.502 10.895
106 HE2 LYS 12 1HE LYS 12 29.525 -1.007 11.691
107 HE3 LYS 12 2HE LYS 12 28.338 0.284 11.877
108 HZ1 LYS 12 1HZ LYS 12 28.961 -1.519 13.775
109 HZ2 LYS 12 2HZ LYS 12 27.569 -2.213 13.091
110 HZ3 LYS 12 3HZ LYS 12 27.511 -0.635 13.718
111 H CYS 13 H CYS 13 27.155 -3.609 6.390
112 HA CYS 13 HA CYS 13 25.529 -2.867 4.016
113 HB2 CYS 13 1HB CYS 13 26.783 -5.547 4.677
114 HB3 CYS 13 2HB CYS 13 26.063 -5.056 3.162
115 H LYS 14 H LYS 14 23.468 -2.989 4.206
116 HA LYS 14 HA LYS 14 22.004 -3.750 6.344
117 HB2 LYS 14 1HB LYS 14 20.864 -2.580 4.681
118 HB3 LYS 14 2HB LYS 14 21.350 -3.698 3.413
119 HG2 LYS 14 1HG LYS 14 19.834 -5.389 4.238
120 HG3 LYS 14 2HG LYS 14 19.490 -4.445 5.689
121 HD2 LYS 14 1HD LYS 14 18.534 -2.648 4.247
122 HD3 LYS 14 2HD LYS 14 18.805 -3.672 2.835
123 HE2 LYS 14 1HE LYS 14 17.291 -5.353 3.681
124 HE3 LYS 14 2HE LYS 14 17.148 -4.518 5.227
125 HZ1 LYS 14 1HZ LYS 14 15.278 -3.811 4.128
126 HZ2 LYS 14 2HZ LYS 14 16.034 -3.781 2.608
127 HZ3 LYS 14 3HZ LYS 14 16.365 -2.564 3.745
128 H GLU 15 H GLU 15 20.479 -5.603 6.639
129 HA GLU 15 HA GLU 15 21.531 -7.969 7.108
130 HB2 GLU 15 1HB GLU 15 18.815 -7.245 6.088
131 HB3 GLU 15 2HB GLU 15 19.199 -8.957 6.236
132 HG2 GLU 15 1HG GLU 15 19.670 -7.017 8.502
133 HG3 GLU 15 2HG GLU 15 18.125 -7.837 8.279
134 H ASN 16 H ASN 16 22.887 -9.176 6.057
135 HA ASN 16 HA ASN 16 23.727 -10.643 4.511
136 HB2 ASN 16 1HB ASN 16 20.852 -10.596 3.577
137 HB3 ASN 16 2HB ASN 16 22.081 -11.663 2.902
138 HD21 ASN 16 1HD2 ASN 16 19.778 -12.698 4.281
139 HD22 ASN 16 2HD2 ASN 16 20.330 -13.465 5.691
140 H GLU 17 H GLU 17 24.317 -8.036 4.017
141 HA GLU 17 HA GLU 17 24.133 -7.845 1.062
142 HB2 GLU 17 1HB GLU 17 24.075 -5.702 3.185
143 HB3 GLU 17 2HB GLU 17 24.352 -5.360 1.482
144 HG2 GLU 17 1HG GLU 17 22.051 -7.018 1.626
145 HG3 GLU 17 2HG GLU 17 21.861 -5.877 2.920
146 H LYS 18 H LYS 18 25.905 -7.574 -0.078
147 HA LYS 18 HA LYS 18 28.424 -8.073 1.267
148 HB2 LYS 18 1HB LYS 18 28.051 -7.679 -1.692
149 HB3 LYS 18 2HB LYS 18 29.262 -8.645 -0.849
150 HG2 LYS 18 1HG LYS 18 26.288 -9.207 -1.019
151 HG3 LYS 18 2HG LYS 18 27.581 -10.139 -1.771
152 HD2 LYS 18 1HD LYS 18 28.494 -10.491 0.602
153 HD3 LYS 18 2HD LYS 18 26.945 -9.872 1.174
154 HE2 LYS 18 1HE LYS 18 25.821 -11.624 -0.263
155 HE3 LYS 18 2HE LYS 18 27.419 -12.316 -0.550
156 HZ1 LYS 18 1HZ LYS 18 27.517 -12.159 2.057
157 HZ2 LYS 18 2HZ LYS 18 26.805 -13.491 1.279
158 HZ3 LYS 18 3HZ LYS 18 25.828 -12.250 1.905
159 HA PRO 19 HA PRO 19 29.400 -3.638 1.064
160 HB2 PRO 19 1HB PRO 19 32.242 -4.358 1.375
161 HB3 PRO 19 2HB PRO 19 31.220 -3.387 2.428
162 HG2 PRO 19 1HG PRO 19 32.092 -5.922 3.005
163 HG3 PRO 19 2HG PRO 19 30.668 -5.165 3.720
164 HD2 PRO 19 1HD PRO 19 30.823 -7.298 1.655
165 HD3 PRO 19 2HD PRO 19 29.525 -6.912 2.801
166 H ILE 20 H ILE 20 29.367 -2.706 -0.949
167 HA ILE 20 HA ILE 20 31.899 -2.981 -2.413
168 HB ILE 20 HB ILE 20 31.007 -3.457 -4.425
169 HG12 ILE 20 1HG1 ILE 20 28.163 -2.754 -3.789
170 HG13 ILE 20 2HG1 ILE 20 29.244 -1.468 -4.305
171 HG21 ILE 20 1HG2 ILE 20 29.178 -5.095 -4.188
172 HG22 ILE 20 2HG2 ILE 20 28.978 -4.622 -2.508
173 HG23 ILE 20 3HG2 ILE 20 30.496 -5.360 -3.037
174 HD11 ILE 20 1HD1 ILE 20 28.116 -2.396 -6.225
175 HD12 ILE 20 2HD1 ILE 20 28.677 -4.020 -5.818
176 HD13 ILE 20 3HD1 ILE 20 29.831 -2.783 -6.315
177 H GLY 21 H GLY 21 31.669 -1.388 -4.402
178 HA2 GLY 21 1HA GLY 21 32.029 0.849 -4.963
179 HA3 GLY 21 2HA GLY 21 30.315 0.853 -4.571
180 H TYR 22 H TYR 22 31.137 3.195 -4.238
181 HA TYR 22 HA TYR 22 32.031 3.570 -1.447
182 HB2 TYR 22 1HB TYR 22 33.545 4.087 -3.728
183 HB3 TYR 22 2HB TYR 22 32.930 5.671 -3.282
184 HD1 TYR 22 HD1 TYR 22 34.951 2.787 -2.182
185 HD2 TYR 22 HD2 TYR 22 33.527 6.699 -1.138
186 HE1 TYR 22 HE1 TYR 22 36.695 2.958 -0.424
187 HE2 TYR 22 HE2 TYR 22 35.143 6.787 0.738
188 HH TYR 22 HH TYR 22 37.723 5.253 1.001
189 H CYS 23 H CYS 23 31.360 5.606 -0.497
190 HA CYS 23 HA CYS 23 29.321 7.162 -1.804
191 HB2 CYS 23 1HB CYS 23 28.571 5.093 0.227
192 HB3 CYS 23 2HB CYS 23 27.671 6.614 0.161
193 H ARG 24 H ARG 24 28.198 8.444 0.291
194 HA ARG 24 HA ARG 24 30.379 10.225 0.843
195 HB2 ARG 24 1HB ARG 24 27.428 10.270 1.492
196 HB3 ARG 24 2HB ARG 24 28.525 11.547 2.013
197 HG2 ARG 24 1HG ARG 24 29.154 11.987 -0.315
198 HG3 ARG 24 2HG ARG 24 28.104 10.679 -0.861
199 HD2 ARG 24 1HD ARG 24 27.089 13.016 0.770
200 HD3 ARG 24 2HD ARG 24 27.115 13.033 -0.992
201 HE ARG 24 HE ARG 24 25.822 10.678 -0.120
202 HH11 ARG 24 1HH1 ARG 24 24.069 11.846 1.632
203 HH12 ARG 24 2HH1 ARG 24 22.939 12.777 0.707
204 HH21 ARG 24 1HH2 ARG 24 24.903 12.814 -2.149
205 HH22 ARG 24 2HH2 ARG 24 23.404 13.310 -1.439
206 H ASN 25 H ASN 25 30.708 11.210 2.932
207 HA ASN 25 HA ASN 25 31.717 10.877 4.997
208 HB2 ASN 25 1HB ASN 25 28.769 10.376 5.239
209 HB3 ASN 25 2HB ASN 25 29.786 10.235 6.670
210 HD21 ASN 25 1HD2 ASN 25 28.209 12.157 7.203
211 HD22 ASN 25 2HD2 ASN 25 28.865 13.697 6.893
212 H GLY 26 H GLY 26 32.526 8.787 3.578
213 HA2 GLY 26 1HA GLY 26 33.665 6.836 4.036
214 HA3 GLY 26 2HA GLY 26 33.139 7.013 5.710
215 H LYS 27 H LYS 27 30.805 6.873 3.107
216 HA LYS 27 HA LYS 27 29.812 4.312 4.218
217 HB2 LYS 27 1HB LYS 27 28.286 6.063 2.316
218 HB3 LYS 27 2HB LYS 27 27.678 4.833 3.404
219 HG2 LYS 27 1HG LYS 27 29.042 6.937 4.912
220 HG3 LYS 27 2HG LYS 27 27.813 7.626 3.867
221 HD2 LYS 27 1HD LYS 27 26.097 6.283 4.842
222 HD3 LYS 27 2HD LYS 27 27.279 5.332 5.749
223 HE2 LYS 27 1HE LYS 27 27.844 7.174 7.141
224 HE3 LYS 27 2HE LYS 27 27.066 8.334 6.068
225 HZ1 LYS 27 1HZ LYS 27 25.941 7.151 8.257
226 HZ2 LYS 27 2HZ LYS 27 25.256 6.312 6.948
227 HZ3 LYS 27 3HZ LYS 27 25.117 8.003 7.040
228 H LYS 28 H LYS 28 29.235 2.651 2.689
229 HA LYS 28 HA LYS 28 30.414 2.979 -0.013
230 HB2 LYS 28 1HB LYS 28 30.496 0.437 1.623
231 HB3 LYS 28 2HB LYS 28 31.274 0.736 0.072
232 HG2 LYS 28 1HG LYS 28 32.532 2.644 1.228
233 HG3 LYS 28 2HG LYS 28 31.948 1.968 2.748
234 HD2 LYS 28 1HD LYS 28 32.968 -0.223 2.108
235 HD3 LYS 28 2HD LYS 28 33.647 0.551 0.677
236 HE2 LYS 28 1HE LYS 28 34.225 1.266 3.566
237 HE3 LYS 28 2HE LYS 28 35.350 0.559 2.405
238 HZ1 LYS 28 1HZ LYS 28 34.553 2.722 1.079
239 HZ2 LYS 28 2HZ LYS 28 35.914 2.699 2.094
240 HZ3 LYS 28 3HZ LYS 28 34.434 3.300 2.672
241 H CYS 29 H CYS 29 29.442 1.552 -1.645
242 HA CYS 29 HA CYS 29 26.609 1.066 -1.092
243 HB2 CYS 29 1HB CYS 29 28.305 0.829 -3.577
244 HB3 CYS 29 2HB CYS 29 26.690 0.142 -3.503
245 H CYS 30 H CYS 30 26.214 -0.676 0.070
246 HA CYS 30 HA CYS 30 27.702 -3.153 -0.454
247 HB2 CYS 30 1HB CYS 30 25.359 -2.659 1.406
248 HB3 CYS 30 2HB CYS 30 26.316 -4.134 1.263
249 H VAL 31 H VAL 31 27.125 -4.192 -2.254
250 HA VAL 31 HA VAL 31 24.404 -4.015 -3.275
251 HB VAL 31 HB VAL 31 26.999 -5.137 -4.192
252 HG11 VAL 31 1HG1 VAL 31 25.620 -6.181 -6.170
253 HG12 VAL 31 2HG1 VAL 31 24.339 -6.282 -4.963
254 HG13 VAL 31 3HG1 VAL 31 25.870 -7.100 -4.690
255 HG21 VAL 31 1HG2 VAL 31 26.267 -2.887 -4.881
256 HG22 VAL 31 2HG2 VAL 31 24.815 -3.567 -5.570
257 HG23 VAL 31 3HG2 VAL 31 26.385 -3.978 -6.264
258 H ASN 32 H ASN 32 22.870 -5.186 -2.574
259 HA ASN 32 HA ASN 32 22.798 -6.964 -0.572
260 HB2 ASN 32 1HB ASN 32 20.863 -6.007 -1.920
261 HB3 ASN 32 2HB ASN 32 21.091 -7.358 -3.029
262 HD21 ASN 32 1HD2 ASN 32 20.194 -6.543 0.331
263 HD22 ASN 32 2HD2 ASN 32 19.695 -8.106 0.762
Start of MODEL 8
1 H1 LYS 1 1H LYS 1 27.161 9.126 -7.916
2 H2 LYS 1 2H LYS 1 26.961 7.522 -7.396
3 H3 LYS 1 3H LYS 1 26.709 8.804 -6.311
4 HA LYS 1 HA LYS 1 24.816 9.565 -7.617
5 HB2 LYS 1 1HB LYS 1 25.369 7.043 -9.211
6 HB3 LYS 1 2HB LYS 1 23.995 8.128 -9.439
7 HG2 LYS 1 1HG LYS 1 25.538 9.972 -9.984
8 HG3 LYS 1 2HG LYS 1 26.916 8.898 -9.739
9 HD2 LYS 1 1HD LYS 1 25.930 7.398 -11.534
10 HD3 LYS 1 2HD LYS 1 24.771 8.685 -11.867
11 HE2 LYS 1 1HE LYS 1 26.807 10.233 -12.123
12 HE3 LYS 1 2HE LYS 1 27.777 8.761 -12.169
13 HZ1 LYS 1 1HZ LYS 1 26.498 7.990 -14.043
14 HZ2 LYS 1 2HZ LYS 1 27.143 9.523 -14.386
15 HZ3 LYS 1 3HZ LYS 1 25.502 9.364 -13.979
16 H LYS 2 H LYS 2 23.942 6.406 -8.261
17 HA LYS 2 HA LYS 2 23.070 5.899 -5.475
18 HB2 LYS 2 1HB LYS 2 21.593 6.058 -7.968
19 HB3 LYS 2 2HB LYS 2 21.419 4.447 -7.294
20 HG2 LYS 2 1HG LYS 2 19.642 5.730 -6.387
21 HG3 LYS 2 2HG LYS 2 20.816 5.573 -5.085
22 HD2 LYS 2 1HD LYS 2 21.776 7.822 -5.970
23 HD3 LYS 2 2HD LYS 2 20.252 7.962 -6.840
24 HE2 LYS 2 1HE LYS 2 19.198 7.427 -4.472
25 HE3 LYS 2 2HE LYS 2 20.755 8.010 -3.883
26 HZ1 LYS 2 1HZ LYS 2 19.303 9.855 -4.018
27 HZ2 LYS 2 2HZ LYS 2 18.811 9.454 -5.592
28 HZ3 LYS 2 3HZ LYS 2 20.392 10.004 -5.313
29 H CYS 3 H CYS 3 23.057 3.730 -4.770
30 HA CYS 3 HA CYS 3 25.313 2.236 -5.628
31 HB2 CYS 3 1HB CYS 3 22.946 1.438 -3.913
32 HB3 CYS 3 2HB CYS 3 24.382 0.440 -4.146
33 H TRP 4 H TRP 4 24.560 -0.348 -5.721
34 HA TRP 4 HA TRP 4 23.409 -0.458 -8.451
35 HB2 TRP 4 1HB TRP 4 25.658 -2.279 -7.718
36 HB3 TRP 4 2HB TRP 4 25.262 -1.556 -9.273
37 HD1 TRP 4 HD1 TRP 4 26.710 -0.582 -5.838
38 HE1 TRP 4 HE1 TRP 4 28.417 1.312 -6.193
39 HE3 TRP 4 HE3 TRP 4 26.088 0.236 -10.837
40 HZ2 TRP 4 HZ2 TRP 4 29.524 2.827 -8.362
41 HZ3 TRP 4 HZ3 TRP 4 27.512 1.872 -12.028
42 HH2 TRP 4 HH2 TRP 4 29.109 3.286 -10.771
43 H ASN 5 H ASN 5 22.930 -2.800 -9.046
44 HA ASN 5 HA ASN 5 21.467 -4.545 -8.622
45 HB2 ASN 5 1HB ASN 5 23.674 -4.886 -6.587
46 HB3 ASN 5 2HB ASN 5 22.428 -6.107 -6.860
47 HD21 ASN 5 1HD2 ASN 5 25.120 -4.365 -8.426
48 HD22 ASN 5 2HD2 ASN 5 25.353 -5.508 -9.659
49 H GLY 6 H GLY 6 20.752 -2.058 -7.298
50 HA2 GLY 6 1HA GLY 6 18.993 -1.415 -5.982
51 HA3 GLY 6 2HA GLY 6 18.674 -3.120 -5.665
52 H GLY 7 H GLY 7 21.819 -2.700 -4.849
53 HA2 GLY 7 1HA GLY 7 21.555 -2.880 -2.147
54 HA3 GLY 7 2HA GLY 7 22.999 -2.225 -2.925
55 H ARG 8 H ARG 8 22.804 -1.108 -0.659
56 HA ARG 8 HA ARG 8 21.768 1.599 -1.262
57 HB2 ARG 8 1HB ARG 8 21.294 1.834 1.172
58 HB3 ARG 8 2HB ARG 8 20.254 0.672 0.362
59 HG2 ARG 8 1HG ARG 8 21.185 -1.145 1.439
60 HG3 ARG 8 2HG ARG 8 22.774 -0.405 1.560
61 HD2 ARG 8 1HD ARG 8 21.864 -0.561 3.773
62 HD3 ARG 8 2HD ARG 8 21.866 1.135 3.313
63 HE ARG 8 HE ARG 8 19.368 0.284 2.608
64 HH11 ARG 8 1HH1 ARG 8 17.737 -0.419 4.192
65 HH12 ARG 8 2HH1 ARG 8 18.024 -0.040 5.858
66 HH21 ARG 8 1HH2 ARG 8 21.222 1.173 5.312
67 HH22 ARG 8 2HH2 ARG 8 19.973 0.906 6.481
68 H CYS 9 H CYS 9 22.767 3.151 0.520
69 HA CYS 9 HA CYS 9 25.670 2.584 0.686
70 HB2 CYS 9 1HB CYS 9 24.110 5.119 0.399
71 HB3 CYS 9 2HB CYS 9 25.673 5.164 1.208
72 H ARG 10 H ARG 10 26.336 1.965 2.627
73 HA ARG 10 HA ARG 10 25.689 3.571 4.952
74 HB2 ARG 10 1HB ARG 10 24.305 1.115 4.393
75 HB3 ARG 10 2HB ARG 10 25.308 0.860 5.811
76 HG2 ARG 10 1HG ARG 10 23.393 3.174 5.470
77 HG3 ARG 10 2HG ARG 10 23.017 1.690 6.338
78 HD2 ARG 10 1HD ARG 10 25.423 2.450 7.497
79 HD3 ARG 10 2HD ARG 10 24.626 3.988 7.216
80 HE ARG 10 HE ARG 10 23.547 1.746 8.822
81 HH11 ARG 10 1HH1 ARG 10 21.174 3.085 8.267
82 HH12 ARG 10 2HH1 ARG 10 21.115 4.451 9.331
83 HH21 ARG 10 1HH2 ARG 10 24.489 4.309 10.118
84 HH22 ARG 10 2HH2 ARG 10 23.002 5.167 10.352
85 H LYS 11 H LYS 11 27.201 3.261 6.663
86 HA LYS 11 HA LYS 11 29.830 2.503 5.944
87 HB2 LYS 11 1HB LYS 11 28.538 2.690 8.681
88 HB3 LYS 11 2HB LYS 11 30.273 2.565 8.387
89 HG2 LYS 11 1HG LYS 11 30.265 4.660 7.149
90 HG3 LYS 11 2HG LYS 11 28.510 4.752 7.270
91 HD2 LYS 11 1HD LYS 11 30.141 4.572 9.791
92 HD3 LYS 11 2HD LYS 11 30.027 6.112 8.954
93 HE2 LYS 11 1HE LYS 11 27.774 6.352 9.419
94 HE3 LYS 11 2HE LYS 11 27.473 4.617 9.432
95 HZ1 LYS 11 1HZ LYS 11 28.257 4.397 11.559
96 HZ2 LYS 11 2HZ LYS 11 27.490 5.910 11.637
97 HZ3 LYS 11 3HZ LYS 11 29.180 5.822 11.498
98 H LYS 12 H LYS 12 27.069 0.733 6.764
99 HA LYS 12 HA LYS 12 28.627 -1.779 6.861
100 HB2 LYS 12 1HB LYS 12 26.909 -0.697 8.870
101 HB3 LYS 12 2HB LYS 12 26.049 -2.054 8.162
102 HG2 LYS 12 1HG LYS 12 27.939 -3.531 8.604
103 HG3 LYS 12 2HG LYS 12 28.889 -2.174 9.203
104 HD2 LYS 12 1HD LYS 12 27.960 -3.364 11.107
105 HD3 LYS 12 2HD LYS 12 27.161 -1.799 10.970
106 HE2 LYS 12 1HE LYS 12 25.163 -2.742 10.198
107 HE3 LYS 12 2HE LYS 12 25.954 -4.210 9.624
108 HZ1 LYS 12 1HZ LYS 12 25.288 -5.102 11.525
109 HZ2 LYS 12 2HZ LYS 12 24.903 -3.598 12.213
110 HZ3 LYS 12 3HZ LYS 12 26.497 -4.179 12.282
111 H CYS 13 H CYS 13 27.066 -3.656 6.343
112 HA CYS 13 HA CYS 13 25.541 -2.897 3.908
113 HB2 CYS 13 1HB CYS 13 26.770 -5.578 4.625
114 HB3 CYS 13 2HB CYS 13 26.082 -5.114 3.088
115 H LYS 14 H LYS 14 23.492 -3.004 3.984
116 HA LYS 14 HA LYS 14 21.891 -3.638 6.051
117 HB2 LYS 14 1HB LYS 14 20.833 -2.606 4.254
118 HB3 LYS 14 2HB LYS 14 21.428 -3.781 3.089
119 HG2 LYS 14 1HG LYS 14 19.894 -5.465 3.934
120 HG3 LYS 14 2HG LYS 14 19.417 -4.415 5.269
121 HD2 LYS 14 1HD LYS 14 18.522 -2.781 3.620
122 HD3 LYS 14 2HD LYS 14 18.948 -3.893 2.318
123 HE2 LYS 14 1HE LYS 14 17.078 -4.545 4.619
124 HE3 LYS 14 2HE LYS 14 16.559 -4.113 2.989
125 HZ1 LYS 14 1HZ LYS 14 18.522 -6.202 3.027
126 HZ2 LYS 14 2HZ LYS 14 17.019 -6.141 2.239
127 HZ3 LYS 14 3HZ LYS 14 17.106 -6.623 3.865
128 H GLU 15 H GLU 15 20.356 -5.458 6.372
129 HA GLU 15 HA GLU 15 21.425 -7.731 7.187
130 HB2 GLU 15 1HB GLU 15 18.786 -7.453 5.736
131 HB3 GLU 15 2HB GLU 15 19.256 -8.905 6.617
132 HG2 GLU 15 1HG GLU 15 17.971 -7.608 8.149
133 HG3 GLU 15 2HG GLU 15 19.648 -7.384 8.638
134 H ASN 16 H ASN 16 22.959 -8.899 6.266
135 HA ASN 16 HA ASN 16 23.926 -10.475 4.904
136 HB2 ASN 16 1HB ASN 16 21.187 -10.713 3.643
137 HB3 ASN 16 2HB ASN 16 22.490 -11.897 3.576
138 HD21 ASN 16 1HD2 ASN 16 19.614 -11.623 4.995
139 HD22 ASN 16 2HD2 ASN 16 19.927 -12.314 6.512
140 H GLU 17 H GLU 17 24.350 -7.880 4.132
141 HA GLU 17 HA GLU 17 24.214 -8.038 1.174
142 HB2 GLU 17 1HB GLU 17 24.066 -5.676 3.054
143 HB3 GLU 17 2HB GLU 17 24.375 -5.503 1.332
144 HG2 GLU 17 1HG GLU 17 22.116 -7.182 1.531
145 HG3 GLU 17 2HG GLU 17 21.869 -6.014 2.790
146 H LYS 18 H LYS 18 25.988 -7.540 -0.028
147 HA LYS 18 HA LYS 18 28.485 -7.967 1.382
148 HB2 LYS 18 1HB LYS 18 27.437 -8.686 -1.138
149 HB3 LYS 18 2HB LYS 18 28.787 -7.624 -1.493
150 HG2 LYS 18 1HG LYS 18 29.735 -9.776 -1.392
151 HG3 LYS 18 2HG LYS 18 30.137 -9.050 0.161
152 HD2 LYS 18 1HD LYS 18 27.879 -10.163 0.954
153 HD3 LYS 18 2HD LYS 18 28.087 -11.163 -0.478
154 HE2 LYS 18 1HE LYS 18 29.818 -10.986 1.973
155 HE3 LYS 18 2HE LYS 18 29.204 -12.419 1.148
156 HZ1 LYS 18 1HZ LYS 18 30.645 -11.685 -0.779
157 HZ2 LYS 18 2HZ LYS 18 31.455 -12.294 0.584
158 HZ3 LYS 18 3HZ LYS 18 31.396 -10.620 0.309
159 HA PRO 19 HA PRO 19 29.447 -3.522 1.112
160 HB2 PRO 19 1HB PRO 19 32.278 -4.241 1.415
161 HB3 PRO 19 2HB PRO 19 31.261 -3.271 2.472
162 HG2 PRO 19 1HG PRO 19 32.151 -5.787 3.070
163 HG3 PRO 19 2HG PRO 19 30.707 -5.050 3.767
164 HD2 PRO 19 1HD PRO 19 30.921 -7.155 1.663
165 HD3 PRO 19 2HD PRO 19 29.644 -6.857 2.861
166 H ILE 20 H ILE 20 29.376 -2.649 -0.917
167 HA ILE 20 HA ILE 20 31.914 -2.923 -2.367
168 HB ILE 20 HB ILE 20 31.037 -3.430 -4.383
169 HG12 ILE 20 1HG1 ILE 20 28.179 -2.804 -3.734
170 HG13 ILE 20 2HG1 ILE 20 29.215 -1.492 -4.271
171 HG21 ILE 20 1HG2 ILE 20 29.272 -5.125 -4.124
172 HG22 ILE 20 2HG2 ILE 20 29.032 -4.625 -2.458
173 HG23 ILE 20 3HG2 ILE 20 30.581 -5.324 -2.949
174 HD11 ILE 20 1HD1 ILE 20 28.146 -2.407 -6.195
175 HD12 ILE 20 2HD1 ILE 20 28.620 -4.049 -5.759
176 HD13 ILE 20 3HD1 ILE 20 29.838 -2.876 -6.267
177 H GLY 21 H GLY 21 31.602 -1.405 -4.417
178 HA2 GLY 21 1HA GLY 21 32.105 0.812 -4.979
179 HA3 GLY 21 2HA GLY 21 30.386 0.901 -4.615
180 H TYR 22 H TYR 22 31.267 3.194 -4.264
181 HA TYR 22 HA TYR 22 32.117 3.537 -1.454
182 HB2 TYR 22 1HB TYR 22 33.648 4.068 -3.787
183 HB3 TYR 22 2HB TYR 22 33.166 5.640 -3.165
184 HD1 TYR 22 HD1 TYR 22 34.010 6.476 -1.067
185 HD2 TYR 22 HD2 TYR 22 34.821 2.437 -2.261
186 HE1 TYR 22 HE1 TYR 22 35.729 6.299 0.707
187 HE2 TYR 22 HE2 TYR 22 36.541 2.258 -0.483
188 HH TYR 22 HH TYR 22 36.926 3.596 1.841
189 H CYS 23 H CYS 23 31.564 5.574 -0.533
190 HA CYS 23 HA CYS 23 29.490 7.162 -1.788
191 HB2 CYS 23 1HB CYS 23 28.750 4.835 -0.391
192 HB3 CYS 23 2HB CYS 23 28.422 6.162 0.715
193 H ARG 24 H ARG 24 28.495 8.478 0.333
194 HA ARG 24 HA ARG 24 30.736 10.175 0.921
195 HB2 ARG 24 1HB ARG 24 27.868 10.301 1.884
196 HB3 ARG 24 2HB ARG 24 29.050 11.605 1.999
197 HG2 ARG 24 1HG ARG 24 29.251 11.576 -0.496
198 HG3 ARG 24 2HG ARG 24 27.962 10.372 -0.551
199 HD2 ARG 24 1HD ARG 24 27.814 13.246 0.348
200 HD3 ARG 24 2HD ARG 24 26.833 12.422 -0.861
201 HE ARG 24 HE ARG 24 26.653 11.616 1.977
202 HH11 ARG 24 1HH1 ARG 24 24.951 13.367 2.661
203 HH12 ARG 24 2HH1 ARG 24 23.491 13.284 1.733
204 HH21 ARG 24 1HH2 ARG 24 24.830 11.152 -0.655
205 HH22 ARG 24 2HH2 ARG 24 23.413 11.996 -0.128
206 H ASN 25 H ASN 25 31.209 11.018 3.001
207 HA ASN 25 HA ASN 25 32.172 10.578 5.079
208 HB2 ASN 25 1HB ASN 25 29.254 10.073 5.682
209 HB3 ASN 25 2HB ASN 25 30.482 10.729 6.765
210 HD21 ASN 25 1HD2 ASN 25 27.907 11.685 4.929
211 HD22 ASN 25 2HD2 ASN 25 28.364 13.303 4.659
212 H GLY 26 H GLY 26 32.689 8.296 3.780
213 HA2 GLY 26 1HA GLY 26 33.643 6.327 4.641
214 HA3 GLY 26 2HA GLY 26 32.548 6.416 6.020
215 H LYS 27 H LYS 27 30.200 6.855 4.208
216 HA LYS 27 HA LYS 27 29.509 4.105 4.272
217 HB2 LYS 27 1HB LYS 27 27.762 6.024 2.779
218 HB3 LYS 27 2HB LYS 27 27.337 4.759 3.910
219 HG2 LYS 27 1HG LYS 27 28.612 6.325 5.638
220 HG3 LYS 27 2HG LYS 27 28.300 7.560 4.430
221 HD2 LYS 27 1HD LYS 27 25.913 7.146 4.520
222 HD3 LYS 27 2HD LYS 27 26.153 5.790 5.627
223 HE2 LYS 27 1HE LYS 27 27.134 7.324 7.291
224 HE3 LYS 27 2HE LYS 27 26.883 8.680 6.192
225 HZ1 LYS 27 1HZ LYS 27 24.968 8.816 7.370
226 HZ2 LYS 27 2HZ LYS 27 24.937 7.161 7.753
227 HZ3 LYS 27 3HZ LYS 27 24.447 7.685 6.215
228 H LYS 28 H LYS 28 29.223 2.639 2.723
229 HA LYS 28 HA LYS 28 30.353 3.248 0.046
230 HB2 LYS 28 1HB LYS 28 30.551 0.670 1.617
231 HB3 LYS 28 2HB LYS 28 31.251 0.987 0.031
232 HG2 LYS 28 1HG LYS 28 32.488 2.940 1.089
233 HG3 LYS 28 2HG LYS 28 31.945 2.340 2.653
234 HD2 LYS 28 1HD LYS 28 33.002 0.108 2.002
235 HD3 LYS 28 2HD LYS 28 33.755 0.968 0.661
236 HE2 LYS 28 1HE LYS 28 34.306 1.178 3.591
237 HE3 LYS 28 2HE LYS 28 35.422 1.290 2.233
238 HZ1 LYS 28 1HZ LYS 28 35.319 3.447 2.972
239 HZ2 LYS 28 2HZ LYS 28 33.670 3.359 3.370
240 HZ3 LYS 28 3HZ LYS 28 34.147 3.462 1.743
241 H CYS 29 H CYS 29 29.422 1.793 -1.708
242 HA CYS 29 HA CYS 29 26.656 1.147 -1.158
243 HB2 CYS 29 1HB CYS 29 28.396 0.772 -3.601
244 HB3 CYS 29 2HB CYS 29 26.749 0.165 -3.516
245 H CYS 30 H CYS 30 26.295 -0.506 0.083
246 HA CYS 30 HA CYS 30 27.727 -3.036 -0.303
247 HB2 CYS 30 1HB CYS 30 25.429 -2.221 1.502
248 HB3 CYS 30 2HB CYS 30 26.088 -3.849 1.402
249 H VAL 31 H VAL 31 27.195 -4.052 -2.139
250 HA VAL 31 HA VAL 31 24.461 -3.950 -3.145
251 HB VAL 31 HB VAL 31 27.084 -4.930 -4.120
252 HG11 VAL 31 1HG1 VAL 31 25.765 -6.056 -6.069
253 HG12 VAL 31 2HG1 VAL 31 24.468 -6.193 -4.883
254 HG13 VAL 31 3HG1 VAL 31 26.022 -6.956 -4.579
255 HG21 VAL 31 1HG2 VAL 31 26.284 -2.740 -4.824
256 HG22 VAL 31 2HG2 VAL 31 24.784 -3.431 -5.382
257 HG23 VAL 31 3HG2 VAL 31 26.293 -3.845 -6.200
258 H ASN 32 H ASN 32 22.972 -5.168 -2.488
259 HA ASN 32 HA ASN 32 23.119 -7.060 -0.528
260 HB2 ASN 32 1HB ASN 32 21.086 -5.869 -1.648
261 HB3 ASN 32 2HB ASN 32 21.031 -7.291 -2.682
262 HD21 ASN 32 1HD2 ASN 32 19.477 -6.149 -0.096
263 HD22 ASN 32 2HD2 ASN 32 19.334 -7.527 0.884
Start of MODEL 9
1 H1 LYS 1 1H LYS 1 24.542 8.949 -2.653
2 H2 LYS 1 2H LYS 1 24.011 9.250 -4.238
3 H3 LYS 1 3H LYS 1 25.223 8.095 -3.953
4 HA LYS 1 HA LYS 1 23.508 6.883 -2.545
5 HB2 LYS 1 1HB LYS 1 21.747 8.735 -4.183
6 HB3 LYS 1 2HB LYS 1 21.173 7.369 -3.224
7 HG2 LYS 1 1HG LYS 1 22.056 8.398 -1.182
8 HG3 LYS 1 2HG LYS 1 22.716 9.737 -2.120
9 HD2 LYS 1 1HD LYS 1 20.407 10.288 -2.880
10 HD3 LYS 1 2HD LYS 1 19.787 9.009 -1.845
11 HE2 LYS 1 1HE LYS 1 19.673 10.566 -0.185
12 HE3 LYS 1 2HE LYS 1 21.431 10.597 -0.165
13 HZ1 LYS 1 1HZ LYS 1 21.273 12.679 -0.847
14 HZ2 LYS 1 2HZ LYS 1 19.604 12.543 -1.129
15 HZ3 LYS 1 3HZ LYS 1 20.708 12.102 -2.341
16 H LYS 2 H LYS 2 25.285 6.949 -4.920
17 HA LYS 2 HA LYS 2 23.740 5.538 -6.987
18 HB2 LYS 2 1HB LYS 2 26.643 6.407 -6.925
19 HB3 LYS 2 2HB LYS 2 25.795 5.725 -8.313
20 HG2 LYS 2 1HG LYS 2 24.216 7.630 -8.275
21 HG3 LYS 2 2HG LYS 2 25.088 8.316 -6.904
22 HD2 LYS 2 1HD LYS 2 27.145 8.421 -8.291
23 HD3 LYS 2 2HD LYS 2 26.233 7.793 -9.664
24 HE2 LYS 2 1HE LYS 2 24.635 9.780 -9.288
25 HE3 LYS 2 2HE LYS 2 25.901 10.443 -8.255
26 HZ1 LYS 2 1HZ LYS 2 27.405 9.949 -10.270
27 HZ2 LYS 2 2HZ LYS 2 26.408 11.324 -10.304
28 HZ3 LYS 2 3HZ LYS 2 25.953 9.925 -11.152
29 H CYS 3 H CYS 3 23.440 3.431 -6.485
30 HA CYS 3 HA CYS 3 25.859 1.801 -6.015
31 HB2 CYS 3 1HB CYS 3 23.225 1.460 -4.562
32 HB3 CYS 3 2HB CYS 3 24.608 0.371 -4.461
33 H TRP 4 H TRP 4 24.669 -0.634 -5.897
34 HA TRP 4 HA TRP 4 23.786 -0.940 -8.702
35 HB2 TRP 4 1HB TRP 4 25.689 -2.954 -7.655
36 HB3 TRP 4 2HB TRP 4 25.593 -2.233 -9.254
37 HD1 TRP 4 HD1 TRP 4 26.481 -0.980 -5.688
38 HE1 TRP 4 HE1 TRP 4 28.723 0.253 -5.820
39 HE3 TRP 4 HE3 TRP 4 27.501 -1.580 -10.644
40 HZ2 TRP 4 HZ2 TRP 4 30.853 0.597 -7.722
41 HZ3 TRP 4 HZ3 TRP 4 29.579 -0.654 -11.613
42 HH2 TRP 4 HH2 TRP 4 31.196 0.566 -10.188
43 H ASN 5 H ASN 5 22.922 -3.156 -9.102
44 HA ASN 5 HA ASN 5 21.254 -4.669 -8.583
45 HB2 ASN 5 1HB ASN 5 23.130 -5.235 -6.279
46 HB3 ASN 5 2HB ASN 5 21.963 -6.349 -6.993
47 HD21 ASN 5 1HD2 ASN 5 24.372 -4.133 -8.523
48 HD22 ASN 5 2HD2 ASN 5 25.140 -5.360 -9.411
49 H GLY 6 H GLY 6 20.724 -2.062 -7.491
50 HA2 GLY 6 1HA GLY 6 19.129 -1.120 -6.128
51 HA3 GLY 6 2HA GLY 6 18.599 -2.761 -5.757
52 H GLY 7 H GLY 7 21.766 -2.806 -5.015
53 HA2 GLY 7 1HA GLY 7 21.566 -2.760 -2.273
54 HA3 GLY 7 2HA GLY 7 23.068 -2.440 -3.142
55 H ARG 8 H ARG 8 22.751 -1.126 -0.779
56 HA ARG 8 HA ARG 8 21.950 1.629 -1.546
57 HB2 ARG 8 1HB ARG 8 21.363 1.978 0.831
58 HB3 ARG 8 2HB ARG 8 20.317 0.818 0.027
59 HG2 ARG 8 1HG ARG 8 21.079 -0.958 1.273
60 HG3 ARG 8 2HG ARG 8 22.720 -0.337 1.376
61 HD2 ARG 8 1HD ARG 8 21.681 -0.283 3.577
62 HD3 ARG 8 2HD ARG 8 21.959 1.360 3.013
63 HE ARG 8 HE ARG 8 19.330 0.434 2.338
64 HH11 ARG 8 1HH1 ARG 8 17.639 0.832 3.877
65 HH12 ARG 8 2HH1 ARG 8 17.943 1.950 5.164
66 HH21 ARG 8 1HH2 ARG 8 21.304 2.327 4.396
67 HH22 ARG 8 2HH2 ARG 8 20.020 2.794 5.460
68 H CYS 9 H CYS 9 22.912 3.167 0.267
69 HA CYS 9 HA CYS 9 25.778 2.505 0.579
70 HB2 CYS 9 1HB CYS 9 24.347 5.057 -0.000
71 HB3 CYS 9 2HB CYS 9 25.850 5.127 0.915
72 H ARG 10 H ARG 10 26.357 2.016 2.601
73 HA ARG 10 HA ARG 10 25.654 3.835 4.744
74 HB2 ARG 10 1HB ARG 10 24.262 1.338 4.381
75 HB3 ARG 10 2HB ARG 10 25.184 1.253 5.873
76 HG2 ARG 10 1HG ARG 10 23.347 3.544 5.156
77 HG3 ARG 10 2HG ARG 10 22.853 2.159 6.120
78 HD2 ARG 10 1HD ARG 10 23.621 3.285 7.942
79 HD3 ARG 10 2HD ARG 10 25.249 3.086 7.319
80 HE ARG 10 HE ARG 10 25.214 5.286 6.562
81 HH11 ARG 10 1HH1 ARG 10 23.808 5.844 9.106
82 HH12 ARG 10 2HH1 ARG 10 22.401 6.725 8.609
83 HH21 ARG 10 1HH2 ARG 10 22.709 5.845 5.268
84 HH22 ARG 10 2HH2 ARG 10 21.778 6.723 6.435
85 H LYS 11 H LYS 11 26.976 3.450 6.687
86 HA LYS 11 HA LYS 11 29.658 2.790 6.124
87 HB2 LYS 11 1HB LYS 11 28.184 2.918 8.768
88 HB3 LYS 11 2HB LYS 11 29.933 2.750 8.616
89 HG2 LYS 11 1HG LYS 11 29.983 4.871 7.300
90 HG3 LYS 11 2HG LYS 11 28.251 5.052 7.580
91 HD2 LYS 11 1HD LYS 11 28.653 5.057 10.022
92 HD3 LYS 11 2HD LYS 11 30.387 4.903 9.731
93 HE2 LYS 11 1HE LYS 11 28.614 7.204 8.854
94 HE3 LYS 11 2HE LYS 11 29.835 7.253 10.125
95 HZ1 LYS 11 1HZ LYS 11 30.908 8.113 8.271
96 HZ2 LYS 11 2HZ LYS 11 30.218 6.982 7.209
97 HZ3 LYS 11 3HZ LYS 11 31.426 6.496 8.301
98 H LYS 12 H LYS 12 26.938 0.888 6.738
99 HA LYS 12 HA LYS 12 28.561 -1.577 6.795
100 HB2 LYS 12 1HB LYS 12 26.682 -2.500 8.307
101 HB3 LYS 12 2HB LYS 12 27.873 -1.439 9.059
102 HG2 LYS 12 1HG LYS 12 26.384 0.455 8.913
103 HG3 LYS 12 2HG LYS 12 25.236 -0.458 7.936
104 HD2 LYS 12 1HD LYS 12 24.806 -1.973 9.816
105 HD3 LYS 12 2HD LYS 12 26.003 -1.125 10.794
106 HE2 LYS 12 1HE LYS 12 24.672 0.809 10.966
107 HE3 LYS 12 2HE LYS 12 23.680 0.366 9.577
108 HZ1 LYS 12 1HZ LYS 12 22.634 0.033 11.812
109 HZ2 LYS 12 2HZ LYS 12 23.745 -1.225 12.072
110 HZ3 LYS 12 3HZ LYS 12 22.628 -1.328 10.796
111 H CYS 13 H CYS 13 27.002 -3.479 6.335
112 HA CYS 13 HA CYS 13 25.450 -2.695 3.935
113 HB2 CYS 13 1HB CYS 13 26.677 -5.378 4.634
114 HB3 CYS 13 2HB CYS 13 25.995 -4.899 3.098
115 H LYS 14 H LYS 14 23.399 -2.890 3.907
116 HA LYS 14 HA LYS 14 21.791 -3.457 6.034
117 HB2 LYS 14 1HB LYS 14 20.807 -2.338 4.246
118 HB3 LYS 14 2HB LYS 14 21.324 -3.537 3.070
119 HG2 LYS 14 1HG LYS 14 19.697 -5.135 3.903
120 HG3 LYS 14 2HG LYS 14 19.292 -4.080 5.254
121 HD2 LYS 14 1HD LYS 14 17.555 -3.644 3.759
122 HD3 LYS 14 2HD LYS 14 18.675 -2.349 3.377
123 HE2 LYS 14 1HE LYS 14 19.607 -4.208 1.657
124 HE3 LYS 14 2HE LYS 14 17.933 -4.742 1.764
125 HZ1 LYS 14 1HZ LYS 14 19.009 -2.508 0.413
126 HZ2 LYS 14 2HZ LYS 14 17.870 -1.984 1.558
127 HZ3 LYS 14 3HZ LYS 14 17.425 -3.119 0.374
128 H GLU 15 H GLU 15 20.195 -5.224 6.312
129 HA GLU 15 HA GLU 15 21.020 -7.570 7.076
130 HB2 GLU 15 1HB GLU 15 18.581 -7.137 5.346
131 HB3 GLU 15 2HB GLU 15 18.894 -8.631 6.230
132 HG2 GLU 15 1HG GLU 15 18.979 -7.374 8.344
133 HG3 GLU 15 2HG GLU 15 18.707 -5.869 7.471
134 H ASN 16 H ASN 16 22.691 -8.656 6.245
135 HA ASN 16 HA ASN 16 23.755 -10.237 4.967
136 HB2 ASN 16 1HB ASN 16 21.128 -10.579 3.518
137 HB3 ASN 16 2HB ASN 16 22.431 -11.755 3.680
138 HD21 ASN 16 1HD2 ASN 16 20.883 -13.274 4.702
139 HD22 ASN 16 2HD2 ASN 16 20.459 -13.066 6.332
140 H GLU 17 H GLU 17 24.218 -7.682 4.158
141 HA GLU 17 HA GLU 17 24.111 -7.829 1.199
142 HB2 GLU 17 1HB GLU 17 23.972 -5.504 3.113
143 HB3 GLU 17 2HB GLU 17 24.376 -5.284 1.416
144 HG2 GLU 17 1HG GLU 17 22.070 -6.868 1.391
145 HG3 GLU 17 2HG GLU 17 21.778 -5.765 2.706
146 H LYS 18 H LYS 18 25.875 -7.516 0.014
147 HA LYS 18 HA LYS 18 28.384 -7.935 1.388
148 HB2 LYS 18 1HB LYS 18 27.282 -8.723 -1.066
149 HB3 LYS 18 2HB LYS 18 28.576 -7.633 -1.520
150 HG2 LYS 18 1HG LYS 18 29.651 -9.705 -1.414
151 HG3 LYS 18 2HG LYS 18 30.027 -8.990 0.144
152 HD2 LYS 18 1HD LYS 18 29.312 -11.086 0.832
153 HD3 LYS 18 2HD LYS 18 27.784 -10.217 0.889
154 HE2 LYS 18 1HE LYS 18 27.500 -12.360 -0.265
155 HE3 LYS 18 2HE LYS 18 27.263 -11.034 -1.404
156 HZ1 LYS 18 1HZ LYS 18 29.026 -13.123 -1.655
157 HZ2 LYS 18 2HZ LYS 18 29.999 -11.791 -1.249
158 HZ3 LYS 18 3HZ LYS 18 28.978 -11.716 -2.605
159 HA PRO 19 HA PRO 19 29.390 -3.523 1.124
160 HB2 PRO 19 1HB PRO 19 32.206 -4.390 1.428
161 HB3 PRO 19 2HB PRO 19 31.268 -3.277 2.419
162 HG2 PRO 19 1HG PRO 19 31.955 -5.828 3.159
163 HG3 PRO 19 2HG PRO 19 30.604 -4.919 3.833
164 HD2 PRO 19 1HD PRO 19 30.551 -7.226 1.992
165 HD3 PRO 19 2HD PRO 19 29.259 -6.570 3.011
166 H ILE 20 H ILE 20 29.445 -2.541 -0.817
167 HA ILE 20 HA ILE 20 31.776 -3.078 -2.481
168 HB ILE 20 HB ILE 20 29.577 -4.395 -3.083
169 HG12 ILE 20 1HG1 ILE 20 30.990 -3.035 -5.344
170 HG13 ILE 20 2HG1 ILE 20 31.824 -4.214 -4.343
171 HG21 ILE 20 1HG2 ILE 20 27.874 -2.892 -3.534
172 HG22 ILE 20 2HG2 ILE 20 28.539 -3.097 -5.132
173 HG23 ILE 20 3HG2 ILE 20 28.951 -1.673 -4.219
174 HD11 ILE 20 1HD1 ILE 20 29.269 -4.696 -5.902
175 HD12 ILE 20 2HD1 ILE 20 30.049 -5.878 -4.854
176 HD13 ILE 20 3HD1 ILE 20 30.866 -5.322 -6.315
177 H GLY 21 H GLY 21 31.620 -1.566 -4.530
178 HA2 GLY 21 1HA GLY 21 32.111 0.598 -5.135
179 HA3 GLY 21 2HA GLY 21 30.406 0.807 -4.810
180 H TYR 22 H TYR 22 31.288 3.039 -4.426
181 HA TYR 22 HA TYR 22 32.118 3.388 -1.615
182 HB2 TYR 22 1HB TYR 22 33.857 3.614 -3.732
183 HB3 TYR 22 2HB TYR 22 33.319 5.279 -3.561
184 HD1 TYR 22 HD1 TYR 22 35.020 2.459 -1.909
185 HD2 TYR 22 HD2 TYR 22 33.855 6.579 -1.567
186 HE1 TYR 22 HE1 TYR 22 36.521 2.719 0.047
187 HE2 TYR 22 HE2 TYR 22 35.386 6.850 0.366
188 HH TYR 22 HH TYR 22 36.325 4.990 2.223
189 H CYS 23 H CYS 23 31.649 5.493 -0.756
190 HA CYS 23 HA CYS 23 29.632 7.089 -2.118
191 HB2 CYS 23 1HB CYS 23 28.894 4.898 -0.436
192 HB3 CYS 23 2HB CYS 23 28.479 6.387 0.403
193 H ARG 24 H ARG 24 28.668 8.546 -0.099
194 HA ARG 24 HA ARG 24 30.942 10.204 0.508
195 HB2 ARG 24 1HB ARG 24 27.966 10.390 0.891
196 HB3 ARG 24 2HB ARG 24 29.019 11.535 1.715
197 HG2 ARG 24 1HG ARG 24 28.224 12.406 -0.450
198 HG3 ARG 24 2HG ARG 24 29.976 12.248 -0.405
199 HD2 ARG 24 1HD ARG 24 28.382 9.941 -1.463
200 HD3 ARG 24 2HD ARG 24 28.578 11.358 -2.484
201 HE ARG 24 HE ARG 24 30.707 9.554 -1.584
202 HH11 ARG 24 1HH1 ARG 24 31.926 12.197 -1.417
203 HH12 ARG 24 2HH1 ARG 24 32.413 12.562 -3.039
204 HH21 ARG 24 1HH2 ARG 24 30.380 10.151 -4.475
205 HH22 ARG 24 2HH2 ARG 24 31.540 11.402 -4.769
206 H ASN 25 H ASN 25 31.334 11.098 2.584
207 HA ASN 25 HA ASN 25 32.200 10.681 4.699
208 HB2 ASN 25 1HB ASN 25 29.333 10.226 5.457
209 HB3 ASN 25 2HB ASN 25 30.557 11.224 6.241
210 HD21 ASN 25 1HD2 ASN 25 27.771 11.475 4.497
211 HD22 ASN 25 2HD2 ASN 25 28.033 12.992 3.770
212 H GLY 26 H GLY 26 32.672 8.348 3.477
213 HA2 GLY 26 1HA GLY 26 33.597 6.421 4.457
214 HA3 GLY 26 2HA GLY 26 32.498 6.606 5.824
215 H LYS 27 H LYS 27 30.175 6.984 3.965
216 HA LYS 27 HA LYS 27 29.409 4.260 4.106
217 HB2 LYS 27 1HB LYS 27 27.803 6.207 2.486
218 HB3 LYS 27 2HB LYS 27 27.269 4.978 3.616
219 HG2 LYS 27 1HG LYS 27 28.507 6.487 5.395
220 HG3 LYS 27 2HG LYS 27 28.381 7.725 4.154
221 HD2 LYS 27 1HD LYS 27 25.972 7.525 4.092
222 HD3 LYS 27 2HD LYS 27 26.015 6.142 5.191
223 HE2 LYS 27 1HE LYS 27 27.056 7.599 6.924
224 HE3 LYS 27 2HE LYS 27 26.890 8.973 5.832
225 HZ1 LYS 27 1HZ LYS 27 24.423 7.677 5.954
226 HZ2 LYS 27 2HZ LYS 27 24.821 9.223 6.534
227 HZ3 LYS 27 3HZ LYS 27 24.965 7.870 7.551
228 H LYS 28 H LYS 28 29.205 2.719 2.605
229 HA LYS 28 HA LYS 28 30.369 3.252 -0.076
230 HB2 LYS 28 1HB LYS 28 30.543 0.539 1.151
231 HB3 LYS 28 2HB LYS 28 31.655 1.357 0.059
232 HG2 LYS 28 1HG LYS 28 32.058 2.986 2.059
233 HG3 LYS 28 2HG LYS 28 31.317 1.721 3.033
234 HD2 LYS 28 1HD LYS 28 33.004 0.114 2.191
235 HD3 LYS 28 2HD LYS 28 33.748 1.404 1.255
236 HE2 LYS 28 1HE LYS 28 33.632 2.510 3.808
237 HE3 LYS 28 2HE LYS 28 34.019 0.822 4.118
238 HZ1 LYS 28 1HZ LYS 28 35.622 1.330 2.061
239 HZ2 LYS 28 2HZ LYS 28 36.085 1.529 3.682
240 HZ3 LYS 28 3HZ LYS 28 35.568 2.869 2.778
241 H CYS 29 H CYS 29 29.572 1.589 -1.723
242 HA CYS 29 HA CYS 29 26.696 1.206 -1.351
243 HB2 CYS 29 1HB CYS 29 28.573 0.722 -3.662
244 HB3 CYS 29 2HB CYS 29 26.904 0.170 -3.693
245 H CYS 30 H CYS 30 26.092 -0.613 -0.207
246 HA CYS 30 HA CYS 30 27.783 -3.029 -0.480
247 HB2 CYS 30 1HB CYS 30 25.340 -2.501 1.241
248 HB3 CYS 30 2HB CYS 30 26.273 -3.995 1.183
249 H VAL 31 H VAL 31 27.390 -4.259 -2.142
250 HA VAL 31 HA VAL 31 24.796 -4.216 -3.456
251 HB VAL 31 HB VAL 31 27.527 -5.145 -4.082
252 HG11 VAL 31 1HG1 VAL 31 26.667 -6.752 -5.854
253 HG12 VAL 31 2HG1 VAL 31 25.132 -6.760 -4.985
254 HG13 VAL 31 3HG1 VAL 31 26.596 -7.351 -4.199
255 HG21 VAL 31 1HG2 VAL 31 26.209 -3.219 -5.117
256 HG22 VAL 31 2HG2 VAL 31 25.251 -4.443 -5.935
257 HG23 VAL 31 3HG2 VAL 31 26.976 -4.329 -6.262
258 H ASN 32 H ASN 32 23.202 -5.374 -2.855
259 HA ASN 32 HA ASN 32 23.148 -7.008 -0.679
260 HB2 ASN 32 1HB ASN 32 21.263 -5.999 -2.256
261 HB3 ASN 32 2HB ASN 32 21.245 -7.629 -2.913
262 HD21 ASN 32 1HD2 ASN 32 21.906 -8.945 -0.356
263 HD22 ASN 32 2HD2 ASN 32 20.657 -8.649 0.753
Start of MODEL 10
1 H1 LYS 1 1H LYS 1 24.042 9.110 -7.133
2 H2 LYS 1 2H LYS 1 25.450 10.032 -7.365
3 H3 LYS 1 3H LYS 1 24.929 9.659 -5.792
4 HA LYS 1 HA LYS 1 26.094 7.839 -7.814
5 HB2 LYS 1 1HB LYS 1 26.777 8.475 -4.927
6 HB3 LYS 1 2HB LYS 1 27.659 7.357 -5.967
7 HG2 LYS 1 1HG LYS 1 28.192 9.193 -7.513
8 HG3 LYS 1 2HG LYS 1 27.275 10.318 -6.511
9 HD2 LYS 1 1HD LYS 1 28.809 9.772 -4.600
10 HD3 LYS 1 2HD LYS 1 29.774 8.796 -5.709
11 HE2 LYS 1 1HE LYS 1 30.845 10.922 -5.672
12 HE3 LYS 1 2HE LYS 1 29.920 10.908 -7.174
13 HZ1 LYS 1 1HZ LYS 1 28.797 11.982 -4.658
14 HZ2 LYS 1 2HZ LYS 1 28.266 12.246 -6.249
15 HZ3 LYS 1 3HZ LYS 1 29.715 12.948 -5.710
16 H LYS 2 H LYS 2 23.720 7.018 -7.793
17 HA LYS 2 HA LYS 2 22.713 5.689 -5.481
18 HB2 LYS 2 1HB LYS 2 22.109 5.107 -8.394
19 HB3 LYS 2 2HB LYS 2 21.113 4.670 -7.010
20 HG2 LYS 2 1HG LYS 2 21.814 7.547 -7.611
21 HG3 LYS 2 2HG LYS 2 20.428 6.754 -8.352
22 HD2 LYS 2 1HD LYS 2 19.595 6.180 -6.064
23 HD3 LYS 2 2HD LYS 2 20.913 7.124 -5.383
24 HE2 LYS 2 1HE LYS 2 19.823 9.087 -5.780
25 HE3 LYS 2 2HE LYS 2 19.376 8.612 -7.414
26 HZ1 LYS 2 1HZ LYS 2 17.432 8.856 -6.050
27 HZ2 LYS 2 2HZ LYS 2 18.031 7.737 -4.921
28 HZ3 LYS 2 3HZ LYS 2 17.622 7.228 -6.489
29 H CYS 3 H CYS 3 22.926 3.584 -4.813
30 HA CYS 3 HA CYS 3 25.286 2.176 -5.629
31 HB2 CYS 3 1HB CYS 3 22.962 1.269 -3.913
32 HB3 CYS 3 2HB CYS 3 24.499 0.420 -4.091
33 H TRP 4 H TRP 4 24.574 -0.441 -5.682
34 HA TRP 4 HA TRP 4 23.263 -0.643 -8.333
35 HB2 TRP 4 1HB TRP 4 25.603 -2.382 -7.690
36 HB3 TRP 4 2HB TRP 4 25.088 -1.735 -9.245
37 HD1 TRP 4 HD1 TRP 4 26.802 -0.685 -5.979
38 HE1 TRP 4 HE1 TRP 4 28.412 1.259 -6.481
39 HE3 TRP 4 HE3 TRP 4 25.591 0.233 -10.853
40 HZ2 TRP 4 HZ2 TRP 4 29.278 2.788 -8.747
41 HZ3 TRP 4 HZ3 TRP 4 26.874 1.890 -12.172
42 HH2 TRP 4 HH2 TRP 4 28.548 3.336 -11.061
43 H ASN 5 H ASN 5 22.837 -3.054 -8.823
44 HA ASN 5 HA ASN 5 21.484 -4.831 -8.251
45 HB2 ASN 5 1HB ASN 5 23.519 -5.057 -6.016
46 HB3 ASN 5 2HB ASN 5 22.472 -6.341 -6.617
47 HD21 ASN 5 1HD2 ASN 5 24.277 -3.923 -8.578
48 HD22 ASN 5 2HD2 ASN 5 25.083 -5.099 -9.498
49 H GLY 6 H GLY 6 20.358 -2.478 -7.315
50 HA2 GLY 6 1HA GLY 6 18.859 -1.649 -5.775
51 HA3 GLY 6 2HA GLY 6 18.519 -3.345 -5.428
52 H GLY 7 H GLY 7 21.719 -2.207 -5.010
53 HA2 GLY 7 1HA GLY 7 21.807 -2.913 -2.225
54 HA3 GLY 7 2HA GLY 7 23.103 -2.172 -3.164
55 H ARG 8 H ARG 8 23.111 -1.081 -0.863
56 HA ARG 8 HA ARG 8 21.873 1.567 -1.229
57 HB2 ARG 8 1HB ARG 8 21.181 1.546 1.151
58 HB3 ARG 8 2HB ARG 8 20.331 0.367 0.172
59 HG2 ARG 8 1HG ARG 8 20.900 -1.128 1.792
60 HG3 ARG 8 2HG ARG 8 22.483 -1.128 1.040
61 HD2 ARG 8 1HD ARG 8 23.016 -0.682 3.256
62 HD3 ARG 8 2HD ARG 8 22.915 0.943 2.598
63 HE ARG 8 HE ARG 8 21.498 0.248 4.752
64 HH11 ARG 8 1HH1 ARG 8 20.586 2.735 3.514
65 HH12 ARG 8 2HH1 ARG 8 18.929 2.390 3.144
66 HH21 ARG 8 1HH2 ARG 8 19.337 -1.050 3.273
67 HH22 ARG 8 2HH2 ARG 8 18.233 0.248 2.967
68 H CYS 9 H CYS 9 22.783 3.110 0.528
69 HA CYS 9 HA CYS 9 25.687 2.578 0.789
70 HB2 CYS 9 1HB CYS 9 24.123 5.051 0.243
71 HB3 CYS 9 2HB CYS 9 25.587 5.213 1.207
72 H ARG 10 H ARG 10 26.339 2.081 2.745
73 HA ARG 10 HA ARG 10 25.725 3.802 4.972
74 HB2 ARG 10 1HB ARG 10 24.775 0.945 4.926
75 HB3 ARG 10 2HB ARG 10 25.152 1.765 6.435
76 HG2 ARG 10 1HG ARG 10 23.529 3.635 5.429
77 HG3 ARG 10 2HG ARG 10 22.914 2.275 4.498
78 HD2 ARG 10 1HD ARG 10 21.598 2.359 6.479
79 HD3 ARG 10 2HD ARG 10 22.735 1.034 6.730
80 HE ARG 10 HE ARG 10 23.602 3.636 7.715
81 HH11 ARG 10 1HH1 ARG 10 24.965 2.297 9.440
82 HH12 ARG 10 2HH1 ARG 10 23.946 1.668 10.692
83 HH21 ARG 10 1HH2 ARG 10 21.008 2.247 8.947
84 HH22 ARG 10 2HH2 ARG 10 21.702 1.625 10.406
85 H LYS 11 H LYS 11 27.080 3.288 6.853
86 HA LYS 11 HA LYS 11 29.742 2.651 6.159
87 HB2 LYS 11 1HB LYS 11 28.477 2.544 8.913
88 HB3 LYS 11 2HB LYS 11 30.192 2.726 8.548
89 HG2 LYS 11 1HG LYS 11 29.655 4.857 7.342
90 HG3 LYS 11 2HG LYS 11 27.983 4.691 7.878
91 HD2 LYS 11 1HD LYS 11 28.733 4.717 10.233
92 HD3 LYS 11 2HD LYS 11 30.405 4.886 9.696
93 HE2 LYS 11 1HE LYS 11 28.144 6.853 9.218
94 HE3 LYS 11 2HE LYS 11 29.543 7.091 10.268
95 HZ1 LYS 11 1HZ LYS 11 30.024 8.176 8.250
96 HZ2 LYS 11 2HZ LYS 11 29.508 6.856 7.316
97 HZ3 LYS 11 3HZ LYS 11 30.934 6.742 8.231
98 H LYS 12 H LYS 12 27.033 0.737 6.820
99 HA LYS 12 HA LYS 12 28.661 -1.728 6.803
100 HB2 LYS 12 1HB LYS 12 27.648 -1.051 9.107
101 HB3 LYS 12 2HB LYS 12 26.106 -1.496 8.390
102 HG2 LYS 12 1HG LYS 12 26.888 -3.755 7.971
103 HG3 LYS 12 2HG LYS 12 28.521 -3.330 8.488
104 HD2 LYS 12 1HD LYS 12 27.612 -2.772 10.747
105 HD3 LYS 12 2HD LYS 12 26.030 -3.337 10.214
106 HE2 LYS 12 1HE LYS 12 26.814 -5.575 9.937
107 HE3 LYS 12 2HE LYS 12 28.501 -5.075 10.067
108 HZ1 LYS 12 1HZ LYS 12 27.861 -6.011 12.135
109 HZ2 LYS 12 2HZ LYS 12 26.451 -5.066 12.211
110 HZ3 LYS 12 3HZ LYS 12 27.975 -4.332 12.365
111 H CYS 13 H CYS 13 27.168 -3.626 6.200
112 HA CYS 13 HA CYS 13 25.532 -2.744 3.912
113 HB2 CYS 13 1HB CYS 13 26.747 -5.460 4.492
114 HB3 CYS 13 2HB CYS 13 26.028 -4.933 2.988
115 H LYS 14 H LYS 14 23.479 -2.917 3.878
116 HA LYS 14 HA LYS 14 21.838 -3.508 5.950
117 HB2 LYS 14 1HB LYS 14 20.834 -2.450 4.140
118 HB3 LYS 14 2HB LYS 14 21.442 -3.621 2.978
119 HG2 LYS 14 1HG LYS 14 19.860 -5.299 3.784
120 HG3 LYS 14 2HG LYS 14 19.327 -4.212 5.070
121 HD2 LYS 14 1HD LYS 14 18.418 -2.661 3.452
122 HD3 LYS 14 2HD LYS 14 19.142 -3.555 2.116
123 HE2 LYS 14 1HE LYS 14 16.798 -4.155 2.234
124 HE3 LYS 14 2HE LYS 14 17.740 -5.538 2.782
125 HZ1 LYS 14 1HZ LYS 14 16.079 -5.314 4.365
126 HZ2 LYS 14 2HZ LYS 14 16.178 -3.620 4.392
127 HZ3 LYS 14 3HZ LYS 14 17.411 -4.553 5.093
128 H GLU 15 H GLU 15 20.238 -5.307 6.171
129 HA GLU 15 HA GLU 15 21.239 -7.638 7.000
130 HB2 GLU 15 1HB GLU 15 18.647 -6.867 5.769
131 HB3 GLU 15 2HB GLU 15 18.933 -8.596 5.912
132 HG2 GLU 15 1HG GLU 15 17.783 -7.799 7.899
133 HG3 GLU 15 2HG GLU 15 19.416 -8.301 8.324
134 H ASN 16 H ASN 16 22.756 -8.821 6.115
135 HA ASN 16 HA ASN 16 23.749 -10.368 4.744
136 HB2 ASN 16 1HB ASN 16 21.051 -10.574 3.397
137 HB3 ASN 16 2HB ASN 16 22.332 -11.784 3.414
138 HD21 ASN 16 1HD2 ASN 16 22.666 -10.751 6.428
139 HD22 ASN 16 2HD2 ASN 16 21.577 -11.778 7.226
140 H GLU 17 H GLU 17 24.226 -7.769 4.000
141 HA GLU 17 HA GLU 17 24.171 -7.902 1.041
142 HB2 GLU 17 1HB GLU 17 24.046 -5.603 2.991
143 HB3 GLU 17 2HB GLU 17 24.388 -5.372 1.280
144 HG2 GLU 17 1HG GLU 17 22.091 -7.010 1.386
145 HG3 GLU 17 2HG GLU 17 21.844 -5.867 2.670
146 H LYS 18 H LYS 18 25.949 -7.667 -0.109
147 HA LYS 18 HA LYS 18 28.467 -8.025 1.245
148 HB2 LYS 18 1HB LYS 18 27.393 -8.290 -1.484
149 HB3 LYS 18 2HB LYS 18 29.067 -7.759 -1.439
150 HG2 LYS 18 1HG LYS 18 28.951 -10.184 -1.560
151 HG3 LYS 18 2HG LYS 18 29.644 -9.689 -0.020
152 HD2 LYS 18 1HD LYS 18 27.764 -10.322 1.197
153 HD3 LYS 18 2HD LYS 18 26.678 -10.137 -0.176
154 HE2 LYS 18 1HE LYS 18 27.665 -12.139 -1.227
155 HE3 LYS 18 2HE LYS 18 28.736 -12.336 0.160
156 HZ1 LYS 18 1HZ LYS 18 27.075 -13.629 0.895
157 HZ2 LYS 18 2HZ LYS 18 25.902 -12.893 -0.088
158 HZ3 LYS 18 3HZ LYS 18 26.372 -12.159 1.369
159 HA PRO 19 HA PRO 19 29.340 -3.576 0.987
160 HB2 PRO 19 1HB PRO 19 32.146 -4.186 1.573
161 HB3 PRO 19 2HB PRO 19 30.993 -3.266 2.529
162 HG2 PRO 19 1HG PRO 19 31.948 -5.807 3.125
163 HG3 PRO 19 2HG PRO 19 30.539 -5.037 3.847
164 HD2 PRO 19 1HD PRO 19 30.644 -7.243 1.901
165 HD3 PRO 19 2HD PRO 19 29.295 -6.698 2.912
166 H ILE 20 H ILE 20 29.474 -2.692 -0.959
167 HA ILE 20 HA ILE 20 32.015 -3.071 -2.371
168 HB ILE 20 HB ILE 20 31.187 -3.574 -4.410
169 HG12 ILE 20 1HG1 ILE 20 28.324 -2.862 -3.878
170 HG13 ILE 20 2HG1 ILE 20 29.418 -1.570 -4.338
171 HG21 ILE 20 1HG2 ILE 20 28.889 -4.661 -2.796
172 HG22 ILE 20 2HG2 ILE 20 30.523 -5.357 -2.737
173 HG23 ILE 20 3HG2 ILE 20 29.618 -5.346 -4.243
174 HD11 ILE 20 1HD1 ILE 20 28.399 -2.448 -6.322
175 HD12 ILE 20 2HD1 ILE 20 28.901 -4.092 -5.910
176 HD13 ILE 20 3HD1 ILE 20 30.105 -2.874 -6.330
177 H GLY 21 H GLY 21 31.910 -1.458 -4.352
178 HA2 GLY 21 1HA GLY 21 32.125 0.773 -4.964
179 HA3 GLY 21 2HA GLY 21 30.412 0.722 -4.558
180 H TYR 22 H TYR 22 31.405 3.116 -4.284
181 HA TYR 22 HA TYR 22 32.141 3.469 -1.438
182 HB2 TYR 22 1HB TYR 22 33.857 3.800 -3.566
183 HB3 TYR 22 2HB TYR 22 33.256 5.439 -3.353
184 HD1 TYR 22 HD1 TYR 22 33.783 6.723 -1.358
185 HD2 TYR 22 HD2 TYR 22 35.097 2.657 -1.798
186 HE1 TYR 22 HE1 TYR 22 35.309 7.006 0.576
187 HE2 TYR 22 HE2 TYR 22 36.619 2.937 0.140
188 HH TYR 22 HH TYR 22 36.482 4.761 2.334
189 H CYS 23 H CYS 23 31.708 5.640 -0.618
190 HA CYS 23 HA CYS 23 29.563 7.134 -1.863
191 HB2 CYS 23 1HB CYS 23 28.899 4.844 -0.378
192 HB3 CYS 23 2HB CYS 23 28.586 6.198 0.702
193 H ARG 24 H ARG 24 28.586 8.506 0.238
194 HA ARG 24 HA ARG 24 30.818 10.218 0.839
195 HB2 ARG 24 1HB ARG 24 27.857 10.303 1.408
196 HB3 ARG 24 2HB ARG 24 28.945 11.474 2.135
197 HG2 ARG 24 1HG ARG 24 28.123 12.487 0.153
198 HG3 ARG 24 2HG ARG 24 29.785 12.024 -0.182
199 HD2 ARG 24 1HD ARG 24 29.129 10.209 -1.532
200 HD3 ARG 24 2HD ARG 24 27.498 10.182 -0.874
201 HE ARG 24 HE ARG 24 28.540 12.307 -2.670
202 HH11 ARG 24 1HH1 ARG 24 26.659 13.714 -3.082
203 HH12 ARG 24 2HH1 ARG 24 25.168 12.905 -3.431
204 HH21 ARG 24 1HH2 ARG 24 26.335 9.783 -2.490
205 HH22 ARG 24 2HH2 ARG 24 24.960 10.694 -3.020
206 H ASN 25 H ASN 25 31.240 11.061 2.933
207 HA ASN 25 HA ASN 25 32.178 10.613 5.011
208 HB2 ASN 25 1HB ASN 25 29.369 10.024 5.871
209 HB3 ASN 25 2HB ASN 25 30.575 11.081 6.604
210 HD21 ASN 25 1HD2 ASN 25 31.169 12.386 3.932
211 HD22 ASN 25 2HD2 ASN 25 29.826 13.385 3.625
212 H GLY 26 H GLY 26 32.735 8.337 3.748
213 HA2 GLY 26 1HA GLY 26 33.674 6.374 4.626
214 HA3 GLY 26 2HA GLY 26 32.595 6.501 6.015
215 H LYS 27 H LYS 27 30.243 6.917 4.212
216 HA LYS 27 HA LYS 27 29.487 4.202 4.305
217 HB2 LYS 27 1HB LYS 27 27.869 6.189 2.734
218 HB3 LYS 27 2HB LYS 27 27.337 4.919 3.817
219 HG2 LYS 27 1HG LYS 27 28.551 6.346 5.659
220 HG3 LYS 27 2HG LYS 27 28.483 7.633 4.462
221 HD2 LYS 27 1HD LYS 27 26.078 7.513 4.341
222 HD3 LYS 27 2HD LYS 27 26.048 6.075 5.369
223 HE2 LYS 27 1HE LYS 27 27.086 7.403 7.200
224 HE3 LYS 27 2HE LYS 27 26.996 8.838 6.179
225 HZ1 LYS 27 1HZ LYS 27 24.808 9.041 6.522
226 HZ2 LYS 27 2HZ LYS 27 25.059 8.034 7.865
227 HZ3 LYS 27 3HZ LYS 27 24.520 7.371 6.398
228 H LYS 28 H LYS 28 29.100 2.710 2.737
229 HA LYS 28 HA LYS 28 30.409 3.207 0.114
230 HB2 LYS 28 1HB LYS 28 30.296 0.520 1.465
231 HB3 LYS 28 2HB LYS 28 31.415 1.100 0.235
232 HG2 LYS 28 1HG LYS 28 32.329 2.730 1.904
233 HG3 LYS 28 2HG LYS 28 31.290 2.000 3.128
234 HD2 LYS 28 1HD LYS 28 32.386 -0.232 2.474
235 HD3 LYS 28 2HD LYS 28 33.597 0.741 1.643
236 HE2 LYS 28 1HE LYS 28 32.877 1.052 4.574
237 HE3 LYS 28 2HE LYS 28 34.272 0.156 3.977
238 HZ1 LYS 28 1HZ LYS 28 34.874 2.288 2.780
239 HZ2 LYS 28 2HZ LYS 28 35.080 2.270 4.465
240 HZ3 LYS 28 3HZ LYS 28 33.737 3.054 3.782
241 H CYS 29 H CYS 29 29.464 1.825 -1.666
242 HA CYS 29 HA CYS 29 26.628 1.263 -1.211
243 HB2 CYS 29 1HB CYS 29 28.412 1.191 -3.630
244 HB3 CYS 29 2HB CYS 29 26.829 0.426 -3.661
245 H CYS 30 H CYS 30 26.281 -0.483 -0.057
246 HA CYS 30 HA CYS 30 27.748 -2.967 -0.557
247 HB2 CYS 30 1HB CYS 30 25.358 -2.381 1.213
248 HB3 CYS 30 2HB CYS 30 26.220 -3.913 1.108
249 H VAL 31 H VAL 31 27.281 -4.029 -2.328
250 HA VAL 31 HA VAL 31 24.607 -3.994 -3.481
251 HB VAL 31 HB VAL 31 27.306 -4.949 -4.267
252 HG11 VAL 31 1HG1 VAL 31 26.055 -6.193 -6.249
253 HG12 VAL 31 2HG1 VAL 31 24.852 -6.487 -5.000
254 HG13 VAL 31 3HG1 VAL 31 26.502 -7.030 -4.772
255 HG21 VAL 31 1HG2 VAL 31 26.460 -2.832 -5.090
256 HG22 VAL 31 2HG2 VAL 31 25.055 -3.611 -5.764
257 HG23 VAL 31 3HG2 VAL 31 26.646 -3.982 -6.420
258 H ASN 32 H ASN 32 23.095 -5.209 -2.806
259 HA ASN 32 HA ASN 32 23.064 -6.905 -0.712
260 HB2 ASN 32 1HB ASN 32 21.085 -6.066 -2.032
261 HB3 ASN 32 2HB ASN 32 21.383 -7.371 -3.179
262 HD21 ASN 32 1HD2 ASN 32 20.189 -6.651 0.075
263 HD22 ASN 32 2HD2 ASN 32 19.928 -8.259 0.548
Start of MODEL 11
1 H1 LYS 1 1H LYS 1 25.137 10.320 -7.944
2 H2 LYS 1 2H LYS 1 24.205 9.162 -8.763
3 H3 LYS 1 3H LYS 1 25.672 9.697 -9.430
4 HA LYS 1 HA LYS 1 26.305 7.698 -8.556
5 HB2 LYS 1 1HB LYS 1 26.785 10.040 -6.796
6 HB3 LYS 1 2HB LYS 1 27.102 8.483 -6.040
7 HG2 LYS 1 1HG LYS 1 28.654 7.878 -7.799
8 HG3 LYS 1 2HG LYS 1 28.255 9.338 -8.704
9 HD2 LYS 1 1HD LYS 1 29.260 10.747 -7.065
10 HD3 LYS 1 2HD LYS 1 29.348 9.438 -5.886
11 HE2 LYS 1 1HE LYS 1 31.555 9.904 -6.943
12 HE3 LYS 1 2HE LYS 1 30.993 8.265 -7.269
13 HZ1 LYS 1 1HZ LYS 1 29.927 9.687 -9.303
14 HZ2 LYS 1 2HZ LYS 1 31.360 8.780 -9.390
15 HZ3 LYS 1 3HZ LYS 1 31.429 10.450 -9.086
16 H LYS 2 H LYS 2 24.930 6.094 -8.238
17 HA LYS 2 HA LYS 2 23.610 5.893 -5.602
18 HB2 LYS 2 1HB LYS 2 22.373 5.299 -8.298
19 HB3 LYS 2 2HB LYS 2 21.713 4.717 -6.768
20 HG2 LYS 2 1HG LYS 2 21.625 7.097 -5.973
21 HG3 LYS 2 2HG LYS 2 22.129 7.609 -7.581
22 HD2 LYS 2 1HD LYS 2 19.710 7.757 -7.446
23 HD3 LYS 2 2HD LYS 2 20.137 6.440 -8.533
24 HE2 LYS 2 1HE LYS 2 19.403 4.807 -7.051
25 HE3 LYS 2 2HE LYS 2 19.722 5.797 -5.628
26 HZ1 LYS 2 1HZ LYS 2 17.860 7.250 -6.857
27 HZ2 LYS 2 2HZ LYS 2 17.521 6.083 -5.671
28 HZ3 LYS 2 3HZ LYS 2 17.377 5.687 -7.317
29 H CYS 3 H CYS 3 23.184 3.680 -4.957
30 HA CYS 3 HA CYS 3 25.409 1.977 -5.585
31 HB2 CYS 3 1HB CYS 3 22.897 1.391 -3.994
32 HB3 CYS 3 2HB CYS 3 24.336 0.372 -4.056
33 H TRP 4 H TRP 4 24.371 -0.527 -5.581
34 HA TRP 4 HA TRP 4 23.359 -0.678 -8.360
35 HB2 TRP 4 1HB TRP 4 25.415 -2.647 -7.533
36 HB3 TRP 4 2HB TRP 4 25.218 -1.816 -9.070
37 HD1 TRP 4 HD1 TRP 4 26.159 -0.790 -5.450
38 HE1 TRP 4 HE1 TRP 4 28.351 0.528 -5.543
39 HE3 TRP 4 HE3 TRP 4 26.947 -0.774 -10.489
40 HZ2 TRP 4 HZ2 TRP 4 30.358 1.172 -7.501
41 HZ3 TRP 4 HZ3 TRP 4 28.918 0.377 -11.439
42 HH2 TRP 4 HH2 TRP 4 30.531 1.534 -9.960
43 H ASN 5 H ASN 5 22.534 -2.864 -8.888
44 HA ASN 5 HA ASN 5 21.026 -4.548 -8.410
45 HB2 ASN 5 1HB ASN 5 23.007 -5.096 -6.188
46 HB3 ASN 5 2HB ASN 5 21.930 -6.258 -6.963
47 HD21 ASN 5 1HD2 ASN 5 25.034 -5.942 -6.871
48 HD22 ASN 5 2HD2 ASN 5 25.488 -6.059 -8.502
49 H GLY 6 H GLY 6 20.357 -2.049 -7.162
50 HA2 GLY 6 1HA GLY 6 18.770 -1.277 -5.689
51 HA3 GLY 6 2HA GLY 6 18.343 -2.964 -5.400
52 H GLY 7 H GLY 7 21.621 -2.113 -4.888
53 HA2 GLY 7 1HA GLY 7 21.508 -2.783 -2.082
54 HA3 GLY 7 2HA GLY 7 22.928 -2.244 -2.979
55 H ARG 8 H ARG 8 22.768 -1.141 -0.572
56 HA ARG 8 HA ARG 8 21.816 1.617 -1.098
57 HB2 ARG 8 1HB ARG 8 21.291 1.817 1.287
58 HB3 ARG 8 2HB ARG 8 20.288 0.620 0.484
59 HG2 ARG 8 1HG ARG 8 21.214 -1.152 1.620
60 HG3 ARG 8 2HG ARG 8 22.805 -0.418 1.728
61 HD2 ARG 8 1HD ARG 8 21.844 -0.499 3.947
62 HD3 ARG 8 2HD ARG 8 21.880 1.180 3.433
63 HE ARG 8 HE ARG 8 19.380 -0.047 2.779
64 HH11 ARG 8 1HH1 ARG 8 18.557 2.345 3.528
65 HH12 ARG 8 2HH1 ARG 8 18.354 2.385 5.248
66 HH21 ARG 8 1HH2 ARG 8 20.271 -0.445 5.812
67 HH22 ARG 8 2HH2 ARG 8 19.326 0.813 6.538
68 H CYS 9 H CYS 9 22.838 3.162 0.548
69 HA CYS 9 HA CYS 9 25.719 2.540 0.837
70 HB2 CYS 9 1HB CYS 9 24.189 5.073 0.394
71 HB3 CYS 9 2HB CYS 9 25.728 5.148 1.245
72 H ARG 10 H ARG 10 26.325 1.998 2.836
73 HA ARG 10 HA ARG 10 25.724 3.783 5.015
74 HB2 ARG 10 1HB ARG 10 24.167 1.402 4.652
75 HB3 ARG 10 2HB ARG 10 25.146 1.183 6.091
76 HG2 ARG 10 1HG ARG 10 23.501 3.678 5.626
77 HG3 ARG 10 2HG ARG 10 22.862 2.250 6.435
78 HD2 ARG 10 1HD ARG 10 24.507 2.388 8.174
79 HD3 ARG 10 2HD ARG 10 25.413 3.624 7.311
80 HE ARG 10 HE ARG 10 22.703 4.410 7.920
81 HH11 ARG 10 1HH1 ARG 10 26.047 4.831 8.484
82 HH12 ARG 10 2HH1 ARG 10 25.842 5.839 9.877
83 HH21 ARG 10 1HH2 ARG 10 22.407 5.397 10.025
84 HH22 ARG 10 2HH2 ARG 10 23.788 6.141 10.762
85 H LYS 11 H LYS 11 27.146 3.405 6.861
86 HA LYS 11 HA LYS 11 29.715 2.464 6.236
87 HB2 LYS 11 1HB LYS 11 28.342 2.871 8.898
88 HB3 LYS 11 2HB LYS 11 30.032 2.392 8.761
89 HG2 LYS 11 1HG LYS 11 30.345 4.446 7.262
90 HG3 LYS 11 2HG LYS 11 28.741 4.947 7.790
91 HD2 LYS 11 1HD LYS 11 30.336 6.007 9.241
92 HD3 LYS 11 2HD LYS 11 29.534 4.745 10.167
93 HE2 LYS 11 1HE LYS 11 32.004 3.860 8.778
94 HE3 LYS 11 2HE LYS 11 32.246 5.040 10.058
95 HZ1 LYS 11 1HZ LYS 11 30.416 2.851 10.626
96 HZ2 LYS 11 2HZ LYS 11 31.535 3.630 11.639
97 HZ3 LYS 11 3HZ LYS 11 32.066 2.464 10.524
98 H LYS 12 H LYS 12 26.866 0.793 7.031
99 HA LYS 12 HA LYS 12 28.357 -1.766 7.245
100 HB2 LYS 12 1HB LYS 12 25.754 -0.945 8.561
101 HB3 LYS 12 2HB LYS 12 26.370 -2.597 8.524
102 HG2 LYS 12 1HG LYS 12 28.405 -1.884 9.701
103 HG3 LYS 12 2HG LYS 12 27.835 -0.214 9.701
104 HD2 LYS 12 1HD LYS 12 25.909 -0.836 11.070
105 HD3 LYS 12 2HD LYS 12 26.373 -2.537 10.994
106 HE2 LYS 12 1HE LYS 12 27.111 -1.558 13.123
107 HE3 LYS 12 2HE LYS 12 28.508 -1.985 12.135
108 HZ1 LYS 12 1HZ LYS 12 27.690 0.567 13.083
109 HZ2 LYS 12 2HZ LYS 12 27.845 0.574 11.392
110 HZ3 LYS 12 3HZ LYS 12 29.158 0.106 12.363
111 H CYS 13 H CYS 13 26.884 -3.623 6.524
112 HA CYS 13 HA CYS 13 25.493 -2.805 4.035
113 HB2 CYS 13 1HB CYS 13 26.729 -5.488 4.713
114 HB3 CYS 13 2HB CYS 13 26.071 -4.986 3.176
115 H LYS 14 H LYS 14 23.433 -3.006 3.919
116 HA LYS 14 HA LYS 14 21.737 -3.701 5.920
117 HB2 LYS 14 1HB LYS 14 20.828 -2.567 4.076
118 HB3 LYS 14 2HB LYS 14 21.368 -3.796 2.935
119 HG2 LYS 14 1HG LYS 14 19.721 -5.362 3.753
120 HG3 LYS 14 2HG LYS 14 19.307 -4.301 5.102
121 HD2 LYS 14 1HD LYS 14 18.549 -2.582 3.455
122 HD3 LYS 14 2HD LYS 14 18.882 -3.724 2.152
123 HE2 LYS 14 1HE LYS 14 17.234 -5.279 3.016
124 HE3 LYS 14 2HE LYS 14 16.997 -4.293 4.459
125 HZ1 LYS 14 1HZ LYS 14 15.355 -3.359 3.304
126 HZ2 LYS 14 2HZ LYS 14 15.908 -3.971 1.819
127 HZ3 LYS 14 3HZ LYS 14 16.572 -2.540 2.448
128 H GLU 15 H GLU 15 20.204 -5.490 6.107
129 HA GLU 15 HA GLU 15 20.937 -7.814 6.935
130 HB2 GLU 15 1HB GLU 15 18.760 -7.467 4.865
131 HB3 GLU 15 2HB GLU 15 18.962 -8.916 5.852
132 HG2 GLU 15 1HG GLU 15 18.703 -7.581 7.897
133 HG3 GLU 15 2HG GLU 15 18.562 -6.110 6.935
134 H ASN 16 H ASN 16 22.856 -8.671 6.266
135 HA ASN 16 HA ASN 16 24.170 -10.180 5.132
136 HB2 ASN 16 1HB ASN 16 21.681 -10.887 3.573
137 HB3 ASN 16 2HB ASN 16 23.076 -11.911 3.903
138 HD21 ASN 16 1HD2 ASN 16 23.422 -11.401 6.682
139 HD22 ASN 16 2HD2 ASN 16 22.073 -12.017 7.510
140 H GLU 17 H GLU 17 24.425 -7.650 4.159
141 HA GLU 17 HA GLU 17 24.363 -7.967 1.215
142 HB2 GLU 17 1HB GLU 17 24.086 -5.552 2.999
143 HB3 GLU 17 2HB GLU 17 24.529 -5.406 1.300
144 HG2 GLU 17 1HG GLU 17 22.316 -7.042 1.210
145 HG3 GLU 17 2HG GLU 17 21.927 -6.036 2.576
146 H LYS 18 H LYS 18 26.082 -7.574 -0.009
147 HA LYS 18 HA LYS 18 28.627 -7.902 1.317
148 HB2 LYS 18 1HB LYS 18 28.286 -7.616 -1.654
149 HB3 LYS 18 2HB LYS 18 29.455 -8.579 -0.755
150 HG2 LYS 18 1HG LYS 18 26.476 -9.097 -0.979
151 HG3 LYS 18 2HG LYS 18 27.767 -10.049 -1.710
152 HD2 LYS 18 1HD LYS 18 28.641 -10.489 0.622
153 HD3 LYS 18 2HD LYS 18 27.175 -9.730 1.244
154 HE2 LYS 18 1HE LYS 18 27.157 -12.070 -0.679
155 HE3 LYS 18 2HE LYS 18 27.038 -12.242 1.072
156 HZ1 LYS 18 1HZ LYS 18 25.070 -11.315 -0.829
157 HZ2 LYS 18 2HZ LYS 18 25.182 -10.375 0.581
158 HZ3 LYS 18 3HZ LYS 18 24.857 -12.038 0.693
159 HA PRO 19 HA PRO 19 29.502 -3.463 1.116
160 HB2 PRO 19 1HB PRO 19 32.357 -4.254 1.223
161 HB3 PRO 19 2HB PRO 19 31.450 -3.197 2.300
162 HG2 PRO 19 1HG PRO 19 32.245 -5.754 2.913
163 HG3 PRO 19 2HG PRO 19 30.925 -4.894 3.703
164 HD2 PRO 19 1HD PRO 19 30.794 -7.159 1.821
165 HD3 PRO 19 2HD PRO 19 29.548 -6.534 2.915
166 H ILE 20 H ILE 20 29.408 -2.445 -0.847
167 HA ILE 20 HA ILE 20 31.706 -2.865 -2.595
168 HB ILE 20 HB ILE 20 29.523 -4.201 -3.193
169 HG12 ILE 20 1HG1 ILE 20 30.812 -2.682 -5.427
170 HG13 ILE 20 2HG1 ILE 20 31.719 -3.885 -4.521
171 HG21 ILE 20 1HG2 ILE 20 27.765 -2.722 -3.506
172 HG22 ILE 20 2HG2 ILE 20 28.381 -2.821 -5.135
173 HG23 ILE 20 3HG2 ILE 20 28.788 -1.440 -4.155
174 HD11 ILE 20 1HD1 ILE 20 29.138 -4.347 -6.040
175 HD12 ILE 20 2HD1 ILE 20 29.948 -5.565 -5.054
176 HD13 ILE 20 3HD1 ILE 20 30.736 -4.933 -6.501
177 H GLY 21 H GLY 21 31.500 -1.280 -4.564
178 HA2 GLY 21 1HA GLY 21 31.784 0.908 -5.184
179 HA3 GLY 21 2HA GLY 21 30.113 1.050 -4.691
180 H TYR 22 H TYR 22 31.045 3.312 -4.320
181 HA TYR 22 HA TYR 22 31.988 3.542 -1.527
182 HB2 TYR 22 1HB TYR 22 33.757 3.842 -3.459
183 HB3 TYR 22 2HB TYR 22 33.001 5.423 -3.646
184 HD1 TYR 22 HD1 TYR 22 33.022 7.054 -1.756
185 HD2 TYR 22 HD2 TYR 22 35.062 3.282 -1.518
186 HE1 TYR 22 HE1 TYR 22 34.293 7.864 0.213
187 HE2 TYR 22 HE2 TYR 22 36.356 4.103 0.430
188 HH TYR 22 HH TYR 22 35.840 5.949 2.314
189 H CYS 23 H CYS 23 31.569 5.639 -0.580
190 HA CYS 23 HA CYS 23 29.446 7.245 -1.718
191 HB2 CYS 23 1HB CYS 23 28.791 4.889 -0.273
192 HB3 CYS 23 2HB CYS 23 28.406 6.246 0.775
193 H ARG 24 H ARG 24 28.506 8.479 0.479
194 HA ARG 24 HA ARG 24 30.741 10.212 1.009
195 HB2 ARG 24 1HB ARG 24 27.897 10.271 2.057
196 HB3 ARG 24 2HB ARG 24 29.053 11.600 2.136
197 HG2 ARG 24 1HG ARG 24 29.125 11.757 -0.285
198 HG3 ARG 24 2HG ARG 24 28.123 10.314 -0.449
199 HD2 ARG 24 1HD ARG 24 26.627 12.133 -0.737
200 HD3 ARG 24 2HD ARG 24 26.353 11.581 0.911
201 HE ARG 24 HE ARG 24 27.415 13.527 1.723
202 HH11 ARG 24 1HH1 ARG 24 29.652 13.924 -0.138
203 HH12 ARG 24 2HH1 ARG 24 29.155 15.257 -1.124
204 HH21 ARG 24 1HH2 ARG 24 25.813 15.011 -0.237
205 HH22 ARG 24 2HH2 ARG 24 26.984 15.880 -1.172
206 H ASN 25 H ASN 25 31.260 11.010 3.112
207 HA ASN 25 HA ASN 25 32.334 10.485 5.112
208 HB2 ASN 25 1HB ASN 25 29.547 9.878 6.054
209 HB3 ASN 25 2HB ASN 25 30.805 10.844 6.822
210 HD21 ASN 25 1HD2 ASN 25 28.238 10.879 4.416
211 HD22 ASN 25 2HD2 ASN 25 28.220 12.570 4.217
212 H GLY 26 H GLY 26 32.759 8.234 3.701
213 HA2 GLY 26 1HA GLY 26 33.793 6.262 4.458
214 HA3 GLY 26 2HA GLY 26 32.830 6.344 5.933
215 H LYS 27 H LYS 27 30.359 6.821 4.253
216 HA LYS 27 HA LYS 27 29.582 4.103 4.365
217 HB2 LYS 27 1HB LYS 27 27.922 6.164 2.938
218 HB3 LYS 27 2HB LYS 27 27.416 4.858 3.996
219 HG2 LYS 27 1HG LYS 27 28.808 6.212 5.807
220 HG3 LYS 27 2HG LYS 27 28.570 7.549 4.688
221 HD2 LYS 27 1HD LYS 27 26.144 7.248 4.793
222 HD3 LYS 27 2HD LYS 27 26.351 5.858 5.868
223 HE2 LYS 27 1HE LYS 27 27.518 7.326 7.498
224 HE3 LYS 27 2HE LYS 27 27.224 8.706 6.442
225 HZ1 LYS 27 1HZ LYS 27 24.775 7.568 6.690
226 HZ2 LYS 27 2HZ LYS 27 25.325 8.919 7.559
227 HZ3 LYS 27 3HZ LYS 27 25.434 7.368 8.243
228 H LYS 28 H LYS 28 29.292 2.594 2.835
229 HA LYS 28 HA LYS 28 30.276 3.224 0.102
230 HB2 LYS 28 1HB LYS 28 30.484 0.494 1.325
231 HB3 LYS 28 2HB LYS 28 31.454 1.228 0.048
232 HG2 LYS 28 1HG LYS 28 32.302 2.876 1.779
233 HG3 LYS 28 2HG LYS 28 31.495 1.901 3.005
234 HD2 LYS 28 1HD LYS 28 32.827 -0.067 2.294
235 HD3 LYS 28 2HD LYS 28 33.661 0.943 1.111
236 HE2 LYS 28 1HE LYS 28 34.404 2.438 2.972
237 HE3 LYS 28 2HE LYS 28 33.667 1.322 4.121
238 HZ1 LYS 28 1HZ LYS 28 35.252 -0.240 3.772
239 HZ2 LYS 28 2HZ LYS 28 36.184 1.136 3.426
240 HZ3 LYS 28 3HZ LYS 28 35.528 0.216 2.160
241 H CYS 29 H CYS 29 29.406 1.630 -1.548
242 HA CYS 29 HA CYS 29 26.547 1.166 -1.060
243 HB2 CYS 29 1HB CYS 29 28.324 0.905 -3.485
244 HB3 CYS 29 2HB CYS 29 26.685 0.266 -3.469
245 H CYS 30 H CYS 30 26.043 -0.721 -0.013
246 HA CYS 30 HA CYS 30 27.818 -3.052 -0.435
247 HB2 CYS 30 1HB CYS 30 25.391 -2.692 1.356
248 HB3 CYS 30 2HB CYS 30 26.406 -4.127 1.244
249 H VAL 31 H VAL 31 27.437 -4.191 -2.179
250 HA VAL 31 HA VAL 31 24.794 -4.224 -3.388
251 HB VAL 31 HB VAL 31 27.538 -4.949 -4.195
252 HG11 VAL 31 1HG1 VAL 31 26.710 -7.199 -4.381
253 HG12 VAL 31 2HG1 VAL 31 26.708 -6.513 -6.002
254 HG13 VAL 31 3HG1 VAL 31 25.199 -6.643 -5.099
255 HG21 VAL 31 1HG2 VAL 31 26.064 -3.055 -5.057
256 HG22 VAL 31 2HG2 VAL 31 25.133 -4.286 -5.897
257 HG23 VAL 31 3HG2 VAL 31 26.830 -4.054 -6.300
258 H ASN 32 H ASN 32 23.298 -5.520 -2.825
259 HA ASN 32 HA ASN 32 23.567 -7.437 -0.804
260 HB2 ASN 32 1HB ASN 32 21.482 -6.170 -1.511
261 HB3 ASN 32 2HB ASN 32 21.326 -7.340 -2.821
262 HD21 ASN 32 1HD2 ASN 32 19.727 -6.862 -0.193
263 HD22 ASN 32 2HD2 ASN 32 19.592 -8.431 0.443
Start of MODEL 12
1 H1 LYS 1 1H LYS 1 26.806 7.349 -4.576
2 H2 LYS 1 2H LYS 1 27.040 9.012 -4.328
3 H3 LYS 1 3H LYS 1 27.697 8.257 -5.699
4 HA LYS 1 HA LYS 1 25.268 9.537 -5.516
5 HB2 LYS 1 1HB LYS 1 26.377 7.610 -7.579
6 HB3 LYS 1 2HB LYS 1 25.035 8.721 -7.855
7 HG2 LYS 1 1HG LYS 1 26.511 10.633 -7.327
8 HG3 LYS 1 2HG LYS 1 27.852 9.518 -7.062
9 HD2 LYS 1 1HD LYS 1 27.420 8.684 -9.454
10 HD3 LYS 1 2HD LYS 1 26.406 10.114 -9.649
11 HE2 LYS 1 1HE LYS 1 28.614 10.682 -10.439
12 HE3 LYS 1 2HE LYS 1 28.380 11.503 -8.896
13 HZ1 LYS 1 1HZ LYS 1 29.476 9.490 -7.871
14 HZ2 LYS 1 2HZ LYS 1 30.485 10.514 -8.775
15 HZ3 LYS 1 3HZ LYS 1 29.942 9.050 -9.444
16 H LYS 2 H LYS 2 24.761 6.723 -7.305
17 HA LYS 2 HA LYS 2 22.848 5.660 -5.302
18 HB2 LYS 2 1HB LYS 2 22.825 5.767 -8.311
19 HB3 LYS 2 2HB LYS 2 21.862 4.571 -7.443
20 HG2 LYS 2 1HG LYS 2 20.636 6.275 -6.280
21 HG3 LYS 2 2HG LYS 2 21.730 7.536 -6.846
22 HD2 LYS 2 1HD LYS 2 19.806 7.712 -8.230
23 HD3 LYS 2 2HD LYS 2 21.006 6.887 -9.220
24 HE2 LYS 2 1HE LYS 2 19.978 4.732 -8.760
25 HE3 LYS 2 2HE LYS 2 18.872 5.467 -7.598
26 HZ1 LYS 2 1HZ LYS 2 18.040 6.858 -9.466
27 HZ2 LYS 2 2HZ LYS 2 17.719 5.199 -9.637
28 HZ3 LYS 2 3HZ LYS 2 18.975 5.916 -10.527
29 H CYS 3 H CYS 3 22.751 3.431 -4.977
30 HA CYS 3 HA CYS 3 25.238 2.005 -5.585
31 HB2 CYS 3 1HB CYS 3 22.855 1.233 -3.881
32 HB3 CYS 3 2HB CYS 3 24.320 0.270 -4.071
33 H TRP 4 H TRP 4 24.550 -0.501 -5.625
34 HA TRP 4 HA TRP 4 23.162 -0.831 -8.219
35 HB2 TRP 4 1HB TRP 4 25.619 -2.430 -7.694
36 HB3 TRP 4 2HB TRP 4 25.054 -1.703 -9.195
37 HD1 TRP 4 HD1 TRP 4 26.906 -0.891 -5.954
38 HE1 TRP 4 HE1 TRP 4 28.306 1.240 -6.307
39 HE3 TRP 4 HE3 TRP 4 25.410 0.375 -10.667
40 HZ2 TRP 4 HZ2 TRP 4 28.951 3.047 -8.435
41 HZ3 TRP 4 HZ3 TRP 4 26.574 2.179 -11.900
42 HH2 TRP 4 HH2 TRP 4 28.206 3.630 -10.733
43 H ASN 5 H ASN 5 22.711 -3.183 -8.660
44 HA ASN 5 HA ASN 5 21.546 -5.061 -8.024
45 HB2 ASN 5 1HB ASN 5 23.448 -4.954 -5.664
46 HB3 ASN 5 2HB ASN 5 22.503 -6.354 -6.168
47 HD21 ASN 5 1HD2 ASN 5 24.329 -4.032 -8.228
48 HD22 ASN 5 2HD2 ASN 5 25.218 -5.242 -9.020
49 H GLY 6 H GLY 6 20.395 -2.569 -7.246
50 HA2 GLY 6 1HA GLY 6 18.813 -1.677 -5.841
51 HA3 GLY 6 2HA GLY 6 18.431 -3.349 -5.419
52 H GLY 7 H GLY 7 21.663 -2.397 -4.893
53 HA2 GLY 7 1HA GLY 7 21.562 -2.877 -2.092
54 HA3 GLY 7 2HA GLY 7 22.927 -2.204 -2.981
55 H ARG 8 H ARG 8 22.781 -1.060 -0.688
56 HA ARG 8 HA ARG 8 21.731 1.630 -1.300
57 HB2 ARG 8 1HB ARG 8 21.094 1.856 1.095
58 HB3 ARG 8 2HB ARG 8 20.113 0.717 0.196
59 HG2 ARG 8 1HG ARG 8 20.565 -0.819 1.804
60 HG3 ARG 8 2HG ARG 8 22.216 -0.864 1.210
61 HD2 ARG 8 1HD ARG 8 22.122 -0.433 3.631
62 HD3 ARG 8 2HD ARG 8 22.848 0.914 2.754
63 HE ARG 8 HE ARG 8 21.043 2.237 3.389
64 HH11 ARG 8 1HH1 ARG 8 20.987 -0.440 5.297
65 HH12 ARG 8 2HH1 ARG 8 19.274 -0.546 5.518
66 HH21 ARG 8 1HH2 ARG 8 18.581 2.089 3.378
67 HH22 ARG 8 2HH2 ARG 8 17.945 1.029 4.590
68 H CYS 9 H CYS 9 22.695 3.229 0.414
69 HA CYS 9 HA CYS 9 25.582 2.609 0.692
70 HB2 CYS 9 1HB CYS 9 24.054 5.142 0.222
71 HB3 CYS 9 2HB CYS 9 25.600 5.225 1.060
72 H ARG 10 H ARG 10 26.247 2.178 2.661
73 HA ARG 10 HA ARG 10 25.589 3.916 4.849
74 HB2 ARG 10 1HB ARG 10 24.614 1.074 4.842
75 HB3 ARG 10 2HB ARG 10 25.032 1.876 6.350
76 HG2 ARG 10 1HG ARG 10 23.439 3.782 5.469
77 HG3 ARG 10 2HG ARG 10 22.817 2.517 4.417
78 HD2 ARG 10 1HD ARG 10 22.462 1.095 6.453
79 HD3 ARG 10 2HD ARG 10 22.947 2.471 7.438
80 HE ARG 10 HE ARG 10 20.686 2.730 5.548
81 HH11 ARG 10 1HH1 ARG 10 21.203 4.958 7.444
82 HH12 ARG 10 2HH1 ARG 10 20.070 4.639 8.716
83 HH21 ARG 10 1HH2 ARG 10 19.551 1.341 7.783
84 HH22 ARG 10 2HH2 ARG 10 19.071 2.616 8.853
85 H LYS 11 H LYS 11 26.959 3.545 6.701
86 HA LYS 11 HA LYS 11 29.619 2.827 6.110
87 HB2 LYS 11 1HB LYS 11 28.247 2.938 8.809
88 HB3 LYS 11 2HB LYS 11 29.988 2.966 8.531
89 HG2 LYS 11 1HG LYS 11 29.716 5.049 7.202
90 HG3 LYS 11 2HG LYS 11 27.991 5.035 7.565
91 HD2 LYS 11 1HD LYS 11 28.689 4.969 10.043
92 HD3 LYS 11 2HD LYS 11 30.302 5.403 9.477
93 HE2 LYS 11 1HE LYS 11 29.257 7.373 8.287
94 HE3 LYS 11 2HE LYS 11 27.742 6.975 9.098
95 HZ1 LYS 11 1HZ LYS 11 28.448 7.882 10.974
96 HZ2 LYS 11 2HZ LYS 11 29.752 8.530 10.100
97 HZ3 LYS 11 3HZ LYS 11 29.930 7.054 10.920
98 H LYS 12 H LYS 12 26.882 0.971 6.733
99 HA LYS 12 HA LYS 12 28.501 -1.502 6.912
100 HB2 LYS 12 1HB LYS 12 25.858 -1.011 8.302
101 HB3 LYS 12 2HB LYS 12 26.849 -2.466 8.404
102 HG2 LYS 12 1HG LYS 12 28.711 -0.879 9.279
103 HG3 LYS 12 2HG LYS 12 27.404 0.276 9.540
104 HD2 LYS 12 1HD LYS 12 27.478 -2.540 10.666
105 HD3 LYS 12 2HD LYS 12 27.889 -1.083 11.568
106 HE2 LYS 12 1HE LYS 12 25.578 -0.207 11.024
107 HE3 LYS 12 2HE LYS 12 25.197 -1.804 10.378
108 HZ1 LYS 12 1HZ LYS 12 24.985 -2.647 12.401
109 HZ2 LYS 12 2HZ LYS 12 24.954 -1.048 12.972
110 HZ3 LYS 12 3HZ LYS 12 26.413 -1.918 12.964
111 H CYS 13 H CYS 13 26.954 -3.436 6.360
112 HA CYS 13 HA CYS 13 25.517 -2.669 3.882
113 HB2 CYS 13 1HB CYS 13 26.743 -5.355 4.563
114 HB3 CYS 13 2HB CYS 13 26.050 -4.869 3.036
115 H LYS 14 H LYS 14 23.475 -2.865 3.816
116 HA LYS 14 HA LYS 14 21.763 -3.506 5.815
117 HB2 LYS 14 1HB LYS 14 20.816 -2.491 3.938
118 HB3 LYS 14 2HB LYS 14 21.476 -3.683 2.829
119 HG2 LYS 14 1HG LYS 14 19.909 -5.360 3.607
120 HG3 LYS 14 2HG LYS 14 19.373 -4.313 4.921
121 HD2 LYS 14 1HD LYS 14 18.539 -2.683 3.233
122 HD3 LYS 14 2HD LYS 14 19.031 -3.790 1.950
123 HE2 LYS 14 1HE LYS 14 17.147 -4.598 4.176
124 HE3 LYS 14 2HE LYS 14 16.577 -3.931 2.646
125 HZ1 LYS 14 1HZ LYS 14 16.675 -6.408 2.755
126 HZ2 LYS 14 2HZ LYS 14 18.368 -6.286 2.831
127 HZ3 LYS 14 3HZ LYS 14 17.538 -5.722 1.461
128 H GLU 15 H GLU 15 20.276 -5.346 6.081
129 HA GLU 15 HA GLU 15 21.383 -7.639 6.865
130 HB2 GLU 15 1HB GLU 15 18.719 -7.330 5.465
131 HB3 GLU 15 2HB GLU 15 19.204 -8.789 6.326
132 HG2 GLU 15 1HG GLU 15 19.202 -6.040 7.595
133 HG3 GLU 15 2HG GLU 15 17.840 -7.153 7.701
134 H ASN 16 H ASN 16 22.812 -8.911 5.939
135 HA ASN 16 HA ASN 16 23.714 -10.477 4.522
136 HB2 ASN 16 1HB ASN 16 20.977 -10.480 3.224
137 HB3 ASN 16 2HB ASN 16 22.216 -11.724 3.068
138 HD21 ASN 16 1HD2 ASN 16 21.114 -13.449 4.127
139 HD22 ASN 16 2HD2 ASN 16 20.624 -13.382 5.750
140 H GLU 17 H GLU 17 24.342 -7.897 3.904
141 HA GLU 17 HA GLU 17 24.308 -7.900 0.939
142 HB2 GLU 17 1HB GLU 17 24.124 -5.632 2.921
143 HB3 GLU 17 2HB GLU 17 24.492 -5.390 1.216
144 HG2 GLU 17 1HG GLU 17 22.209 -7.041 1.276
145 HG3 GLU 17 2HG GLU 17 21.929 -5.911 2.560
146 H LYS 18 H LYS 18 26.131 -7.738 -0.126
147 HA LYS 18 HA LYS 18 28.594 -8.020 1.352
148 HB2 LYS 18 1HB LYS 18 27.625 -8.532 -1.360
149 HB3 LYS 18 2HB LYS 18 29.252 -7.867 -1.364
150 HG2 LYS 18 1HG LYS 18 29.349 -10.285 -1.272
151 HG3 LYS 18 2HG LYS 18 29.981 -9.588 0.209
152 HD2 LYS 18 1HD LYS 18 28.478 -10.746 1.445
153 HD3 LYS 18 2HD LYS 18 27.149 -10.002 0.575
154 HE2 LYS 18 1HE LYS 18 26.990 -12.406 0.352
155 HE3 LYS 18 2HE LYS 18 27.414 -11.718 -1.216
156 HZ1 LYS 18 1HZ LYS 18 29.293 -12.943 0.727
157 HZ2 LYS 18 2HZ LYS 18 29.747 -12.211 -0.737
158 HZ3 LYS 18 3HZ LYS 18 28.794 -13.616 -0.750
159 HA PRO 19 HA PRO 19 29.350 -3.578 1.007
160 HB2 PRO 19 1HB PRO 19 32.167 -4.056 1.645
161 HB3 PRO 19 2HB PRO 19 30.956 -3.197 2.584
162 HG2 PRO 19 1HG PRO 19 32.024 -5.719 3.148
163 HG3 PRO 19 2HG PRO 19 30.629 -4.976 3.919
164 HD2 PRO 19 1HD PRO 19 30.689 -7.210 2.041
165 HD3 PRO 19 2HD PRO 19 29.328 -6.591 2.988
166 H ILE 20 H ILE 20 29.482 -2.732 -0.995
167 HA ILE 20 HA ILE 20 32.074 -3.083 -2.333
168 HB ILE 20 HB ILE 20 31.284 -3.643 -4.356
169 HG12 ILE 20 1HG1 ILE 20 28.398 -2.925 -4.084
170 HG13 ILE 20 2HG1 ILE 20 29.493 -1.576 -4.294
171 HG21 ILE 20 1HG2 ILE 20 28.938 -4.623 -2.751
172 HG22 ILE 20 2HG2 ILE 20 30.554 -5.346 -2.666
173 HG23 ILE 20 3HG2 ILE 20 29.661 -5.367 -4.177
174 HD11 ILE 20 1HD1 ILE 20 28.732 -2.349 -6.448
175 HD12 ILE 20 2HD1 ILE 20 29.368 -3.967 -6.116
176 HD13 ILE 20 3HD1 ILE 20 30.463 -2.597 -6.276
177 H GLY 21 H GLY 21 31.966 -1.520 -4.355
178 HA2 GLY 21 1HA GLY 21 32.172 0.701 -5.027
179 HA3 GLY 21 2HA GLY 21 30.471 0.656 -4.574
180 H TYR 22 H TYR 22 31.537 3.051 -4.384
181 HA TYR 22 HA TYR 22 32.228 3.452 -1.525
182 HB2 TYR 22 1HB TYR 22 34.081 3.786 -3.315
183 HB3 TYR 22 2HB TYR 22 33.195 5.247 -3.746
184 HD1 TYR 22 HD1 TYR 22 32.924 7.089 -2.100
185 HD2 TYR 22 HD2 TYR 22 35.220 3.577 -1.183
186 HE1 TYR 22 HE1 TYR 22 34.127 8.322 -0.311
187 HE2 TYR 22 HE2 TYR 22 36.305 4.778 0.697
188 HH TYR 22 HH TYR 22 36.332 7.892 1.149
189 H CYS 23 H CYS 23 31.601 5.496 -0.646
190 HA CYS 23 HA CYS 23 29.505 6.995 -1.979
191 HB2 CYS 23 1HB CYS 23 28.770 4.698 -0.567
192 HB3 CYS 23 2HB CYS 23 28.459 6.010 0.561
193 H ARG 24 H ARG 24 28.434 8.330 0.103
194 HA ARG 24 HA ARG 24 30.619 10.126 0.608
195 HB2 ARG 24 1HB ARG 24 27.710 10.214 1.447
196 HB3 ARG 24 2HB ARG 24 28.858 11.536 1.660
197 HG2 ARG 24 1HG ARG 24 29.281 11.408 -0.851
198 HG3 ARG 24 2HG ARG 24 27.891 10.324 -0.941
199 HD2 ARG 24 1HD ARG 24 26.437 12.034 -0.000
200 HD3 ARG 24 2HD ARG 24 27.812 13.106 0.259
201 HE ARG 24 HE ARG 24 26.392 12.764 -2.194
202 HH11 ARG 24 1HH1 ARG 24 28.091 15.128 -1.189
203 HH12 ARG 24 2HH1 ARG 24 29.364 15.159 -2.360
204 HH21 ARG 24 1HH2 ARG 24 28.729 11.949 -3.508
205 HH22 ARG 24 2HH2 ARG 24 29.738 13.345 -3.665
206 H ASN 25 H ASN 25 31.019 11.092 2.662
207 HA ASN 25 HA ASN 25 32.028 10.744 4.729
208 HB2 ASN 25 1HB ASN 25 29.261 10.069 5.661
209 HB3 ASN 25 2HB ASN 25 30.441 11.176 6.356
210 HD21 ASN 25 1HD2 ASN 25 27.508 11.356 5.145
211 HD22 ASN 25 2HD2 ASN 25 27.600 12.847 4.329
212 H GLY 26 H GLY 26 32.668 8.480 3.526
213 HA2 GLY 26 1HA GLY 26 33.698 6.574 4.414
214 HA3 GLY 26 2HA GLY 26 32.628 6.668 5.813
215 H LYS 27 H LYS 27 30.260 6.948 3.947
216 HA LYS 27 HA LYS 27 29.633 4.179 4.226
217 HB2 LYS 27 1HB LYS 27 27.835 6.023 2.689
218 HB3 LYS 27 2HB LYS 27 27.433 4.791 3.872
219 HG2 LYS 27 1HG LYS 27 28.608 6.333 5.586
220 HG3 LYS 27 2HG LYS 27 28.539 7.562 4.333
221 HD2 LYS 27 1HD LYS 27 26.091 7.284 4.167
222 HD3 LYS 27 2HD LYS 27 26.151 6.090 5.470
223 HE2 LYS 27 1HE LYS 27 26.890 7.703 7.054
224 HE3 LYS 27 2HE LYS 27 27.265 8.881 5.798
225 HZ1 LYS 27 1HZ LYS 27 24.966 9.147 5.318
226 HZ2 LYS 27 2HZ LYS 27 25.149 9.298 7.000
227 HZ3 LYS 27 3HZ LYS 27 24.532 7.860 6.337
228 H LYS 28 H LYS 28 29.271 2.635 2.695
229 HA LYS 28 HA LYS 28 30.429 3.188 0.016
230 HB2 LYS 28 1HB LYS 28 30.496 0.637 1.641
231 HB3 LYS 28 2HB LYS 28 31.176 0.851 0.029
232 HG2 LYS 28 1HG LYS 28 32.559 2.756 0.981
233 HG3 LYS 28 2HG LYS 28 32.008 2.260 2.581
234 HD2 LYS 28 1HD LYS 28 32.889 -0.078 1.967
235 HD3 LYS 28 2HD LYS 28 33.724 0.715 0.633
236 HE2 LYS 28 1HE LYS 28 35.333 0.743 2.341
237 HE3 LYS 28 2HE LYS 28 34.613 2.346 2.470
238 HZ1 LYS 28 1HZ LYS 28 34.625 0.230 4.360
239 HZ2 LYS 28 2HZ LYS 28 33.031 0.685 3.994
240 HZ3 LYS 28 3HZ LYS 28 34.135 1.844 4.561
241 H CYS 29 H CYS 29 29.457 1.848 -1.757
242 HA CYS 29 HA CYS 29 26.682 1.169 -1.252
243 HB2 CYS 29 1HB CYS 29 28.445 1.185 -3.675
244 HB3 CYS 29 2HB CYS 29 26.907 0.322 -3.718
245 H CYS 30 H CYS 30 26.317 -0.527 -0.116
246 HA CYS 30 HA CYS 30 27.769 -3.032 -0.566
247 HB2 CYS 30 1HB CYS 30 25.370 -2.435 1.192
248 HB3 CYS 30 2HB CYS 30 26.278 -3.942 1.122
249 H VAL 31 H VAL 31 27.291 -4.209 -2.240
250 HA VAL 31 HA VAL 31 24.675 -4.035 -3.537
251 HB VAL 31 HB VAL 31 27.372 -5.058 -4.207
252 HG11 VAL 31 1HG1 VAL 31 26.300 -6.370 -6.181
253 HG12 VAL 31 2HG1 VAL 31 24.920 -6.532 -5.101
254 HG13 VAL 31 3HG1 VAL 31 26.488 -7.151 -4.617
255 HG21 VAL 31 1HG2 VAL 31 26.171 -2.929 -5.050
256 HG22 VAL 31 2HG2 VAL 31 25.323 -4.029 -6.129
257 HG23 VAL 31 3HG2 VAL 31 27.066 -3.915 -6.210
258 H ASN 32 H ASN 32 23.096 -5.198 -2.889
259 HA ASN 32 HA ASN 32 23.173 -7.032 -0.846
260 HB2 ASN 32 1HB ASN 32 21.163 -5.824 -1.950
261 HB3 ASN 32 2HB ASN 32 21.091 -7.224 -3.015
262 HD21 ASN 32 1HD2 ASN 32 19.420 -6.166 -0.532
263 HD22 ASN 32 2HD2 ASN 32 19.312 -7.519 0.485
Start of MODEL 13
1 H1 LYS 1 1H LYS 1 25.608 9.434 -3.917
2 H2 LYS 1 2H LYS 1 25.519 7.799 -4.363
3 H3 LYS 1 3H LYS 1 25.678 8.224 -2.728
4 HA LYS 1 HA LYS 1 23.503 8.335 -2.479
5 HB2 LYS 1 1HB LYS 1 22.200 9.980 -3.746
6 HB3 LYS 1 2HB LYS 1 23.746 10.668 -3.255
7 HG2 LYS 1 1HG LYS 1 24.661 10.091 -5.514
8 HG3 LYS 1 2HG LYS 1 23.060 9.535 -5.985
9 HD2 LYS 1 1HD LYS 1 23.083 11.728 -6.792
10 HD3 LYS 1 2HD LYS 1 22.255 11.896 -5.249
11 HE2 LYS 1 1HE LYS 1 24.258 12.724 -4.185
12 HE3 LYS 1 2HE LYS 1 25.235 12.332 -5.601
13 HZ1 LYS 1 1HZ LYS 1 22.934 14.088 -5.981
14 HZ2 LYS 1 2HZ LYS 1 24.446 14.095 -6.754
15 HZ3 LYS 1 3HZ LYS 1 24.289 14.735 -5.189
16 H LYS 2 H LYS 2 24.935 6.618 -4.671
17 HA LYS 2 HA LYS 2 22.484 5.345 -5.668
18 HB2 LYS 2 1HB LYS 2 23.350 5.262 -7.958
19 HB3 LYS 2 2HB LYS 2 23.153 6.931 -7.427
20 HG2 LYS 2 1HG LYS 2 25.589 6.951 -6.808
21 HG3 LYS 2 2HG LYS 2 25.735 5.342 -7.503
22 HD2 LYS 2 1HD LYS 2 26.405 6.721 -9.273
23 HD3 LYS 2 2HD LYS 2 24.715 6.402 -9.647
24 HE2 LYS 2 1HE LYS 2 24.044 8.559 -8.808
25 HE3 LYS 2 2HE LYS 2 25.641 8.853 -8.120
26 HZ1 LYS 2 1HZ LYS 2 25.788 8.230 -10.892
27 HZ2 LYS 2 2HZ LYS 2 26.384 9.584 -10.055
28 HZ3 LYS 2 3HZ LYS 2 24.781 9.569 -10.615
29 H CYS 3 H CYS 3 22.733 3.157 -6.155
30 HA CYS 3 HA CYS 3 25.406 1.951 -5.856
31 HB2 CYS 3 1HB CYS 3 22.926 1.193 -4.292
32 HB3 CYS 3 2HB CYS 3 24.353 0.169 -4.412
33 H TRP 4 H TRP 4 24.732 -0.648 -5.936
34 HA TRP 4 HA TRP 4 23.816 -0.848 -8.749
35 HB2 TRP 4 1HB TRP 4 25.992 -2.623 -7.715
36 HB3 TRP 4 2HB TRP 4 25.725 -2.008 -9.342
37 HD1 TRP 4 HD1 TRP 4 26.838 -0.790 -5.869
38 HE1 TRP 4 HE1 TRP 4 28.493 1.160 -6.175
39 HE3 TRP 4 HE3 TRP 4 26.797 -0.400 -10.956
40 HZ2 TRP 4 HZ2 TRP 4 29.773 2.578 -8.314
41 HZ3 TRP 4 HZ3 TRP 4 28.256 1.236 -12.100
42 HH2 TRP 4 HH2 TRP 4 29.727 2.737 -10.792
43 H ASN 5 H ASN 5 23.149 -3.024 -9.376
44 HA ASN 5 HA ASN 5 21.669 -4.777 -9.043
45 HB2 ASN 5 1HB ASN 5 23.793 -5.207 -6.936
46 HB3 ASN 5 2HB ASN 5 22.550 -6.404 -7.305
47 HD21 ASN 5 1HD2 ASN 5 25.559 -5.000 -8.372
48 HD22 ASN 5 2HD2 ASN 5 25.758 -5.988 -9.737
49 H GLY 6 H GLY 6 21.011 -2.289 -7.641
50 HA2 GLY 6 1HA GLY 6 19.234 -1.635 -6.344
51 HA3 GLY 6 2HA GLY 6 18.836 -3.336 -6.105
52 H GLY 7 H GLY 7 21.977 -1.978 -5.308
53 HA2 GLY 7 1HA GLY 7 21.708 -2.893 -2.552
54 HA3 GLY 7 2HA GLY 7 23.156 -2.230 -3.309
55 H ARG 8 H ARG 8 23.071 -1.115 -1.062
56 HA ARG 8 HA ARG 8 22.024 1.597 -1.581
57 HB2 ARG 8 1HB ARG 8 21.244 1.752 0.706
58 HB3 ARG 8 2HB ARG 8 20.460 0.415 -0.108
59 HG2 ARG 8 1HG ARG 8 21.189 -1.016 1.489
60 HG3 ARG 8 2HG ARG 8 22.853 -0.622 1.099
61 HD2 ARG 8 1HD ARG 8 22.358 -0.213 3.466
62 HD3 ARG 8 2HD ARG 8 22.796 1.272 2.634
63 HE ARG 8 HE ARG 8 20.014 0.487 3.323
64 HH11 ARG 8 1HH1 ARG 8 22.041 2.874 1.963
65 HH12 ARG 8 2HH1 ARG 8 21.192 4.211 2.663
66 HH21 ARG 8 1HH2 ARG 8 19.120 2.226 4.606
67 HH22 ARG 8 2HH2 ARG 8 19.532 3.845 4.145
68 H CYS 9 H CYS 9 23.057 3.219 0.009
69 HA CYS 9 HA CYS 9 25.879 2.454 0.502
70 HB2 CYS 9 1HB CYS 9 24.699 5.231 0.367
71 HB3 CYS 9 2HB CYS 9 26.383 4.842 0.682
72 H ARG 10 H ARG 10 26.416 2.068 2.510
73 HA ARG 10 HA ARG 10 25.715 3.943 4.560
74 HB2 ARG 10 1HB ARG 10 24.588 1.174 4.584
75 HB3 ARG 10 2HB ARG 10 25.144 1.830 6.116
76 HG2 ARG 10 1HG ARG 10 23.686 3.890 5.571
77 HG3 ARG 10 2HG ARG 10 22.968 2.888 4.313
78 HD2 ARG 10 1HD ARG 10 22.263 1.245 5.941
79 HD3 ARG 10 2HD ARG 10 23.125 2.086 7.227
80 HE ARG 10 HE ARG 10 21.037 3.582 5.813
81 HH11 ARG 10 1HH1 ARG 10 20.073 4.935 7.462
82 HH12 ARG 10 2HH1 ARG 10 19.778 4.236 9.018
83 HH21 ARG 10 1HH2 ARG 10 21.579 1.352 8.356
84 HH22 ARG 10 2HH2 ARG 10 20.631 2.210 9.525
85 H LYS 11 H LYS 11 26.931 3.507 6.583
86 HA LYS 11 HA LYS 11 29.644 2.868 6.079
87 HB2 LYS 11 1HB LYS 11 27.952 3.589 8.394
88 HB3 LYS 11 2HB LYS 11 29.345 2.613 8.826
89 HG2 LYS 11 1HG LYS 11 29.633 5.042 7.063
90 HG3 LYS 11 2HG LYS 11 29.609 5.188 8.817
91 HD2 LYS 11 1HD LYS 11 31.483 3.481 8.891
92 HD3 LYS 11 2HD LYS 11 31.579 3.615 7.136
93 HE2 LYS 11 1HE LYS 11 32.114 5.972 7.286
94 HE3 LYS 11 2HE LYS 11 31.817 5.972 9.024
95 HZ1 LYS 11 1HZ LYS 11 34.185 5.328 7.657
96 HZ2 LYS 11 2HZ LYS 11 33.647 3.945 8.484
97 HZ3 LYS 11 3HZ LYS 11 33.913 5.392 9.331
98 H LYS 12 H LYS 12 26.940 0.985 6.367
99 HA LYS 12 HA LYS 12 28.499 -1.481 6.688
100 HB2 LYS 12 1HB LYS 12 26.071 -0.749 8.344
101 HB3 LYS 12 2HB LYS 12 26.709 -2.387 8.202
102 HG2 LYS 12 1HG LYS 12 28.882 -1.621 9.090
103 HG3 LYS 12 2HG LYS 12 28.246 0.020 9.230
104 HD2 LYS 12 1HD LYS 12 26.514 -0.781 10.794
105 HD3 LYS 12 2HD LYS 12 27.138 -2.423 10.650
106 HE2 LYS 12 1HE LYS 12 29.307 -1.686 11.558
107 HE3 LYS 12 2HE LYS 12 28.701 -0.034 11.682
108 HZ1 LYS 12 1HZ LYS 12 28.604 -1.514 13.746
109 HZ2 LYS 12 2HZ LYS 12 27.289 -2.275 12.986
110 HZ3 LYS 12 3HZ LYS 12 27.218 -0.616 13.346
111 H CYS 13 H CYS 13 26.963 -3.389 6.232
112 HA CYS 13 HA CYS 13 25.409 -2.685 3.809
113 HB2 CYS 13 1HB CYS 13 26.609 -5.347 4.644
114 HB3 CYS 13 2HB CYS 13 25.959 -4.944 3.074
115 H LYS 14 H LYS 14 23.346 -2.777 3.874
116 HA LYS 14 HA LYS 14 21.730 -3.350 5.934
117 HB2 LYS 14 1HB LYS 14 20.682 -2.372 4.104
118 HB3 LYS 14 2HB LYS 14 21.287 -3.578 2.977
119 HG2 LYS 14 1HG LYS 14 19.741 -5.238 3.841
120 HG3 LYS 14 2HG LYS 14 19.253 -4.160 5.150
121 HD2 LYS 14 1HD LYS 14 18.356 -2.566 3.482
122 HD3 LYS 14 2HD LYS 14 18.836 -3.662 2.185
123 HE2 LYS 14 1HE LYS 14 16.986 -4.480 4.440
124 HE3 LYS 14 2HE LYS 14 16.404 -3.849 2.900
125 HZ1 LYS 14 1HZ LYS 14 16.912 -6.441 3.400
126 HZ2 LYS 14 2HZ LYS 14 18.360 -5.953 2.659
127 HZ3 LYS 14 3HZ LYS 14 16.881 -5.745 1.851
128 H GLU 15 H GLU 15 20.186 -5.150 6.317
129 HA GLU 15 HA GLU 15 21.272 -7.393 7.201
130 HB2 GLU 15 1HB GLU 15 18.597 -6.733 6.130
131 HB3 GLU 15 2HB GLU 15 18.918 -8.460 6.225
132 HG2 GLU 15 1HG GLU 15 17.874 -7.641 8.289
133 HG3 GLU 15 2HG GLU 15 19.502 -8.240 8.597
134 H ASN 16 H ASN 16 22.748 -8.635 6.345
135 HA ASN 16 HA ASN 16 23.700 -10.262 5.040
136 HB2 ASN 16 1HB ASN 16 21.029 -10.553 3.668
137 HB3 ASN 16 2HB ASN 16 22.280 -11.774 3.892
138 HD21 ASN 16 1HD2 ASN 16 19.620 -12.268 4.767
139 HD22 ASN 16 2HD2 ASN 16 19.582 -12.273 6.464
140 H GLU 17 H GLU 17 24.128 -7.676 4.187
141 HA GLU 17 HA GLU 17 24.042 -7.929 1.235
142 HB2 GLU 17 1HB GLU 17 23.955 -5.533 3.064
143 HB3 GLU 17 2HB GLU 17 24.320 -5.396 1.350
144 HG2 GLU 17 1HG GLU 17 21.995 -6.957 1.459
145 HG3 GLU 17 2HG GLU 17 21.754 -5.818 2.746
146 H LYS 18 H LYS 18 25.821 -7.712 0.052
147 HA LYS 18 HA LYS 18 28.337 -8.061 1.395
148 HB2 LYS 18 1HB LYS 18 27.260 -8.336 -1.333
149 HB3 LYS 18 2HB LYS 18 28.942 -7.831 -1.288
150 HG2 LYS 18 1HG LYS 18 28.886 -10.232 -1.371
151 HG3 LYS 18 2HG LYS 18 29.425 -9.760 0.237
152 HD2 LYS 18 1HD LYS 18 26.943 -9.951 0.926
153 HD3 LYS 18 2HD LYS 18 26.712 -10.788 -0.607
154 HE2 LYS 18 1HE LYS 18 28.249 -11.655 1.817
155 HE3 LYS 18 2HE LYS 18 27.187 -12.598 0.773
156 HZ1 LYS 18 1HZ LYS 18 28.972 -12.188 -0.991
157 HZ2 LYS 18 2HZ LYS 18 29.296 -13.330 0.223
158 HZ3 LYS 18 3HZ LYS 18 29.982 -11.778 0.312
159 HA PRO 19 HA PRO 19 29.317 -3.625 1.069
160 HB2 PRO 19 1HB PRO 19 32.130 -4.355 1.540
161 HB3 PRO 19 2HB PRO 19 31.073 -3.330 2.504
162 HG2 PRO 19 1HG PRO 19 31.892 -5.824 3.253
163 HG3 PRO 19 2HG PRO 19 30.414 -5.053 3.829
164 HD2 PRO 19 1HD PRO 19 30.743 -7.240 1.824
165 HD3 PRO 19 2HD PRO 19 29.394 -6.889 2.924
166 H ILE 20 H ILE 20 29.365 -2.775 -0.957
167 HA ILE 20 HA ILE 20 31.967 -3.094 -2.281
168 HB ILE 20 HB ILE 20 31.178 -3.660 -4.297
169 HG12 ILE 20 1HG1 ILE 20 28.309 -2.904 -4.023
170 HG13 ILE 20 2HG1 ILE 20 29.422 -1.580 -4.292
171 HG21 ILE 20 1HG2 ILE 20 29.257 -5.201 -4.119
172 HG22 ILE 20 2HG2 ILE 20 28.978 -4.646 -2.475
173 HG23 ILE 20 3HG2 ILE 20 30.491 -5.468 -2.879
174 HD11 ILE 20 1HD1 ILE 20 28.594 -2.447 -6.406
175 HD12 ILE 20 2HD1 ILE 20 29.211 -4.054 -6.010
176 HD13 ILE 20 3HD1 ILE 20 30.329 -2.715 -6.265
177 H GLY 21 H GLY 21 31.850 -1.550 -4.300
178 HA2 GLY 21 1HA GLY 21 32.227 0.666 -4.920
179 HA3 GLY 21 2HA GLY 21 30.506 0.698 -4.556
180 H TYR 22 H TYR 22 31.498 3.041 -4.300
181 HA TYR 22 HA TYR 22 32.249 3.453 -1.467
182 HB2 TYR 22 1HB TYR 22 33.973 3.771 -3.537
183 HB3 TYR 22 2HB TYR 22 33.277 5.387 -3.475
184 HD1 TYR 22 HD1 TYR 22 33.511 6.780 -1.451
185 HD2 TYR 22 HD2 TYR 22 35.234 2.854 -1.653
186 HE1 TYR 22 HE1 TYR 22 34.890 7.283 0.549
187 HE2 TYR 22 HE2 TYR 22 36.611 3.353 0.348
188 HH TYR 22 HH TYR 22 37.480 5.924 1.381
189 H CYS 23 H CYS 23 31.533 5.433 -0.550
190 HA CYS 23 HA CYS 23 29.649 7.078 -2.000
191 HB2 CYS 23 1HB CYS 23 28.721 5.119 0.077
192 HB3 CYS 23 2HB CYS 23 27.885 6.662 -0.123
193 H ARG 24 H ARG 24 28.514 8.447 0.061
194 HA ARG 24 HA ARG 24 30.759 10.176 0.536
195 HB2 ARG 24 1HB ARG 24 29.068 11.736 1.342
196 HB3 ARG 24 2HB ARG 24 28.471 10.958 -0.125
197 HG2 ARG 24 1HG ARG 24 27.301 9.274 1.357
198 HG3 ARG 24 2HG ARG 24 27.737 10.276 2.739
199 HD2 ARG 24 1HD ARG 24 26.559 12.196 1.688
200 HD3 ARG 24 2HD ARG 24 26.046 11.130 0.382
201 HE ARG 24 HE ARG 24 24.551 10.081 1.851
202 HH11 ARG 24 1HH1 ARG 24 26.950 11.644 3.723
203 HH12 ARG 24 2HH1 ARG 24 25.917 11.968 5.075
204 HH21 ARG 24 1HH2 ARG 24 23.081 10.675 3.557
205 HH22 ARG 24 2HH2 ARG 24 23.726 11.422 4.980
206 H ASN 25 H ASN 25 31.146 11.212 2.622
207 HA ASN 25 HA ASN 25 32.045 10.911 4.739
208 HB2 ASN 25 1HB ASN 25 29.073 10.507 4.892
209 HB3 ASN 25 2HB ASN 25 30.043 10.409 6.358
210 HD21 ASN 25 1HD2 ASN 25 28.171 12.444 6.201
211 HD22 ASN 25 2HD2 ASN 25 28.993 13.930 6.079
212 H GLY 26 H GLY 26 32.826 8.752 3.412
213 HA2 GLY 26 1HA GLY 26 33.790 6.717 3.872
214 HA3 GLY 26 2HA GLY 26 33.343 6.979 5.557
215 H LYS 27 H LYS 27 31.115 6.826 2.824
216 HA LYS 27 HA LYS 27 29.857 4.415 4.012
217 HB2 LYS 27 1HB LYS 27 28.680 6.387 2.052
218 HB3 LYS 27 2HB LYS 27 27.826 5.116 2.910
219 HG2 LYS 27 1HG LYS 27 29.282 7.096 4.618
220 HG3 LYS 27 2HG LYS 27 27.884 7.707 3.746
221 HD2 LYS 27 1HD LYS 27 26.440 6.114 4.788
222 HD3 LYS 27 2HD LYS 27 27.812 5.225 5.468
223 HE2 LYS 27 1HE LYS 27 28.412 7.262 6.784
224 HE3 LYS 27 2HE LYS 27 26.968 8.058 6.157
225 HZ1 LYS 27 1HZ LYS 27 26.899 5.483 7.623
226 HZ2 LYS 27 2HZ LYS 27 25.585 6.480 7.216
227 HZ3 LYS 27 3HZ LYS 27 26.710 6.990 8.382
228 H LYS 28 H LYS 28 29.140 2.768 2.470
229 HA LYS 28 HA LYS 28 30.536 2.849 -0.145
230 HB2 LYS 28 1HB LYS 28 30.344 0.422 1.652
231 HB3 LYS 28 2HB LYS 28 31.226 0.554 0.134
232 HG2 LYS 28 1HG LYS 28 32.704 2.250 1.096
233 HG3 LYS 28 2HG LYS 28 31.817 2.195 2.613
234 HD2 LYS 28 1HD LYS 28 33.003 -0.341 1.506
235 HD3 LYS 28 2HD LYS 28 34.045 0.809 2.334
236 HE2 LYS 28 1HE LYS 28 31.473 -0.083 3.621
237 HE3 LYS 28 2HE LYS 28 32.920 -1.081 3.727
238 HZ1 LYS 28 1HZ LYS 28 32.855 1.791 4.459
239 HZ2 LYS 28 2HZ LYS 28 34.106 0.679 4.749
240 HZ3 LYS 28 3HZ LYS 28 32.630 0.532 5.576
241 H CYS 29 H CYS 29 29.441 1.655 -1.845
242 HA CYS 29 HA CYS 29 26.678 1.058 -1.310
243 HB2 CYS 29 1HB CYS 29 28.415 0.741 -3.757
244 HB3 CYS 29 2HB CYS 29 26.798 0.060 -3.691
245 H CYS 30 H CYS 30 26.217 -0.624 -0.145
246 HA CYS 30 HA CYS 30 27.679 -3.144 -0.493
247 HB2 CYS 30 1HB CYS 30 25.309 -2.467 1.273
248 HB3 CYS 30 2HB CYS 30 26.186 -3.996 1.225
249 H VAL 31 H VAL 31 27.164 -4.212 -2.283
250 HA VAL 31 HA VAL 31 24.463 -4.151 -3.357
251 HB VAL 31 HB VAL 31 27.078 -5.359 -4.157
252 HG11 VAL 31 1HG1 VAL 31 25.698 -6.284 -6.192
253 HG12 VAL 31 2HG1 VAL 31 24.367 -6.290 -5.025
254 HG13 VAL 31 3HG1 VAL 31 25.821 -7.225 -4.711
255 HG21 VAL 31 1HG2 VAL 31 26.191 -2.983 -4.747
256 HG22 VAL 31 2HG2 VAL 31 25.138 -3.818 -5.867
257 HG23 VAL 31 3HG2 VAL 31 26.883 -3.973 -6.039
258 H ASN 32 H ASN 32 22.931 -5.348 -2.692
259 HA ASN 32 HA ASN 32 22.972 -7.083 -0.607
260 HB2 ASN 32 1HB ASN 32 20.976 -6.086 -1.894
261 HB3 ASN 32 2HB ASN 32 21.090 -7.510 -2.925
262 HD21 ASN 32 1HD2 ASN 32 19.917 -6.334 0.109
263 HD22 ASN 32 2HD2 ASN 32 19.477 -7.831 0.779
Start of MODEL 14
1 H1 LYS 1 1H LYS 1 28.190 9.003 -8.754
2 H2 LYS 1 2H LYS 1 27.384 8.958 -7.259
3 H3 LYS 1 3H LYS 1 26.524 8.679 -8.697
4 HA LYS 1 HA LYS 1 27.735 6.643 -9.084
5 HB2 LYS 1 1HB LYS 1 29.124 7.465 -6.519
6 HB3 LYS 1 2HB LYS 1 29.237 5.848 -7.214
7 HG2 LYS 1 1HG LYS 1 30.193 6.758 -9.268
8 HG3 LYS 1 2HG LYS 1 29.981 8.404 -8.671
9 HD2 LYS 1 1HD LYS 1 31.509 7.888 -6.779
10 HD3 LYS 1 2HD LYS 1 31.756 6.272 -7.440
11 HE2 LYS 1 1HE LYS 1 32.718 7.197 -9.473
12 HE3 LYS 1 2HE LYS 1 32.351 8.839 -8.943
13 HZ1 LYS 1 1HZ LYS 1 33.743 8.072 -6.875
14 HZ2 LYS 1 2HZ LYS 1 34.501 8.672 -8.271
15 HZ3 LYS 1 3HZ LYS 1 34.421 6.997 -8.001
16 H LYS 2 H LYS 2 25.465 6.248 -8.877
17 HA LYS 2 HA LYS 2 24.248 5.907 -6.275
18 HB2 LYS 2 1HB LYS 2 23.255 4.959 -8.978
19 HB3 LYS 2 2HB LYS 2 22.297 5.195 -7.516
20 HG2 LYS 2 1HG LYS 2 22.735 7.596 -7.571
21 HG3 LYS 2 2HG LYS 2 23.803 7.397 -8.960
22 HD2 LYS 2 1HD LYS 2 21.783 6.353 -10.159
23 HD3 LYS 2 2HD LYS 2 20.808 6.983 -8.833
24 HE2 LYS 2 1HE LYS 2 21.467 9.250 -9.332
25 HE3 LYS 2 2HE LYS 2 22.660 8.702 -10.510
26 HZ1 LYS 2 1HZ LYS 2 20.553 9.480 -11.505
27 HZ2 LYS 2 2HZ LYS 2 19.748 8.194 -10.743
28 HZ3 LYS 2 3HZ LYS 2 20.941 7.877 -11.909
29 H CYS 3 H CYS 3 23.555 3.869 -5.395
30 HA CYS 3 HA CYS 3 25.471 1.762 -5.746
31 HB2 CYS 3 1HB CYS 3 22.799 1.581 -4.344
32 HB3 CYS 3 2HB CYS 3 24.173 0.489 -4.179
33 H TRP 4 H TRP 4 23.992 -0.525 -5.662
34 HA TRP 4 HA TRP 4 22.835 -0.694 -8.359
35 HB2 TRP 4 1HB TRP 4 24.951 -2.676 -7.685
36 HB3 TRP 4 2HB TRP 4 24.516 -2.000 -9.248
37 HD1 TRP 4 HD1 TRP 4 26.052 -0.693 -5.931
38 HE1 TRP 4 HE1 TRP 4 28.142 0.669 -6.514
39 HE3 TRP 4 HE3 TRP 4 26.011 -1.172 -11.008
40 HZ2 TRP 4 HZ2 TRP 4 29.808 1.097 -8.823
41 HZ3 TRP 4 HZ3 TRP 4 27.766 -0.097 -12.379
42 HH2 TRP 4 HH2 TRP 4 29.571 1.214 -11.304
43 H ASN 5 H ASN 5 22.136 -3.049 -8.756
44 HA ASN 5 HA ASN 5 20.597 -4.645 -8.109
45 HB2 ASN 5 1HB ASN 5 22.661 -5.011 -5.923
46 HB3 ASN 5 2HB ASN 5 21.484 -6.210 -6.455
47 HD21 ASN 5 1HD2 ASN 5 23.518 -4.007 -8.452
48 HD22 ASN 5 2HD2 ASN 5 24.253 -5.261 -9.329
49 H GLY 6 H GLY 6 19.924 -2.069 -7.121
50 HA2 GLY 6 1HA GLY 6 18.518 -1.067 -5.606
51 HA3 GLY 6 2HA GLY 6 17.931 -2.699 -5.279
52 H GLY 7 H GLY 7 21.183 -2.693 -4.685
53 HA2 GLY 7 1HA GLY 7 21.174 -2.917 -1.983
54 HA3 GLY 7 2HA GLY 7 22.565 -2.298 -2.874
55 H ARG 8 H ARG 8 22.673 -1.149 -0.616
56 HA ARG 8 HA ARG 8 21.593 1.562 -1.066
57 HB2 ARG 8 1HB ARG 8 21.144 1.712 1.380
58 HB3 ARG 8 2HB ARG 8 20.076 0.616 0.521
59 HG2 ARG 8 1HG ARG 8 20.847 -1.224 1.639
60 HG3 ARG 8 2HG ARG 8 22.520 -0.696 1.561
61 HD2 ARG 8 1HD ARG 8 21.850 -0.747 3.865
62 HD3 ARG 8 2HD ARG 8 22.055 0.932 3.385
63 HE ARG 8 HE ARG 8 19.626 1.122 3.249
64 HH11 ARG 8 1HH1 ARG 8 17.735 -0.485 3.489
65 HH12 ARG 8 2HH1 ARG 8 17.708 -1.289 5.022
66 HH21 ARG 8 1HH2 ARG 8 20.951 -0.386 5.850
67 HH22 ARG 8 2HH2 ARG 8 19.506 -1.174 6.387
68 H CYS 9 H CYS 9 22.628 3.121 0.556
69 HA CYS 9 HA CYS 9 25.509 2.507 0.848
70 HB2 CYS 9 1HB CYS 9 23.975 4.990 0.269
71 HB3 CYS 9 2HB CYS 9 25.418 5.163 1.260
72 H ARG 10 H ARG 10 26.137 2.020 2.856
73 HA ARG 10 HA ARG 10 25.382 3.768 5.035
74 HB2 ARG 10 1HB ARG 10 24.265 1.083 4.690
75 HB3 ARG 10 2HB ARG 10 25.050 1.264 6.249
76 HG2 ARG 10 1HG ARG 10 23.087 3.327 5.251
77 HG3 ARG 10 2HG ARG 10 22.548 1.867 6.075
78 HD2 ARG 10 1HD ARG 10 23.970 2.430 8.005
79 HD3 ARG 10 2HD ARG 10 24.517 3.889 7.186
80 HE ARG 10 HE ARG 10 21.661 3.435 7.857
81 HH11 ARG 10 1HH1 ARG 10 24.294 4.936 9.217
82 HH12 ARG 10 2HH1 ARG 10 23.615 6.528 9.261
83 HH21 ARG 10 1HH2 ARG 10 20.841 5.689 7.363
84 HH22 ARG 10 2HH2 ARG 10 21.675 6.961 8.192
85 H LYS 11 H LYS 11 26.718 3.386 6.972
86 HA LYS 11 HA LYS 11 29.432 2.824 6.411
87 HB2 LYS 11 1HB LYS 11 27.782 3.492 8.760
88 HB3 LYS 11 2HB LYS 11 29.180 2.505 9.162
89 HG2 LYS 11 1HG LYS 11 30.686 4.106 8.172
90 HG3 LYS 11 2HG LYS 11 29.340 5.045 7.536
91 HD2 LYS 11 1HD LYS 11 28.629 5.698 9.718
92 HD3 LYS 11 2HD LYS 11 29.687 4.520 10.490
93 HE2 LYS 11 1HE LYS 11 30.962 6.596 8.742
94 HE3 LYS 11 2HE LYS 11 30.382 7.087 10.332
95 HZ1 LYS 11 1HZ LYS 11 32.486 6.372 10.808
96 HZ2 LYS 11 2HZ LYS 11 32.465 5.136 9.643
97 HZ3 LYS 11 3HZ LYS 11 31.601 4.951 11.093
98 H LYS 12 H LYS 12 26.800 0.808 6.810
99 HA LYS 12 HA LYS 12 28.550 -1.559 6.911
100 HB2 LYS 12 1HB LYS 12 26.134 -1.030 8.628
101 HB3 LYS 12 2HB LYS 12 26.580 -2.676 8.195
102 HG2 LYS 12 1HG LYS 12 28.901 -2.156 9.119
103 HG3 LYS 12 2HG LYS 12 28.201 -0.678 9.780
104 HD2 LYS 12 1HD LYS 12 26.384 -2.263 10.779
105 HD3 LYS 12 2HD LYS 12 27.540 -3.548 10.441
106 HE2 LYS 12 1HE LYS 12 28.152 -1.079 12.091
107 HE3 LYS 12 2HE LYS 12 27.716 -2.649 12.764
108 HZ1 LYS 12 1HZ LYS 12 30.016 -2.220 10.942
109 HZ2 LYS 12 2HZ LYS 12 29.644 -3.629 11.815
110 HZ3 LYS 12 3HZ LYS 12 30.141 -2.229 12.635
111 H CYS 13 H CYS 13 27.175 -3.532 6.277
112 HA CYS 13 HA CYS 13 25.547 -2.789 3.910
113 HB2 CYS 13 1HB CYS 13 26.975 -5.397 4.521
114 HB3 CYS 13 2HB CYS 13 26.218 -4.948 3.014
115 H LYS 14 H LYS 14 23.491 -3.111 3.979
116 HA LYS 14 HA LYS 14 22.002 -3.873 6.094
117 HB2 LYS 14 1HB LYS 14 20.795 -2.916 4.360
118 HB3 LYS 14 2HB LYS 14 21.473 -3.991 3.146
119 HG2 LYS 14 1HG LYS 14 20.106 -5.839 3.961
120 HG3 LYS 14 2HG LYS 14 19.557 -4.871 5.329
121 HD2 LYS 14 1HD LYS 14 18.510 -3.275 3.764
122 HD3 LYS 14 2HD LYS 14 19.046 -4.255 2.406
123 HE2 LYS 14 1HE LYS 14 17.500 -5.738 4.462
124 HE3 LYS 14 2HE LYS 14 16.595 -4.523 3.569
125 HZ1 LYS 14 1HZ LYS 14 17.995 -6.898 2.548
126 HZ2 LYS 14 2HZ LYS 14 17.728 -5.565 1.532
127 HZ3 LYS 14 3HZ LYS 14 16.411 -6.369 2.243
128 H GLU 15 H GLU 15 20.608 -5.818 6.431
129 HA GLU 15 HA GLU 15 21.931 -7.989 7.163
130 HB2 GLU 15 1HB GLU 15 19.171 -7.448 6.451
131 HB3 GLU 15 2HB GLU 15 19.558 -9.117 6.062
132 HG2 GLU 15 1HG GLU 15 20.481 -9.371 8.386
133 HG3 GLU 15 2HG GLU 15 19.869 -7.757 8.746
134 H ASN 16 H ASN 16 23.480 -9.055 6.174
135 HA ASN 16 HA ASN 16 24.443 -10.608 4.785
136 HB2 ASN 16 1HB ASN 16 21.712 -10.911 3.524
137 HB3 ASN 16 2HB ASN 16 23.038 -12.072 3.505
138 HD21 ASN 16 1HD2 ASN 16 20.471 -12.786 4.546
139 HD22 ASN 16 2HD2 ASN 16 20.599 -12.993 6.226
140 H GLU 17 H GLU 17 24.651 -7.911 4.073
141 HA GLU 17 HA GLU 17 24.524 -8.014 1.112
142 HB2 GLU 17 1HB GLU 17 24.269 -5.734 3.070
143 HB3 GLU 17 2HB GLU 17 24.564 -5.475 1.358
144 HG2 GLU 17 1HG GLU 17 22.396 -7.275 1.479
145 HG3 GLU 17 2HG GLU 17 22.092 -6.176 2.789
146 H LYS 18 H LYS 18 26.229 -7.509 -0.092
147 HA LYS 18 HA LYS 18 28.816 -7.734 1.211
148 HB2 LYS 18 1HB LYS 18 28.048 -7.622 -1.712
149 HB3 LYS 18 2HB LYS 18 29.666 -7.958 -1.096
150 HG2 LYS 18 1HG LYS 18 27.192 -9.603 -0.485
151 HG3 LYS 18 2HG LYS 18 28.414 -10.023 -1.679
152 HD2 LYS 18 1HD LYS 18 30.057 -9.716 0.409
153 HD3 LYS 18 2HD LYS 18 28.588 -10.052 1.319
154 HE2 LYS 18 1HE LYS 18 29.569 -12.174 0.986
155 HE3 LYS 18 2HE LYS 18 28.316 -12.088 -0.253
156 HZ1 LYS 18 1HZ LYS 18 30.176 -11.105 -1.693
157 HZ2 LYS 18 2HZ LYS 18 30.173 -12.781 -1.420
158 HZ3 LYS 18 3HZ LYS 18 31.233 -11.780 -0.550
159 HA PRO 19 HA PRO 19 29.430 -3.265 0.916
160 HB2 PRO 19 1HB PRO 19 32.331 -3.820 1.018
161 HB3 PRO 19 2HB PRO 19 31.340 -2.863 2.114
162 HG2 PRO 19 1HG PRO 19 32.372 -5.367 2.659
163 HG3 PRO 19 2HG PRO 19 31.036 -4.605 3.518
164 HD2 PRO 19 1HD PRO 19 30.967 -6.868 1.643
165 HD3 PRO 19 2HD PRO 19 29.719 -6.309 2.768
166 H ILE 20 H ILE 20 29.266 -2.279 -1.025
167 HA ILE 20 HA ILE 20 31.495 -2.659 -2.885
168 HB ILE 20 HB ILE 20 29.255 -3.973 -3.339
169 HG12 ILE 20 1HG1 ILE 20 30.476 -2.483 -5.630
170 HG13 ILE 20 2HG1 ILE 20 31.365 -3.744 -4.786
171 HG21 ILE 20 1HG2 ILE 20 27.505 -2.481 -3.565
172 HG22 ILE 20 2HG2 ILE 20 28.030 -2.565 -5.224
173 HG23 ILE 20 3HG2 ILE 20 28.506 -1.202 -4.249
174 HD11 ILE 20 1HD1 ILE 20 28.737 -4.034 -6.254
175 HD12 ILE 20 2HD1 ILE 20 29.430 -5.304 -5.244
176 HD13 ILE 20 3HD1 ILE 20 30.282 -4.763 -6.689
177 H GLY 21 H GLY 21 31.127 -1.022 -4.829
178 HA2 GLY 21 1HA GLY 21 31.568 1.185 -5.320
179 HA3 GLY 21 2HA GLY 21 29.899 1.363 -4.834
180 H TYR 22 H TYR 22 30.753 3.580 -4.315
181 HA TYR 22 HA TYR 22 31.753 3.668 -1.545
182 HB2 TYR 22 1HB TYR 22 33.444 4.060 -3.623
183 HB3 TYR 22 2HB TYR 22 32.848 5.704 -3.428
184 HD1 TYR 22 HD1 TYR 22 33.326 6.986 -1.395
185 HD2 TYR 22 HD2 TYR 22 34.720 2.952 -1.877
186 HE1 TYR 22 HE1 TYR 22 34.751 7.235 0.620
187 HE2 TYR 22 HE2 TYR 22 36.244 3.248 0.055
188 HH TYR 22 HH TYR 22 37.277 5.088 1.335
189 H CYS 23 H CYS 23 31.285 5.592 -0.425
190 HA CYS 23 HA CYS 23 29.263 7.381 -1.518
191 HB2 CYS 23 1HB CYS 23 28.568 5.049 0.053
192 HB3 CYS 23 2HB CYS 23 28.121 6.521 0.909
193 H ARG 24 H ARG 24 28.420 8.571 0.727
194 HA ARG 24 HA ARG 24 30.712 10.231 1.257
195 HB2 ARG 24 1HB ARG 24 28.922 11.465 2.666
196 HB3 ARG 24 2HB ARG 24 28.642 11.353 0.928
197 HG2 ARG 24 1HG ARG 24 27.059 9.616 1.171
198 HG3 ARG 24 2HG ARG 24 27.581 9.241 2.812
199 HD2 ARG 24 1HD ARG 24 26.699 11.405 3.590
200 HD3 ARG 24 2HD ARG 24 26.184 11.787 1.947
201 HE ARG 24 HE ARG 24 24.300 10.536 2.397
202 HH11 ARG 24 1HH1 ARG 24 24.812 7.868 2.274
203 HH12 ARG 24 2HH1 ARG 24 24.779 7.260 3.895
204 HH21 ARG 24 1HH2 ARG 24 25.338 10.356 5.350
205 HH22 ARG 24 2HH2 ARG 24 25.043 8.675 5.638
206 H ASN 25 H ASN 25 31.332 10.942 3.341
207 HA ASN 25 HA ASN 25 32.360 10.381 5.355
208 HB2 ASN 25 1HB ASN 25 29.379 10.266 5.820
209 HB3 ASN 25 2HB ASN 25 30.564 10.269 7.128
210 HD21 ASN 25 1HD2 ASN 25 28.509 12.368 6.149
211 HD22 ASN 25 2HD2 ASN 25 29.439 13.790 6.044
212 H GLY 26 H GLY 26 32.704 8.121 3.965
213 HA2 GLY 26 1HA GLY 26 33.636 6.111 4.754
214 HA3 GLY 26 2HA GLY 26 32.591 6.196 6.171
215 H LYS 27 H LYS 27 30.200 6.745 4.457
216 HA LYS 27 HA LYS 27 29.435 4.017 4.395
217 HB2 LYS 27 1HB LYS 27 27.726 6.058 3.032
218 HB3 LYS 27 2HB LYS 27 27.271 4.739 4.079
219 HG2 LYS 27 1HG LYS 27 28.764 6.359 5.784
220 HG3 LYS 27 2HG LYS 27 27.982 7.530 4.741
221 HD2 LYS 27 1HD LYS 27 25.789 6.554 5.259
222 HD3 LYS 27 2HD LYS 27 26.571 5.330 6.267
223 HE2 LYS 27 1HE LYS 27 27.423 7.036 7.771
224 HE3 LYS 27 2HE LYS 27 26.784 8.315 6.740
225 HZ1 LYS 27 1HZ LYS 27 25.086 8.132 8.217
226 HZ2 LYS 27 2HZ LYS 27 25.376 6.489 8.540
227 HZ3 LYS 27 3HZ LYS 27 24.579 6.947 7.112
228 H LYS 28 H LYS 28 29.201 2.618 2.787
229 HA LYS 28 HA LYS 28 30.109 3.408 0.074
230 HB2 LYS 28 1HB LYS 28 30.433 0.652 1.224
231 HB3 LYS 28 2HB LYS 28 31.249 1.383 -0.157
232 HG2 LYS 28 1HG LYS 28 32.209 3.088 1.510
233 HG3 LYS 28 2HG LYS 28 31.645 2.000 2.776
234 HD2 LYS 28 1HD LYS 28 32.977 0.165 1.762
235 HD3 LYS 28 2HD LYS 28 33.573 1.294 0.545
236 HE2 LYS 28 1HE LYS 28 34.478 2.727 2.388
237 HE3 LYS 28 2HE LYS 28 33.985 1.490 3.543
238 HZ1 LYS 28 1HZ LYS 28 36.280 1.570 1.877
239 HZ2 LYS 28 2HZ LYS 28 35.383 0.158 1.584
240 HZ3 LYS 28 3HZ LYS 28 35.919 0.513 3.157
241 H CYS 29 H CYS 29 29.230 1.864 -1.653
242 HA CYS 29 HA CYS 29 26.391 1.385 -1.130
243 HB2 CYS 29 1HB CYS 29 28.163 1.079 -3.560
244 HB3 CYS 29 2HB CYS 29 26.524 0.452 -3.548
245 H CYS 30 H CYS 30 25.907 -0.513 -0.067
246 HA CYS 30 HA CYS 30 27.659 -2.855 -0.555
247 HB2 CYS 30 1HB CYS 30 25.322 -2.492 1.350
248 HB3 CYS 30 2HB CYS 30 26.321 -3.936 1.174
249 H VAL 31 H VAL 31 27.189 -3.965 -2.285
250 HA VAL 31 HA VAL 31 24.481 -4.029 -3.341
251 HB VAL 31 HB VAL 31 27.194 -4.757 -4.269
252 HG11 VAL 31 1HG1 VAL 31 26.341 -6.984 -4.484
253 HG12 VAL 31 2HG1 VAL 31 26.229 -6.255 -6.084
254 HG13 VAL 31 3HG1 VAL 31 24.787 -6.402 -5.080
255 HG21 VAL 31 1HG2 VAL 31 25.720 -2.811 -5.017
256 HG22 VAL 31 2HG2 VAL 31 24.730 -4.010 -5.840
257 HG23 VAL 31 3HG2 VAL 31 26.416 -3.798 -6.313
258 H ASN 32 H ASN 32 23.033 -5.325 -2.664
259 HA ASN 32 HA ASN 32 23.310 -7.099 -0.617
260 HB2 ASN 32 1HB ASN 32 21.207 -6.123 -1.929
261 HB3 ASN 32 2HB ASN 32 21.228 -7.705 -2.694
262 HD21 ASN 32 1HD2 ASN 32 19.799 -6.101 -0.197
263 HD22 ASN 32 2HD2 ASN 32 19.624 -7.355 0.931
Start of MODEL 15
1 H1 LYS 1 1H LYS 1 20.705 9.078 -5.722
2 H2 LYS 1 2H LYS 1 19.303 8.378 -5.066
3 H3 LYS 1 3H LYS 1 19.921 7.814 -6.544
4 HA LYS 1 HA LYS 1 21.471 7.668 -4.025
5 HB2 LYS 1 1HB LYS 1 19.665 5.572 -5.273
6 HB3 LYS 1 2HB LYS 1 20.742 5.305 -3.902
7 HG2 LYS 1 1HG LYS 1 19.510 7.063 -2.635
8 HG3 LYS 1 2HG LYS 1 18.402 7.235 -3.997
9 HD2 LYS 1 1HD LYS 1 17.785 4.845 -3.783
10 HD3 LYS 1 2HD LYS 1 18.867 4.697 -2.401
11 HE2 LYS 1 1HE LYS 1 16.772 5.061 -1.400
12 HE3 LYS 1 2HE LYS 1 17.492 6.669 -1.397
13 HZ1 LYS 1 1HZ LYS 1 15.214 5.678 -2.849
14 HZ2 LYS 1 2HZ LYS 1 16.301 6.552 -3.816
15 HZ3 LYS 1 3HZ LYS 1 15.627 7.271 -2.434
16 H LYS 2 H LYS 2 23.305 6.294 -4.288
17 HA LYS 2 HA LYS 2 24.038 5.660 -7.096
18 HB2 LYS 2 1HB LYS 2 25.906 6.731 -4.974
19 HB3 LYS 2 2HB LYS 2 26.294 6.382 -6.649
20 HG2 LYS 2 1HG LYS 2 25.792 8.542 -7.130
21 HG3 LYS 2 2HG LYS 2 24.112 8.151 -6.824
22 HD2 LYS 2 1HD LYS 2 24.667 10.051 -5.489
23 HD3 LYS 2 2HD LYS 2 24.492 8.680 -4.403
24 HE2 LYS 2 1HE LYS 2 26.676 8.827 -3.742
25 HE3 LYS 2 2HE LYS 2 27.257 9.033 -5.391
26 HZ1 LYS 2 1HZ LYS 2 26.039 11.133 -3.691
27 HZ2 LYS 2 2HZ LYS 2 26.507 11.341 -5.310
28 HZ3 LYS 2 3HZ LYS 2 27.676 11.004 -4.125
29 H CYS 3 H CYS 3 23.892 3.494 -7.055
30 HA CYS 3 HA CYS 3 25.993 1.995 -5.944
31 HB2 CYS 3 1HB CYS 3 23.311 1.675 -4.588
32 HB3 CYS 3 2HB CYS 3 24.537 0.416 -4.567
33 H TRP 4 H TRP 4 24.923 -0.518 -5.947
34 HA TRP 4 HA TRP 4 24.101 -0.803 -8.774
35 HB2 TRP 4 1HB TRP 4 25.882 -2.889 -7.668
36 HB3 TRP 4 2HB TRP 4 25.892 -2.141 -9.256
37 HD1 TRP 4 HD1 TRP 4 26.646 -0.946 -5.638
38 HE1 TRP 4 HE1 TRP 4 28.896 0.272 -5.659
39 HE3 TRP 4 HE3 TRP 4 27.858 -1.466 -10.563
40 HZ2 TRP 4 HZ2 TRP 4 31.113 0.606 -7.463
41 HZ3 TRP 4 HZ3 TRP 4 30.000 -0.577 -11.420
42 HH2 TRP 4 HH2 TRP 4 31.554 0.626 -9.915
43 H ASN 5 H ASN 5 23.275 -3.078 -9.178
44 HA ASN 5 HA ASN 5 21.541 -4.549 -8.720
45 HB2 ASN 5 1HB ASN 5 23.222 -5.117 -6.274
46 HB3 ASN 5 2HB ASN 5 22.181 -6.235 -7.153
47 HD21 ASN 5 1HD2 ASN 5 24.633 -7.253 -6.976
48 HD22 ASN 5 2HD2 ASN 5 25.502 -7.066 -8.422
49 H GLY 6 H GLY 6 21.079 -1.895 -7.642
50 HA2 GLY 6 1HA GLY 6 19.442 -0.888 -6.386
51 HA3 GLY 6 2HA GLY 6 18.801 -2.500 -6.067
52 H GLY 7 H GLY 7 21.937 -2.656 -5.108
53 HA2 GLY 7 1HA GLY 7 21.560 -2.712 -2.407
54 HA3 GLY 7 2HA GLY 7 23.111 -2.300 -3.143
55 H ARG 8 H ARG 8 22.969 -1.021 -0.915
56 HA ARG 8 HA ARG 8 22.106 1.725 -1.609
57 HB2 ARG 8 1HB ARG 8 21.451 2.046 0.746
58 HB3 ARG 8 2HB ARG 8 20.467 0.823 -0.053
59 HG2 ARG 8 1HG ARG 8 21.595 -0.963 1.020
60 HG3 ARG 8 2HG ARG 8 22.917 0.062 1.559
61 HD2 ARG 8 1HD ARG 8 21.610 -0.214 3.492
62 HD3 ARG 8 2HD ARG 8 21.096 1.353 2.889
63 HE ARG 8 HE ARG 8 19.464 -0.756 1.846
64 HH11 ARG 8 1HH1 ARG 8 19.966 -0.653 5.027
65 HH12 ARG 8 2HH1 ARG 8 18.438 0.006 5.506
66 HH21 ARG 8 1HH2 ARG 8 17.489 0.839 2.276
67 HH22 ARG 8 2HH2 ARG 8 17.031 0.844 3.947
68 H CYS 9 H CYS 9 23.054 3.265 0.179
69 HA CYS 9 HA CYS 9 25.907 2.586 0.593
70 HB2 CYS 9 1HB CYS 9 24.478 5.175 0.089
71 HB3 CYS 9 2HB CYS 9 26.020 5.173 0.942
72 H ARG 10 H ARG 10 26.414 2.063 2.626
73 HA ARG 10 HA ARG 10 25.719 3.919 4.729
74 HB2 ARG 10 1HB ARG 10 24.279 1.437 4.391
75 HB3 ARG 10 2HB ARG 10 25.164 1.372 5.903
76 HG2 ARG 10 1HG ARG 10 23.451 3.750 5.163
77 HG3 ARG 10 2HG ARG 10 22.801 2.337 5.989
78 HD2 ARG 10 1HD ARG 10 24.328 2.624 7.835
79 HD3 ARG 10 2HD ARG 10 25.189 3.908 6.997
80 HE ARG 10 HE ARG 10 22.555 4.110 8.273
81 HH11 ARG 10 1HH1 ARG 10 23.119 6.223 9.418
82 HH12 ARG 10 2HH1 ARG 10 23.414 7.548 8.343
83 HH21 ARG 10 1HH2 ARG 10 23.888 5.522 5.565
84 HH22 ARG 10 2HH2 ARG 10 23.797 7.152 6.144
85 H LYS 11 H LYS 11 27.005 3.521 6.708
86 HA LYS 11 HA LYS 11 29.661 2.690 6.207
87 HB2 LYS 11 1HB LYS 11 28.109 3.146 8.751
88 HB3 LYS 11 2HB LYS 11 29.763 2.546 8.793
89 HG2 LYS 11 1HG LYS 11 30.444 4.529 7.402
90 HG3 LYS 11 2HG LYS 11 28.803 5.153 7.594
91 HD2 LYS 11 1HD LYS 11 29.098 5.040 10.073
92 HD3 LYS 11 2HD LYS 11 30.773 4.552 9.819
93 HE2 LYS 11 1HE LYS 11 29.491 7.164 8.963
94 HE3 LYS 11 2HE LYS 11 30.722 6.947 10.207
95 HZ1 LYS 11 1HZ LYS 11 32.314 6.341 8.605
96 HZ2 LYS 11 2HZ LYS 11 31.537 7.716 7.981
97 HZ3 LYS 11 3HZ LYS 11 31.150 6.177 7.380
98 H LYS 12 H LYS 12 26.815 0.950 6.728
99 HA LYS 12 HA LYS 12 28.332 -1.571 6.976
100 HB2 LYS 12 1HB LYS 12 26.887 -2.452 8.586
101 HB3 LYS 12 2HB LYS 12 27.144 -0.802 9.138
102 HG2 LYS 12 1HG LYS 12 25.012 -0.144 7.994
103 HG3 LYS 12 2HG LYS 12 24.736 -1.845 7.619
104 HD2 LYS 12 1HD LYS 12 24.967 -2.312 10.109
105 HD3 LYS 12 2HD LYS 12 24.878 -0.567 10.350
106 HE2 LYS 12 1HE LYS 12 22.692 -0.473 9.302
107 HE3 LYS 12 2HE LYS 12 22.791 -2.175 8.846
108 HZ1 LYS 12 1HZ LYS 12 21.646 -2.419 10.749
109 HZ2 LYS 12 2HZ LYS 12 22.232 -0.981 11.437
110 HZ3 LYS 12 3HZ LYS 12 23.194 -2.380 11.445
111 H CYS 13 H CYS 13 26.802 -3.441 6.361
112 HA CYS 13 HA CYS 13 25.369 -2.649 3.890
113 HB2 CYS 13 1HB CYS 13 26.531 -5.344 4.663
114 HB3 CYS 13 2HB CYS 13 25.897 -4.879 3.101
115 H LYS 14 H LYS 14 23.317 -2.769 3.803
116 HA LYS 14 HA LYS 14 21.556 -3.293 5.777
117 HB2 LYS 14 1HB LYS 14 20.678 -2.304 3.861
118 HB3 LYS 14 2HB LYS 14 21.329 -3.540 2.795
119 HG2 LYS 14 1HG LYS 14 19.674 -5.141 3.569
120 HG3 LYS 14 2HG LYS 14 19.122 -4.025 4.819
121 HD2 LYS 14 1HD LYS 14 18.473 -2.419 3.006
122 HD3 LYS 14 2HD LYS 14 18.918 -3.642 1.815
123 HE2 LYS 14 1HE LYS 14 17.251 -5.181 2.729
124 HE3 LYS 14 2HE LYS 14 16.847 -4.025 3.999
125 HZ1 LYS 14 1HZ LYS 14 15.986 -2.519 2.431
126 HZ2 LYS 14 2HZ LYS 14 15.343 -4.032 2.005
127 HZ3 LYS 14 3HZ LYS 14 16.633 -3.377 1.116
128 H GLU 15 H GLU 15 19.944 -5.092 6.009
129 HA GLU 15 HA GLU 15 20.836 -7.385 6.937
130 HB2 GLU 15 1HB GLU 15 18.404 -7.027 5.190
131 HB3 GLU 15 2HB GLU 15 18.738 -8.528 6.052
132 HG2 GLU 15 1HG GLU 15 18.842 -7.242 8.183
133 HG3 GLU 15 2HG GLU 15 18.409 -5.782 7.296
134 H ASN 16 H ASN 16 22.461 -8.579 6.211
135 HA ASN 16 HA ASN 16 23.564 -10.174 4.984
136 HB2 ASN 16 1HB ASN 16 20.954 -10.507 3.496
137 HB3 ASN 16 2HB ASN 16 22.248 -11.692 3.663
138 HD21 ASN 16 1HD2 ASN 16 22.822 -11.529 6.412
139 HD22 ASN 16 2HD2 ASN 16 21.463 -12.055 7.282
140 H GLU 17 H GLU 17 24.108 -7.668 4.149
141 HA GLU 17 HA GLU 17 24.140 -7.874 1.187
142 HB2 GLU 17 1HB GLU 17 23.901 -5.491 3.027
143 HB3 GLU 17 2HB GLU 17 24.326 -5.342 1.326
144 HG2 GLU 17 1HG GLU 17 22.034 -6.967 1.370
145 HG3 GLU 17 2HG GLU 17 21.718 -5.788 2.607
146 H LYS 18 H LYS 18 26.021 -7.519 0.118
147 HA LYS 18 HA LYS 18 28.426 -7.821 1.731
148 HB2 LYS 18 1HB LYS 18 27.624 -8.318 -1.077
149 HB3 LYS 18 2HB LYS 18 29.307 -7.858 -0.849
150 HG2 LYS 18 1HG LYS 18 29.020 -10.294 -0.795
151 HG3 LYS 18 2HG LYS 18 29.622 -9.685 0.742
152 HD2 LYS 18 1HD LYS 18 27.533 -9.978 1.812
153 HD3 LYS 18 2HD LYS 18 26.664 -10.076 0.281
154 HE2 LYS 18 1HE LYS 18 27.561 -12.246 -0.192
155 HE3 LYS 18 2HE LYS 18 28.727 -12.123 1.124
156 HZ1 LYS 18 1HZ LYS 18 26.336 -13.324 1.313
157 HZ2 LYS 18 2HZ LYS 18 25.972 -11.779 1.919
158 HZ3 LYS 18 3HZ LYS 18 27.204 -12.704 2.634
159 HA PRO 19 HA PRO 19 29.423 -3.437 1.244
160 HB2 PRO 19 1HB PRO 19 32.248 -4.225 1.600
161 HB3 PRO 19 2HB PRO 19 31.271 -3.119 2.558
162 HG2 PRO 19 1HG PRO 19 32.033 -5.656 3.331
163 HG3 PRO 19 2HG PRO 19 30.703 -4.737 4.031
164 HD2 PRO 19 1HD PRO 19 30.592 -7.101 2.286
165 HD3 PRO 19 2HD PRO 19 29.312 -6.374 3.271
166 H ILE 20 H ILE 20 29.463 -2.562 -0.752
167 HA ILE 20 HA ILE 20 31.837 -3.148 -2.359
168 HB ILE 20 HB ILE 20 29.581 -4.381 -2.944
169 HG12 ILE 20 1HG1 ILE 20 31.058 -3.127 -5.224
170 HG13 ILE 20 2HG1 ILE 20 31.845 -4.317 -4.199
171 HG21 ILE 20 1HG2 ILE 20 27.940 -2.844 -3.457
172 HG22 ILE 20 2HG2 ILE 20 28.640 -3.054 -5.042
173 HG23 ILE 20 3HG2 ILE 20 29.065 -1.651 -4.103
174 HD11 ILE 20 1HD1 ILE 20 29.334 -4.703 -5.845
175 HD12 ILE 20 2HD1 ILE 20 29.926 -5.887 -4.680
176 HD13 ILE 20 3HD1 ILE 20 30.896 -5.483 -6.096
177 H GLY 21 H GLY 21 31.706 -1.661 -4.438
178 HA2 GLY 21 1HA GLY 21 32.318 0.476 -5.052
179 HA3 GLY 21 2HA GLY 21 30.620 0.760 -4.745
180 H TYR 22 H TYR 22 31.493 2.970 -4.317
181 HA TYR 22 HA TYR 22 32.334 3.257 -1.498
182 HB2 TYR 22 1HB TYR 22 34.140 3.516 -3.439
183 HB3 TYR 22 2HB TYR 22 33.447 5.130 -3.556
184 HD1 TYR 22 HD1 TYR 22 35.399 2.810 -1.512
185 HD2 TYR 22 HD2 TYR 22 33.530 6.676 -1.599
186 HE1 TYR 22 HE1 TYR 22 36.714 3.490 0.477
187 HE2 TYR 22 HE2 TYR 22 34.790 7.331 0.432
188 HH TYR 22 HH TYR 22 36.544 5.080 2.324
189 H CYS 23 H CYS 23 31.891 5.381 -0.608
190 HA CYS 23 HA CYS 23 29.893 7.023 -1.904
191 HB2 CYS 23 1HB CYS 23 29.075 4.731 -0.444
192 HB3 CYS 23 2HB CYS 23 28.693 6.122 0.562
193 H ARG 24 H ARG 24 28.883 8.364 0.237
194 HA ARG 24 HA ARG 24 31.182 10.025 0.727
195 HB2 ARG 24 1HB ARG 24 28.224 10.208 1.111
196 HB3 ARG 24 2HB ARG 24 29.214 11.268 2.106
197 HG2 ARG 24 1HG ARG 24 28.518 12.347 -0.006
198 HG3 ARG 24 2HG ARG 24 30.269 12.219 0.138
199 HD2 ARG 24 1HD ARG 24 30.406 10.530 -1.474
200 HD3 ARG 24 2HD ARG 24 28.727 10.048 -1.264
201 HE ARG 24 HE ARG 24 28.115 12.209 -2.347
202 HH11 ARG 24 1HH1 ARG 24 31.467 11.946 -2.434
203 HH12 ARG 24 2HH1 ARG 24 31.622 12.243 -4.133
204 HH21 ARG 24 1HH2 ARG 24 28.206 12.229 -4.712
205 HH22 ARG 24 2HH2 ARG 24 29.776 12.385 -5.427
206 H ASN 25 H ASN 25 31.707 10.906 2.782
207 HA ASN 25 HA ASN 25 32.705 10.432 4.836
208 HB2 ASN 25 1HB ASN 25 29.729 10.650 5.084
209 HB3 ASN 25 2HB ASN 25 30.681 10.352 6.535
210 HD21 ASN 25 1HD2 ASN 25 29.583 12.805 4.422
211 HD22 ASN 25 2HD2 ASN 25 30.519 14.066 5.075
212 H GLY 26 H GLY 26 33.039 8.131 3.584
213 HA2 GLY 26 1HA GLY 26 33.994 6.191 4.512
214 HA3 GLY 26 2HA GLY 26 32.939 6.361 5.915
215 H LYS 27 H LYS 27 30.574 6.778 4.116
216 HA LYS 27 HA LYS 27 29.790 4.063 4.261
217 HB2 LYS 27 1HB LYS 27 28.131 6.029 2.721
218 HB3 LYS 27 2HB LYS 27 27.643 4.810 3.885
219 HG2 LYS 27 1HG LYS 27 28.972 6.312 5.594
220 HG3 LYS 27 2HG LYS 27 28.795 7.550 4.358
221 HD2 LYS 27 1HD LYS 27 26.371 7.300 4.376
222 HD3 LYS 27 2HD LYS 27 26.493 5.989 5.555
223 HE2 LYS 27 1HE LYS 27 27.550 7.537 7.162
224 HE3 LYS 27 2HE LYS 27 27.414 8.847 5.990
225 HZ1 LYS 27 1HZ LYS 27 24.920 8.077 5.997
226 HZ2 LYS 27 2HZ LYS 27 25.506 9.163 7.165
227 HZ3 LYS 27 3HZ LYS 27 25.323 7.518 7.549
228 H LYS 28 H LYS 28 29.466 2.544 2.735
229 HA LYS 28 HA LYS 28 30.627 3.078 0.060
230 HB2 LYS 28 1HB LYS 28 30.629 0.365 1.360
231 HB3 LYS 28 2HB LYS 28 31.657 0.985 0.070
232 HG2 LYS 28 1HG LYS 28 32.704 2.561 1.678
233 HG3 LYS 28 2HG LYS 28 31.709 1.885 2.968
234 HD2 LYS 28 1HD LYS 28 32.705 -0.351 2.522
235 HD3 LYS 28 2HD LYS 28 33.761 0.384 1.316
236 HE2 LYS 28 1HE LYS 28 34.695 1.884 3.053
237 HE3 LYS 28 2HE LYS 28 33.666 1.114 4.260
238 HZ1 LYS 28 1HZ LYS 28 34.997 -0.658 4.372
239 HZ2 LYS 28 2HZ LYS 28 36.163 0.325 3.625
240 HZ3 LYS 28 3HZ LYS 28 35.220 -0.734 2.690
241 H CYS 29 H CYS 29 29.748 1.548 -1.645
242 HA CYS 29 HA CYS 29 26.880 1.231 -1.301
243 HB2 CYS 29 1HB CYS 29 28.820 0.777 -3.552
244 HB3 CYS 29 2HB CYS 29 27.192 0.120 -3.660
245 H CYS 30 H CYS 30 26.161 -0.566 -0.200
246 HA CYS 30 HA CYS 30 27.792 -3.032 -0.377
247 HB2 CYS 30 1HB CYS 30 25.327 -2.331 1.256
248 HB3 CYS 30 2HB CYS 30 26.136 -3.894 1.249
249 H VAL 31 H VAL 31 27.440 -4.187 -2.105
250 HA VAL 31 HA VAL 31 24.843 -4.200 -3.422
251 HB VAL 31 HB VAL 31 27.594 -5.104 -4.054
252 HG11 VAL 31 1HG1 VAL 31 26.715 -6.655 -5.869
253 HG12 VAL 31 2HG1 VAL 31 25.181 -6.666 -5.000
254 HG13 VAL 31 3HG1 VAL 31 26.638 -7.294 -4.229
255 HG21 VAL 31 1HG2 VAL 31 26.307 -3.137 -5.058
256 HG22 VAL 31 2HG2 VAL 31 25.340 -4.330 -5.910
257 HG23 VAL 31 3HG2 VAL 31 27.070 -4.242 -6.214
258 H ASN 32 H ASN 32 23.293 -5.429 -2.839
259 HA ASN 32 HA ASN 32 23.102 -6.929 -0.648
260 HB2 ASN 32 1HB ASN 32 21.256 -6.321 -2.265
261 HB3 ASN 32 2HB ASN 32 21.713 -7.738 -3.210
262 HD21 ASN 32 1HD2 ASN 32 20.186 -6.675 -0.209
263 HD22 ASN 32 2HD2 ASN 32 19.726 -8.217 0.326
Start of MODEL 16
1 H1 LYS 1 1H LYS 1 28.044 6.028 -8.848
2 H2 LYS 1 2H LYS 1 28.755 7.312 -9.699
3 H3 LYS 1 3H LYS 1 27.122 6.922 -9.959
4 HA LYS 1 HA LYS 1 28.281 7.971 -7.435
5 HB2 LYS 1 1HB LYS 1 26.217 9.361 -9.127
6 HB3 LYS 1 2HB LYS 1 27.374 10.051 -7.991
7 HG2 LYS 1 1HG LYS 1 29.214 9.357 -9.569
8 HG3 LYS 1 2HG LYS 1 27.969 8.880 -10.723
9 HD2 LYS 1 1HD LYS 1 27.044 11.271 -10.447
10 HD3 LYS 1 2HD LYS 1 28.581 11.646 -9.668
11 HE2 LYS 1 1HE LYS 1 28.050 10.846 -12.519
12 HE3 LYS 1 2HE LYS 1 29.028 12.178 -11.905
13 HZ1 LYS 1 1HZ LYS 1 30.429 10.269 -10.890
14 HZ2 LYS 1 2HZ LYS 1 30.616 10.666 -12.531
15 HZ3 LYS 1 3HZ LYS 1 29.684 9.318 -12.085
16 H LYS 2 H LYS 2 26.476 5.615 -8.408
17 HA LYS 2 HA LYS 2 24.408 5.954 -6.346
18 HB2 LYS 2 1HB LYS 2 22.633 5.289 -7.839
19 HB3 LYS 2 2HB LYS 2 23.454 6.675 -8.557
20 HG2 LYS 2 1HG LYS 2 24.901 4.895 -9.789
21 HG3 LYS 2 2HG LYS 2 23.627 3.765 -9.337
22 HD2 LYS 2 1HD LYS 2 23.199 6.340 -10.882
23 HD3 LYS 2 2HD LYS 2 23.267 4.730 -11.597
24 HE2 LYS 2 1HE LYS 2 21.359 4.081 -10.054
25 HE3 LYS 2 2HE LYS 2 21.214 5.788 -9.638
26 HZ1 LYS 2 1HZ LYS 2 21.343 5.229 -12.471
27 HZ2 LYS 2 2HZ LYS 2 20.323 6.284 -11.616
28 HZ3 LYS 2 3HZ LYS 2 19.957 4.627 -11.696
29 H CYS 3 H CYS 3 23.477 3.907 -5.676
30 HA CYS 3 HA CYS 3 25.455 1.778 -5.783
31 HB2 CYS 3 1HB CYS 3 22.743 1.739 -4.452
32 HB3 CYS 3 2HB CYS 3 24.054 0.580 -4.237
33 H TRP 4 H TRP 4 23.950 -0.461 -5.678
34 HA TRP 4 HA TRP 4 22.830 -0.707 -8.387
35 HB2 TRP 4 1HB TRP 4 24.910 -2.689 -7.635
36 HB3 TRP 4 2HB TRP 4 24.537 -2.013 -9.213
37 HD1 TRP 4 HD1 TRP 4 25.965 -0.668 -5.855
38 HE1 TRP 4 HE1 TRP 4 28.076 0.679 -6.384
39 HE3 TRP 4 HE3 TRP 4 26.169 -1.320 -10.910
40 HZ2 TRP 4 HZ2 TRP 4 29.847 1.070 -8.611
41 HZ3 TRP 4 HZ3 TRP 4 28.037 -0.363 -12.215
42 HH2 TRP 4 HH2 TRP 4 29.802 0.962 -11.096
43 H ASN 5 H ASN 5 22.143 -3.085 -8.718
44 HA ASN 5 HA ASN 5 20.598 -4.665 -8.033
45 HB2 ASN 5 1HB ASN 5 22.664 -5.029 -5.852
46 HB3 ASN 5 2HB ASN 5 21.522 -6.239 -6.439
47 HD21 ASN 5 1HD2 ASN 5 24.145 -6.996 -6.599
48 HD22 ASN 5 2HD2 ASN 5 24.744 -6.867 -8.182
49 H GLY 6 H GLY 6 20.035 -2.039 -6.977
50 HA2 GLY 6 1HA GLY 6 18.551 -1.092 -5.504
51 HA3 GLY 6 2HA GLY 6 18.044 -2.736 -5.114
52 H GLY 7 H GLY 7 21.265 -2.722 -4.554
53 HA2 GLY 7 1HA GLY 7 21.254 -2.790 -1.839
54 HA3 GLY 7 2HA GLY 7 22.670 -2.288 -2.766
55 H ARG 8 H ARG 8 22.647 -1.077 -0.446
56 HA ARG 8 HA ARG 8 21.672 1.657 -1.024
57 HB2 ARG 8 1HB ARG 8 21.156 1.905 1.384
58 HB3 ARG 8 2HB ARG 8 20.112 0.749 0.571
59 HG2 ARG 8 1HG ARG 8 20.986 -1.063 1.701
60 HG3 ARG 8 2HG ARG 8 22.593 -0.363 1.822
61 HD2 ARG 8 1HD ARG 8 21.594 -0.467 4.029
62 HD3 ARG 8 2HD ARG 8 21.750 1.217 3.543
63 HE ARG 8 HE ARG 8 19.173 0.014 2.952
64 HH11 ARG 8 1HH1 ARG 8 21.160 1.537 5.336
65 HH12 ARG 8 2HH1 ARG 8 19.823 2.084 6.294
66 HH21 ARG 8 1HH2 ARG 8 17.425 1.004 4.035
67 HH22 ARG 8 2HH2 ARG 8 17.715 1.873 5.505
68 H CYS 9 H CYS 9 22.638 3.146 0.815
69 HA CYS 9 HA CYS 9 25.544 2.613 0.958
70 HB2 CYS 9 1HB CYS 9 23.925 5.144 0.848
71 HB3 CYS 9 2HB CYS 9 25.565 5.151 1.492
72 H ARG 10 H ARG 10 26.279 2.000 2.893
73 HA ARG 10 HA ARG 10 25.570 3.549 5.236
74 HB2 ARG 10 1HB ARG 10 24.377 0.963 4.676
75 HB3 ARG 10 2HB ARG 10 25.318 0.866 6.150
76 HG2 ARG 10 1HG ARG 10 23.315 3.074 5.651
77 HG3 ARG 10 2HG ARG 10 22.868 1.540 6.393
78 HD2 ARG 10 1HD ARG 10 24.732 1.972 8.088
79 HD3 ARG 10 2HD ARG 10 24.817 3.603 7.437
80 HE ARG 10 HE ARG 10 22.418 3.833 8.069
81 HH11 ARG 10 1HH1 ARG 10 24.799 2.331 9.965
82 HH12 ARG 10 2HH1 ARG 10 23.731 1.862 11.245
83 HH21 ARG 10 1HH2 ARG 10 20.866 2.907 9.602
84 HH22 ARG 10 2HH2 ARG 10 21.514 2.243 11.064
85 H LYS 11 H LYS 11 27.066 3.180 7.014
86 HA LYS 11 HA LYS 11 29.721 2.569 6.273
87 HB2 LYS 11 1HB LYS 11 28.374 2.688 8.976
88 HB3 LYS 11 2HB LYS 11 30.099 2.382 8.779
89 HG2 LYS 11 1HG LYS 11 30.237 4.520 7.440
90 HG3 LYS 11 2HG LYS 11 28.564 4.833 7.889
91 HD2 LYS 11 1HD LYS 11 30.604 4.266 10.034
92 HD3 LYS 11 2HD LYS 11 30.509 5.870 9.318
93 HE2 LYS 11 1HE LYS 11 28.271 6.185 10.040
94 HE3 LYS 11 2HE LYS 11 28.064 4.478 10.422
95 HZ1 LYS 11 1HZ LYS 11 30.269 5.410 11.851
96 HZ2 LYS 11 2HZ LYS 11 28.768 4.896 12.459
97 HZ3 LYS 11 3HZ LYS 11 29.014 6.533 12.077
98 H LYS 12 H LYS 12 27.054 0.618 6.934
99 HA LYS 12 HA LYS 12 28.731 -1.820 6.884
100 HB2 LYS 12 1HB LYS 12 26.279 -1.301 8.580
101 HB3 LYS 12 2HB LYS 12 26.983 -2.898 8.328
102 HG2 LYS 12 1HG LYS 12 29.175 -1.937 9.191
103 HG3 LYS 12 2HG LYS 12 28.264 -0.509 9.675
104 HD2 LYS 12 1HD LYS 12 27.609 -3.337 10.554
105 HD3 LYS 12 2HD LYS 12 28.525 -2.184 11.523
106 HE2 LYS 12 1HE LYS 12 26.503 -0.605 11.222
107 HE3 LYS 12 2HE LYS 12 25.628 -2.037 10.680
108 HZ1 LYS 12 1HZ LYS 12 25.233 -1.992 12.939
109 HZ2 LYS 12 2HZ LYS 12 26.812 -1.497 13.322
110 HZ3 LYS 12 3HZ LYS 12 26.521 -3.091 12.812
111 H CYS 13 H CYS 13 27.191 -3.741 6.329
112 HA CYS 13 HA CYS 13 25.644 -2.890 3.945
113 HB2 CYS 13 1HB CYS 13 26.976 -5.558 4.497
114 HB3 CYS 13 2HB CYS 13 26.210 -5.058 3.010
115 H LYS 14 H LYS 14 23.618 -3.134 3.914
116 HA LYS 14 HA LYS 14 21.989 -3.796 5.967
117 HB2 LYS 14 1HB LYS 14 21.008 -2.740 4.125
118 HB3 LYS 14 2HB LYS 14 21.598 -3.949 2.992
119 HG2 LYS 14 1HG LYS 14 20.015 -5.583 3.812
120 HG3 LYS 14 2HG LYS 14 19.541 -4.526 5.144
121 HD2 LYS 14 1HD LYS 14 18.707 -2.866 3.491
122 HD3 LYS 14 2HD LYS 14 19.139 -3.972 2.186
123 HE2 LYS 14 1HE LYS 14 17.195 -4.589 4.433
124 HE3 LYS 14 2HE LYS 14 16.736 -4.159 2.787
125 HZ1 LYS 14 1HZ LYS 14 18.248 -6.552 3.673
126 HZ2 LYS 14 2HZ LYS 14 18.083 -6.102 2.044
127 HZ3 LYS 14 3HZ LYS 14 16.710 -6.512 2.957
128 H GLU 15 H GLU 15 20.467 -5.619 6.223
129 HA GLU 15 HA GLU 15 21.346 -7.939 7.028
130 HB2 GLU 15 1HB GLU 15 18.947 -7.571 5.226
131 HB3 GLU 15 2HB GLU 15 19.270 -9.053 6.128
132 HG2 GLU 15 1HG GLU 15 19.112 -6.324 7.429
133 HG3 GLU 15 2HG GLU 15 17.727 -7.406 7.294
134 H ASN 16 H ASN 16 23.095 -8.946 6.227
135 HA ASN 16 HA ASN 16 24.273 -10.444 4.951
136 HB2 ASN 16 1HB ASN 16 21.680 -11.000 3.510
137 HB3 ASN 16 2HB ASN 16 23.053 -12.084 3.728
138 HD21 ASN 16 1HD2 ASN 16 21.017 -13.397 4.630
139 HD22 ASN 16 2HD2 ASN 16 20.791 -13.274 6.308
140 H GLU 17 H GLU 17 24.607 -7.912 4.095
141 HA GLU 17 HA GLU 17 24.496 -8.113 1.139
142 HB2 GLU 17 1HB GLU 17 24.219 -5.767 3.020
143 HB3 GLU 17 2HB GLU 17 24.550 -5.557 1.307
144 HG2 GLU 17 1HG GLU 17 22.369 -7.333 1.425
145 HG3 GLU 17 2HG GLU 17 22.041 -6.204 2.703
146 H LYS 18 H LYS 18 26.230 -7.415 -0.071
147 HA LYS 18 HA LYS 18 28.778 -7.717 1.332
148 HB2 LYS 18 1HB LYS 18 28.056 -7.794 -1.599
149 HB3 LYS 18 2HB LYS 18 29.698 -7.919 -0.989
150 HG2 LYS 18 1HG LYS 18 29.178 -10.165 -1.125
151 HG3 LYS 18 2HG LYS 18 28.636 -9.857 0.518
152 HD2 LYS 18 1HD LYS 18 26.337 -9.372 -0.478
153 HD3 LYS 18 2HD LYS 18 26.960 -10.027 -1.991
154 HE2 LYS 18 1HE LYS 18 26.015 -11.929 -1.031
155 HE3 LYS 18 2HE LYS 18 27.670 -12.066 -0.446
156 HZ1 LYS 18 1HZ LYS 18 26.767 -10.640 1.499
157 HZ2 LYS 18 2HZ LYS 18 26.454 -12.308 1.470
158 HZ3 LYS 18 3HZ LYS 18 25.251 -11.211 0.991
159 HA PRO 19 HA PRO 19 29.496 -3.310 0.946
160 HB2 PRO 19 1HB PRO 19 32.393 -3.821 0.974
161 HB3 PRO 19 2HB PRO 19 31.411 -2.934 2.129
162 HG2 PRO 19 1HG PRO 19 32.501 -5.480 2.487
163 HG3 PRO 19 2HG PRO 19 31.284 -4.714 3.499
164 HD2 PRO 19 1HD PRO 19 30.957 -6.953 1.671
165 HD3 PRO 19 2HD PRO 19 29.779 -6.274 2.802
166 H ILE 20 H ILE 20 29.302 -2.284 -0.970
167 HA ILE 20 HA ILE 20 31.504 -2.635 -2.863
168 HB ILE 20 HB ILE 20 29.255 -3.959 -3.280
169 HG12 ILE 20 1HG1 ILE 20 30.461 -2.513 -5.603
170 HG13 ILE 20 2HG1 ILE 20 31.362 -3.752 -4.740
171 HG21 ILE 20 1HG2 ILE 20 27.508 -2.473 -3.520
172 HG22 ILE 20 2HG2 ILE 20 28.033 -2.573 -5.178
173 HG23 ILE 20 3HG2 ILE 20 28.505 -1.198 -4.215
174 HD11 ILE 20 1HD1 ILE 20 28.709 -4.100 -6.154
175 HD12 ILE 20 2HD1 ILE 20 29.459 -5.342 -5.152
176 HD13 ILE 20 3HD1 ILE 20 30.255 -4.800 -6.627
177 H GLY 21 H GLY 21 31.048 -1.012 -4.816
178 HA2 GLY 21 1HA GLY 21 31.487 1.201 -5.313
179 HA3 GLY 21 2HA GLY 21 29.813 1.348 -4.833
180 H TYR 22 H TYR 22 30.529 3.571 -4.309
181 HA TYR 22 HA TYR 22 31.659 3.745 -1.588
182 HB2 TYR 22 1HB TYR 22 33.153 4.285 -3.802
183 HB3 TYR 22 2HB TYR 22 32.470 5.878 -3.497
184 HD1 TYR 22 HD1 TYR 22 33.067 7.140 -1.494
185 HD2 TYR 22 HD2 TYR 22 34.643 3.210 -2.211
186 HE1 TYR 22 HE1 TYR 22 34.619 7.413 0.420
187 HE2 TYR 22 HE2 TYR 22 36.303 3.548 -0.401
188 HH TYR 22 HH TYR 22 37.288 5.982 0.778
189 H CYS 23 H CYS 23 31.176 5.743 -0.494
190 HA CYS 23 HA CYS 23 29.019 7.389 -1.487
191 HB2 CYS 23 1HB CYS 23 28.392 4.962 -0.147
192 HB3 CYS 23 2HB CYS 23 28.032 6.265 0.979
193 H ARG 24 H ARG 24 28.116 8.503 0.812
194 HA ARG 24 HA ARG 24 30.352 10.252 1.266
195 HB2 ARG 24 1HB ARG 24 27.504 10.234 2.292
196 HB3 ARG 24 2HB ARG 24 28.668 11.495 2.691
197 HG2 ARG 24 1HG ARG 24 28.952 11.998 0.293
198 HG3 ARG 24 2HG ARG 24 27.795 10.729 -0.111
199 HD2 ARG 24 1HD ARG 24 27.154 13.079 1.691
200 HD3 ARG 24 2HD ARG 24 26.803 13.054 -0.035
201 HE ARG 24 HE ARG 24 25.659 10.751 0.986
202 HH11 ARG 24 1HH1 ARG 24 24.840 13.857 0.163
203 HH12 ARG 24 2HH1 ARG 24 23.360 13.898 1.064
204 HH21 ARG 24 1HH2 ARG 24 24.064 11.019 2.861
205 HH22 ARG 24 2HH2 ARG 24 22.984 12.362 2.681
206 H ASN 25 H ASN 25 30.985 11.019 3.331
207 HA ASN 25 HA ASN 25 32.147 10.509 5.287
208 HB2 ASN 25 1HB ASN 25 29.206 10.176 5.880
209 HB3 ASN 25 2HB ASN 25 30.442 10.241 7.135
210 HD21 ASN 25 1HD2 ASN 25 28.322 12.226 6.765
211 HD22 ASN 25 2HD2 ASN 25 29.080 13.702 6.384
212 H GLY 26 H GLY 26 32.588 8.308 3.847
213 HA2 GLY 26 1HA GLY 26 33.669 6.339 4.511
214 HA3 GLY 26 2HA GLY 26 32.737 6.347 6.008
215 H LYS 27 H LYS 27 30.202 6.785 4.406
216 HA LYS 27 HA LYS 27 29.565 4.012 4.416
217 HB2 LYS 27 1HB LYS 27 27.679 5.982 3.181
218 HB3 LYS 27 2HB LYS 27 27.357 4.655 4.283
219 HG2 LYS 27 1HG LYS 27 28.755 6.115 5.983
220 HG3 LYS 27 2HG LYS 27 28.381 7.422 4.872
221 HD2 LYS 27 1HD LYS 27 25.994 7.024 5.106
222 HD3 LYS 27 2HD LYS 27 26.301 5.621 6.135
223 HE2 LYS 27 1HE LYS 27 27.298 7.007 7.844
224 HE3 LYS 27 2HE LYS 27 27.249 8.424 6.795
225 HZ1 LYS 27 1HZ LYS 27 25.393 8.675 8.131
226 HZ2 LYS 27 2HZ LYS 27 25.014 7.019 8.112
227 HZ3 LYS 27 3HZ LYS 27 24.741 7.969 6.731
228 H LYS 28 H LYS 28 29.206 2.610 2.801
229 HA LYS 28 HA LYS 28 30.096 3.419 0.092
230 HB2 LYS 28 1HB LYS 28 30.420 0.626 1.146
231 HB3 LYS 28 2HB LYS 28 31.332 1.460 -0.110
232 HG2 LYS 28 1HG LYS 28 32.273 2.978 1.641
233 HG3 LYS 28 2HG LYS 28 31.433 2.037 2.870
234 HD2 LYS 28 1HD LYS 28 32.666 0.013 2.156
235 HD3 LYS 28 2HD LYS 28 33.534 0.977 0.960
236 HE2 LYS 28 1HE LYS 28 34.229 2.484 2.931
237 HE3 LYS 28 2HE LYS 28 33.663 1.179 3.972
238 HZ1 LYS 28 1HZ LYS 28 35.354 -0.167 3.365
239 HZ2 LYS 28 2HZ LYS 28 36.134 1.312 3.067
240 HZ3 LYS 28 3HZ LYS 28 35.441 0.445 1.783
241 H CYS 29 H CYS 29 29.238 1.787 -1.616
242 HA CYS 29 HA CYS 29 26.369 1.386 -1.082
243 HB2 CYS 29 1HB CYS 29 28.093 1.031 -3.543
244 HB3 CYS 29 2HB CYS 29 26.438 0.453 -3.485
245 H CYS 30 H CYS 30 25.935 -0.506 0.016
246 HA CYS 30 HA CYS 30 27.689 -2.840 -0.466
247 HB2 CYS 30 1HB CYS 30 25.380 -2.347 1.446
248 HB3 CYS 30 2HB CYS 30 26.207 -3.889 1.254
249 H VAL 31 H VAL 31 27.230 -3.966 -2.213
250 HA VAL 31 HA VAL 31 24.520 -4.030 -3.272
251 HB VAL 31 HB VAL 31 27.232 -4.694 -4.231
252 HG11 VAL 31 1HG1 VAL 31 24.869 -6.405 -5.031
253 HG12 VAL 31 2HG1 VAL 31 26.442 -6.944 -4.448
254 HG13 VAL 31 3HG1 VAL 31 26.298 -6.212 -6.044
255 HG21 VAL 31 1HG2 VAL 31 25.720 -2.787 -4.964
256 HG22 VAL 31 2HG2 VAL 31 24.729 -3.999 -5.766
257 HG23 VAL 31 3HG2 VAL 31 26.401 -3.765 -6.272
258 H ASN 32 H ASN 32 23.087 -5.347 -2.586
259 HA ASN 32 HA ASN 32 23.404 -7.218 -0.626
260 HB2 ASN 32 1HB ASN 32 21.241 -6.244 -1.598
261 HB3 ASN 32 2HB ASN 32 21.325 -7.541 -2.788
262 HD21 ASN 32 1HD2 ASN 32 19.272 -7.242 -0.678
263 HD22 ASN 32 2HD2 ASN 32 19.389 -8.626 0.297
Start of MODEL 17
1 H1 LYS 1 1H LYS 1 27.211 8.847 -6.647
2 H2 LYS 1 2H LYS 1 27.163 8.259 -8.239
3 H3 LYS 1 3H LYS 1 26.607 7.291 -6.959
4 HA LYS 1 HA LYS 1 25.251 9.785 -6.988
5 HB2 LYS 1 1HB LYS 1 25.247 8.107 -9.509
6 HB3 LYS 1 2HB LYS 1 23.969 9.255 -9.112
7 HG2 LYS 1 1HG LYS 1 25.644 11.071 -8.986
8 HG3 LYS 1 2HG LYS 1 26.916 9.920 -9.397
9 HD2 LYS 1 1HD LYS 1 25.855 9.473 -11.557
10 HD3 LYS 1 2HD LYS 1 24.513 10.541 -11.143
11 HE2 LYS 1 1HE LYS 1 26.092 12.442 -10.976
12 HE3 LYS 1 2HE LYS 1 27.421 11.370 -11.418
13 HZ1 LYS 1 1HZ LYS 1 25.569 10.928 -13.353
14 HZ2 LYS 1 2HZ LYS 1 26.934 11.926 -13.502
15 HZ3 LYS 1 3HZ LYS 1 25.434 12.599 -13.080
16 H LYS 2 H LYS 2 24.994 6.366 -7.972
17 HA LYS 2 HA LYS 2 23.041 5.884 -5.831
18 HB2 LYS 2 1HB LYS 2 21.460 4.841 -7.358
19 HB3 LYS 2 2HB LYS 2 21.741 6.507 -7.863
20 HG2 LYS 2 1HG LYS 2 23.562 5.539 -9.415
21 HG3 LYS 2 2HG LYS 2 22.832 3.968 -9.087
22 HD2 LYS 2 1HD LYS 2 21.314 6.365 -10.160
23 HD3 LYS 2 2HD LYS 2 21.947 5.060 -11.161
24 HE2 LYS 2 1HE LYS 2 20.616 3.461 -9.676
25 HE3 LYS 2 2HE LYS 2 19.814 4.891 -9.024
26 HZ1 LYS 2 1HZ LYS 2 19.815 3.927 -11.823
27 HZ2 LYS 2 2HZ LYS 2 19.308 5.489 -11.393
28 HZ3 LYS 2 3HZ LYS 2 18.484 4.133 -10.789
29 H CYS 3 H CYS 3 22.944 3.707 -5.180
30 HA CYS 3 HA CYS 3 25.331 2.187 -5.755
31 HB2 CYS 3 1HB CYS 3 22.882 1.501 -4.114
32 HB3 CYS 3 2HB CYS 3 24.326 0.495 -4.232
33 H TRP 4 H TRP 4 24.475 -0.397 -5.739
34 HA TRP 4 HA TRP 4 23.433 -0.614 -8.502
35 HB2 TRP 4 1HB TRP 4 25.546 -2.521 -7.655
36 HB3 TRP 4 2HB TRP 4 25.298 -1.740 -9.211
37 HD1 TRP 4 HD1 TRP 4 26.438 -0.836 -5.646
38 HE1 TRP 4 HE1 TRP 4 28.395 0.809 -5.803
39 HE3 TRP 4 HE3 TRP 4 26.881 -0.562 -10.700
40 HZ2 TRP 4 HZ2 TRP 4 30.250 1.647 -7.830
41 HZ3 TRP 4 HZ3 TRP 4 28.731 0.724 -11.720
42 HH2 TRP 4 HH2 TRP 4 30.331 1.965 -10.297
43 H ASN 5 H ASN 5 22.813 -2.915 -9.008
44 HA ASN 5 HA ASN 5 21.280 -4.596 -8.538
45 HB2 ASN 5 1HB ASN 5 23.422 -4.911 -6.429
46 HB3 ASN 5 2HB ASN 5 22.172 -6.122 -6.723
47 HD21 ASN 5 1HD2 ASN 5 25.130 -4.697 -7.980
48 HD22 ASN 5 2HD2 ASN 5 25.329 -5.792 -9.262
49 H GLY 6 H GLY 6 20.668 -2.017 -7.291
50 HA2 GLY 6 1HA GLY 6 18.930 -1.256 -6.002
51 HA3 GLY 6 2HA GLY 6 18.504 -2.935 -5.676
52 H GLY 7 H GLY 7 21.656 -2.747 -4.827
53 HA2 GLY 7 1HA GLY 7 21.308 -2.855 -2.092
54 HA3 GLY 7 2HA GLY 7 22.828 -2.400 -2.867
55 H ARG 8 H ARG 8 22.662 -1.133 -0.629
56 HA ARG 8 HA ARG 8 21.688 1.586 -1.299
57 HB2 ARG 8 1HB ARG 8 21.221 1.907 1.106
58 HB3 ARG 8 2HB ARG 8 20.208 0.662 0.383
59 HG2 ARG 8 1HG ARG 8 21.490 -1.095 1.359
60 HG3 ARG 8 2HG ARG 8 22.783 0.002 1.830
61 HD2 ARG 8 1HD ARG 8 21.549 -0.422 3.816
62 HD3 ARG 8 2HD ARG 8 21.061 1.186 3.299
63 HE ARG 8 HE ARG 8 19.325 -0.863 2.276
64 HH11 ARG 8 1HH1 ARG 8 19.904 1.484 4.728
65 HH12 ARG 8 2HH1 ARG 8 18.404 1.200 5.546
66 HH21 ARG 8 1HH2 ARG 8 17.504 -1.476 3.539
67 HH22 ARG 8 2HH2 ARG 8 17.070 -0.500 4.902
68 H CYS 9 H CYS 9 22.773 3.193 0.372
69 HA CYS 9 HA CYS 9 25.653 2.523 0.564
70 HB2 CYS 9 1HB CYS 9 24.195 5.060 0.062
71 HB3 CYS 9 2HB CYS 9 25.646 5.168 1.049
72 H ARG 10 H ARG 10 26.292 1.948 2.511
73 HA ARG 10 HA ARG 10 25.721 3.650 4.787
74 HB2 ARG 10 1HB ARG 10 24.840 0.768 4.708
75 HB3 ARG 10 2HB ARG 10 25.109 1.645 6.212
76 HG2 ARG 10 1HG ARG 10 23.469 3.406 5.231
77 HG3 ARG 10 2HG ARG 10 23.049 2.152 4.066
78 HD2 ARG 10 1HD ARG 10 22.487 0.614 5.902
79 HD3 ARG 10 2HD ARG 10 22.904 1.858 7.076
80 HE ARG 10 HE ARG 10 20.899 2.711 5.186
81 HH11 ARG 10 1HH1 ARG 10 19.652 3.944 6.947
82 HH12 ARG 10 2HH1 ARG 10 18.863 2.905 8.086
83 HH21 ARG 10 1HH2 ARG 10 20.694 0.098 7.200
84 HH22 ARG 10 2HH2 ARG 10 19.452 0.729 8.229
85 H LYS 11 H LYS 11 27.314 3.518 6.361
86 HA LYS 11 HA LYS 11 29.875 2.595 5.720
87 HB2 LYS 11 1HB LYS 11 30.329 2.853 8.164
88 HB3 LYS 11 2HB LYS 11 29.537 4.256 7.446
89 HG2 LYS 11 1HG LYS 11 27.328 3.285 8.209
90 HG3 LYS 11 2HG LYS 11 28.245 2.065 9.094
91 HD2 LYS 11 1HD LYS 11 29.375 3.821 10.386
92 HD3 LYS 11 2HD LYS 11 28.521 5.062 9.469
93 HE2 LYS 11 1HE LYS 11 26.356 3.888 10.272
94 HE3 LYS 11 2HE LYS 11 27.393 3.085 11.451
95 HZ1 LYS 11 1HZ LYS 11 27.053 4.902 12.673
96 HZ2 LYS 11 2HZ LYS 11 26.488 5.813 11.356
97 HZ3 LYS 11 3HZ LYS 11 28.157 5.669 11.635
98 H LYS 12 H LYS 12 27.158 0.836 6.446
99 HA LYS 12 HA LYS 12 28.757 -1.624 6.654
100 HB2 LYS 12 1HB LYS 12 26.892 -0.541 8.650
101 HB3 LYS 12 2HB LYS 12 26.451 -2.166 8.155
102 HG2 LYS 12 1HG LYS 12 28.606 -3.030 8.748
103 HG3 LYS 12 2HG LYS 12 29.241 -1.416 9.039
104 HD2 LYS 12 1HD LYS 12 26.819 -2.331 10.580
105 HD3 LYS 12 2HD LYS 12 28.404 -2.922 11.058
106 HE2 LYS 12 1HE LYS 12 29.190 -0.777 11.590
107 HE3 LYS 12 2HE LYS 12 27.950 0.028 10.631
108 HZ1 LYS 12 1HZ LYS 12 27.239 0.274 12.810
109 HZ2 LYS 12 2HZ LYS 12 27.677 -1.307 13.249
110 HZ3 LYS 12 3HZ LYS 12 26.327 -1.044 12.253
111 H CYS 13 H CYS 13 27.219 -3.542 6.248
112 HA CYS 13 HA CYS 13 25.567 -2.842 3.885
113 HB2 CYS 13 1HB CYS 13 26.853 -5.494 4.603
114 HB3 CYS 13 2HB CYS 13 26.139 -5.052 3.069
115 H LYS 14 H LYS 14 23.513 -3.010 4.007
116 HA LYS 14 HA LYS 14 21.989 -3.634 6.149
117 HB2 LYS 14 1HB LYS 14 20.848 -2.647 4.382
118 HB3 LYS 14 2HB LYS 14 21.456 -3.799 3.203
119 HG2 LYS 14 1HG LYS 14 19.994 -5.538 4.082
120 HG3 LYS 14 2HG LYS 14 19.500 -4.488 5.410
121 HD2 LYS 14 1HD LYS 14 18.288 -3.055 3.975
122 HD3 LYS 14 2HD LYS 14 19.099 -3.666 2.533
123 HE2 LYS 14 1HE LYS 14 16.678 -4.477 3.006
124 HE3 LYS 14 2HE LYS 14 17.884 -5.682 2.554
125 HZ1 LYS 14 1HZ LYS 14 17.078 -6.679 4.393
126 HZ2 LYS 14 2HZ LYS 14 16.579 -5.226 5.118
127 HZ3 LYS 14 3HZ LYS 14 18.214 -5.686 5.170
128 H GLU 15 H GLU 15 20.500 -5.477 6.526
129 HA GLU 15 HA GLU 15 21.577 -7.730 7.347
130 HB2 GLU 15 1HB GLU 15 18.960 -7.540 5.838
131 HB3 GLU 15 2HB GLU 15 19.434 -8.921 6.828
132 HG2 GLU 15 1HG GLU 15 19.601 -7.494 8.803
133 HG3 GLU 15 2HG GLU 15 19.254 -6.064 7.832
134 H ASN 16 H ASN 16 23.156 -8.866 6.425
135 HA ASN 16 HA ASN 16 24.165 -10.418 5.070
136 HB2 ASN 16 1HB ASN 16 21.470 -10.817 3.768
137 HB3 ASN 16 2HB ASN 16 22.787 -11.977 3.919
138 HD21 ASN 16 1HD2 ASN 16 19.836 -11.768 5.033
139 HD22 ASN 16 2HD2 ASN 16 20.027 -12.185 6.668
140 H GLU 17 H GLU 17 24.493 -7.831 4.220
141 HA GLU 17 HA GLU 17 24.244 -8.038 1.272
142 HB2 GLU 17 1HB GLU 17 24.147 -5.660 3.125
143 HB3 GLU 17 2HB GLU 17 24.433 -5.497 1.396
144 HG2 GLU 17 1HG GLU 17 22.171 -7.141 1.590
145 HG3 GLU 17 2HG GLU 17 21.950 -6.031 2.906
146 H LYS 18 H LYS 18 25.947 -7.678 0.000
147 HA LYS 18 HA LYS 18 28.533 -8.067 1.207
148 HB2 LYS 18 1HB LYS 18 27.984 -7.588 -1.713
149 HB3 LYS 18 2HB LYS 18 29.310 -8.489 -0.978
150 HG2 LYS 18 1HG LYS 18 26.378 -9.260 -0.978
151 HG3 LYS 18 2HG LYS 18 27.678 -10.064 -1.856
152 HD2 LYS 18 1HD LYS 18 28.776 -10.424 0.446
153 HD3 LYS 18 2HD LYS 18 27.214 -9.970 1.131
154 HE2 LYS 18 1HE LYS 18 26.107 -11.790 -0.003
155 HE3 LYS 18 2HE LYS 18 27.571 -12.187 -0.902
156 HZ1 LYS 18 1HZ LYS 18 27.965 -13.598 0.757
157 HZ2 LYS 18 2HZ LYS 18 26.835 -12.864 1.792
158 HZ3 LYS 18 3HZ LYS 18 28.407 -12.232 1.665
159 HA PRO 19 HA PRO 19 29.428 -3.592 1.041
160 HB2 PRO 19 1HB PRO 19 32.264 -4.332 1.383
161 HB3 PRO 19 2HB PRO 19 31.245 -3.330 2.414
162 HG2 PRO 19 1HG PRO 19 32.083 -5.842 3.070
163 HG3 PRO 19 2HG PRO 19 30.618 -5.092 3.707
164 HD2 PRO 19 1HD PRO 19 30.897 -7.223 1.637
165 HD3 PRO 19 2HD PRO 19 29.576 -6.906 2.779
166 H ILE 20 H ILE 20 29.390 -2.665 -0.933
167 HA ILE 20 HA ILE 20 31.934 -2.899 -2.373
168 HB ILE 20 HB ILE 20 31.080 -3.505 -4.343
169 HG12 ILE 20 1HG1 ILE 20 28.224 -2.742 -4.077
170 HG13 ILE 20 2HG1 ILE 20 29.314 -1.396 -4.286
171 HG21 ILE 20 1HG2 ILE 20 29.138 -5.013 -4.122
172 HG22 ILE 20 2HG2 ILE 20 28.906 -4.451 -2.474
173 HG23 ILE 20 3HG2 ILE 20 30.398 -5.293 -2.913
174 HD11 ILE 20 1HD1 ILE 20 29.193 -3.819 -6.080
175 HD12 ILE 20 2HD1 ILE 20 30.276 -2.444 -6.277
176 HD13 ILE 20 3HD1 ILE 20 28.536 -2.224 -6.445
177 H GLY 21 H GLY 21 31.668 -1.332 -4.373
178 HA2 GLY 21 1HA GLY 21 31.979 0.894 -4.978
179 HA3 GLY 21 2HA GLY 21 30.296 0.921 -4.488
180 H TYR 22 H TYR 22 31.373 3.267 -4.216
181 HA TYR 22 HA TYR 22 32.142 3.547 -1.370
182 HB2 TYR 22 1HB TYR 22 34.049 3.712 -3.139
183 HB3 TYR 22 2HB TYR 22 33.337 5.277 -3.529
184 HD1 TYR 22 HD1 TYR 22 35.227 3.337 -1.083
185 HD2 TYR 22 HD2 TYR 22 33.168 7.046 -1.755
186 HE1 TYR 22 HE1 TYR 22 36.316 4.304 0.923
187 HE2 TYR 22 HE2 TYR 22 34.231 8.000 0.272
188 HH TYR 22 HH TYR 22 35.301 7.102 2.403
189 H CYS 23 H CYS 23 31.620 5.543 -0.424
190 HA CYS 23 HA CYS 23 29.657 7.246 -1.742
191 HB2 CYS 23 1HB CYS 23 28.861 4.934 -0.281
192 HB3 CYS 23 2HB CYS 23 28.438 6.336 0.688
193 H ARG 24 H ARG 24 28.670 8.550 0.406
194 HA ARG 24 HA ARG 24 30.975 10.131 1.146
195 HB2 ARG 24 1HB ARG 24 29.025 11.444 2.349
196 HB3 ARG 24 2HB ARG 24 29.138 11.458 0.592
197 HG2 ARG 24 1HG ARG 24 27.438 9.823 0.351
198 HG3 ARG 24 2HG ARG 24 27.520 9.365 2.052
199 HD2 ARG 24 1HD ARG 24 25.538 10.751 1.623
200 HD3 ARG 24 2HD ARG 24 26.664 11.597 2.682
201 HE ARG 24 HE ARG 24 27.339 12.402 0.131
202 HH11 ARG 24 1HH1 ARG 24 26.612 14.508 1.923
203 HH12 ARG 24 2HH1 ARG 24 25.049 15.045 1.406
204 HH21 ARG 24 1HH2 ARG 24 24.384 12.178 -0.431
205 HH22 ARG 24 2HH2 ARG 24 23.786 13.724 0.071
206 H ASN 25 H ASN 25 31.304 10.887 3.339
207 HA ASN 25 HA ASN 25 32.045 10.285 5.454
208 HB2 ASN 25 1HB ASN 25 29.117 10.642 5.290
209 HB3 ASN 25 2HB ASN 25 29.675 9.923 6.796
210 HD21 ASN 25 1HD2 ASN 25 29.783 11.539 8.319
211 HD22 ASN 25 2HD2 ASN 25 30.466 13.077 8.058
212 H GLY 26 H GLY 26 32.560 8.105 4.048
213 HA2 GLY 26 1HA GLY 26 33.420 6.064 4.818
214 HA3 GLY 26 2HA GLY 26 32.335 6.155 6.205
215 H LYS 27 H LYS 27 30.070 6.796 4.307
216 HA LYS 27 HA LYS 27 29.109 4.138 4.221
217 HB2 LYS 27 1HB LYS 27 27.810 6.414 2.744
218 HB3 LYS 27 2HB LYS 27 27.062 5.057 3.572
219 HG2 LYS 27 1HG LYS 27 28.327 6.139 5.679
220 HG3 LYS 27 2HG LYS 27 28.246 7.585 4.683
221 HD2 LYS 27 1HD LYS 27 25.812 7.368 4.517
222 HD3 LYS 27 2HD LYS 27 25.876 5.863 5.445
223 HE2 LYS 27 1HE LYS 27 26.964 7.135 7.315
224 HE3 LYS 27 2HE LYS 27 26.680 8.621 6.411
225 HZ1 LYS 27 1HZ LYS 27 24.767 8.594 7.576
226 HZ2 LYS 27 2HZ LYS 27 24.796 6.913 7.821
227 HZ3 LYS 27 3HZ LYS 27 24.257 7.546 6.341
228 H LYS 28 H LYS 28 29.031 2.677 2.710
229 HA LYS 28 HA LYS 28 30.262 3.244 0.060
230 HB2 LYS 28 1HB LYS 28 30.343 0.716 1.716
231 HB3 LYS 28 2HB LYS 28 31.080 0.942 0.129
232 HG2 LYS 28 1HG LYS 28 32.436 2.808 1.041
233 HG3 LYS 28 2HG LYS 28 31.719 2.539 2.629
234 HD2 LYS 28 1HD LYS 28 32.588 0.100 2.353
235 HD3 LYS 28 2HD LYS 28 33.615 0.771 1.087
236 HE2 LYS 28 1HE LYS 28 33.582 1.478 4.025
237 HE3 LYS 28 2HE LYS 28 34.933 0.880 3.064
238 HZ1 LYS 28 1HZ LYS 28 35.350 2.907 2.216
239 HZ2 LYS 28 2HZ LYS 28 34.571 3.442 3.627
240 HZ3 LYS 28 3HZ LYS 28 33.714 3.362 2.164
241 H CYS 29 H CYS 29 29.362 1.777 -1.713
242 HA CYS 29 HA CYS 29 26.553 1.148 -1.219
243 HB2 CYS 29 1HB CYS 29 28.267 0.843 -3.686
244 HB3 CYS 29 2HB CYS 29 26.615 0.263 -3.585
245 H CYS 30 H CYS 30 26.226 -0.511 -0.017
246 HA CYS 30 HA CYS 30 27.695 -3.015 -0.394
247 HB2 CYS 30 1HB CYS 30 25.416 -2.187 1.425
248 HB3 CYS 30 2HB CYS 30 26.072 -3.816 1.349
249 H VAL 31 H VAL 31 27.140 -4.089 -2.209
250 HA VAL 31 HA VAL 31 24.407 -4.068 -3.183
251 HB VAL 31 HB VAL 31 26.996 -5.263 -4.069
252 HG11 VAL 31 1HG1 VAL 31 25.809 -7.083 -4.781
253 HG12 VAL 31 2HG1 VAL 31 25.451 -6.019 -6.132
254 HG13 VAL 31 3HG1 VAL 31 24.282 -6.220 -4.826
255 HG21 VAL 31 1HG2 VAL 31 26.018 -2.839 -4.543
256 HG22 VAL 31 2HG2 VAL 31 25.104 -3.681 -5.768
257 HG23 VAL 31 3HG2 VAL 31 26.863 -3.728 -5.812
258 H ASN 32 H ASN 32 22.913 -5.283 -2.511
259 HA ASN 32 HA ASN 32 23.119 -7.146 -0.491
260 HB2 ASN 32 1HB ASN 32 21.049 -5.925 -1.439
261 HB3 ASN 32 2HB ASN 32 20.938 -7.272 -2.570
262 HD21 ASN 32 1HD2 ASN 32 19.588 -6.282 0.226
263 HD22 ASN 32 2HD2 ASN 32 19.344 -7.769 1.005
Start of MODEL 18
1 H1 LYS 1 1H LYS 1 25.651 7.363 -4.121
2 H2 LYS 1 2H LYS 1 26.092 8.860 -3.452
3 H3 LYS 1 3H LYS 1 26.756 8.363 -4.934
4 HA LYS 1 HA LYS 1 24.303 9.715 -4.403
5 HB2 LYS 1 1HB LYS 1 26.033 9.103 -6.800
6 HB3 LYS 1 2HB LYS 1 24.501 9.959 -6.963
7 HG2 LYS 1 1HG LYS 1 25.276 11.681 -5.394
8 HG3 LYS 1 2HG LYS 1 26.797 10.813 -5.173
9 HD2 LYS 1 1HD LYS 1 27.356 11.122 -7.529
10 HD3 LYS 1 2HD LYS 1 25.794 11.881 -7.831
11 HE2 LYS 1 1HE LYS 1 26.377 13.709 -6.283
12 HE3 LYS 1 2HE LYS 1 27.936 12.946 -5.963
13 HZ1 LYS 1 1HZ LYS 1 27.185 13.492 -8.742
14 HZ2 LYS 1 2HZ LYS 1 28.724 13.465 -8.022
15 HZ3 LYS 1 3HZ LYS 1 27.693 14.792 -7.776
16 H LYS 2 H LYS 2 25.201 6.643 -5.929
17 HA LYS 2 HA LYS 2 22.537 5.648 -5.623
18 HB2 LYS 2 1HB LYS 2 22.764 7.132 -7.850
19 HB3 LYS 2 2HB LYS 2 23.374 5.621 -8.500
20 HG2 LYS 2 1HG LYS 2 20.721 5.928 -7.065
21 HG3 LYS 2 2HG LYS 2 20.918 5.904 -8.813
22 HD2 LYS 2 1HD LYS 2 21.928 3.639 -8.649
23 HD3 LYS 2 2HD LYS 2 21.648 3.662 -6.907
24 HE2 LYS 2 1HE LYS 2 19.231 3.909 -7.281
25 HE3 LYS 2 2HE LYS 2 19.493 3.924 -9.025
26 HZ1 LYS 2 1HZ LYS 2 20.710 1.691 -8.498
27 HZ2 LYS 2 2HZ LYS 2 19.022 1.734 -8.683
28 HZ3 LYS 2 3HZ LYS 2 19.706 1.698 -7.129
29 H CYS 3 H CYS 3 22.862 3.601 -5.015
30 HA CYS 3 HA CYS 3 25.340 2.234 -5.706
31 HB2 CYS 3 1HB CYS 3 22.963 1.432 -4.013
32 HB3 CYS 3 2HB CYS 3 24.366 0.399 -4.284
33 H TRP 4 H TRP 4 24.600 -0.352 -5.831
34 HA TRP 4 HA TRP 4 23.474 -0.458 -8.568
35 HB2 TRP 4 1HB TRP 4 25.690 -2.313 -7.873
36 HB3 TRP 4 2HB TRP 4 25.359 -1.479 -9.385
37 HD1 TRP 4 HD1 TRP 4 26.660 -0.723 -5.835
38 HE1 TRP 4 HE1 TRP 4 28.463 1.105 -6.010
39 HE3 TRP 4 HE3 TRP 4 26.401 0.285 -10.833
40 HZ2 TRP 4 HZ2 TRP 4 29.746 2.665 -8.042
41 HZ3 TRP 4 HZ3 TRP 4 27.909 1.958 -11.854
42 HH2 TRP 4 HH2 TRP 4 29.497 3.237 -10.450
43 H ASN 5 H ASN 5 23.102 -2.851 -9.163
44 HA ASN 5 HA ASN 5 21.610 -4.584 -8.782
45 HB2 ASN 5 1HB ASN 5 23.723 -4.908 -6.641
46 HB3 ASN 5 2HB ASN 5 22.520 -6.144 -7.011
47 HD21 ASN 5 1HD2 ASN 5 25.596 -4.920 -7.885
48 HD22 ASN 5 2HD2 ASN 5 25.785 -5.792 -9.330
49 H GLY 6 H GLY 6 20.811 -2.107 -7.512
50 HA2 GLY 6 1HA GLY 6 19.044 -1.449 -6.217
51 HA3 GLY 6 2HA GLY 6 18.694 -3.155 -5.941
52 H GLY 7 H GLY 7 21.810 -2.811 -5.005
53 HA2 GLY 7 1HA GLY 7 21.450 -3.009 -2.307
54 HA3 GLY 7 2HA GLY 7 22.929 -2.378 -3.035
55 H ARG 8 H ARG 8 22.757 -1.238 -0.821
56 HA ARG 8 HA ARG 8 21.709 1.469 -1.390
57 HB2 ARG 8 1HB ARG 8 21.263 1.687 1.054
58 HB3 ARG 8 2HB ARG 8 20.209 0.538 0.242
59 HG2 ARG 8 1HG ARG 8 21.171 -1.305 1.261
60 HG3 ARG 8 2HG ARG 8 22.742 -0.535 1.429
61 HD2 ARG 8 1HD ARG 8 21.863 -0.726 3.622
62 HD3 ARG 8 2HD ARG 8 21.704 0.968 3.190
63 HE ARG 8 HE ARG 8 19.310 -0.369 2.516
64 HH11 ARG 8 1HH1 ARG 8 20.649 1.702 4.783
65 HH12 ARG 8 2HH1 ARG 8 19.599 1.276 6.092
66 HH21 ARG 8 1HH2 ARG 8 18.140 -1.381 4.415
67 HH22 ARG 8 2HH2 ARG 8 18.192 -0.475 5.890
68 H CYS 9 H CYS 9 22.779 3.089 0.185
69 HA CYS 9 HA CYS 9 25.652 2.433 0.479
70 HB2 CYS 9 1HB CYS 9 24.184 4.899 -0.234
71 HB3 CYS 9 2HB CYS 9 25.535 5.133 0.865
72 H ARG 10 H ARG 10 26.260 1.951 2.493
73 HA ARG 10 HA ARG 10 25.561 3.765 4.646
74 HB2 ARG 10 1HB ARG 10 24.257 1.200 4.261
75 HB3 ARG 10 2HB ARG 10 25.134 1.185 5.778
76 HG2 ARG 10 1HG ARG 10 23.277 3.442 5.007
77 HG3 ARG 10 2HG ARG 10 22.711 2.002 5.849
78 HD2 ARG 10 1HD ARG 10 24.785 3.980 6.825
79 HD3 ARG 10 2HD ARG 10 23.188 3.699 7.500
80 HE ARG 10 HE ARG 10 25.377 1.691 7.544
81 HH11 ARG 10 1HH1 ARG 10 23.702 -0.028 8.543
82 HH12 ARG 10 2HH1 ARG 10 23.234 0.428 10.145
83 HH21 ARG 10 1HH2 ARG 10 24.439 3.665 9.858
84 HH22 ARG 10 2HH2 ARG 10 23.630 2.526 10.882
85 H LYS 11 H LYS 11 26.884 3.390 6.574
86 HA LYS 11 HA LYS 11 29.574 2.691 6.019
87 HB2 LYS 11 1HB LYS 11 28.056 3.049 8.607
88 HB3 LYS 11 2HB LYS 11 29.774 2.656 8.564
89 HG2 LYS 11 1HG LYS 11 30.174 4.681 7.171
90 HG3 LYS 11 2HG LYS 11 28.463 5.092 7.320
91 HD2 LYS 11 1HD LYS 11 28.658 5.289 9.727
92 HD3 LYS 11 2HD LYS 11 30.311 4.677 9.687
93 HE2 LYS 11 1HE LYS 11 30.457 7.069 9.890
94 HE3 LYS 11 2HE LYS 11 30.904 6.667 8.233
95 HZ1 LYS 11 1HZ LYS 11 28.097 7.261 8.868
96 HZ2 LYS 11 2HZ LYS 11 28.940 7.467 7.408
97 HZ3 LYS 11 3HZ LYS 11 29.199 8.542 8.696
98 H LYS 12 H LYS 12 26.824 0.832 6.596
99 HA LYS 12 HA LYS 12 28.443 -1.623 6.725
100 HB2 LYS 12 1HB LYS 12 26.078 -0.947 8.483
101 HB3 LYS 12 2HB LYS 12 26.597 -2.598 8.184
102 HG2 LYS 12 1HG LYS 12 28.983 -1.531 8.934
103 HG3 LYS 12 2HG LYS 12 27.905 -0.446 9.799
104 HD2 LYS 12 1HD LYS 12 26.879 -2.302 10.962
105 HD3 LYS 12 2HD LYS 12 27.755 -3.468 9.970
106 HE2 LYS 12 1HE LYS 12 29.229 -1.431 11.632
107 HE3 LYS 12 2HE LYS 12 28.706 -2.971 12.312
108 HZ1 LYS 12 1HZ LYS 12 30.992 -2.522 10.883
109 HZ2 LYS 12 2HZ LYS 12 29.966 -3.300 9.775
110 HZ3 LYS 12 3HZ LYS 12 30.325 -4.038 11.262
111 H CYS 13 H CYS 13 26.904 -3.533 6.314
112 HA CYS 13 HA CYS 13 25.426 -2.840 3.838
113 HB2 CYS 13 1HB CYS 13 26.662 -5.483 4.687
114 HB3 CYS 13 2HB CYS 13 26.029 -5.087 3.109
115 H LYS 14 H LYS 14 23.356 -2.996 3.845
116 HA LYS 14 HA LYS 14 21.714 -3.583 5.870
117 HB2 LYS 14 1HB LYS 14 20.651 -2.677 4.025
118 HB3 LYS 14 2HB LYS 14 21.329 -3.852 2.908
119 HG2 LYS 14 1HG LYS 14 19.843 -5.585 3.810
120 HG3 LYS 14 2HG LYS 14 19.238 -4.461 5.026
121 HD2 LYS 14 1HD LYS 14 18.447 -2.988 3.139
122 HD3 LYS 14 2HD LYS 14 18.933 -4.254 2.015
123 HE2 LYS 14 1HE LYS 14 16.683 -4.242 3.997
124 HE3 LYS 14 2HE LYS 14 16.702 -4.824 2.333
125 HZ1 LYS 14 1HZ LYS 14 18.089 -6.122 4.615
126 HZ2 LYS 14 2HZ LYS 14 18.038 -6.696 3.017
127 HZ3 LYS 14 3HZ LYS 14 16.616 -6.635 3.944
128 H GLU 15 H GLU 15 20.192 -5.411 6.233
129 HA GLU 15 HA GLU 15 21.367 -7.607 7.213
130 HB2 GLU 15 1HB GLU 15 18.665 -7.062 6.110
131 HB3 GLU 15 2HB GLU 15 19.045 -8.762 6.348
132 HG2 GLU 15 1HG GLU 15 17.991 -7.895 8.352
133 HG3 GLU 15 2HG GLU 15 19.676 -8.272 8.697
134 H ASN 16 H ASN 16 22.853 -8.843 6.363
135 HA ASN 16 HA ASN 16 23.829 -10.462 5.062
136 HB2 ASN 16 1HB ASN 16 21.119 -10.699 3.742
137 HB3 ASN 16 2HB ASN 16 22.400 -11.907 3.760
138 HD21 ASN 16 1HD2 ASN 16 19.809 -12.525 4.804
139 HD22 ASN 16 2HD2 ASN 16 19.976 -12.776 6.474
140 H GLU 17 H GLU 17 24.213 -7.832 4.228
141 HA GLU 17 HA GLU 17 24.260 -8.132 1.280
142 HB2 GLU 17 1HB GLU 17 24.025 -5.705 3.064
143 HB3 GLU 17 2HB GLU 17 24.421 -5.590 1.355
144 HG2 GLU 17 1HG GLU 17 22.148 -7.248 1.475
145 HG3 GLU 17 2HG GLU 17 21.847 -6.066 2.708
146 H LYS 18 H LYS 18 26.065 -7.461 0.139
147 HA LYS 18 HA LYS 18 28.528 -7.940 1.648
148 HB2 LYS 18 1HB LYS 18 28.142 -7.869 -1.338
149 HB3 LYS 18 2HB LYS 18 29.531 -8.496 -0.460
150 HG2 LYS 18 1HG LYS 18 26.791 -9.640 0.065
151 HG3 LYS 18 2HG LYS 18 27.700 -10.155 -1.347
152 HD2 LYS 18 1HD LYS 18 29.436 -11.070 -0.069
153 HD3 LYS 18 2HD LYS 18 28.986 -10.178 1.374
154 HE2 LYS 18 1HE LYS 18 26.799 -11.916 0.492
155 HE3 LYS 18 2HE LYS 18 28.273 -12.817 0.814
156 HZ1 LYS 18 1HZ LYS 18 26.589 -12.158 2.704
157 HZ2 LYS 18 2HZ LYS 18 27.541 -10.751 2.732
158 HZ3 LYS 18 3HZ LYS 18 28.261 -12.268 2.983
159 HA PRO 19 HA PRO 19 29.452 -3.524 1.163
160 HB2 PRO 19 1HB PRO 19 32.297 -4.248 1.542
161 HB3 PRO 19 2HB PRO 19 31.289 -3.151 2.482
162 HG2 PRO 19 1HG PRO 19 32.085 -5.602 3.357
163 HG3 PRO 19 2HG PRO 19 30.615 -4.795 3.904
164 HD2 PRO 19 1HD PRO 19 30.915 -7.100 2.036
165 HD3 PRO 19 2HD PRO 19 29.567 -6.663 3.104
166 H ILE 20 H ILE 20 29.400 -2.732 -0.911
167 HA ILE 20 HA ILE 20 31.940 -3.060 -2.356
168 HB ILE 20 HB ILE 20 31.044 -3.599 -4.349
169 HG12 ILE 20 1HG1 ILE 20 28.187 -2.944 -3.719
170 HG13 ILE 20 2HG1 ILE 20 29.238 -1.645 -4.267
171 HG21 ILE 20 1HG2 ILE 20 29.236 -5.261 -4.028
172 HG22 ILE 20 2HG2 ILE 20 29.087 -4.751 -2.351
173 HG23 ILE 20 3HG2 ILE 20 30.598 -5.470 -2.920
174 HD11 ILE 20 1HD1 ILE 20 28.140 -2.631 -6.170
175 HD12 ILE 20 2HD1 ILE 20 28.702 -4.240 -5.717
176 HD13 ILE 20 3HD1 ILE 20 29.855 -3.016 -6.246
177 H GLY 21 H GLY 21 31.617 -1.588 -4.453
178 HA2 GLY 21 1HA GLY 21 32.185 0.606 -5.054
179 HA3 GLY 21 2HA GLY 21 30.468 0.739 -4.698
180 H TYR 22 H TYR 22 31.496 3.021 -4.421
181 HA TYR 22 HA TYR 22 32.227 3.406 -1.582
182 HB2 TYR 22 1HB TYR 22 34.038 3.573 -3.600
183 HB3 TYR 22 2HB TYR 22 33.451 5.231 -3.599
184 HD1 TYR 22 HD1 TYR 22 35.192 2.627 -1.673
185 HD2 TYR 22 HD2 TYR 22 33.786 6.686 -1.641
186 HE1 TYR 22 HE1 TYR 22 36.571 3.088 0.335
187 HE2 TYR 22 HE2 TYR 22 35.114 7.129 0.406
188 HH TYR 22 HH TYR 22 36.163 5.172 2.396
189 H CYS 23 H CYS 23 31.654 5.388 -0.688
190 HA CYS 23 HA CYS 23 29.673 7.024 -2.101
191 HB2 CYS 23 1HB CYS 23 28.951 4.854 -0.424
192 HB3 CYS 23 2HB CYS 23 28.616 6.320 0.482
193 H ARG 24 H ARG 24 28.759 8.542 -0.131
194 HA ARG 24 HA ARG 24 31.044 10.168 0.505
195 HB2 ARG 24 1HB ARG 24 28.107 10.453 1.194
196 HB3 ARG 24 2HB ARG 24 29.332 11.698 1.441
197 HG2 ARG 24 1HG ARG 24 29.758 11.843 -0.934
198 HG3 ARG 24 2HG ARG 24 28.731 10.444 -1.252
199 HD2 ARG 24 1HD ARG 24 27.495 12.497 -1.748
200 HD3 ARG 24 2HD ARG 24 26.783 11.700 -0.348
201 HE ARG 24 HE ARG 24 28.756 13.617 0.438
202 HH11 ARG 24 1HH1 ARG 24 25.608 13.406 -0.968
203 HH12 ARG 24 2HH1 ARG 24 24.988 14.788 -0.130
204 HH21 ARG 24 1HH2 ARG 24 27.872 15.283 1.731
205 HH22 ARG 24 2HH2 ARG 24 26.250 15.817 1.438
206 H ASN 25 H ASN 25 31.414 11.085 2.590
207 HA ASN 25 HA ASN 25 32.257 10.668 4.715
208 HB2 ASN 25 1HB ASN 25 29.401 10.211 5.493
209 HB3 ASN 25 2HB ASN 25 30.613 11.260 6.223
210 HD21 ASN 25 1HD2 ASN 25 27.836 11.913 5.281
211 HD22 ASN 25 2HD2 ASN 25 28.023 13.150 4.127
212 H GLY 26 H GLY 26 32.771 8.349 3.536
213 HA2 GLY 26 1HA GLY 26 33.625 6.395 4.508
214 HA3 GLY 26 2HA GLY 26 32.497 6.589 5.850
215 H LYS 27 H LYS 27 30.218 6.986 3.896
216 HA LYS 27 HA LYS 27 29.458 4.238 4.118
217 HB2 LYS 27 1HB LYS 27 27.805 6.147 2.504
218 HB3 LYS 27 2HB LYS 27 27.309 4.907 3.636
219 HG2 LYS 27 1HG LYS 27 28.553 6.477 5.392
220 HG3 LYS 27 2HG LYS 27 28.304 7.698 4.154
221 HD2 LYS 27 1HD LYS 27 25.915 7.369 4.192
222 HD3 LYS 27 2HD LYS 27 26.072 5.973 5.263
223 HE2 LYS 27 1HE LYS 27 27.093 7.455 6.985
224 HE3 LYS 27 2HE LYS 27 26.794 8.839 5.934
225 HZ1 LYS 27 1HZ LYS 27 24.736 8.927 6.714
226 HZ2 LYS 27 2HZ LYS 27 25.018 7.572 7.699
227 HZ3 LYS 27 3HZ LYS 27 24.428 7.365 6.121
228 H LYS 28 H LYS 28 29.195 2.717 2.609
229 HA LYS 28 HA LYS 28 30.433 3.205 -0.048
230 HB2 LYS 28 1HB LYS 28 30.486 0.537 1.321
231 HB3 LYS 28 2HB LYS 28 31.579 1.190 0.104
232 HG2 LYS 28 1HG LYS 28 32.265 2.928 1.857
233 HG3 LYS 28 2HG LYS 28 31.403 1.935 3.031
234 HD2 LYS 28 1HD LYS 28 32.810 -0.022 2.242
235 HD3 LYS 28 2HD LYS 28 33.780 1.141 1.337
236 HE2 LYS 28 1HE LYS 28 34.196 2.405 3.443
237 HE3 LYS 28 2HE LYS 28 33.309 1.169 4.334
238 HZ1 LYS 28 1HZ LYS 28 34.984 -0.295 4.158
239 HZ2 LYS 28 2HZ LYS 28 35.933 1.099 3.956
240 HZ3 LYS 28 3HZ LYS 28 35.429 0.212 2.599
241 H CYS 29 H CYS 29 29.500 1.680 -1.765
242 HA CYS 29 HA CYS 29 26.706 1.098 -1.234
243 HB2 CYS 29 1HB CYS 29 28.464 0.684 -3.653
244 HB3 CYS 29 2HB CYS 29 26.822 0.067 -3.571
245 H CYS 30 H CYS 30 26.301 -0.560 0.027
246 HA CYS 30 HA CYS 30 27.738 -3.099 -0.324
247 HB2 CYS 30 1HB CYS 30 25.396 -2.292 1.431
248 HB3 CYS 30 2HB CYS 30 26.110 -3.900 1.374
249 H VAL 31 H VAL 31 27.216 -4.063 -2.204
250 HA VAL 31 HA VAL 31 24.445 -4.092 -3.115
251 HB VAL 31 HB VAL 31 27.071 -4.963 -4.204
252 HG11 VAL 31 1HG1 VAL 31 26.018 -6.989 -4.678
253 HG12 VAL 31 2HG1 VAL 31 25.688 -6.056 -6.132
254 HG13 VAL 31 3HG1 VAL 31 24.441 -6.240 -4.894
255 HG21 VAL 31 1HG2 VAL 31 26.245 -2.776 -4.825
256 HG22 VAL 31 2HG2 VAL 31 24.696 -3.438 -5.293
257 HG23 VAL 31 3HG2 VAL 31 26.137 -3.840 -6.231
258 H ASN 32 H ASN 32 23.034 -5.420 -2.523
259 HA ASN 32 HA ASN 32 23.245 -7.220 -0.506
260 HB2 ASN 32 1HB ASN 32 21.165 -6.282 -1.746
261 HB3 ASN 32 2HB ASN 32 21.309 -7.717 -2.757
262 HD21 ASN 32 1HD2 ASN 32 19.793 -6.591 0.001
263 HD22 ASN 32 2HD2 ASN 32 19.591 -8.054 0.835
Start of MODEL 19
1 H1 LYS 1 1H LYS 1 27.641 8.181 -8.648
2 H2 LYS 1 2H LYS 1 26.656 6.828 -8.355
3 H3 LYS 1 3H LYS 1 28.050 7.083 -7.418
4 HA LYS 1 HA LYS 1 27.128 8.826 -6.239
5 HB2 LYS 1 1HB LYS 1 25.084 8.933 -8.475
6 HB3 LYS 1 2HB LYS 1 24.995 9.910 -7.008
7 HG2 LYS 1 1HG LYS 1 27.275 10.809 -7.542
8 HG3 LYS 1 2HG LYS 1 27.218 9.938 -9.072
9 HD2 LYS 1 1HD LYS 1 25.164 11.990 -8.195
10 HD3 LYS 1 2HD LYS 1 26.524 12.345 -9.258
11 HE2 LYS 1 1HE LYS 1 25.608 10.375 -10.705
12 HE3 LYS 1 2HE LYS 1 24.119 10.611 -9.789
13 HZ1 LYS 1 1HZ LYS 1 25.523 12.828 -11.158
14 HZ2 LYS 1 2HZ LYS 1 23.942 12.816 -10.538
15 HZ3 LYS 1 3HZ LYS 1 24.323 11.899 -11.917
16 H LYS 2 H LYS 2 24.818 6.683 -7.904
17 HA LYS 2 HA LYS 2 23.598 5.961 -5.314
18 HB2 LYS 2 1HB LYS 2 22.688 5.316 -8.130
19 HB3 LYS 2 2HB LYS 2 21.780 5.044 -6.646
20 HG2 LYS 2 1HG LYS 2 22.723 7.808 -7.413
21 HG3 LYS 2 2HG LYS 2 21.221 7.146 -8.050
22 HD2 LYS 2 1HD LYS 2 20.457 6.737 -5.706
23 HD3 LYS 2 2HD LYS 2 21.920 7.528 -5.123
24 HE2 LYS 2 1HE LYS 2 20.109 8.949 -7.066
25 HE3 LYS 2 2HE LYS 2 19.750 8.945 -5.341
26 HZ1 LYS 2 1HZ LYS 2 22.138 10.018 -6.710
27 HZ2 LYS 2 2HZ LYS 2 22.140 9.681 -5.046
28 HZ3 LYS 2 3HZ LYS 2 21.057 10.825 -5.679
29 H CYS 3 H CYS 3 23.036 3.660 -5.018
30 HA CYS 3 HA CYS 3 25.370 2.002 -5.612
31 HB2 CYS 3 1HB CYS 3 22.903 1.419 -3.954
32 HB3 CYS 3 2HB CYS 3 24.338 0.400 -4.065
33 H TRP 4 H TRP 4 24.333 -0.478 -5.638
34 HA TRP 4 HA TRP 4 23.155 -0.577 -8.351
35 HB2 TRP 4 1HB TRP 4 25.514 -2.300 -7.692
36 HB3 TRP 4 2HB TRP 4 25.009 -1.638 -9.245
37 HD1 TRP 4 HD1 TRP 4 26.589 -0.560 -5.914
38 HE1 TRP 4 HE1 TRP 4 28.168 1.421 -6.357
39 HE3 TRP 4 HE3 TRP 4 25.698 0.176 -10.886
40 HZ2 TRP 4 HZ2 TRP 4 29.009 3.055 -8.554
41 HZ3 TRP 4 HZ3 TRP 4 26.988 1.864 -12.152
42 HH2 TRP 4 HH2 TRP 4 28.667 3.280 -11.006
43 H ASN 5 H ASN 5 22.474 -2.763 -8.961
44 HA ASN 5 HA ASN 5 21.200 -4.634 -8.526
45 HB2 ASN 5 1HB ASN 5 23.379 -4.866 -6.443
46 HB3 ASN 5 2HB ASN 5 22.214 -6.151 -6.770
47 HD21 ASN 5 1HD2 ASN 5 24.992 -4.390 -8.081
48 HD22 ASN 5 2HD2 ASN 5 25.240 -5.411 -9.416
49 H GLY 6 H GLY 6 20.348 -2.178 -7.271
50 HA2 GLY 6 1HA GLY 6 18.706 -1.501 -5.826
51 HA3 GLY 6 2HA GLY 6 18.330 -3.209 -5.597
52 H GLY 7 H GLY 7 21.551 -2.194 -4.919
53 HA2 GLY 7 1HA GLY 7 21.325 -2.902 -2.132
54 HA3 GLY 7 2HA GLY 7 22.765 -2.292 -2.949
55 H ARG 8 H ARG 8 22.709 -1.162 -0.677
56 HA ARG 8 HA ARG 8 21.671 1.563 -1.192
57 HB2 ARG 8 1HB ARG 8 21.209 1.763 1.230
58 HB3 ARG 8 2HB ARG 8 20.167 0.603 0.422
59 HG2 ARG 8 1HG ARG 8 21.061 -1.201 1.531
60 HG3 ARG 8 2HG ARG 8 22.683 -0.523 1.560
61 HD2 ARG 8 1HD ARG 8 21.827 -0.619 3.821
62 HD3 ARG 8 2HD ARG 8 21.972 1.061 3.324
63 HE ARG 8 HE ARG 8 19.356 -0.258 3.032
64 HH11 ARG 8 1HH1 ARG 8 18.160 0.172 5.097
65 HH12 ARG 8 2HH1 ARG 8 18.338 1.766 5.752
66 HH21 ARG 8 1HH2 ARG 8 20.948 2.630 3.643
67 HH22 ARG 8 2HH2 ARG 8 19.930 3.147 4.945
68 H CYS 9 H CYS 9 22.703 3.093 0.524
69 HA CYS 9 HA CYS 9 25.600 2.501 0.689
70 HB2 CYS 9 1HB CYS 9 24.023 4.980 0.239
71 HB3 CYS 9 2HB CYS 9 25.486 5.144 1.203
72 H ARG 10 H ARG 10 26.306 1.937 2.625
73 HA ARG 10 HA ARG 10 25.653 3.552 4.936
74 HB2 ARG 10 1HB ARG 10 24.448 0.937 4.469
75 HB3 ARG 10 2HB ARG 10 25.352 0.955 5.975
76 HG2 ARG 10 1HG ARG 10 23.211 2.949 5.208
77 HG3 ARG 10 2HG ARG 10 23.002 1.598 6.313
78 HD2 ARG 10 1HD ARG 10 25.189 2.790 7.432
79 HD3 ARG 10 2HD ARG 10 24.362 4.192 6.765
80 HE ARG 10 HE ARG 10 22.627 2.427 8.249
81 HH11 ARG 10 1HH1 ARG 10 24.084 2.692 10.521
82 HH12 ARG 10 2HH1 ARG 10 23.800 4.286 11.136
83 HH21 ARG 10 1HH2 ARG 10 22.732 5.554 8.089
84 HH22 ARG 10 2HH2 ARG 10 23.024 5.906 9.758
85 H LYS 11 H LYS 11 27.212 3.304 6.634
86 HA LYS 11 HA LYS 11 29.830 2.526 5.937
87 HB2 LYS 11 1HB LYS 11 28.505 2.790 8.641
88 HB3 LYS 11 2HB LYS 11 30.224 2.463 8.428
89 HG2 LYS 11 1HG LYS 11 30.390 4.551 7.046
90 HG3 LYS 11 2HG LYS 11 28.700 4.884 7.435
91 HD2 LYS 11 1HD LYS 11 29.238 4.922 9.831
92 HD3 LYS 11 2HD LYS 11 30.925 4.558 9.468
93 HE2 LYS 11 1HE LYS 11 31.106 6.657 8.184
94 HE3 LYS 11 2HE LYS 11 29.416 7.021 8.536
95 HZ1 LYS 11 1HZ LYS 11 29.860 7.398 10.743
96 HZ2 LYS 11 2HZ LYS 11 31.274 8.002 10.020
97 HZ3 LYS 11 3HZ LYS 11 31.279 6.465 10.743
98 H LYS 12 H LYS 12 27.091 0.706 6.703
99 HA LYS 12 HA LYS 12 28.693 -1.785 6.700
100 HB2 LYS 12 1HB LYS 12 26.370 -1.032 8.480
101 HB3 LYS 12 2HB LYS 12 26.854 -2.706 8.213
102 HG2 LYS 12 1HG LYS 12 29.007 -2.345 9.165
103 HG3 LYS 12 2HG LYS 12 28.821 -0.595 9.124
104 HD2 LYS 12 1HD LYS 12 27.104 -2.461 10.788
105 HD3 LYS 12 2HD LYS 12 28.507 -1.599 11.406
106 HE2 LYS 12 1HE LYS 12 27.197 0.508 10.364
107 HE3 LYS 12 2HE LYS 12 25.815 -0.539 10.679
108 HZ1 LYS 12 1HZ LYS 12 26.555 -0.785 12.955
109 HZ2 LYS 12 2HZ LYS 12 26.323 0.853 12.573
110 HZ3 LYS 12 3HZ LYS 12 27.894 0.215 12.653
111 H CYS 13 H CYS 13 27.109 -3.669 6.245
112 HA CYS 13 HA CYS 13 25.517 -2.866 3.873
113 HB2 CYS 13 1HB CYS 13 26.811 -5.539 4.496
114 HB3 CYS 13 2HB CYS 13 26.075 -5.054 2.986
115 H LYS 14 H LYS 14 23.471 -3.042 3.934
116 HA LYS 14 HA LYS 14 21.898 -3.663 6.027
117 HB2 LYS 14 1HB LYS 14 20.808 -2.674 4.226
118 HB3 LYS 14 2HB LYS 14 21.421 -3.851 3.072
119 HG2 LYS 14 1HG LYS 14 19.914 -5.554 3.948
120 HG3 LYS 14 2HG LYS 14 19.409 -4.480 5.254
121 HD2 LYS 14 1HD LYS 14 18.435 -2.933 3.621
122 HD3 LYS 14 2HD LYS 14 19.014 -3.937 2.292
123 HE2 LYS 14 1HE LYS 14 17.643 -5.825 3.151
124 HE3 LYS 14 2HE LYS 14 17.028 -4.774 4.428
125 HZ1 LYS 14 1HZ LYS 14 16.571 -4.607 1.519
126 HZ2 LYS 14 2HZ LYS 14 16.368 -3.243 2.510
127 HZ3 LYS 14 3HZ LYS 14 15.429 -4.632 2.777
128 H GLU 15 H GLU 15 20.382 -5.505 6.381
129 HA GLU 15 HA GLU 15 21.456 -7.757 7.229
130 HB2 GLU 15 1HB GLU 15 18.838 -7.449 5.764
131 HB3 GLU 15 2HB GLU 15 19.304 -8.972 6.521
132 HG2 GLU 15 1HG GLU 15 19.568 -7.818 8.685
133 HG3 GLU 15 2HG GLU 15 19.110 -6.292 7.930
134 H ASN 16 H ASN 16 23.085 -8.828 6.321
135 HA ASN 16 HA ASN 16 24.106 -10.418 5.023
136 HB2 ASN 16 1HB ASN 16 21.476 -10.864 3.620
137 HB3 ASN 16 2HB ASN 16 22.757 -12.026 3.959
138 HD21 ASN 16 1HD2 ASN 16 23.180 -11.374 6.744
139 HD22 ASN 16 2HD2 ASN 16 21.800 -11.892 7.585
140 H GLU 17 H GLU 17 24.420 -7.829 4.142
141 HA GLU 17 HA GLU 17 24.234 -8.069 1.192
142 HB2 GLU 17 1HB GLU 17 24.076 -5.696 3.048
143 HB3 GLU 17 2HB GLU 17 24.372 -5.517 1.325
144 HG2 GLU 17 1HG GLU 17 22.140 -7.218 1.505
145 HG3 GLU 17 2HG GLU 17 21.884 -6.092 2.800
146 H LYS 18 H LYS 18 25.949 -7.540 -0.073
147 HA LYS 18 HA LYS 18 28.528 -7.898 1.207
148 HB2 LYS 18 1HB LYS 18 27.368 -8.208 -1.483
149 HB3 LYS 18 2HB LYS 18 29.038 -7.659 -1.486
150 HG2 LYS 18 1HG LYS 18 28.979 -10.088 -1.562
151 HG3 LYS 18 2HG LYS 18 29.652 -9.559 -0.022
152 HD2 LYS 18 1HD LYS 18 27.518 -9.952 1.096
153 HD3 LYS 18 2HD LYS 18 26.751 -10.329 -0.442
154 HE2 LYS 18 1HE LYS 18 27.756 -12.419 -0.567
155 HE3 LYS 18 2HE LYS 18 29.171 -11.917 0.355
156 HZ1 LYS 18 1HZ LYS 18 26.681 -11.797 1.806
157 HZ2 LYS 18 2HZ LYS 18 28.196 -12.393 2.286
158 HZ3 LYS 18 3HZ LYS 18 27.159 -13.362 1.354
159 HA PRO 19 HA PRO 19 29.359 -3.427 0.959
160 HB2 PRO 19 1HB PRO 19 32.194 -4.114 1.310
161 HB3 PRO 19 2HB PRO 19 31.152 -3.137 2.338
162 HG2 PRO 19 1HG PRO 19 32.054 -5.660 2.954
163 HG3 PRO 19 2HG PRO 19 30.641 -4.889 3.673
164 HD2 PRO 19 1HD PRO 19 30.764 -7.077 1.675
165 HD3 PRO 19 2HD PRO 19 29.464 -6.632 2.797
166 H ILE 20 H ILE 20 29.320 -2.545 -1.052
167 HA ILE 20 HA ILE 20 31.874 -2.817 -2.477
168 HB ILE 20 HB ILE 20 31.010 -3.304 -4.484
169 HG12 ILE 20 1HG1 ILE 20 28.144 -2.617 -4.086
170 HG13 ILE 20 2HG1 ILE 20 29.211 -1.249 -4.289
171 HG21 ILE 20 1HG2 ILE 20 29.145 -4.893 -4.283
172 HG22 ILE 20 2HG2 ILE 20 28.895 -4.385 -2.618
173 HG23 ILE 20 3HG2 ILE 20 30.413 -5.162 -3.080
174 HD11 ILE 20 1HD1 ILE 20 28.361 -1.995 -6.441
175 HD12 ILE 20 2HD1 ILE 20 29.051 -3.600 -6.172
176 HD13 ILE 20 3HD1 ILE 20 30.107 -2.202 -6.350
177 H GLY 21 H GLY 21 31.585 -1.253 -4.485
178 HA2 GLY 21 1HA GLY 21 32.095 0.980 -5.017
179 HA3 GLY 21 2HA GLY 21 30.375 1.036 -4.659
180 H TYR 22 H TYR 22 31.291 3.357 -4.275
181 HA TYR 22 HA TYR 22 32.041 3.631 -1.427
182 HB2 TYR 22 1HB TYR 22 33.770 4.080 -3.496
183 HB3 TYR 22 2HB TYR 22 33.093 5.690 -3.289
184 HD1 TYR 22 HD1 TYR 22 33.357 6.901 -1.145
185 HD2 TYR 22 HD2 TYR 22 35.065 3.007 -1.744
186 HE1 TYR 22 HE1 TYR 22 34.740 7.193 0.893
187 HE2 TYR 22 HE2 TYR 22 36.506 3.332 0.248
188 HH TYR 22 HH TYR 22 37.404 5.336 1.565
189 H CYS 23 H CYS 23 31.555 5.775 -0.551
190 HA CYS 23 HA CYS 23 29.362 7.228 -1.756
191 HB2 CYS 23 1HB CYS 23 28.771 4.879 -0.348
192 HB3 CYS 23 2HB CYS 23 28.421 6.176 0.790
193 H ARG 24 H ARG 24 28.309 8.495 0.333
194 HA ARG 24 HA ARG 24 30.450 10.292 0.995
195 HB2 ARG 24 1HB ARG 24 27.702 10.519 2.189
196 HB3 ARG 24 2HB ARG 24 28.771 11.785 1.594
197 HG2 ARG 24 1HG ARG 24 28.412 10.688 -0.737
198 HG3 ARG 24 2HG ARG 24 27.048 9.867 0.024
199 HD2 ARG 24 1HD ARG 24 26.176 11.876 -0.957
200 HD3 ARG 24 2HD ARG 24 26.244 12.152 0.783
201 HE ARG 24 HE ARG 24 28.529 13.022 -0.854
202 HH11 ARG 24 1HH1 ARG 24 29.306 15.001 0.073
203 HH12 ARG 24 2HH1 ARG 24 28.140 16.148 0.642
204 HH21 ARG 24 1HH2 ARG 24 25.442 14.014 0.203
205 HH22 ARG 24 2HH2 ARG 24 25.953 15.576 0.750
206 H ASN 25 H ASN 25 30.775 11.128 3.157
207 HA ASN 25 HA ASN 25 31.782 10.624 5.193
208 HB2 ASN 25 1HB ASN 25 28.811 10.343 5.335
209 HB3 ASN 25 2HB ASN 25 29.736 9.951 6.782
210 HD21 ASN 25 1HD2 ASN 25 29.025 12.597 4.499
211 HD22 ASN 25 2HD2 ASN 25 29.433 13.834 5.595
212 H GLY 26 H GLY 26 32.502 8.571 3.679
213 HA2 GLY 26 1HA GLY 26 33.664 6.627 4.225
214 HA3 GLY 26 2HA GLY 26 32.786 6.563 5.752
215 H LYS 27 H LYS 27 30.193 6.888 4.157
216 HA LYS 27 HA LYS 27 29.668 4.122 4.292
217 HB2 LYS 27 1HB LYS 27 27.733 5.923 2.881
218 HB3 LYS 27 2HB LYS 27 27.441 4.637 4.033
219 HG2 LYS 27 1HG LYS 27 28.810 6.322 5.640
220 HG3 LYS 27 2HG LYS 27 28.182 7.499 4.499
221 HD2 LYS 27 1HD LYS 27 25.906 6.824 4.940
222 HD3 LYS 27 2HD LYS 27 26.458 5.491 5.962
223 HE2 LYS 27 1HE LYS 27 27.248 6.945 7.640
224 HE3 LYS 27 2HE LYS 27 27.251 8.341 6.564
225 HZ1 LYS 27 1HZ LYS 27 25.340 8.691 7.737
226 HZ2 LYS 27 2HZ LYS 27 24.991 7.037 7.907
227 HZ3 LYS 27 3HZ LYS 27 24.722 7.814 6.421
228 H LYS 28 H LYS 28 29.260 2.600 2.787
229 HA LYS 28 HA LYS 28 30.409 3.158 0.111
230 HB2 LYS 28 1HB LYS 28 30.303 0.394 1.270
231 HB3 LYS 28 2HB LYS 28 31.492 1.108 0.188
232 HG2 LYS 28 1HG LYS 28 32.297 2.534 2.073
233 HG3 LYS 28 2HG LYS 28 31.161 1.711 3.143
234 HD2 LYS 28 1HD LYS 28 32.250 -0.464 2.504
235 HD3 LYS 28 2HD LYS 28 33.481 0.467 1.652
236 HE2 LYS 28 1HE LYS 28 32.811 0.862 4.581
237 HE3 LYS 28 2HE LYS 28 34.132 -0.155 4.007
238 HZ1 LYS 28 1HZ LYS 28 35.335 1.624 3.320
239 HZ2 LYS 28 2HZ LYS 28 34.487 2.370 4.588
240 HZ3 LYS 28 3HZ LYS 28 33.969 2.578 2.983
241 H CYS 29 H CYS 29 29.485 1.706 -1.651
242 HA CYS 29 HA CYS 29 26.631 1.214 -1.190
243 HB2 CYS 29 1HB CYS 29 28.373 0.998 -3.639
244 HB3 CYS 29 2HB CYS 29 26.752 0.317 -3.592
245 H CYS 30 H CYS 30 26.226 -0.457 -0.021
246 HA CYS 30 HA CYS 30 27.638 -2.990 -0.462
247 HB2 CYS 30 1HB CYS 30 25.330 -2.248 1.366
248 HB3 CYS 30 2HB CYS 30 26.069 -3.842 1.256
249 H VAL 31 H VAL 31 27.102 -3.983 -2.263
250 HA VAL 31 HA VAL 31 24.361 -3.970 -3.263
251 HB VAL 31 HB VAL 31 26.991 -5.053 -4.167
252 HG11 VAL 31 1HG1 VAL 31 25.468 -5.893 -6.224
253 HG12 VAL 31 2HG1 VAL 31 24.333 -6.168 -4.903
254 HG13 VAL 31 3HG1 VAL 31 25.909 -6.935 -4.881
255 HG21 VAL 31 1HG2 VAL 31 25.972 -2.690 -4.650
256 HG22 VAL 31 2HG2 VAL 31 24.989 -3.543 -5.818
257 HG23 VAL 31 3HG2 VAL 31 26.738 -3.583 -5.966
258 H ASN 32 H ASN 32 22.918 -5.216 -2.527
259 HA ASN 32 HA ASN 32 23.141 -7.063 -0.537
260 HB2 ASN 32 1HB ASN 32 21.034 -6.022 -1.496
261 HB3 ASN 32 2HB ASN 32 21.082 -7.274 -2.736
262 HD21 ASN 32 1HD2 ASN 32 19.612 -6.614 0.141
263 HD22 ASN 32 2HD2 ASN 32 19.446 -8.184 0.764
Start of MODEL 20
1 H1 LYS 1 1H LYS 1 26.238 9.232 -4.377
2 H2 LYS 1 2H LYS 1 27.757 9.162 -5.132
3 H3 LYS 1 3H LYS 1 26.973 7.729 -4.668
4 HA LYS 1 HA LYS 1 25.859 9.614 -6.665
5 HB2 LYS 1 1HB LYS 1 27.562 7.134 -7.040
6 HB3 LYS 1 2HB LYS 1 26.643 7.904 -8.333
7 HG2 LYS 1 1HG LYS 1 27.892 9.997 -7.990
8 HG3 LYS 1 2HG LYS 1 28.794 9.251 -6.670
9 HD2 LYS 1 1HD LYS 1 29.700 7.572 -8.234
10 HD3 LYS 1 2HD LYS 1 28.794 8.308 -9.554
11 HE2 LYS 1 1HE LYS 1 30.028 10.416 -9.237
12 HE3 LYS 1 2HE LYS 1 30.923 9.698 -7.899
13 HZ1 LYS 1 1HZ LYS 1 30.945 8.757 -10.716
14 HZ2 LYS 1 2HZ LYS 1 31.783 8.029 -9.429
15 HZ3 LYS 1 3HZ LYS 1 32.198 9.596 -9.934
16 H LYS 2 H LYS 2 26.019 6.170 -6.958
17 HA LYS 2 HA LYS 2 23.439 5.674 -5.733
18 HB2 LYS 2 1HB LYS 2 22.816 6.605 -7.955
19 HB3 LYS 2 2HB LYS 2 23.763 5.333 -8.725
20 HG2 LYS 2 1HG LYS 2 22.354 3.616 -7.742
21 HG3 LYS 2 2HG LYS 2 21.468 4.820 -6.809
22 HD2 LYS 2 1HD LYS 2 21.611 4.807 -9.835
23 HD3 LYS 2 2HD LYS 2 20.317 4.041 -8.926
24 HE2 LYS 2 1HE LYS 2 20.478 6.649 -7.855
25 HE3 LYS 2 2HE LYS 2 20.631 6.849 -9.596
26 HZ1 LYS 2 1HZ LYS 2 18.332 6.381 -8.169
27 HZ2 LYS 2 2HZ LYS 2 18.654 4.917 -8.968
28 HZ3 LYS 2 3HZ LYS 2 18.508 6.356 -9.858
29 H CYS 3 H CYS 3 23.071 3.481 -5.372
30 HA CYS 3 HA CYS 3 25.416 1.758 -5.765
31 HB2 CYS 3 1HB CYS 3 22.876 1.246 -4.199
32 HB3 CYS 3 2HB CYS 3 24.343 0.265 -4.181
33 H TRP 4 H TRP 4 24.347 -0.676 -5.709
34 HA TRP 4 HA TRP 4 23.247 -0.891 -8.451
35 HB2 TRP 4 1HB TRP 4 25.318 -2.843 -7.615
36 HB3 TRP 4 2HB TRP 4 25.065 -2.086 -9.178
37 HD1 TRP 4 HD1 TRP 4 26.157 -0.846 -5.654
38 HE1 TRP 4 HE1 TRP 4 28.355 0.426 -5.926
39 HE3 TRP 4 HE3 TRP 4 26.770 -1.240 -10.704
40 HZ2 TRP 4 HZ2 TRP 4 30.269 0.972 -7.998
41 HZ3 TRP 4 HZ3 TRP 4 28.699 -0.160 -11.813
42 HH2 TRP 4 HH2 TRP 4 30.377 1.085 -10.484
43 H ASN 5 H ASN 5 22.578 -3.223 -8.888
44 HA ASN 5 HA ASN 5 21.032 -4.858 -8.337
45 HB2 ASN 5 1HB ASN 5 22.932 -5.269 -6.019
46 HB3 ASN 5 2HB ASN 5 21.919 -6.482 -6.803
47 HD21 ASN 5 1HD2 ASN 5 24.380 -7.374 -6.891
48 HD22 ASN 5 2HD2 ASN 5 25.078 -7.145 -8.419
49 H GLY 6 H GLY 6 20.414 -2.252 -7.207
50 HA2 GLY 6 1HA GLY 6 18.773 -1.398 -5.843
51 HA3 GLY 6 2HA GLY 6 18.319 -3.059 -5.461
52 H GLY 7 H GLY 7 21.501 -2.956 -4.773
53 HA2 GLY 7 1HA GLY 7 21.393 -2.963 -2.068
54 HA3 GLY 7 2HA GLY 7 22.832 -2.447 -2.948
55 H ARG 8 H ARG 8 22.766 -1.188 -0.697
56 HA ARG 8 HA ARG 8 21.694 1.501 -1.313
57 HB2 ARG 8 1HB ARG 8 21.175 1.789 1.063
58 HB3 ARG 8 2HB ARG 8 20.220 0.503 0.335
59 HG2 ARG 8 1HG ARG 8 21.460 -1.201 1.374
60 HG3 ARG 8 2HG ARG 8 22.810 -0.145 1.753
61 HD2 ARG 8 1HD ARG 8 21.015 1.148 3.211
62 HD3 ARG 8 2HD ARG 8 20.146 -0.379 3.118
63 HE ARG 8 HE ARG 8 22.871 -0.782 3.875
64 HH11 ARG 8 1HH1 ARG 8 23.425 -0.441 6.126
65 HH12 ARG 8 2HH1 ARG 8 22.144 -0.488 7.291
66 HH21 ARG 8 1HH2 ARG 8 19.629 -0.631 4.908
67 HH22 ARG 8 2HH2 ARG 8 19.994 -0.575 6.601
68 H CYS 9 H CYS 9 22.716 3.138 0.306
69 HA CYS 9 HA CYS 9 25.608 2.561 0.582
70 HB2 CYS 9 1HB CYS 9 24.051 5.035 0.014
71 HB3 CYS 9 2HB CYS 9 25.507 5.212 0.986
72 H ARG 10 H ARG 10 26.251 2.082 2.566
73 HA ARG 10 HA ARG 10 25.536 3.767 4.807
74 HB2 ARG 10 1HB ARG 10 24.333 1.130 4.382
75 HB3 ARG 10 2HB ARG 10 25.139 1.238 5.936
76 HG2 ARG 10 1HG ARG 10 23.247 3.405 5.037
77 HG3 ARG 10 2HG ARG 10 22.649 1.931 5.784
78 HD2 ARG 10 1HD ARG 10 24.885 3.312 7.197
79 HD3 ARG 10 2HD ARG 10 23.310 4.095 7.233
80 HE ARG 10 HE ARG 10 24.025 1.644 8.569
81 HH11 ARG 10 1HH1 ARG 10 21.465 3.149 6.823
82 HH12 ARG 10 2HH1 ARG 10 20.210 2.514 7.834
83 HH21 ARG 10 1HH2 ARG 10 22.408 1.148 10.145
84 HH22 ARG 10 2HH2 ARG 10 20.748 1.467 9.767
85 H LYS 11 H LYS 11 26.968 3.430 6.631
86 HA LYS 11 HA LYS 11 29.626 2.752 6.018
87 HB2 LYS 11 1HB LYS 11 28.313 2.687 8.747
88 HB3 LYS 11 2HB LYS 11 30.040 2.831 8.414
89 HG2 LYS 11 1HG LYS 11 29.435 4.922 7.059
90 HG3 LYS 11 2HG LYS 11 27.857 4.844 7.847
91 HD2 LYS 11 1HD LYS 11 30.566 5.116 9.182
92 HD3 LYS 11 2HD LYS 11 29.296 6.335 9.114
93 HE2 LYS 11 1HE LYS 11 27.806 4.651 10.331
94 HE3 LYS 11 2HE LYS 11 29.274 3.715 10.623
95 HZ1 LYS 11 1HZ LYS 11 28.819 5.198 12.464
96 HZ2 LYS 11 2HZ LYS 11 28.825 6.539 11.422
97 HZ3 LYS 11 3HZ LYS 11 30.254 5.659 11.680
98 H LYS 12 H LYS 12 26.910 0.848 6.843
99 HA LYS 12 HA LYS 12 28.553 -1.618 6.878
100 HB2 LYS 12 1HB LYS 12 26.562 -2.482 8.328
101 HB3 LYS 12 2HB LYS 12 27.801 -1.491 9.095
102 HG2 LYS 12 1HG LYS 12 26.408 0.505 8.862
103 HG3 LYS 12 2HG LYS 12 25.200 -0.414 7.969
104 HD2 LYS 12 1HD LYS 12 24.462 -0.197 10.268
105 HD3 LYS 12 2HD LYS 12 24.907 -1.877 9.980
106 HE2 LYS 12 1HE LYS 12 26.883 -1.698 11.231
107 HE3 LYS 12 2HE LYS 12 26.940 0.059 11.086
108 HZ1 LYS 12 1HZ LYS 12 25.535 -1.588 12.985
109 HZ2 LYS 12 2HZ LYS 12 24.583 -0.350 12.318
110 HZ3 LYS 12 3HZ LYS 12 26.036 0.031 13.108
111 H CYS 13 H CYS 13 27.032 -3.542 6.354
112 HA CYS 13 HA CYS 13 25.544 -2.768 3.915
113 HB2 CYS 13 1HB CYS 13 26.792 -5.442 4.611
114 HB3 CYS 13 2HB CYS 13 26.080 -4.976 3.087
115 H LYS 14 H LYS 14 23.508 -2.968 3.814
116 HA LYS 14 HA LYS 14 21.786 -3.551 5.806
117 HB2 LYS 14 1HB LYS 14 20.895 -2.554 3.882
118 HB3 LYS 14 2HB LYS 14 21.488 -3.828 2.826
119 HG2 LYS 14 1HG LYS 14 19.845 -5.379 3.675
120 HG3 LYS 14 2HG LYS 14 19.384 -4.265 4.965
121 HD2 LYS 14 1HD LYS 14 18.631 -2.636 3.226
122 HD3 LYS 14 2HD LYS 14 19.000 -3.837 1.987
123 HE2 LYS 14 1HE LYS 14 17.367 -5.376 2.908
124 HE3 LYS 14 2HE LYS 14 17.093 -4.319 4.293
125 HZ1 LYS 14 1HZ LYS 14 16.420 -2.588 2.616
126 HZ2 LYS 14 2HZ LYS 14 15.351 -3.895 2.799
127 HZ3 LYS 14 3HZ LYS 14 16.392 -3.831 1.459
128 H GLU 15 H GLU 15 20.249 -5.345 6.093
129 HA GLU 15 HA GLU 15 21.158 -7.604 7.032
130 HB2 GLU 15 1HB GLU 15 18.741 -7.464 5.212
131 HB3 GLU 15 2HB GLU 15 19.065 -8.756 6.371
132 HG2 GLU 15 1HG GLU 15 19.055 -7.121 8.211
133 HG3 GLU 15 2HG GLU 15 18.759 -5.817 7.063
134 H ASN 16 H ASN 16 22.853 -8.711 6.279
135 HA ASN 16 HA ASN 16 23.993 -10.294 5.073
136 HB2 ASN 16 1HB ASN 16 21.433 -10.827 3.568
137 HB3 ASN 16 2HB ASN 16 22.749 -11.946 3.921
138 HD21 ASN 16 1HD2 ASN 16 23.148 -11.583 6.653
139 HD22 ASN 16 2HD2 ASN 16 21.740 -12.025 7.492
140 H GLU 17 H GLU 17 24.400 -7.778 4.178
141 HA GLU 17 HA GLU 17 24.416 -8.067 1.227
142 HB2 GLU 17 1HB GLU 17 24.091 -5.650 3.009
143 HB3 GLU 17 2HB GLU 17 24.486 -5.519 1.301
144 HG2 GLU 17 1HG GLU 17 22.285 -7.274 1.426
145 HG3 GLU 17 2HG GLU 17 21.921 -6.073 2.627
146 H LYS 18 H LYS 18 26.204 -7.456 0.072
147 HA LYS 18 HA LYS 18 28.678 -7.708 1.601
148 HB2 LYS 18 1HB LYS 18 27.753 -8.389 -1.110
149 HB3 LYS 18 2HB LYS 18 29.400 -7.780 -1.063
150 HG2 LYS 18 1HG LYS 18 29.482 -10.170 -0.835
151 HG3 LYS 18 2HG LYS 18 29.919 -9.462 0.712
152 HD2 LYS 18 1HD LYS 18 28.401 -11.078 1.400
153 HD3 LYS 18 2HD LYS 18 27.325 -9.702 1.214
154 HE2 LYS 18 1HE LYS 18 26.144 -11.279 0.001
155 HE3 LYS 18 2HE LYS 18 27.171 -10.667 -1.294
156 HZ1 LYS 18 1HZ LYS 18 28.534 -12.652 0.189
157 HZ2 LYS 18 2HZ LYS 18 28.142 -12.633 -1.463
158 HZ3 LYS 18 3HZ LYS 18 27.036 -13.255 -0.335
159 HA PRO 19 HA PRO 19 29.497 -3.336 1.053
160 HB2 PRO 19 1HB PRO 19 32.383 -3.969 1.156
161 HB3 PRO 19 2HB PRO 19 31.430 -2.940 2.217
162 HG2 PRO 19 1HG PRO 19 32.378 -5.479 2.824
163 HG3 PRO 19 2HG PRO 19 31.123 -4.610 3.701
164 HD2 PRO 19 1HD PRO 19 30.848 -6.962 2.001
165 HD3 PRO 19 2HD PRO 19 29.636 -6.199 3.042
166 H ILE 20 H ILE 20 29.352 -2.394 -0.922
167 HA ILE 20 HA ILE 20 31.647 -2.798 -2.685
168 HB ILE 20 HB ILE 20 29.455 -4.156 -3.190
169 HG12 ILE 20 1HG1 ILE 20 30.686 -2.711 -5.502
170 HG13 ILE 20 2HG1 ILE 20 31.617 -3.882 -4.579
171 HG21 ILE 20 1HG2 ILE 20 27.682 -2.708 -3.516
172 HG22 ILE 20 2HG2 ILE 20 28.273 -2.832 -5.153
173 HG23 ILE 20 3HG2 ILE 20 28.680 -1.429 -4.206
174 HD11 ILE 20 1HD1 ILE 20 29.025 -4.388 -6.060
175 HD12 ILE 20 2HD1 ILE 20 29.805 -5.572 -5.010
176 HD13 ILE 20 3HD1 ILE 20 30.616 -5.020 -6.476
177 H GLY 21 H GLY 21 31.305 -1.246 -4.707
178 HA2 GLY 21 1HA GLY 21 31.742 0.943 -5.278
179 HA3 GLY 21 2HA GLY 21 30.059 1.123 -4.840
180 H TYR 22 H TYR 22 30.890 3.357 -4.410
181 HA TYR 22 HA TYR 22 31.923 3.613 -1.652
182 HB2 TYR 22 1HB TYR 22 33.693 3.857 -3.533
183 HB3 TYR 22 2HB TYR 22 32.891 5.387 -3.890
184 HD1 TYR 22 HD1 TYR 22 35.005 3.553 -1.543
185 HD2 TYR 22 HD2 TYR 22 32.764 7.170 -2.124
186 HE1 TYR 22 HE1 TYR 22 36.236 4.615 0.328
187 HE2 TYR 22 HE2 TYR 22 34.030 8.248 -0.283
188 HH TYR 22 HH TYR 22 36.791 6.957 1.090
189 H CYS 23 H CYS 23 31.449 5.619 -0.649
190 HA CYS 23 HA CYS 23 29.419 7.336 -1.807
191 HB2 CYS 23 1HB CYS 23 28.688 5.021 -0.255
192 HB3 CYS 23 2HB CYS 23 28.245 6.480 0.624
193 H ARG 24 H ARG 24 28.532 8.612 0.404
194 HA ARG 24 HA ARG 24 30.863 10.201 0.986
195 HB2 ARG 24 1HB ARG 24 27.963 10.416 1.826
196 HB3 ARG 24 2HB ARG 24 29.194 11.611 2.231
197 HG2 ARG 24 1HG ARG 24 29.610 12.041 -0.137
198 HG3 ARG 24 2HG ARG 24 28.484 10.760 -0.593
199 HD2 ARG 24 1HD ARG 24 27.386 12.950 -0.751
200 HD3 ARG 24 2HD ARG 24 26.649 11.983 0.525
201 HE ARG 24 HE ARG 24 28.290 13.304 2.037
202 HH11 ARG 24 1HH1 ARG 24 29.145 15.533 1.935
203 HH12 ARG 24 2HH1 ARG 24 28.102 16.728 1.240
204 HH21 ARG 24 1HH2 ARG 24 25.836 14.408 0.008
205 HH22 ARG 24 2HH2 ARG 24 26.236 16.088 0.128
206 H ASN 25 H ASN 25 31.390 10.968 3.095
207 HA ASN 25 HA ASN 25 32.373 10.396 5.125
208 HB2 ASN 25 1HB ASN 25 29.387 10.492 5.413
209 HB3 ASN 25 2HB ASN 25 30.391 10.191 6.828
210 HD21 ASN 25 1HD2 ASN 25 28.994 12.463 7.024
211 HD22 ASN 25 2HD2 ASN 25 30.015 13.809 6.819
212 H GLY 26 H GLY 26 32.720 8.163 3.721
213 HA2 GLY 26 1HA GLY 26 33.646 6.139 4.485
214 HA3 GLY 26 2HA GLY 26 32.633 6.240 5.926
215 H LYS 27 H LYS 27 30.224 6.830 4.217
216 HA LYS 27 HA LYS 27 29.377 4.137 4.180
217 HB2 LYS 27 1HB LYS 27 27.760 6.187 2.720
218 HB3 LYS 27 2HB LYS 27 27.251 4.923 3.816
219 HG2 LYS 27 1HG LYS 27 28.676 6.428 5.552
220 HG3 LYS 27 2HG LYS 27 28.268 7.681 4.394
221 HD2 LYS 27 1HD LYS 27 25.912 7.286 4.669
222 HD3 LYS 27 2HD LYS 27 26.213 5.849 5.654
223 HE2 LYS 27 1HE LYS 27 27.389 7.281 7.317
224 HE3 LYS 27 2HE LYS 27 26.963 8.700 6.362
225 HZ1 LYS 27 1HZ LYS 27 25.418 7.403 8.280
226 HZ2 LYS 27 2HZ LYS 27 24.667 7.127 6.783
227 HZ3 LYS 27 3HZ LYS 27 24.970 8.716 7.300
228 H LYS 28 H LYS 28 29.131 2.693 2.628
229 HA LYS 28 HA LYS 28 30.194 3.332 -0.072
230 HB2 LYS 28 1HB LYS 28 30.435 0.631 1.231
231 HB3 LYS 28 2HB LYS 28 31.365 1.311 -0.105
232 HG2 LYS 28 1HG LYS 28 32.348 2.979 1.456
233 HG3 LYS 28 2HG LYS 28 31.463 2.238 2.787
234 HD2 LYS 28 1HD LYS 28 32.628 0.074 2.277
235 HD3 LYS 28 2HD LYS 28 33.612 0.940 1.095
236 HE2 LYS 28 1HE LYS 28 33.403 1.695 4.027
237 HE3 LYS 28 2HE LYS 28 34.713 0.734 3.343
238 HZ1 LYS 28 1HZ LYS 28 34.296 3.073 1.806
239 HZ2 LYS 28 2HZ LYS 28 35.697 2.566 2.621
240 HZ3 LYS 28 3HZ LYS 28 34.527 3.488 3.436
241 H CYS 29 H CYS 29 29.365 1.636 -1.714
242 HA CYS 29 HA CYS 29 26.487 1.245 -1.236
243 HB2 CYS 29 1HB CYS 29 28.275 0.946 -3.642
244 HB3 CYS 29 2HB CYS 29 26.652 0.267 -3.636
245 H CYS 30 H CYS 30 25.956 -0.613 -0.149
246 HA CYS 30 HA CYS 30 27.746 -2.953 -0.452
247 HB2 CYS 30 1HB CYS 30 25.360 -2.397 1.343
248 HB3 CYS 30 2HB CYS 30 26.199 -3.940 1.246
249 H VAL 31 H VAL 31 27.360 -4.135 -2.182
250 HA VAL 31 HA VAL 31 24.701 -4.237 -3.348
251 HB VAL 31 HB VAL 31 27.446 -4.962 -4.162
252 HG11 VAL 31 1HG1 VAL 31 26.578 -6.542 -5.954
253 HG12 VAL 31 2HG1 VAL 31 25.100 -6.674 -5.001
254 HG13 VAL 31 3HG1 VAL 31 26.637 -7.212 -4.326
255 HG21 VAL 31 1HG2 VAL 31 25.968 -3.075 -5.040
256 HG22 VAL 31 2HG2 VAL 31 25.024 -4.317 -5.847
257 HG23 VAL 31 3HG2 VAL 31 26.718 -4.102 -6.271
258 H ASN 32 H ASN 32 23.227 -5.509 -2.691
259 HA ASN 32 HA ASN 32 23.359 -7.276 -0.634
260 HB2 ASN 32 1HB ASN 32 21.280 -6.410 -1.733
261 HB3 ASN 32 2HB ASN 32 21.510 -7.610 -3.004
262 HD21 ASN 32 1HD2 ASN 32 20.074 -7.103 0.040
263 HD22 ASN 32 2HD2 ASN 32 19.806 -8.726 0.455