NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
12297 |
1ss1   |
cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY -1 HT1 GLY -1 83.300 -16.518 -5.854
2 2H GLY -1 HT2 GLY -1 81.631 -16.251 -5.930
3 3H GLY -1 HT3 GLY -1 82.580 -15.368 -4.843
4 1HA GLY -1 HA1 GLY -1 82.166 -14.982 -7.692
5 2HA GLY -1 HA2 GLY -1 82.456 -13.793 -6.431
6 H SER 0 HN SER 0 84.828 -14.848 -5.363
7 HA SER 0 HA SER 0 86.771 -15.309 -7.391
8 1HB SER 0 HB2 SER 0 88.009 -13.124 -6.993
9 2HB SER 0 HB1 SER 0 86.533 -13.001 -7.949
10 HG SER 0 HG SER 0 85.490 -12.108 -6.244
11 H THR 1 HN THR 1 87.154 -13.281 -4.512
12 HA THR 1 HA THR 1 88.071 -15.480 -2.895
13 HB THR 1 HB THR 1 90.015 -13.368 -3.853
14 HG1 THR 1 HG1 THR 1 90.032 -16.193 -4.082
15 1HG2 THR 1 HG21 THR 1 90.557 -15.565 -1.874
16 2HG2 THR 1 HG22 THR 1 90.324 -13.870 -1.446
17 3HG2 THR 1 HG23 THR 1 91.688 -14.344 -2.459
18 H ALA 2 HN ALA 2 89.031 -12.064 -2.808
19 HA ALA 2 HA ALA 2 87.420 -11.763 -0.358
20 1HB ALA 2 HB1 ALA 2 90.217 -11.073 -0.949
21 2HB ALA 2 HB2 ALA 2 89.441 -11.466 0.586
22 3HB ALA 2 HB3 ALA 2 89.300 -9.840 -0.083
23 H ASP 3 HN ASP 3 87.767 -10.751 -3.534
24 HA ASP 3 HA ASP 3 87.051 -8.958 -4.752
25 1HB ASP 3 HB2 ASP 3 84.956 -9.715 -2.862
26 2HB ASP 3 HB1 ASP 3 84.802 -8.051 -3.418
27 H ASN 4 HN ASN 4 88.911 -8.382 -2.534
28 HA ASN 4 HA ASN 4 89.601 -6.646 -1.138
29 1HB ASN 4 HB2 ASN 4 89.479 -5.843 -3.978
30 2HB ASN 4 HB1 ASN 4 89.694 -4.522 -2.832
31 1HD2 ASN 4 HD21 ASN 4 91.091 -7.361 -4.230
32 2HD2 ASN 4 HD22 ASN 4 92.682 -7.146 -3.590
33 H LYS 5 HN LYS 5 87.391 -6.776 -0.024
34 HA LYS 5 HA LYS 5 85.390 -4.869 -0.533
35 1HB LYS 5 HB2 LYS 5 84.997 -6.898 0.779
36 2HB LYS 5 HB1 LYS 5 86.060 -6.298 2.043
37 1HG LYS 5 HG2 LYS 5 84.535 -4.764 2.793
38 2HG LYS 5 HG1 LYS 5 83.730 -4.638 1.227
39 1HD LYS 5 HD2 LYS 5 83.618 -7.256 2.621
40 2HD LYS 5 HD1 LYS 5 82.653 -5.937 3.287
41 1HE LYS 5 HE2 LYS 5 82.559 -6.553 0.361
42 2HE LYS 5 HE1 LYS 5 81.615 -7.511 1.501
43 1HZ LYS 5 HZ1 LYS 5 80.258 -5.767 1.988
44 2HZ LYS 5 HZ2 LYS 5 80.635 -5.368 0.389
45 3HZ LYS 5 HZ3 LYS 5 81.432 -4.593 1.663
46 H PHE 6 HN PHE 6 87.470 -3.290 -0.769
47 HA PHE 6 HA PHE 6 88.249 -1.977 1.637
48 1HB PHE 6 HB2 PHE 6 88.616 -1.416 -1.291
49 2HB PHE 6 HB1 PHE 6 89.041 -0.195 -0.098
50 HD1 PHE 6 HD1 PHE 6 91.312 -0.491 -1.266
51 HD2 PHE 6 HD2 PHE 6 89.510 -3.486 1.161
52 HE1 PHE 6 HE1 PHE 6 93.507 -1.556 -0.953
53 HE2 PHE 6 HE2 PHE 6 91.695 -4.544 1.480
54 HZ PHE 6 HZ PHE 6 93.706 -3.594 0.428
55 H ASN 7 HN ASN 7 85.929 -1.741 2.362
56 HA ASN 7 HA ASN 7 84.009 -0.156 1.229
57 1HB ASN 7 HB2 ASN 7 84.732 -0.276 4.165
58 2HB ASN 7 HB1 ASN 7 83.198 0.296 3.513
59 1HD2 ASN 7 HD21 ASN 7 81.850 -1.223 2.407
60 2HD2 ASN 7 HD22 ASN 7 81.938 -2.904 2.797
61 H LYS 8 HN LYS 8 83.314 2.056 2.419
62 HA LYS 8 HA LYS 8 84.881 4.061 1.335
63 1HB LYS 8 HB2 LYS 8 83.618 5.580 2.960
64 2HB LYS 8 HB1 LYS 8 82.656 4.620 1.843
65 1HG LYS 8 HG2 LYS 8 82.006 3.116 3.535
66 2HG LYS 8 HG1 LYS 8 83.232 3.725 4.651
67 1HD LYS 8 HD2 LYS 8 82.065 5.741 4.994
68 2HD LYS 8 HD1 LYS 8 81.024 5.470 3.595
69 1HE LYS 8 HE2 LYS 8 80.975 4.084 6.262
70 2HE LYS 8 HE1 LYS 8 79.692 5.011 5.486
71 1HZ LYS 8 HZ1 LYS 8 79.855 3.192 3.686
72 2HZ LYS 8 HZ2 LYS 8 79.047 2.842 5.130
73 3HZ LYS 8 HZ3 LYS 8 80.624 2.282 4.888
74 H GLU 9 HN GLU 9 85.063 2.596 4.518
75 HA GLU 9 HA GLU 9 86.876 4.550 5.581
76 1HB GLU 9 HB2 GLU 9 85.236 2.803 6.758
77 2HB GLU 9 HB1 GLU 9 86.698 1.828 6.768
78 1HG GLU 9 HG2 GLU 9 87.783 3.967 7.783
79 2HG GLU 9 HG1 GLU 9 86.117 4.387 8.180
80 H GLN 10 HN GLN 10 87.190 1.276 4.273
81 HA GLN 10 HA GLN 10 90.027 1.178 4.692
82 1HB GLN 10 HB2 GLN 10 88.444 -0.807 4.645
83 2HB GLN 10 HB1 GLN 10 88.391 -0.610 2.901
84 1HG GLN 10 HG2 GLN 10 90.144 -1.951 2.791
85 2HG GLN 10 HG1 GLN 10 91.098 -0.653 3.505
86 1HE2 GLN 10 HE21 GLN 10 91.674 -3.399 3.807
87 2HE2 GLN 10 HE22 GLN 10 91.490 -3.804 5.471
88 H GLN 11 HN GLN 11 87.893 1.808 1.948
89 HA GLN 11 HA GLN 11 89.772 1.783 -0.106
90 1HB GLN 11 HB2 GLN 11 87.445 1.887 -0.651
91 2HB GLN 11 HB1 GLN 11 87.241 3.395 0.224
92 1HG GLN 11 HG2 GLN 11 88.240 4.644 -1.437
93 2HG GLN 11 HG1 GLN 11 89.118 3.261 -2.091
94 1HE2 GLN 11 HE21 GLN 11 86.901 5.355 -2.933
95 2HE2 GLN 11 HE22 GLN 11 85.852 4.383 -3.903
96 H ASN 12 HN ASN 12 89.073 4.235 2.294
97 HA ASN 12 HA ASN 12 90.194 6.475 1.129
98 1HB ASN 12 HB2 ASN 12 89.150 5.963 3.566
99 2HB ASN 12 HB1 ASN 12 90.858 6.029 3.989
100 1HD2 ASN 12 HD21 ASN 12 91.758 7.954 2.245
101 2HD2 ASN 12 HD22 ASN 12 91.035 9.472 2.643
102 H ALA 13 HN ALA 13 91.737 3.721 2.647
103 HA ALA 13 HA ALA 13 94.334 4.650 2.874
104 1HB ALA 13 HB1 ALA 13 93.141 2.310 3.405
105 2HB ALA 13 HB2 ALA 13 94.892 2.501 3.321
106 3HB ALA 13 HB3 ALA 13 94.005 1.868 1.934
107 H PHE 14 HN PHE 14 92.763 3.093 0.034
108 HA PHE 14 HA PHE 14 94.944 2.953 -1.623
109 1HB PHE 14 HB2 PHE 14 92.687 2.039 -2.088
110 2HB PHE 14 HB1 PHE 14 92.126 3.662 -2.439
111 HD1 PHE 14 HD1 PHE 14 93.263 4.932 -4.327
112 HD2 PHE 14 HD2 PHE 14 93.654 0.731 -3.766
113 HE1 PHE 14 HE1 PHE 14 93.960 4.690 -6.674
114 HE2 PHE 14 HE2 PHE 14 94.355 0.480 -6.112
115 HZ PHE 14 HZ PHE 14 94.509 2.460 -7.569
116 H TRP 15 HN TRP 15 92.570 5.615 -1.590
117 HA TRP 15 HA TRP 15 93.907 7.217 -3.452
118 1HB TRP 15 HB2 TRP 15 91.762 7.590 -1.501
119 2HB TRP 15 HB1 TRP 15 92.685 9.055 -1.818
120 HD1 TRP 15 HD1 TRP 15 91.783 6.357 -4.433
121 HE1 TRP 15 HE1 TRP 15 90.381 7.472 -6.279
122 HE3 TRP 15 HE3 TRP 15 91.327 11.017 -2.388
123 HZ2 TRP 15 HZ2 TRP 15 89.226 9.999 -6.798
124 HZ3 TRP 15 HZ3 TRP 15 90.057 12.729 -3.625
125 HH2 TRP 15 HH2 TRP 15 89.031 12.229 -5.784
126 H GLU 16 HN GLU 16 93.994 7.422 0.083
127 HA GLU 16 HA GLU 16 95.896 9.450 0.327
128 1HB GLU 16 HB2 GLU 16 95.054 7.184 2.107
129 2HB GLU 16 HB1 GLU 16 96.400 8.216 2.573
130 1HG GLU 16 HG2 GLU 16 94.290 9.911 1.780
131 2HG GLU 16 HG1 GLU 16 93.603 8.679 2.837
132 H ILE 17 HN ILE 17 96.190 6.183 -0.522
133 HA ILE 17 HA ILE 17 99.053 5.952 -0.037
134 HB ILE 17 HB ILE 17 97.088 4.089 -1.355
135 1HG1 ILE 17 HG12 ILE 17 98.945 3.417 0.896
136 2HG1 ILE 17 HG11 ILE 17 97.517 4.389 1.230
137 1HG2 ILE 17 HG21 ILE 17 98.796 3.413 -2.660
138 2HG2 ILE 17 HG22 ILE 17 99.374 2.625 -1.192
139 3HG2 ILE 17 HG23 ILE 17 100.010 4.205 -1.653
140 1HD1 ILE 17 HD11 ILE 17 96.199 2.538 0.084
141 2HD1 ILE 17 HD12 ILE 17 96.880 2.189 1.673
142 3HD1 ILE 17 HD13 ILE 17 97.670 1.575 0.221
143 H LEU 18 HN LEU 18 96.911 6.111 -2.844
144 HA LEU 18 HA LEU 18 98.913 6.249 -4.818
145 1HB LEU 18 HB2 LEU 18 95.980 6.697 -4.664
146 2HB LEU 18 HB1 LEU 18 96.814 7.438 -6.019
147 HG LEU 18 HG LEU 18 95.863 5.260 -6.607
148 1HD1 LEU 18 HD11 LEU 18 98.863 5.473 -6.596
149 2HD1 LEU 18 HD12 LEU 18 97.742 5.925 -7.882
150 3HD1 LEU 18 HD13 LEU 18 97.979 4.225 -7.476
151 1HD2 LEU 18 HD21 LEU 18 96.096 4.268 -4.336
152 2HD2 LEU 18 HD22 LEU 18 97.822 4.081 -4.646
153 3HD2 LEU 18 HD23 LEU 18 96.647 3.221 -5.641
154 H HIS 19 HN HIS 19 97.271 8.653 -2.901
155 HA HIS 19 HA HIS 19 98.197 10.875 -4.446
156 1HB HIS 19 HB2 HIS 19 96.181 10.556 -2.653
157 2HB HIS 19 HB1 HIS 19 97.388 11.341 -1.642
158 HD1 HIS 19 HD1 HIS 19 96.890 12.149 -5.293
159 HD2 HIS 19 HD2 HIS 19 96.165 13.812 -1.553
160 HE1 HIS 19 HE1 HIS 19 96.153 14.513 -5.738
161 HE2 HIS 19 HE2 HIS 19 95.667 15.482 -3.463
162 H LEU 20 HN LEU 20 98.907 9.787 -1.117
163 HA LEU 20 HA LEU 20 100.566 10.767 0.224
164 1HB LEU 20 HB2 LEU 20 101.737 8.680 -1.560
165 2HB LEU 20 HB1 LEU 20 102.686 9.424 -0.299
166 HG LEU 20 HG LEU 20 100.280 7.650 -0.018
167 1HD1 LEU 20 HD11 LEU 20 102.121 6.297 0.011
168 2HD1 LEU 20 HD12 LEU 20 102.011 6.709 1.723
169 3HD1 LEU 20 HD13 LEU 20 103.166 7.547 0.688
170 1HD2 LEU 20 HD21 LEU 20 100.458 8.114 2.443
171 2HD2 LEU 20 HD22 LEU 20 99.799 9.439 1.483
172 3HD2 LEU 20 HD23 LEU 20 101.471 9.500 2.040
173 HA PRO 21 HA PRO 21 102.286 13.809 -2.906
174 1HB PRO 21 HB2 PRO 21 101.265 15.729 -0.904
175 2HB PRO 21 HB1 PRO 21 101.068 15.731 -2.659
176 1HG PRO 21 HG2 PRO 21 99.029 15.147 -1.015
177 2HG PRO 21 HG1 PRO 21 99.221 14.350 -2.588
178 1HD PRO 21 HD2 PRO 21 99.858 13.324 0.150
179 2HD PRO 21 HD1 PRO 21 99.148 12.475 -1.236
180 H ASN 22 HN ASN 22 104.314 13.063 -2.275
181 HA ASN 22 HA ASN 22 106.263 14.356 -1.304
182 1HB ASN 22 HB2 ASN 22 104.517 14.056 1.107
183 2HB ASN 22 HB1 ASN 22 106.260 14.018 1.320
184 1HD2 ASN 22 HD21 ASN 22 105.384 15.967 2.616
185 2HD2 ASN 22 HD22 ASN 22 105.484 17.483 1.799
186 H LEU 23 HN LEU 23 104.803 11.478 -1.492
187 HA LEU 23 HA LEU 23 107.102 10.025 -0.382
188 1HB LEU 23 HB2 LEU 23 104.933 9.420 0.638
189 2HB LEU 23 HB1 LEU 23 104.314 9.017 -0.950
190 HG LEU 23 HG LEU 23 106.708 7.510 -0.499
191 1HD1 LEU 23 HD11 LEU 23 105.468 6.109 1.370
192 2HD1 LEU 23 HD12 LEU 23 104.840 7.701 1.796
193 3HD1 LEU 23 HD13 LEU 23 106.580 7.421 1.771
194 1HD2 LEU 23 HD21 LEU 23 104.787 5.670 -0.495
195 2HD2 LEU 23 HD22 LEU 23 105.294 6.500 -1.964
196 3HD2 LEU 23 HD23 LEU 23 103.849 7.030 -1.108
197 H ASN 24 HN ASN 24 108.114 8.479 -1.698
198 HA ASN 24 HA ASN 24 108.242 9.043 -4.436
199 1HB ASN 24 HB2 ASN 24 109.239 6.922 -2.655
200 2HB ASN 24 HB1 ASN 24 108.952 6.378 -4.305
201 1HD2 ASN 24 HD21 ASN 24 110.826 6.311 -5.299
202 2HD2 ASN 24 HD22 ASN 24 112.031 7.550 -5.285
203 H GLU 25 HN GLU 25 106.548 8.858 -5.869
204 HA GLU 25 HA GLU 25 104.218 7.497 -5.293
205 1HB GLU 25 HB2 GLU 25 103.545 8.028 -7.490
206 2HB GLU 25 HB1 GLU 25 104.621 9.327 -6.975
207 1HG GLU 25 HG2 GLU 25 106.426 7.796 -8.168
208 2HG GLU 25 HG1 GLU 25 105.008 7.236 -9.053
209 H GLU 26 HN GLU 26 107.218 6.290 -6.437
210 HA GLU 26 HA GLU 26 106.258 3.824 -7.548
211 1HB GLU 26 HB2 GLU 26 108.462 4.685 -8.180
212 2HB GLU 26 HB1 GLU 26 108.992 4.615 -6.505
213 1HG GLU 26 HG2 GLU 26 108.568 2.126 -6.614
214 2HG GLU 26 HG1 GLU 26 108.396 2.330 -8.357
215 H GLN 27 HN GLN 27 106.973 5.123 -4.493
216 HA GLN 27 HA GLN 27 107.065 2.631 -3.016
217 1HB GLN 27 HB2 GLN 27 107.371 5.486 -2.376
218 2HB GLN 27 HB1 GLN 27 106.476 4.589 -1.160
219 1HG GLN 27 HG2 GLN 27 109.172 3.760 -2.200
220 2HG GLN 27 HG1 GLN 27 108.932 4.759 -0.767
221 1HE2 GLN 27 HE21 GLN 27 109.733 3.337 0.705
222 2HE2 GLN 27 HE22 GLN 27 108.990 1.824 1.079
223 H ARG 28 HN ARG 28 104.824 5.202 -3.836
224 HA ARG 28 HA ARG 28 102.605 4.422 -2.316
225 1HB ARG 28 HB2 ARG 28 102.840 5.839 -4.974
226 2HB ARG 28 HB1 ARG 28 101.283 5.522 -4.228
227 1HG ARG 28 HG2 ARG 28 102.203 6.755 -2.193
228 2HG ARG 28 HG1 ARG 28 103.489 7.310 -3.268
229 1HD ARG 28 HD2 ARG 28 100.908 7.658 -4.492
230 2HD ARG 28 HD1 ARG 28 100.943 8.432 -2.930
231 HE ARG 28 HE ARG 28 102.856 9.712 -3.691
232 1HH1 ARG 28 HH11 ARG 28 101.017 8.066 -6.173
233 2HH1 ARG 28 HH12 ARG 28 101.532 9.139 -7.427
234 1HH2 ARG 28 HH21 ARG 28 103.521 11.113 -5.345
235 2HH2 ARG 28 HH22 ARG 28 102.951 10.864 -6.962
236 H ASN 29 HN ASN 29 103.437 3.674 -5.706
237 HA ASN 29 HA ASN 29 101.395 1.924 -6.294
238 1HB ASN 29 HB2 ASN 29 103.347 2.847 -7.760
239 2HB ASN 29 HB1 ASN 29 104.182 1.380 -7.259
240 1HD2 ASN 29 HD21 ASN 29 104.168 0.108 -8.976
241 2HD2 ASN 29 HD22 ASN 29 102.772 -0.328 -9.895
242 H GLY 30 HN GLY 30 104.602 1.147 -4.916
243 1HA GLY 30 HA2 GLY 30 104.276 -1.611 -4.685
244 2HA GLY 30 HA1 GLY 30 105.260 -0.632 -3.604
245 H PHE 31 HN PHE 31 103.139 0.972 -2.586
246 HA PHE 31 HA PHE 31 102.249 -0.678 -0.467
247 1HB PHE 31 HB2 PHE 31 101.733 2.152 -1.307
248 2HB PHE 31 HB1 PHE 31 100.713 1.429 -0.070
249 HD1 PHE 31 HD1 PHE 31 103.047 3.711 -0.172
250 HD2 PHE 31 HD2 PHE 31 102.633 -0.225 1.389
251 HE1 PHE 31 HE1 PHE 31 104.745 4.211 1.533
252 HE2 PHE 31 HE2 PHE 31 104.330 0.267 3.097
253 HZ PHE 31 HZ PHE 31 105.389 2.490 3.172
254 H ILE 32 HN ILE 32 100.834 0.345 -3.481
255 HA ILE 32 HA ILE 32 98.148 -0.404 -2.890
256 HB ILE 32 HB ILE 32 99.136 -0.500 -5.705
257 1HG1 ILE 32 HG12 ILE 32 98.796 2.045 -4.102
258 2HG1 ILE 32 HG11 ILE 32 100.289 1.448 -4.815
259 1HG2 ILE 32 HG21 ILE 32 96.971 0.603 -6.119
260 2HG2 ILE 32 HG22 ILE 32 96.653 0.586 -4.384
261 3HG2 ILE 32 HG23 ILE 32 96.801 -0.933 -5.269
262 1HD1 ILE 32 HD11 ILE 32 97.900 2.058 -6.505
263 2HD1 ILE 32 HD12 ILE 32 99.591 1.932 -6.981
264 3HD1 ILE 32 HD13 ILE 32 99.045 3.310 -6.027
265 H GLN 33 HN GLN 33 100.805 -2.026 -4.584
266 HA GLN 33 HA GLN 33 99.375 -4.337 -5.318
267 1HB GLN 33 HB2 GLN 33 102.318 -4.296 -4.674
268 2HB GLN 33 HB1 GLN 33 101.475 -5.319 -5.829
269 1HG GLN 33 HG2 GLN 33 100.888 -2.999 -6.931
270 2HG GLN 33 HG1 GLN 33 102.342 -2.491 -6.071
271 1HE2 GLN 33 HE21 GLN 33 103.280 -2.114 -8.143
272 2HE2 GLN 33 HE22 GLN 33 103.925 -3.427 -9.062
273 H SER 34 HN SER 34 101.485 -3.720 -2.512
274 HA SER 34 HA SER 34 101.115 -6.253 -1.317
275 1HB SER 34 HB2 SER 34 102.973 -4.876 -0.629
276 2HB SER 34 HB1 SER 34 101.887 -3.582 -0.119
277 HG SER 34 HG SER 34 102.812 -5.470 1.382
278 H LEU 35 HN LEU 35 99.390 -3.210 -1.067
279 HA LEU 35 HA LEU 35 97.674 -3.973 1.076
280 1HB LEU 35 HB2 LEU 35 98.011 -1.652 0.658
281 2HB LEU 35 HB1 LEU 35 97.531 -1.812 -1.021
282 HG LEU 35 HG LEU 35 95.237 -2.142 -0.414
283 1HD1 LEU 35 HD11 LEU 35 96.376 -2.492 2.309
284 2HD1 LEU 35 HD12 LEU 35 95.165 -3.451 1.468
285 3HD1 LEU 35 HD13 LEU 35 94.732 -1.877 2.138
286 1HD2 LEU 35 HD21 LEU 35 96.069 0.058 1.429
287 2HD2 LEU 35 HD22 LEU 35 94.721 -0.005 0.292
288 3HD2 LEU 35 HD23 LEU 35 96.368 0.197 -0.304
289 H LYS 36 HN LYS 36 97.171 -3.776 -2.464
290 HA LYS 36 HA LYS 36 94.518 -4.616 -2.477
291 1HB LYS 36 HB2 LYS 36 95.714 -3.709 -4.446
292 2HB LYS 36 HB1 LYS 36 96.614 -5.214 -4.571
293 1HG LYS 36 HG2 LYS 36 94.983 -6.170 -5.722
294 2HG LYS 36 HG1 LYS 36 93.792 -5.747 -4.490
295 1HD LYS 36 HD2 LYS 36 92.911 -4.484 -6.136
296 2HD LYS 36 HD1 LYS 36 94.171 -3.341 -5.667
297 1HE LYS 36 HE2 LYS 36 95.655 -4.426 -7.374
298 2HE LYS 36 HE1 LYS 36 94.249 -5.340 -7.919
299 1HZ LYS 36 HZ1 LYS 36 94.578 -3.380 -9.272
300 2HZ LYS 36 HZ2 LYS 36 94.504 -2.381 -7.909
301 3HZ LYS 36 HZ3 LYS 36 93.133 -3.241 -8.401
302 H ASP 37 HN ASP 37 97.357 -6.712 -3.223
303 HA ASP 37 HA ASP 37 96.010 -9.097 -3.253
304 1HB ASP 37 HB2 ASP 37 98.825 -8.320 -2.673
305 2HB ASP 37 HB1 ASP 37 98.343 -9.977 -2.323
306 H ASP 38 HN ASP 38 96.780 -7.174 -0.484
307 HA ASP 38 HA ASP 38 95.573 -9.238 1.215
308 1HB ASP 38 HB2 ASP 38 98.269 -8.665 1.287
309 2HB ASP 38 HB1 ASP 38 97.623 -7.670 2.587
310 HA PRO 39 HA PRO 39 93.277 -5.367 1.946
311 1HB PRO 39 HB2 PRO 39 91.017 -6.573 2.824
312 2HB PRO 39 HB1 PRO 39 91.405 -6.421 1.107
313 1HG PRO 39 HG2 PRO 39 91.785 -8.766 2.931
314 2HG PRO 39 HG1 PRO 39 91.142 -8.728 1.278
315 1HD PRO 39 HD2 PRO 39 93.692 -9.445 1.825
316 2HD PRO 39 HD1 PRO 39 93.242 -8.601 0.330
317 H SER 40 HN SER 40 93.799 -8.096 4.064
318 HA SER 40 HA SER 40 92.947 -6.810 6.473
319 1HB SER 40 HB2 SER 40 93.453 -9.394 5.826
320 2HB SER 40 HB1 SER 40 94.950 -8.984 6.662
321 HG SER 40 HG SER 40 93.862 -8.657 8.496
322 H GLN 41 HN GLN 41 95.603 -6.407 4.474
323 HA GLN 41 HA GLN 41 97.426 -5.615 6.597
324 1HB GLN 41 HB2 GLN 41 97.743 -5.795 3.600
325 2HB GLN 41 HB1 GLN 41 99.008 -5.251 4.698
326 1HG GLN 41 HG2 GLN 41 98.699 -7.484 5.891
327 2HG GLN 41 HG1 GLN 41 97.815 -7.980 4.451
328 1HE2 GLN 41 HE21 GLN 41 100.907 -6.967 5.709
329 2HE2 GLN 41 HE22 GLN 41 101.860 -7.561 4.396
330 H SER 42 HN SER 42 94.984 -4.182 4.808
331 HA SER 42 HA SER 42 95.824 -1.746 3.938
332 1HB SER 42 HB2 SER 42 93.633 -0.908 4.310
333 2HB SER 42 HB1 SER 42 93.450 -2.637 4.013
334 HG SER 42 HG SER 42 92.717 -1.230 6.159
335 H ALA 43 HN ALA 43 95.662 -2.751 7.278
336 HA ALA 43 HA ALA 43 95.990 -0.106 8.344
337 1HB ALA 43 HB1 ALA 43 95.626 -1.058 10.342
338 2HB ALA 43 HB2 ALA 43 96.795 -2.346 10.053
339 3HB ALA 43 HB3 ALA 43 95.163 -2.475 9.398
340 H ASN 44 HN ASN 44 98.119 -2.881 7.795
341 HA ASN 44 HA ASN 44 100.441 -1.682 8.884
342 1HB ASN 44 HB2 ASN 44 99.755 -4.206 8.003
343 2HB ASN 44 HB1 ASN 44 100.943 -3.684 6.813
344 1HD2 ASN 44 HD21 ASN 44 101.842 -5.690 8.058
345 2HD2 ASN 44 HD22 ASN 44 102.928 -5.303 9.345
346 H LEU 45 HN LEU 45 99.109 -1.794 5.609
347 HA LEU 45 HA LEU 45 101.427 -0.571 4.433
348 1HB LEU 45 HB2 LEU 45 98.669 -1.184 3.412
349 2HB LEU 45 HB1 LEU 45 99.821 -0.279 2.455
350 HG LEU 45 HG LEU 45 99.865 -2.565 1.744
351 1HD1 LEU 45 HD11 LEU 45 102.033 -2.201 1.436
352 2HD1 LEU 45 HD12 LEU 45 102.312 -3.061 2.949
353 3HD1 LEU 45 HD13 LEU 45 102.173 -1.305 2.947
354 1HD2 LEU 45 HD21 LEU 45 100.282 -4.411 3.194
355 2HD2 LEU 45 HD22 LEU 45 98.938 -3.481 3.857
356 3HD2 LEU 45 HD23 LEU 45 100.545 -3.337 4.569
357 H LEU 46 HN LEU 46 98.127 0.520 5.180
358 HA LEU 46 HA LEU 46 98.392 3.141 4.262
359 1HB LEU 46 HB2 LEU 46 96.275 1.960 4.950
360 2HB LEU 46 HB1 LEU 46 96.720 2.278 6.616
361 HG LEU 46 HG LEU 46 96.400 4.491 4.601
362 1HD1 LEU 46 HD11 LEU 46 94.166 4.564 4.852
363 2HD1 LEU 46 HD12 LEU 46 94.228 4.012 6.526
364 3HD1 LEU 46 HD13 LEU 46 94.349 2.847 5.208
365 1HD2 LEU 46 HD21 LEU 46 96.816 4.275 7.529
366 2HD2 LEU 46 HD22 LEU 46 95.763 5.564 6.946
367 3HD2 LEU 46 HD23 LEU 46 97.430 5.464 6.380
368 H ALA 47 HN ALA 47 99.079 1.766 7.467
369 HA ALA 47 HA ALA 47 99.734 4.249 8.673
370 1HB ALA 47 HB1 ALA 47 100.883 2.743 10.376
371 2HB ALA 47 HB2 ALA 47 100.295 1.391 9.407
372 3HB ALA 47 HB3 ALA 47 99.150 2.513 10.143
373 H GLU 48 HN GLU 48 101.748 1.613 7.369
374 HA GLU 48 HA GLU 48 104.240 2.735 7.860
375 1HB GLU 48 HB2 GLU 48 103.260 0.858 5.721
376 2HB GLU 48 HB1 GLU 48 104.943 1.357 5.806
377 1HG GLU 48 HG2 GLU 48 103.844 0.386 8.338
378 2HG GLU 48 HG1 GLU 48 103.888 -0.815 7.047
379 H ALA 49 HN ALA 49 102.059 3.196 5.114
380 HA ALA 49 HA ALA 49 103.870 4.822 3.626
381 1HB ALA 49 HB1 ALA 49 102.309 4.761 2.009
382 2HB ALA 49 HB2 ALA 49 101.002 5.188 3.113
383 3HB ALA 49 HB3 ALA 49 101.567 3.521 3.019
384 H LYS 50 HN LYS 50 101.384 5.428 6.019
385 HA LYS 50 HA LYS 50 101.133 8.209 5.633
386 1HB LYS 50 HB2 LYS 50 100.320 6.239 7.652
387 2HB LYS 50 HB1 LYS 50 100.579 7.855 8.293
388 1HG LYS 50 HG2 LYS 50 98.800 7.226 5.949
389 2HG LYS 50 HG1 LYS 50 98.241 7.398 7.614
390 1HD LYS 50 HD2 LYS 50 99.205 9.698 7.627
391 2HD LYS 50 HD1 LYS 50 99.564 9.506 5.910
392 1HE LYS 50 HE2 LYS 50 97.423 10.725 6.465
393 2HE LYS 50 HE1 LYS 50 97.274 9.368 5.349
394 1HZ LYS 50 HZ1 LYS 50 95.595 9.569 7.249
395 2HZ LYS 50 HZ2 LYS 50 96.838 8.999 8.244
396 3HZ LYS 50 HZ3 LYS 50 96.282 8.051 6.958
397 H LYS 51 HN LYS 51 102.974 6.418 8.118
398 HA LYS 51 HA LYS 51 104.247 8.722 9.145
399 1HB LYS 51 HB2 LYS 51 105.912 6.942 10.060
400 2HB LYS 51 HB1 LYS 51 104.260 6.975 10.656
401 1HG LYS 51 HG2 LYS 51 103.716 5.001 9.672
402 2HG LYS 51 HG1 LYS 51 104.842 5.226 8.334
403 1HD LYS 51 HD2 LYS 51 105.813 3.507 9.567
404 2HD LYS 51 HD1 LYS 51 106.678 4.941 10.124
405 1HE LYS 51 HE2 LYS 51 106.182 4.025 12.146
406 2HE LYS 51 HE1 LYS 51 104.709 4.964 11.905
407 1HZ LYS 51 HZ1 LYS 51 103.728 3.005 12.323
408 2HZ LYS 51 HZ2 LYS 51 105.091 2.092 11.914
409 3HZ LYS 51 HZ3 LYS 51 104.066 2.670 10.700
410 H LEU 52 HN LEU 52 105.327 6.272 6.801
411 HA LEU 52 HA LEU 52 107.942 7.154 6.467
412 1HB LEU 52 HB2 LEU 52 106.770 5.088 5.485
413 2HB LEU 52 HB1 LEU 52 106.272 6.148 4.180
414 HG LEU 52 HG LEU 52 109.075 6.481 4.541
415 1HD1 LEU 52 HD11 LEU 52 109.287 4.391 5.608
416 2HD1 LEU 52 HD12 LEU 52 109.741 4.122 3.925
417 3HD1 LEU 52 HD13 LEU 52 108.150 3.623 4.500
418 1HD2 LEU 52 HD21 LEU 52 108.914 5.208 2.222
419 2HD2 LEU 52 HD22 LEU 52 108.375 6.876 2.414
420 3HD2 LEU 52 HD23 LEU 52 107.199 5.562 2.436
421 H ASN 53 HN ASN 53 105.056 8.082 4.598
422 HA ASN 53 HA ASN 53 106.242 9.920 2.898
423 1HB ASN 53 HB2 ASN 53 104.022 9.371 2.391
424 2HB ASN 53 HB1 ASN 53 103.470 9.667 4.033
425 1HD2 ASN 53 HD21 ASN 53 103.540 10.851 0.948
426 2HD2 ASN 53 HD22 ASN 53 103.161 12.504 1.276
427 H ASP 54 HN ASP 54 105.024 10.381 6.188
428 HA ASP 54 HA ASP 54 105.250 13.154 6.335
429 1HB ASP 54 HB2 ASP 54 105.232 10.940 8.337
430 2HB ASP 54 HB1 ASP 54 105.687 12.554 8.877
431 H ALA 55 HN ALA 55 107.618 10.703 7.434
432 HA ALA 55 HA ALA 55 109.605 12.660 8.028
433 1HB ALA 55 HB1 ALA 55 110.792 10.952 8.892
434 2HB ALA 55 HB2 ALA 55 110.495 9.902 7.506
435 3HB ALA 55 HB3 ALA 55 109.259 10.092 8.750
436 H GLN 56 HN GLN 56 109.269 10.309 5.385
437 HA GLN 56 HA GLN 56 111.585 11.166 4.006
438 1HB GLN 56 HB2 GLN 56 110.987 9.668 2.301
439 2HB GLN 56 HB1 GLN 56 110.387 8.932 3.778
440 1HG GLN 56 HG2 GLN 56 108.371 8.793 2.895
441 2HG GLN 56 HG1 GLN 56 108.314 10.545 2.717
442 1HE2 GLN 56 HE21 GLN 56 109.762 11.289 0.785
443 2HE2 GLN 56 HE22 GLN 56 109.477 10.438 -0.690
444 H ALA 57 HN ALA 57 108.584 12.672 4.349
445 HA ALA 57 HA ALA 57 108.117 13.806 1.849
446 1HB ALA 57 HB1 ALA 57 106.401 14.227 3.298
447 2HB ALA 57 HB2 ALA 57 107.238 15.778 3.363
448 3HB ALA 57 HB3 ALA 57 107.480 14.591 4.644
449 HA PRO 58 HA PRO 58 111.720 16.342 1.234
450 1HB PRO 58 HB2 PRO 58 109.984 17.983 -0.502
451 2HB PRO 58 HB1 PRO 58 111.476 17.125 -0.890
452 1HG PRO 58 HG2 PRO 58 109.096 16.242 -1.742
453 2HG PRO 58 HG1 PRO 58 110.388 15.124 -1.267
454 1HD PRO 58 HD2 PRO 58 107.943 15.951 0.244
455 2HD PRO 58 HD1 PRO 58 108.713 14.355 0.128
456 H LYS 59 HN LYS 59 108.913 18.495 0.938
457 HA LYS 59 HA LYS 59 109.898 20.779 1.948
458 1HB LYS 59 HB2 LYS 59 107.622 21.341 2.747
459 2HB LYS 59 HB1 LYS 59 107.637 20.654 1.132
460 1HG LYS 59 HG2 LYS 59 105.969 19.387 1.925
461 2HG LYS 59 HG1 LYS 59 107.281 18.422 2.605
462 1HD LYS 59 HD2 LYS 59 107.047 19.425 4.731
463 2HD LYS 59 HD1 LYS 59 106.025 20.715 4.093
464 1HE LYS 59 HE2 LYS 59 104.279 19.488 4.732
465 2HE LYS 59 HE1 LYS 59 104.678 18.396 3.406
466 1HZ LYS 59 HZ1 LYS 59 106.133 18.022 5.905
467 2HZ LYS 59 HZ2 LYS 59 105.558 16.873 4.805
468 3HZ LYS 59 HZ3 LYS 59 104.496 17.591 5.908
469 H ALA 60 HN ALA 60 109.717 21.885 4.000
470 HA ALA 60 HA ALA 60 109.195 20.672 6.445
471 1HB ALA 60 HB1 ALA 60 111.063 19.641 7.146
472 2HB ALA 60 HB2 ALA 60 112.123 20.846 6.414
473 3HB ALA 60 HB3 ALA 60 111.455 19.544 5.430
Start of MODEL 2
1 1H GLY -1 HT1 GLY -1 85.528 -9.726 -12.677
2 2H GLY -1 HT2 GLY -1 83.919 -10.103 -12.314
3 3H GLY -1 HT3 GLY -1 85.147 -11.208 -11.954
4 1HA GLY -1 HA1 GLY -1 84.215 -8.942 -10.452
5 2HA GLY -1 HA2 GLY -1 85.082 -10.369 -9.904
6 H SER 0 HN SER 0 87.393 -10.199 -11.431
7 HA SER 0 HA SER 0 89.474 -9.275 -11.378
8 1HB SER 0 HB2 SER 0 87.865 -7.402 -12.503
9 2HB SER 0 HB1 SER 0 88.498 -6.493 -11.131
10 HG SER 0 HG SER 0 90.335 -6.357 -12.127
11 H THR 1 HN THR 1 90.997 -7.935 -10.052
12 HA THR 1 HA THR 1 90.662 -8.486 -7.331
13 HB THR 1 HB THR 1 92.884 -8.301 -7.928
14 HG1 THR 1 HG1 THR 1 92.899 -7.173 -6.100
15 1HG2 THR 1 HG21 THR 1 93.385 -5.734 -8.908
16 2HG2 THR 1 HG22 THR 1 92.003 -6.342 -9.818
17 3HG2 THR 1 HG23 THR 1 93.503 -7.266 -9.773
18 H ALA 2 HN ALA 2 90.914 -5.222 -8.747
19 HA ALA 2 HA ALA 2 90.405 -3.435 -7.008
20 1HB ALA 2 HB1 ALA 2 88.358 -3.455 -9.177
21 2HB ALA 2 HB2 ALA 2 90.074 -3.319 -9.562
22 3HB ALA 2 HB3 ALA 2 89.302 -2.110 -8.535
23 H ASP 3 HN ASP 3 87.823 -2.289 -7.120
24 HA ASP 3 HA ASP 3 86.111 -2.073 -5.610
25 1HB ASP 3 HB2 ASP 3 85.543 -3.905 -7.596
26 2HB ASP 3 HB1 ASP 3 85.048 -4.745 -6.129
27 H ASN 4 HN ASN 4 86.728 -5.558 -5.376
28 HA ASN 4 HA ASN 4 86.780 -6.955 -3.569
29 1HB ASN 4 HB2 ASN 4 89.058 -5.728 -3.722
30 2HB ASN 4 HB1 ASN 4 88.532 -4.880 -2.273
31 1HD2 ASN 4 HD21 ASN 4 89.214 -8.041 -3.639
32 2HD2 ASN 4 HD22 ASN 4 89.561 -8.823 -2.138
33 H LYS 5 HN LYS 5 87.463 -5.344 -0.843
34 HA LYS 5 HA LYS 5 84.686 -4.618 -0.246
35 1HB LYS 5 HB2 LYS 5 86.396 -6.660 1.101
36 2HB LYS 5 HB1 LYS 5 85.308 -5.700 2.095
37 1HG LYS 5 HG2 LYS 5 84.312 -7.120 -0.343
38 2HG LYS 5 HG1 LYS 5 84.490 -7.961 1.199
39 1HD LYS 5 HD2 LYS 5 83.003 -6.368 2.269
40 2HD LYS 5 HD1 LYS 5 82.873 -5.451 0.767
41 1HE LYS 5 HE2 LYS 5 81.918 -8.268 1.260
42 2HE LYS 5 HE1 LYS 5 80.916 -6.835 1.035
43 1HZ LYS 5 HZ1 LYS 5 82.147 -8.522 -0.925
44 2HZ LYS 5 HZ2 LYS 5 82.490 -6.886 -1.186
45 3HZ LYS 5 HZ3 LYS 5 80.884 -7.409 -1.100
46 H PHE 6 HN PHE 6 87.062 -3.029 -0.812
47 HA PHE 6 HA PHE 6 88.029 -1.989 1.659
48 1HB PHE 6 HB2 PHE 6 88.364 -1.214 -1.222
49 2HB PHE 6 HB1 PHE 6 88.927 -0.150 0.061
50 HD1 PHE 6 HD1 PHE 6 91.167 -0.280 0.449
51 HD2 PHE 6 HD2 PHE 6 89.066 -3.823 -0.616
52 HE1 PHE 6 HE1 PHE 6 93.251 -1.567 0.636
53 HE2 PHE 6 HE2 PHE 6 91.149 -5.119 -0.432
54 HZ PHE 6 HZ PHE 6 93.249 -3.991 0.198
55 H ASN 7 HN ASN 7 85.871 -1.556 2.574
56 HA ASN 7 HA ASN 7 84.100 0.343 1.550
57 1HB ASN 7 HB2 ASN 7 84.149 -1.266 3.742
58 2HB ASN 7 HB1 ASN 7 84.332 0.306 4.482
59 1HD2 ASN 7 HD21 ASN 7 82.430 -1.173 1.870
60 2HD2 ASN 7 HD22 ASN 7 80.927 -0.460 2.335
61 H LYS 8 HN LYS 8 83.927 2.052 3.937
62 HA LYS 8 HA LYS 8 85.213 4.274 2.974
63 1HB LYS 8 HB2 LYS 8 84.355 3.784 5.821
64 2HB LYS 8 HB1 LYS 8 84.657 5.356 5.096
65 1HG LYS 8 HG2 LYS 8 82.744 5.243 3.765
66 2HG LYS 8 HG1 LYS 8 82.586 3.498 3.983
67 1HD LYS 8 HD2 LYS 8 81.423 3.736 5.882
68 2HD LYS 8 HD1 LYS 8 82.518 4.976 6.496
69 1HE LYS 8 HE2 LYS 8 80.367 5.451 4.439
70 2HE LYS 8 HE1 LYS 8 80.192 5.776 6.163
71 1HZ LYS 8 HZ1 LYS 8 82.520 6.963 4.909
72 2HZ LYS 8 HZ2 LYS 8 81.432 7.626 6.023
73 3HZ LYS 8 HZ3 LYS 8 81.034 7.575 4.380
74 H GLU 9 HN GLU 9 86.151 2.386 5.844
75 HA GLU 9 HA GLU 9 88.490 3.826 6.383
76 1HB GLU 9 HB2 GLU 9 87.275 1.307 7.272
77 2HB GLU 9 HB1 GLU 9 89.028 1.341 7.395
78 1HG GLU 9 HG2 GLU 9 87.436 3.626 8.457
79 2HG GLU 9 HG1 GLU 9 87.549 2.129 9.383
80 H GLN 10 HN GLN 10 88.140 0.686 4.682
81 HA GLN 10 HA GLN 10 90.847 0.276 4.175
82 1HB GLN 10 HB2 GLN 10 88.296 -0.809 3.312
83 2HB GLN 10 HB1 GLN 10 89.481 -0.822 2.021
84 1HG GLN 10 HG2 GLN 10 89.832 -2.061 4.732
85 2HG GLN 10 HG1 GLN 10 89.451 -2.913 3.232
86 1HE2 GLN 10 HE21 GLN 10 91.414 -4.103 3.875
87 2HE2 GLN 10 HE22 GLN 10 92.943 -3.489 3.373
88 H GLN 11 HN GLN 11 88.377 1.621 1.984
89 HA GLN 11 HA GLN 11 90.008 2.058 -0.206
90 1HB GLN 11 HB2 GLN 11 87.615 2.208 -0.381
91 2HB GLN 11 HB1 GLN 11 87.573 3.587 0.712
92 1HG GLN 11 HG2 GLN 11 89.023 4.769 -1.041
93 2HG GLN 11 HG1 GLN 11 88.538 3.463 -2.120
94 1HE2 GLN 11 HE21 GLN 11 87.338 6.072 -0.093
95 2HE2 GLN 11 HE22 GLN 11 85.861 6.313 -0.956
96 H ASN 12 HN ASN 12 89.585 4.043 2.663
97 HA ASN 12 HA ASN 12 90.662 6.438 1.808
98 1HB ASN 12 HB2 ASN 12 89.819 6.431 4.001
99 2HB ASN 12 HB1 ASN 12 90.738 5.000 4.451
100 1HD2 ASN 12 HD21 ASN 12 92.541 5.279 5.553
101 2HD2 ASN 12 HD22 ASN 12 93.385 6.774 5.751
102 H ALA 13 HN ALA 13 92.310 3.475 2.824
103 HA ALA 13 HA ALA 13 94.916 4.387 2.855
104 1HB ALA 13 HB1 ALA 13 95.488 1.998 2.157
105 2HB ALA 13 HB2 ALA 13 93.747 1.716 2.144
106 3HB ALA 13 HB3 ALA 13 94.549 2.211 3.635
107 H PHE 14 HN PHE 14 93.063 3.135 0.034
108 HA PHE 14 HA PHE 14 95.072 3.165 -1.835
109 1HB PHE 14 HB2 PHE 14 92.797 2.292 -2.169
110 2HB PHE 14 HB1 PHE 14 92.181 3.930 -2.247
111 HD1 PHE 14 HD1 PHE 14 95.368 2.922 -3.790
112 HD2 PHE 14 HD2 PHE 14 91.237 3.735 -4.417
113 HE1 PHE 14 HE1 PHE 14 95.745 2.954 -6.221
114 HE2 PHE 14 HE2 PHE 14 91.609 3.774 -6.847
115 HZ PHE 14 HZ PHE 14 93.865 3.380 -7.753
116 H TRP 15 HN TRP 15 92.755 5.806 -1.288
117 HA TRP 15 HA TRP 15 93.920 7.610 -3.084
118 1HB TRP 15 HB2 TRP 15 92.080 7.851 -0.765
119 2HB TRP 15 HB1 TRP 15 92.850 9.322 -1.349
120 HD1 TRP 15 HD1 TRP 15 91.216 6.357 -3.269
121 HE1 TRP 15 HE1 TRP 15 89.545 7.352 -4.956
122 HE3 TRP 15 HE3 TRP 15 91.774 11.299 -2.119
123 HZ2 TRP 15 HZ2 TRP 15 88.588 9.909 -5.698
124 HZ3 TRP 15 HZ3 TRP 15 90.445 12.960 -3.362
125 HH2 TRP 15 HH2 TRP 15 88.887 12.277 -5.114
126 H GLU 16 HN GLU 16 94.259 7.533 0.456
127 HA GLU 16 HA GLU 16 96.179 9.520 0.716
128 1HB GLU 16 HB2 GLU 16 95.538 7.090 2.373
129 2HB GLU 16 HB1 GLU 16 96.825 8.195 2.836
130 1HG GLU 16 HG2 GLU 16 93.999 9.085 2.344
131 2HG GLU 16 HG1 GLU 16 94.592 8.575 3.924
132 H ILE 17 HN ILE 17 96.456 6.298 -0.372
133 HA ILE 17 HA ILE 17 99.341 6.114 -0.072
134 HB ILE 17 HB ILE 17 97.248 4.286 -1.123
135 1HG1 ILE 17 HG12 ILE 17 98.491 2.641 0.146
136 2HG1 ILE 17 HG11 ILE 17 99.847 3.746 0.331
137 1HG2 ILE 17 HG21 ILE 17 98.555 4.316 -3.095
138 2HG2 ILE 17 HG22 ILE 17 99.056 2.878 -2.204
139 3HG2 ILE 17 HG23 ILE 17 100.064 4.326 -2.179
140 1HD1 ILE 17 HD11 ILE 17 98.908 4.019 2.357
141 2HD1 ILE 17 HD12 ILE 17 97.291 3.610 1.792
142 3HD1 ILE 17 HD13 ILE 17 97.951 5.216 1.489
143 H LEU 18 HN LEU 18 97.019 6.521 -2.702
144 HA LEU 18 HA LEU 18 98.932 6.917 -4.745
145 1HB LEU 18 HB2 LEU 18 96.009 7.125 -4.430
146 2HB LEU 18 HB1 LEU 18 96.681 8.218 -5.625
147 HG LEU 18 HG LEU 18 97.557 6.418 -6.924
148 1HD1 LEU 18 HD11 LEU 18 98.359 5.001 -5.123
149 2HD1 LEU 18 HD12 LEU 18 97.351 4.079 -6.238
150 3HD1 LEU 18 HD13 LEU 18 96.700 4.595 -4.682
151 1HD2 LEU 18 HD21 LEU 18 95.466 5.032 -7.288
152 2HD2 LEU 18 HD22 LEU 18 95.283 6.781 -7.425
153 3HD2 LEU 18 HD23 LEU 18 94.747 5.949 -5.965
154 H HIS 19 HN HIS 19 97.518 9.022 -2.369
155 HA HIS 19 HA HIS 19 98.189 11.462 -3.697
156 1HB HIS 19 HB2 HIS 19 96.554 10.887 -1.625
157 2HB HIS 19 HB1 HIS 19 97.973 11.439 -0.740
158 HD1 HIS 19 HD1 HIS 19 98.661 13.603 -3.081
159 HD2 HIS 19 HD2 HIS 19 95.133 13.201 -0.921
160 HE1 HIS 19 HE1 HIS 19 97.547 15.856 -3.186
161 HE2 HIS 19 HE2 HIS 19 95.457 15.612 -1.802
162 H LEU 20 HN LEU 20 99.515 9.843 -0.814
163 HA LEU 20 HA LEU 20 101.465 10.668 0.291
164 1HB LEU 20 HB2 LEU 20 102.154 8.707 -1.874
165 2HB LEU 20 HB1 LEU 20 103.222 9.109 -0.555
166 HG LEU 20 HG LEU 20 100.669 7.551 -0.500
167 1HD1 LEU 20 HD11 LEU 20 102.580 6.197 -0.647
168 2HD1 LEU 20 HD12 LEU 20 102.109 6.158 1.054
169 3HD1 LEU 20 HD13 LEU 20 103.457 7.170 0.534
170 1HD2 LEU 20 HD21 LEU 20 100.515 7.735 1.887
171 2HD2 LEU 20 HD22 LEU 20 100.418 9.347 1.182
172 3HD2 LEU 20 HD23 LEU 20 101.913 8.800 1.931
173 HA PRO 21 HA PRO 21 102.793 13.847 -2.850
174 1HB PRO 21 HB2 PRO 21 102.524 15.590 -0.481
175 2HB PRO 21 HB1 PRO 21 101.920 15.825 -2.123
176 1HG PRO 21 HG2 PRO 21 100.272 15.228 -0.094
177 2HG PRO 21 HG1 PRO 21 99.995 14.613 -1.734
178 1HD PRO 21 HD2 PRO 21 101.136 13.215 0.651
179 2HD PRO 21 HD1 PRO 21 100.029 12.601 -0.593
180 H ASN 22 HN ASN 22 104.853 13.049 -2.951
181 HA ASN 22 HA ASN 22 107.095 13.798 -2.631
182 1HB ASN 22 HB2 ASN 22 106.369 14.100 0.284
183 2HB ASN 22 HB1 ASN 22 107.982 14.320 -0.378
184 1HD2 ASN 22 HD21 ASN 22 107.916 16.464 0.430
185 2HD2 ASN 22 HD22 ASN 22 107.075 17.703 -0.431
186 H LEU 23 HN LEU 23 105.346 11.260 -1.642
187 HA LEU 23 HA LEU 23 107.586 9.745 -0.546
188 1HB LEU 23 HB2 LEU 23 105.346 9.284 0.352
189 2HB LEU 23 HB1 LEU 23 104.786 8.869 -1.257
190 HG LEU 23 HG LEU 23 107.030 7.230 -0.743
191 1HD1 LEU 23 HD11 LEU 23 107.040 7.182 1.509
192 2HD1 LEU 23 HD12 LEU 23 105.714 6.042 1.267
193 3HD1 LEU 23 HD13 LEU 23 105.369 7.732 1.639
194 1HD2 LEU 23 HD21 LEU 23 104.743 5.677 -0.444
195 2HD2 LEU 23 HD22 LEU 23 105.617 6.000 -1.941
196 3HD2 LEU 23 HD23 LEU 23 104.246 7.009 -1.485
197 H ASN 24 HN ASN 24 108.632 8.054 -1.719
198 HA ASN 24 HA ASN 24 108.950 8.469 -4.462
199 1HB ASN 24 HB2 ASN 24 110.321 6.972 -2.792
200 2HB ASN 24 HB1 ASN 24 109.197 5.710 -3.285
201 1HD2 ASN 24 HD21 ASN 24 110.986 4.577 -4.153
202 2HD2 ASN 24 HD22 ASN 24 111.650 5.016 -5.686
203 H GLU 25 HN GLU 25 107.326 8.298 -6.031
204 HA GLU 25 HA GLU 25 104.884 7.139 -5.476
205 1HB GLU 25 HB2 GLU 25 105.070 8.792 -7.156
206 2HB GLU 25 HB1 GLU 25 106.261 7.851 -8.053
207 1HG GLU 25 HG2 GLU 25 104.570 6.197 -8.619
208 2HG GLU 25 HG1 GLU 25 103.372 7.086 -7.680
209 H GLU 26 HN GLU 26 107.851 5.695 -6.382
210 HA GLU 26 HA GLU 26 106.835 3.238 -7.444
211 1HB GLU 26 HB2 GLU 26 109.137 3.889 -7.908
212 2HB GLU 26 HB1 GLU 26 109.502 3.944 -6.189
213 1HG GLU 26 HG2 GLU 26 109.329 1.590 -5.986
214 2HG GLU 26 HG1 GLU 26 108.639 1.437 -7.601
215 H GLN 27 HN GLN 27 107.327 4.656 -4.406
216 HA GLN 27 HA GLN 27 107.072 2.248 -2.809
217 1HB GLN 27 HB2 GLN 27 107.401 5.150 -2.220
218 2HB GLN 27 HB1 GLN 27 106.577 4.175 -1.014
219 1HG GLN 27 HG2 GLN 27 109.309 3.587 -2.126
220 2HG GLN 27 HG1 GLN 27 108.993 4.417 -0.603
221 1HE2 GLN 27 HE21 GLN 27 107.308 3.124 0.772
222 2HE2 GLN 27 HE22 GLN 27 107.685 1.450 0.970
223 H ARG 28 HN ARG 28 105.175 4.875 -4.067
224 HA ARG 28 HA ARG 28 102.759 4.368 -2.694
225 1HB ARG 28 HB2 ARG 28 103.531 5.869 -5.158
226 2HB ARG 28 HB1 ARG 28 101.833 5.515 -4.896
227 1HG ARG 28 HG2 ARG 28 102.240 6.546 -2.556
228 2HG ARG 28 HG1 ARG 28 103.666 7.254 -3.320
229 1HD ARG 28 HD2 ARG 28 100.826 7.537 -4.304
230 2HD ARG 28 HD1 ARG 28 101.719 8.761 -3.428
231 HE ARG 28 HE ARG 28 102.846 7.786 -5.928
232 1HH1 ARG 28 HH11 ARG 28 101.243 10.352 -4.189
233 2HH1 ARG 28 HH12 ARG 28 101.593 11.550 -5.386
234 1HH2 ARG 28 HH21 ARG 28 103.291 9.362 -7.509
235 2HH2 ARG 28 HH22 ARG 28 102.755 10.990 -7.268
236 H ASN 29 HN ASN 29 104.260 3.008 -5.555
237 HA ASN 29 HA ASN 29 101.891 1.684 -6.477
238 1HB ASN 29 HB2 ASN 29 103.746 2.302 -8.002
239 2HB ASN 29 HB1 ASN 29 104.793 1.160 -7.165
240 1HD2 ASN 29 HD21 ASN 29 101.448 1.018 -8.343
241 2HD2 ASN 29 HD22 ASN 29 101.662 -0.414 -9.285
242 H GLY 30 HN GLY 30 104.861 0.692 -4.784
243 1HA GLY 30 HA2 GLY 30 104.200 -2.023 -4.493
244 2HA GLY 30 HA1 GLY 30 105.271 -1.122 -3.427
245 H PHE 31 HN PHE 31 103.178 0.816 -2.734
246 HA PHE 31 HA PHE 31 102.105 -0.553 -0.488
247 1HB PHE 31 HB2 PHE 31 102.080 2.215 -1.533
248 2HB PHE 31 HB1 PHE 31 100.724 1.776 -0.494
249 HD1 PHE 31 HD1 PHE 31 101.868 0.018 1.438
250 HD2 PHE 31 HD2 PHE 31 103.534 3.527 -0.278
251 HE1 PHE 31 HE1 PHE 31 103.263 0.294 3.420
252 HE2 PHE 31 HE2 PHE 31 104.945 3.832 1.717
253 HZ PHE 31 HZ PHE 31 104.813 2.219 3.575
254 H ILE 32 HN ILE 32 100.679 0.631 -3.514
255 HA ILE 32 HA ILE 32 98.003 -0.064 -2.847
256 HB ILE 32 HB ILE 32 98.944 -0.080 -5.693
257 1HG1 ILE 32 HG12 ILE 32 98.238 2.514 -4.389
258 2HG1 ILE 32 HG11 ILE 32 99.873 1.890 -4.242
259 1HG2 ILE 32 HG21 ILE 32 96.512 -0.407 -4.653
260 2HG2 ILE 32 HG22 ILE 32 96.785 0.366 -6.214
261 3HG2 ILE 32 HG23 ILE 32 96.524 1.352 -4.775
262 1HD1 ILE 32 HD11 ILE 32 99.816 3.391 -6.085
263 2HD1 ILE 32 HD12 ILE 32 98.415 2.569 -6.773
264 3HD1 ILE 32 HD13 ILE 32 99.976 1.754 -6.720
265 H GLN 33 HN GLN 33 100.533 -1.640 -4.714
266 HA GLN 33 HA GLN 33 99.096 -3.910 -5.501
267 1HB GLN 33 HB2 GLN 33 102.050 -3.566 -4.983
268 2HB GLN 33 HB1 GLN 33 101.346 -4.983 -5.750
269 1HG GLN 33 HG2 GLN 33 100.334 -3.286 -7.414
270 2HG GLN 33 HG1 GLN 33 101.562 -2.189 -6.784
271 1HE2 GLN 33 HE21 GLN 33 103.668 -2.472 -7.342
272 2HE2 GLN 33 HE22 GLN 33 104.207 -3.645 -8.491
273 H SER 34 HN SER 34 101.220 -3.488 -2.662
274 HA SER 34 HA SER 34 100.854 -6.095 -1.655
275 1HB SER 34 HB2 SER 34 102.700 -5.019 -0.735
276 2HB SER 34 HB1 SER 34 101.827 -3.508 -0.476
277 HG SER 34 HG SER 34 102.053 -4.459 1.503
278 H LEU 35 HN LEU 35 99.099 -3.087 -1.111
279 HA LEU 35 HA LEU 35 97.331 -4.216 0.880
280 1HB LEU 35 HB2 LEU 35 97.746 -1.862 0.987
281 2HB LEU 35 HB1 LEU 35 97.320 -1.645 -0.701
282 HG LEU 35 HG LEU 35 94.979 -2.233 -0.166
283 1HD1 LEU 35 HD11 LEU 35 94.384 -2.144 2.303
284 2HD1 LEU 35 HD12 LEU 35 96.096 -2.436 2.611
285 3HD1 LEU 35 HD13 LEU 35 95.147 -3.622 1.716
286 1HD2 LEU 35 HD21 LEU 35 94.875 -0.004 -0.124
287 2HD2 LEU 35 HD22 LEU 35 96.412 0.130 0.733
288 3HD2 LEU 35 HD23 LEU 35 94.920 -0.139 1.634
289 H LYS 36 HN LYS 36 97.434 -3.801 -2.574
290 HA LYS 36 HA LYS 36 94.714 -4.113 -3.162
291 1HB LYS 36 HB2 LYS 36 97.242 -4.232 -4.696
292 2HB LYS 36 HB1 LYS 36 95.839 -4.998 -5.426
293 1HG LYS 36 HG2 LYS 36 95.738 -2.189 -4.385
294 2HG LYS 36 HG1 LYS 36 96.292 -2.567 -6.018
295 1HD LYS 36 HD2 LYS 36 93.630 -3.439 -4.905
296 2HD LYS 36 HD1 LYS 36 93.865 -1.958 -5.836
297 1HE LYS 36 HE2 LYS 36 94.367 -4.782 -6.766
298 2HE LYS 36 HE1 LYS 36 93.068 -3.712 -7.290
299 1HZ LYS 36 HZ1 LYS 36 94.681 -3.597 -8.959
300 2HZ LYS 36 HZ2 LYS 36 95.961 -3.488 -7.859
301 3HZ LYS 36 HZ3 LYS 36 94.910 -2.179 -8.063
302 H ASP 37 HN ASP 37 97.326 -6.637 -3.029
303 HA ASP 37 HA ASP 37 95.375 -8.632 -3.759
304 1HB ASP 37 HB2 ASP 37 98.328 -8.608 -3.224
305 2HB ASP 37 HB1 ASP 37 97.449 -10.130 -3.297
306 H ASP 38 HN ASP 38 96.417 -7.156 -0.893
307 HA ASP 38 HA ASP 38 95.178 -9.313 0.661
308 1HB ASP 38 HB2 ASP 38 97.830 -9.146 0.676
309 2HB ASP 38 HB1 ASP 38 97.499 -7.896 1.874
310 HA PRO 39 HA PRO 39 93.141 -5.447 1.925
311 1HB PRO 39 HB2 PRO 39 90.932 -6.655 2.941
312 2HB PRO 39 HB1 PRO 39 91.138 -6.332 1.215
313 1HG PRO 39 HG2 PRO 39 91.579 -8.875 2.732
314 2HG PRO 39 HG1 PRO 39 90.795 -8.632 1.160
315 1HD PRO 39 HD2 PRO 39 93.346 -9.507 1.397
316 2HD PRO 39 HD1 PRO 39 92.804 -8.501 0.037
317 H SER 40 HN SER 40 93.931 -8.339 3.694
318 HA SER 40 HA SER 40 93.298 -7.395 6.298
319 1HB SER 40 HB2 SER 40 93.683 -9.810 5.640
320 2HB SER 40 HB1 SER 40 95.408 -9.444 5.592
321 HG SER 40 HG SER 40 95.430 -9.172 7.739
322 H GLN 41 HN GLN 41 95.902 -6.847 4.118
323 HA GLN 41 HA GLN 41 97.843 -6.020 6.043
324 1HB GLN 41 HB2 GLN 41 97.586 -5.858 3.062
325 2HB GLN 41 HB1 GLN 41 98.844 -4.946 3.883
326 1HG GLN 41 HG2 GLN 41 99.311 -7.296 5.003
327 2HG GLN 41 HG1 GLN 41 98.551 -7.872 3.520
328 1HE2 GLN 41 HE21 GLN 41 101.356 -6.576 4.948
329 2HE2 GLN 41 HE22 GLN 41 102.324 -6.481 3.520
330 H SER 42 HN SER 42 95.043 -4.594 4.850
331 HA SER 42 HA SER 42 95.239 -2.025 4.326
332 1HB SER 42 HB2 SER 42 93.126 -1.794 5.102
333 2HB SER 42 HB1 SER 42 93.254 -3.526 5.396
334 HG SER 42 HG SER 42 93.216 -1.421 7.188
335 H ALA 43 HN ALA 43 95.563 -3.069 7.742
336 HA ALA 43 HA ALA 43 96.221 -0.491 8.686
337 1HB ALA 43 HB1 ALA 43 96.739 -3.175 9.953
338 2HB ALA 43 HB2 ALA 43 95.272 -2.210 10.121
339 3HB ALA 43 HB3 ALA 43 96.798 -1.614 10.772
340 H ASN 44 HN ASN 44 98.247 -3.284 7.844
341 HA ASN 44 HA ASN 44 100.685 -2.136 8.688
342 1HB ASN 44 HB2 ASN 44 99.963 -4.610 7.874
343 2HB ASN 44 HB1 ASN 44 100.764 -4.034 6.415
344 1HD2 ASN 44 HD21 ASN 44 101.160 -4.643 9.841
345 2HD2 ASN 44 HD22 ASN 44 102.882 -4.781 9.812
346 H LEU 45 HN LEU 45 98.942 -2.075 5.645
347 HA LEU 45 HA LEU 45 101.031 -0.753 4.198
348 1HB LEU 45 HB2 LEU 45 98.177 -1.461 3.633
349 2HB LEU 45 HB1 LEU 45 99.057 -0.403 2.550
350 HG LEU 45 HG LEU 45 98.928 -3.026 2.163
351 1HD1 LEU 45 HD11 LEU 45 100.494 -2.701 0.571
352 2HD1 LEU 45 HD12 LEU 45 101.624 -1.917 1.681
353 3HD1 LEU 45 HD13 LEU 45 100.251 -1.017 1.031
354 1HD2 LEU 45 HD21 LEU 45 100.778 -4.234 3.023
355 2HD2 LEU 45 HD22 LEU 45 100.002 -3.458 4.403
356 3HD2 LEU 45 HD23 LEU 45 101.486 -2.783 3.732
357 H LEU 46 HN LEU 46 97.837 0.252 5.410
358 HA LEU 46 HA LEU 46 97.927 2.908 4.615
359 1HB LEU 46 HB2 LEU 46 95.915 1.821 5.473
360 2HB LEU 46 HB1 LEU 46 96.631 1.727 7.071
361 HG LEU 46 HG LEU 46 96.733 4.282 7.006
362 1HD1 LEU 46 HD11 LEU 46 96.253 4.233 4.471
363 2HD1 LEU 46 HD12 LEU 46 95.476 5.468 5.461
364 3HD1 LEU 46 HD13 LEU 46 94.568 4.044 4.955
365 1HD2 LEU 46 HD21 LEU 46 94.821 4.321 8.199
366 2HD2 LEU 46 HD22 LEU 46 94.901 2.571 7.996
367 3HD2 LEU 46 HD23 LEU 46 93.885 3.536 6.927
368 H ALA 47 HN ALA 47 98.736 1.641 7.857
369 HA ALA 47 HA ALA 47 99.666 4.049 8.914
370 1HB ALA 47 HB1 ALA 47 101.006 1.605 9.865
371 2HB ALA 47 HB2 ALA 47 99.244 1.596 9.930
372 3HB ALA 47 HB3 ALA 47 100.150 2.858 10.764
373 H GLU 48 HN GLU 48 101.359 1.584 7.044
374 HA GLU 48 HA GLU 48 103.961 2.642 7.475
375 1HB GLU 48 HB2 GLU 48 102.763 0.625 5.639
376 2HB GLU 48 HB1 GLU 48 104.352 1.264 5.247
377 1HG GLU 48 HG2 GLU 48 104.288 -0.878 6.581
378 2HG GLU 48 HG1 GLU 48 105.307 0.416 7.210
379 H ALA 49 HN ALA 49 101.628 2.992 4.809
380 HA ALA 49 HA ALA 49 103.347 4.629 3.233
381 1HB ALA 49 HB1 ALA 49 100.560 5.068 2.653
382 2HB ALA 49 HB2 ALA 49 100.893 3.348 2.857
383 3HB ALA 49 HB3 ALA 49 101.800 4.288 1.672
384 H LYS 50 HN LYS 50 100.811 5.285 5.589
385 HA LYS 50 HA LYS 50 100.639 8.066 5.146
386 1HB LYS 50 HB2 LYS 50 99.248 6.279 6.665
387 2HB LYS 50 HB1 LYS 50 100.149 7.145 7.901
388 1HG LYS 50 HG2 LYS 50 98.464 8.599 7.844
389 2HG LYS 50 HG1 LYS 50 99.210 9.188 6.358
390 1HD LYS 50 HD2 LYS 50 97.412 8.587 5.196
391 2HD LYS 50 HD1 LYS 50 97.605 6.916 5.729
392 1HE LYS 50 HE2 LYS 50 95.445 7.540 6.417
393 2HE LYS 50 HE1 LYS 50 96.438 7.626 7.872
394 1HZ LYS 50 HZ1 LYS 50 95.946 10.011 6.196
395 2HZ LYS 50 HZ2 LYS 50 96.454 9.942 7.808
396 3HZ LYS 50 HZ3 LYS 50 94.860 9.545 7.407
397 H LYS 51 HN LYS 51 102.328 6.266 7.739
398 HA LYS 51 HA LYS 51 103.578 8.499 8.868
399 1HB LYS 51 HB2 LYS 51 105.102 6.915 9.941
400 2HB LYS 51 HB1 LYS 51 103.439 6.353 10.025
401 1HG LYS 51 HG2 LYS 51 104.346 4.409 9.380
402 2HG LYS 51 HG1 LYS 51 104.239 5.120 7.770
403 1HD LYS 51 HD2 LYS 51 106.486 5.465 7.626
404 2HD LYS 51 HD1 LYS 51 106.662 5.734 9.361
405 1HE LYS 51 HE2 LYS 51 107.700 3.702 9.140
406 2HE LYS 51 HE1 LYS 51 106.053 3.189 9.500
407 1HZ LYS 51 HZ1 LYS 51 107.519 3.080 6.961
408 2HZ LYS 51 HZ2 LYS 51 105.836 3.249 6.919
409 3HZ LYS 51 HZ3 LYS 51 106.532 1.911 7.685
410 H LEU 52 HN LEU 52 104.732 6.253 6.357
411 HA LEU 52 HA LEU 52 107.299 7.273 6.047
412 1HB LEU 52 HB2 LEU 52 105.434 5.703 4.403
413 2HB LEU 52 HB1 LEU 52 106.598 6.630 3.477
414 HG LEU 52 HG LEU 52 107.345 4.697 5.670
415 1HD1 LEU 52 HD11 LEU 52 106.284 3.535 3.797
416 2HD1 LEU 52 HD12 LEU 52 108.008 3.179 3.888
417 3HD1 LEU 52 HD13 LEU 52 107.404 4.313 2.679
418 1HD2 LEU 52 HD21 LEU 52 109.246 5.491 3.564
419 2HD2 LEU 52 HD22 LEU 52 109.503 5.227 5.289
420 3HD2 LEU 52 HD23 LEU 52 108.813 6.748 4.722
421 H ASN 53 HN ASN 53 104.279 8.253 4.464
422 HA ASN 53 HA ASN 53 105.336 10.299 2.870
423 1HB ASN 53 HB2 ASN 53 103.208 10.265 2.175
424 2HB ASN 53 HB1 ASN 53 102.752 9.287 3.563
425 1HD2 ASN 53 HD21 ASN 53 102.656 12.378 2.105
426 2HD2 ASN 53 HD22 ASN 53 101.728 13.176 3.325
427 H ASP 54 HN ASP 54 104.328 10.249 6.236
428 HA ASP 54 HA ASP 54 104.288 13.007 6.712
429 1HB ASP 54 HB2 ASP 54 103.776 10.810 8.227
430 2HB ASP 54 HB1 ASP 54 105.323 11.312 8.903
431 H ALA 55 HN ALA 55 106.931 10.650 6.987
432 HA ALA 55 HA ALA 55 108.842 12.718 7.671
433 1HB ALA 55 HB1 ALA 55 110.479 10.860 7.658
434 2HB ALA 55 HB2 ALA 55 109.195 9.774 7.127
435 3HB ALA 55 HB3 ALA 55 109.091 10.560 8.703
436 H GLN 56 HN GLN 56 107.721 11.171 4.788
437 HA GLN 56 HA GLN 56 110.061 11.950 3.247
438 1HB GLN 56 HB2 GLN 56 107.765 10.158 2.850
439 2HB GLN 56 HB1 GLN 56 108.247 11.039 1.409
440 1HG GLN 56 HG2 GLN 56 110.650 10.179 2.290
441 2HG GLN 56 HG1 GLN 56 109.607 8.872 2.848
442 1HE2 GLN 56 HE21 GLN 56 111.237 10.225 0.222
443 2HE2 GLN 56 HE22 GLN 56 110.612 9.197 -1.017
444 H ALA 57 HN ALA 57 107.206 13.435 4.222
445 HA ALA 57 HA ALA 57 107.413 15.345 1.993
446 1HB ALA 57 HB1 ALA 57 105.365 13.758 1.998
447 2HB ALA 57 HB2 ALA 57 105.125 15.480 1.701
448 3HB ALA 57 HB3 ALA 57 104.778 14.803 3.292
449 HA PRO 58 HA PRO 58 107.859 17.694 5.923
450 1HB PRO 58 HB2 PRO 58 109.769 19.378 5.037
451 2HB PRO 58 HB1 PRO 58 110.148 17.754 5.620
452 1HG PRO 58 HG2 PRO 58 109.867 18.736 2.805
453 2HG PRO 58 HG1 PRO 58 111.089 17.651 3.495
454 1HD PRO 58 HD2 PRO 58 108.937 16.766 2.080
455 2HD PRO 58 HD1 PRO 58 109.713 15.814 3.361
456 H LYS 59 HN LYS 59 107.762 18.878 2.595
457 HA LYS 59 HA LYS 59 106.343 21.286 3.460
458 1HB LYS 59 HB2 LYS 59 108.339 21.280 1.822
459 2HB LYS 59 HB1 LYS 59 107.187 20.672 0.641
460 1HG LYS 59 HG2 LYS 59 107.194 22.960 0.273
461 2HG LYS 59 HG1 LYS 59 105.764 22.708 1.276
462 1HD LYS 59 HD2 LYS 59 106.897 24.605 2.152
463 2HD LYS 59 HD1 LYS 59 107.193 23.272 3.270
464 1HE LYS 59 HE2 LYS 59 109.295 23.008 1.577
465 2HE LYS 59 HE1 LYS 59 109.060 24.754 1.544
466 1HZ LYS 59 HZ1 LYS 59 110.278 23.196 3.534
467 2HZ LYS 59 HZ2 LYS 59 108.905 23.920 4.206
468 3HZ LYS 59 HZ3 LYS 59 110.097 24.877 3.481
469 H ALA 60 HN ALA 60 106.055 18.891 0.833
470 HA ALA 60 HA ALA 60 104.250 17.935 -0.166
471 1HB ALA 60 HB1 ALA 60 103.584 18.121 2.597
472 2HB ALA 60 HB2 ALA 60 103.044 16.938 1.406
473 3HB ALA 60 HB3 ALA 60 102.132 18.429 1.643
Start of MODEL 3
1 1H GLY -1 HT1 GLY -1 93.402 -12.443 -2.106
2 2H GLY -1 HT2 GLY -1 93.447 -14.095 -1.744
3 3H GLY -1 HT3 GLY -1 92.699 -13.017 -0.677
4 1HA GLY -1 HA1 GLY -1 91.163 -12.454 -2.627
5 2HA GLY -1 HA2 GLY -1 91.765 -13.955 -3.314
6 H SER 0 HN SER 0 91.879 -15.699 -1.326
7 HA SER 0 HA SER 0 89.109 -15.805 -0.334
8 1HB SER 0 HB2 SER 0 91.020 -18.097 -0.848
9 2HB SER 0 HB1 SER 0 89.343 -18.243 -0.325
10 HG SER 0 HG SER 0 88.864 -18.210 -2.360
11 H THR 1 HN THR 1 88.684 -16.452 1.756
12 HA THR 1 HA THR 1 89.291 -17.304 3.903
13 HB THR 1 HB THR 1 91.940 -15.900 3.483
14 HG1 THR 1 HG1 THR 1 91.203 -18.628 3.324
15 1HG2 THR 1 HG21 THR 1 90.782 -17.399 5.773
16 2HG2 THR 1 HG22 THR 1 91.783 -15.947 5.760
17 3HG2 THR 1 HG23 THR 1 92.509 -17.522 5.443
18 H ALA 2 HN ALA 2 90.903 -14.173 3.324
19 HA ALA 2 HA ALA 2 89.702 -12.956 5.585
20 1HB ALA 2 HB1 ALA 2 91.445 -12.098 3.369
21 2HB ALA 2 HB2 ALA 2 91.570 -11.787 5.101
22 3HB ALA 2 HB3 ALA 2 90.464 -10.834 4.111
23 H ASP 3 HN ASP 3 88.396 -10.886 5.367
24 HA ASP 3 HA ASP 3 86.217 -11.353 3.446
25 1HB ASP 3 HB2 ASP 3 85.984 -11.246 6.116
26 2HB ASP 3 HB1 ASP 3 85.828 -9.528 5.761
27 H ASN 4 HN ASN 4 88.438 -10.105 2.471
28 HA ASN 4 HA ASN 4 88.983 -7.529 2.542
29 1HB ASN 4 HB2 ASN 4 88.810 -7.650 -0.138
30 2HB ASN 4 HB1 ASN 4 90.085 -8.438 0.776
31 1HD2 ASN 4 HD21 ASN 4 90.183 -10.625 0.861
32 2HD2 ASN 4 HD22 ASN 4 89.144 -11.666 -0.045
33 H LYS 5 HN LYS 5 86.990 -7.745 -0.288
34 HA LYS 5 HA LYS 5 85.275 -6.455 -1.030
35 1HB LYS 5 HB2 LYS 5 84.011 -7.747 0.630
36 2HB LYS 5 HB1 LYS 5 84.434 -6.577 1.871
37 1HG LYS 5 HG2 LYS 5 82.786 -5.205 1.282
38 2HG LYS 5 HG1 LYS 5 83.189 -5.328 -0.431
39 1HD LYS 5 HD2 LYS 5 81.686 -6.983 -0.806
40 2HD LYS 5 HD1 LYS 5 81.919 -7.702 0.789
41 1HE LYS 5 HE2 LYS 5 80.611 -5.874 1.784
42 2HE LYS 5 HE1 LYS 5 80.360 -5.192 0.178
43 1HZ LYS 5 HZ1 LYS 5 79.099 -7.484 1.435
44 2HZ LYS 5 HZ2 LYS 5 79.493 -7.677 -0.198
45 3HZ LYS 5 HZ3 LYS 5 78.487 -6.406 0.283
46 H PHE 6 HN PHE 6 87.656 -5.281 0.837
47 HA PHE 6 HA PHE 6 88.147 -3.257 1.833
48 1HB PHE 6 HB2 PHE 6 87.881 -3.012 -1.129
49 2HB PHE 6 HB1 PHE 6 88.268 -1.567 -0.200
50 HD1 PHE 6 HD1 PHE 6 90.482 -1.049 -0.214
51 HD2 PHE 6 HD2 PHE 6 89.344 -5.145 -0.107
52 HE1 PHE 6 HE1 PHE 6 92.852 -1.697 -0.107
53 HE2 PHE 6 HE2 PHE 6 91.712 -5.802 -0.004
54 HZ PHE 6 HZ PHE 6 93.472 -4.079 0.006
55 H ASN 7 HN ASN 7 86.539 -1.206 -0.339
56 HA ASN 7 HA ASN 7 84.475 -0.120 -0.244
57 1HB ASN 7 HB2 ASN 7 84.302 -0.900 2.674
58 2HB ASN 7 HB1 ASN 7 83.052 -0.125 1.710
59 1HD2 ASN 7 HD21 ASN 7 82.987 -1.525 -0.564
60 2HD2 ASN 7 HD22 ASN 7 82.569 -3.174 -0.262
61 H LYS 8 HN LYS 8 83.744 1.591 1.935
62 HA LYS 8 HA LYS 8 85.341 3.769 1.437
63 1HB LYS 8 HB2 LYS 8 84.286 4.816 3.402
64 2HB LYS 8 HB1 LYS 8 83.128 4.002 2.359
65 1HG LYS 8 HG2 LYS 8 82.396 2.811 4.069
66 2HG LYS 8 HG1 LYS 8 84.010 2.149 4.327
67 1HD LYS 8 HD2 LYS 8 83.856 4.854 5.311
68 2HD LYS 8 HD1 LYS 8 82.578 3.864 6.018
69 1HE LYS 8 HE2 LYS 8 85.179 2.536 5.929
70 2HE LYS 8 HE1 LYS 8 85.170 4.003 6.905
71 1HZ LYS 8 HZ1 LYS 8 83.986 1.451 7.443
72 2HZ LYS 8 HZ2 LYS 8 82.887 2.721 7.640
73 3HZ LYS 8 HZ3 LYS 8 84.341 2.722 8.503
74 H GLU 9 HN GLU 9 85.765 1.386 4.045
75 HA GLU 9 HA GLU 9 87.741 2.989 5.368
76 1HB GLU 9 HB2 GLU 9 86.199 0.843 6.093
77 2HB GLU 9 HB1 GLU 9 87.789 0.113 5.931
78 1HG GLU 9 HG2 GLU 9 88.672 1.896 7.441
79 2HG GLU 9 HG1 GLU 9 87.005 2.405 7.710
80 H GLN 10 HN GLN 10 87.985 -0.063 3.512
81 HA GLN 10 HA GLN 10 90.861 0.112 3.516
82 1HB GLN 10 HB2 GLN 10 89.203 -1.794 1.898
83 2HB GLN 10 HB1 GLN 10 90.870 -1.985 2.405
84 1HG GLN 10 HG2 GLN 10 88.526 -1.902 4.289
85 2HG GLN 10 HG1 GLN 10 89.251 -3.381 3.661
86 1HE2 GLN 10 HE21 GLN 10 91.336 -3.988 4.360
87 2HE2 GLN 10 HE22 GLN 10 92.040 -3.309 5.778
88 H GLN 11 HN GLN 11 88.316 0.426 1.068
89 HA GLN 11 HA GLN 11 89.966 0.713 -1.164
90 1HB GLN 11 HB2 GLN 11 87.367 0.503 -0.965
91 2HB GLN 11 HB1 GLN 11 87.414 2.260 -0.964
92 1HG GLN 11 HG2 GLN 11 87.484 2.220 -3.170
93 2HG GLN 11 HG1 GLN 11 89.063 1.441 -3.078
94 1HE2 GLN 11 HE21 GLN 11 86.598 1.186 -4.853
95 2HE2 GLN 11 HE22 GLN 11 86.323 -0.518 -4.927
96 H ASN 12 HN ASN 12 88.828 3.140 1.139
97 HA ASN 12 HA ASN 12 89.659 5.433 -0.185
98 1HB ASN 12 HB2 ASN 12 88.341 5.343 1.952
99 2HB ASN 12 HB1 ASN 12 89.844 4.995 2.801
100 1HD2 ASN 12 HD21 ASN 12 88.239 7.353 0.737
101 2HD2 ASN 12 HD22 ASN 12 89.099 8.729 1.331
102 H ALA 13 HN ALA 13 91.516 3.060 1.613
103 HA ALA 13 HA ALA 13 93.869 4.464 2.032
104 1HB ALA 13 HB1 ALA 13 93.737 2.380 3.059
105 2HB ALA 13 HB2 ALA 13 94.960 2.161 1.807
106 3HB ALA 13 HB3 ALA 13 93.327 1.559 1.555
107 H PHE 14 HN PHE 14 92.734 2.817 -0.888
108 HA PHE 14 HA PHE 14 95.049 2.793 -2.382
109 1HB PHE 14 HB2 PHE 14 92.942 1.756 -3.071
110 2HB PHE 14 HB1 PHE 14 92.222 3.335 -3.306
111 HD1 PHE 14 HD1 PHE 14 91.637 2.610 -5.587
112 HD2 PHE 14 HD2 PHE 14 95.682 2.939 -4.306
113 HE1 PHE 14 HE1 PHE 14 92.373 2.619 -7.933
114 HE2 PHE 14 HE2 PHE 14 96.425 2.950 -6.652
115 HZ PHE 14 HZ PHE 14 94.772 2.789 -8.468
116 H TRP 15 HN TRP 15 92.542 5.306 -2.429
117 HA TRP 15 HA TRP 15 93.953 7.088 -4.087
118 1HB TRP 15 HB2 TRP 15 91.611 7.296 -2.276
119 2HB TRP 15 HB1 TRP 15 92.394 8.796 -2.762
120 HD1 TRP 15 HD1 TRP 15 91.254 5.604 -4.678
121 HE1 TRP 15 HE1 TRP 15 90.053 6.372 -6.822
122 HE3 TRP 15 HE3 TRP 15 91.686 10.658 -4.076
123 HZ2 TRP 15 HZ2 TRP 15 89.376 8.803 -8.089
124 HZ3 TRP 15 HZ3 TRP 15 90.734 12.139 -5.799
125 HH2 TRP 15 HH2 TRP 15 89.605 11.228 -7.763
126 H GLU 16 HN GLU 16 93.505 7.218 -0.542
127 HA GLU 16 HA GLU 16 95.181 9.367 0.003
128 1HB GLU 16 HB2 GLU 16 94.843 6.939 1.771
129 2HB GLU 16 HB1 GLU 16 95.251 8.568 2.278
130 1HG GLU 16 HG2 GLU 16 92.696 8.220 0.834
131 2HG GLU 16 HG1 GLU 16 92.802 7.549 2.461
132 H ILE 17 HN ILE 17 95.895 6.177 -0.860
133 HA ILE 17 HA ILE 17 98.674 6.208 0.019
134 HB ILE 17 HB ILE 17 97.003 4.172 -1.413
135 1HG1 ILE 17 HG12 ILE 17 98.867 3.945 0.954
136 2HG1 ILE 17 HG11 ILE 17 97.161 4.352 1.099
137 1HG2 ILE 17 HG21 ILE 17 98.929 4.046 -2.753
138 2HG2 ILE 17 HG22 ILE 17 99.148 2.789 -1.535
139 3HG2 ILE 17 HG23 ILE 17 100.004 4.325 -1.382
140 1HD1 ILE 17 HD11 ILE 17 98.185 1.825 -0.159
141 2HD1 ILE 17 HD12 ILE 17 96.516 2.222 0.249
142 3HD1 ILE 17 HD13 ILE 17 97.702 1.971 1.531
143 H LEU 18 HN LEU 18 96.796 6.400 -2.940
144 HA LEU 18 HA LEU 18 99.002 6.761 -4.698
145 1HB LEU 18 HB2 LEU 18 96.191 6.412 -4.906
146 2HB LEU 18 HB1 LEU 18 96.576 7.914 -5.723
147 HG LEU 18 HG LEU 18 98.142 6.774 -7.189
148 1HD1 LEU 18 HD11 LEU 18 99.010 5.076 -5.757
149 2HD1 LEU 18 HD12 LEU 18 98.250 4.289 -7.140
150 3HD1 LEU 18 HD13 LEU 18 97.420 4.332 -5.585
151 1HD2 LEU 18 HD21 LEU 18 95.904 6.874 -7.995
152 2HD2 LEU 18 HD22 LEU 18 95.417 5.507 -6.992
153 3HD2 LEU 18 HD23 LEU 18 96.517 5.258 -8.348
154 H HIS 19 HN HIS 19 97.082 8.873 -2.729
155 HA HIS 19 HA HIS 19 97.840 11.263 -4.112
156 1HB HIS 19 HB2 HIS 19 96.178 10.558 -1.793
157 2HB HIS 19 HB1 HIS 19 97.044 12.080 -1.610
158 HD1 HIS 19 HD1 HIS 19 93.894 10.983 -2.616
159 HD2 HIS 19 HD2 HIS 19 96.643 13.609 -4.295
160 HE1 HIS 19 HE1 HIS 19 92.567 12.436 -4.182
161 HE2 HIS 19 HE2 HIS 19 94.240 14.059 -5.138
162 H LEU 20 HN LEU 20 98.543 10.065 -0.816
163 HA LEU 20 HA LEU 20 100.161 11.090 0.566
164 1HB LEU 20 HB2 LEU 20 101.334 8.995 -1.211
165 2HB LEU 20 HB1 LEU 20 102.276 9.715 0.078
166 HG LEU 20 HG LEU 20 99.840 7.970 0.284
167 1HD1 LEU 20 HD11 LEU 20 102.501 7.415 0.424
168 2HD1 LEU 20 HD12 LEU 20 101.223 6.452 1.165
169 3HD1 LEU 20 HD13 LEU 20 102.090 7.652 2.124
170 1HD2 LEU 20 HD21 LEU 20 100.750 10.072 2.177
171 2HD2 LEU 20 HD22 LEU 20 100.221 8.527 2.844
172 3HD2 LEU 20 HD23 LEU 20 99.123 9.474 1.840
173 HA PRO 21 HA PRO 21 101.753 14.193 -2.532
174 1HB PRO 21 HB2 PRO 21 100.951 15.965 -0.292
175 2HB PRO 21 HB1 PRO 21 100.675 16.148 -2.028
176 1HG PRO 21 HG2 PRO 21 98.689 15.462 -0.374
177 2HG PRO 21 HG1 PRO 21 98.805 14.788 -2.010
178 1HD PRO 21 HD2 PRO 21 99.491 13.535 0.613
179 2HD PRO 21 HD1 PRO 21 98.754 12.807 -0.827
180 H ASN 22 HN ASN 22 103.843 13.497 -2.238
181 HA ASN 22 HA ASN 22 105.937 14.508 -1.605
182 1HB ASN 22 HB2 ASN 22 104.605 15.714 0.379
183 2HB ASN 22 HB1 ASN 22 105.374 14.427 1.306
184 1HD2 ASN 22 HD21 ASN 22 106.334 16.443 2.265
185 2HD2 ASN 22 HD22 ASN 22 107.807 17.013 1.565
186 H LEU 23 HN LEU 23 104.632 11.759 -1.579
187 HA LEU 23 HA LEU 23 106.783 10.468 -0.040
188 1HB LEU 23 HB2 LEU 23 104.626 9.868 0.883
189 2HB LEU 23 HB1 LEU 23 104.033 9.424 -0.707
190 HG LEU 23 HG LEU 23 106.443 7.990 0.250
191 1HD1 LEU 23 HD11 LEU 23 105.538 7.411 2.201
192 2HD1 LEU 23 HD12 LEU 23 104.424 6.424 1.250
193 3HD1 LEU 23 HD13 LEU 23 103.956 8.046 1.757
194 1HD2 LEU 23 HD21 LEU 23 104.875 7.770 -1.910
195 2HD2 LEU 23 HD22 LEU 23 104.070 6.625 -0.836
196 3HD2 LEU 23 HD23 LEU 23 105.777 6.427 -1.219
197 H ASN 24 HN ASN 24 107.903 8.727 -1.077
198 HA ASN 24 HA ASN 24 108.332 9.057 -3.825
199 1HB ASN 24 HB2 ASN 24 109.753 7.765 -2.052
200 2HB ASN 24 HB1 ASN 24 108.732 6.394 -2.469
201 1HD2 ASN 24 HD21 ASN 24 110.361 5.196 -3.367
202 2HD2 ASN 24 HD22 ASN 24 111.133 5.615 -4.855
203 H GLU 25 HN GLU 25 106.628 8.908 -5.264
204 HA GLU 25 HA GLU 25 104.337 7.457 -4.836
205 1HB GLU 25 HB2 GLU 25 103.839 7.875 -7.164
206 2HB GLU 25 HB1 GLU 25 104.595 9.298 -6.437
207 1HG GLU 25 HG2 GLU 25 106.672 7.725 -7.521
208 2HG GLU 25 HG1 GLU 25 105.395 7.785 -8.735
209 H GLU 26 HN GLU 26 107.426 6.327 -5.837
210 HA GLU 26 HA GLU 26 106.613 3.894 -7.091
211 1HB GLU 26 HB2 GLU 26 108.945 5.047 -7.104
212 2HB GLU 26 HB1 GLU 26 109.186 4.236 -5.562
213 1HG GLU 26 HG2 GLU 26 108.363 2.713 -8.003
214 2HG GLU 26 HG1 GLU 26 110.053 3.109 -7.691
215 H GLN 27 HN GLN 27 106.906 5.076 -3.935
216 HA GLN 27 HA GLN 27 106.739 2.509 -2.566
217 1HB GLN 27 HB2 GLN 27 107.329 5.215 -1.753
218 2HB GLN 27 HB1 GLN 27 106.002 4.583 -0.789
219 1HG GLN 27 HG2 GLN 27 108.252 4.228 0.195
220 2HG GLN 27 HG1 GLN 27 107.314 2.754 -0.032
221 1HE2 GLN 27 HE21 GLN 27 108.157 1.146 -1.200
222 2HE2 GLN 27 HE22 GLN 27 109.645 1.228 -2.074
223 H ARG 28 HN ARG 28 104.786 5.196 -3.627
224 HA ARG 28 HA ARG 28 102.347 4.549 -2.387
225 1HB ARG 28 HB2 ARG 28 103.042 6.083 -4.883
226 2HB ARG 28 HB1 ARG 28 101.372 5.793 -4.440
227 1HG ARG 28 HG2 ARG 28 102.116 6.828 -2.155
228 2HG ARG 28 HG1 ARG 28 103.407 7.522 -3.135
229 1HD ARG 28 HD2 ARG 28 100.534 7.749 -3.957
230 2HD ARG 28 HD1 ARG 28 101.238 8.875 -2.832
231 HE ARG 28 HE ARG 28 102.590 9.736 -4.530
232 1HH1 ARG 28 HH11 ARG 28 100.610 7.103 -5.697
233 2HH1 ARG 28 HH12 ARG 28 100.798 7.539 -7.360
234 1HH2 ARG 28 HH21 ARG 28 102.827 10.307 -6.717
235 2HH2 ARG 28 HH22 ARG 28 102.057 9.353 -7.940
236 H ASN 29 HN ASN 29 103.971 3.307 -5.249
237 HA ASN 29 HA ASN 29 101.656 1.939 -6.255
238 1HB ASN 29 HB2 ASN 29 103.820 2.792 -7.507
239 2HB ASN 29 HB1 ASN 29 104.447 1.213 -7.044
240 1HD2 ASN 29 HD21 ASN 29 104.506 0.244 -8.989
241 2HD2 ASN 29 HD22 ASN 29 103.119 -0.050 -9.976
242 H GLY 30 HN GLY 30 104.706 1.009 -4.661
243 1HA GLY 30 HA2 GLY 30 104.293 -1.736 -4.513
244 2HA GLY 30 HA1 GLY 30 105.194 -0.806 -3.323
245 H PHE 31 HN PHE 31 102.950 0.836 -2.560
246 HA PHE 31 HA PHE 31 101.846 -0.834 -0.539
247 1HB PHE 31 HB2 PHE 31 101.326 2.013 -1.386
248 2HB PHE 31 HB1 PHE 31 100.411 1.245 -0.089
249 HD1 PHE 31 HD1 PHE 31 102.711 3.585 -0.375
250 HD2 PHE 31 HD2 PHE 31 102.409 -0.324 1.288
251 HE1 PHE 31 HE1 PHE 31 104.512 4.122 1.211
252 HE2 PHE 31 HE2 PHE 31 104.207 0.208 2.868
253 HZ PHE 31 HZ PHE 31 105.261 2.433 2.839
254 H ILE 32 HN ILE 32 100.746 0.271 -3.665
255 HA ILE 32 HA ILE 32 98.000 -0.400 -3.313
256 HB ILE 32 HB ILE 32 99.197 -0.546 -6.036
257 1HG1 ILE 32 HG12 ILE 32 98.832 2.058 -4.540
258 2HG1 ILE 32 HG11 ILE 32 100.375 1.351 -5.002
259 1HG2 ILE 32 HG21 ILE 32 97.123 0.817 -6.515
260 2HG2 ILE 32 HG22 ILE 32 96.669 0.543 -4.832
261 3HG2 ILE 32 HG23 ILE 32 96.862 -0.826 -5.928
262 1HD1 ILE 32 HD11 ILE 32 98.232 2.314 -6.872
263 2HD1 ILE 32 HD12 ILE 32 99.740 1.543 -7.359
264 3HD1 ILE 32 HD13 ILE 32 99.773 3.102 -6.537
265 H GLN 33 HN GLN 33 100.759 -2.089 -4.754
266 HA GLN 33 HA GLN 33 99.290 -4.364 -5.589
267 1HB GLN 33 HB2 GLN 33 102.217 -4.251 -4.841
268 2HB GLN 33 HB1 GLN 33 101.439 -5.462 -5.850
269 1HG GLN 33 HG2 GLN 33 101.047 -3.881 -7.584
270 2HG GLN 33 HG1 GLN 33 101.548 -2.542 -6.553
271 1HE2 GLN 33 HE21 GLN 33 103.415 -1.770 -7.202
272 2HE2 GLN 33 HE22 GLN 33 104.774 -2.693 -7.736
273 H SER 34 HN SER 34 101.286 -3.784 -2.694
274 HA SER 34 HA SER 34 100.816 -6.286 -1.495
275 1HB SER 34 HB2 SER 34 102.639 -4.680 -0.858
276 2HB SER 34 HB1 SER 34 101.418 -3.677 -0.072
277 HG SER 34 HG SER 34 101.250 -5.097 1.508
278 H LEU 35 HN LEU 35 99.156 -3.175 -1.220
279 HA LEU 35 HA LEU 35 97.329 -4.094 0.772
280 1HB LEU 35 HB2 LEU 35 97.772 -1.748 0.669
281 2HB LEU 35 HB1 LEU 35 97.324 -1.674 -1.025
282 HG LEU 35 HG LEU 35 94.989 -2.158 -0.433
283 1HD1 LEU 35 HD11 LEU 35 96.164 -2.387 2.300
284 2HD1 LEU 35 HD12 LEU 35 94.987 -3.422 1.491
285 3HD1 LEU 35 HD13 LEU 35 94.498 -1.841 2.102
286 1HD2 LEU 35 HD21 LEU 35 94.896 0.008 1.216
287 2HD2 LEU 35 HD22 LEU 35 95.022 0.083 -0.543
288 3HD2 LEU 35 HD23 LEU 35 96.473 0.204 0.453
289 H LYS 36 HN LYS 36 97.149 -3.618 -2.742
290 HA LYS 36 HA LYS 36 94.467 -4.124 -3.125
291 1HB LYS 36 HB2 LYS 36 96.886 -4.535 -4.828
292 2HB LYS 36 HB1 LYS 36 95.353 -5.196 -5.370
293 1HG LYS 36 HG2 LYS 36 95.907 -2.301 -4.739
294 2HG LYS 36 HG1 LYS 36 95.738 -3.011 -6.345
295 1HD LYS 36 HD2 LYS 36 93.591 -2.391 -6.169
296 2HD LYS 36 HD1 LYS 36 93.428 -3.813 -5.137
297 1HE LYS 36 HE2 LYS 36 93.152 -2.579 -3.284
298 2HE LYS 36 HE1 LYS 36 94.411 -1.434 -3.746
299 1HZ LYS 36 HZ1 LYS 36 92.887 -0.268 -5.123
300 2HZ LYS 36 HZ2 LYS 36 92.139 -0.477 -3.621
301 3HZ LYS 36 HZ3 LYS 36 91.691 -1.450 -4.930
302 H ASP 37 HN ASP 37 97.083 -6.627 -3.405
303 HA ASP 37 HA ASP 37 95.246 -8.735 -3.605
304 1HB ASP 37 HB2 ASP 37 97.797 -8.582 -4.158
305 2HB ASP 37 HB1 ASP 37 97.996 -9.144 -2.500
306 H ASP 38 HN ASP 38 96.083 -6.949 -0.807
307 HA ASP 38 HA ASP 38 94.731 -8.962 0.819
308 1HB ASP 38 HB2 ASP 38 97.450 -8.932 0.829
309 2HB ASP 38 HB1 ASP 38 97.095 -7.830 2.157
310 HA PRO 39 HA PRO 39 93.120 -5.097 2.464
311 1HB PRO 39 HB2 PRO 39 90.959 -6.084 3.631
312 2HB PRO 39 HB1 PRO 39 91.097 -6.133 1.869
313 1HG PRO 39 HG2 PRO 39 91.609 -8.315 3.862
314 2HG PRO 39 HG1 PRO 39 90.713 -8.392 2.339
315 1HD PRO 39 HD2 PRO 39 93.339 -9.170 2.628
316 2HD PRO 39 HD1 PRO 39 92.616 -8.651 1.092
317 H SER 40 HN SER 40 94.070 -7.927 4.199
318 HA SER 40 HA SER 40 93.611 -6.978 6.855
319 1HB SER 40 HB2 SER 40 94.091 -9.425 5.926
320 2HB SER 40 HB1 SER 40 95.757 -8.980 6.297
321 HG SER 40 HG SER 40 95.181 -8.665 8.424
322 H GLN 41 HN GLN 41 95.925 -6.327 4.461
323 HA GLN 41 HA GLN 41 97.992 -5.480 6.306
324 1HB GLN 41 HB2 GLN 41 97.753 -5.460 3.294
325 2HB GLN 41 HB1 GLN 41 99.131 -4.775 4.151
326 1HG GLN 41 HG2 GLN 41 99.661 -6.939 5.098
327 2HG GLN 41 HG1 GLN 41 98.239 -7.645 4.331
328 1HE2 GLN 41 HE21 GLN 41 101.514 -6.849 3.994
329 2HE2 GLN 41 HE22 GLN 41 101.701 -7.286 2.333
330 H SER 42 HN SER 42 95.233 -4.132 4.757
331 HA SER 42 HA SER 42 95.824 -1.590 4.075
332 1HB SER 42 HB2 SER 42 93.608 -0.954 4.614
333 2HB SER 42 HB1 SER 42 93.528 -2.675 4.230
334 HG SER 42 HG SER 42 93.530 -1.466 6.794
335 H ALA 43 HN ALA 43 95.711 -2.754 7.408
336 HA ALA 43 HA ALA 43 96.001 -0.137 8.543
337 1HB ALA 43 HB1 ALA 43 96.487 -1.458 10.649
338 2HB ALA 43 HB2 ALA 43 96.209 -2.909 9.685
339 3HB ALA 43 HB3 ALA 43 94.914 -1.730 9.898
340 H ASN 44 HN ASN 44 98.169 -2.871 7.960
341 HA ASN 44 HA ASN 44 100.451 -1.692 9.149
342 1HB ASN 44 HB2 ASN 44 100.011 -4.164 8.571
343 2HB ASN 44 HB1 ASN 44 100.551 -3.744 6.949
344 1HD2 ASN 44 HD21 ASN 44 102.528 -4.462 6.680
345 2HD2 ASN 44 HD22 ASN 44 103.828 -4.321 7.809
346 H LEU 45 HN LEU 45 99.152 -1.685 5.893
347 HA LEU 45 HA LEU 45 101.416 -0.428 4.695
348 1HB LEU 45 HB2 LEU 45 98.733 -1.297 3.847
349 2HB LEU 45 HB1 LEU 45 99.434 0.018 2.931
350 HG LEU 45 HG LEU 45 100.936 -1.313 1.912
351 1HD1 LEU 45 HD11 LEU 45 101.706 -3.526 3.129
352 2HD1 LEU 45 HD12 LEU 45 101.211 -2.625 4.562
353 3HD1 LEU 45 HD13 LEU 45 102.449 -1.968 3.491
354 1HD2 LEU 45 HD21 LEU 45 99.453 -2.687 1.050
355 2HD2 LEU 45 HD22 LEU 45 98.549 -2.764 2.561
356 3HD2 LEU 45 HD23 LEU 45 99.912 -3.848 2.293
357 H LEU 46 HN LEU 46 98.198 0.685 5.714
358 HA LEU 46 HA LEU 46 98.540 3.334 4.814
359 1HB LEU 46 HB2 LEU 46 96.663 1.942 6.641
360 2HB LEU 46 HB1 LEU 46 96.787 3.683 6.814
361 HG LEU 46 HG LEU 46 94.945 3.057 5.325
362 1HD1 LEU 46 HD11 LEU 46 97.118 4.299 3.666
363 2HD1 LEU 46 HD12 LEU 46 96.350 5.149 5.007
364 3HD1 LEU 46 HD13 LEU 46 95.384 4.620 3.629
365 1HD2 LEU 46 HD21 LEU 46 95.161 1.360 3.910
366 2HD2 LEU 46 HD22 LEU 46 96.870 1.217 4.311
367 3HD2 LEU 46 HD23 LEU 46 96.360 2.277 3.001
368 H ALA 47 HN ALA 47 99.453 1.685 7.777
369 HA ALA 47 HA ALA 47 100.135 4.089 9.184
370 1HB ALA 47 HB1 ALA 47 99.726 2.493 10.729
371 2HB ALA 47 HB2 ALA 47 101.455 2.197 10.548
372 3HB ALA 47 HB3 ALA 47 100.292 1.185 9.690
373 H GLU 48 HN GLU 48 101.956 1.598 7.413
374 HA GLU 48 HA GLU 48 104.499 2.771 7.952
375 1HB GLU 48 HB2 GLU 48 105.355 1.216 6.233
376 2HB GLU 48 HB1 GLU 48 104.369 0.411 7.442
377 1HG GLU 48 HG2 GLU 48 102.452 0.603 5.759
378 2HG GLU 48 HG1 GLU 48 103.690 1.019 4.583
379 H ALA 49 HN ALA 49 102.255 2.913 5.238
380 HA ALA 49 HA ALA 49 103.924 4.441 3.535
381 1HB ALA 49 HB1 ALA 49 102.136 4.513 2.075
382 2HB ALA 49 HB2 ALA 49 100.942 4.552 3.373
383 3HB ALA 49 HB3 ALA 49 101.794 3.053 3.001
384 H LYS 50 HN LYS 50 101.331 5.325 5.806
385 HA LYS 50 HA LYS 50 101.339 8.079 5.208
386 1HB LYS 50 HB2 LYS 50 100.403 6.475 7.564
387 2HB LYS 50 HB1 LYS 50 100.350 8.231 7.598
388 1HG LYS 50 HG2 LYS 50 98.981 8.193 5.540
389 2HG LYS 50 HG1 LYS 50 98.965 6.432 5.622
390 1HD LYS 50 HD2 LYS 50 97.089 6.693 6.814
391 2HD LYS 50 HD1 LYS 50 98.166 7.134 8.141
392 1HE LYS 50 HE2 LYS 50 96.381 8.779 7.868
393 2HE LYS 50 HE1 LYS 50 97.960 9.489 7.537
394 1HZ LYS 50 HZ1 LYS 50 96.288 8.423 5.350
395 2HZ LYS 50 HZ2 LYS 50 97.540 9.557 5.270
396 3HZ LYS 50 HZ3 LYS 50 96.049 9.991 5.939
397 H LYS 51 HN LYS 51 102.857 6.340 7.951
398 HA LYS 51 HA LYS 51 104.184 8.592 8.985
399 1HB LYS 51 HB2 LYS 51 105.499 7.057 10.290
400 2HB LYS 51 HB1 LYS 51 103.856 6.441 10.206
401 1HG LYS 51 HG2 LYS 51 104.655 4.504 9.507
402 2HG LYS 51 HG1 LYS 51 105.236 5.295 8.043
403 1HD LYS 51 HD2 LYS 51 106.939 5.696 10.396
404 2HD LYS 51 HD1 LYS 51 106.811 4.018 9.869
405 1HE LYS 51 HE2 LYS 51 108.383 4.493 8.364
406 2HE LYS 51 HE1 LYS 51 107.157 5.434 7.515
407 1HZ LYS 51 HZ1 LYS 51 108.514 6.778 9.708
408 2HZ LYS 51 HZ2 LYS 51 108.048 7.372 8.194
409 3HZ LYS 51 HZ3 LYS 51 109.459 6.452 8.343
410 H LEU 52 HN LEU 52 105.008 6.351 6.435
411 HA LEU 52 HA LEU 52 107.728 6.966 6.138
412 1HB LEU 52 HB2 LEU 52 106.787 5.051 5.043
413 2HB LEU 52 HB1 LEU 52 105.655 6.048 4.150
414 HG LEU 52 HG LEU 52 107.734 7.108 3.070
415 1HD1 LEU 52 HD11 LEU 52 109.490 5.073 3.000
416 2HD1 LEU 52 HD12 LEU 52 108.915 4.928 4.662
417 3HD1 LEU 52 HD13 LEU 52 109.626 6.442 4.103
418 1HD2 LEU 52 HD21 LEU 52 106.056 5.247 2.218
419 2HD2 LEU 52 HD22 LEU 52 107.515 4.257 2.275
420 3HD2 LEU 52 HD23 LEU 52 107.477 5.716 1.284
421 H ASN 53 HN ASN 53 104.941 8.223 4.331
422 HA ASN 53 HA ASN 53 106.162 10.059 2.716
423 1HB ASN 53 HB2 ASN 53 103.776 9.615 2.589
424 2HB ASN 53 HB1 ASN 53 103.517 10.364 4.156
425 1HD2 ASN 53 HD21 ASN 53 101.984 11.715 3.075
426 2HD2 ASN 53 HD22 ASN 53 102.521 13.098 2.190
427 H ASP 54 HN ASP 54 105.036 10.710 6.045
428 HA ASP 54 HA ASP 54 105.856 13.382 6.136
429 1HB ASP 54 HB2 ASP 54 105.576 11.330 8.335
430 2HB ASP 54 HB1 ASP 54 105.892 13.036 8.633
431 H ALA 55 HN ALA 55 107.558 10.482 7.325
432 HA ALA 55 HA ALA 55 109.879 11.782 8.167
433 1HB ALA 55 HB1 ALA 55 109.829 9.709 9.041
434 2HB ALA 55 HB2 ALA 55 110.828 9.339 7.636
435 3HB ALA 55 HB3 ALA 55 109.098 8.998 7.602
436 H GLN 56 HN GLN 56 109.283 10.153 5.031
437 HA GLN 56 HA GLN 56 111.891 11.048 4.108
438 1HB GLN 56 HB2 GLN 56 111.407 9.689 2.094
439 2HB GLN 56 HB1 GLN 56 111.341 8.774 3.594
440 1HG GLN 56 HG2 GLN 56 109.352 8.041 2.988
441 2HG GLN 56 HG1 GLN 56 108.740 9.684 3.162
442 1HE2 GLN 56 HE21 GLN 56 108.832 11.062 1.294
443 2HE2 GLN 56 HE22 GLN 56 108.684 10.375 -0.283
444 H ALA 57 HN ALA 57 109.026 12.580 4.261
445 HA ALA 57 HA ALA 57 108.202 13.531 1.891
446 1HB ALA 57 HB1 ALA 57 108.423 15.888 3.294
447 2HB ALA 57 HB2 ALA 57 108.424 14.663 4.562
448 3HB ALA 57 HB3 ALA 57 107.094 14.735 3.407
449 HA PRO 58 HA PRO 58 112.222 14.871 0.181
450 1HB PRO 58 HB2 PRO 58 110.715 14.890 -2.336
451 2HB PRO 58 HB1 PRO 58 112.165 13.981 -1.905
452 1HG PRO 58 HG2 PRO 58 109.774 12.788 -2.212
453 2HG PRO 58 HG1 PRO 58 110.962 12.226 -1.022
454 1HD PRO 58 HD2 PRO 58 108.513 13.902 -0.610
455 2HD PRO 58 HD1 PRO 58 109.143 12.568 0.374
456 H LYS 59 HN LYS 59 112.717 16.629 -1.486
457 HA LYS 59 HA LYS 59 110.837 18.872 -1.250
458 1HB LYS 59 HB2 LYS 59 112.712 19.021 0.424
459 2HB LYS 59 HB1 LYS 59 113.825 19.147 -0.932
460 1HG LYS 59 HG2 LYS 59 111.771 21.054 -1.328
461 2HG LYS 59 HG1 LYS 59 112.325 21.194 0.341
462 1HD LYS 59 HD2 LYS 59 113.694 22.647 -0.928
463 2HD LYS 59 HD1 LYS 59 114.682 21.226 -0.582
464 1HE LYS 59 HE2 LYS 59 114.133 20.336 -2.816
465 2HE LYS 59 HE1 LYS 59 113.215 21.803 -3.155
466 1HZ LYS 59 HZ1 LYS 59 115.920 21.382 -3.561
467 2HZ LYS 59 HZ2 LYS 59 115.817 22.468 -2.268
468 3HZ LYS 59 HZ3 LYS 59 115.070 22.834 -3.740
469 H ALA 60 HN ALA 60 112.784 16.945 -3.215
470 HA ALA 60 HA ALA 60 113.714 17.186 -5.305
471 1HB ALA 60 HB1 ALA 60 111.086 18.434 -5.995
472 2HB ALA 60 HB2 ALA 60 111.175 16.769 -5.418
473 3HB ALA 60 HB3 ALA 60 112.027 17.240 -6.890
Start of MODEL 4
1 1H GLY -1 HT1 GLY -1 89.669 -20.684 -9.469
2 2H GLY -1 HT2 GLY -1 89.582 -19.058 -9.015
3 3H GLY -1 HT3 GLY -1 90.610 -19.530 -10.274
4 1HA GLY -1 HA1 GLY -1 88.947 -18.854 -11.596
5 2HA GLY -1 HA2 GLY -1 88.302 -20.445 -11.219
6 H SER 0 HN SER 0 88.096 -17.024 -10.544
7 HA SER 0 HA SER 0 86.423 -15.725 -9.725
8 1HB SER 0 HB2 SER 0 84.229 -16.314 -10.211
9 2HB SER 0 HB1 SER 0 85.125 -17.335 -11.335
10 HG SER 0 HG SER 0 83.386 -18.134 -9.592
11 H THR 1 HN THR 1 86.040 -15.090 -7.709
12 HA THR 1 HA THR 1 85.150 -16.846 -5.643
13 HB THR 1 HB THR 1 87.987 -15.810 -5.484
14 HG1 THR 1 HG1 THR 1 87.052 -18.480 -5.420
15 1HG2 THR 1 HG21 THR 1 86.149 -16.714 -3.404
16 2HG2 THR 1 HG22 THR 1 87.650 -15.796 -3.279
17 3HG2 THR 1 HG23 THR 1 87.700 -17.554 -3.418
18 H ALA 2 HN ALA 2 87.142 -13.890 -5.843
19 HA ALA 2 HA ALA 2 86.789 -11.766 -5.118
20 1HB ALA 2 HB1 ALA 2 84.619 -12.224 -6.466
21 2HB ALA 2 HB2 ALA 2 84.695 -10.823 -5.398
22 3HB ALA 2 HB3 ALA 2 83.854 -12.285 -4.879
23 H ASP 3 HN ASP 3 87.867 -12.206 -3.149
24 HA ASP 3 HA ASP 3 86.165 -12.774 -0.828
25 1HB ASP 3 HB2 ASP 3 89.055 -13.107 -1.437
26 2HB ASP 3 HB1 ASP 3 88.646 -12.680 0.222
27 H ASN 4 HN ASN 4 89.051 -10.769 -1.313
28 HA ASN 4 HA ASN 4 88.354 -8.874 0.638
29 1HB ASN 4 HB2 ASN 4 90.208 -7.567 -0.185
30 2HB ASN 4 HB1 ASN 4 90.664 -9.265 -0.235
31 1HD2 ASN 4 HD21 ASN 4 90.856 -10.305 -2.227
32 2HD2 ASN 4 HD22 ASN 4 91.012 -9.417 -3.702
33 H LYS 5 HN LYS 5 88.110 -6.501 0.129
34 HA LYS 5 HA LYS 5 86.986 -5.578 -2.270
35 1HB LYS 5 HB2 LYS 5 85.167 -7.182 -1.356
36 2HB LYS 5 HB1 LYS 5 84.866 -5.926 -0.162
37 1HG LYS 5 HG2 LYS 5 83.339 -5.356 -1.755
38 2HG LYS 5 HG1 LYS 5 84.716 -4.390 -2.287
39 1HD LYS 5 HD2 LYS 5 84.653 -7.115 -3.372
40 2HD LYS 5 HD1 LYS 5 83.300 -6.100 -3.874
41 1HE LYS 5 HE2 LYS 5 84.692 -4.542 -4.903
42 2HE LYS 5 HE1 LYS 5 86.113 -5.081 -4.010
43 1HZ LYS 5 HZ1 LYS 5 85.602 -7.290 -5.316
44 2HZ LYS 5 HZ2 LYS 5 86.519 -6.049 -6.007
45 3HZ LYS 5 HZ3 LYS 5 84.884 -6.216 -6.408
46 H PHE 6 HN PHE 6 88.280 -3.821 -1.840
47 HA PHE 6 HA PHE 6 88.352 -2.475 0.620
48 1HB PHE 6 HB2 PHE 6 89.141 -1.559 -2.144
49 2HB PHE 6 HB1 PHE 6 89.436 -0.624 -0.689
50 HD1 PHE 6 HD1 PHE 6 91.733 -0.961 -2.072
51 HD2 PHE 6 HD2 PHE 6 89.830 -3.892 0.358
52 HE1 PHE 6 HE1 PHE 6 93.889 -2.086 -1.749
53 HE2 PHE 6 HE2 PHE 6 91.991 -5.016 0.685
54 HZ PHE 6 HZ PHE 6 94.027 -4.118 -0.358
55 H ASN 7 HN ASN 7 85.921 -2.342 0.920
56 HA ASN 7 HA ASN 7 84.276 -0.695 -0.593
57 1HB ASN 7 HB2 ASN 7 84.238 -1.259 2.378
58 2HB ASN 7 HB1 ASN 7 82.937 -0.442 1.516
59 1HD2 ASN 7 HD21 ASN 7 82.621 -1.798 -0.731
60 2HD2 ASN 7 HD22 ASN 7 82.210 -3.448 -0.427
61 H LYS 8 HN LYS 8 83.276 1.377 1.013
62 HA LYS 8 HA LYS 8 84.877 3.519 0.335
63 1HB LYS 8 HB2 LYS 8 83.486 4.847 1.889
64 2HB LYS 8 HB1 LYS 8 82.527 3.787 0.866
65 1HG LYS 8 HG2 LYS 8 83.089 2.320 3.194
66 2HG LYS 8 HG1 LYS 8 82.645 3.943 3.724
67 1HD LYS 8 HD2 LYS 8 80.532 3.201 3.540
68 2HD LYS 8 HD1 LYS 8 80.767 3.460 1.810
69 1HE LYS 8 HE2 LYS 8 79.829 1.238 2.331
70 2HE LYS 8 HE1 LYS 8 81.380 1.150 1.499
71 1HZ LYS 8 HZ1 LYS 8 80.678 -0.035 3.908
72 2HZ LYS 8 HZ2 LYS 8 81.798 1.174 4.290
73 3HZ LYS 8 HZ3 LYS 8 82.200 -0.025 3.171
74 H GLU 9 HN GLU 9 84.962 1.574 3.231
75 HA GLU 9 HA GLU 9 86.569 3.361 4.768
76 1HB GLU 9 HB2 GLU 9 85.681 0.520 5.032
77 2HB GLU 9 HB1 GLU 9 86.953 1.127 6.084
78 1HG GLU 9 HG2 GLU 9 84.369 2.601 5.812
79 2HG GLU 9 HG1 GLU 9 84.507 1.207 6.883
80 H GLN 10 HN GLN 10 87.271 0.371 3.007
81 HA GLN 10 HA GLN 10 90.095 0.552 3.557
82 1HB GLN 10 HB2 GLN 10 88.539 -1.549 3.076
83 2HB GLN 10 HB1 GLN 10 89.044 -1.221 1.430
84 1HG GLN 10 HG2 GLN 10 90.693 -2.641 1.994
85 2HG GLN 10 HG1 GLN 10 91.432 -1.154 2.581
86 1HE2 GLN 10 HE21 GLN 10 92.056 -3.762 3.507
87 2HE2 GLN 10 HE22 GLN 10 91.599 -3.853 5.165
88 H GLN 11 HN GLN 11 87.962 1.236 0.848
89 HA GLN 11 HA GLN 11 89.844 1.552 -1.174
90 1HB GLN 11 HB2 GLN 11 87.382 1.541 -1.488
91 2HB GLN 11 HB1 GLN 11 87.315 3.163 -0.816
92 1HG GLN 11 HG2 GLN 11 88.998 2.509 -3.206
93 2HG GLN 11 HG1 GLN 11 87.287 2.907 -3.352
94 1HE2 GLN 11 HE21 GLN 11 86.607 4.985 -2.441
95 2HE2 GLN 11 HE22 GLN 11 87.701 6.319 -2.517
96 H ASN 12 HN ASN 12 88.776 3.860 1.293
97 HA ASN 12 HA ASN 12 89.919 6.173 0.310
98 1HB ASN 12 HB2 ASN 12 88.524 6.102 2.342
99 2HB ASN 12 HB1 ASN 12 89.825 5.285 3.204
100 1HD2 ASN 12 HD21 ASN 12 89.250 8.198 1.271
101 2HD2 ASN 12 HD22 ASN 12 90.225 9.244 2.242
102 H ALA 13 HN ALA 13 91.438 3.468 1.983
103 HA ALA 13 HA ALA 13 93.921 4.574 2.527
104 1HB ALA 13 HB1 ALA 13 93.634 2.486 3.446
105 2HB ALA 13 HB2 ALA 13 94.700 2.119 2.092
106 3HB ALA 13 HB3 ALA 13 92.976 1.804 1.960
107 H PHE 14 HN PHE 14 92.785 2.984 -0.459
108 HA PHE 14 HA PHE 14 95.140 2.997 -1.915
109 1HB PHE 14 HB2 PHE 14 93.077 1.878 -2.609
110 2HB PHE 14 HB1 PHE 14 92.297 3.426 -2.855
111 HD1 PHE 14 HD1 PHE 14 93.220 4.962 -4.640
112 HD2 PHE 14 HD2 PHE 14 94.271 0.850 -4.342
113 HE1 PHE 14 HE1 PHE 14 93.934 4.978 -6.992
114 HE2 PHE 14 HE2 PHE 14 94.998 0.863 -6.695
115 HZ PHE 14 HZ PHE 14 94.830 2.929 -8.021
116 H TRP 15 HN TRP 15 92.549 5.401 -2.017
117 HA TRP 15 HA TRP 15 93.753 7.216 -3.733
118 1HB TRP 15 HB2 TRP 15 91.548 7.267 -1.824
119 2HB TRP 15 HB1 TRP 15 92.312 8.833 -2.061
120 HD1 TRP 15 HD1 TRP 15 91.494 6.083 -4.679
121 HE1 TRP 15 HE1 TRP 15 90.104 7.175 -6.551
122 HE3 TRP 15 HE3 TRP 15 91.081 10.797 -2.740
123 HZ2 TRP 15 HZ2 TRP 15 88.984 9.701 -7.129
124 HZ3 TRP 15 HZ3 TRP 15 89.834 12.492 -4.016
125 HH2 TRP 15 HH2 TRP 15 88.808 11.954 -6.166
126 H GLU 16 HN GLU 16 94.125 6.906 -0.225
127 HA GLU 16 HA GLU 16 95.555 9.351 0.126
128 1HB GLU 16 HB2 GLU 16 95.147 6.873 1.713
129 2HB GLU 16 HB1 GLU 16 96.575 7.818 2.109
130 1HG GLU 16 HG2 GLU 16 94.322 9.558 1.874
131 2HG GLU 16 HG1 GLU 16 93.925 8.223 2.954
132 H ILE 17 HN ILE 17 96.661 5.997 -0.080
133 HA ILE 17 HA ILE 17 99.365 6.334 -0.162
134 HB ILE 17 HB ILE 17 97.824 4.406 -1.917
135 1HG1 ILE 17 HG12 ILE 17 99.109 3.786 0.732
136 2HG1 ILE 17 HG11 ILE 17 97.456 4.382 0.638
137 1HG2 ILE 17 HG21 ILE 17 99.835 3.096 -2.019
138 2HG2 ILE 17 HG22 ILE 17 100.670 4.221 -0.949
139 3HG2 ILE 17 HG23 ILE 17 100.195 4.733 -2.568
140 1HD1 ILE 17 HD11 ILE 17 98.240 1.760 0.532
141 2HD1 ILE 17 HD12 ILE 17 97.957 2.159 -1.163
142 3HD1 ILE 17 HD13 ILE 17 96.674 2.395 0.024
143 H LEU 18 HN LEU 18 97.086 6.714 -2.832
144 HA LEU 18 HA LEU 18 99.124 7.437 -4.736
145 1HB LEU 18 HB2 LEU 18 96.203 7.026 -4.703
146 2HB LEU 18 HB1 LEU 18 96.733 8.311 -5.775
147 HG LEU 18 HG LEU 18 98.107 6.818 -7.046
148 1HD1 LEU 18 HD11 LEU 18 98.691 4.676 -6.481
149 2HD1 LEU 18 HD12 LEU 18 97.294 4.451 -5.429
150 3HD1 LEU 18 HD13 LEU 18 98.652 5.441 -4.894
151 1HD2 LEU 18 HD21 LEU 18 95.279 6.313 -6.627
152 2HD2 LEU 18 HD22 LEU 18 96.135 4.907 -7.262
153 3HD2 LEU 18 HD23 LEU 18 96.198 6.441 -8.127
154 H HIS 19 HN HIS 19 96.943 9.058 -2.559
155 HA HIS 19 HA HIS 19 97.507 11.663 -3.692
156 1HB HIS 19 HB2 HIS 19 95.231 11.165 -2.975
157 2HB HIS 19 HB1 HIS 19 95.796 10.837 -1.341
158 HD1 HIS 19 HD1 HIS 19 96.199 12.828 0.186
159 HD2 HIS 19 HD2 HIS 19 95.181 13.911 -3.694
160 HE1 HIS 19 HE1 HIS 19 95.755 15.300 0.274
161 HE2 HIS 19 HE2 HIS 19 95.047 15.916 -2.064
162 H LEU 20 HN LEU 20 99.472 9.838 -1.987
163 HA LEU 20 HA LEU 20 100.029 11.556 0.228
164 1HB LEU 20 HB2 LEU 20 101.380 9.136 -0.884
165 2HB LEU 20 HB1 LEU 20 102.178 10.115 0.332
166 HG LEU 20 HG LEU 20 99.708 8.430 0.602
167 1HD1 LEU 20 HD11 LEU 20 102.428 8.372 1.555
168 2HD1 LEU 20 HD12 LEU 20 101.187 7.120 1.609
169 3HD1 LEU 20 HD13 LEU 20 101.281 8.326 2.893
170 1HD2 LEU 20 HD21 LEU 20 99.501 9.498 2.909
171 2HD2 LEU 20 HD22 LEU 20 98.885 10.417 1.534
172 3HD2 LEU 20 HD23 LEU 20 100.447 10.828 2.244
173 HA PRO 21 HA PRO 21 102.219 14.350 -2.536
174 1HB PRO 21 HB2 PRO 21 102.244 16.089 -0.162
175 2HB PRO 21 HB1 PRO 21 101.575 16.394 -1.768
176 1HG PRO 21 HG2 PRO 21 99.990 15.986 0.360
177 2HG PRO 21 HG1 PRO 21 99.549 15.401 -1.257
178 1HD PRO 21 HD2 PRO 21 100.745 13.893 1.042
179 2HD PRO 21 HD1 PRO 21 99.430 13.416 -0.044
180 H ASN 22 HN ASN 22 104.143 13.166 -2.645
181 HA ASN 22 HA ASN 22 106.466 13.512 -2.370
182 1HB ASN 22 HB2 ASN 22 105.933 15.343 -0.657
183 2HB ASN 22 HB1 ASN 22 106.093 14.073 0.556
184 1HD2 ASN 22 HD21 ASN 22 107.665 16.506 -0.042
185 2HD2 ASN 22 HD22 ASN 22 109.292 15.956 -0.173
186 H LEU 23 HN LEU 23 104.463 11.302 -1.548
187 HA LEU 23 HA LEU 23 106.291 9.674 0.074
188 1HB LEU 23 HB2 LEU 23 103.985 9.298 0.629
189 2HB LEU 23 HB1 LEU 23 103.535 9.140 -1.056
190 HG LEU 23 HG LEU 23 104.891 7.024 -1.142
191 1HD1 LEU 23 HD11 LEU 23 105.149 7.628 1.782
192 2HD1 LEU 23 HD12 LEU 23 106.398 7.157 0.629
193 3HD1 LEU 23 HD13 LEU 23 105.210 5.972 1.175
194 1HD2 LEU 23 HD21 LEU 23 102.314 7.447 -0.313
195 2HD2 LEU 23 HD22 LEU 23 102.966 6.419 0.963
196 3HD2 LEU 23 HD23 LEU 23 103.019 5.882 -0.716
197 H ASN 24 HN ASN 24 107.619 8.075 -0.918
198 HA ASN 24 HA ASN 24 108.432 8.423 -3.527
199 1HB ASN 24 HB2 ASN 24 109.109 6.631 -1.562
200 2HB ASN 24 HB1 ASN 24 108.295 5.576 -2.712
201 1HD2 ASN 24 HD21 ASN 24 110.284 8.436 -3.317
202 2HD2 ASN 24 HD22 ASN 24 111.491 7.614 -4.236
203 H GLU 25 HN GLU 25 107.211 8.297 -5.478
204 HA GLU 25 HA GLU 25 104.587 7.359 -5.353
205 1HB GLU 25 HB2 GLU 25 104.533 7.799 -7.719
206 2HB GLU 25 HB1 GLU 25 105.439 9.080 -6.908
207 1HG GLU 25 HG2 GLU 25 106.961 6.770 -8.015
208 2HG GLU 25 HG1 GLU 25 106.286 7.937 -9.150
209 H GLU 26 HN GLU 26 107.573 5.788 -5.740
210 HA GLU 26 HA GLU 26 106.602 3.364 -6.966
211 1HB GLU 26 HB2 GLU 26 108.981 4.080 -7.159
212 2HB GLU 26 HB1 GLU 26 109.157 3.888 -5.420
213 1HG GLU 26 HG2 GLU 26 109.316 1.651 -5.543
214 2HG GLU 26 HG1 GLU 26 108.144 1.529 -6.855
215 H GLN 27 HN GLN 27 106.870 4.802 -3.921
216 HA GLN 27 HA GLN 27 106.456 2.417 -2.313
217 1HB GLN 27 HB2 GLN 27 106.659 5.349 -1.702
218 2HB GLN 27 HB1 GLN 27 105.910 4.277 -0.530
219 1HG GLN 27 HG2 GLN 27 108.622 3.699 -1.656
220 2HG GLN 27 HG1 GLN 27 108.404 4.795 -0.293
221 1HE2 GLN 27 HE21 GLN 27 109.765 2.210 -0.439
222 2HE2 GLN 27 HE22 GLN 27 109.009 1.208 0.748
223 H ARG 28 HN ARG 28 104.684 5.133 -3.630
224 HA ARG 28 HA ARG 28 102.186 4.656 -2.449
225 1HB ARG 28 HB2 ARG 28 102.830 5.962 -5.105
226 2HB ARG 28 HB1 ARG 28 101.264 6.028 -4.307
227 1HG ARG 28 HG2 ARG 28 102.664 6.999 -2.324
228 2HG ARG 28 HG1 ARG 28 103.814 7.390 -3.596
229 1HD ARG 28 HD2 ARG 28 101.026 8.132 -4.180
230 2HD ARG 28 HD1 ARG 28 101.733 8.965 -2.816
231 HE ARG 28 HE ARG 28 103.168 10.072 -4.230
232 1HH1 ARG 28 HH11 ARG 28 101.522 7.546 -5.997
233 2HH1 ARG 28 HH12 ARG 28 101.993 8.155 -7.549
234 1HH2 ARG 28 HH21 ARG 28 103.780 10.874 -6.272
235 2HH2 ARG 28 HH22 ARG 28 103.273 10.044 -7.706
236 H ASN 29 HN ASN 29 103.676 3.426 -5.420
237 HA ASN 29 HA ASN 29 101.322 1.993 -6.224
238 1HB ASN 29 HB2 ASN 29 102.913 2.781 -7.906
239 2HB ASN 29 HB1 ASN 29 104.192 1.815 -7.172
240 1HD2 ASN 29 HD21 ASN 29 100.829 1.248 -8.179
241 2HD2 ASN 29 HD22 ASN 29 101.169 -0.178 -9.093
242 H GLY 30 HN GLY 30 104.417 1.225 -4.690
243 1HA GLY 30 HA2 GLY 30 104.179 -1.553 -4.572
244 2HA GLY 30 HA1 GLY 30 105.079 -0.576 -3.427
245 H PHE 31 HN PHE 31 102.850 0.951 -2.511
246 HA PHE 31 HA PHE 31 101.919 -0.757 -0.457
247 1HB PHE 31 HB2 PHE 31 101.384 2.064 -1.300
248 2HB PHE 31 HB1 PHE 31 100.292 1.309 -0.143
249 HD1 PHE 31 HD1 PHE 31 102.935 3.446 -0.297
250 HD2 PHE 31 HD2 PHE 31 101.793 -0.154 1.661
251 HE1 PHE 31 HE1 PHE 31 104.520 3.933 1.514
252 HE2 PHE 31 HE2 PHE 31 103.376 0.323 3.476
253 HZ PHE 31 HZ PHE 31 104.745 2.376 3.409
254 H ILE 32 HN ILE 32 100.502 0.451 -3.432
255 HA ILE 32 HA ILE 32 97.863 -0.469 -3.022
256 HB ILE 32 HB ILE 32 98.897 -0.503 -5.807
257 1HG1 ILE 32 HG12 ILE 32 98.624 2.048 -4.205
258 2HG1 ILE 32 HG11 ILE 32 100.111 1.399 -4.889
259 1HG2 ILE 32 HG21 ILE 32 96.564 1.083 -4.913
260 2HG2 ILE 32 HG22 ILE 32 96.452 -0.673 -4.796
261 3HG2 ILE 32 HG23 ILE 32 96.777 0.089 -6.353
262 1HD1 ILE 32 HD11 ILE 32 99.571 2.958 -6.457
263 2HD1 ILE 32 HD12 ILE 32 97.834 2.735 -6.239
264 3HD1 ILE 32 HD13 ILE 32 98.772 1.537 -7.129
265 H GLN 33 HN GLN 33 100.663 -1.985 -4.561
266 HA GLN 33 HA GLN 33 99.265 -4.299 -5.413
267 1HB GLN 33 HB2 GLN 33 101.580 -5.301 -5.618
268 2HB GLN 33 HB1 GLN 33 101.287 -3.833 -6.538
269 1HG GLN 33 HG2 GLN 33 102.381 -2.565 -4.671
270 2HG GLN 33 HG1 GLN 33 102.844 -4.123 -3.987
271 1HE2 GLN 33 HE21 GLN 33 103.043 -2.199 -6.952
272 2HE2 GLN 33 HE22 GLN 33 104.599 -2.779 -7.430
273 H SER 34 HN SER 34 101.370 -3.718 -2.557
274 HA SER 34 HA SER 34 101.025 -6.316 -1.505
275 1HB SER 34 HB2 SER 34 102.890 -4.882 -0.806
276 2HB SER 34 HB1 SER 34 101.761 -3.720 -0.105
277 HG SER 34 HG SER 34 102.855 -5.622 1.179
278 H LEU 35 HN LEU 35 99.375 -3.231 -0.970
279 HA LEU 35 HA LEU 35 97.642 -4.155 1.069
280 1HB LEU 35 HB2 LEU 35 97.914 -1.805 0.870
281 2HB LEU 35 HB1 LEU 35 97.518 -1.823 -0.837
282 HG LEU 35 HG LEU 35 95.206 -2.228 -0.378
283 1HD1 LEU 35 HD11 LEU 35 96.209 -3.010 2.244
284 2HD1 LEU 35 HD12 LEU 35 94.755 -3.512 1.382
285 3HD1 LEU 35 HD13 LEU 35 94.759 -2.005 2.299
286 1HD2 LEU 35 HD21 LEU 35 95.116 -0.223 1.551
287 2HD2 LEU 35 HD22 LEU 35 95.071 -0.021 -0.201
288 3HD2 LEU 35 HD23 LEU 35 96.610 0.063 0.658
289 H LYS 36 HN LYS 36 97.047 -3.564 -2.386
290 HA LYS 36 HA LYS 36 94.430 -4.445 -2.471
291 1HB LYS 36 HB2 LYS 36 94.629 -4.702 -4.835
292 2HB LYS 36 HB1 LYS 36 95.658 -3.358 -4.369
293 1HG LYS 36 HG2 LYS 36 97.598 -4.939 -4.442
294 2HG LYS 36 HG1 LYS 36 96.508 -6.139 -5.136
295 1HD LYS 36 HD2 LYS 36 95.975 -4.132 -6.791
296 2HD LYS 36 HD1 LYS 36 97.602 -3.642 -6.322
297 1HE LYS 36 HE2 LYS 36 97.386 -6.478 -6.976
298 2HE LYS 36 HE1 LYS 36 96.964 -5.419 -8.321
299 1HZ LYS 36 HZ1 LYS 36 99.534 -5.862 -7.049
300 2HZ LYS 36 HZ2 LYS 36 99.190 -4.253 -7.439
301 3HZ LYS 36 HZ3 LYS 36 99.173 -5.436 -8.647
302 H ASP 37 HN ASP 37 97.271 -6.506 -3.299
303 HA ASP 37 HA ASP 37 95.897 -8.876 -3.545
304 1HB ASP 37 HB2 ASP 37 98.681 -8.080 -3.057
305 2HB ASP 37 HB1 ASP 37 98.285 -9.699 -2.489
306 H ASP 38 HN ASP 38 96.569 -7.136 -0.623
307 HA ASP 38 HA ASP 38 95.340 -9.312 0.919
308 1HB ASP 38 HB2 ASP 38 98.044 -8.856 0.984
309 2HB ASP 38 HB1 ASP 38 97.483 -7.888 2.342
310 HA PRO 39 HA PRO 39 93.182 -5.473 2.143
311 1HB PRO 39 HB2 PRO 39 90.970 -6.653 3.123
312 2HB PRO 39 HB1 PRO 39 91.228 -6.472 1.385
313 1HG PRO 39 HG2 PRO 39 91.696 -8.862 3.127
314 2HG PRO 39 HG1 PRO 39 90.913 -8.775 1.542
315 1HD PRO 39 HD2 PRO 39 93.490 -9.560 1.854
316 2HD PRO 39 HD1 PRO 39 92.926 -8.697 0.409
317 H SER 40 HN SER 40 93.855 -8.330 4.004
318 HA SER 40 HA SER 40 93.208 -7.198 6.567
319 1HB SER 40 HB2 SER 40 94.305 -9.182 7.502
320 2HB SER 40 HB1 SER 40 93.186 -9.639 6.218
321 HG SER 40 HG SER 40 96.010 -9.438 6.060
322 H GLN 41 HN GLN 41 95.659 -6.698 4.373
323 HA GLN 41 HA GLN 41 97.716 -6.114 6.346
324 1HB GLN 41 HB2 GLN 41 97.634 -6.220 3.339
325 2HB GLN 41 HB1 GLN 41 98.979 -5.462 4.183
326 1HG GLN 41 HG2 GLN 41 99.081 -7.706 5.492
327 2HG GLN 41 HG1 GLN 41 98.179 -8.333 4.115
328 1HE2 GLN 41 HE21 GLN 41 99.432 -9.253 2.658
329 2HE2 GLN 41 HE22 GLN 41 101.039 -8.783 2.246
330 H SER 42 HN SER 42 95.145 -4.509 4.813
331 HA SER 42 HA SER 42 95.853 -2.068 4.018
332 1HB SER 42 HB2 SER 42 93.882 -1.168 5.491
333 2HB SER 42 HB1 SER 42 93.554 -2.325 4.202
334 HG SER 42 HG SER 42 93.092 -2.565 6.821
335 H ALA 43 HN ALA 43 95.069 -2.262 7.479
336 HA ALA 43 HA ALA 43 96.208 0.063 8.302
337 1HB ALA 43 HB1 ALA 43 94.991 -1.020 9.931
338 2HB ALA 43 HB2 ALA 43 96.642 -1.227 10.515
339 3HB ALA 43 HB3 ALA 43 95.828 -2.554 9.688
340 H ASN 44 HN ASN 44 97.912 -2.997 7.787
341 HA ASN 44 HA ASN 44 100.372 -2.173 8.924
342 1HB ASN 44 HB2 ASN 44 99.598 -4.372 7.023
343 2HB ASN 44 HB1 ASN 44 101.280 -4.100 7.469
344 1HD2 ASN 44 HD21 ASN 44 99.467 -6.357 7.992
345 2HD2 ASN 44 HD22 ASN 44 99.475 -6.569 9.706
346 H LEU 45 HN LEU 45 99.214 -2.247 5.575
347 HA LEU 45 HA LEU 45 101.642 -1.198 4.498
348 1HB LEU 45 HB2 LEU 45 98.919 -1.821 3.462
349 2HB LEU 45 HB1 LEU 45 99.968 -0.812 2.491
350 HG LEU 45 HG LEU 45 100.010 -3.254 1.912
351 1HD1 LEU 45 HD11 LEU 45 101.833 -2.071 1.090
352 2HD1 LEU 45 HD12 LEU 45 102.576 -3.390 1.995
353 3HD1 LEU 45 HD13 LEU 45 102.492 -1.775 2.700
354 1HD2 LEU 45 HD21 LEU 45 101.756 -3.747 4.259
355 2HD2 LEU 45 HD22 LEU 45 100.748 -4.863 3.340
356 3HD2 LEU 45 HD23 LEU 45 100.010 -3.768 4.508
357 H LEU 46 HN LEU 46 98.394 0.197 4.953
358 HA LEU 46 HA LEU 46 98.963 2.758 4.021
359 1HB LEU 46 HB2 LEU 46 96.972 1.799 6.066
360 2HB LEU 46 HB1 LEU 46 97.029 3.455 5.498
361 HG LEU 46 HG LEU 46 95.530 2.812 3.968
362 1HD1 LEU 46 HD11 LEU 46 97.971 1.448 2.857
363 2HD1 LEU 46 HD12 LEU 46 97.307 3.024 2.425
364 3HD1 LEU 46 HD13 LEU 46 96.449 1.550 1.978
365 1HD2 LEU 46 HD21 LEU 46 94.665 0.699 3.825
366 2HD2 LEU 46 HD22 LEU 46 95.490 0.591 5.379
367 3HD2 LEU 46 HD23 LEU 46 96.245 -0.075 3.932
368 H ALA 47 HN ALA 47 99.201 1.463 7.338
369 HA ALA 47 HA ALA 47 99.820 3.825 8.656
370 1HB ALA 47 HB1 ALA 47 100.982 2.373 10.308
371 2HB ALA 47 HB2 ALA 47 100.793 1.022 9.190
372 3HB ALA 47 HB3 ALA 47 99.370 1.805 9.876
373 H GLU 48 HN GLU 48 102.074 1.477 7.195
374 HA GLU 48 HA GLU 48 104.428 2.914 7.758
375 1HB GLU 48 HB2 GLU 48 103.769 0.829 5.679
376 2HB GLU 48 HB1 GLU 48 105.376 1.525 5.829
377 1HG GLU 48 HG2 GLU 48 104.145 0.419 8.283
378 2HG GLU 48 HG1 GLU 48 104.661 -0.723 7.044
379 H ALA 49 HN ALA 49 102.106 3.121 5.140
380 HA ALA 49 HA ALA 49 103.687 4.633 3.356
381 1HB ALA 49 HB1 ALA 49 100.773 5.075 3.291
382 2HB ALA 49 HB2 ALA 49 101.304 3.400 3.146
383 3HB ALA 49 HB3 ALA 49 101.882 4.611 2.001
384 H LYS 50 HN LYS 50 101.151 5.671 5.637
385 HA LYS 50 HA LYS 50 101.412 8.417 5.131
386 1HB LYS 50 HB2 LYS 50 100.298 8.684 7.379
387 2HB LYS 50 HB1 LYS 50 99.442 7.667 6.228
388 1HG LYS 50 HG2 LYS 50 100.463 5.679 7.362
389 2HG LYS 50 HG1 LYS 50 101.064 6.782 8.600
390 1HD LYS 50 HD2 LYS 50 99.108 6.235 9.598
391 2HD LYS 50 HD1 LYS 50 98.493 7.527 8.565
392 1HE LYS 50 HE2 LYS 50 98.597 4.814 7.394
393 2HE LYS 50 HE1 LYS 50 97.407 5.079 8.664
394 1HZ LYS 50 HZ1 LYS 50 96.136 6.257 7.293
395 2HZ LYS 50 HZ2 LYS 50 97.102 5.688 6.027
396 3HZ LYS 50 HZ3 LYS 50 97.432 7.189 6.733
397 H LYS 51 HN LYS 51 102.762 6.463 7.815
398 HA LYS 51 HA LYS 51 104.187 8.472 9.077
399 1HB LYS 51 HB2 LYS 51 104.865 5.541 8.781
400 2HB LYS 51 HB1 LYS 51 105.615 6.623 9.946
401 1HG LYS 51 HG2 LYS 51 103.734 6.730 11.259
402 2HG LYS 51 HG1 LYS 51 102.652 6.331 9.923
403 1HD LYS 51 HD2 LYS 51 102.837 4.496 11.548
404 2HD LYS 51 HD1 LYS 51 103.423 4.025 9.953
405 1HE LYS 51 HE2 LYS 51 105.442 5.128 11.805
406 2HE LYS 51 HE1 LYS 51 104.760 3.562 12.246
407 1HZ LYS 51 HZ1 LYS 51 105.972 2.574 10.696
408 2HZ LYS 51 HZ2 LYS 51 106.771 4.039 10.427
409 3HZ LYS 51 HZ3 LYS 51 105.427 3.626 9.487
410 H LEU 52 HN LEU 52 105.258 6.244 6.543
411 HA LEU 52 HA LEU 52 107.884 7.082 6.267
412 1HB LEU 52 HB2 LEU 52 107.146 5.097 5.174
413 2HB LEU 52 HB1 LEU 52 105.927 5.971 4.267
414 HG LEU 52 HG LEU 52 107.689 7.104 2.982
415 1HD1 LEU 52 HD11 LEU 52 109.385 5.824 5.000
416 2HD1 LEU 52 HD12 LEU 52 109.649 7.284 4.048
417 3HD1 LEU 52 HD13 LEU 52 109.982 5.702 3.345
418 1HD2 LEU 52 HD21 LEU 52 108.580 4.364 2.589
419 2HD2 LEU 52 HD22 LEU 52 107.688 5.433 1.506
420 3HD2 LEU 52 HD23 LEU 52 106.826 4.497 2.727
421 H ASN 53 HN ASN 53 105.094 8.115 4.327
422 HA ASN 53 HA ASN 53 106.294 9.973 2.714
423 1HB ASN 53 HB2 ASN 53 103.915 9.214 2.583
424 2HB ASN 53 HB1 ASN 53 103.549 10.255 3.951
425 1HD2 ASN 53 HD21 ASN 53 102.112 11.480 2.804
426 2HD2 ASN 53 HD22 ASN 53 102.594 12.595 1.576
427 H ASP 54 HN ASP 54 104.754 10.672 5.863
428 HA ASP 54 HA ASP 54 105.327 13.373 5.977
429 1HB ASP 54 HB2 ASP 54 104.034 11.731 7.617
430 2HB ASP 54 HB1 ASP 54 105.562 11.781 8.491
431 H ALA 55 HN ALA 55 107.319 10.667 7.157
432 HA ALA 55 HA ALA 55 109.435 12.232 8.136
433 1HB ALA 55 HB1 ALA 55 108.899 9.812 8.636
434 2HB ALA 55 HB2 ALA 55 110.604 10.220 8.430
435 3HB ALA 55 HB3 ALA 55 109.723 9.424 7.126
436 H GLN 56 HN GLN 56 108.927 10.841 4.896
437 HA GLN 56 HA GLN 56 111.564 11.792 4.092
438 1HB GLN 56 HB2 GLN 56 110.925 10.728 1.866
439 2HB GLN 56 HB1 GLN 56 111.166 9.656 3.235
440 1HG GLN 56 HG2 GLN 56 109.025 8.987 3.263
441 2HG GLN 56 HG1 GLN 56 108.405 10.577 2.820
442 1HE2 GLN 56 HE21 GLN 56 109.655 11.062 0.464
443 2HE2 GLN 56 HE22 GLN 56 109.172 9.901 -0.720
444 H ALA 57 HN ALA 57 108.592 13.195 4.329
445 HA ALA 57 HA ALA 57 108.603 14.640 1.827
446 1HB ALA 57 HB1 ALA 57 106.626 13.999 3.516
447 2HB ALA 57 HB2 ALA 57 106.539 15.347 2.388
448 3HB ALA 57 HB3 ALA 57 106.971 15.634 4.077
449 HA PRO 58 HA PRO 58 110.640 18.429 2.963
450 1HB PRO 58 HB2 PRO 58 108.876 20.369 3.799
451 2HB PRO 58 HB1 PRO 58 109.210 19.985 2.108
452 1HG PRO 58 HG2 PRO 58 106.940 19.107 3.839
453 2HG PRO 58 HG1 PRO 58 106.928 19.608 2.138
454 1HD PRO 58 HD2 PRO 58 106.807 17.037 2.849
455 2HD PRO 58 HD1 PRO 58 107.681 17.550 1.398
456 H LYS 59 HN LYS 59 111.489 17.195 4.769
457 HA LYS 59 HA LYS 59 110.995 18.583 7.284
458 1HB LYS 59 HB2 LYS 59 109.612 16.454 7.208
459 2HB LYS 59 HB1 LYS 59 111.132 15.570 7.204
460 1HG LYS 59 HG2 LYS 59 110.621 15.562 9.435
461 2HG LYS 59 HG1 LYS 59 111.633 17.003 9.328
462 1HD LYS 59 HD2 LYS 59 109.941 18.047 10.358
463 2HD LYS 59 HD1 LYS 59 109.142 18.000 8.786
464 1HE LYS 59 HE2 LYS 59 107.624 17.165 10.449
465 2HE LYS 59 HE1 LYS 59 108.131 15.827 9.419
466 1HZ LYS 59 HZ1 LYS 59 108.454 14.855 11.415
467 2HZ LYS 59 HZ2 LYS 59 108.683 16.316 12.235
468 3HZ LYS 59 HZ3 LYS 59 109.947 15.647 11.333
469 H ALA 60 HN ALA 60 112.786 18.792 8.552
470 HA ALA 60 HA ALA 60 115.156 17.237 8.160
471 1HB ALA 60 HB1 ALA 60 116.586 18.860 7.209
472 2HB ALA 60 HB2 ALA 60 115.374 20.131 7.377
473 3HB ALA 60 HB3 ALA 60 115.137 18.838 6.202
Start of MODEL 5
1 1H GLY -1 HT1 GLY -1 83.514 -17.215 -5.697
2 2H GLY -1 HT2 GLY -1 83.075 -18.613 -4.852
3 3H GLY -1 HT3 GLY -1 83.540 -18.717 -6.475
4 1HA GLY -1 HA1 GLY -1 85.319 -17.827 -4.272
5 2HA GLY -1 HA2 GLY -1 85.289 -19.461 -4.918
6 H SER 0 HN SER 0 86.906 -16.614 -5.040
7 HA SER 0 HA SER 0 88.401 -17.407 -7.346
8 1HB SER 0 HB2 SER 0 86.242 -15.998 -8.068
9 2HB SER 0 HB1 SER 0 87.317 -14.654 -7.684
10 HG SER 0 HG SER 0 87.420 -16.470 -9.761
11 H THR 1 HN THR 1 90.281 -16.073 -7.702
12 HA THR 1 HA THR 1 91.602 -15.377 -5.355
13 HB THR 1 HB THR 1 93.285 -14.302 -6.879
14 HG1 THR 1 HG1 THR 1 92.608 -13.711 -8.754
15 1HG2 THR 1 HG21 THR 1 92.351 -17.001 -7.820
16 2HG2 THR 1 HG22 THR 1 93.385 -16.713 -6.422
17 3HG2 THR 1 HG23 THR 1 93.954 -16.301 -8.040
18 H ALA 2 HN ALA 2 90.467 -13.132 -7.897
19 HA ALA 2 HA ALA 2 90.899 -10.856 -6.186
20 1HB ALA 2 HB1 ALA 2 91.126 -11.007 -8.763
21 2HB ALA 2 HB2 ALA 2 90.482 -9.537 -8.033
22 3HB ALA 2 HB3 ALA 2 89.387 -10.713 -8.758
23 H ASP 3 HN ASP 3 89.548 -10.446 -4.568
24 HA ASP 3 HA ASP 3 86.840 -9.794 -5.047
25 1HB ASP 3 HB2 ASP 3 86.411 -11.753 -3.061
26 2HB ASP 3 HB1 ASP 3 85.770 -11.720 -4.697
27 H ASN 4 HN ASN 4 89.252 -8.703 -3.809
28 HA ASN 4 HA ASN 4 89.372 -8.667 -1.095
29 1HB ASN 4 HB2 ASN 4 89.864 -6.082 -1.503
30 2HB ASN 4 HB1 ASN 4 90.998 -7.330 -1.998
31 1HD2 ASN 4 HD21 ASN 4 89.570 -4.573 -2.964
32 2HD2 ASN 4 HD22 ASN 4 89.625 -4.784 -4.678
33 H LYS 5 HN LYS 5 87.766 -5.926 -2.671
34 HA LYS 5 HA LYS 5 85.625 -5.080 -2.344
35 1HB LYS 5 HB2 LYS 5 85.118 -7.413 -1.235
36 2HB LYS 5 HB1 LYS 5 85.301 -6.513 0.265
37 1HG LYS 5 HG2 LYS 5 83.569 -5.191 -1.674
38 2HG LYS 5 HG1 LYS 5 82.988 -6.780 -1.171
39 1HD LYS 5 HD2 LYS 5 83.849 -4.630 0.755
40 2HD LYS 5 HD1 LYS 5 82.180 -4.859 0.230
41 1HE LYS 5 HE2 LYS 5 82.845 -7.378 0.987
42 2HE LYS 5 HE1 LYS 5 83.811 -6.423 2.111
43 1HZ LYS 5 HZ1 LYS 5 81.089 -5.510 1.814
44 2HZ LYS 5 HZ2 LYS 5 82.001 -5.760 3.216
45 3HZ LYS 5 HZ3 LYS 5 81.224 -7.064 2.471
46 H PHE 6 HN PHE 6 87.588 -3.532 -1.937
47 HA PHE 6 HA PHE 6 87.961 -2.678 0.771
48 1HB PHE 6 HB2 PHE 6 88.888 -1.698 -1.908
49 2HB PHE 6 HB1 PHE 6 89.068 -0.669 -0.493
50 HD1 PHE 6 HD1 PHE 6 91.290 -0.627 0.074
51 HD2 PHE 6 HD2 PHE 6 89.486 -4.343 -0.933
52 HE1 PHE 6 HE1 PHE 6 93.366 -1.791 0.678
53 HE2 PHE 6 HE2 PHE 6 91.564 -5.522 -0.335
54 HZ PHE 6 HZ PHE 6 93.515 -4.248 0.481
55 H ASN 7 HN ASN 7 85.803 -2.192 1.452
56 HA ASN 7 HA ASN 7 84.046 -0.460 0.175
57 1HB ASN 7 HB2 ASN 7 84.406 -0.940 3.140
58 2HB ASN 7 HB1 ASN 7 83.009 -0.156 2.410
59 1HD2 ASN 7 HD21 ASN 7 82.967 -2.511 3.993
60 2HD2 ASN 7 HD22 ASN 7 82.379 -3.797 2.998
61 H LYS 8 HN LYS 8 83.406 1.575 1.944
62 HA LYS 8 HA LYS 8 84.918 3.700 1.031
63 1HB LYS 8 HB2 LYS 8 83.802 5.063 2.705
64 2HB LYS 8 HB1 LYS 8 82.667 3.931 1.984
65 1HG LYS 8 HG2 LYS 8 82.079 3.589 4.125
66 2HG LYS 8 HG1 LYS 8 83.460 2.492 4.110
67 1HD LYS 8 HD2 LYS 8 84.884 4.289 4.988
68 2HD LYS 8 HD1 LYS 8 83.493 5.373 5.013
69 1HE LYS 8 HE2 LYS 8 82.648 3.112 6.397
70 2HE LYS 8 HE1 LYS 8 84.309 3.363 6.930
71 1HZ LYS 8 HZ1 LYS 8 82.715 4.553 8.315
72 2HZ LYS 8 HZ2 LYS 8 82.166 5.421 6.971
73 3HZ LYS 8 HZ3 LYS 8 83.752 5.629 7.521
74 H GLU 9 HN GLU 9 85.284 1.908 4.061
75 HA GLU 9 HA GLU 9 87.284 3.620 5.129
76 1HB GLU 9 HB2 GLU 9 87.690 1.703 6.709
77 2HB GLU 9 HB1 GLU 9 86.038 2.302 6.662
78 1HG GLU 9 HG2 GLU 9 85.458 0.165 6.462
79 2HG GLU 9 HG1 GLU 9 85.974 0.320 4.785
80 H GLN 10 HN GLN 10 87.473 0.420 3.589
81 HA GLN 10 HA GLN 10 90.287 0.231 3.708
82 1HB GLN 10 HB2 GLN 10 88.331 -1.520 3.225
83 2HB GLN 10 HB1 GLN 10 88.796 -1.175 1.569
84 1HG GLN 10 HG2 GLN 10 90.164 -2.927 1.958
85 2HG GLN 10 HG1 GLN 10 91.213 -1.630 2.536
86 1HE2 GLN 10 HE21 GLN 10 91.869 -3.974 3.505
87 2HE2 GLN 10 HE22 GLN 10 91.334 -4.187 5.127
88 H GLN 11 HN GLN 11 88.114 1.058 1.002
89 HA GLN 11 HA GLN 11 90.041 1.378 -0.967
90 1HB GLN 11 HB2 GLN 11 87.426 1.470 -1.054
91 2HB GLN 11 HB1 GLN 11 87.673 3.200 -0.886
92 1HG GLN 11 HG2 GLN 11 88.422 3.426 -2.983
93 2HG GLN 11 HG1 GLN 11 89.327 1.914 -2.934
94 1HE2 GLN 11 HE21 GLN 11 88.676 0.681 -4.540
95 2HE2 GLN 11 HE22 GLN 11 87.037 0.389 -5.001
96 H ASN 12 HN ASN 12 89.072 3.590 1.579
97 HA ASN 12 HA ASN 12 90.043 5.984 0.607
98 1HB ASN 12 HB2 ASN 12 89.611 4.831 3.294
99 2HB ASN 12 HB1 ASN 12 90.747 6.175 3.228
100 1HD2 ASN 12 HD21 ASN 12 89.456 7.619 4.284
101 2HD2 ASN 12 HD22 ASN 12 87.996 8.254 3.614
102 H ALA 13 HN ALA 13 91.804 3.320 2.133
103 HA ALA 13 HA ALA 13 94.286 4.516 2.410
104 1HB ALA 13 HB1 ALA 13 95.191 2.350 2.578
105 2HB ALA 13 HB2 ALA 13 93.933 1.658 1.554
106 3HB ALA 13 HB3 ALA 13 93.539 2.215 3.180
107 H PHE 14 HN PHE 14 92.914 2.872 -0.459
108 HA PHE 14 HA PHE 14 95.131 2.835 -2.070
109 1HB PHE 14 HB2 PHE 14 92.889 1.836 -2.504
110 2HB PHE 14 HB1 PHE 14 92.313 3.427 -2.967
111 HD1 PHE 14 HD1 PHE 14 93.819 0.427 -4.098
112 HD2 PHE 14 HD2 PHE 14 93.568 4.602 -4.879
113 HE1 PHE 14 HE1 PHE 14 94.563 0.035 -6.411
114 HE2 PHE 14 HE2 PHE 14 94.309 4.220 -7.192
115 HZ PHE 14 HZ PHE 14 94.808 1.933 -7.962
116 H TRP 15 HN TRP 15 92.655 5.402 -2.081
117 HA TRP 15 HA TRP 15 94.029 7.050 -3.907
118 1HB TRP 15 HB2 TRP 15 91.715 7.329 -2.120
119 2HB TRP 15 HB1 TRP 15 92.552 8.834 -2.483
120 HD1 TRP 15 HD1 TRP 15 91.880 5.882 -4.900
121 HE1 TRP 15 HE1 TRP 15 90.575 6.800 -6.919
122 HE3 TRP 15 HE3 TRP 15 91.255 10.703 -3.327
123 HZ2 TRP 15 HZ2 TRP 15 89.428 9.254 -7.735
124 HZ3 TRP 15 HZ3 TRP 15 90.045 12.275 -4.784
125 HH2 TRP 15 HH2 TRP 15 89.152 11.564 -6.943
126 H GLU 16 HN GLU 16 93.765 7.332 -0.365
127 HA GLU 16 HA GLU 16 95.480 9.495 0.002
128 1HB GLU 16 HB2 GLU 16 94.726 7.158 1.738
129 2HB GLU 16 HB1 GLU 16 95.888 8.354 2.298
130 1HG GLU 16 HG2 GLU 16 93.338 9.384 1.223
131 2HG GLU 16 HG1 GLU 16 93.266 8.524 2.760
132 H ILE 17 HN ILE 17 96.095 6.260 -0.772
133 HA ILE 17 HA ILE 17 98.933 6.289 -0.105
134 HB ILE 17 HB ILE 17 97.218 4.258 -1.528
135 1HG1 ILE 17 HG12 ILE 17 99.044 3.765 0.802
136 2HG1 ILE 17 HG11 ILE 17 97.487 4.543 1.068
137 1HG2 ILE 17 HG21 ILE 17 100.207 4.475 -1.437
138 2HG2 ILE 17 HG22 ILE 17 99.159 4.091 -2.802
139 3HG2 ILE 17 HG23 ILE 17 99.419 2.897 -1.529
140 1HD1 ILE 17 HD11 ILE 17 96.495 2.551 -0.191
141 2HD1 ILE 17 HD12 ILE 17 97.084 2.286 1.450
142 3HD1 ILE 17 HD13 ILE 17 98.060 1.782 0.070
143 H LEU 18 HN LEU 18 96.853 6.399 -2.934
144 HA LEU 18 HA LEU 18 98.839 6.689 -4.896
145 1HB LEU 18 HB2 LEU 18 96.154 6.316 -4.923
146 2HB LEU 18 HB1 LEU 18 96.224 8.023 -5.301
147 HG LEU 18 HG LEU 18 97.361 7.670 -7.326
148 1HD1 LEU 18 HD11 LEU 18 99.092 6.193 -6.830
149 2HD1 LEU 18 HD12 LEU 18 98.078 5.291 -7.958
150 3HD1 LEU 18 HD13 LEU 18 97.989 4.957 -6.230
151 1HD2 LEU 18 HD21 LEU 18 95.033 6.016 -6.733
152 2HD2 LEU 18 HD22 LEU 18 95.961 5.454 -8.124
153 3HD2 LEU 18 HD23 LEU 18 95.339 7.104 -8.087
154 H HIS 19 HN HIS 19 97.256 8.980 -2.800
155 HA HIS 19 HA HIS 19 98.103 11.283 -4.265
156 1HB HIS 19 HB2 HIS 19 96.661 10.768 -1.720
157 2HB HIS 19 HB1 HIS 19 97.462 12.327 -1.890
158 HD1 HIS 19 HD1 HIS 19 94.411 12.205 -1.733
159 HD2 HIS 19 HD2 HIS 19 96.546 12.137 -5.296
160 HE1 HIS 19 HE1 HIS 19 92.805 13.009 -3.495
161 HE2 HIS 19 HE2 HIS 19 94.149 13.048 -5.626
162 H LEU 20 HN LEU 20 99.004 10.020 -1.039
163 HA LEU 20 HA LEU 20 100.706 11.073 0.235
164 1HB LEU 20 HB2 LEU 20 101.972 9.031 -1.552
165 2HB LEU 20 HB1 LEU 20 102.670 9.638 -0.071
166 HG LEU 20 HG LEU 20 100.271 7.873 -0.412
167 1HD1 LEU 20 HD11 LEU 20 101.488 6.308 0.650
168 2HD1 LEU 20 HD12 LEU 20 102.253 7.481 1.726
169 3HD1 LEU 20 HD13 LEU 20 102.849 7.274 0.076
170 1HD2 LEU 20 HD21 LEU 20 100.991 9.434 2.066
171 2HD2 LEU 20 HD22 LEU 20 99.752 8.184 1.952
172 3HD2 LEU 20 HD23 LEU 20 99.568 9.693 1.058
173 HA PRO 21 HA PRO 21 102.170 14.173 -2.897
174 1HB PRO 21 HB2 PRO 21 101.697 15.863 -0.499
175 2HB PRO 21 HB1 PRO 21 101.270 16.162 -2.187
176 1HG PRO 21 HG2 PRO 21 99.406 15.484 -0.399
177 2HG PRO 21 HG1 PRO 21 99.344 14.881 -2.066
178 1HD PRO 21 HD2 PRO 21 100.193 13.476 0.429
179 2HD PRO 21 HD1 PRO 21 99.300 12.850 -0.971
180 H ASN 22 HN ASN 22 104.246 13.403 -2.876
181 HA ASN 22 HA ASN 22 106.460 14.208 -2.453
182 1HB ASN 22 HB2 ASN 22 105.506 15.643 -0.524
183 2HB ASN 22 HB1 ASN 22 105.932 14.269 0.495
184 1HD2 ASN 22 HD21 ASN 22 108.229 13.474 0.148
185 2HD2 ASN 22 HD22 ASN 22 109.450 14.688 0.002
186 H LEU 23 HN LEU 23 104.675 11.654 -1.451
187 HA LEU 23 HA LEU 23 106.932 10.181 -0.328
188 1HB LEU 23 HB2 LEU 23 104.567 9.831 0.515
189 2HB LEU 23 HB1 LEU 23 104.221 9.060 -1.023
190 HG LEU 23 HG LEU 23 106.564 8.001 0.434
191 1HD1 LEU 23 HD11 LEU 23 104.509 6.552 1.556
192 2HD1 LEU 23 HD12 LEU 23 103.965 8.221 1.705
193 3HD1 LEU 23 HD13 LEU 23 105.518 7.741 2.382
194 1HD2 LEU 23 HD21 LEU 23 105.039 5.901 -0.252
195 2HD2 LEU 23 HD22 LEU 23 106.174 6.684 -1.351
196 3HD2 LEU 23 HD23 LEU 23 104.462 7.091 -1.417
197 H ASN 24 HN ASN 24 108.006 8.493 -1.460
198 HA ASN 24 HA ASN 24 108.297 8.857 -4.209
199 1HB ASN 24 HB2 ASN 24 109.105 6.813 -2.250
200 2HB ASN 24 HB1 ASN 24 108.891 6.183 -3.881
201 1HD2 ASN 24 HD21 ASN 24 110.025 7.350 -5.616
202 2HD2 ASN 24 HD22 ASN 24 111.580 8.020 -5.269
203 H GLU 25 HN GLU 25 106.695 8.644 -5.742
204 HA GLU 25 HA GLU 25 104.285 7.383 -5.236
205 1HB GLU 25 HB2 GLU 25 103.840 7.703 -7.597
206 2HB GLU 25 HB1 GLU 25 104.665 9.118 -6.938
207 1HG GLU 25 HG2 GLU 25 105.921 8.903 -8.787
208 2HG GLU 25 HG1 GLU 25 106.781 7.709 -7.815
209 H GLU 26 HN GLU 26 107.319 6.110 -6.279
210 HA GLU 26 HA GLU 26 106.360 3.617 -7.309
211 1HB GLU 26 HB2 GLU 26 108.697 2.882 -7.109
212 2HB GLU 26 HB1 GLU 26 108.600 4.458 -7.883
213 1HG GLU 26 HG2 GLU 26 109.736 5.474 -6.245
214 2HG GLU 26 HG1 GLU 26 108.928 4.556 -4.976
215 H GLN 27 HN GLN 27 107.013 5.006 -4.275
216 HA GLN 27 HA GLN 27 107.011 2.556 -2.728
217 1HB GLN 27 HB2 GLN 27 107.492 5.376 -2.190
218 2HB GLN 27 HB1 GLN 27 106.409 4.672 -0.998
219 1HG GLN 27 HG2 GLN 27 108.786 4.586 -0.349
220 2HG GLN 27 HG1 GLN 27 108.018 3.001 -0.425
221 1HE2 GLN 27 HE21 GLN 27 109.096 1.477 -1.444
222 2HE2 GLN 27 HE22 GLN 27 110.341 1.718 -2.618
223 H ARG 28 HN ARG 28 104.843 5.158 -3.659
224 HA ARG 28 HA ARG 28 102.585 4.440 -2.150
225 1HB ARG 28 HB2 ARG 28 102.774 5.790 -4.861
226 2HB ARG 28 HB1 ARG 28 101.289 5.656 -3.932
227 1HG ARG 28 HG2 ARG 28 102.561 6.867 -2.073
228 2HG ARG 28 HG1 ARG 28 103.744 7.261 -3.319
229 1HD ARG 28 HD2 ARG 28 101.303 7.916 -4.466
230 2HD ARG 28 HD1 ARG 28 101.127 8.414 -2.806
231 HE ARG 28 HE ARG 28 102.980 9.880 -3.079
232 1HH1 ARG 28 HH11 ARG 28 101.893 8.401 -6.059
233 2HH1 ARG 28 HH12 ARG 28 102.653 9.588 -7.062
234 1HH2 ARG 28 HH21 ARG 28 103.971 11.431 -4.405
235 2HH2 ARG 28 HH22 ARG 28 103.832 11.304 -6.127
236 H ASN 29 HN ASN 29 103.354 3.739 -5.562
237 HA ASN 29 HA ASN 29 101.287 2.023 -6.154
238 1HB ASN 29 HB2 ASN 29 102.831 2.834 -7.854
239 2HB ASN 29 HB1 ASN 29 104.154 1.934 -7.120
240 1HD2 ASN 29 HD21 ASN 29 100.871 1.363 -8.343
241 2HD2 ASN 29 HD22 ASN 29 101.251 -0.112 -9.159
242 H GLY 30 HN GLY 30 104.485 1.202 -4.798
243 1HA GLY 30 HA2 GLY 30 104.111 -1.571 -4.647
244 2HA GLY 30 HA1 GLY 30 105.164 -0.637 -3.591
245 H PHE 31 HN PHE 31 103.081 1.009 -2.507
246 HA PHE 31 HA PHE 31 102.259 -0.647 -0.358
247 1HB PHE 31 HB2 PHE 31 101.882 2.205 -1.136
248 2HB PHE 31 HB1 PHE 31 100.768 1.534 0.050
249 HD1 PHE 31 HD1 PHE 31 103.540 3.458 -0.160
250 HD2 PHE 31 HD2 PHE 31 102.221 -0.095 1.762
251 HE1 PHE 31 HE1 PHE 31 105.219 3.794 1.607
252 HE2 PHE 31 HE2 PHE 31 103.890 0.226 3.530
253 HZ PHE 31 HZ PHE 31 105.396 2.176 3.458
254 H ILE 32 HN ILE 32 100.662 0.587 -3.231
255 HA ILE 32 HA ILE 32 98.032 -0.213 -2.482
256 HB ILE 32 HB ILE 32 98.704 -0.096 -5.374
257 1HG1 ILE 32 HG12 ILE 32 98.775 2.316 -3.546
258 2HG1 ILE 32 HG11 ILE 32 100.083 1.717 -4.561
259 1HG2 ILE 32 HG21 ILE 32 96.579 1.446 -5.103
260 2HG2 ILE 32 HG22 ILE 32 96.447 0.592 -3.568
261 3HG2 ILE 32 HG23 ILE 32 96.450 -0.312 -5.082
262 1HD1 ILE 32 HD11 ILE 32 99.298 3.488 -5.785
263 2HD1 ILE 32 HD12 ILE 32 97.618 3.192 -5.337
264 3HD1 ILE 32 HD13 ILE 32 98.419 2.138 -6.502
265 H GLN 33 HN GLN 33 100.610 -1.731 -4.350
266 HA GLN 33 HA GLN 33 99.119 -3.955 -5.241
267 1HB GLN 33 HB2 GLN 33 102.079 -3.566 -4.796
268 2HB GLN 33 HB1 GLN 33 101.398 -5.023 -5.507
269 1HG GLN 33 HG2 GLN 33 100.486 -2.558 -6.776
270 2HG GLN 33 HG1 GLN 33 102.227 -2.818 -6.883
271 1HE2 GLN 33 HE21 GLN 33 102.454 -3.394 -8.957
272 2HE2 GLN 33 HE22 GLN 33 101.688 -4.758 -9.691
273 H SER 34 HN SER 34 101.310 -3.541 -2.473
274 HA SER 34 HA SER 34 100.944 -6.135 -1.415
275 1HB SER 34 HB2 SER 34 102.849 -4.775 -0.743
276 2HB SER 34 HB1 SER 34 101.776 -3.557 -0.049
277 HG SER 34 HG SER 34 102.296 -6.181 0.859
278 H LEU 35 HN LEU 35 99.250 -3.102 -1.005
279 HA LEU 35 HA LEU 35 97.597 -3.959 1.165
280 1HB LEU 35 HB2 LEU 35 97.914 -1.632 0.945
281 2HB LEU 35 HB1 LEU 35 97.505 -1.648 -0.760
282 HG LEU 35 HG LEU 35 95.179 -2.001 -0.273
283 1HD1 LEU 35 HD11 LEU 35 96.237 -2.692 2.390
284 2HD1 LEU 35 HD12 LEU 35 94.878 -3.368 1.496
285 3HD1 LEU 35 HD13 LEU 35 94.693 -1.838 2.353
286 1HD2 LEU 35 HD21 LEU 35 95.223 0.233 -0.144
287 2HD2 LEU 35 HD22 LEU 35 96.653 0.236 0.891
288 3HD2 LEU 35 HD23 LEU 35 95.055 -0.005 1.596
289 H LYS 36 HN LYS 36 96.996 -3.538 -2.351
290 HA LYS 36 HA LYS 36 94.323 -4.327 -2.308
291 1HB LYS 36 HB2 LYS 36 95.628 -3.306 -4.237
292 2HB LYS 36 HB1 LYS 36 96.230 -4.924 -4.567
293 1HG LYS 36 HG2 LYS 36 94.358 -4.391 -6.008
294 2HG LYS 36 HG1 LYS 36 93.943 -5.710 -4.912
295 1HD LYS 36 HD2 LYS 36 92.118 -4.081 -5.121
296 2HD LYS 36 HD1 LYS 36 92.741 -4.161 -3.473
297 1HE LYS 36 HE2 LYS 36 94.138 -2.183 -5.069
298 2HE LYS 36 HE1 LYS 36 92.403 -1.877 -5.014
299 1HZ LYS 36 HZ1 LYS 36 92.804 -0.930 -3.057
300 2HZ LYS 36 HZ2 LYS 36 94.369 -1.564 -2.960
301 3HZ LYS 36 HZ3 LYS 36 93.051 -2.485 -2.437
302 H ASP 37 HN ASP 37 97.102 -6.398 -3.328
303 HA ASP 37 HA ASP 37 95.708 -8.757 -3.459
304 1HB ASP 37 HB2 ASP 37 98.480 -7.947 -3.358
305 2HB ASP 37 HB1 ASP 37 98.246 -9.465 -2.497
306 H ASP 38 HN ASP 38 96.602 -7.019 -0.622
307 HA ASP 38 HA ASP 38 95.528 -9.215 0.998
308 1HB ASP 38 HB2 ASP 38 98.208 -8.576 0.962
309 2HB ASP 38 HB1 ASP 38 97.611 -7.682 2.356
310 HA PRO 39 HA PRO 39 93.230 -5.447 2.157
311 1HB PRO 39 HB2 PRO 39 91.026 -6.750 3.032
312 2HB PRO 39 HB1 PRO 39 91.319 -6.434 1.319
313 1HG PRO 39 HG2 PRO 39 91.782 -8.940 2.888
314 2HG PRO 39 HG1 PRO 39 91.081 -8.746 1.270
315 1HD PRO 39 HD2 PRO 39 93.658 -9.497 1.676
316 2HD PRO 39 HD1 PRO 39 93.141 -8.556 0.263
317 H SER 40 HN SER 40 93.958 -8.358 3.933
318 HA SER 40 HA SER 40 93.197 -7.391 6.510
319 1HB SER 40 HB2 SER 40 93.425 -9.815 5.961
320 2HB SER 40 HB1 SER 40 95.170 -9.588 5.841
321 HG SER 40 HG SER 40 95.283 -9.215 7.989
322 H GLN 41 HN GLN 41 95.763 -6.710 4.428
323 HA GLN 41 HA GLN 41 97.606 -5.960 6.553
324 1HB GLN 41 HB2 GLN 41 97.891 -5.821 3.548
325 2HB GLN 41 HB1 GLN 41 99.161 -5.466 4.716
326 1HG GLN 41 HG2 GLN 41 98.951 -7.800 5.556
327 2HG GLN 41 HG1 GLN 41 97.842 -8.118 4.228
328 1HE2 GLN 41 HE21 GLN 41 99.182 -6.552 2.274
329 2HE2 GLN 41 HE22 GLN 41 100.656 -7.360 1.877
330 H SER 42 HN SER 42 95.040 -4.568 4.943
331 HA SER 42 HA SER 42 95.584 -2.084 4.125
332 1HB SER 42 HB2 SER 42 93.326 -3.360 5.233
333 2HB SER 42 HB1 SER 42 93.463 -1.799 6.038
334 HG SER 42 HG SER 42 93.011 -2.390 3.343
335 H ALA 43 HN ALA 43 95.613 -3.016 7.545
336 HA ALA 43 HA ALA 43 96.074 -0.391 8.518
337 1HB ALA 43 HB1 ALA 43 95.331 -1.614 10.251
338 2HB ALA 43 HB2 ALA 43 97.046 -1.946 10.498
339 3HB ALA 43 HB3 ALA 43 96.038 -3.109 9.638
340 H ASN 44 HN ASN 44 98.250 -3.115 7.856
341 HA ASN 44 HA ASN 44 100.611 -1.836 8.727
342 1HB ASN 44 HB2 ASN 44 100.305 -4.308 8.405
343 2HB ASN 44 HB1 ASN 44 100.403 -4.037 6.668
344 1HD2 ASN 44 HD21 ASN 44 102.363 -3.431 5.752
345 2HD2 ASN 44 HD22 ASN 44 103.863 -3.616 6.589
346 H LEU 45 HN LEU 45 99.040 -2.006 5.558
347 HA LEU 45 HA LEU 45 101.210 -0.747 4.182
348 1HB LEU 45 HB2 LEU 45 98.362 -1.358 3.446
349 2HB LEU 45 HB1 LEU 45 99.402 -0.442 2.379
350 HG LEU 45 HG LEU 45 99.325 -2.774 1.708
351 1HD1 LEU 45 HD11 LEU 45 101.809 -3.301 1.934
352 2HD1 LEU 45 HD12 LEU 45 101.930 -1.777 2.809
353 3HD1 LEU 45 HD13 LEU 45 101.366 -1.792 1.139
354 1HD2 LEU 45 HD21 LEU 45 98.820 -3.718 3.900
355 2HD2 LEU 45 HD22 LEU 45 100.468 -3.374 4.426
356 3HD2 LEU 45 HD23 LEU 45 100.179 -4.535 3.129
357 H LEU 46 HN LEU 46 97.961 0.382 5.118
358 HA LEU 46 HA LEU 46 98.222 3.004 4.225
359 1HB LEU 46 HB2 LEU 46 96.251 1.560 5.407
360 2HB LEU 46 HB1 LEU 46 96.682 2.649 6.710
361 HG LEU 46 HG LEU 46 96.003 3.630 3.945
362 1HD1 LEU 46 HD11 LEU 46 93.756 3.920 4.579
363 2HD1 LEU 46 HD12 LEU 46 94.096 3.526 6.264
364 3HD1 LEU 46 HD13 LEU 46 94.163 2.265 5.033
365 1HD2 LEU 46 HD21 LEU 46 97.120 5.306 5.148
366 2HD2 LEU 46 HD22 LEU 46 96.295 4.897 6.652
367 3HD2 LEU 46 HD23 LEU 46 95.407 5.678 5.344
368 H ALA 47 HN ALA 47 98.932 1.674 7.465
369 HA ALA 47 HA ALA 47 99.726 4.156 8.571
370 1HB ALA 47 HB1 ALA 47 100.874 1.676 9.692
371 2HB ALA 47 HB2 ALA 47 99.115 1.780 9.636
372 3HB ALA 47 HB3 ALA 47 100.043 3.009 10.494
373 H GLU 48 HN GLU 48 101.504 1.540 6.997
374 HA GLU 48 HA GLU 48 104.098 2.425 7.593
375 1HB GLU 48 HB2 GLU 48 102.903 0.662 5.503
376 2HB GLU 48 HB1 GLU 48 104.566 1.193 5.297
377 1HG GLU 48 HG2 GLU 48 103.588 -0.127 7.809
378 2HG GLU 48 HG1 GLU 48 104.221 -1.032 6.435
379 H ALA 49 HN ALA 49 102.097 3.014 4.703
380 HA ALA 49 HA ALA 49 103.992 4.760 3.493
381 1HB ALA 49 HB1 ALA 49 101.954 3.418 2.486
382 2HB ALA 49 HB2 ALA 49 102.531 4.912 1.746
383 3HB ALA 49 HB3 ALA 49 101.110 4.936 2.791
384 H LYS 50 HN LYS 50 101.313 5.195 5.691
385 HA LYS 50 HA LYS 50 100.951 7.966 5.376
386 1HB LYS 50 HB2 LYS 50 100.288 5.968 7.491
387 2HB LYS 50 HB1 LYS 50 100.172 7.675 7.897
388 1HG LYS 50 HG2 LYS 50 98.899 7.199 5.378
389 2HG LYS 50 HG1 LYS 50 98.274 6.076 6.586
390 1HD LYS 50 HD2 LYS 50 98.525 8.727 7.691
391 2HD LYS 50 HD1 LYS 50 97.555 8.755 6.218
392 1HE LYS 50 HE2 LYS 50 96.270 8.380 8.348
393 2HE LYS 50 HE1 LYS 50 96.023 7.169 7.091
394 1HZ LYS 50 HZ1 LYS 50 98.035 6.763 9.212
395 2HZ LYS 50 HZ2 LYS 50 97.273 5.608 8.240
396 3HZ LYS 50 HZ3 LYS 50 96.409 6.377 9.474
397 H LYS 51 HN LYS 51 102.873 6.160 7.785
398 HA LYS 51 HA LYS 51 103.967 8.519 8.942
399 1HB LYS 51 HB2 LYS 51 105.597 6.892 10.001
400 2HB LYS 51 HB1 LYS 51 103.895 6.616 10.340
401 1HG LYS 51 HG2 LYS 51 104.005 4.563 9.526
402 2HG LYS 51 HG1 LYS 51 104.674 5.149 8.003
403 1HD LYS 51 HD2 LYS 51 106.591 5.172 10.209
404 2HD LYS 51 HD1 LYS 51 105.980 3.562 9.823
405 1HE LYS 51 HE2 LYS 51 106.902 5.375 7.633
406 2HE LYS 51 HE1 LYS 51 108.084 4.487 8.594
407 1HZ LYS 51 HZ1 LYS 51 106.988 2.427 7.982
408 2HZ LYS 51 HZ2 LYS 51 107.459 3.276 6.597
409 3HZ LYS 51 HZ3 LYS 51 105.837 3.274 7.075
410 H LEU 52 HN LEU 52 105.034 6.291 6.432
411 HA LEU 52 HA LEU 52 107.685 7.095 6.181
412 1HB LEU 52 HB2 LEU 52 106.479 5.190 4.996
413 2HB LEU 52 HB1 LEU 52 105.911 6.389 3.850
414 HG LEU 52 HG LEU 52 108.275 6.924 3.294
415 1HD1 LEU 52 HD11 LEU 52 109.782 4.837 4.042
416 2HD1 LEU 52 HD12 LEU 52 108.737 4.969 5.457
417 3HD1 LEU 52 HD13 LEU 52 109.707 6.350 4.945
418 1HD2 LEU 52 HD21 LEU 52 107.308 5.509 1.744
419 2HD2 LEU 52 HD22 LEU 52 107.132 4.191 2.902
420 3HD2 LEU 52 HD23 LEU 52 108.723 4.588 2.254
421 H ASN 53 HN ASN 53 104.865 8.308 4.381
422 HA ASN 53 HA ASN 53 106.081 10.277 2.885
423 1HB ASN 53 HB2 ASN 53 103.809 9.851 2.429
424 2HB ASN 53 HB1 ASN 53 103.323 10.121 4.093
425 1HD2 ASN 53 HD21 ASN 53 101.708 11.500 3.105
426 2HD2 ASN 53 HD22 ASN 53 102.118 13.130 2.702
427 H ASP 54 HN ASP 54 105.033 10.507 6.301
428 HA ASP 54 HA ASP 54 105.729 13.266 6.531
429 1HB ASP 54 HB2 ASP 54 104.974 11.084 8.453
430 2HB ASP 54 HB1 ASP 54 105.629 12.604 9.055
431 H ALA 55 HN ALA 55 107.353 10.264 6.713
432 HA ALA 55 HA ALA 55 109.618 11.161 8.244
433 1HB ALA 55 HB1 ALA 55 109.345 8.705 6.517
434 2HB ALA 55 HB2 ALA 55 108.914 8.804 8.224
435 3HB ALA 55 HB3 ALA 55 110.594 9.006 7.725
436 H GLN 56 HN GLN 56 109.014 10.507 4.788
437 HA GLN 56 HA GLN 56 111.583 11.777 4.180
438 1HB GLN 56 HB2 GLN 56 111.230 10.771 1.878
439 2HB GLN 56 HB1 GLN 56 111.539 9.654 3.196
440 1HG GLN 56 HG2 GLN 56 109.829 8.555 2.222
441 2HG GLN 56 HG1 GLN 56 108.883 9.611 3.263
442 1HE2 GLN 56 HE21 GLN 56 108.023 11.556 2.336
443 2HE2 GLN 56 HE22 GLN 56 107.629 11.607 0.658
444 H ALA 57 HN ALA 57 108.648 12.989 4.556
445 HA ALA 57 HA ALA 57 108.915 14.730 2.186
446 1HB ALA 57 HB1 ALA 57 106.830 13.274 2.263
447 2HB ALA 57 HB2 ALA 57 106.602 15.005 2.005
448 3HB ALA 57 HB3 ALA 57 106.301 14.307 3.592
449 HA PRO 58 HA PRO 58 109.589 17.907 5.238
450 1HB PRO 58 HB2 PRO 58 109.595 20.031 3.558
451 2HB PRO 58 HB1 PRO 58 110.954 18.906 3.670
452 1HG PRO 58 HG2 PRO 58 108.747 19.012 1.648
453 2HG PRO 58 HG1 PRO 58 110.485 18.761 1.395
454 1HD PRO 58 HD2 PRO 58 108.700 16.721 1.413
455 2HD PRO 58 HD1 PRO 58 110.375 16.532 1.971
456 H LYS 59 HN LYS 59 108.406 19.584 6.243
457 HA LYS 59 HA LYS 59 105.755 20.174 5.159
458 1HB LYS 59 HB2 LYS 59 106.255 19.115 7.946
459 2HB LYS 59 HB1 LYS 59 104.719 19.755 7.376
460 1HG LYS 59 HG2 LYS 59 104.374 17.956 5.925
461 2HG LYS 59 HG1 LYS 59 106.067 17.464 5.991
462 1HD LYS 59 HD2 LYS 59 104.392 17.448 8.471
463 2HD LYS 59 HD1 LYS 59 104.289 16.115 7.320
464 1HE LYS 59 HE2 LYS 59 106.717 15.785 7.509
465 2HE LYS 59 HE1 LYS 59 106.793 17.093 8.690
466 1HZ LYS 59 HZ1 LYS 59 104.883 15.009 9.304
467 2HZ LYS 59 HZ2 LYS 59 106.003 15.782 10.308
468 3HZ LYS 59 HZ3 LYS 59 106.499 14.506 9.315
469 H ALA 60 HN ALA 60 107.584 22.019 4.935
470 HA ALA 60 HA ALA 60 107.092 23.879 7.170
471 1HB ALA 60 HB1 ALA 60 109.388 23.403 7.307
472 2HB ALA 60 HB2 ALA 60 109.295 24.946 6.457
473 3HB ALA 60 HB3 ALA 60 109.591 23.460 5.556
Start of MODEL 6
1 1H GLY -1 HT1 GLY -1 89.597 -12.784 -15.319
2 2H GLY -1 HT2 GLY -1 88.402 -13.322 -14.251
3 3H GLY -1 HT3 GLY -1 89.530 -12.169 -13.744
4 1HA GLY -1 HA1 GLY -1 87.957 -11.470 -16.087
5 2HA GLY -1 HA2 GLY -1 87.082 -11.548 -14.565
6 H SER 0 HN SER 0 86.882 -9.621 -13.656
7 HA SER 0 HA SER 0 88.393 -7.362 -14.388
8 1HB SER 0 HB2 SER 0 86.090 -7.857 -12.870
9 2HB SER 0 HB1 SER 0 87.217 -7.093 -11.750
10 HG SER 0 HG SER 0 87.515 -5.514 -13.551
11 H THR 1 HN THR 1 89.091 -6.055 -12.057
12 HA THR 1 HA THR 1 91.626 -7.259 -11.506
13 HB THR 1 HB THR 1 91.819 -5.264 -9.910
14 HG1 THR 1 HG1 THR 1 90.140 -4.051 -9.656
15 1HG2 THR 1 HG21 THR 1 91.587 -3.599 -11.961
16 2HG2 THR 1 HG22 THR 1 91.552 -5.123 -12.849
17 3HG2 THR 1 HG23 THR 1 92.924 -4.740 -11.809
18 H ALA 2 HN ALA 2 89.351 -5.955 -9.111
19 HA ALA 2 HA ALA 2 88.475 -8.038 -7.697
20 1HB ALA 2 HB1 ALA 2 90.362 -8.246 -5.882
21 2HB ALA 2 HB2 ALA 2 91.406 -7.775 -7.223
22 3HB ALA 2 HB3 ALA 2 90.409 -9.223 -7.349
23 H ASP 3 HN ASP 3 87.090 -6.196 -7.339
24 HA ASP 3 HA ASP 3 87.993 -4.027 -5.691
25 1HB ASP 3 HB2 ASP 3 85.564 -3.394 -5.670
26 2HB ASP 3 HB1 ASP 3 86.255 -3.566 -7.281
27 H ASN 4 HN ASN 4 88.773 -5.922 -4.189
28 HA ASN 4 HA ASN 4 87.350 -7.459 -2.538
29 1HB ASN 4 HB2 ASN 4 89.892 -6.202 -2.404
30 2HB ASN 4 HB1 ASN 4 89.146 -6.066 -0.815
31 1HD2 ASN 4 HD21 ASN 4 91.233 -7.848 -2.399
32 2HD2 ASN 4 HD22 ASN 4 90.924 -9.412 -1.734
33 H LYS 5 HN LYS 5 87.158 -6.989 -0.014
34 HA LYS 5 HA LYS 5 84.854 -5.358 0.254
35 1HB LYS 5 HB2 LYS 5 85.362 -7.482 1.512
36 2HB LYS 5 HB1 LYS 5 86.486 -6.549 2.490
37 1HG LYS 5 HG2 LYS 5 84.844 -5.526 3.648
38 2HG LYS 5 HG1 LYS 5 83.753 -5.466 2.263
39 1HD LYS 5 HD2 LYS 5 84.142 -8.194 2.969
40 2HD LYS 5 HD1 LYS 5 83.760 -7.295 4.439
41 1HE LYS 5 HE2 LYS 5 81.767 -8.204 3.248
42 2HE LYS 5 HE1 LYS 5 81.737 -6.456 3.481
43 1HZ LYS 5 HZ1 LYS 5 81.711 -6.113 1.297
44 2HZ LYS 5 HZ2 LYS 5 81.359 -7.758 1.123
45 3HZ LYS 5 HZ3 LYS 5 82.957 -7.220 1.004
46 H PHE 6 HN PHE 6 87.727 -4.106 -0.190
47 HA PHE 6 HA PHE 6 88.571 -2.574 1.884
48 1HB PHE 6 HB2 PHE 6 88.447 -2.093 -1.056
49 2HB PHE 6 HB1 PHE 6 88.890 -0.742 -0.017
50 HD1 PHE 6 HD1 PHE 6 89.787 -4.246 -0.836
51 HD2 PHE 6 HD2 PHE 6 91.065 -0.524 0.778
52 HE1 PHE 6 HE1 PHE 6 92.095 -5.092 -0.728
53 HE2 PHE 6 HE2 PHE 6 93.374 -1.360 0.888
54 HZ PHE 6 HZ PHE 6 93.894 -3.650 0.135
55 H ASN 7 HN ASN 7 86.611 -2.247 3.141
56 HA ASN 7 HA ASN 7 84.408 -0.756 2.464
57 1HB ASN 7 HB2 ASN 7 85.765 -0.625 5.159
58 2HB ASN 7 HB1 ASN 7 84.055 -0.391 4.812
59 1HD2 ASN 7 HD21 ASN 7 83.282 -2.400 3.344
60 2HD2 ASN 7 HD22 ASN 7 83.581 -3.925 4.098
61 H LYS 8 HN LYS 8 83.912 1.418 3.660
62 HA LYS 8 HA LYS 8 85.089 3.474 2.244
63 1HB LYS 8 HB2 LYS 8 82.932 3.687 3.369
64 2HB LYS 8 HB1 LYS 8 83.722 3.616 4.936
65 1HG LYS 8 HG2 LYS 8 85.032 5.699 3.952
66 2HG LYS 8 HG1 LYS 8 83.560 5.842 2.988
67 1HD LYS 8 HD2 LYS 8 82.253 5.723 5.119
68 2HD LYS 8 HD1 LYS 8 83.783 5.805 5.995
69 1HE LYS 8 HE2 LYS 8 82.793 8.007 5.870
70 2HE LYS 8 HE1 LYS 8 84.265 7.958 4.901
71 1HZ LYS 8 HZ1 LYS 8 81.541 7.616 3.776
72 2HZ LYS 8 HZ2 LYS 8 82.985 7.808 2.917
73 3HZ LYS 8 HZ3 LYS 8 82.361 9.095 3.819
74 H GLU 9 HN GLU 9 85.980 2.191 5.399
75 HA GLU 9 HA GLU 9 87.926 4.236 5.920
76 1HB GLU 9 HB2 GLU 9 88.563 2.832 7.838
77 2HB GLU 9 HB1 GLU 9 86.827 3.098 7.771
78 1HG GLU 9 HG2 GLU 9 86.686 0.848 6.598
79 2HG GLU 9 HG1 GLU 9 88.357 0.607 7.104
80 H GLN 10 HN GLN 10 87.931 1.022 4.525
81 HA GLN 10 HA GLN 10 90.792 0.786 4.482
82 1HB GLN 10 HB2 GLN 10 88.899 -1.053 4.489
83 2HB GLN 10 HB1 GLN 10 89.017 -0.869 2.745
84 1HG GLN 10 HG2 GLN 10 90.755 -2.223 2.726
85 2HG GLN 10 HG1 GLN 10 91.647 -1.092 3.740
86 1HE2 GLN 10 HE21 GLN 10 92.123 -3.778 3.877
87 2HE2 GLN 10 HE22 GLN 10 91.588 -4.388 5.395
88 H GLN 11 HN GLN 11 88.301 1.276 1.983
89 HA GLN 11 HA GLN 11 89.971 1.418 -0.223
90 1HB GLN 11 HB2 GLN 11 87.518 1.274 -0.350
91 2HB GLN 11 HB1 GLN 11 87.395 2.936 0.211
92 1HG GLN 11 HG2 GLN 11 88.433 3.756 -1.774
93 2HG GLN 11 HG1 GLN 11 88.823 2.121 -2.306
94 1HE2 GLN 11 HE21 GLN 11 87.621 1.612 -3.981
95 2HE2 GLN 11 HE22 GLN 11 85.935 1.936 -4.166
96 H ASN 12 HN ASN 12 89.139 3.959 2.088
97 HA ASN 12 HA ASN 12 90.038 6.189 0.709
98 1HB ASN 12 HB2 ASN 12 89.042 5.816 3.178
99 2HB ASN 12 HB1 ASN 12 90.740 6.030 3.593
100 1HD2 ASN 12 HD21 ASN 12 88.206 7.496 1.596
101 2HD2 ASN 12 HD22 ASN 12 88.666 9.132 1.909
102 H ALA 13 HN ALA 13 91.825 3.651 2.273
103 HA ALA 13 HA ALA 13 94.326 4.810 2.546
104 1HB ALA 13 HB1 ALA 13 93.982 1.965 1.665
105 2HB ALA 13 HB2 ALA 13 93.508 2.494 3.279
106 3HB ALA 13 HB3 ALA 13 95.185 2.652 2.757
107 H PHE 14 HN PHE 14 92.893 3.227 -0.331
108 HA PHE 14 HA PHE 14 95.105 3.179 -1.957
109 1HB PHE 14 HB2 PHE 14 92.881 2.197 -2.445
110 2HB PHE 14 HB1 PHE 14 92.277 3.804 -2.804
111 HD1 PHE 14 HD1 PHE 14 93.864 0.910 -4.125
112 HD2 PHE 14 HD2 PHE 14 93.442 5.110 -4.666
113 HE1 PHE 14 HE1 PHE 14 94.596 0.680 -6.463
114 HE2 PHE 14 HE2 PHE 14 94.173 4.888 -7.004
115 HZ PHE 14 HZ PHE 14 94.751 2.670 -7.906
116 H TRP 15 HN TRP 15 92.649 5.773 -1.919
117 HA TRP 15 HA TRP 15 93.990 7.440 -3.734
118 1HB TRP 15 HB2 TRP 15 91.766 7.729 -1.847
119 2HB TRP 15 HB1 TRP 15 92.637 9.225 -2.167
120 HD1 TRP 15 HD1 TRP 15 91.820 6.427 -4.714
121 HE1 TRP 15 HE1 TRP 15 90.460 7.474 -6.630
122 HE3 TRP 15 HE3 TRP 15 91.322 11.155 -2.851
123 HZ2 TRP 15 HZ2 TRP 15 89.321 9.982 -7.267
124 HZ3 TRP 15 HZ3 TRP 15 90.082 12.822 -4.174
125 HH2 TRP 15 HH2 TRP 15 89.104 12.246 -6.336
126 H GLU 16 HN GLU 16 93.925 7.609 -0.199
127 HA GLU 16 HA GLU 16 95.755 9.717 0.118
128 1HB GLU 16 HB2 GLU 16 94.786 7.499 1.873
129 2HB GLU 16 HB1 GLU 16 96.157 8.464 2.405
130 1HG GLU 16 HG2 GLU 16 93.744 9.903 1.460
131 2HG GLU 16 HG1 GLU 16 93.661 9.085 3.020
132 H ILE 17 HN ILE 17 96.165 6.494 -0.712
133 HA ILE 17 HA ILE 17 98.989 6.257 -0.012
134 HB ILE 17 HB ILE 17 97.042 4.393 -1.325
135 1HG1 ILE 17 HG12 ILE 17 99.058 3.818 0.836
136 2HG1 ILE 17 HG11 ILE 17 97.523 4.597 1.203
137 1HG2 ILE 17 HG21 ILE 17 98.941 4.217 -2.785
138 2HG2 ILE 17 HG22 ILE 17 98.924 2.807 -1.727
139 3HG2 ILE 17 HG23 ILE 17 100.045 4.131 -1.414
140 1HD1 ILE 17 HD11 ILE 17 96.643 2.580 1.394
141 2HD1 ILE 17 HD12 ILE 17 98.113 1.823 0.780
142 3HD1 ILE 17 HD13 ILE 17 96.869 2.372 -0.343
143 H LEU 18 HN LEU 18 97.023 6.433 -2.936
144 HA LEU 18 HA LEU 18 99.159 6.607 -4.774
145 1HB LEU 18 HB2 LEU 18 96.208 7.100 -4.841
146 2HB LEU 18 HB1 LEU 18 97.185 7.703 -6.169
147 HG LEU 18 HG LEU 18 96.148 5.504 -6.628
148 1HD1 LEU 18 HD11 LEU 18 98.071 4.514 -7.624
149 2HD1 LEU 18 HD12 LEU 18 99.149 5.331 -6.492
150 3HD1 LEU 18 HD13 LEU 18 98.265 6.265 -7.700
151 1HD2 LEU 18 HD21 LEU 18 97.822 4.688 -4.276
152 2HD2 LEU 18 HD22 LEU 18 97.305 3.532 -5.501
153 3HD2 LEU 18 HD23 LEU 18 96.105 4.410 -4.560
154 H HIS 19 HN HIS 19 97.257 8.978 -3.026
155 HA HIS 19 HA HIS 19 98.197 11.228 -4.457
156 1HB HIS 19 HB2 HIS 19 96.204 10.884 -2.687
157 2HB HIS 19 HB1 HIS 19 97.425 11.554 -1.608
158 HD1 HIS 19 HD1 HIS 19 98.614 13.485 -3.900
159 HD2 HIS 19 HD2 HIS 19 94.659 13.205 -2.653
160 HE1 HIS 19 HE1 HIS 19 97.558 15.683 -4.515
161 HE2 HIS 19 HE2 HIS 19 95.140 15.449 -3.847
162 H LEU 20 HN LEU 20 98.973 10.111 -1.153
163 HA LEU 20 HA LEU 20 100.708 11.131 0.136
164 1HB LEU 20 HB2 LEU 20 101.521 8.836 -1.554
165 2HB LEU 20 HB1 LEU 20 102.719 9.584 -0.525
166 HG LEU 20 HG LEU 20 100.128 8.327 0.359
167 1HD1 LEU 20 HD11 LEU 20 101.815 6.704 -0.229
168 2HD1 LEU 20 HD12 LEU 20 101.583 6.743 1.520
169 3HD1 LEU 20 HD13 LEU 20 102.989 7.525 0.800
170 1HD2 LEU 20 HD21 LEU 20 100.231 9.596 2.174
171 2HD2 LEU 20 HD22 LEU 20 101.735 10.334 1.624
172 3HD2 LEU 20 HD23 LEU 20 101.777 8.844 2.565
173 HA PRO 21 HA PRO 21 102.221 14.009 -3.366
174 1HB PRO 21 HB2 PRO 21 101.836 15.751 -0.963
175 2HB PRO 21 HB1 PRO 21 101.559 16.114 -2.671
176 1HG PRO 21 HG2 PRO 21 99.519 15.555 -1.058
177 2HG PRO 21 HG1 PRO 21 99.550 14.964 -2.729
178 1HD PRO 21 HD2 PRO 21 99.984 13.484 -0.188
179 2HD PRO 21 HD1 PRO 21 99.313 12.920 -1.726
180 H ASN 22 HN ASN 22 104.228 12.970 -3.291
181 HA ASN 22 HA ASN 22 106.484 13.916 -2.948
182 1HB ASN 22 HB2 ASN 22 105.484 13.979 -0.124
183 2HB ASN 22 HB1 ASN 22 107.192 13.698 -0.419
184 1HD2 ASN 22 HD21 ASN 22 105.163 16.017 0.398
185 2HD2 ASN 22 HD22 ASN 22 105.916 17.390 -0.331
186 H LEU 23 HN LEU 23 105.095 11.562 -0.626
187 HA LEU 23 HA LEU 23 107.009 9.796 -0.302
188 1HB LEU 23 HB2 LEU 23 104.663 9.445 0.401
189 2HB LEU 23 HB1 LEU 23 104.291 8.919 -1.231
190 HG LEU 23 HG LEU 23 106.475 7.346 -0.393
191 1HD1 LEU 23 HD11 LEU 23 104.953 6.287 1.567
192 2HD1 LEU 23 HD12 LEU 23 104.649 8.008 1.812
193 3HD1 LEU 23 HD13 LEU 23 106.300 7.393 1.848
194 1HD2 LEU 23 HD21 LEU 23 105.014 6.327 -1.826
195 2HD2 LEU 23 HD22 LEU 23 103.598 6.948 -0.987
196 3HD2 LEU 23 HD23 LEU 23 104.510 5.611 -0.296
197 H ASN 24 HN ASN 24 108.066 8.125 -1.289
198 HA ASN 24 HA ASN 24 108.740 8.413 -3.993
199 1HB ASN 24 HB2 ASN 24 109.148 6.368 -1.925
200 2HB ASN 24 HB1 ASN 24 109.041 5.687 -3.546
201 1HD2 ASN 24 HD21 ASN 24 110.504 6.500 -5.160
202 2HD2 ASN 24 HD22 ASN 24 112.051 7.104 -4.686
203 H GLU 25 HN GLU 25 107.486 8.058 -5.839
204 HA GLU 25 HA GLU 25 104.861 7.111 -5.550
205 1HB GLU 25 HB2 GLU 25 104.732 7.308 -7.963
206 2HB GLU 25 HB1 GLU 25 105.572 8.701 -7.276
207 1HG GLU 25 HG2 GLU 25 107.233 6.411 -8.178
208 2HG GLU 25 HG1 GLU 25 106.454 7.387 -9.422
209 H GLU 26 HN GLU 26 107.878 5.571 -6.234
210 HA GLU 26 HA GLU 26 106.882 3.063 -7.157
211 1HB GLU 26 HB2 GLU 26 109.295 3.966 -7.308
212 2HB GLU 26 HB1 GLU 26 109.458 3.457 -5.633
213 1HG GLU 26 HG2 GLU 26 108.562 1.176 -6.587
214 2HG GLU 26 HG1 GLU 26 109.198 1.821 -8.099
215 H GLN 27 HN GLN 27 107.154 4.672 -4.229
216 HA GLN 27 HA GLN 27 106.856 2.385 -2.453
217 1HB GLN 27 HB2 GLN 27 107.433 5.199 -2.109
218 2HB GLN 27 HB1 GLN 27 106.108 4.715 -1.064
219 1HG GLN 27 HG2 GLN 27 108.259 4.530 0.057
220 2HG GLN 27 HG1 GLN 27 107.468 2.962 -0.101
221 1HE2 GLN 27 HE21 GLN 27 108.546 1.352 -1.033
222 2HE2 GLN 27 HE22 GLN 27 110.061 1.504 -1.850
223 H ARG 28 HN ARG 28 104.955 4.951 -3.907
224 HA ARG 28 HA ARG 28 102.493 4.418 -2.644
225 1HB ARG 28 HB2 ARG 28 103.155 5.679 -5.312
226 2HB ARG 28 HB1 ARG 28 101.516 5.580 -4.680
227 1HG ARG 28 HG2 ARG 28 102.738 6.697 -2.581
228 2HG ARG 28 HG1 ARG 28 103.761 7.315 -3.874
229 1HD ARG 28 HD2 ARG 28 100.807 7.500 -4.177
230 2HD ARG 28 HD1 ARG 28 101.592 8.592 -3.069
231 HE ARG 28 HE ARG 28 101.650 8.725 -5.897
232 1HH1 ARG 28 HH11 ARG 28 103.521 9.416 -3.040
233 2HH1 ARG 28 HH12 ARG 28 104.441 10.674 -3.794
234 1HH2 ARG 28 HH21 ARG 28 102.847 10.391 -6.891
235 2HH2 ARG 28 HH22 ARG 28 104.058 11.229 -5.979
236 H ASN 29 HN ASN 29 103.588 3.528 -5.937
237 HA ASN 29 HA ASN 29 101.485 1.862 -6.603
238 1HB ASN 29 HB2 ASN 29 103.610 2.681 -7.949
239 2HB ASN 29 HB1 ASN 29 104.251 1.117 -7.451
240 1HD2 ASN 29 HD21 ASN 29 104.126 -0.196 -9.120
241 2HD2 ASN 29 HD22 ASN 29 102.748 -0.417 -10.137
242 H GLY 30 HN GLY 30 104.583 1.018 -5.037
243 1HA GLY 30 HA2 GLY 30 104.131 -1.728 -4.762
244 2HA GLY 30 HA1 GLY 30 105.138 -0.763 -3.688
245 H PHE 31 HN PHE 31 102.964 0.983 -2.884
246 HA PHE 31 HA PHE 31 101.972 -0.540 -0.695
247 1HB PHE 31 HB2 PHE 31 101.761 2.269 -1.647
248 2HB PHE 31 HB1 PHE 31 100.478 1.703 -0.581
249 HD1 PHE 31 HD1 PHE 31 101.838 -0.022 1.258
250 HD2 PHE 31 HD2 PHE 31 103.149 3.667 -0.386
251 HE1 PHE 31 HE1 PHE 31 103.265 0.306 3.214
252 HE2 PHE 31 HE2 PHE 31 104.596 4.020 1.569
253 HZ PHE 31 HZ PHE 31 104.663 2.346 3.373
254 H ILE 32 HN ILE 32 100.631 0.570 -3.737
255 HA ILE 32 HA ILE 32 97.928 -0.128 -3.242
256 HB ILE 32 HB ILE 32 98.913 -0.342 -6.037
257 1HG1 ILE 32 HG12 ILE 32 98.792 2.311 -4.582
258 2HG1 ILE 32 HG11 ILE 32 100.258 1.526 -5.158
259 1HG2 ILE 32 HG21 ILE 32 96.471 -0.245 -4.915
260 2HG2 ILE 32 HG22 ILE 32 96.816 0.263 -6.568
261 3HG2 ILE 32 HG23 ILE 32 96.717 1.463 -5.279
262 1HD1 ILE 32 HD11 ILE 32 97.997 2.400 -6.930
263 2HD1 ILE 32 HD12 ILE 32 99.561 1.762 -7.436
264 3HD1 ILE 32 HD13 ILE 32 99.466 3.329 -6.634
265 H GLN 33 HN GLN 33 100.613 -1.907 -4.698
266 HA GLN 33 HA GLN 33 99.055 -4.157 -5.469
267 1HB GLN 33 HB2 GLN 33 102.035 -4.014 -4.983
268 2HB GLN 33 HB1 GLN 33 101.187 -5.256 -5.893
269 1HG GLN 33 HG2 GLN 33 100.750 -3.836 -7.673
270 2HG GLN 33 HG1 GLN 33 101.000 -2.385 -6.703
271 1HE2 GLN 33 HE21 GLN 33 102.192 -3.336 -9.263
272 2HE2 GLN 33 HE22 GLN 33 103.900 -3.263 -9.013
273 H SER 34 HN SER 34 101.269 -3.606 -2.726
274 HA SER 34 HA SER 34 100.920 -6.129 -1.543
275 1HB SER 34 HB2 SER 34 102.264 -3.667 -0.916
276 2HB SER 34 HB1 SER 34 101.422 -4.248 0.521
277 HG SER 34 HG SER 34 102.447 -6.351 -0.049
278 H LEU 35 HN LEU 35 99.171 -3.098 -1.199
279 HA LEU 35 HA LEU 35 97.511 -3.977 0.947
280 1HB LEU 35 HB2 LEU 35 97.866 -1.632 0.658
281 2HB LEU 35 HB1 LEU 35 97.298 -1.688 -1.000
282 HG LEU 35 HG LEU 35 95.030 -2.089 -0.272
283 1HD1 LEU 35 HD11 LEU 35 96.334 -2.465 2.378
284 2HD1 LEU 35 HD12 LEU 35 95.070 -3.415 1.598
285 3HD1 LEU 35 HD13 LEU 35 94.683 -1.848 2.311
286 1HD2 LEU 35 HD21 LEU 35 95.048 0.151 -0.282
287 2HD2 LEU 35 HD22 LEU 35 96.563 0.235 0.619
288 3HD2 LEU 35 HD23 LEU 35 95.039 0.011 1.477
289 H LYS 36 HN LYS 36 96.816 -3.443 -2.534
290 HA LYS 36 HA LYS 36 94.197 -4.331 -2.478
291 1HB LYS 36 HB2 LYS 36 94.317 -4.627 -4.853
292 2HB LYS 36 HB1 LYS 36 95.292 -3.230 -4.426
293 1HG LYS 36 HG2 LYS 36 97.301 -4.737 -4.523
294 2HG LYS 36 HG1 LYS 36 96.242 -5.971 -5.209
295 1HD LYS 36 HD2 LYS 36 95.676 -3.756 -6.738
296 2HD LYS 36 HD1 LYS 36 97.410 -3.602 -6.447
297 1HE LYS 36 HE2 LYS 36 97.040 -4.859 -8.475
298 2HE LYS 36 HE1 LYS 36 97.720 -5.915 -7.239
299 1HZ LYS 36 HZ1 LYS 36 96.042 -7.250 -7.852
300 2HZ LYS 36 HZ2 LYS 36 95.120 -5.996 -8.513
301 3HZ LYS 36 HZ3 LYS 36 95.102 -6.268 -6.844
302 H ASP 37 HN ASP 37 97.018 -6.383 -3.462
303 HA ASP 37 HA ASP 37 95.553 -8.735 -3.575
304 1HB ASP 37 HB2 ASP 37 98.455 -8.102 -3.240
305 2HB ASP 37 HB1 ASP 37 97.915 -9.769 -3.067
306 H ASP 38 HN ASP 38 96.570 -6.974 -0.811
307 HA ASP 38 HA ASP 38 95.633 -9.179 0.880
308 1HB ASP 38 HB2 ASP 38 98.305 -8.468 0.709
309 2HB ASP 38 HB1 ASP 38 97.747 -7.626 2.152
310 HA PRO 39 HA PRO 39 93.300 -5.471 2.128
311 1HB PRO 39 HB2 PRO 39 91.234 -6.840 3.230
312 2HB PRO 39 HB1 PRO 39 91.365 -6.534 1.495
313 1HG PRO 39 HG2 PRO 39 92.045 -9.004 3.041
314 2HG PRO 39 HG1 PRO 39 91.220 -8.852 1.479
315 1HD PRO 39 HD2 PRO 39 93.845 -9.510 1.701
316 2HD PRO 39 HD1 PRO 39 93.193 -8.606 0.319
317 H SER 40 HN SER 40 93.994 -8.367 4.037
318 HA SER 40 HA SER 40 93.504 -7.239 6.576
319 1HB SER 40 HB2 SER 40 93.752 -9.701 6.047
320 2HB SER 40 HB1 SER 40 95.493 -9.432 5.960
321 HG SER 40 HG SER 40 93.898 -8.800 8.218
322 H GLN 41 HN GLN 41 96.024 -6.773 4.325
323 HA GLN 41 HA GLN 41 98.025 -5.973 6.241
324 1HB GLN 41 HB2 GLN 41 97.857 -5.959 3.237
325 2HB GLN 41 HB1 GLN 41 99.189 -5.188 4.087
326 1HG GLN 41 HG2 GLN 41 99.415 -7.488 5.275
327 2HG GLN 41 HG1 GLN 41 98.500 -8.079 3.890
328 1HE2 GLN 41 HE21 GLN 41 99.459 -6.674 1.821
329 2HE2 GLN 41 HE22 GLN 41 101.145 -6.974 1.597
330 H SER 42 HN SER 42 95.314 -4.513 4.889
331 HA SER 42 HA SER 42 95.792 -1.984 4.189
332 1HB SER 42 HB2 SER 42 93.726 -1.368 5.641
333 2HB SER 42 HB1 SER 42 93.539 -2.546 4.343
334 HG SER 42 HG SER 42 93.596 -4.187 5.847
335 H ALA 43 HN ALA 43 96.216 -3.187 7.482
336 HA ALA 43 HA ALA 43 96.563 -0.617 8.663
337 1HB ALA 43 HB1 ALA 43 97.502 -1.908 10.578
338 2HB ALA 43 HB2 ALA 43 97.339 -3.371 9.606
339 3HB ALA 43 HB3 ALA 43 95.906 -2.447 10.057
340 H ASN 44 HN ASN 44 98.835 -3.158 7.680
341 HA ASN 44 HA ASN 44 101.184 -1.700 8.309
342 1HB ASN 44 HB2 ASN 44 100.986 -4.212 7.964
343 2HB ASN 44 HB1 ASN 44 100.964 -3.883 6.234
344 1HD2 ASN 44 HD21 ASN 44 102.823 -3.124 5.230
345 2HD2 ASN 44 HD22 ASN 44 104.377 -3.225 5.976
346 H LEU 45 HN LEU 45 99.138 -1.864 5.482
347 HA LEU 45 HA LEU 45 101.006 -0.497 3.786
348 1HB LEU 45 HB2 LEU 45 98.119 -1.277 3.518
349 2HB LEU 45 HB1 LEU 45 98.911 -0.283 2.312
350 HG LEU 45 HG LEU 45 98.755 -2.864 1.974
351 1HD1 LEU 45 HD11 LEU 45 100.400 -2.677 0.423
352 2HD1 LEU 45 HD12 LEU 45 101.512 -1.875 1.535
353 3HD1 LEU 45 HD13 LEU 45 100.180 -0.971 0.805
354 1HD2 LEU 45 HD21 LEU 45 101.303 -2.750 3.568
355 2HD2 LEU 45 HD22 LEU 45 100.506 -4.167 2.885
356 3HD2 LEU 45 HD23 LEU 45 99.774 -3.311 4.241
357 H LEU 46 HN LEU 46 97.880 0.414 5.230
358 HA LEU 46 HA LEU 46 97.943 3.090 4.399
359 1HB LEU 46 HB2 LEU 46 96.026 1.585 5.371
360 2HB LEU 46 HB1 LEU 46 96.514 2.307 6.893
361 HG LEU 46 HG LEU 46 95.689 3.893 4.460
362 1HD1 LEU 46 HD11 LEU 46 94.012 2.336 5.922
363 2HD1 LEU 46 HD12 LEU 46 93.541 3.821 5.095
364 3HD1 LEU 46 HD13 LEU 46 93.939 3.857 6.813
365 1HD2 LEU 46 HD21 LEU 46 96.790 5.469 5.635
366 2HD2 LEU 46 HD22 LEU 46 96.699 4.563 7.145
367 3HD2 LEU 46 HD23 LEU 46 95.309 5.496 6.592
368 H ALA 47 HN ALA 47 98.561 1.840 7.733
369 HA ALA 47 HA ALA 47 99.312 4.349 8.737
370 1HB ALA 47 HB1 ALA 47 99.537 1.548 9.676
371 2HB ALA 47 HB2 ALA 47 98.762 2.941 10.429
372 3HB ALA 47 HB3 ALA 47 100.516 2.772 10.482
373 H GLU 48 HN GLU 48 101.382 1.620 7.698
374 HA GLU 48 HA GLU 48 103.813 2.883 8.253
375 1HB GLU 48 HB2 GLU 48 104.420 0.786 7.788
376 2HB GLU 48 HB1 GLU 48 102.934 0.486 6.918
377 1HG GLU 48 HG2 GLU 48 104.678 0.040 5.425
378 2HG GLU 48 HG1 GLU 48 103.991 1.584 4.931
379 H ALA 49 HN ALA 49 101.785 2.962 5.348
380 HA ALA 49 HA ALA 49 103.643 4.474 3.796
381 1HB ALA 49 HB1 ALA 49 101.867 4.737 2.213
382 2HB ALA 49 HB2 ALA 49 100.651 4.344 3.429
383 3HB ALA 49 HB3 ALA 49 101.764 3.101 2.860
384 H LYS 50 HN LYS 50 100.971 5.232 5.937
385 HA LYS 50 HA LYS 50 100.873 8.015 5.403
386 1HB LYS 50 HB2 LYS 50 98.951 6.987 6.377
387 2HB LYS 50 HB1 LYS 50 99.893 6.333 7.709
388 1HG LYS 50 HG2 LYS 50 98.483 8.247 8.357
389 2HG LYS 50 HG1 LYS 50 100.203 8.528 8.639
390 1HD LYS 50 HD2 LYS 50 100.276 9.734 6.446
391 2HD LYS 50 HD1 LYS 50 98.518 9.593 6.377
392 1HE LYS 50 HE2 LYS 50 99.136 11.764 7.248
393 2HE LYS 50 HE1 LYS 50 98.360 10.809 8.511
394 1HZ LYS 50 HZ1 LYS 50 101.296 11.127 8.200
395 2HZ LYS 50 HZ2 LYS 50 100.499 10.326 9.458
396 3HZ LYS 50 HZ3 LYS 50 100.343 12.002 9.290
397 H LYS 51 HN LYS 51 102.807 6.022 7.535
398 HA LYS 51 HA LYS 51 103.783 8.240 9.092
399 1HB LYS 51 HB2 LYS 51 104.575 5.334 8.901
400 2HB LYS 51 HB1 LYS 51 105.431 6.485 9.918
401 1HG LYS 51 HG2 LYS 51 103.441 6.892 11.213
402 2HG LYS 51 HG1 LYS 51 102.495 5.859 10.140
403 1HD LYS 51 HD2 LYS 51 104.767 4.398 11.067
404 2HD LYS 51 HD1 LYS 51 103.949 5.122 12.453
405 1HE LYS 51 HE2 LYS 51 102.146 3.796 12.237
406 2HE LYS 51 HE1 LYS 51 102.158 3.901 10.477
407 1HZ LYS 51 HZ1 LYS 51 102.625 1.674 11.008
408 2HZ LYS 51 HZ2 LYS 51 103.748 2.093 12.201
409 3HZ LYS 51 HZ3 LYS 51 104.116 2.343 10.570
410 H LEU 52 HN LEU 52 105.065 6.099 6.572
411 HA LEU 52 HA LEU 52 107.625 7.126 6.354
412 1HB LEU 52 HB2 LEU 52 106.357 5.165 5.107
413 2HB LEU 52 HB1 LEU 52 106.148 6.389 3.870
414 HG LEU 52 HG LEU 52 108.893 6.363 4.702
415 1HD1 LEU 52 HD11 LEU 52 108.116 3.966 5.298
416 2HD1 LEU 52 HD12 LEU 52 109.592 4.187 4.358
417 3HD1 LEU 52 HD13 LEU 52 108.094 3.723 3.551
418 1HD2 LEU 52 HD21 LEU 52 108.253 7.228 2.588
419 2HD2 LEU 52 HD22 LEU 52 107.435 5.729 2.146
420 3HD2 LEU 52 HD23 LEU 52 109.193 5.769 2.275
421 H ASN 53 HN ASN 53 104.755 8.082 4.456
422 HA ASN 53 HA ASN 53 105.881 10.143 3.002
423 1HB ASN 53 HB2 ASN 53 103.693 9.584 2.387
424 2HB ASN 53 HB1 ASN 53 103.101 9.662 4.042
425 1HD2 ASN 53 HD21 ASN 53 103.746 11.403 1.148
426 2HD2 ASN 53 HD22 ASN 53 103.072 12.914 1.647
427 H ASP 54 HN ASP 54 104.913 10.082 6.367
428 HA ASP 54 HA ASP 54 105.113 12.919 6.731
429 1HB ASP 54 HB2 ASP 54 104.316 10.616 8.307
430 2HB ASP 54 HB1 ASP 54 105.352 11.696 9.234
431 H ALA 55 HN ALA 55 107.241 10.179 6.886
432 HA ALA 55 HA ALA 55 109.293 11.524 8.390
433 1HB ALA 55 HB1 ALA 55 109.399 9.270 8.762
434 2HB ALA 55 HB2 ALA 55 110.621 9.444 7.502
435 3HB ALA 55 HB3 ALA 55 109.007 8.862 7.092
436 H GLN 56 HN GLN 56 108.598 10.976 4.974
437 HA GLN 56 HA GLN 56 111.084 12.417 4.337
438 1HB GLN 56 HB2 GLN 56 110.611 11.424 1.958
439 2HB GLN 56 HB1 GLN 56 111.397 10.461 3.194
440 1HG GLN 56 HG2 GLN 56 109.900 8.902 2.697
441 2HG GLN 56 HG1 GLN 56 108.751 9.886 3.594
442 1HE2 GLN 56 HE21 GLN 56 107.746 11.663 2.283
443 2HE2 GLN 56 HE22 GLN 56 107.228 11.263 0.688
444 H ALA 57 HN ALA 57 107.890 13.003 4.653
445 HA ALA 57 HA ALA 57 108.035 15.233 2.752
446 1HB ALA 57 HB1 ALA 57 106.487 13.065 2.186
447 2HB ALA 57 HB2 ALA 57 106.181 14.699 1.602
448 3HB ALA 57 HB3 ALA 57 105.343 14.103 3.035
449 HA PRO 58 HA PRO 58 106.224 17.555 6.040
450 1HB PRO 58 HB2 PRO 58 104.504 19.257 4.908
451 2HB PRO 58 HB1 PRO 58 106.221 19.290 4.499
452 1HG PRO 58 HG2 PRO 58 103.946 18.072 2.981
453 2HG PRO 58 HG1 PRO 58 105.308 19.032 2.376
454 1HD PRO 58 HD2 PRO 58 105.189 16.278 2.313
455 2HD PRO 58 HD1 PRO 58 106.695 17.216 2.288
456 H LYS 59 HN LYS 59 103.102 18.159 4.793
457 HA LYS 59 HA LYS 59 101.054 17.715 5.696
458 1HB LYS 59 HB2 LYS 59 102.057 15.491 4.336
459 2HB LYS 59 HB1 LYS 59 101.354 14.836 5.808
460 1HG LYS 59 HG2 LYS 59 99.814 16.788 4.154
461 2HG LYS 59 HG1 LYS 59 99.891 15.088 3.688
462 1HD LYS 59 HD2 LYS 59 99.320 15.364 6.505
463 2HD LYS 59 HD1 LYS 59 98.151 16.260 5.534
464 1HE LYS 59 HE2 LYS 59 97.586 13.840 6.040
465 2HE LYS 59 HE1 LYS 59 97.500 14.333 4.350
466 1HZ LYS 59 HZ1 LYS 59 100.090 13.354 5.083
467 2HZ LYS 59 HZ2 LYS 59 99.090 12.899 3.797
468 3HZ LYS 59 HZ3 LYS 59 98.878 12.198 5.321
469 H ALA 60 HN ALA 60 100.995 18.447 7.769
470 HA ALA 60 HA ALA 60 101.984 16.696 9.902
471 1HB ALA 60 HB1 ALA 60 101.111 19.579 9.961
472 2HB ALA 60 HB2 ALA 60 102.762 18.966 10.041
473 3HB ALA 60 HB3 ALA 60 101.644 18.662 11.370
Start of MODEL 7
1 1H GLY -1 HT1 GLY -1 94.327 -13.631 -3.002
2 2H GLY -1 HT2 GLY -1 95.061 -15.071 -3.499
3 3H GLY -1 HT3 GLY -1 95.777 -14.132 -2.288
4 1HA GLY -1 HA1 GLY -1 93.260 -14.605 -1.339
5 2HA GLY -1 HA2 GLY -1 93.737 -16.124 -2.079
6 H SER 0 HN SER 0 94.315 -17.436 -0.467
7 HA SER 0 HA SER 0 95.493 -18.304 1.272
8 1HB SER 0 HB2 SER 0 97.328 -15.913 1.176
9 2HB SER 0 HB1 SER 0 97.698 -17.560 1.686
10 HG SER 0 HG SER 0 97.555 -16.472 -0.860
11 H THR 1 HN THR 1 95.979 -14.829 1.913
12 HA THR 1 HA THR 1 94.459 -15.192 4.411
13 HB THR 1 HB THR 1 95.870 -13.336 5.326
14 HG1 THR 1 HG1 THR 1 96.613 -12.395 3.452
15 1HG2 THR 1 HG21 THR 1 97.418 -14.738 6.124
16 2HG2 THR 1 HG22 THR 1 97.916 -15.272 4.518
17 3HG2 THR 1 HG23 THR 1 96.479 -15.963 5.272
18 H ALA 2 HN ALA 2 93.858 -14.150 1.533
19 HA ALA 2 HA ALA 2 92.855 -11.490 2.232
20 1HB ALA 2 HB1 ALA 2 94.227 -11.977 0.120
21 2HB ALA 2 HB2 ALA 2 92.762 -11.011 -0.053
22 3HB ALA 2 HB3 ALA 2 92.752 -12.716 -0.506
23 H ASP 3 HN ASP 3 90.828 -11.533 0.173
24 HA ASP 3 HA ASP 3 88.794 -12.687 -0.373
25 1HB ASP 3 HB2 ASP 3 88.886 -13.567 2.523
26 2HB ASP 3 HB1 ASP 3 87.495 -13.780 1.470
27 H ASN 4 HN ASN 4 89.456 -10.103 0.055
28 HA ASN 4 HA ASN 4 86.946 -8.952 0.828
29 1HB ASN 4 HB2 ASN 4 89.401 -8.131 2.403
30 2HB ASN 4 HB1 ASN 4 87.782 -7.463 2.561
31 1HD2 ASN 4 HD21 ASN 4 86.257 -8.540 3.733
32 2HD2 ASN 4 HD22 ASN 4 86.604 -9.937 4.688
33 H LYS 5 HN LYS 5 86.974 -6.537 0.432
34 HA LYS 5 HA LYS 5 89.031 -5.877 -1.543
35 1HB LYS 5 HB2 LYS 5 86.121 -5.034 -1.491
36 2HB LYS 5 HB1 LYS 5 87.313 -4.489 -2.664
37 1HG LYS 5 HG2 LYS 5 87.127 -6.344 -3.888
38 2HG LYS 5 HG1 LYS 5 87.135 -7.392 -2.469
39 1HD LYS 5 HD2 LYS 5 85.018 -7.728 -3.381
40 2HD LYS 5 HD1 LYS 5 84.728 -6.551 -2.099
41 1HE LYS 5 HE2 LYS 5 83.534 -5.916 -4.114
42 2HE LYS 5 HE1 LYS 5 84.801 -4.744 -3.756
43 1HZ LYS 5 HZ1 LYS 5 84.608 -5.444 -6.139
44 2HZ LYS 5 HZ2 LYS 5 85.166 -6.972 -5.676
45 3HZ LYS 5 HZ3 LYS 5 86.152 -5.614 -5.467
46 H PHE 6 HN PHE 6 87.206 -3.216 -1.233
47 HA PHE 6 HA PHE 6 88.205 -2.226 1.277
48 1HB PHE 6 HB2 PHE 6 89.238 -1.024 -1.306
49 2HB PHE 6 HB1 PHE 6 89.601 -0.465 0.324
50 HD1 PHE 6 HD1 PHE 6 91.232 -1.540 1.660
51 HD2 PHE 6 HD2 PHE 6 90.157 -3.177 -2.110
52 HE1 PHE 6 HE1 PHE 6 93.118 -3.094 1.810
53 HE2 PHE 6 HE2 PHE 6 92.064 -4.728 -1.980
54 HZ PHE 6 HZ PHE 6 93.542 -4.697 -0.006
55 H ASN 7 HN ASN 7 85.874 -1.976 1.496
56 HA ASN 7 HA ASN 7 84.246 -0.476 -0.159
57 1HB ASN 7 HB2 ASN 7 84.081 -0.806 2.843
58 2HB ASN 7 HB1 ASN 7 82.779 -0.200 1.823
59 1HD2 ASN 7 HD21 ASN 7 82.568 -1.752 -0.226
60 2HD2 ASN 7 HD22 ASN 7 82.336 -3.409 0.204
61 H LYS 8 HN LYS 8 83.448 1.410 2.253
62 HA LYS 8 HA LYS 8 84.655 3.714 1.086
63 1HB LYS 8 HB2 LYS 8 83.309 4.016 3.705
64 2HB LYS 8 HB1 LYS 8 83.119 4.943 2.225
65 1HG LYS 8 HG2 LYS 8 81.858 2.960 1.294
66 2HG LYS 8 HG1 LYS 8 81.858 2.311 2.936
67 1HD LYS 8 HD2 LYS 8 79.888 3.435 3.029
68 2HD LYS 8 HD1 LYS 8 80.959 4.770 3.463
69 1HE LYS 8 HE2 LYS 8 80.315 4.230 0.594
70 2HE LYS 8 HE1 LYS 8 79.165 5.102 1.607
71 1HZ LYS 8 HZ1 LYS 8 81.425 6.397 2.168
72 2HZ LYS 8 HZ2 LYS 8 80.360 6.866 0.942
73 3HZ LYS 8 HZ3 LYS 8 81.733 5.953 0.565
74 H GLU 9 HN GLU 9 84.746 2.554 4.462
75 HA GLU 9 HA GLU 9 86.769 4.331 5.266
76 1HB GLU 9 HB2 GLU 9 86.965 2.793 7.251
77 2HB GLU 9 HB1 GLU 9 85.352 3.413 6.928
78 1HG GLU 9 HG2 GLU 9 85.515 1.019 5.507
79 2HG GLU 9 HG1 GLU 9 86.283 0.696 7.060
80 H GLN 10 HN GLN 10 86.948 1.061 3.982
81 HA GLN 10 HA GLN 10 89.732 0.761 4.616
82 1HB GLN 10 HB2 GLN 10 88.096 -1.122 4.495
83 2HB GLN 10 HB1 GLN 10 88.045 -0.909 2.752
84 1HG GLN 10 HG2 GLN 10 89.722 -2.334 2.607
85 2HG GLN 10 HG1 GLN 10 90.748 -1.116 3.365
86 1HE2 GLN 10 HE21 GLN 10 91.634 -3.500 3.789
87 2HE2 GLN 10 HE22 GLN 10 91.242 -4.111 5.351
88 H GLN 11 HN GLN 11 87.909 1.487 1.650
89 HA GLN 11 HA GLN 11 90.064 1.362 -0.146
90 1HB GLN 11 HB2 GLN 11 87.494 1.662 -0.568
91 2HB GLN 11 HB1 GLN 11 87.892 3.369 -0.560
92 1HG GLN 11 HG2 GLN 11 89.800 2.189 -2.205
93 2HG GLN 11 HG1 GLN 11 88.283 1.390 -2.614
94 1HE2 GLN 11 HE21 GLN 11 89.722 4.583 -2.136
95 2HE2 GLN 11 HE22 GLN 11 88.752 5.392 -3.316
96 H ASN 12 HN ASN 12 89.176 3.785 2.170
97 HA ASN 12 HA ASN 12 90.275 6.067 1.093
98 1HB ASN 12 HB2 ASN 12 89.288 5.344 3.571
99 2HB ASN 12 HB1 ASN 12 90.971 5.726 3.921
100 1HD2 ASN 12 HD21 ASN 12 91.757 7.823 3.328
101 2HD2 ASN 12 HD22 ASN 12 90.669 9.162 3.255
102 H ALA 13 HN ALA 13 91.902 3.308 2.581
103 HA ALA 13 HA ALA 13 94.459 4.398 2.823
104 1HB ALA 13 HB1 ALA 13 95.277 2.153 2.866
105 2HB ALA 13 HB2 ALA 13 93.846 1.556 2.025
106 3HB ALA 13 HB3 ALA 13 93.709 2.168 3.674
107 H PHE 14 HN PHE 14 92.956 2.743 0.051
108 HA PHE 14 HA PHE 14 95.102 2.727 -1.696
109 1HB PHE 14 HB2 PHE 14 93.058 1.543 -2.166
110 2HB PHE 14 HB1 PHE 14 92.140 3.031 -2.198
111 HD1 PHE 14 HD1 PHE 14 91.464 3.712 -4.253
112 HD2 PHE 14 HD2 PHE 14 95.179 1.672 -3.909
113 HE1 PHE 14 HE1 PHE 14 91.774 3.881 -6.686
114 HE2 PHE 14 HE2 PHE 14 95.497 1.838 -6.344
115 HZ PHE 14 HZ PHE 14 93.793 2.944 -7.735
116 H TRP 15 HN TRP 15 92.475 5.094 -1.586
117 HA TRP 15 HA TRP 15 93.519 6.832 -3.505
118 1HB TRP 15 HB2 TRP 15 91.379 6.910 -1.527
119 2HB TRP 15 HB1 TRP 15 92.071 8.493 -1.863
120 HD1 TRP 15 HD1 TRP 15 91.539 5.671 -4.449
121 HE1 TRP 15 HE1 TRP 15 89.963 6.563 -6.283
122 HE3 TRP 15 HE3 TRP 15 90.450 10.234 -2.427
123 HZ2 TRP 15 HZ2 TRP 15 88.459 8.899 -6.803
124 HZ3 TRP 15 HZ3 TRP 15 88.935 11.741 -3.656
125 HH2 TRP 15 HH2 TRP 15 87.964 11.086 -5.799
126 H GLU 16 HN GLU 16 93.855 6.943 0.004
127 HA GLU 16 HA GLU 16 95.368 9.368 -0.030
128 1HB GLU 16 HB2 GLU 16 95.951 8.990 2.261
129 2HB GLU 16 HB1 GLU 16 94.290 8.471 2.047
130 1HG GLU 16 HG2 GLU 16 95.119 6.799 3.346
131 2HG GLU 16 HG1 GLU 16 95.357 6.120 1.744
132 H ILE 17 HN ILE 17 96.384 5.981 0.287
133 HA ILE 17 HA ILE 17 99.107 6.234 0.151
134 HB ILE 17 HB ILE 17 97.422 4.113 -1.184
135 1HG1 ILE 17 HG12 ILE 17 97.493 4.677 1.459
136 2HG1 ILE 17 HG11 ILE 17 97.208 3.070 0.810
137 1HG2 ILE 17 HG21 ILE 17 100.333 3.961 -0.423
138 2HG2 ILE 17 HG22 ILE 17 99.721 4.178 -2.063
139 3HG2 ILE 17 HG23 ILE 17 99.368 2.694 -1.180
140 1HD1 ILE 17 HD11 ILE 17 99.143 2.279 1.591
141 2HD1 ILE 17 HD12 ILE 17 99.037 3.655 2.687
142 3HD1 ILE 17 HD13 ILE 17 100.026 3.762 1.233
143 H LEU 18 HN LEU 18 96.811 6.165 -2.547
144 HA LEU 18 HA LEU 18 98.746 6.221 -4.606
145 1HB LEU 18 HB2 LEU 18 95.825 6.418 -4.370
146 2HB LEU 18 HB1 LEU 18 96.482 7.323 -5.719
147 HG LEU 18 HG LEU 18 95.803 5.110 -6.439
148 1HD1 LEU 18 HD11 LEU 18 98.803 5.393 -6.362
149 2HD1 LEU 18 HD12 LEU 18 97.722 6.134 -7.541
150 3HD1 LEU 18 HD13 LEU 18 97.887 4.379 -7.476
151 1HD2 LEU 18 HD21 LEU 18 96.027 3.944 -4.320
152 2HD2 LEU 18 HD22 LEU 18 97.781 4.095 -4.403
153 3HD2 LEU 18 HD23 LEU 18 96.923 3.108 -5.586
154 H HIS 19 HN HIS 19 96.795 8.809 -3.142
155 HA HIS 19 HA HIS 19 97.779 10.859 -4.806
156 1HB HIS 19 HB2 HIS 19 96.174 10.658 -2.363
157 2HB HIS 19 HB1 HIS 19 97.158 12.116 -2.425
158 HD1 HIS 19 HD1 HIS 19 93.896 11.303 -3.044
159 HD2 HIS 19 HD2 HIS 19 96.785 13.103 -5.426
160 HE1 HIS 19 HE1 HIS 19 92.622 12.565 -4.806
161 HE2 HIS 19 HE2 HIS 19 94.389 13.726 -6.176
162 H LEU 20 HN LEU 20 98.620 9.982 -1.476
163 HA LEU 20 HA LEU 20 100.316 11.044 -0.215
164 1HB LEU 20 HB2 LEU 20 101.121 8.714 -1.822
165 2HB LEU 20 HB1 LEU 20 102.393 9.552 -0.959
166 HG LEU 20 HG LEU 20 99.920 8.312 0.248
167 1HD1 LEU 20 HD11 LEU 20 102.145 7.026 -0.537
168 2HD1 LEU 20 HD12 LEU 20 101.172 6.541 0.851
169 3HD1 LEU 20 HD13 LEU 20 102.624 7.513 1.087
170 1HD2 LEU 20 HD21 LEU 20 101.180 8.874 2.406
171 2HD2 LEU 20 HD22 LEU 20 100.329 10.182 1.584
172 3HD2 LEU 20 HD23 LEU 20 102.077 10.028 1.421
173 HA PRO 21 HA PRO 21 102.195 13.760 -3.560
174 1HB PRO 21 HB2 PRO 21 101.046 15.955 -1.985
175 2HB PRO 21 HB1 PRO 21 100.888 15.625 -3.712
176 1HG PRO 21 HG2 PRO 21 98.827 15.333 -1.990
177 2HG PRO 21 HG1 PRO 21 99.022 14.313 -3.427
178 1HD PRO 21 HD2 PRO 21 99.667 13.702 -0.565
179 2HD PRO 21 HD1 PRO 21 98.926 12.667 -1.798
180 H ASN 22 HN ASN 22 104.139 13.090 -2.616
181 HA ASN 22 HA ASN 22 105.967 14.553 -1.592
182 1HB ASN 22 HB2 ASN 22 103.914 14.503 0.556
183 2HB ASN 22 HB1 ASN 22 105.582 14.347 1.058
184 1HD2 ASN 22 HD21 ASN 22 107.025 15.938 -0.356
185 2HD2 ASN 22 HD22 ASN 22 106.488 17.578 -0.287
186 H LEU 23 HN LEU 23 104.874 11.630 -1.969
187 HA LEU 23 HA LEU 23 106.996 10.421 -0.319
188 1HB LEU 23 HB2 LEU 23 104.884 9.753 0.623
189 2HB LEU 23 HB1 LEU 23 104.265 9.318 -0.957
190 HG LEU 23 HG LEU 23 106.692 7.860 -0.195
191 1HD1 LEU 23 HD11 LEU 23 104.432 8.020 1.649
192 2HD1 LEU 23 HD12 LEU 23 106.075 7.436 1.909
193 3HD1 LEU 23 HD13 LEU 23 104.868 6.375 1.179
194 1HD2 LEU 23 HD21 LEU 23 105.155 7.473 -2.175
195 2HD2 LEU 23 HD22 LEU 23 104.000 6.813 -1.019
196 3HD2 LEU 23 HD23 LEU 23 105.578 6.056 -1.217
197 H ASN 24 HN ASN 24 108.043 8.566 -1.276
198 HA ASN 24 HA ASN 24 108.610 8.870 -4.013
199 1HB ASN 24 HB2 ASN 24 109.428 7.115 -1.877
200 2HB ASN 24 HB1 ASN 24 109.102 6.160 -3.320
201 1HD2 ASN 24 HD21 ASN 24 110.027 7.246 -5.373
202 2HD2 ASN 24 HD22 ASN 24 111.664 7.783 -5.242
203 H GLU 25 HN GLU 25 107.020 8.679 -5.557
204 HA GLU 25 HA GLU 25 104.656 7.306 -5.225
205 1HB GLU 25 HB2 GLU 25 104.317 7.653 -7.586
206 2HB GLU 25 HB1 GLU 25 105.102 9.070 -6.887
207 1HG GLU 25 HG2 GLU 25 106.219 8.736 -8.899
208 2HG GLU 25 HG1 GLU 25 107.291 8.023 -7.695
209 H GLU 26 HN GLU 26 107.779 6.078 -5.973
210 HA GLU 26 HA GLU 26 106.934 3.609 -7.156
211 1HB GLU 26 HB2 GLU 26 109.220 2.894 -6.892
212 2HB GLU 26 HB1 GLU 26 109.239 4.572 -7.415
213 1HG GLU 26 HG2 GLU 26 109.643 5.284 -5.112
214 2HG GLU 26 HG1 GLU 26 109.631 3.599 -4.594
215 H GLN 27 HN GLN 27 107.294 4.919 -4.019
216 HA GLN 27 HA GLN 27 107.150 2.413 -2.582
217 1HB GLN 27 HB2 GLN 27 107.398 5.261 -1.860
218 2HB GLN 27 HB1 GLN 27 106.416 4.313 -0.753
219 1HG GLN 27 HG2 GLN 27 109.275 3.795 -1.535
220 2HG GLN 27 HG1 GLN 27 108.685 4.365 0.026
221 1HE2 GLN 27 HE21 GLN 27 106.713 2.783 0.710
222 2HE2 GLN 27 HE22 GLN 27 107.196 1.126 0.779
223 H ARG 28 HN ARG 28 105.063 4.970 -3.727
224 HA ARG 28 HA ARG 28 102.666 4.282 -2.449
225 1HB ARG 28 HB2 ARG 28 103.299 5.598 -5.083
226 2HB ARG 28 HB1 ARG 28 101.638 5.250 -4.633
227 1HG ARG 28 HG2 ARG 28 102.338 6.529 -2.436
228 2HG ARG 28 HG1 ARG 28 103.536 7.237 -3.523
229 1HD ARG 28 HD2 ARG 28 100.624 7.125 -4.244
230 2HD ARG 28 HD1 ARG 28 101.270 8.426 -3.282
231 HE ARG 28 HE ARG 28 101.598 8.054 -6.092
232 1HH1 ARG 28 HH11 ARG 28 103.064 9.423 -3.235
233 2HH1 ARG 28 HH12 ARG 28 103.927 10.643 -4.110
234 1HH2 ARG 28 HH21 ARG 28 102.718 9.669 -7.243
235 2HH2 ARG 28 HH22 ARG 28 103.729 10.783 -6.385
236 H ASN 29 HN ASN 29 103.799 3.439 -5.727
237 HA ASN 29 HA ASN 29 101.844 1.650 -6.442
238 1HB ASN 29 HB2 ASN 29 103.745 2.481 -7.876
239 2HB ASN 29 HB1 ASN 29 104.781 1.302 -7.076
240 1HD2 ASN 29 HD21 ASN 29 104.707 -0.790 -7.690
241 2HD2 ASN 29 HD22 ASN 29 103.697 -1.396 -8.954
242 H GLY 30 HN GLY 30 104.926 0.912 -4.765
243 1HA GLY 30 HA2 GLY 30 104.526 -1.830 -4.433
244 2HA GLY 30 HA1 GLY 30 105.439 -0.816 -3.323
245 H PHE 31 HN PHE 31 103.236 0.876 -2.612
246 HA PHE 31 HA PHE 31 102.118 -0.684 -0.505
247 1HB PHE 31 HB2 PHE 31 101.974 2.159 -1.385
248 2HB PHE 31 HB1 PHE 31 100.695 1.566 -0.331
249 HD1 PHE 31 HD1 PHE 31 101.731 0.035 1.663
250 HD2 PHE 31 HD2 PHE 31 103.675 3.259 -0.310
251 HE1 PHE 31 HE1 PHE 31 103.180 0.346 3.621
252 HE2 PHE 31 HE2 PHE 31 105.131 3.584 1.647
253 HZ PHE 31 HZ PHE 31 104.886 2.126 3.617
254 H ILE 32 HN ILE 32 100.967 0.463 -3.616
255 HA ILE 32 HA ILE 32 98.212 -0.100 -3.183
256 HB ILE 32 HB ILE 32 99.362 -0.255 -5.935
257 1HG1 ILE 32 HG12 ILE 32 99.095 2.294 -4.326
258 2HG1 ILE 32 HG11 ILE 32 100.576 1.613 -4.985
259 1HG2 ILE 32 HG21 ILE 32 97.009 -0.542 -5.749
260 2HG2 ILE 32 HG22 ILE 32 97.293 1.063 -6.423
261 3HG2 ILE 32 HG23 ILE 32 96.855 0.885 -4.724
262 1HD1 ILE 32 HD11 ILE 32 99.523 3.564 -6.220
263 2HD1 ILE 32 HD12 ILE 32 98.305 2.409 -6.760
264 3HD1 ILE 32 HD13 ILE 32 100.001 2.160 -7.172
265 H GLN 33 HN GLN 33 100.817 -1.897 -4.784
266 HA GLN 33 HA GLN 33 99.213 -4.108 -5.513
267 1HB GLN 33 HB2 GLN 33 101.526 -5.305 -5.560
268 2HB GLN 33 HB1 GLN 33 101.182 -4.032 -6.720
269 1HG GLN 33 HG2 GLN 33 102.865 -2.792 -5.988
270 2HG GLN 33 HG1 GLN 33 102.357 -2.966 -4.311
271 1HE2 GLN 33 HE21 GLN 33 104.765 -3.601 -6.471
272 2HE2 GLN 33 HE22 GLN 33 105.583 -4.864 -5.622
273 H SER 34 HN SER 34 101.432 -3.632 -2.741
274 HA SER 34 HA SER 34 100.977 -6.149 -1.567
275 1HB SER 34 HB2 SER 34 102.822 -4.489 -1.001
276 2HB SER 34 HB1 SER 34 101.622 -3.614 -0.049
277 HG SER 34 HG SER 34 101.303 -5.586 1.132
278 H LEU 35 HN LEU 35 99.355 -3.047 -1.219
279 HA LEU 35 HA LEU 35 97.615 -3.819 0.898
280 1HB LEU 35 HB2 LEU 35 98.005 -1.502 0.565
281 2HB LEU 35 HB1 LEU 35 97.564 -1.592 -1.128
282 HG LEU 35 HG LEU 35 95.262 -1.731 -0.642
283 1HD1 LEU 35 HD11 LEU 35 94.925 -3.258 1.013
284 2HD1 LEU 35 HD12 LEU 35 94.654 -1.770 1.919
285 3HD1 LEU 35 HD13 LEU 35 96.203 -2.602 2.033
286 1HD2 LEU 35 HD21 LEU 35 96.758 0.424 0.180
287 2HD2 LEU 35 HD22 LEU 35 95.740 0.094 1.581
288 3HD2 LEU 35 HD23 LEU 35 95.004 0.392 0.007
289 H LYS 36 HN LYS 36 96.996 -3.367 -2.602
290 HA LYS 36 HA LYS 36 94.353 -4.185 -2.612
291 1HB LYS 36 HB2 LYS 36 95.814 -3.254 -4.533
292 2HB LYS 36 HB1 LYS 36 96.210 -4.937 -4.850
293 1HG LYS 36 HG2 LYS 36 93.378 -4.672 -4.582
294 2HG LYS 36 HG1 LYS 36 93.974 -3.479 -5.736
295 1HD LYS 36 HD2 LYS 36 94.518 -6.448 -5.816
296 2HD LYS 36 HD1 LYS 36 93.386 -5.575 -6.850
297 1HE LYS 36 HE2 LYS 36 95.399 -4.161 -7.547
298 2HE LYS 36 HE1 LYS 36 96.384 -5.416 -6.797
299 1HZ LYS 36 HZ1 LYS 36 94.426 -5.852 -8.989
300 2HZ LYS 36 HZ2 LYS 36 95.408 -7.037 -8.287
301 3HZ LYS 36 HZ3 LYS 36 96.107 -5.780 -9.176
302 H ASP 37 HN ASP 37 97.123 -6.312 -3.515
303 HA ASP 37 HA ASP 37 95.697 -8.654 -3.644
304 1HB ASP 37 HB2 ASP 37 97.828 -9.825 -3.302
305 2HB ASP 37 HB1 ASP 37 98.006 -8.463 -4.402
306 H ASP 38 HN ASP 38 96.565 -6.911 -0.788
307 HA ASP 38 HA ASP 38 95.393 -9.076 0.812
308 1HB ASP 38 HB2 ASP 38 98.093 -8.423 0.863
309 2HB ASP 38 HB1 ASP 38 97.431 -7.608 2.276
310 HA PRO 39 HA PRO 39 93.075 -5.312 1.888
311 1HB PRO 39 HB2 PRO 39 90.888 -6.601 2.812
312 2HB PRO 39 HB1 PRO 39 91.189 -6.355 1.088
313 1HG PRO 39 HG2 PRO 39 91.686 -8.784 2.770
314 2HG PRO 39 HG1 PRO 39 90.977 -8.674 1.148
315 1HD PRO 39 HD2 PRO 39 93.563 -9.368 1.575
316 2HD PRO 39 HD1 PRO 39 93.032 -8.489 0.126
317 H SER 40 HN SER 40 93.572 -8.181 3.882
318 HA SER 40 HA SER 40 92.880 -6.974 6.351
319 1HB SER 40 HB2 SER 40 92.961 -9.427 6.021
320 2HB SER 40 HB1 SER 40 94.713 -9.333 5.844
321 HG SER 40 HG SER 40 94.754 -9.513 7.930
322 H GLN 41 HN GLN 41 95.589 -6.660 4.317
323 HA GLN 41 HA GLN 41 97.410 -5.888 6.437
324 1HB GLN 41 HB2 GLN 41 97.679 -6.059 3.440
325 2HB GLN 41 HB1 GLN 41 98.943 -5.408 4.475
326 1HG GLN 41 HG2 GLN 41 98.260 -7.849 5.626
327 2HG GLN 41 HG1 GLN 41 98.292 -8.144 3.891
328 1HE2 GLN 41 HE21 GLN 41 100.210 -5.970 5.920
329 2HE2 GLN 41 HE22 GLN 41 101.744 -6.639 5.492
330 H SER 42 HN SER 42 95.001 -4.391 4.633
331 HA SER 42 HA SER 42 95.669 -1.973 3.786
332 1HB SER 42 HB2 SER 42 93.344 -3.064 5.089
333 2HB SER 42 HB1 SER 42 93.555 -1.377 5.554
334 HG SER 42 HG SER 42 92.850 -0.864 3.658
335 H ALA 43 HN ALA 43 95.459 -2.723 7.260
336 HA ALA 43 HA ALA 43 96.103 -0.114 8.141
337 1HB ALA 43 HB1 ALA 43 96.882 -1.716 10.206
338 2HB ALA 43 HB2 ALA 43 95.734 -2.749 9.354
339 3HB ALA 43 HB3 ALA 43 95.235 -1.155 9.921
340 H ASN 44 HN ASN 44 98.091 -3.032 7.751
341 HA ASN 44 HA ASN 44 100.500 -1.926 8.679
342 1HB ASN 44 HB2 ASN 44 99.683 -4.411 7.870
343 2HB ASN 44 HB1 ASN 44 100.766 -3.947 6.561
344 1HD2 ASN 44 HD21 ASN 44 102.720 -4.706 6.852
345 2HD2 ASN 44 HD22 ASN 44 103.551 -4.849 8.360
346 H LEU 45 HN LEU 45 98.977 -1.870 5.509
347 HA LEU 45 HA LEU 45 101.296 -0.760 4.201
348 1HB LEU 45 HB2 LEU 45 98.449 -1.227 3.352
349 2HB LEU 45 HB1 LEU 45 99.562 -0.325 2.348
350 HG LEU 45 HG LEU 45 99.411 -2.626 1.594
351 1HD1 LEU 45 HD11 LEU 45 101.507 -1.890 1.053
352 2HD1 LEU 45 HD12 LEU 45 101.909 -3.270 2.074
353 3HD1 LEU 45 HD13 LEU 45 101.977 -1.638 2.733
354 1HD2 LEU 45 HD21 LEU 45 98.775 -3.624 3.725
355 2HD2 LEU 45 HD22 LEU 45 100.410 -3.365 4.335
356 3HD2 LEU 45 HD23 LEU 45 100.135 -4.471 2.987
357 H LEU 46 HN LEU 46 98.094 0.415 5.152
358 HA LEU 46 HA LEU 46 98.341 3.055 4.351
359 1HB LEU 46 HB2 LEU 46 96.227 2.103 5.036
360 2HB LEU 46 HB1 LEU 46 96.818 1.878 6.671
361 HG LEU 46 HG LEU 46 97.129 4.514 6.535
362 1HD1 LEU 46 HD11 LEU 46 96.063 4.137 4.085
363 2HD1 LEU 46 HD12 LEU 46 95.905 5.627 5.016
364 3HD1 LEU 46 HD13 LEU 46 94.606 4.435 5.032
365 1HD2 LEU 46 HD21 LEU 46 94.686 4.638 7.359
366 2HD2 LEU 46 HD22 LEU 46 95.840 3.661 8.265
367 3HD2 LEU 46 HD23 LEU 46 94.699 2.885 7.167
368 H ALA 47 HN ALA 47 98.867 1.790 7.655
369 HA ALA 47 HA ALA 47 99.795 4.173 8.762
370 1HB ALA 47 HB1 ALA 47 100.967 2.566 10.409
371 2HB ALA 47 HB2 ALA 47 100.150 1.296 9.499
372 3HB ALA 47 HB3 ALA 47 99.206 2.549 10.306
373 H GLU 48 HN GLU 48 101.544 1.627 7.060
374 HA GLU 48 HA GLU 48 104.142 2.589 7.650
375 1HB GLU 48 HB2 GLU 48 103.014 0.706 5.608
376 2HB GLU 48 HB1 GLU 48 104.697 1.205 5.513
377 1HG GLU 48 HG2 GLU 48 103.712 0.207 8.121
378 2HG GLU 48 HG1 GLU 48 103.925 -0.965 6.821
379 H ALA 49 HN ALA 49 101.910 3.170 4.977
380 HA ALA 49 HA ALA 49 103.782 4.744 3.476
381 1HB ALA 49 HB1 ALA 49 100.910 5.092 2.932
382 2HB ALA 49 HB2 ALA 49 101.519 3.442 2.804
383 3HB ALA 49 HB3 ALA 49 102.242 4.726 1.835
384 H LYS 50 HN LYS 50 101.088 5.423 5.654
385 HA LYS 50 HA LYS 50 100.982 8.202 5.264
386 1HB LYS 50 HB2 LYS 50 100.227 6.511 7.649
387 2HB LYS 50 HB1 LYS 50 99.882 8.231 7.526
388 1HG LYS 50 HG2 LYS 50 98.964 6.860 5.174
389 2HG LYS 50 HG1 LYS 50 98.310 6.104 6.628
390 1HD LYS 50 HD2 LYS 50 98.231 9.020 6.714
391 2HD LYS 50 HD1 LYS 50 97.304 8.341 5.374
392 1HE LYS 50 HE2 LYS 50 95.666 8.094 6.879
393 2HE LYS 50 HE1 LYS 50 96.594 6.707 7.446
394 1HZ LYS 50 HZ1 LYS 50 96.715 7.727 9.395
395 2HZ LYS 50 HZ2 LYS 50 96.028 9.145 8.780
396 3HZ LYS 50 HZ3 LYS 50 97.700 8.907 8.687
397 H LYS 51 HN LYS 51 102.698 6.273 7.715
398 HA LYS 51 HA LYS 51 103.909 8.527 8.957
399 1HB LYS 51 HB2 LYS 51 104.616 5.589 9.038
400 2HB LYS 51 HB1 LYS 51 105.361 6.814 10.056
401 1HG LYS 51 HG2 LYS 51 102.831 7.314 10.662
402 2HG LYS 51 HG1 LYS 51 102.651 5.624 10.187
403 1HD LYS 51 HD2 LYS 51 103.059 5.601 12.513
404 2HD LYS 51 HD1 LYS 51 104.578 5.122 11.754
405 1HE LYS 51 HE2 LYS 51 104.305 8.008 12.152
406 2HE LYS 51 HE1 LYS 51 104.294 7.077 13.649
407 1HZ LYS 51 HZ1 LYS 51 106.341 5.931 12.530
408 2HZ LYS 51 HZ2 LYS 51 106.519 7.395 13.358
409 3HZ LYS 51 HZ3 LYS 51 106.433 7.386 11.669
410 H LEU 52 HN LEU 52 104.988 6.175 6.537
411 HA LEU 52 HA LEU 52 107.651 6.965 6.332
412 1HB LEU 52 HB2 LEU 52 106.942 4.960 5.259
413 2HB LEU 52 HB1 LEU 52 105.748 5.813 4.300
414 HG LEU 52 HG LEU 52 107.645 6.980 3.132
415 1HD1 LEU 52 HD11 LEU 52 109.731 6.756 3.837
416 2HD1 LEU 52 HD12 LEU 52 109.636 5.003 3.668
417 3HD1 LEU 52 HD13 LEU 52 109.151 5.770 5.180
418 1HD2 LEU 52 HD21 LEU 52 107.162 5.453 1.597
419 2HD2 LEU 52 HD22 LEU 52 106.678 4.299 2.840
420 3HD2 LEU 52 HD23 LEU 52 108.362 4.384 2.322
421 H ASN 53 HN ASN 53 104.822 8.122 4.521
422 HA ASN 53 HA ASN 53 106.034 9.898 2.808
423 1HB ASN 53 HB2 ASN 53 103.823 9.807 2.307
424 2HB ASN 53 HB1 ASN 53 103.342 9.610 3.986
425 1HD2 ASN 53 HD21 ASN 53 103.193 11.618 1.381
426 2HD2 ASN 53 HD22 ASN 53 102.863 13.109 2.187
427 H ASP 54 HN ASP 54 104.834 10.636 6.095
428 HA ASP 54 HA ASP 54 105.625 13.312 6.124
429 1HB ASP 54 HB2 ASP 54 104.871 11.292 8.148
430 2HB ASP 54 HB1 ASP 54 105.796 12.667 8.743
431 H ALA 55 HN ALA 55 107.344 10.489 7.480
432 HA ALA 55 HA ALA 55 109.573 11.820 8.431
433 1HB ALA 55 HB1 ALA 55 110.557 9.365 7.649
434 2HB ALA 55 HB2 ALA 55 108.831 9.077 7.872
435 3HB ALA 55 HB3 ALA 55 109.792 9.747 9.191
436 H GLN 56 HN GLN 56 108.905 10.819 5.116
437 HA GLN 56 HA GLN 56 111.601 11.732 4.368
438 1HB GLN 56 HB2 GLN 56 111.149 10.545 2.199
439 2HB GLN 56 HB1 GLN 56 111.245 9.508 3.614
440 1HG GLN 56 HG2 GLN 56 109.246 8.682 3.178
441 2HG GLN 56 HG1 GLN 56 108.534 10.292 3.253
442 1HE2 GLN 56 HE21 GLN 56 109.331 11.594 1.141
443 2HE2 GLN 56 HE22 GLN 56 108.937 10.778 -0.330
444 H ALA 57 HN ALA 57 108.566 12.989 4.532
445 HA ALA 57 HA ALA 57 108.801 14.462 2.005
446 1HB ALA 57 HB1 ALA 57 106.483 14.162 3.895
447 2HB ALA 57 HB2 ALA 57 106.681 13.393 2.320
448 3HB ALA 57 HB3 ALA 57 106.469 15.143 2.430
449 HA PRO 58 HA PRO 58 109.923 18.101 4.340
450 1HB PRO 58 HB2 PRO 58 110.217 19.782 2.286
451 2HB PRO 58 HB1 PRO 58 111.348 18.445 2.530
452 1HG PRO 58 HG2 PRO 58 109.061 18.667 0.617
453 2HG PRO 58 HG1 PRO 58 110.676 17.984 0.357
454 1HD PRO 58 HD2 PRO 58 108.403 16.507 0.912
455 2HD PRO 58 HD1 PRO 58 110.065 15.949 1.182
456 H LYS 59 HN LYS 59 107.396 18.047 1.908
457 HA LYS 59 HA LYS 59 105.135 18.626 2.501
458 1HB LYS 59 HB2 LYS 59 106.534 20.661 4.128
459 2HB LYS 59 HB1 LYS 59 105.079 21.209 3.326
460 1HG LYS 59 HG2 LYS 59 105.261 18.826 5.155
461 2HG LYS 59 HG1 LYS 59 104.629 20.415 5.590
462 1HD LYS 59 HD2 LYS 59 103.506 18.590 3.461
463 2HD LYS 59 HD1 LYS 59 102.824 18.843 5.066
464 1HE LYS 59 HE2 LYS 59 101.741 20.654 4.374
465 2HE LYS 59 HE1 LYS 59 103.235 21.372 3.778
466 1HZ LYS 59 HZ1 LYS 59 102.814 19.693 1.824
467 2HZ LYS 59 HZ2 LYS 59 102.064 21.208 1.851
468 3HZ LYS 59 HZ3 LYS 59 101.206 19.833 2.334
469 H ALA 60 HN ALA 60 107.748 20.279 1.008
470 HA ALA 60 HA ALA 60 106.397 22.226 -0.467
471 1HB ALA 60 HB1 ALA 60 108.501 21.119 -2.052
472 2HB ALA 60 HB2 ALA 60 109.011 21.174 -0.365
473 3HB ALA 60 HB3 ALA 60 108.459 22.644 -1.167
Start of MODEL 8
1 1H GLY -1 HT1 GLY -1 81.838 -17.493 2.147
2 2H GLY -1 HT2 GLY -1 82.049 -17.734 3.807
3 3H GLY -1 HT3 GLY -1 82.914 -18.676 2.700
4 1HA GLY -1 HA1 GLY -1 84.559 -17.221 2.647
5 2HA GLY -1 HA2 GLY -1 83.428 -15.978 2.134
6 H SER 0 HN SER 0 85.311 -17.230 4.714
7 HA SER 0 HA SER 0 84.373 -15.031 6.436
8 1HB SER 0 HB2 SER 0 83.876 -17.574 7.072
9 2HB SER 0 HB1 SER 0 85.518 -17.471 7.706
10 HG SER 0 HG SER 0 83.503 -15.582 8.328
11 H THR 1 HN THR 1 86.783 -15.737 4.525
12 HA THR 1 HA THR 1 88.702 -14.233 6.045
13 HB THR 1 HB THR 1 89.242 -16.385 6.955
14 HG1 THR 1 HG1 THR 1 91.359 -16.539 6.302
15 1HG2 THR 1 HG21 THR 1 89.975 -17.655 4.409
16 2HG2 THR 1 HG22 THR 1 88.248 -17.530 4.740
17 3HG2 THR 1 HG23 THR 1 89.308 -18.354 5.884
18 H ALA 2 HN ALA 2 88.140 -12.913 4.190
19 HA ALA 2 HA ALA 2 89.902 -12.277 2.410
20 1HB ALA 2 HB1 ALA 2 88.621 -14.752 1.262
21 2HB ALA 2 HB2 ALA 2 90.335 -14.438 1.537
22 3HB ALA 2 HB3 ALA 2 89.472 -13.563 0.276
23 H ASP 3 HN ASP 3 87.719 -13.084 0.052
24 HA ASP 3 HA ASP 3 86.152 -11.854 -1.054
25 1HB ASP 3 HB2 ASP 3 85.014 -12.772 1.183
26 2HB ASP 3 HB1 ASP 3 84.872 -11.047 1.512
27 H ASN 4 HN ASN 4 88.195 -10.368 -1.193
28 HA ASN 4 HA ASN 4 88.112 -7.910 0.243
29 1HB ASN 4 HB2 ASN 4 89.819 -7.187 -1.464
30 2HB ASN 4 HB1 ASN 4 90.231 -8.643 -0.565
31 1HD2 ASN 4 HD21 ASN 4 90.631 -10.470 -1.639
32 2HD2 ASN 4 HD22 ASN 4 90.465 -10.668 -3.347
33 H LYS 5 HN LYS 5 87.228 -6.011 -0.241
34 HA LYS 5 HA LYS 5 86.244 -5.399 -2.886
35 1HB LYS 5 HB2 LYS 5 83.945 -4.963 -2.184
36 2HB LYS 5 HB1 LYS 5 84.357 -6.653 -1.929
37 1HG LYS 5 HG2 LYS 5 84.669 -6.247 0.440
38 2HG LYS 5 HG1 LYS 5 84.338 -4.530 0.206
39 1HD LYS 5 HD2 LYS 5 82.417 -6.802 -0.305
40 2HD LYS 5 HD1 LYS 5 82.367 -5.684 1.060
41 1HE LYS 5 HE2 LYS 5 82.278 -3.861 -0.804
42 2HE LYS 5 HE1 LYS 5 81.735 -5.196 -1.820
43 1HZ LYS 5 HZ1 LYS 5 80.233 -5.402 0.460
44 2HZ LYS 5 HZ2 LYS 5 79.717 -4.784 -1.027
45 3HZ LYS 5 HZ3 LYS 5 80.300 -3.736 0.166
46 H PHE 6 HN PHE 6 88.173 -4.467 -0.866
47 HA PHE 6 HA PHE 6 88.559 -2.603 0.537
48 1HB PHE 6 HB2 PHE 6 88.788 -2.086 -2.385
49 2HB PHE 6 HB1 PHE 6 89.086 -0.752 -1.277
50 HD1 PHE 6 HD1 PHE 6 91.177 -0.481 -0.346
51 HD2 PHE 6 HD2 PHE 6 90.089 -4.289 -1.890
52 HE1 PHE 6 HE1 PHE 6 93.469 -1.275 0.021
53 HE2 PHE 6 HE2 PHE 6 92.382 -5.104 -1.506
54 HZ PHE 6 HZ PHE 6 94.079 -3.595 -0.535
55 H ASN 7 HN ASN 7 86.238 -2.536 1.363
56 HA ASN 7 HA ASN 7 84.326 -0.778 0.408
57 1HB ASN 7 HB2 ASN 7 84.959 -2.004 3.020
58 2HB ASN 7 HB1 ASN 7 83.953 -0.566 3.090
59 1HD2 ASN 7 HD21 ASN 7 82.081 -1.544 3.671
60 2HD2 ASN 7 HD22 ASN 7 81.221 -2.651 2.662
61 H LYS 8 HN LYS 8 83.743 1.081 2.324
62 HA LYS 8 HA LYS 8 85.143 3.321 1.521
63 1HB LYS 8 HB2 LYS 8 83.707 2.977 4.155
64 2HB LYS 8 HB1 LYS 8 84.074 4.502 3.362
65 1HG LYS 8 HG2 LYS 8 82.529 4.069 1.619
66 2HG LYS 8 HG1 LYS 8 82.325 2.392 2.128
67 1HD LYS 8 HD2 LYS 8 81.476 3.348 4.338
68 2HD LYS 8 HD1 LYS 8 81.367 4.893 3.492
69 1HE LYS 8 HE2 LYS 8 80.156 2.948 1.839
70 2HE LYS 8 HE1 LYS 8 79.542 2.694 3.472
71 1HZ LYS 8 HZ1 LYS 8 78.412 4.394 1.871
72 2HZ LYS 8 HZ2 LYS 8 79.637 5.428 2.412
73 3HZ LYS 8 HZ3 LYS 8 78.560 4.740 3.521
74 H GLU 9 HN GLU 9 85.396 1.799 4.735
75 HA GLU 9 HA GLU 9 87.491 3.316 5.703
76 1HB GLU 9 HB2 GLU 9 86.583 0.519 6.304
77 2HB GLU 9 HB1 GLU 9 87.968 1.218 7.130
78 1HG GLU 9 HG2 GLU 9 86.409 1.848 8.615
79 2HG GLU 9 HG1 GLU 9 86.192 3.190 7.493
80 H GLN 10 HN GLN 10 87.729 0.142 4.071
81 HA GLN 10 HA GLN 10 90.544 0.047 4.196
82 1HB GLN 10 HB2 GLN 10 89.602 -2.026 3.939
83 2HB GLN 10 HB1 GLN 10 88.400 -1.474 2.793
84 1HG GLN 10 HG2 GLN 10 89.948 -2.962 1.738
85 2HG GLN 10 HG1 GLN 10 90.138 -1.335 1.093
86 1HE2 GLN 10 HE21 GLN 10 91.599 -3.908 2.870
87 2HE2 GLN 10 HE22 GLN 10 93.171 -3.216 2.997
88 H GLN 11 HN GLN 11 88.369 0.855 1.470
89 HA GLN 11 HA GLN 11 90.333 1.307 -0.438
90 1HB GLN 11 HB2 GLN 11 88.101 1.212 -1.187
91 2HB GLN 11 HB1 GLN 11 87.585 2.480 -0.084
92 1HG GLN 11 HG2 GLN 11 89.586 3.094 -2.208
93 2HG GLN 11 HG1 GLN 11 87.877 2.968 -2.623
94 1HE2 GLN 11 HE21 GLN 11 86.435 4.213 -1.017
95 2HE2 GLN 11 HE22 GLN 11 86.954 5.819 -0.648
96 H ASN 12 HN ASN 12 89.375 3.316 2.241
97 HA ASN 12 HA ASN 12 90.214 5.818 1.405
98 1HB ASN 12 HB2 ASN 12 89.113 5.330 3.588
99 2HB ASN 12 HB1 ASN 12 90.628 4.643 4.165
100 1HD2 ASN 12 HD21 ASN 12 91.948 5.948 5.203
101 2HD2 ASN 12 HD22 ASN 12 91.918 7.675 5.153
102 H ALA 13 HN ALA 13 92.116 3.123 2.683
103 HA ALA 13 HA ALA 13 94.571 4.364 2.945
104 1HB ALA 13 HB1 ALA 13 94.303 2.138 3.742
105 2HB ALA 13 HB2 ALA 13 95.536 2.088 2.481
106 3HB ALA 13 HB3 ALA 13 93.895 1.543 2.132
107 H PHE 14 HN PHE 14 93.086 2.936 0.013
108 HA PHE 14 HA PHE 14 95.222 3.115 -1.700
109 1HB PHE 14 HB2 PHE 14 93.021 2.118 -2.242
110 2HB PHE 14 HB1 PHE 14 92.337 3.727 -2.359
111 HD1 PHE 14 HD1 PHE 14 92.961 5.220 -4.185
112 HD2 PHE 14 HD2 PHE 14 94.375 1.211 -4.009
113 HE1 PHE 14 HE1 PHE 14 93.597 5.349 -6.556
114 HE2 PHE 14 HE2 PHE 14 95.016 1.330 -6.383
115 HZ PHE 14 HZ PHE 14 94.627 3.400 -7.659
116 H TRP 15 HN TRP 15 92.698 5.589 -1.277
117 HA TRP 15 HA TRP 15 93.812 7.512 -2.949
118 1HB TRP 15 HB2 TRP 15 91.845 7.501 -0.777
119 2HB TRP 15 HB1 TRP 15 92.662 9.044 -0.998
120 HD1 TRP 15 HD1 TRP 15 91.661 6.656 -3.857
121 HE1 TRP 15 HE1 TRP 15 90.017 7.899 -5.396
122 HE3 TRP 15 HE3 TRP 15 91.099 10.936 -1.131
123 HZ2 TRP 15 HZ2 TRP 15 88.652 10.377 -5.442
124 HZ3 TRP 15 HZ3 TRP 15 89.605 12.697 -1.988
125 HH2 TRP 15 HH2 TRP 15 88.409 12.421 -4.100
126 H GLU 16 HN GLU 16 94.181 7.279 0.591
127 HA GLU 16 HA GLU 16 96.000 9.380 0.904
128 1HB GLU 16 HB2 GLU 16 95.534 6.866 2.497
129 2HB GLU 16 HB1 GLU 16 96.726 8.063 2.983
130 1HG GLU 16 HG2 GLU 16 94.401 9.516 2.496
131 2HG GLU 16 HG1 GLU 16 93.871 8.061 3.339
132 H ILE 17 HN ILE 17 96.420 6.209 -0.262
133 HA ILE 17 HA ILE 17 99.313 6.139 0.001
134 HB ILE 17 HB ILE 17 97.284 4.254 -1.084
135 1HG1 ILE 17 HG12 ILE 17 98.592 2.635 0.181
136 2HG1 ILE 17 HG11 ILE 17 99.862 3.823 0.442
137 1HG2 ILE 17 HG21 ILE 17 98.751 4.479 -3.016
138 2HG2 ILE 17 HG22 ILE 17 98.982 2.912 -2.246
139 3HG2 ILE 17 HG23 ILE 17 100.161 4.199 -1.994
140 1HD1 ILE 17 HD11 ILE 17 98.821 3.992 2.431
141 2HD1 ILE 17 HD12 ILE 17 97.258 3.497 1.784
142 3HD1 ILE 17 HD13 ILE 17 97.832 5.146 1.540
143 H LEU 18 HN LEU 18 97.004 6.404 -2.661
144 HA LEU 18 HA LEU 18 98.840 6.925 -4.717
145 1HB LEU 18 HB2 LEU 18 95.897 7.252 -4.317
146 2HB LEU 18 HB1 LEU 18 96.634 8.108 -5.659
147 HG LEU 18 HG LEU 18 95.683 5.993 -6.390
148 1HD1 LEU 18 HD11 LEU 18 98.694 5.939 -6.437
149 2HD1 LEU 18 HD12 LEU 18 97.661 6.854 -7.535
150 3HD1 LEU 18 HD13 LEU 18 97.614 5.091 -7.545
151 1HD2 LEU 18 HD21 LEU 18 95.892 4.764 -4.287
152 2HD2 LEU 18 HD22 LEU 18 97.639 4.698 -4.502
153 3HD2 LEU 18 HD23 LEU 18 96.580 3.866 -5.638
154 H HIS 19 HN HIS 19 97.280 9.003 -2.370
155 HA HIS 19 HA HIS 19 97.906 11.437 -3.715
156 1HB HIS 19 HB2 HIS 19 96.556 10.641 -1.284
157 2HB HIS 19 HB1 HIS 19 97.645 11.989 -0.971
158 HD1 HIS 19 HD1 HIS 19 95.161 11.191 -3.756
159 HD2 HIS 19 HD2 HIS 19 96.290 14.301 -1.242
160 HE1 HIS 19 HE1 HIS 19 93.668 13.121 -4.363
161 HE2 HIS 19 HE2 HIS 19 94.337 14.979 -2.797
162 H LEU 20 HN LEU 20 99.240 9.843 -0.823
163 HA LEU 20 HA LEU 20 101.105 10.843 0.330
164 1HB LEU 20 HB2 LEU 20 101.761 8.720 -1.655
165 2HB LEU 20 HB1 LEU 20 102.965 9.318 -0.541
166 HG LEU 20 HG LEU 20 100.479 7.751 0.046
167 1HD1 LEU 20 HD11 LEU 20 102.334 6.361 -0.172
168 2HD1 LEU 20 HD12 LEU 20 102.184 6.604 1.569
169 3HD1 LEU 20 HD13 LEU 20 103.398 7.498 0.655
170 1HD2 LEU 20 HD21 LEU 20 100.110 9.327 1.672
171 2HD2 LEU 20 HD22 LEU 20 101.818 9.737 1.817
172 3HD2 LEU 20 HD23 LEU 20 101.209 8.239 2.519
173 HA PRO 21 HA PRO 21 102.391 14.036 -2.771
174 1HB PRO 21 HB2 PRO 21 102.494 15.530 -0.203
175 2HB PRO 21 HB1 PRO 21 101.843 16.026 -1.769
176 1HG PRO 21 HG2 PRO 21 100.220 15.356 0.240
177 2HG PRO 21 HG1 PRO 21 99.836 14.917 -1.436
178 1HD PRO 21 HD2 PRO 21 100.906 13.216 0.773
179 2HD PRO 21 HD1 PRO 21 99.753 12.805 -0.513
180 H ASN 22 HN ASN 22 104.373 13.139 -3.191
181 HA ASN 22 HA ASN 22 106.687 13.685 -3.119
182 1HB ASN 22 HB2 ASN 22 106.218 15.163 -1.077
183 2HB ASN 22 HB1 ASN 22 106.601 13.728 -0.131
184 1HD2 ASN 22 HD21 ASN 22 108.554 13.854 0.650
185 2HD2 ASN 22 HD22 ASN 22 109.951 14.439 -0.177
186 H LEU 23 HN LEU 23 105.005 11.370 -1.236
187 HA LEU 23 HA LEU 23 107.182 9.728 -0.497
188 1HB LEU 23 HB2 LEU 23 104.909 9.213 0.295
189 2HB LEU 23 HB1 LEU 23 104.433 8.820 -1.350
190 HG LEU 23 HG LEU 23 106.655 7.208 -0.882
191 1HD1 LEU 23 HD11 LEU 23 105.138 7.674 1.606
192 2HD1 LEU 23 HD12 LEU 23 106.822 7.212 1.359
193 3HD1 LEU 23 HD13 LEU 23 105.545 6.001 1.214
194 1HD2 LEU 23 HD21 LEU 23 105.157 6.011 -2.015
195 2HD2 LEU 23 HD22 LEU 23 103.803 6.920 -1.347
196 3HD2 LEU 23 HD23 LEU 23 104.491 5.575 -0.441
197 H ASN 24 HN ASN 24 108.298 8.049 -1.692
198 HA ASN 24 HA ASN 24 108.641 8.605 -4.424
199 1HB ASN 24 HB2 ASN 24 109.989 7.042 -2.717
200 2HB ASN 24 HB1 ASN 24 109.003 5.794 -3.472
201 1HD2 ASN 24 HD21 ASN 24 110.610 8.709 -4.698
202 2HD2 ASN 24 HD22 ASN 24 111.501 7.902 -5.938
203 H GLU 25 HN GLU 25 107.048 8.415 -6.016
204 HA GLU 25 HA GLU 25 104.634 7.178 -5.542
205 1HB GLU 25 HB2 GLU 25 104.169 7.522 -7.862
206 2HB GLU 25 HB1 GLU 25 105.128 8.884 -7.284
207 1HG GLU 25 HG2 GLU 25 106.436 6.544 -8.627
208 2HG GLU 25 HG1 GLU 25 105.681 7.826 -9.574
209 H GLU 26 HN GLU 26 107.655 5.822 -6.485
210 HA GLU 26 HA GLU 26 106.681 3.338 -7.511
211 1HB GLU 26 HB2 GLU 26 108.984 4.167 -7.949
212 2HB GLU 26 HB1 GLU 26 109.357 3.985 -6.241
213 1HG GLU 26 HG2 GLU 26 110.174 2.005 -6.895
214 2HG GLU 26 HG1 GLU 26 108.487 1.501 -6.801
215 H GLN 27 HN GLN 27 107.238 4.757 -4.464
216 HA GLN 27 HA GLN 27 107.082 2.338 -2.887
217 1HB GLN 27 HB2 GLN 27 107.537 5.183 -2.344
218 2HB GLN 27 HB1 GLN 27 106.488 4.415 -1.163
219 1HG GLN 27 HG2 GLN 27 108.152 2.816 -0.605
220 2HG GLN 27 HG1 GLN 27 109.166 3.311 -1.959
221 1HE2 GLN 27 HE21 GLN 27 109.625 3.218 0.981
222 2HE2 GLN 27 HE22 GLN 27 110.171 4.803 1.397
223 H ARG 28 HN ARG 28 105.026 4.960 -3.976
224 HA ARG 28 HA ARG 28 102.691 4.330 -2.544
225 1HB ARG 28 HB2 ARG 28 103.228 5.749 -5.141
226 2HB ARG 28 HB1 ARG 28 101.573 5.388 -4.670
227 1HG ARG 28 HG2 ARG 28 102.140 6.564 -2.472
228 2HG ARG 28 HG1 ARG 28 103.557 7.180 -3.325
229 1HD ARG 28 HD2 ARG 28 100.697 7.544 -4.215
230 2HD ARG 28 HD1 ARG 28 101.646 8.747 -3.378
231 HE ARG 28 HE ARG 28 102.766 7.745 -5.852
232 1HH1 ARG 28 HH11 ARG 28 100.953 10.268 -4.256
233 2HH1 ARG 28 HH12 ARG 28 101.241 11.432 -5.504
234 1HH2 ARG 28 HH21 ARG 28 103.139 9.279 -7.493
235 2HH2 ARG 28 HH22 ARG 28 102.479 10.872 -7.339
236 H ASN 29 HN ASN 29 103.632 3.494 -5.883
237 HA ASN 29 HA ASN 29 101.560 1.778 -6.502
238 1HB ASN 29 HB2 ASN 29 103.113 2.454 -8.209
239 2HB ASN 29 HB1 ASN 29 104.464 1.726 -7.347
240 1HD2 ASN 29 HD21 ASN 29 105.016 -0.286 -7.823
241 2HD2 ASN 29 HD22 ASN 29 104.095 -1.377 -8.795
242 H GLY 30 HN GLY 30 104.642 1.072 -4.869
243 1HA GLY 30 HA2 GLY 30 104.303 -1.702 -4.598
244 2HA GLY 30 HA1 GLY 30 105.257 -0.689 -3.523
245 H PHE 31 HN PHE 31 103.089 0.992 -2.719
246 HA PHE 31 HA PHE 31 102.092 -0.536 -0.548
247 1HB PHE 31 HB2 PHE 31 101.909 2.267 -1.481
248 2HB PHE 31 HB1 PHE 31 100.575 1.711 -0.474
249 HD1 PHE 31 HD1 PHE 31 101.348 0.361 1.653
250 HD2 PHE 31 HD2 PHE 31 103.730 3.215 -0.412
251 HE1 PHE 31 HE1 PHE 31 102.718 0.662 3.666
252 HE2 PHE 31 HE2 PHE 31 105.102 3.532 1.604
253 HZ PHE 31 HZ PHE 31 104.599 2.255 3.649
254 H ILE 32 HN ILE 32 100.758 0.488 -3.625
255 HA ILE 32 HA ILE 32 98.058 -0.216 -3.049
256 HB ILE 32 HB ILE 32 99.028 -0.322 -5.864
257 1HG1 ILE 32 HG12 ILE 32 98.853 2.231 -4.246
258 2HG1 ILE 32 HG11 ILE 32 100.290 1.569 -5.014
259 1HG2 ILE 32 HG21 ILE 32 96.607 -0.514 -4.913
260 2HG2 ILE 32 HG22 ILE 32 96.912 0.398 -6.390
261 3HG2 ILE 32 HG23 ILE 32 96.700 1.246 -4.858
262 1HD1 ILE 32 HD11 ILE 32 98.250 1.879 -6.977
263 2HD1 ILE 32 HD12 ILE 32 99.832 2.651 -6.878
264 3HD1 ILE 32 HD13 ILE 32 98.442 3.385 -6.082
265 H GLN 33 HN GLN 33 100.753 -1.881 -4.551
266 HA GLN 33 HA GLN 33 99.249 -4.169 -5.346
267 1HB GLN 33 HB2 GLN 33 101.667 -5.262 -5.278
268 2HB GLN 33 HB1 GLN 33 101.158 -4.191 -6.570
269 1HG GLN 33 HG2 GLN 33 102.269 -2.555 -4.569
270 2HG GLN 33 HG1 GLN 33 103.344 -3.936 -4.755
271 1HE2 GLN 33 HE21 GLN 33 104.920 -3.539 -6.115
272 2HE2 GLN 33 HE22 GLN 33 104.817 -2.609 -7.562
273 H SER 34 HN SER 34 101.401 -3.606 -2.540
274 HA SER 34 HA SER 34 101.054 -6.151 -1.398
275 1HB SER 34 HB2 SER 34 102.819 -4.456 -0.772
276 2HB SER 34 HB1 SER 34 101.570 -3.570 0.106
277 HG SER 34 HG SER 34 102.940 -5.225 1.261
278 H LEU 35 HN LEU 35 99.287 -3.126 -1.025
279 HA LEU 35 HA LEU 35 97.500 -4.117 0.992
280 1HB LEU 35 HB2 LEU 35 97.894 -1.779 0.934
281 2HB LEU 35 HB1 LEU 35 97.539 -1.682 -0.779
282 HG LEU 35 HG LEU 35 95.199 -1.987 -0.389
283 1HD1 LEU 35 HD11 LEU 35 96.105 -2.811 2.316
284 2HD1 LEU 35 HD12 LEU 35 94.852 -3.498 1.283
285 3HD1 LEU 35 HD13 LEU 35 94.542 -2.006 2.171
286 1HD2 LEU 35 HD21 LEU 35 96.707 0.120 0.935
287 2HD2 LEU 35 HD22 LEU 35 95.104 -0.119 1.630
288 3HD2 LEU 35 HD23 LEU 35 95.276 0.223 -0.091
289 H LYS 36 HN LYS 36 97.293 -3.592 -2.529
290 HA LYS 36 HA LYS 36 94.622 -4.158 -2.922
291 1HB LYS 36 HB2 LYS 36 97.047 -4.439 -4.630
292 2HB LYS 36 HB1 LYS 36 95.548 -5.165 -5.190
293 1HG LYS 36 HG2 LYS 36 95.699 -2.293 -4.336
294 2HG LYS 36 HG1 LYS 36 96.067 -2.810 -5.982
295 1HD LYS 36 HD2 LYS 36 93.895 -2.786 -6.455
296 2HD LYS 36 HD1 LYS 36 93.629 -4.041 -5.244
297 1HE LYS 36 HE2 LYS 36 92.761 -2.593 -3.763
298 2HE LYS 36 HE1 LYS 36 93.956 -1.350 -4.134
299 1HZ LYS 36 HZ1 LYS 36 91.707 -1.968 -5.957
300 2HZ LYS 36 HZ2 LYS 36 92.698 -0.598 -5.946
301 3HZ LYS 36 HZ3 LYS 36 91.569 -0.833 -4.709
302 H ASP 37 HN ASP 37 97.287 -6.589 -3.276
303 HA ASP 37 HA ASP 37 95.516 -8.743 -3.586
304 1HB ASP 37 HB2 ASP 37 98.383 -8.594 -2.657
305 2HB ASP 37 HB1 ASP 37 97.533 -10.124 -2.853
306 H ASP 38 HN ASP 38 97.243 -7.578 -0.731
307 HA ASP 38 HA ASP 38 95.559 -9.280 0.962
308 1HB ASP 38 HB2 ASP 38 98.244 -8.873 1.040
309 2HB ASP 38 HB1 ASP 38 97.695 -7.687 2.218
310 HA PRO 39 HA PRO 39 93.386 -5.352 1.681
311 1HB PRO 39 HB2 PRO 39 91.056 -6.422 2.454
312 2HB PRO 39 HB1 PRO 39 91.544 -6.414 0.753
313 1HG PRO 39 HG2 PRO 39 91.749 -8.629 2.766
314 2HG PRO 39 HG1 PRO 39 91.154 -8.695 1.097
315 1HD PRO 39 HD2 PRO 39 93.671 -9.443 1.796
316 2HD PRO 39 HD1 PRO 39 93.278 -8.750 0.209
317 H SER 40 HN SER 40 93.924 -8.056 3.824
318 HA SER 40 HA SER 40 92.950 -6.772 6.193
319 1HB SER 40 HB2 SER 40 94.549 -8.645 7.214
320 2HB SER 40 HB1 SER 40 92.976 -9.049 6.526
321 HG SER 40 HG SER 40 95.525 -9.578 5.576
322 H GLN 41 HN GLN 41 95.637 -6.343 4.247
323 HA GLN 41 HA GLN 41 97.440 -5.538 6.359
324 1HB GLN 41 HB2 GLN 41 97.700 -5.470 3.346
325 2HB GLN 41 HB1 GLN 41 98.972 -5.022 4.485
326 1HG GLN 41 HG2 GLN 41 98.842 -7.313 5.443
327 2HG GLN 41 HG1 GLN 41 97.744 -7.736 4.133
328 1HE2 GLN 41 HE21 GLN 41 100.609 -8.456 4.971
329 2HE2 GLN 41 HE22 GLN 41 101.496 -8.345 3.493
330 H SER 42 HN SER 42 94.870 -4.110 4.774
331 HA SER 42 HA SER 42 95.431 -1.630 3.941
332 1HB SER 42 HB2 SER 42 93.423 -1.040 5.758
333 2HB SER 42 HB1 SER 42 93.191 -1.646 4.125
334 HG SER 42 HG SER 42 92.924 -3.672 4.901
335 H ALA 43 HN ALA 43 95.361 -2.454 7.421
336 HA ALA 43 HA ALA 43 96.042 0.143 8.306
337 1HB ALA 43 HB1 ALA 43 96.814 -1.315 10.385
338 2HB ALA 43 HB2 ALA 43 95.883 -2.549 9.536
339 3HB ALA 43 HB3 ALA 43 95.114 -1.035 10.012
340 H ASN 44 HN ASN 44 97.988 -2.750 7.691
341 HA ASN 44 HA ASN 44 100.439 -1.710 8.608
342 1HB ASN 44 HB2 ASN 44 99.853 -4.142 8.105
343 2HB ASN 44 HB1 ASN 44 100.149 -3.757 6.412
344 1HD2 ASN 44 HD21 ASN 44 101.636 -3.652 9.613
345 2HD2 ASN 44 HD22 ASN 44 103.254 -3.911 9.064
346 H LEU 45 HN LEU 45 98.996 -1.808 5.358
347 HA LEU 45 HA LEU 45 101.213 -0.486 4.136
348 1HB LEU 45 HB2 LEU 45 98.462 -1.253 3.254
349 2HB LEU 45 HB1 LEU 45 99.398 -0.151 2.271
350 HG LEU 45 HG LEU 45 99.715 -2.307 1.346
351 1HD1 LEU 45 HD11 LEU 45 101.986 -1.133 2.791
352 2HD1 LEU 45 HD12 LEU 45 101.822 -1.582 1.097
353 3HD1 LEU 45 HD13 LEU 45 102.192 -2.813 2.302
354 1HD2 LEU 45 HD21 LEU 45 100.619 -3.402 3.978
355 2HD2 LEU 45 HD22 LEU 45 100.116 -4.269 2.525
356 3HD2 LEU 45 HD23 LEU 45 98.921 -3.412 3.500
357 H LEU 46 HN LEU 46 97.961 0.539 5.116
358 HA LEU 46 HA LEU 46 98.111 3.182 4.224
359 1HB LEU 46 HB2 LEU 46 96.018 2.184 4.926
360 2HB LEU 46 HB1 LEU 46 96.612 2.010 6.566
361 HG LEU 46 HG LEU 46 96.662 4.445 6.824
362 1HD1 LEU 46 HD11 LEU 46 96.472 4.395 3.977
363 2HD1 LEU 46 HD12 LEU 46 96.754 5.766 5.049
364 3HD1 LEU 46 HD13 LEU 46 95.106 5.298 4.632
365 1HD2 LEU 46 HD21 LEU 46 94.382 4.721 7.152
366 2HD2 LEU 46 HD22 LEU 46 94.572 2.968 7.177
367 3HD2 LEU 46 HD23 LEU 46 93.959 3.768 5.729
368 H ALA 47 HN ALA 47 98.790 1.873 7.468
369 HA ALA 47 HA ALA 47 99.648 4.299 8.599
370 1HB ALA 47 HB1 ALA 47 100.755 2.822 10.303
371 2HB ALA 47 HB2 ALA 47 100.238 1.441 9.337
372 3HB ALA 47 HB3 ALA 47 99.037 2.517 10.049
373 H GLU 48 HN GLU 48 101.524 1.603 7.222
374 HA GLU 48 HA GLU 48 104.065 2.676 7.614
375 1HB GLU 48 HB2 GLU 48 102.972 0.761 5.568
376 2HB GLU 48 HB1 GLU 48 104.668 1.222 5.582
377 1HG GLU 48 HG2 GLU 48 103.254 0.031 7.951
378 2HG GLU 48 HG1 GLU 48 104.118 -0.924 6.747
379 H ALA 49 HN ALA 49 101.894 2.988 4.817
380 HA ALA 49 HA ALA 49 103.670 4.586 3.286
381 1HB ALA 49 HB1 ALA 49 101.486 3.237 2.628
382 2HB ALA 49 HB2 ALA 49 102.039 4.623 1.690
383 3HB ALA 49 HB3 ALA 49 100.738 4.816 2.865
384 H LYS 50 HN LYS 50 101.078 5.322 5.563
385 HA LYS 50 HA LYS 50 100.990 8.105 5.072
386 1HB LYS 50 HB2 LYS 50 99.946 6.258 7.133
387 2HB LYS 50 HB1 LYS 50 100.136 7.932 7.632
388 1HG LYS 50 HG2 LYS 50 98.662 7.153 5.136
389 2HG LYS 50 HG1 LYS 50 97.878 7.268 6.713
390 1HD LYS 50 HD2 LYS 50 97.559 9.429 6.243
391 2HD LYS 50 HD1 LYS 50 99.289 9.634 6.522
392 1HE LYS 50 HE2 LYS 50 99.778 9.733 4.292
393 2HE LYS 50 HE1 LYS 50 98.406 8.726 3.835
394 1HZ LYS 50 HZ1 LYS 50 97.534 10.666 3.179
395 2HZ LYS 50 HZ2 LYS 50 98.567 11.596 4.142
396 3HZ LYS 50 HZ3 LYS 50 97.183 10.898 4.818
397 H LYS 51 HN LYS 51 102.497 6.288 7.765
398 HA LYS 51 HA LYS 51 103.761 8.477 8.943
399 1HB LYS 51 HB2 LYS 51 104.549 5.559 8.942
400 2HB LYS 51 HB1 LYS 51 105.250 6.777 9.999
401 1HG LYS 51 HG2 LYS 51 103.039 7.184 10.979
402 2HG LYS 51 HG1 LYS 51 102.360 5.932 9.938
403 1HD LYS 51 HD2 LYS 51 102.865 4.433 11.502
404 2HD LYS 51 HD1 LYS 51 104.573 4.762 11.208
405 1HE LYS 51 HE2 LYS 51 104.280 5.090 13.514
406 2HE LYS 51 HE1 LYS 51 104.310 6.712 12.824
407 1HZ LYS 51 HZ1 LYS 51 102.377 7.060 13.817
408 2HZ LYS 51 HZ2 LYS 51 102.258 5.446 14.308
409 3HZ LYS 51 HZ3 LYS 51 101.665 5.915 12.795
410 H LEU 52 HN LEU 52 104.955 6.182 6.502
411 HA LEU 52 HA LEU 52 107.579 7.081 6.332
412 1HB LEU 52 HB2 LEU 52 106.998 5.093 5.182
413 2HB LEU 52 HB1 LEU 52 105.734 5.897 4.272
414 HG LEU 52 HG LEU 52 107.423 7.149 3.014
415 1HD1 LEU 52 HD11 LEU 52 109.091 6.956 4.986
416 2HD1 LEU 52 HD12 LEU 52 109.697 6.977 3.330
417 3HD1 LEU 52 HD13 LEU 52 109.568 5.449 4.203
418 1HD2 LEU 52 HD21 LEU 52 108.419 4.387 2.745
419 2HD2 LEU 52 HD22 LEU 52 107.745 5.476 1.533
420 3HD2 LEU 52 HD23 LEU 52 106.673 4.598 2.624
421 H ASN 53 HN ASN 53 104.816 8.086 4.311
422 HA ASN 53 HA ASN 53 106.131 10.149 2.928
423 1HB ASN 53 HB2 ASN 53 103.936 9.213 2.270
424 2HB ASN 53 HB1 ASN 53 103.199 9.975 3.677
425 1HD2 ASN 53 HD21 ASN 53 102.019 11.614 3.021
426 2HD2 ASN 53 HD22 ASN 53 102.488 12.807 1.863
427 H ASP 54 HN ASP 54 104.667 10.044 6.113
428 HA ASP 54 HA ASP 54 104.484 12.813 6.564
429 1HB ASP 54 HB2 ASP 54 104.363 10.366 8.180
430 2HB ASP 54 HB1 ASP 54 104.970 11.768 9.056
431 H ALA 55 HN ALA 55 107.089 10.493 7.284
432 HA ALA 55 HA ALA 55 108.807 12.583 8.290
433 1HB ALA 55 HB1 ALA 55 110.479 10.599 8.300
434 2HB ALA 55 HB2 ALA 55 109.044 9.623 7.989
435 3HB ALA 55 HB3 ALA 55 109.136 10.616 9.443
436 H GLN 56 HN GLN 56 108.430 10.809 5.282
437 HA GLN 56 HA GLN 56 110.886 12.011 4.249
438 1HB GLN 56 HB2 GLN 56 110.861 10.438 2.496
439 2HB GLN 56 HB1 GLN 56 110.387 9.543 3.929
440 1HG GLN 56 HG2 GLN 56 108.537 8.866 2.930
441 2HG GLN 56 HG1 GLN 56 108.038 10.532 2.656
442 1HE2 GLN 56 HE21 GLN 56 109.832 11.452 0.880
443 2HE2 GLN 56 HE22 GLN 56 109.747 10.559 -0.597
444 H ALA 57 HN ALA 57 107.885 13.082 4.591
445 HA ALA 57 HA ALA 57 108.118 14.861 2.321
446 1HB ALA 57 HB1 ALA 57 106.839 12.833 1.528
447 2HB ALA 57 HB2 ALA 57 106.046 14.396 1.315
448 3HB ALA 57 HB3 ALA 57 105.553 13.333 2.626
449 HA PRO 58 HA PRO 58 106.122 17.488 5.300
450 1HB PRO 58 HB2 PRO 58 106.045 19.734 3.880
451 2HB PRO 58 HB1 PRO 58 107.593 19.014 4.338
452 1HG PRO 58 HG2 PRO 58 106.194 18.986 1.706
453 2HG PRO 58 HG1 PRO 58 107.928 19.078 2.056
454 1HD PRO 58 HD2 PRO 58 106.482 16.766 1.354
455 2HD PRO 58 HD1 PRO 58 108.131 16.819 2.005
456 H LYS 59 HN LYS 59 104.566 16.189 2.667
457 HA LYS 59 HA LYS 59 102.381 15.965 2.105
458 1HB LYS 59 HB2 LYS 59 102.278 16.956 4.825
459 2HB LYS 59 HB1 LYS 59 100.915 17.551 3.888
460 1HG LYS 59 HG2 LYS 59 100.478 15.183 3.195
461 2HG LYS 59 HG1 LYS 59 101.701 14.690 4.367
462 1HD LYS 59 HD2 LYS 59 99.237 16.303 5.023
463 2HD LYS 59 HD1 LYS 59 99.388 14.559 5.250
464 1HE LYS 59 HE2 LYS 59 101.196 16.606 6.527
465 2HE LYS 59 HE1 LYS 59 99.788 15.895 7.315
466 1HZ LYS 59 HZ1 LYS 59 101.580 13.940 6.210
467 2HZ LYS 59 HZ2 LYS 59 100.900 14.031 7.756
468 3HZ LYS 59 HZ3 LYS 59 102.305 14.902 7.398
469 H ALA 60 HN ALA 60 103.233 17.339 0.317
470 HA ALA 60 HA ALA 60 101.377 19.415 -0.259
471 1HB ALA 60 HB1 ALA 60 102.545 21.320 0.049
472 2HB ALA 60 HB2 ALA 60 104.088 20.567 -0.353
473 3HB ALA 60 HB3 ALA 60 103.396 20.356 1.255
Start of MODEL 9
1 1H GLY -1 HT1 GLY -1 96.193 0.447 -15.623
2 2H GLY -1 HT2 GLY -1 96.312 -0.700 -16.860
3 3H GLY -1 HT3 GLY -1 96.306 -1.198 -15.244
4 1HA GLY -1 HA1 GLY -1 94.062 -0.091 -16.824
5 2HA GLY -1 HA2 GLY -1 94.160 -1.664 -16.047
6 H SER 0 HN SER 0 95.401 -0.445 -13.629
7 HA SER 0 HA SER 0 94.734 0.306 -11.589
8 1HB SER 0 HB2 SER 0 94.532 2.448 -12.882
9 2HB SER 0 HB1 SER 0 92.825 2.081 -13.125
10 HG SER 0 HG SER 0 92.762 1.937 -10.735
11 H THR 1 HN THR 1 93.781 -1.975 -11.628
12 HA THR 1 HA THR 1 90.855 -1.960 -11.529
13 HB THR 1 HB THR 1 91.127 -4.454 -11.355
14 HG1 THR 1 HG1 THR 1 93.307 -4.347 -10.540
15 1HG2 THR 1 HG21 THR 1 92.660 -3.600 -13.757
16 2HG2 THR 1 HG22 THR 1 90.980 -3.098 -13.571
17 3HG2 THR 1 HG23 THR 1 91.389 -4.813 -13.600
18 H ALA 2 HN ALA 2 89.711 -2.693 -9.721
19 HA ALA 2 HA ALA 2 91.230 -3.051 -7.239
20 1HB ALA 2 HB1 ALA 2 90.353 -1.280 -6.151
21 2HB ALA 2 HB2 ALA 2 88.799 -1.406 -6.975
22 3HB ALA 2 HB3 ALA 2 90.165 -0.635 -7.782
23 H ASP 3 HN ASP 3 90.620 -5.273 -7.570
24 HA ASP 3 HA ASP 3 87.775 -5.879 -7.245
25 1HB ASP 3 HB2 ASP 3 90.146 -7.631 -7.919
26 2HB ASP 3 HB1 ASP 3 88.512 -8.243 -7.679
27 H ASN 4 HN ASN 4 88.089 -4.922 -5.002
28 HA ASN 4 HA ASN 4 88.325 -7.115 -3.138
29 1HB ASN 4 HB2 ASN 4 90.536 -5.357 -3.539
30 2HB ASN 4 HB1 ASN 4 89.852 -5.012 -1.953
31 1HD2 ASN 4 HD21 ASN 4 91.184 -5.952 -0.568
32 2HD2 ASN 4 HD22 ASN 4 91.675 -7.608 -0.611
33 H LYS 5 HN LYS 5 87.397 -6.642 -1.075
34 HA LYS 5 HA LYS 5 85.118 -5.084 -1.114
35 1HB LYS 5 HB2 LYS 5 85.797 -6.911 0.547
36 2HB LYS 5 HB1 LYS 5 86.643 -5.649 1.424
37 1HG LYS 5 HG2 LYS 5 83.808 -5.149 0.732
38 2HG LYS 5 HG1 LYS 5 84.145 -6.355 1.976
39 1HD LYS 5 HD2 LYS 5 85.413 -3.640 2.056
40 2HD LYS 5 HD1 LYS 5 83.795 -3.911 2.705
41 1HE LYS 5 HE2 LYS 5 85.020 -4.290 4.591
42 2HE LYS 5 HE1 LYS 5 85.013 -5.920 3.919
43 1HZ LYS 5 HZ1 LYS 5 87.224 -4.780 4.688
44 2HZ LYS 5 HZ2 LYS 5 87.176 -4.108 3.137
45 3HZ LYS 5 HZ3 LYS 5 87.195 -5.788 3.329
46 H PHE 6 HN PHE 6 87.677 -4.222 1.209
47 HA PHE 6 HA PHE 6 88.376 -2.224 1.970
48 1HB PHE 6 HB2 PHE 6 88.344 -1.744 -1.005
49 2HB PHE 6 HB1 PHE 6 89.036 -0.602 0.143
50 HD1 PHE 6 HD1 PHE 6 90.263 -2.445 -2.184
51 HD2 PHE 6 HD2 PHE 6 90.235 -2.537 2.064
52 HE1 PHE 6 HE1 PHE 6 92.387 -3.695 -2.196
53 HE2 PHE 6 HE2 PHE 6 92.352 -3.771 2.066
54 HZ PHE 6 HZ PHE 6 93.435 -4.362 -0.064
55 H ASN 7 HN ASN 7 86.080 -2.078 2.864
56 HA ASN 7 HA ASN 7 84.086 -0.504 1.796
57 1HB ASN 7 HB2 ASN 7 83.840 0.171 4.415
58 2HB ASN 7 HB1 ASN 7 83.274 -1.343 3.731
59 1HD2 ASN 7 HD21 ASN 7 83.485 -2.418 5.679
60 2HD2 ASN 7 HD22 ASN 7 85.023 -2.842 6.342
61 H LYS 8 HN LYS 8 83.509 1.660 3.308
62 HA LYS 8 HA LYS 8 84.867 3.718 2.079
63 1HB LYS 8 HB2 LYS 8 82.719 4.136 3.026
64 2HB LYS 8 HB1 LYS 8 83.266 3.677 4.632
65 1HG LYS 8 HG2 LYS 8 84.668 5.946 3.356
66 2HG LYS 8 HG1 LYS 8 82.994 6.214 3.846
67 1HD LYS 8 HD2 LYS 8 83.502 6.172 6.039
68 2HD LYS 8 HD1 LYS 8 84.644 4.841 5.847
69 1HE LYS 8 HE2 LYS 8 86.389 6.289 5.224
70 2HE LYS 8 HE1 LYS 8 85.281 7.627 4.923
71 1HZ LYS 8 HZ1 LYS 8 85.288 6.574 7.630
72 2HZ LYS 8 HZ2 LYS 8 85.219 8.176 7.091
73 3HZ LYS 8 HZ3 LYS 8 86.704 7.368 7.152
74 H GLU 9 HN GLU 9 85.311 2.555 5.413
75 HA GLU 9 HA GLU 9 87.359 4.352 6.090
76 1HB GLU 9 HB2 GLU 9 86.199 1.894 7.229
77 2HB GLU 9 HB1 GLU 9 87.855 2.232 7.715
78 1HG GLU 9 HG2 GLU 9 85.963 4.491 7.849
79 2HG GLU 9 HG1 GLU 9 85.712 3.179 9.001
80 H GLN 10 HN GLN 10 87.500 1.090 4.718
81 HA GLN 10 HA GLN 10 90.365 0.977 4.876
82 1HB GLN 10 HB2 GLN 10 88.523 -0.939 4.792
83 2HB GLN 10 HB1 GLN 10 88.873 -0.848 3.073
84 1HG GLN 10 HG2 GLN 10 90.997 -1.632 3.316
85 2HG GLN 10 HG1 GLN 10 91.156 -1.018 4.959
86 1HE2 GLN 10 HE21 GLN 10 91.894 -3.598 4.117
87 2HE2 GLN 10 HE22 GLN 10 90.913 -4.736 4.955
88 H GLN 11 HN GLN 11 88.034 1.442 2.226
89 HA GLN 11 HA GLN 11 89.816 1.446 0.100
90 1HB GLN 11 HB2 GLN 11 87.287 1.528 0.008
91 2HB GLN 11 HB1 GLN 11 87.415 3.258 0.272
92 1HG GLN 11 HG2 GLN 11 87.298 3.209 -1.996
93 2HG GLN 11 HG1 GLN 11 89.045 3.112 -1.782
94 1HE2 GLN 11 HE21 GLN 11 90.116 1.339 -2.458
95 2HE2 GLN 11 HE22 GLN 11 89.370 -0.016 -3.228
96 H ASN 12 HN ASN 12 89.067 4.014 2.378
97 HA ASN 12 HA ASN 12 90.108 6.207 1.054
98 1HB ASN 12 HB2 ASN 12 89.359 5.563 3.736
99 2HB ASN 12 HB1 ASN 12 90.908 6.399 3.785
100 1HD2 ASN 12 HD21 ASN 12 91.050 8.464 2.696
101 2HD2 ASN 12 HD22 ASN 12 89.649 9.470 2.605
102 H ALA 13 HN ALA 13 91.749 3.547 2.589
103 HA ALA 13 HA ALA 13 94.302 4.585 2.894
104 1HB ALA 13 HB1 ALA 13 93.244 2.219 3.429
105 2HB ALA 13 HB2 ALA 13 94.984 2.433 3.241
106 3HB ALA 13 HB3 ALA 13 94.024 1.797 1.905
107 H PHE 14 HN PHE 14 92.854 3.004 0.029
108 HA PHE 14 HA PHE 14 95.086 3.038 -1.622
109 1HB PHE 14 HB2 PHE 14 93.008 1.848 -2.128
110 2HB PHE 14 HB1 PHE 14 92.172 3.371 -2.353
111 HD1 PHE 14 HD1 PHE 14 94.814 1.190 -3.745
112 HD2 PHE 14 HD2 PHE 14 92.251 4.524 -4.396
113 HE1 PHE 14 HE1 PHE 14 95.420 1.189 -6.132
114 HE2 PHE 14 HE2 PHE 14 92.853 4.526 -6.781
115 HZ PHE 14 HZ PHE 14 94.436 2.855 -7.651
116 H TRP 15 HN TRP 15 92.423 5.375 -1.574
117 HA TRP 15 HA TRP 15 93.480 7.159 -3.423
118 1HB TRP 15 HB2 TRP 15 91.411 7.293 -1.327
119 2HB TRP 15 HB1 TRP 15 92.067 8.838 -1.854
120 HD1 TRP 15 HD1 TRP 15 90.800 5.655 -3.700
121 HE1 TRP 15 HE1 TRP 15 89.315 6.432 -5.656
122 HE3 TRP 15 HE3 TRP 15 91.177 10.710 -3.044
123 HZ2 TRP 15 HZ2 TRP 15 88.428 8.870 -6.776
124 HZ3 TRP 15 HZ3 TRP 15 89.984 12.196 -4.602
125 HH2 TRP 15 HH2 TRP 15 88.638 11.292 -6.429
126 H GLU 16 HN GLU 16 94.063 6.966 0.041
127 HA GLU 16 HA GLU 16 95.508 9.461 0.125
128 1HB GLU 16 HB2 GLU 16 94.783 7.368 2.025
129 2HB GLU 16 HB1 GLU 16 96.414 7.968 2.290
130 1HG GLU 16 HG2 GLU 16 95.282 9.429 3.592
131 2HG GLU 16 HG1 GLU 16 95.197 10.305 2.065
132 H ILE 17 HN ILE 17 96.503 6.065 0.364
133 HA ILE 17 HA ILE 17 99.234 6.401 0.265
134 HB ILE 17 HB ILE 17 97.720 4.146 -1.063
135 1HG1 ILE 17 HG12 ILE 17 98.959 3.892 1.633
136 2HG1 ILE 17 HG11 ILE 17 97.452 4.792 1.519
137 1HG2 ILE 17 HG21 ILE 17 99.677 2.943 -1.158
138 2HG2 ILE 17 HG22 ILE 17 100.441 3.875 0.129
139 3HG2 ILE 17 HG23 ILE 17 100.274 4.570 -1.483
140 1HD1 ILE 17 HD11 ILE 17 97.981 1.906 1.053
141 2HD1 ILE 17 HD12 ILE 17 96.659 2.685 0.184
142 3HD1 ILE 17 HD13 ILE 17 96.678 2.688 1.948
143 H LEU 18 HN LEU 18 96.980 6.196 -2.470
144 HA LEU 18 HA LEU 18 98.821 6.171 -4.535
145 1HB LEU 18 HB2 LEU 18 95.972 6.873 -4.213
146 2HB LEU 18 HB1 LEU 18 96.758 7.607 -5.601
147 HG LEU 18 HG LEU 18 95.724 5.599 -6.340
148 1HD1 LEU 18 HD11 LEU 18 98.060 4.167 -6.541
149 2HD1 LEU 18 HD12 LEU 18 98.627 5.823 -6.308
150 3HD1 LEU 18 HD13 LEU 18 97.529 5.444 -7.635
151 1HD2 LEU 18 HD21 LEU 18 96.524 3.403 -5.307
152 2HD2 LEU 18 HD22 LEU 18 95.333 4.351 -4.423
153 3HD2 LEU 18 HD23 LEU 18 97.028 4.384 -3.936
154 H HIS 19 HN HIS 19 97.266 8.987 -3.048
155 HA HIS 19 HA HIS 19 98.608 10.839 -4.724
156 1HB HIS 19 HB2 HIS 19 96.452 10.966 -3.060
157 2HB HIS 19 HB1 HIS 19 97.653 11.859 -2.138
158 HD1 HIS 19 HD1 HIS 19 95.012 12.817 -3.912
159 HD2 HIS 19 HD2 HIS 19 99.049 13.495 -4.625
160 HE1 HIS 19 HE1 HIS 19 95.101 14.857 -5.378
161 HE2 HIS 19 HE2 HIS 19 97.546 15.171 -5.899
162 H LEU 20 HN LEU 20 99.056 10.098 -1.266
163 HA LEU 20 HA LEU 20 100.667 11.011 0.142
164 1HB LEU 20 HB2 LEU 20 102.080 9.075 -1.642
165 2HB LEU 20 HB1 LEU 20 102.812 9.745 -0.206
166 HG LEU 20 HG LEU 20 100.371 7.981 -0.339
167 1HD1 LEU 20 HD11 LEU 20 101.689 6.290 0.277
168 2HD1 LEU 20 HD12 LEU 20 102.566 7.279 1.444
169 3HD1 LEU 20 HD13 LEU 20 103.026 7.307 -0.259
170 1HD2 LEU 20 HD21 LEU 20 100.916 8.233 2.300
171 2HD2 LEU 20 HD22 LEU 20 99.682 9.158 1.445
172 3HD2 LEU 20 HD23 LEU 20 101.274 9.862 1.727
173 HA PRO 21 HA PRO 21 101.942 14.304 -3.101
174 1HB PRO 21 HB2 PRO 21 101.272 15.721 -0.551
175 2HB PRO 21 HB1 PRO 21 101.026 16.242 -2.222
176 1HG PRO 21 HG2 PRO 21 99.017 15.246 -0.760
177 2HG PRO 21 HG1 PRO 21 99.152 14.929 -2.498
178 1HD PRO 21 HD2 PRO 21 99.579 13.107 -0.219
179 2HD PRO 21 HD1 PRO 21 99.190 12.741 -1.905
180 H ASN 22 HN ASN 22 104.040 13.411 -2.980
181 HA ASN 22 HA ASN 22 106.179 14.623 -2.518
182 1HB ASN 22 HB2 ASN 22 105.195 14.160 0.298
183 2HB ASN 22 HB1 ASN 22 106.910 14.342 -0.054
184 1HD2 ASN 22 HD21 ASN 22 105.547 16.060 1.614
185 2HD2 ASN 22 HD22 ASN 22 105.490 17.622 0.884
186 H LEU 23 HN LEU 23 105.112 11.980 -0.370
187 HA LEU 23 HA LEU 23 107.215 10.375 -0.287
188 1HB LEU 23 HB2 LEU 23 104.959 9.844 0.614
189 2HB LEU 23 HB1 LEU 23 104.484 9.317 -0.989
190 HG LEU 23 HG LEU 23 106.915 8.010 -0.047
191 1HD1 LEU 23 HD11 LEU 23 104.464 7.943 1.625
192 2HD1 LEU 23 HD12 LEU 23 106.161 7.910 2.102
193 3HD1 LEU 23 HD13 LEU 23 105.407 6.467 1.420
194 1HD2 LEU 23 HD21 LEU 23 106.190 6.514 -1.497
195 2HD2 LEU 23 HD22 LEU 23 104.797 7.540 -1.811
196 3HD2 LEU 23 HD23 LEU 23 104.703 6.280 -0.583
197 H ASN 24 HN ASN 24 108.040 8.560 -1.417
198 HA ASN 24 HA ASN 24 108.459 9.051 -4.187
199 1HB ASN 24 HB2 ASN 24 109.770 7.559 -2.307
200 2HB ASN 24 HB1 ASN 24 108.956 6.300 -3.229
201 1HD2 ASN 24 HD21 ASN 24 110.730 5.454 -4.191
202 2HD2 ASN 24 HD22 ASN 24 111.697 6.304 -5.343
203 H GLU 25 HN GLU 25 106.873 8.795 -5.684
204 HA GLU 25 HA GLU 25 104.518 7.417 -5.271
205 1HB GLU 25 HB2 GLU 25 104.573 9.055 -6.954
206 2HB GLU 25 HB1 GLU 25 105.952 8.310 -7.755
207 1HG GLU 25 HG2 GLU 25 104.610 6.523 -8.585
208 2HG GLU 25 HG1 GLU 25 103.238 7.021 -7.595
209 H GLU 26 HN GLU 26 107.625 6.224 -6.171
210 HA GLU 26 HA GLU 26 106.773 3.710 -7.250
211 1HB GLU 26 HB2 GLU 26 109.013 4.693 -7.712
212 2HB GLU 26 HB1 GLU 26 109.435 4.468 -6.020
213 1HG GLU 26 HG2 GLU 26 108.939 1.997 -6.402
214 2HG GLU 26 HG1 GLU 26 108.968 2.384 -8.121
215 H GLN 27 HN GLN 27 107.312 5.076 -4.166
216 HA GLN 27 HA GLN 27 107.369 2.590 -2.685
217 1HB GLN 27 HB2 GLN 27 107.724 5.404 -2.062
218 2HB GLN 27 HB1 GLN 27 106.614 4.647 -0.928
219 1HG GLN 27 HG2 GLN 27 108.221 3.377 0.011
220 2HG GLN 27 HG1 GLN 27 109.086 3.153 -1.508
221 1HE2 GLN 27 HE21 GLN 27 110.361 4.961 -2.289
222 2HE2 GLN 27 HE22 GLN 27 111.106 6.021 -1.147
223 H ARG 28 HN ARG 28 105.110 5.118 -3.592
224 HA ARG 28 HA ARG 28 102.854 4.290 -2.169
225 1HB ARG 28 HB2 ARG 28 103.034 5.573 -4.909
226 2HB ARG 28 HB1 ARG 28 101.543 5.395 -3.997
227 1HG ARG 28 HG2 ARG 28 102.858 6.687 -2.149
228 2HG ARG 28 HG1 ARG 28 103.860 7.198 -3.507
229 1HD ARG 28 HD2 ARG 28 101.219 7.529 -4.355
230 2HD ARG 28 HD1 ARG 28 101.243 8.110 -2.716
231 HE ARG 28 HE ARG 28 102.772 9.778 -3.336
232 1HH1 ARG 28 HH11 ARG 28 101.823 7.791 -6.052
233 2HH1 ARG 28 HH12 ARG 28 102.393 8.923 -7.230
234 1HH2 ARG 28 HH21 ARG 28 103.526 11.254 -4.890
235 2HH2 ARG 28 HH22 ARG 28 103.365 10.881 -6.574
236 H ASN 29 HN ASN 29 103.763 3.559 -5.538
237 HA ASN 29 HA ASN 29 101.815 1.707 -6.165
238 1HB ASN 29 HB2 ASN 29 103.944 2.680 -7.488
239 2HB ASN 29 HB1 ASN 29 104.576 1.088 -7.078
240 1HD2 ASN 29 HD21 ASN 29 103.524 -0.757 -7.881
241 2HD2 ASN 29 HD22 ASN 29 102.489 -0.671 -9.262
242 H GLY 30 HN GLY 30 104.996 1.096 -4.644
243 1HA GLY 30 HA2 GLY 30 104.704 -1.678 -4.349
244 2HA GLY 30 HA1 GLY 30 105.670 -0.650 -3.294
245 H PHE 31 HN PHE 31 103.523 0.995 -2.409
246 HA PHE 31 HA PHE 31 102.553 -0.581 -0.243
247 1HB PHE 31 HB2 PHE 31 102.452 2.251 -1.071
248 2HB PHE 31 HB1 PHE 31 101.092 1.708 -0.092
249 HD1 PHE 31 HD1 PHE 31 101.943 0.099 1.921
250 HD2 PHE 31 HD2 PHE 31 104.155 3.248 0.108
251 HE1 PHE 31 HE1 PHE 31 103.311 0.293 3.951
252 HE2 PHE 31 HE2 PHE 31 105.528 3.454 2.138
253 HZ PHE 31 HZ PHE 31 105.109 1.976 4.065
254 H ILE 32 HN ILE 32 100.985 0.952 -3.040
255 HA ILE 32 HA ILE 32 98.356 0.141 -2.485
256 HB ILE 32 HB ILE 32 98.764 0.018 -5.320
257 1HG1 ILE 32 HG12 ILE 32 100.844 1.374 -4.526
258 2HG1 ILE 32 HG11 ILE 32 99.916 1.882 -5.910
259 1HG2 ILE 32 HG21 ILE 32 97.131 1.702 -5.385
260 2HG2 ILE 32 HG22 ILE 32 97.496 2.235 -3.744
261 3HG2 ILE 32 HG23 ILE 32 96.732 0.669 -4.014
262 1HD1 ILE 32 HD11 ILE 32 100.470 3.789 -4.545
263 2HD1 ILE 32 HD12 ILE 32 99.741 3.024 -3.134
264 3HD1 ILE 32 HD13 ILE 32 98.730 3.511 -4.492
265 H GLN 33 HN GLN 33 100.858 -1.332 -4.458
266 HA GLN 33 HA GLN 33 99.420 -3.561 -5.357
267 1HB GLN 33 HB2 GLN 33 102.378 -3.324 -4.780
268 2HB GLN 33 HB1 GLN 33 101.637 -4.635 -5.688
269 1HG GLN 33 HG2 GLN 33 101.320 -1.775 -6.518
270 2HG GLN 33 HG1 GLN 33 102.720 -2.734 -6.996
271 1HE2 GLN 33 HE21 GLN 33 102.539 -4.119 -8.653
272 2HE2 GLN 33 HE22 GLN 33 101.078 -4.434 -9.519
273 H SER 34 HN SER 34 101.538 -3.268 -2.500
274 HA SER 34 HA SER 34 101.150 -5.900 -1.579
275 1HB SER 34 HB2 SER 34 103.007 -4.611 -0.751
276 2HB SER 34 HB1 SER 34 101.928 -3.381 -0.093
277 HG SER 34 HG SER 34 102.797 -5.050 1.400
278 H LEU 35 HN LEU 35 99.401 -2.905 -0.920
279 HA LEU 35 HA LEU 35 97.632 -4.119 1.016
280 1HB LEU 35 HB2 LEU 35 97.909 -1.831 1.374
281 2HB LEU 35 HB1 LEU 35 97.794 -1.445 -0.333
282 HG LEU 35 HG LEU 35 95.404 -1.805 -0.312
283 1HD1 LEU 35 HD11 LEU 35 94.592 -3.319 1.100
284 2HD1 LEU 35 HD12 LEU 35 94.672 -2.075 2.342
285 3HD1 LEU 35 HD13 LEU 35 96.005 -3.215 2.148
286 1HD2 LEU 35 HD21 LEU 35 96.733 0.233 1.076
287 2HD2 LEU 35 HD22 LEU 35 95.358 -0.215 2.085
288 3HD2 LEU 35 HD23 LEU 35 95.100 0.274 0.409
289 H LYS 36 HN LYS 36 97.670 -3.457 -2.404
290 HA LYS 36 HA LYS 36 94.911 -3.958 -2.870
291 1HB LYS 36 HB2 LYS 36 96.239 -2.501 -4.326
292 2HB LYS 36 HB1 LYS 36 97.224 -3.874 -4.810
293 1HG LYS 36 HG2 LYS 36 94.381 -4.335 -5.205
294 2HG LYS 36 HG1 LYS 36 94.985 -2.942 -6.101
295 1HD LYS 36 HD2 LYS 36 96.599 -5.431 -6.173
296 2HD LYS 36 HD1 LYS 36 95.088 -5.408 -7.083
297 1HE LYS 36 HE2 LYS 36 95.798 -3.532 -8.366
298 2HE LYS 36 HE1 LYS 36 97.200 -3.278 -7.328
299 1HZ LYS 36 HZ1 LYS 36 96.812 -5.183 -9.486
300 2HZ LYS 36 HZ2 LYS 36 97.637 -5.769 -8.131
301 3HZ LYS 36 HZ3 LYS 36 98.225 -4.416 -8.957
302 H ASP 37 HN ASP 37 97.646 -6.076 -2.465
303 HA ASP 37 HA ASP 37 96.352 -8.198 -3.976
304 1HB ASP 37 HB2 ASP 37 99.054 -7.659 -2.978
305 2HB ASP 37 HB1 ASP 37 98.527 -9.319 -2.716
306 H ASP 38 HN ASP 38 96.277 -6.862 -0.894
307 HA ASP 38 HA ASP 38 94.787 -9.107 0.162
308 1HB ASP 38 HB2 ASP 38 97.427 -9.216 0.659
309 2HB ASP 38 HB1 ASP 38 96.929 -8.175 1.992
310 HA PRO 39 HA PRO 39 92.898 -5.527 2.029
311 1HB PRO 39 HB2 PRO 39 90.738 -6.695 3.061
312 2HB PRO 39 HB1 PRO 39 90.957 -6.556 1.312
313 1HG PRO 39 HG2 PRO 39 91.356 -8.919 3.092
314 2HG PRO 39 HG1 PRO 39 90.689 -8.849 1.452
315 1HD PRO 39 HD2 PRO 39 93.308 -9.554 2.115
316 2HD PRO 39 HD1 PRO 39 92.748 -9.058 0.507
317 H SER 40 HN SER 40 93.508 -8.454 3.910
318 HA SER 40 HA SER 40 93.006 -7.322 6.455
319 1HB SER 40 HB2 SER 40 94.802 -9.655 5.758
320 2HB SER 40 HB1 SER 40 94.144 -9.288 7.352
321 HG SER 40 HG SER 40 92.603 -9.866 5.039
322 H GLN 41 HN GLN 41 95.456 -6.657 4.275
323 HA GLN 41 HA GLN 41 97.456 -6.061 6.315
324 1HB GLN 41 HB2 GLN 41 97.559 -5.955 3.297
325 2HB GLN 41 HB1 GLN 41 98.907 -5.562 4.357
326 1HG GLN 41 HG2 GLN 41 97.556 -8.223 4.518
327 2HG GLN 41 HG1 GLN 41 98.803 -7.900 3.314
328 1HE2 GLN 41 HE21 GLN 41 98.135 -7.885 6.772
329 2HE2 GLN 41 HE22 GLN 41 99.762 -8.180 7.274
330 H SER 42 HN SER 42 94.953 -4.499 4.674
331 HA SER 42 HA SER 42 95.721 -2.020 3.955
332 1HB SER 42 HB2 SER 42 93.433 -2.445 3.785
333 2HB SER 42 HB1 SER 42 93.295 -2.912 5.479
334 HG SER 42 HG SER 42 93.140 -0.434 4.323
335 H ALA 43 HN ALA 43 95.619 -3.159 7.284
336 HA ALA 43 HA ALA 43 95.962 -0.556 8.423
337 1HB ALA 43 HB1 ALA 43 95.680 -1.574 10.405
338 2HB ALA 43 HB2 ALA 43 96.827 -2.859 10.026
339 3HB ALA 43 HB3 ALA 43 95.172 -2.948 9.423
340 H ASN 44 HN ASN 44 98.119 -3.297 7.814
341 HA ASN 44 HA ASN 44 100.437 -2.024 8.857
342 1HB ASN 44 HB2 ASN 44 100.324 -4.306 6.877
343 2HB ASN 44 HB1 ASN 44 101.673 -3.884 7.927
344 1HD2 ASN 44 HD21 ASN 44 101.652 -4.503 10.042
345 2HD2 ASN 44 HD22 ASN 44 100.450 -5.545 10.718
346 H LEU 45 HN LEU 45 98.963 -2.142 5.689
347 HA LEU 45 HA LEU 45 101.235 -0.967 4.366
348 1HB LEU 45 HB2 LEU 45 98.468 -1.725 3.529
349 2HB LEU 45 HB1 LEU 45 99.441 -0.688 2.500
350 HG LEU 45 HG LEU 45 99.548 -3.105 1.895
351 1HD1 LEU 45 HD11 LEU 45 102.048 -1.666 2.738
352 2HD1 LEU 45 HD12 LEU 45 101.333 -1.764 1.129
353 3HD1 LEU 45 HD13 LEU 45 102.078 -3.188 1.854
354 1HD2 LEU 45 HD21 LEU 45 101.315 -3.556 4.248
355 2HD2 LEU 45 HD22 LEU 45 100.398 -4.715 3.286
356 3HD2 LEU 45 HD23 LEU 45 99.570 -3.687 4.456
357 H LEU 46 HN LEU 46 97.939 0.145 5.123
358 HA LEU 46 HA LEU 46 98.237 2.763 4.220
359 1HB LEU 46 HB2 LEU 46 96.122 1.502 4.959
360 2HB LEU 46 HB1 LEU 46 96.524 2.038 6.580
361 HG LEU 46 HG LEU 46 95.978 3.845 4.222
362 1HD1 LEU 46 HD11 LEU 46 93.881 4.301 5.170
363 2HD1 LEU 46 HD12 LEU 46 94.299 3.501 6.685
364 3HD1 LEU 46 HD13 LEU 46 94.038 2.546 5.226
365 1HD2 LEU 46 HD21 LEU 46 96.957 4.324 6.981
366 2HD2 LEU 46 HD22 LEU 46 95.792 5.464 6.312
367 3HD2 LEU 46 HD23 LEU 46 97.323 5.181 5.485
368 H ALA 47 HN ALA 47 98.749 1.457 7.504
369 HA ALA 47 HA ALA 47 99.400 3.913 8.707
370 1HB ALA 47 HB1 ALA 47 100.455 1.223 9.548
371 2HB ALA 47 HB2 ALA 47 98.816 1.774 9.891
372 3HB ALA 47 HB3 ALA 47 100.197 2.647 10.555
373 H GLU 48 HN GLU 48 101.493 1.354 7.398
374 HA GLU 48 HA GLU 48 103.939 2.620 7.915
375 1HB GLU 48 HB2 GLU 48 103.051 0.485 6.013
376 2HB GLU 48 HB1 GLU 48 104.676 1.141 5.881
377 1HG GLU 48 HG2 GLU 48 104.275 0.559 8.600
378 2HG GLU 48 HG1 GLU 48 103.655 -0.819 7.691
379 H ALA 49 HN ALA 49 101.774 2.793 5.132
380 HA ALA 49 HA ALA 49 103.534 4.321 3.501
381 1HB ALA 49 HB1 ALA 49 101.874 4.306 1.930
382 2HB ALA 49 HB2 ALA 49 100.589 4.491 3.125
383 3HB ALA 49 HB3 ALA 49 101.377 2.927 2.911
384 H LYS 50 HN LYS 50 100.782 5.189 5.564
385 HA LYS 50 HA LYS 50 100.736 7.923 5.013
386 1HB LYS 50 HB2 LYS 50 99.175 6.325 6.473
387 2HB LYS 50 HB1 LYS 50 100.121 7.022 7.781
388 1HG LYS 50 HG2 LYS 50 98.763 8.768 7.763
389 2HG LYS 50 HG1 LYS 50 99.372 9.176 6.158
390 1HD LYS 50 HD2 LYS 50 97.251 8.913 5.483
391 2HD LYS 50 HD1 LYS 50 97.569 7.183 5.616
392 1HE LYS 50 HE2 LYS 50 96.264 8.988 7.638
393 2HE LYS 50 HE1 LYS 50 95.554 7.612 6.797
394 1HZ LYS 50 HZ1 LYS 50 97.653 7.551 8.891
395 2HZ LYS 50 HZ2 LYS 50 97.222 6.202 7.967
396 3HZ LYS 50 HZ3 LYS 50 96.084 6.924 8.988
397 H LYS 51 HN LYS 51 102.423 6.172 7.612
398 HA LYS 51 HA LYS 51 103.605 8.469 8.747
399 1HB LYS 51 HB2 LYS 51 104.955 6.963 10.034
400 2HB LYS 51 HB1 LYS 51 103.343 6.278 9.903
401 1HG LYS 51 HG2 LYS 51 104.045 4.619 8.408
402 2HG LYS 51 HG1 LYS 51 105.555 5.458 8.051
403 1HD LYS 51 HD2 LYS 51 106.284 3.804 9.479
404 2HD LYS 51 HD1 LYS 51 106.005 5.135 10.603
405 1HE LYS 51 HE2 LYS 51 103.707 4.181 10.987
406 2HE LYS 51 HE1 LYS 51 104.220 2.770 10.064
407 1HZ LYS 51 HZ1 LYS 51 104.928 3.578 12.757
408 2HZ LYS 51 HZ2 LYS 51 106.207 2.974 11.830
409 3HZ LYS 51 HZ3 LYS 51 104.826 2.030 12.081
410 H LEU 52 HN LEU 52 104.692 6.218 6.251
411 HA LEU 52 HA LEU 52 107.344 7.137 6.085
412 1HB LEU 52 HB2 LEU 52 105.836 5.187 4.829
413 2HB LEU 52 HB1 LEU 52 106.241 6.287 3.530
414 HG LEU 52 HG LEU 52 108.451 5.446 5.326
415 1HD1 LEU 52 HD11 LEU 52 108.714 3.440 3.713
416 2HD1 LEU 52 HD12 LEU 52 106.976 3.620 3.474
417 3HD1 LEU 52 HD13 LEU 52 107.616 3.303 5.086
418 1HD2 LEU 52 HD21 LEU 52 109.190 6.862 3.670
419 2HD2 LEU 52 HD22 LEU 52 108.059 6.230 2.474
420 3HD2 LEU 52 HD23 LEU 52 109.477 5.286 2.932
421 H ASN 53 HN ASN 53 104.470 8.060 4.191
422 HA ASN 53 HA ASN 53 105.612 9.812 2.426
423 1HB ASN 53 HB2 ASN 53 103.269 9.218 2.291
424 2HB ASN 53 HB1 ASN 53 102.934 10.043 3.807
425 1HD2 ASN 53 HD21 ASN 53 101.520 11.539 3.082
426 2HD2 ASN 53 HD22 ASN 53 101.911 12.771 1.936
427 H ASP 54 HN ASP 54 104.439 10.646 5.691
428 HA ASP 54 HA ASP 54 105.184 13.371 5.494
429 1HB ASP 54 HB2 ASP 54 104.958 13.333 8.018
430 2HB ASP 54 HB1 ASP 54 103.537 12.835 7.106
431 H ALA 55 HN ALA 55 106.753 10.660 7.210
432 HA ALA 55 HA ALA 55 108.960 12.148 8.117
433 1HB ALA 55 HB1 ALA 55 108.083 9.410 8.169
434 2HB ALA 55 HB2 ALA 55 109.123 10.280 9.297
435 3HB ALA 55 HB3 ALA 55 109.820 9.503 7.876
436 H GLN 56 HN GLN 56 108.429 10.462 5.075
437 HA GLN 56 HA GLN 56 111.211 10.932 4.324
438 1HB GLN 56 HB2 GLN 56 110.932 9.361 2.580
439 2HB GLN 56 HB1 GLN 56 110.133 8.679 3.985
440 1HG GLN 56 HG2 GLN 56 108.288 8.419 2.806
441 2HG GLN 56 HG1 GLN 56 108.197 10.162 2.553
442 1HE2 GLN 56 HE21 GLN 56 109.570 10.990 0.747
443 2HE2 GLN 56 HE22 GLN 56 109.645 10.034 -0.687
444 H ALA 57 HN ALA 57 108.217 12.428 3.961
445 HA ALA 57 HA ALA 57 107.322 13.796 2.253
446 1HB ALA 57 HB1 ALA 57 108.719 14.936 4.146
447 2HB ALA 57 HB2 ALA 57 108.092 15.885 2.799
448 3HB ALA 57 HB3 ALA 57 109.784 15.375 2.813
449 HA PRO 58 HA PRO 58 109.412 13.994 -1.702
450 1HB PRO 58 HB2 PRO 58 110.216 16.472 -2.404
451 2HB PRO 58 HB1 PRO 58 108.508 16.035 -2.293
452 1HG PRO 58 HG2 PRO 58 110.199 17.573 -0.388
453 2HG PRO 58 HG1 PRO 58 108.495 17.799 -0.815
454 1HD PRO 58 HD2 PRO 58 109.406 16.539 1.467
455 2HD PRO 58 HD1 PRO 58 107.799 16.327 0.778
456 H LYS 59 HN LYS 59 111.386 16.126 0.332
457 HA LYS 59 HA LYS 59 113.852 15.779 -0.855
458 1HB LYS 59 HB2 LYS 59 113.607 17.431 0.839
459 2HB LYS 59 HB1 LYS 59 113.074 16.247 2.021
460 1HG LYS 59 HG2 LYS 59 115.571 15.329 1.378
461 2HG LYS 59 HG1 LYS 59 115.771 17.077 1.270
462 1HD LYS 59 HD2 LYS 59 116.274 16.247 3.520
463 2HD LYS 59 HD1 LYS 59 114.883 17.333 3.525
464 1HE LYS 59 HE2 LYS 59 113.464 15.713 4.179
465 2HE LYS 59 HE1 LYS 59 114.226 14.495 3.157
466 1HZ LYS 59 HZ1 LYS 59 115.801 15.366 5.429
467 2HZ LYS 59 HZ2 LYS 59 115.548 13.809 4.819
468 3HZ LYS 59 HZ3 LYS 59 114.387 14.522 5.820
469 H ALA 60 HN ALA 60 112.443 13.865 1.801
470 HA ALA 60 HA ALA 60 112.872 11.763 2.560
471 1HB ALA 60 HB1 ALA 60 114.326 10.672 0.334
472 2HB ALA 60 HB2 ALA 60 112.944 11.606 -0.236
473 3HB ALA 60 HB3 ALA 60 112.704 10.287 0.909
Start of MODEL 10
1 1H GLY -1 HT1 GLY -1 78.830 -11.107 2.072
2 2H GLY -1 HT2 GLY -1 80.380 -10.738 1.506
3 3H GLY -1 HT3 GLY -1 80.191 -11.696 2.887
4 1HA GLY -1 HA1 GLY -1 78.987 -13.348 1.446
5 2HA GLY -1 HA2 GLY -1 79.561 -12.404 0.081
6 H SER 0 HN SER 0 82.089 -11.823 1.706
7 HA SER 0 HA SER 0 84.202 -12.654 1.846
8 1HB SER 0 HB2 SER 0 82.488 -14.967 2.606
9 2HB SER 0 HB1 SER 0 84.180 -15.308 2.241
10 HG SER 0 HG SER 0 84.720 -14.421 4.067
11 H THR 1 HN THR 1 82.850 -12.469 -0.740
12 HA THR 1 HA THR 1 84.532 -14.366 -2.239
13 HB THR 1 HB THR 1 82.630 -14.052 -4.048
14 HG1 THR 1 HG1 THR 1 81.216 -13.735 -1.614
15 1HG2 THR 1 HG21 THR 1 82.674 -16.237 -3.639
16 2HG2 THR 1 HG22 THR 1 81.330 -15.921 -2.542
17 3HG2 THR 1 HG23 THR 1 82.977 -16.004 -1.918
18 H ALA 2 HN ALA 2 85.970 -13.356 -3.442
19 HA ALA 2 HA ALA 2 85.708 -11.458 -5.342
20 1HB ALA 2 HB1 ALA 2 86.047 -10.111 -2.668
21 2HB ALA 2 HB2 ALA 2 84.758 -9.856 -3.843
22 3HB ALA 2 HB3 ALA 2 86.395 -9.324 -4.206
23 H ASP 3 HN ASP 3 87.976 -9.722 -4.600
24 HA ASP 3 HA ASP 3 90.121 -11.670 -4.222
25 1HB ASP 3 HB2 ASP 3 89.664 -10.928 -6.703
26 2HB ASP 3 HB1 ASP 3 90.442 -9.430 -6.201
27 H ASN 4 HN ASN 4 88.890 -8.404 -4.145
28 HA ASN 4 HA ASN 4 90.839 -7.737 -2.055
29 1HB ASN 4 HB2 ASN 4 90.684 -5.332 -2.978
30 2HB ASN 4 HB1 ASN 4 91.666 -6.488 -3.871
31 1HD2 ASN 4 HD21 ASN 4 90.730 -7.475 -5.766
32 2HD2 ASN 4 HD22 ASN 4 89.553 -6.605 -6.684
33 H LYS 5 HN LYS 5 88.794 -5.133 -2.803
34 HA LYS 5 HA LYS 5 86.310 -5.448 -1.959
35 1HB LYS 5 HB2 LYS 5 86.758 -6.760 -0.042
36 2HB LYS 5 HB1 LYS 5 88.103 -5.745 0.454
37 1HG LYS 5 HG2 LYS 5 85.720 -4.171 0.420
38 2HG LYS 5 HG1 LYS 5 85.418 -5.659 1.316
39 1HD LYS 5 HD2 LYS 5 87.621 -3.657 1.816
40 2HD LYS 5 HD1 LYS 5 86.214 -3.964 2.834
41 1HE LYS 5 HE2 LYS 5 87.084 -6.367 2.990
42 2HE LYS 5 HE1 LYS 5 88.595 -5.727 2.344
43 1HZ LYS 5 HZ1 LYS 5 89.098 -4.754 4.279
44 2HZ LYS 5 HZ2 LYS 5 87.973 -5.821 4.950
45 3HZ LYS 5 HZ3 LYS 5 87.513 -4.238 4.570
46 H PHE 6 HN PHE 6 88.593 -3.773 0.126
47 HA PHE 6 HA PHE 6 88.649 -1.593 0.770
48 1HB PHE 6 HB2 PHE 6 89.115 -1.442 -2.203
49 2HB PHE 6 HB1 PHE 6 89.477 -0.142 -1.072
50 HD1 PHE 6 HD1 PHE 6 91.382 -0.209 0.331
51 HD2 PHE 6 HD2 PHE 6 90.354 -3.577 -2.058
52 HE1 PHE 6 HE1 PHE 6 93.556 -1.226 0.836
53 HE2 PHE 6 HE2 PHE 6 92.535 -4.602 -1.557
54 HZ PHE 6 HZ PHE 6 94.137 -3.426 -0.100
55 H ASN 7 HN ASN 7 86.084 -1.971 0.997
56 HA ASN 7 HA ASN 7 84.414 -0.532 -0.732
57 1HB ASN 7 HB2 ASN 7 82.820 -0.518 1.251
58 2HB ASN 7 HB1 ASN 7 83.379 -2.081 0.705
59 1HD2 ASN 7 HD21 ASN 7 83.920 -3.421 2.253
60 2HD2 ASN 7 HD22 ASN 7 84.537 -2.989 3.808
61 H LYS 8 HN LYS 8 83.526 0.873 2.094
62 HA LYS 8 HA LYS 8 84.320 3.433 1.160
63 1HB LYS 8 HB2 LYS 8 83.148 4.215 3.304
64 2HB LYS 8 HB1 LYS 8 82.183 3.426 2.067
65 1HG LYS 8 HG2 LYS 8 83.073 1.371 3.749
66 2HG LYS 8 HG1 LYS 8 82.599 2.692 4.814
67 1HD LYS 8 HD2 LYS 8 80.754 1.106 4.301
68 2HD LYS 8 HD1 LYS 8 80.406 2.772 3.838
69 1HE LYS 8 HE2 LYS 8 80.589 2.316 1.574
70 2HE LYS 8 HE1 LYS 8 81.587 0.889 1.839
71 1HZ LYS 8 HZ1 LYS 8 79.188 0.531 1.126
72 2HZ LYS 8 HZ2 LYS 8 78.760 0.973 2.702
73 3HZ LYS 8 HZ3 LYS 8 79.742 -0.379 2.440
74 H GLU 9 HN GLU 9 84.847 1.911 4.351
75 HA GLU 9 HA GLU 9 86.709 3.881 5.168
76 1HB GLU 9 HB2 GLU 9 85.385 1.612 6.306
77 2HB GLU 9 HB1 GLU 9 87.093 1.551 6.720
78 1HG GLU 9 HG2 GLU 9 86.781 3.072 8.288
79 2HG GLU 9 HG1 GLU 9 86.195 4.217 7.082
80 H GLN 10 HN GLN 10 87.118 0.758 3.626
81 HA GLN 10 HA GLN 10 89.948 0.665 4.153
82 1HB GLN 10 HB2 GLN 10 87.969 -1.161 3.281
83 2HB GLN 10 HB1 GLN 10 89.209 -1.101 2.042
84 1HG GLN 10 HG2 GLN 10 90.002 -1.397 4.895
85 2HG GLN 10 HG1 GLN 10 89.400 -2.792 3.999
86 1HE2 GLN 10 HE21 GLN 10 91.362 -3.877 4.014
87 2HE2 GLN 10 HE22 GLN 10 92.727 -3.346 3.106
88 H GLN 11 HN GLN 11 87.925 1.524 1.383
89 HA GLN 11 HA GLN 11 89.941 1.648 -0.556
90 1HB GLN 11 HB2 GLN 11 87.701 1.721 -1.304
91 2HB GLN 11 HB1 GLN 11 87.320 3.106 -0.295
92 1HG GLN 11 HG2 GLN 11 88.245 4.591 -1.751
93 2HG GLN 11 HG1 GLN 11 89.412 3.425 -2.372
94 1HE2 GLN 11 HE21 GLN 11 88.851 4.085 -4.491
95 2HE2 GLN 11 HE22 GLN 11 87.402 3.519 -5.242
96 H ASN 12 HN ASN 12 89.113 3.864 1.998
97 HA ASN 12 HA ASN 12 90.192 6.225 1.056
98 1HB ASN 12 HB2 ASN 12 89.380 6.739 3.094
99 2HB ASN 12 HB1 ASN 12 89.549 5.085 3.662
100 1HD2 ASN 12 HD21 ASN 12 91.110 8.188 3.357
101 2HD2 ASN 12 HD22 ASN 12 92.344 7.904 4.532
102 H ALA 13 HN ALA 13 91.814 3.394 2.398
103 HA ALA 13 HA ALA 13 94.380 4.470 2.638
104 1HB ALA 13 HB1 ALA 13 93.586 1.648 1.944
105 2HB ALA 13 HB2 ALA 13 93.785 2.310 3.566
106 3HB ALA 13 HB3 ALA 13 95.179 2.161 2.497
107 H PHE 14 HN PHE 14 92.811 2.899 -0.201
108 HA PHE 14 HA PHE 14 95.029 2.894 -1.870
109 1HB PHE 14 HB2 PHE 14 93.036 1.681 -2.419
110 2HB PHE 14 HB1 PHE 14 92.069 3.137 -2.414
111 HD1 PHE 14 HD1 PHE 14 95.126 1.862 -4.158
112 HD2 PHE 14 HD2 PHE 14 91.407 3.907 -4.442
113 HE1 PHE 14 HE1 PHE 14 95.437 2.092 -6.589
114 HE2 PHE 14 HE2 PHE 14 91.714 4.145 -6.870
115 HZ PHE 14 HZ PHE 14 93.733 3.235 -7.947
116 H TRP 15 HN TRP 15 92.370 5.217 -1.798
117 HA TRP 15 HA TRP 15 93.454 7.011 -3.646
118 1HB TRP 15 HB2 TRP 15 91.220 6.982 -1.788
119 2HB TRP 15 HB1 TRP 15 91.898 8.592 -2.000
120 HD1 TRP 15 HD1 TRP 15 91.454 5.850 -4.704
121 HE1 TRP 15 HE1 TRP 15 90.006 6.832 -6.594
122 HE3 TRP 15 HE3 TRP 15 90.415 10.411 -2.641
123 HZ2 TRP 15 HZ2 TRP 15 88.608 9.226 -7.137
124 HZ3 TRP 15 HZ3 TRP 15 89.016 11.990 -3.910
125 HH2 TRP 15 HH2 TRP 15 88.133 11.408 -6.113
126 H GLU 16 HN GLU 16 93.813 6.912 -0.130
127 HA GLU 16 HA GLU 16 95.201 9.430 -0.064
128 1HB GLU 16 HB2 GLU 16 95.846 8.848 2.248
129 2HB GLU 16 HB1 GLU 16 94.128 8.626 1.972
130 1HG GLU 16 HG2 GLU 16 94.514 6.719 3.078
131 2HG GLU 16 HG1 GLU 16 94.943 6.149 1.470
132 H ILE 17 HN ILE 17 96.312 6.069 0.270
133 HA ILE 17 HA ILE 17 99.030 6.460 0.224
134 HB ILE 17 HB ILE 17 97.452 4.201 -1.016
135 1HG1 ILE 17 HG12 ILE 17 99.027 4.246 1.559
136 2HG1 ILE 17 HG11 ILE 17 97.312 4.627 1.479
137 1HG2 ILE 17 HG21 ILE 17 100.418 4.413 -0.523
138 2HG2 ILE 17 HG22 ILE 17 99.605 4.213 -2.075
139 3HG2 ILE 17 HG23 ILE 17 99.573 2.908 -0.889
140 1HD1 ILE 17 HD11 ILE 17 96.877 2.391 0.570
141 2HD1 ILE 17 HD12 ILE 17 97.631 2.341 2.163
142 3HD1 ILE 17 HD13 ILE 17 98.593 2.016 0.721
143 H LEU 18 HN LEU 18 96.834 6.211 -2.534
144 HA LEU 18 HA LEU 18 98.715 6.221 -4.583
145 1HB LEU 18 HB2 LEU 18 95.844 6.585 -4.309
146 2HB LEU 18 HB1 LEU 18 96.505 7.582 -5.591
147 HG LEU 18 HG LEU 18 95.742 5.469 -6.487
148 1HD1 LEU 18 HD11 LEU 18 98.097 4.619 -7.281
149 2HD1 LEU 18 HD12 LEU 18 98.655 6.099 -6.498
150 3HD1 LEU 18 HD13 LEU 18 97.473 6.183 -7.804
151 1HD2 LEU 18 HD21 LEU 18 97.689 4.237 -4.546
152 2HD2 LEU 18 HD22 LEU 18 96.841 3.371 -5.825
153 3HD2 LEU 18 HD23 LEU 18 95.932 4.108 -4.505
154 H HIS 19 HN HIS 19 96.859 9.008 -3.350
155 HA HIS 19 HA HIS 19 98.058 10.913 -4.993
156 1HB HIS 19 HB2 HIS 19 96.151 10.878 -2.908
157 2HB HIS 19 HB1 HIS 19 97.354 12.082 -2.467
158 HD1 HIS 19 HD1 HIS 19 97.851 12.799 -5.602
159 HD2 HIS 19 HD2 HIS 19 94.275 12.898 -3.489
160 HE1 HIS 19 HE1 HIS 19 96.377 14.404 -6.853
161 HE2 HIS 19 HE2 HIS 19 94.261 14.537 -5.491
162 H LEU 20 HN LEU 20 98.816 10.095 -1.637
163 HA LEU 20 HA LEU 20 100.451 11.287 -0.360
164 1HB LEU 20 HB2 LEU 20 101.437 8.913 -1.804
165 2HB LEU 20 HB1 LEU 20 102.551 9.799 -0.794
166 HG LEU 20 HG LEU 20 99.978 8.489 0.081
167 1HD1 LEU 20 HD11 LEU 20 102.153 7.604 1.596
168 2HD1 LEU 20 HD12 LEU 20 102.706 7.591 -0.079
169 3HD1 LEU 20 HD13 LEU 20 101.254 6.699 0.377
170 1HD2 LEU 20 HD21 LEU 20 100.873 9.164 2.382
171 2HD2 LEU 20 HD22 LEU 20 100.112 10.414 1.397
172 3HD2 LEU 20 HD23 LEU 20 101.869 10.327 1.508
173 HA PRO 21 HA PRO 21 102.301 13.905 -3.769
174 1HB PRO 21 HB2 PRO 21 101.290 16.058 -2.019
175 2HB PRO 21 HB1 PRO 21 101.124 15.862 -3.766
176 1HG PRO 21 HG2 PRO 21 99.043 15.508 -2.117
177 2HG PRO 21 HG1 PRO 21 99.256 14.517 -3.573
178 1HD PRO 21 HD2 PRO 21 99.839 13.840 -0.715
179 2HD PRO 21 HD1 PRO 21 99.117 12.837 -1.985
180 H ASN 22 HN ASN 22 104.301 13.204 -3.027
181 HA ASN 22 HA ASN 22 106.324 14.391 -2.307
182 1HB ASN 22 HB2 ASN 22 104.803 15.803 -0.649
183 2HB ASN 22 HB1 ASN 22 105.302 14.555 0.495
184 1HD2 ASN 22 HD21 ASN 22 105.929 17.523 -0.041
185 2HD2 ASN 22 HD22 ASN 22 107.650 17.588 0.086
186 H LEU 23 HN LEU 23 105.060 11.700 -2.330
187 HA LEU 23 HA LEU 23 106.936 10.463 -0.431
188 1HB LEU 23 HB2 LEU 23 104.585 10.072 0.257
189 2HB LEU 23 HB1 LEU 23 104.289 9.314 -1.297
190 HG LEU 23 HG LEU 23 106.534 8.183 0.237
191 1HD1 LEU 23 HD11 LEU 23 104.449 6.804 1.337
192 2HD1 LEU 23 HD12 LEU 23 103.890 8.478 1.410
193 3HD1 LEU 23 HD13 LEU 23 105.422 8.032 2.153
194 1HD2 LEU 23 HD21 LEU 23 105.118 7.473 -1.969
195 2HD2 LEU 23 HD22 LEU 23 104.351 6.488 -0.724
196 3HD2 LEU 23 HD23 LEU 23 106.088 6.373 -0.996
197 H ASN 24 HN ASN 24 107.856 8.443 -1.164
198 HA ASN 24 HA ASN 24 108.673 8.519 -3.860
199 1HB ASN 24 HB2 ASN 24 108.964 6.659 -1.580
200 2HB ASN 24 HB1 ASN 24 109.055 5.899 -3.165
201 1HD2 ASN 24 HD21 ASN 24 111.196 5.422 -3.119
202 2HD2 ASN 24 HD22 ASN 24 112.447 6.614 -3.113
203 H GLU 25 HN GLU 25 107.122 8.375 -5.495
204 HA GLU 25 HA GLU 25 104.672 7.119 -5.201
205 1HB GLU 25 HB2 GLU 25 104.959 8.748 -6.892
206 2HB GLU 25 HB1 GLU 25 106.301 7.865 -7.619
207 1HG GLU 25 HG2 GLU 25 104.785 6.106 -8.343
208 2HG GLU 25 HG1 GLU 25 103.437 6.936 -7.567
209 H GLU 26 HN GLU 26 107.789 5.811 -5.898
210 HA GLU 26 HA GLU 26 106.930 3.300 -6.977
211 1HB GLU 26 HB2 GLU 26 109.508 4.205 -5.680
212 2HB GLU 26 HB1 GLU 26 109.269 2.571 -6.279
213 1HG GLU 26 HG2 GLU 26 109.685 3.179 -8.372
214 2HG GLU 26 HG1 GLU 26 108.593 4.561 -8.271
215 H GLN 27 HN GLN 27 107.281 4.742 -3.913
216 HA GLN 27 HA GLN 27 107.119 2.324 -2.330
217 1HB GLN 27 HB2 GLN 27 107.517 5.167 -1.802
218 2HB GLN 27 HB1 GLN 27 106.353 4.453 -0.695
219 1HG GLN 27 HG2 GLN 27 109.199 3.601 -1.154
220 2HG GLN 27 HG1 GLN 27 108.515 4.331 0.298
221 1HE2 GLN 27 HE21 GLN 27 109.906 1.752 -0.178
222 2HE2 GLN 27 HE22 GLN 27 108.844 0.544 0.451
223 H ARG 28 HN ARG 28 105.070 4.901 -3.524
224 HA ARG 28 HA ARG 28 102.670 4.228 -2.234
225 1HB ARG 28 HB2 ARG 28 103.153 5.511 -4.937
226 2HB ARG 28 HB1 ARG 28 101.571 5.387 -4.182
227 1HG ARG 28 HG2 ARG 28 102.765 6.600 -2.192
228 2HG ARG 28 HG1 ARG 28 103.893 7.096 -3.452
229 1HD ARG 28 HD2 ARG 28 101.377 7.555 -4.547
230 2HD ARG 28 HD1 ARG 28 101.219 8.041 -2.885
231 HE ARG 28 HE ARG 28 102.847 9.698 -3.218
232 1HH1 ARG 28 HH11 ARG 28 102.162 7.912 -6.146
233 2HH1 ARG 28 HH12 ARG 28 102.871 9.103 -7.182
234 1HH2 ARG 28 HH21 ARG 28 103.779 11.261 -4.590
235 2HH2 ARG 28 HH22 ARG 28 103.790 10.998 -6.302
236 H ASN 29 HN ASN 29 103.763 3.444 -5.538
237 HA ASN 29 HA ASN 29 101.754 1.718 -6.286
238 1HB ASN 29 HB2 ASN 29 104.079 2.558 -7.425
239 2HB ASN 29 HB1 ASN 29 104.466 0.874 -7.088
240 1HD2 ASN 29 HD21 ASN 29 104.005 -0.483 -8.645
241 2HD2 ASN 29 HD22 ASN 29 102.773 -0.286 -9.840
242 H GLY 30 HN GLY 30 104.815 0.881 -4.638
243 1HA GLY 30 HA2 GLY 30 104.374 -1.861 -4.386
244 2HA GLY 30 HA1 GLY 30 105.320 -0.896 -3.261
245 H PHE 31 HN PHE 31 103.163 0.821 -2.485
246 HA PHE 31 HA PHE 31 102.059 -0.767 -0.399
247 1HB PHE 31 HB2 PHE 31 101.770 2.098 -1.248
248 2HB PHE 31 HB1 PHE 31 100.678 1.434 -0.041
249 HD1 PHE 31 HD1 PHE 31 102.581 -0.382 1.377
250 HD2 PHE 31 HD2 PHE 31 103.016 3.639 0.020
251 HE1 PHE 31 HE1 PHE 31 104.288 0.018 3.103
252 HE2 PHE 31 HE2 PHE 31 104.708 4.044 1.753
253 HZ PHE 31 HZ PHE 31 105.352 2.235 3.298
254 H ILE 32 HN ILE 32 100.837 0.525 -3.430
255 HA ILE 32 HA ILE 32 98.102 -0.071 -2.998
256 HB ILE 32 HB ILE 32 99.186 -0.174 -5.773
257 1HG1 ILE 32 HG12 ILE 32 99.052 2.338 -4.086
258 2HG1 ILE 32 HG11 ILE 32 100.484 1.635 -4.827
259 1HG2 ILE 32 HG21 ILE 32 96.932 -0.271 -5.910
260 2HG2 ILE 32 HG22 ILE 32 97.088 1.482 -5.837
261 3HG2 ILE 32 HG23 ILE 32 96.690 0.573 -4.382
262 1HD1 ILE 32 HD11 ILE 32 100.034 2.501 -6.851
263 2HD1 ILE 32 HD12 ILE 32 99.130 3.668 -5.890
264 3HD1 ILE 32 HD13 ILE 32 98.289 2.325 -6.665
265 H GLN 33 HN GLN 33 100.688 -1.877 -4.602
266 HA GLN 33 HA GLN 33 99.011 -4.029 -5.402
267 1HB GLN 33 HB2 GLN 33 101.164 -5.265 -5.759
268 2HB GLN 33 HB1 GLN 33 101.037 -3.731 -6.605
269 1HG GLN 33 HG2 GLN 33 102.253 -2.889 -4.382
270 2HG GLN 33 HG1 GLN 33 102.837 -4.551 -4.415
271 1HE2 GLN 33 HE21 GLN 33 102.168 -2.128 -6.920
272 2HE2 GLN 33 HE22 GLN 33 103.727 -2.211 -7.660
273 H SER 34 HN SER 34 101.315 -3.691 -2.681
274 HA SER 34 HA SER 34 100.840 -6.238 -1.590
275 1HB SER 34 HB2 SER 34 102.770 -4.809 -0.967
276 2HB SER 34 HB1 SER 34 101.671 -3.707 -0.141
277 HG SER 34 HG SER 34 101.045 -5.600 1.136
278 H LEU 35 HN LEU 35 99.300 -3.117 -1.085
279 HA LEU 35 HA LEU 35 97.556 -3.992 1.012
280 1HB LEU 35 HB2 LEU 35 98.058 -1.663 0.892
281 2HB LEU 35 HB1 LEU 35 97.583 -1.574 -0.793
282 HG LEU 35 HG LEU 35 95.273 -1.796 -0.241
283 1HD1 LEU 35 HD11 LEU 35 96.316 -2.536 2.456
284 2HD1 LEU 35 HD12 LEU 35 95.110 -3.348 1.461
285 3HD1 LEU 35 HD13 LEU 35 94.702 -1.846 2.289
286 1HD2 LEU 35 HD21 LEU 35 95.425 0.075 1.805
287 2HD2 LEU 35 HD22 LEU 35 95.363 0.404 0.073
288 3HD2 LEU 35 HD23 LEU 35 96.920 0.289 0.894
289 H LYS 36 HN LYS 36 97.049 -3.309 -2.475
290 HA LYS 36 HA LYS 36 94.350 -3.842 -2.603
291 1HB LYS 36 HB2 LYS 36 95.678 -2.917 -4.459
292 2HB LYS 36 HB1 LYS 36 96.407 -4.496 -4.719
293 1HG LYS 36 HG2 LYS 36 94.464 -5.397 -5.589
294 2HG LYS 36 HG1 LYS 36 93.437 -4.183 -4.823
295 1HD LYS 36 HD2 LYS 36 93.402 -3.412 -6.975
296 2HD LYS 36 HD1 LYS 36 94.820 -2.549 -6.376
297 1HE LYS 36 HE2 LYS 36 96.083 -4.693 -7.206
298 2HE LYS 36 HE1 LYS 36 94.653 -4.890 -8.218
299 1HZ LYS 36 HZ1 LYS 36 96.770 -2.906 -8.362
300 2HZ LYS 36 HZ2 LYS 36 95.206 -2.330 -8.654
301 3HZ LYS 36 HZ3 LYS 36 95.836 -3.584 -9.599
302 H ASP 37 HN ASP 37 96.909 -6.262 -3.432
303 HA ASP 37 HA ASP 37 95.139 -8.400 -3.669
304 1HB ASP 37 HB2 ASP 37 97.791 -8.113 -4.068
305 2HB ASP 37 HB1 ASP 37 97.820 -8.999 -2.546
306 H ASP 38 HN ASP 38 97.044 -7.378 -0.886
307 HA ASP 38 HA ASP 38 95.524 -9.198 0.837
308 1HB ASP 38 HB2 ASP 38 98.217 -8.514 0.758
309 2HB ASP 38 HB1 ASP 38 97.597 -7.649 2.159
310 HA PRO 39 HA PRO 39 93.242 -5.363 1.795
311 1HB PRO 39 HB2 PRO 39 91.018 -6.593 2.715
312 2HB PRO 39 HB1 PRO 39 91.345 -6.385 0.990
313 1HG PRO 39 HG2 PRO 39 91.775 -8.793 2.719
314 2HG PRO 39 HG1 PRO 39 91.081 -8.697 1.090
315 1HD PRO 39 HD2 PRO 39 93.649 -9.435 1.541
316 2HD PRO 39 HD1 PRO 39 93.144 -8.564 0.080
317 H SER 40 HN SER 40 93.607 -8.228 3.839
318 HA SER 40 HA SER 40 92.920 -6.972 6.279
319 1HB SER 40 HB2 SER 40 93.141 -9.509 5.699
320 2HB SER 40 HB1 SER 40 94.832 -9.286 6.150
321 HG SER 40 HG SER 40 92.690 -8.492 7.820
322 H GLN 41 HN GLN 41 95.631 -6.612 4.302
323 HA GLN 41 HA GLN 41 97.493 -6.018 6.441
324 1HB GLN 41 HB2 GLN 41 97.751 -5.793 3.437
325 2HB GLN 41 HB1 GLN 41 99.053 -5.513 4.594
326 1HG GLN 41 HG2 GLN 41 98.752 -7.844 5.403
327 2HG GLN 41 HG1 GLN 41 97.618 -8.096 4.077
328 1HE2 GLN 41 HE21 GLN 41 99.648 -9.751 4.102
329 2HE2 GLN 41 HE22 GLN 41 100.833 -9.352 2.910
330 H SER 42 HN SER 42 95.068 -4.346 4.874
331 HA SER 42 HA SER 42 95.718 -1.889 4.160
332 1HB SER 42 HB2 SER 42 93.417 -2.962 5.011
333 2HB SER 42 HB1 SER 42 93.735 -1.873 6.358
334 HG SER 42 HG SER 42 94.041 -0.836 3.791
335 H ALA 43 HN ALA 43 95.858 -2.893 7.568
336 HA ALA 43 HA ALA 43 96.557 -0.335 8.558
337 1HB ALA 43 HB1 ALA 43 95.701 -2.518 9.764
338 2HB ALA 43 HB2 ALA 43 96.667 -1.313 10.616
339 3HB ALA 43 HB3 ALA 43 97.428 -2.780 10.000
340 H ASN 44 HN ASN 44 98.534 -3.217 7.883
341 HA ASN 44 HA ASN 44 101.003 -2.094 8.593
342 1HB ASN 44 HB2 ASN 44 100.100 -4.455 7.041
343 2HB ASN 44 HB1 ASN 44 101.756 -3.919 6.764
344 1HD2 ASN 44 HD21 ASN 44 100.891 -6.373 7.963
345 2HD2 ASN 44 HD22 ASN 44 101.524 -6.402 9.570
346 H LEU 45 HN LEU 45 99.223 -2.055 5.553
347 HA LEU 45 HA LEU 45 101.390 -0.834 4.098
348 1HB LEU 45 HB2 LEU 45 98.511 -1.343 3.410
349 2HB LEU 45 HB1 LEU 45 99.583 -0.479 2.340
350 HG LEU 45 HG LEU 45 99.367 -2.807 1.668
351 1HD1 LEU 45 HD11 LEU 45 102.006 -1.829 2.662
352 2HD1 LEU 45 HD12 LEU 45 101.420 -1.998 1.008
353 3HD1 LEU 45 HD13 LEU 45 101.867 -3.429 1.935
354 1HD2 LEU 45 HD21 LEU 45 100.600 -3.500 4.323
355 2HD2 LEU 45 HD22 LEU 45 100.101 -4.615 3.050
356 3HD2 LEU 45 HD23 LEU 45 98.890 -3.681 3.931
357 H LEU 46 HN LEU 46 98.224 0.252 5.279
358 HA LEU 46 HA LEU 46 98.387 2.907 4.463
359 1HB LEU 46 HB2 LEU 46 96.347 1.792 5.309
360 2HB LEU 46 HB1 LEU 46 97.019 1.833 6.928
361 HG LEU 46 HG LEU 46 97.100 4.488 5.962
362 1HD1 LEU 46 HD11 LEU 46 94.890 4.981 5.294
363 2HD1 LEU 46 HD12 LEU 46 94.335 3.347 5.662
364 3HD1 LEU 46 HD13 LEU 46 95.413 3.625 4.294
365 1HD2 LEU 46 HD21 LEU 46 95.796 4.958 7.864
366 2HD2 LEU 46 HD22 LEU 46 96.769 3.553 8.300
367 3HD2 LEU 46 HD23 LEU 46 95.072 3.350 7.865
368 H ALA 47 HN ALA 47 99.103 1.609 7.717
369 HA ALA 47 HA ALA 47 100.046 3.993 8.816
370 1HB ALA 47 HB1 ALA 47 101.314 2.408 10.390
371 2HB ALA 47 HB2 ALA 47 100.529 1.112 9.485
372 3HB ALA 47 HB3 ALA 47 99.552 2.305 10.343
373 H GLU 48 HN GLU 48 101.748 1.498 6.992
374 HA GLU 48 HA GLU 48 104.361 2.471 7.437
375 1HB GLU 48 HB2 GLU 48 103.094 0.633 5.452
376 2HB GLU 48 HB1 GLU 48 104.727 1.209 5.147
377 1HG GLU 48 HG2 GLU 48 103.937 -0.098 7.730
378 2HG GLU 48 HG1 GLU 48 104.494 -1.014 6.331
379 H ALA 49 HN ALA 49 101.981 3.116 4.898
380 HA ALA 49 HA ALA 49 103.738 4.801 3.387
381 1HB ALA 49 HB1 ALA 49 102.124 4.788 1.820
382 2HB ALA 49 HB2 ALA 49 100.841 5.114 2.985
383 3HB ALA 49 HB3 ALA 49 101.460 3.474 2.790
384 H LYS 50 HN LYS 50 101.153 5.332 5.735
385 HA LYS 50 HA LYS 50 101.039 8.141 5.490
386 1HB LYS 50 HB2 LYS 50 99.887 6.096 7.181
387 2HB LYS 50 HB1 LYS 50 100.348 7.497 8.137
388 1HG LYS 50 HG2 LYS 50 98.575 7.541 5.703
389 2HG LYS 50 HG1 LYS 50 98.034 7.633 7.380
390 1HD LYS 50 HD2 LYS 50 100.035 9.598 6.343
391 2HD LYS 50 HD1 LYS 50 98.319 9.818 5.992
392 1HE LYS 50 HE2 LYS 50 98.281 10.909 7.954
393 2HE LYS 50 HE1 LYS 50 98.258 9.292 8.657
394 1HZ LYS 50 HZ1 LYS 50 99.983 10.325 9.763
395 2HZ LYS 50 HZ2 LYS 50 100.521 11.161 8.395
396 3HZ LYS 50 HZ3 LYS 50 100.804 9.500 8.534
397 H LYS 51 HN LYS 51 103.058 5.974 7.349
398 HA LYS 51 HA LYS 51 104.235 8.057 8.941
399 1HB LYS 51 HB2 LYS 51 104.814 5.133 8.556
400 2HB LYS 51 HB1 LYS 51 105.913 6.163 9.465
401 1HG LYS 51 HG2 LYS 51 103.821 6.821 10.819
402 2HG LYS 51 HG1 LYS 51 103.102 5.375 10.112
403 1HD LYS 51 HD2 LYS 51 105.571 4.501 10.981
404 2HD LYS 51 HD1 LYS 51 105.074 5.634 12.238
405 1HE LYS 51 HE2 LYS 51 103.309 3.427 11.200
406 2HE LYS 51 HE1 LYS 51 104.375 3.242 12.592
407 1HZ LYS 51 HZ1 LYS 51 102.497 5.495 12.543
408 2HZ LYS 51 HZ2 LYS 51 103.106 4.632 13.864
409 3HZ LYS 51 HZ3 LYS 51 101.899 3.952 12.894
410 H LEU 52 HN LEU 52 105.072 6.247 6.045
411 HA LEU 52 HA LEU 52 107.713 7.128 5.750
412 1HB LEU 52 HB2 LEU 52 105.884 5.568 4.290
413 2HB LEU 52 HB1 LEU 52 106.396 6.840 3.199
414 HG LEU 52 HG LEU 52 107.726 4.729 3.051
415 1HD1 LEU 52 HD11 LEU 52 109.223 7.217 3.852
416 2HD1 LEU 52 HD12 LEU 52 108.597 6.851 2.244
417 3HD1 LEU 52 HD13 LEU 52 109.884 5.863 2.936
418 1HD2 LEU 52 HD21 LEU 52 108.927 5.588 5.670
419 2HD2 LEU 52 HD22 LEU 52 109.238 4.112 4.757
420 3HD2 LEU 52 HD23 LEU 52 107.679 4.348 5.547
421 H ASN 53 HN ASN 53 104.744 8.397 4.248
422 HA ASN 53 HA ASN 53 105.795 10.528 2.849
423 1HB ASN 53 HB2 ASN 53 103.544 10.061 2.452
424 2HB ASN 53 HB1 ASN 53 103.131 10.063 4.161
425 1HD2 ASN 53 HD21 ASN 53 103.174 11.826 1.304
426 2HD2 ASN 53 HD22 ASN 53 102.757 13.373 1.951
427 H ASP 54 HN ASP 54 104.912 10.440 6.312
428 HA ASP 54 HA ASP 54 105.503 13.221 6.654
429 1HB ASP 54 HB2 ASP 54 105.039 12.882 8.987
430 2HB ASP 54 HB1 ASP 54 103.827 12.024 8.046
431 H ALA 55 HN ALA 55 107.297 10.260 6.833
432 HA ALA 55 HA ALA 55 109.454 11.375 8.386
433 1HB ALA 55 HB1 ALA 55 108.638 8.865 8.069
434 2HB ALA 55 HB2 ALA 55 110.309 9.274 8.462
435 3HB ALA 55 HB3 ALA 55 109.858 8.910 6.796
436 H GLN 56 HN GLN 56 108.673 11.007 4.989
437 HA GLN 56 HA GLN 56 111.333 12.073 4.313
438 1HB GLN 56 HB2 GLN 56 110.712 11.226 1.960
439 2HB GLN 56 HB1 GLN 56 111.173 10.048 3.180
440 1HG GLN 56 HG2 GLN 56 109.138 9.098 3.225
441 2HG GLN 56 HG1 GLN 56 108.298 10.634 3.015
442 1HE2 GLN 56 HE21 GLN 56 109.226 11.583 0.702
443 2HE2 GLN 56 HE22 GLN 56 108.844 10.516 -0.600
444 H ALA 57 HN ALA 57 108.226 13.123 4.713
445 HA ALA 57 HA ALA 57 108.643 15.284 2.753
446 1HB ALA 57 HB1 ALA 57 105.867 14.467 3.467
447 2HB ALA 57 HB2 ALA 57 106.753 13.542 2.254
448 3HB ALA 57 HB3 ALA 57 106.467 15.264 2.017
449 HA PRO 58 HA PRO 58 108.113 17.979 6.205
450 1HB PRO 58 HB2 PRO 58 107.317 20.247 4.973
451 2HB PRO 58 HB1 PRO 58 108.965 19.626 4.835
452 1HG PRO 58 HG2 PRO 58 106.684 19.375 2.916
453 2HG PRO 58 HG1 PRO 58 108.386 19.746 2.586
454 1HD PRO 58 HD2 PRO 58 107.321 17.269 2.247
455 2HD PRO 58 HD1 PRO 58 109.020 17.538 2.689
456 H LYS 59 HN LYS 59 106.157 16.414 6.611
457 HA LYS 59 HA LYS 59 103.550 16.941 6.017
458 1HB LYS 59 HB2 LYS 59 103.103 16.131 8.453
459 2HB LYS 59 HB1 LYS 59 103.842 15.040 7.296
460 1HG LYS 59 HG2 LYS 59 105.550 14.738 8.663
461 2HG LYS 59 HG1 LYS 59 105.931 16.457 8.578
462 1HD LYS 59 HD2 LYS 59 104.542 16.938 10.456
463 2HD LYS 59 HD1 LYS 59 103.863 15.309 10.445
464 1HE LYS 59 HE2 LYS 59 106.741 15.227 10.630
465 2HE LYS 59 HE1 LYS 59 106.057 16.223 11.914
466 1HZ LYS 59 HZ1 LYS 59 104.428 14.127 12.004
467 2HZ LYS 59 HZ2 LYS 59 105.846 14.237 12.920
468 3HZ LYS 59 HZ3 LYS 59 105.840 13.361 11.474
469 H ALA 60 HN ALA 60 105.230 18.257 8.880
470 HA ALA 60 HA ALA 60 103.107 20.048 9.499
471 1HB ALA 60 HB1 ALA 60 104.467 19.322 11.300
472 2HB ALA 60 HB2 ALA 60 104.791 21.043 11.086
473 3HB ALA 60 HB3 ALA 60 105.941 19.847 10.487
Start of MODEL 11
1 1H GLY -1 HT1 GLY -1 76.254 -11.180 -6.956
2 2H GLY -1 HT2 GLY -1 75.376 -10.124 -5.969
3 3H GLY -1 HT3 GLY -1 74.712 -10.665 -7.428
4 1HA GLY -1 HA1 GLY -1 73.675 -12.213 -6.235
5 2HA GLY -1 HA2 GLY -1 75.249 -12.990 -6.168
6 H SER 0 HN SER 0 76.616 -12.542 -4.318
7 HA SER 0 HA SER 0 75.007 -12.142 -1.907
8 1HB SER 0 HB2 SER 0 76.908 -14.047 -2.549
9 2HB SER 0 HB1 SER 0 77.791 -12.940 -1.498
10 HG SER 0 HG SER 0 76.538 -13.470 0.144
11 H THR 1 HN THR 1 78.428 -11.461 -2.630
12 HA THR 1 HA THR 1 78.272 -8.679 -2.481
13 HB THR 1 HB THR 1 79.601 -8.933 -0.049
14 HG1 THR 1 HG1 THR 1 78.691 -10.459 1.042
15 1HG2 THR 1 HG21 THR 1 78.327 -7.137 0.178
16 2HG2 THR 1 HG22 THR 1 77.031 -8.232 0.660
17 3HG2 THR 1 HG23 THR 1 77.168 -7.714 -1.020
18 H ALA 2 HN ALA 2 80.438 -7.665 -2.106
19 HA ALA 2 HA ALA 2 82.365 -8.746 -3.762
20 1HB ALA 2 HB1 ALA 2 82.068 -6.405 -2.281
21 2HB ALA 2 HB2 ALA 2 83.327 -6.769 -3.461
22 3HB ALA 2 HB3 ALA 2 83.601 -7.095 -1.749
23 H ASP 3 HN ASP 3 84.800 -8.817 -2.701
24 HA ASP 3 HA ASP 3 84.748 -10.810 -0.547
25 1HB ASP 3 HB2 ASP 3 85.088 -11.626 -3.083
26 2HB ASP 3 HB1 ASP 3 86.752 -11.187 -2.711
27 H ASN 4 HN ASN 4 85.273 -8.061 -0.373
28 HA ASN 4 HA ASN 4 87.896 -8.131 0.827
29 1HB ASN 4 HB2 ASN 4 87.408 -6.005 -1.260
30 2HB ASN 4 HB1 ASN 4 88.910 -6.375 -0.421
31 1HD2 ASN 4 HD21 ASN 4 90.298 -7.728 -1.344
32 2HD2 ASN 4 HD22 ASN 4 89.982 -8.675 -2.754
33 H LYS 5 HN LYS 5 88.315 -6.243 2.160
34 HA LYS 5 HA LYS 5 85.888 -5.223 3.330
35 1HB LYS 5 HB2 LYS 5 88.396 -5.769 4.314
36 2HB LYS 5 HB1 LYS 5 88.419 -4.015 4.213
37 1HG LYS 5 HG2 LYS 5 85.993 -4.474 5.371
38 2HG LYS 5 HG1 LYS 5 86.975 -5.777 6.042
39 1HD LYS 5 HD2 LYS 5 88.323 -3.181 6.018
40 2HD LYS 5 HD1 LYS 5 86.860 -3.211 7.003
41 1HE LYS 5 HE2 LYS 5 89.152 -5.161 7.215
42 2HE LYS 5 HE1 LYS 5 88.874 -3.793 8.292
43 1HZ LYS 5 HZ1 LYS 5 87.298 -4.897 9.403
44 2HZ LYS 5 HZ2 LYS 5 87.956 -6.290 8.703
45 3HZ LYS 5 HZ3 LYS 5 86.605 -5.551 8.004
46 H PHE 6 HN PHE 6 88.837 -3.478 2.417
47 HA PHE 6 HA PHE 6 88.911 -1.150 2.026
48 1HB PHE 6 HB2 PHE 6 88.066 -2.590 -0.471
49 2HB PHE 6 HB1 PHE 6 88.635 -0.924 -0.459
50 HD1 PHE 6 HD1 PHE 6 90.850 -0.586 -0.956
51 HD2 PHE 6 HD2 PHE 6 89.697 -4.226 0.911
52 HE1 PHE 6 HE1 PHE 6 93.183 -1.371 -1.056
53 HE2 PHE 6 HE2 PHE 6 92.016 -5.018 0.806
54 HZ PHE 6 HZ PHE 6 93.774 -3.599 -0.160
55 H ASN 7 HN ASN 7 87.426 -0.044 3.213
56 HA ASN 7 HA ASN 7 85.129 0.904 1.685
57 1HB ASN 7 HB2 ASN 7 83.792 0.859 3.878
58 2HB ASN 7 HB1 ASN 7 84.032 -0.665 3.046
59 1HD2 ASN 7 HD21 ASN 7 83.930 0.618 5.981
60 2HD2 ASN 7 HD22 ASN 7 85.037 -0.405 6.824
61 H LYS 8 HN LYS 8 84.830 1.977 4.819
62 HA LYS 8 HA LYS 8 85.572 4.585 4.147
63 1HB LYS 8 HB2 LYS 8 85.180 5.134 6.494
64 2HB LYS 8 HB1 LYS 8 83.909 4.093 5.869
65 1HG LYS 8 HG2 LYS 8 85.101 2.156 6.913
66 2HG LYS 8 HG1 LYS 8 86.180 3.321 7.682
67 1HD LYS 8 HD2 LYS 8 84.256 4.376 8.774
68 2HD LYS 8 HD1 LYS 8 83.182 3.202 8.011
69 1HE LYS 8 HE2 LYS 8 83.528 1.797 9.695
70 2HE LYS 8 HE1 LYS 8 85.247 1.757 9.306
71 1HZ LYS 8 HZ1 LYS 8 85.693 2.906 11.129
72 2HZ LYS 8 HZ2 LYS 8 84.067 2.796 11.579
73 3HZ LYS 8 HZ3 LYS 8 84.613 4.136 10.703
74 H GLU 9 HN GLU 9 87.182 2.269 6.326
75 HA GLU 9 HA GLU 9 89.456 3.971 6.681
76 1HB GLU 9 HB2 GLU 9 88.381 2.076 8.214
77 2HB GLU 9 HB1 GLU 9 89.596 1.097 7.403
78 1HG GLU 9 HG2 GLU 9 91.361 2.446 8.225
79 2HG GLU 9 HG1 GLU 9 90.237 3.674 8.805
80 H GLN 10 HN GLN 10 89.014 0.817 5.037
81 HA GLN 10 HA GLN 10 91.728 0.782 4.143
82 1HB GLN 10 HB2 GLN 10 90.649 -1.277 4.697
83 2HB GLN 10 HB1 GLN 10 89.351 -0.972 3.572
84 1HG GLN 10 HG2 GLN 10 90.658 -2.549 2.518
85 2HG GLN 10 HG1 GLN 10 91.167 -1.037 1.774
86 1HE2 GLN 10 HE21 GLN 10 92.178 -3.845 3.298
87 2HE2 GLN 10 HE22 GLN 10 93.807 -3.391 3.622
88 H GLN 11 HN GLN 11 88.632 1.064 2.322
89 HA GLN 11 HA GLN 11 89.759 1.205 -0.198
90 1HB GLN 11 HB2 GLN 11 87.428 0.901 -0.072
91 2HB GLN 11 HB1 GLN 11 87.204 2.347 0.890
92 1HG GLN 11 HG2 GLN 11 88.363 3.161 -1.546
93 2HG GLN 11 HG1 GLN 11 87.071 2.027 -1.932
94 1HE2 GLN 11 HE21 GLN 11 85.065 2.771 -1.972
95 2HE2 GLN 11 HE22 GLN 11 84.538 4.286 -1.331
96 H ASN 12 HN ASN 12 88.953 3.963 1.936
97 HA ASN 12 HA ASN 12 89.777 5.989 0.223
98 1HB ASN 12 HB2 ASN 12 89.740 7.422 2.065
99 2HB ASN 12 HB1 ASN 12 88.661 6.128 2.572
100 1HD2 ASN 12 HD21 ASN 12 91.534 7.841 3.213
101 2HD2 ASN 12 HD22 ASN 12 92.016 6.967 4.623
102 H ALA 13 HN ALA 13 91.619 3.702 2.042
103 HA ALA 13 HA ALA 13 94.085 4.982 2.195
104 1HB ALA 13 HB1 ALA 13 93.852 2.035 1.731
105 2HB ALA 13 HB2 ALA 13 93.308 2.766 3.238
106 3HB ALA 13 HB3 ALA 13 94.992 2.916 2.744
107 H PHE 14 HN PHE 14 92.671 3.092 -0.494
108 HA PHE 14 HA PHE 14 94.890 2.744 -2.055
109 1HB PHE 14 HB2 PHE 14 92.641 1.859 -2.529
110 2HB PHE 14 HB1 PHE 14 92.110 3.463 -2.989
111 HD1 PHE 14 HD1 PHE 14 93.293 4.593 -4.935
112 HD2 PHE 14 HD2 PHE 14 93.598 0.428 -4.113
113 HE1 PHE 14 HE1 PHE 14 94.011 4.195 -7.253
114 HE2 PHE 14 HE2 PHE 14 94.317 0.021 -6.432
115 HZ PHE 14 HZ PHE 14 94.524 1.905 -8.005
116 H TRP 15 HN TRP 15 92.618 5.489 -2.367
117 HA TRP 15 HA TRP 15 94.268 6.841 -4.242
118 1HB TRP 15 HB2 TRP 15 92.321 8.295 -2.482
119 2HB TRP 15 HB1 TRP 15 92.772 8.627 -4.152
120 HD1 TRP 15 HD1 TRP 15 92.075 6.289 -5.810
121 HE1 TRP 15 HE1 TRP 15 89.738 5.220 -5.899
122 HE3 TRP 15 HE3 TRP 15 90.261 8.004 -1.362
123 HZ2 TRP 15 HZ2 TRP 15 87.413 5.127 -4.283
124 HZ3 TRP 15 HZ3 TRP 15 87.966 7.384 -0.701
125 HH2 TRP 15 HH2 TRP 15 86.576 5.977 -2.136
126 H GLU 16 HN GLU 16 93.775 7.319 -0.742
127 HA GLU 16 HA GLU 16 95.549 9.429 -0.382
128 1HB GLU 16 HB2 GLU 16 93.982 8.552 1.341
129 2HB GLU 16 HB1 GLU 16 95.019 7.146 1.533
130 1HG GLU 16 HG2 GLU 16 96.013 9.945 1.960
131 2HG GLU 16 HG1 GLU 16 95.254 9.001 3.240
132 H ILE 17 HN ILE 17 96.061 6.190 -1.088
133 HA ILE 17 HA ILE 17 98.891 6.086 -0.337
134 HB ILE 17 HB ILE 17 97.113 4.033 -1.659
135 1HG1 ILE 17 HG12 ILE 17 96.852 3.647 0.593
136 2HG1 ILE 17 HG11 ILE 17 98.304 2.703 0.324
137 1HG2 ILE 17 HG21 ILE 17 100.094 3.797 -1.256
138 2HG2 ILE 17 HG22 ILE 17 99.295 4.035 -2.811
139 3HG2 ILE 17 HG23 ILE 17 99.018 2.554 -1.896
140 1HD1 ILE 17 HD11 ILE 17 98.033 5.388 1.615
141 2HD1 ILE 17 HD12 ILE 17 99.583 4.790 1.024
142 3HD1 ILE 17 HD13 ILE 17 98.714 3.901 2.274
143 H LEU 18 HN LEU 18 96.834 6.189 -3.180
144 HA LEU 18 HA LEU 18 98.877 6.204 -5.125
145 1HB LEU 18 HB2 LEU 18 96.382 5.710 -5.422
146 2HB LEU 18 HB1 LEU 18 96.155 7.445 -5.439
147 HG LEU 18 HG LEU 18 97.543 7.649 -7.429
148 1HD1 LEU 18 HD11 LEU 18 99.058 5.768 -6.952
149 2HD1 LEU 18 HD12 LEU 18 98.404 5.716 -8.590
150 3HD1 LEU 18 HD13 LEU 18 97.753 4.647 -7.347
151 1HD2 LEU 18 HD21 LEU 18 95.984 6.861 -8.961
152 2HD2 LEU 18 HD22 LEU 18 95.044 7.009 -7.476
153 3HD2 LEU 18 HD23 LEU 18 95.618 5.427 -8.002
154 H HIS 19 HN HIS 19 97.224 8.754 -3.378
155 HA HIS 19 HA HIS 19 98.395 10.844 -4.950
156 1HB HIS 19 HB2 HIS 19 96.225 10.695 -3.259
157 2HB HIS 19 HB1 HIS 19 97.393 11.602 -2.302
158 HD1 HIS 19 HD1 HIS 19 98.688 13.215 -4.632
159 HD2 HIS 19 HD2 HIS 19 94.600 12.757 -4.034
160 HE1 HIS 19 HE1 HIS 19 97.615 15.167 -5.797
161 HE2 HIS 19 HE2 HIS 19 95.137 14.804 -5.520
162 H LEU 20 HN LEU 20 98.690 9.975 -1.489
163 HA LEU 20 HA LEU 20 100.285 10.860 -0.049
164 1HB LEU 20 HB2 LEU 20 101.192 8.562 -1.599
165 2HB LEU 20 HB1 LEU 20 102.460 9.406 -0.742
166 HG LEU 20 HG LEU 20 99.945 8.369 0.553
167 1HD1 LEU 20 HD11 LEU 20 102.681 7.159 0.755
168 2HD1 LEU 20 HD12 LEU 20 101.484 6.611 -0.419
169 3HD1 LEU 20 HD13 LEU 20 101.144 6.497 1.308
170 1HD2 LEU 20 HD21 LEU 20 101.387 10.329 1.515
171 2HD2 LEU 20 HD22 LEU 20 102.468 9.019 1.980
172 3HD2 LEU 20 HD23 LEU 20 100.808 9.037 2.567
173 HA PRO 21 HA PRO 21 102.319 13.782 -3.130
174 1HB PRO 21 HB2 PRO 21 101.192 15.754 -1.230
175 2HB PRO 21 HB1 PRO 21 101.171 15.759 -2.997
176 1HG PRO 21 HG2 PRO 21 98.959 15.241 -1.582
177 2HG PRO 21 HG1 PRO 21 99.297 14.409 -3.111
178 1HD PRO 21 HD2 PRO 21 99.607 13.421 -0.305
179 2HD PRO 21 HD1 PRO 21 99.036 12.563 -1.747
180 H ASN 22 HN ASN 22 104.279 13.016 -2.362
181 HA ASN 22 HA ASN 22 106.214 14.238 -1.345
182 1HB ASN 22 HB2 ASN 22 106.290 14.584 1.029
183 2HB ASN 22 HB1 ASN 22 104.864 15.388 0.400
184 1HD2 ASN 22 HD21 ASN 22 105.369 14.692 3.070
185 2HD2 ASN 22 HD22 ASN 22 104.194 13.534 3.564
186 H LEU 23 HN LEU 23 104.649 11.421 -1.416
187 HA LEU 23 HA LEU 23 106.770 9.970 0.019
188 1HB LEU 23 HB2 LEU 23 104.352 9.511 0.623
189 2HB LEU 23 HB1 LEU 23 104.156 8.855 -0.990
190 HG LEU 23 HG LEU 23 106.403 7.583 0.249
191 1HD1 LEU 23 HD11 LEU 23 104.664 6.380 1.910
192 2HD1 LEU 23 HD12 LEU 23 104.073 8.038 1.992
193 3HD1 LEU 23 HD13 LEU 23 105.748 7.680 2.405
194 1HD2 LEU 23 HD21 LEU 23 104.739 5.601 -0.016
195 2HD2 LEU 23 HD22 LEU 23 105.363 6.413 -1.448
196 3HD2 LEU 23 HD23 LEU 23 103.747 6.786 -0.862
197 H ASN 24 HN ASN 24 108.024 8.460 -1.110
198 HA ASN 24 HA ASN 24 108.513 8.906 -3.823
199 1HB ASN 24 HB2 ASN 24 109.797 7.440 -2.010
200 2HB ASN 24 HB1 ASN 24 108.847 6.137 -2.718
201 1HD2 ASN 24 HD21 ASN 24 110.523 8.975 -4.043
202 2HD2 ASN 24 HD22 ASN 24 111.451 8.093 -5.203
203 H GLU 25 HN GLU 25 106.985 8.683 -5.476
204 HA GLU 25 HA GLU 25 104.591 7.392 -5.123
205 1HB GLU 25 HB2 GLU 25 104.712 8.994 -6.804
206 2HB GLU 25 HB1 GLU 25 106.140 8.265 -7.532
207 1HG GLU 25 HG2 GLU 25 103.778 6.530 -7.532
208 2HG GLU 25 HG1 GLU 25 103.606 8.005 -8.483
209 H GLU 26 HN GLU 26 107.672 6.059 -5.927
210 HA GLU 26 HA GLU 26 106.771 3.579 -7.021
211 1HB GLU 26 HB2 GLU 26 109.343 4.175 -5.533
212 2HB GLU 26 HB1 GLU 26 109.043 2.789 -6.573
213 1HG GLU 26 HG2 GLU 26 109.037 4.113 -8.512
214 2HG GLU 26 HG1 GLU 26 108.899 5.607 -7.587
215 H GLN 27 HN GLN 27 107.112 4.967 -3.930
216 HA GLN 27 HA GLN 27 106.848 2.521 -2.402
217 1HB GLN 27 HB2 GLN 27 107.152 5.402 -1.752
218 2HB GLN 27 HB1 GLN 27 106.246 4.435 -0.601
219 1HG GLN 27 HG2 GLN 27 108.980 3.666 -1.575
220 2HG GLN 27 HG1 GLN 27 108.714 4.691 -0.165
221 1HE2 GLN 27 HE21 GLN 27 109.423 3.358 1.405
222 2HE2 GLN 27 HE22 GLN 27 108.719 1.825 1.776
223 H ARG 28 HN ARG 28 104.906 5.164 -3.620
224 HA ARG 28 HA ARG 28 102.486 4.600 -2.307
225 1HB ARG 28 HB2 ARG 28 103.188 5.990 -4.878
226 2HB ARG 28 HB1 ARG 28 101.506 5.693 -4.472
227 1HG ARG 28 HG2 ARG 28 102.103 6.856 -2.235
228 2HG ARG 28 HG1 ARG 28 103.489 7.476 -3.133
229 1HD ARG 28 HD2 ARG 28 101.168 7.806 -4.741
230 2HD ARG 28 HD1 ARG 28 100.797 8.411 -3.147
231 HE ARG 28 HE ARG 28 102.555 9.989 -3.363
232 1HH1 ARG 28 HH11 ARG 28 101.945 8.174 -6.293
233 2HH1 ARG 28 HH12 ARG 28 102.755 9.317 -7.307
234 1HH2 ARG 28 HH21 ARG 28 103.614 11.481 -4.706
235 2HH2 ARG 28 HH22 ARG 28 103.704 11.188 -6.411
236 H ASN 29 HN ASN 29 103.464 3.776 -5.665
237 HA ASN 29 HA ASN 29 101.331 2.129 -6.263
238 1HB ASN 29 HB2 ASN 29 103.124 2.981 -7.836
239 2HB ASN 29 HB1 ASN 29 104.153 1.682 -7.242
240 1HD2 ASN 29 HD21 ASN 29 104.299 0.410 -8.979
241 2HD2 ASN 29 HD22 ASN 29 102.957 -0.338 -9.770
242 H GLY 30 HN GLY 30 104.527 1.191 -4.934
243 1HA GLY 30 HA2 GLY 30 104.061 -1.550 -4.742
244 2HA GLY 30 HA1 GLY 30 105.100 -0.639 -3.653
245 H PHE 31 HN PHE 31 103.029 1.071 -2.670
246 HA PHE 31 HA PHE 31 102.081 -0.503 -0.521
247 1HB PHE 31 HB2 PHE 31 101.842 2.327 -1.387
248 2HB PHE 31 HB1 PHE 31 100.595 1.734 -0.295
249 HD1 PHE 31 HD1 PHE 31 103.301 3.659 -0.166
250 HD2 PHE 31 HD2 PHE 31 101.974 -0.022 1.462
251 HE1 PHE 31 HE1 PHE 31 104.817 3.960 1.750
252 HE2 PHE 31 HE2 PHE 31 103.463 0.246 3.369
253 HZ PHE 31 HZ PHE 31 104.903 2.258 3.531
254 H ILE 32 HN ILE 32 100.579 0.718 -3.465
255 HA ILE 32 HA ILE 32 97.925 -0.029 -2.805
256 HB ILE 32 HB ILE 32 98.801 -0.031 -5.660
257 1HG1 ILE 32 HG12 ILE 32 98.577 2.447 -3.935
258 2HG1 ILE 32 HG11 ILE 32 100.014 1.869 -4.771
259 1HG2 ILE 32 HG21 ILE 32 96.588 -0.150 -5.835
260 2HG2 ILE 32 HG22 ILE 32 96.551 1.542 -5.339
261 3HG2 ILE 32 HG23 ILE 32 96.352 0.268 -4.138
262 1HD1 ILE 32 HD11 ILE 32 97.499 2.904 -6.046
263 2HD1 ILE 32 HD12 ILE 32 98.876 2.235 -6.920
264 3HD1 ILE 32 HD13 ILE 32 99.065 3.712 -5.975
265 H GLN 33 HN GLN 33 100.440 -1.625 -4.717
266 HA GLN 33 HA GLN 33 98.947 -3.867 -5.503
267 1HB GLN 33 HB2 GLN 33 101.867 -3.304 -5.207
268 2HB GLN 33 HB1 GLN 33 101.342 -4.951 -5.524
269 1HG GLN 33 HG2 GLN 33 101.379 -4.425 -7.675
270 2HG GLN 33 HG1 GLN 33 99.942 -3.449 -7.371
271 1HE2 GLN 33 HE21 GLN 33 103.283 -3.442 -8.118
272 2HE2 GLN 33 HE22 GLN 33 103.482 -1.736 -8.259
273 H SER 34 HN SER 34 101.148 -3.471 -2.729
274 HA SER 34 HA SER 34 100.767 -6.053 -1.675
275 1HB SER 34 HB2 SER 34 102.643 -4.901 -0.847
276 2HB SER 34 HB1 SER 34 101.709 -3.449 -0.484
277 HG SER 34 HG SER 34 102.275 -5.481 1.123
278 H LEU 35 HN LEU 35 99.044 -3.033 -1.226
279 HA LEU 35 HA LEU 35 97.391 -3.915 0.918
280 1HB LEU 35 HB2 LEU 35 97.750 -1.570 0.577
281 2HB LEU 35 HB1 LEU 35 97.136 -1.653 -1.062
282 HG LEU 35 HG LEU 35 94.895 -1.994 -0.293
283 1HD1 LEU 35 HD11 LEU 35 95.295 -1.680 2.550
284 2HD1 LEU 35 HD12 LEU 35 96.078 -3.134 1.944
285 3HD1 LEU 35 HD13 LEU 35 94.358 -2.883 1.669
286 1HD2 LEU 35 HD21 LEU 35 95.010 0.249 -0.253
287 2HD2 LEU 35 HD22 LEU 35 96.483 0.260 0.718
288 3HD2 LEU 35 HD23 LEU 35 94.916 0.040 1.496
289 H LYS 36 HN LYS 36 96.615 -3.392 -2.564
290 HA LYS 36 HA LYS 36 94.015 -4.386 -2.401
291 1HB LYS 36 HB2 LYS 36 94.422 -5.049 -4.896
292 2HB LYS 36 HB1 LYS 36 94.395 -3.357 -4.428
293 1HG LYS 36 HG2 LYS 36 96.463 -3.043 -5.141
294 2HG LYS 36 HG1 LYS 36 97.062 -4.435 -4.239
295 1HD LYS 36 HD2 LYS 36 97.205 -5.644 -6.104
296 2HD LYS 36 HD1 LYS 36 95.522 -5.305 -6.508
297 1HE LYS 36 HE2 LYS 36 97.971 -3.716 -7.233
298 2HE LYS 36 HE1 LYS 36 96.808 -4.483 -8.313
299 1HZ LYS 36 HZ1 LYS 36 96.573 -1.977 -6.806
300 2HZ LYS 36 HZ2 LYS 36 95.166 -2.864 -7.117
301 3HZ LYS 36 HZ3 LYS 36 96.124 -2.322 -8.401
302 H ASP 37 HN ASP 37 96.867 -6.237 -3.622
303 HA ASP 37 HA ASP 37 95.638 -8.682 -3.764
304 1HB ASP 37 HB2 ASP 37 98.346 -7.707 -3.726
305 2HB ASP 37 HB1 ASP 37 98.246 -9.217 -2.826
306 H ASP 38 HN ASP 38 96.633 -6.989 -0.895
307 HA ASP 38 HA ASP 38 95.606 -9.230 0.702
308 1HB ASP 38 HB2 ASP 38 98.248 -8.734 0.612
309 2HB ASP 38 HB1 ASP 38 97.787 -7.622 1.897
310 HA PRO 39 HA PRO 39 93.247 -5.542 1.955
311 1HB PRO 39 HB2 PRO 39 91.163 -6.925 3.011
312 2HB PRO 39 HB1 PRO 39 91.326 -6.612 1.281
313 1HG PRO 39 HG2 PRO 39 92.006 -9.080 2.830
314 2HG PRO 39 HG1 PRO 39 91.189 -8.932 1.262
315 1HD PRO 39 HD2 PRO 39 93.809 -9.572 1.484
316 2HD PRO 39 HD1 PRO 39 93.168 -8.638 0.117
317 H SER 40 HN SER 40 94.017 -8.401 3.854
318 HA SER 40 HA SER 40 93.424 -7.276 6.394
319 1HB SER 40 HB2 SER 40 95.183 -9.597 5.581
320 2HB SER 40 HB1 SER 40 94.859 -9.163 7.259
321 HG SER 40 HG SER 40 92.866 -9.779 5.336
322 H GLN 41 HN GLN 41 95.909 -6.682 4.189
323 HA GLN 41 HA GLN 41 97.951 -6.035 6.112
324 1HB GLN 41 HB2 GLN 41 97.687 -5.874 3.132
325 2HB GLN 41 HB1 GLN 41 98.974 -4.997 3.944
326 1HG GLN 41 HG2 GLN 41 99.204 -7.450 5.088
327 2HG GLN 41 HG1 GLN 41 98.693 -7.859 3.456
328 1HE2 GLN 41 HE21 GLN 41 101.270 -7.000 5.428
329 2HE2 GLN 41 HE22 GLN 41 102.453 -6.728 4.198
330 H SER 42 HN SER 42 95.207 -4.487 4.967
331 HA SER 42 HA SER 42 95.442 -1.937 4.457
332 1HB SER 42 HB2 SER 42 93.423 -1.553 5.478
333 2HB SER 42 HB1 SER 42 93.439 -3.313 5.527
334 HG SER 42 HG SER 42 92.913 -2.231 7.550
335 H ALA 43 HN ALA 43 95.658 -2.796 7.921
336 HA ALA 43 HA ALA 43 96.498 -0.340 8.840
337 1HB ALA 43 HB1 ALA 43 95.759 -2.491 10.090
338 2HB ALA 43 HB2 ALA 43 96.851 -1.351 10.876
339 3HB ALA 43 HB3 ALA 43 97.488 -2.828 10.153
340 H ASN 44 HN ASN 44 98.558 -3.068 7.849
341 HA ASN 44 HA ASN 44 101.006 -1.835 8.528
342 1HB ASN 44 HB2 ASN 44 100.327 -4.055 6.601
343 2HB ASN 44 HB1 ASN 44 101.981 -3.535 6.909
344 1HD2 ASN 44 HD21 ASN 44 99.992 -5.897 7.591
345 2HD2 ASN 44 HD22 ASN 44 100.453 -6.284 9.210
346 H LEU 45 HN LEU 45 99.024 -1.718 5.648
347 HA LEU 45 HA LEU 45 101.032 -0.434 4.042
348 1HB LEU 45 HB2 LEU 45 98.114 -1.016 3.645
349 2HB LEU 45 HB1 LEU 45 99.032 -0.073 2.488
350 HG LEU 45 HG LEU 45 98.708 -2.660 2.155
351 1HD1 LEU 45 HD11 LEU 45 100.252 -0.847 1.001
352 2HD1 LEU 45 HD12 LEU 45 100.377 -2.565 0.625
353 3HD1 LEU 45 HD13 LEU 45 101.518 -1.823 1.751
354 1HD2 LEU 45 HD21 LEU 45 99.643 -3.201 4.404
355 2HD2 LEU 45 HD22 LEU 45 101.206 -2.618 3.838
356 3HD2 LEU 45 HD23 LEU 45 100.455 -4.014 3.067
357 H LEU 46 HN LEU 46 97.928 0.649 5.415
358 HA LEU 46 HA LEU 46 98.250 3.347 4.665
359 1HB LEU 46 HB2 LEU 46 96.145 1.982 5.443
360 2HB LEU 46 HB1 LEU 46 96.603 2.561 7.031
361 HG LEU 46 HG LEU 46 94.846 3.900 5.759
362 1HD1 LEU 46 HD11 LEU 46 95.668 6.013 6.607
363 2HD1 LEU 46 HD12 LEU 46 97.299 5.355 6.726
364 3HD1 LEU 46 HD13 LEU 46 96.015 4.718 7.752
365 1HD2 LEU 46 HD21 LEU 46 95.341 5.065 3.894
366 2HD2 LEU 46 HD22 LEU 46 96.571 3.818 3.693
367 3HD2 LEU 46 HD23 LEU 46 97.001 5.376 4.398
368 H ALA 47 HN ALA 47 99.081 1.599 7.625
369 HA ALA 47 HA ALA 47 99.750 3.931 9.115
370 1HB ALA 47 HB1 ALA 47 100.648 1.086 9.556
371 2HB ALA 47 HB2 ALA 47 99.163 1.801 10.183
372 3HB ALA 47 HB3 ALA 47 100.729 2.403 10.726
373 H GLU 48 HN GLU 48 101.723 1.501 7.419
374 HA GLU 48 HA GLU 48 104.199 2.769 7.946
375 1HB GLU 48 HB2 GLU 48 103.417 0.801 5.791
376 2HB GLU 48 HB1 GLU 48 105.069 1.291 6.138
377 1HG GLU 48 HG2 GLU 48 103.260 -0.002 8.159
378 2HG GLU 48 HG1 GLU 48 104.373 -0.895 7.122
379 H ALA 49 HN ALA 49 101.899 2.988 5.291
380 HA ALA 49 HA ALA 49 103.557 4.510 3.565
381 1HB ALA 49 HB1 ALA 49 100.547 4.414 3.604
382 2HB ALA 49 HB2 ALA 49 101.580 3.216 2.822
383 3HB ALA 49 HB3 ALA 49 101.581 4.885 2.255
384 H LYS 50 HN LYS 50 100.948 5.443 5.798
385 HA LYS 50 HA LYS 50 101.052 8.199 5.280
386 1HB LYS 50 HB2 LYS 50 99.292 6.837 6.593
387 2HB LYS 50 HB1 LYS 50 100.355 7.054 7.976
388 1HG LYS 50 HG2 LYS 50 99.396 9.009 8.356
389 2HG LYS 50 HG1 LYS 50 100.052 9.597 6.828
390 1HD LYS 50 HD2 LYS 50 97.754 8.001 6.276
391 2HD LYS 50 HD1 LYS 50 97.339 9.164 7.536
392 1HE LYS 50 HE2 LYS 50 98.755 10.708 5.786
393 2HE LYS 50 HE1 LYS 50 97.938 9.585 4.699
394 1HZ LYS 50 HZ1 LYS 50 96.412 11.275 4.916
395 2HZ LYS 50 HZ2 LYS 50 96.770 11.558 6.544
396 3HZ LYS 50 HZ3 LYS 50 95.874 10.194 6.101
397 H LYS 51 HN LYS 51 102.530 6.355 7.974
398 HA LYS 51 HA LYS 51 103.867 8.467 9.166
399 1HB LYS 51 HB2 LYS 51 104.657 5.557 8.988
400 2HB LYS 51 HB1 LYS 51 105.401 6.722 10.074
401 1HG LYS 51 HG2 LYS 51 103.291 7.050 11.218
402 2HG LYS 51 HG1 LYS 51 102.489 5.956 10.090
403 1HD LYS 51 HD2 LYS 51 104.606 4.457 11.015
404 2HD LYS 51 HD1 LYS 51 104.107 5.364 12.443
405 1HE LYS 51 HE2 LYS 51 102.109 4.305 12.583
406 2HE LYS 51 HE1 LYS 51 101.946 4.152 10.834
407 1HZ LYS 51 HZ1 LYS 51 102.896 2.142 10.849
408 2HZ LYS 51 HZ2 LYS 51 102.541 2.130 12.502
409 3HZ LYS 51 HZ3 LYS 51 104.082 2.581 11.973
410 H LEU 52 HN LEU 52 105.043 6.253 6.629
411 HA LEU 52 HA LEU 52 107.631 7.231 6.415
412 1HB LEU 52 HB2 LEU 52 105.990 5.458 4.959
413 2HB LEU 52 HB1 LEU 52 106.612 6.612 3.798
414 HG LEU 52 HG LEU 52 108.571 5.417 5.679
415 1HD1 LEU 52 HD11 LEU 52 107.575 3.388 5.209
416 2HD1 LEU 52 HD12 LEU 52 108.769 3.522 3.918
417 3HD1 LEU 52 HD13 LEU 52 107.075 3.888 3.593
418 1HD2 LEU 52 HD21 LEU 52 108.484 6.570 2.954
419 2HD2 LEU 52 HD22 LEU 52 109.672 5.300 3.249
420 3HD2 LEU 52 HD23 LEU 52 109.683 6.763 4.233
421 H ASN 53 HN ASN 53 104.741 8.288 4.622
422 HA ASN 53 HA ASN 53 105.869 10.206 3.001
423 1HB ASN 53 HB2 ASN 53 103.721 10.508 2.432
424 2HB ASN 53 HB1 ASN 53 103.292 9.385 3.709
425 1HD2 ASN 53 HD21 ASN 53 102.340 12.108 2.462
426 2HD2 ASN 53 HD22 ASN 53 101.823 12.980 3.861
427 H ASP 54 HN ASP 54 105.056 10.476 6.412
428 HA ASP 54 HA ASP 54 105.551 13.285 6.551
429 1HB ASP 54 HB2 ASP 54 105.002 11.110 8.485
430 2HB ASP 54 HB1 ASP 54 105.893 12.494 9.112
431 H ALA 55 HN ALA 55 107.430 10.460 7.652
432 HA ALA 55 HA ALA 55 109.690 11.874 8.467
433 1HB ALA 55 HB1 ALA 55 109.868 9.081 7.425
434 2HB ALA 55 HB2 ALA 55 108.988 9.441 8.911
435 3HB ALA 55 HB3 ALA 55 110.706 9.824 8.788
436 H GLN 56 HN GLN 56 108.939 10.540 5.240
437 HA GLN 56 HA GLN 56 111.538 11.567 4.346
438 1HB GLN 56 HB2 GLN 56 111.191 10.190 2.296
439 2HB GLN 56 HB1 GLN 56 111.320 9.274 3.783
440 1HG GLN 56 HG2 GLN 56 109.627 8.220 2.629
441 2HG GLN 56 HG1 GLN 56 108.777 9.241 3.776
442 1HE2 GLN 56 HE21 GLN 56 107.661 11.022 3.054
443 2HE2 GLN 56 HE22 GLN 56 107.252 11.248 1.395
444 H ALA 57 HN ALA 57 108.373 12.529 4.386
445 HA ALA 57 HA ALA 57 107.056 13.723 2.789
446 1HB ALA 57 HB1 ALA 57 108.478 14.951 4.713
447 2HB ALA 57 HB2 ALA 57 107.272 15.747 3.706
448 3HB ALA 57 HB3 ALA 57 108.987 15.871 3.300
449 HA PRO 58 HA PRO 58 108.353 14.960 -1.300
450 1HB PRO 58 HB2 PRO 58 109.447 17.531 -1.340
451 2HB PRO 58 HB1 PRO 58 107.748 17.122 -1.588
452 1HG PRO 58 HG2 PRO 58 109.130 18.084 0.868
453 2HG PRO 58 HG1 PRO 58 107.495 18.438 0.282
454 1HD PRO 58 HD2 PRO 58 107.916 16.752 2.300
455 2HD PRO 58 HD1 PRO 58 106.632 16.459 1.120
456 H LYS 59 HN LYS 59 110.785 16.521 0.766
457 HA LYS 59 HA LYS 59 112.846 14.972 -0.660
458 1HB LYS 59 HB2 LYS 59 112.645 17.840 -0.274
459 2HB LYS 59 HB1 LYS 59 114.126 17.213 0.435
460 1HG LYS 59 HG2 LYS 59 113.221 16.919 -2.420
461 2HG LYS 59 HG1 LYS 59 114.563 17.894 -1.819
462 1HD LYS 59 HD2 LYS 59 115.876 16.135 -2.219
463 2HD LYS 59 HD1 LYS 59 115.086 15.342 -0.855
464 1HE LYS 59 HE2 LYS 59 113.301 14.636 -2.563
465 2HE LYS 59 HE1 LYS 59 114.487 15.089 -3.785
466 1HZ LYS 59 HZ1 LYS 59 114.713 12.972 -1.727
467 2HZ LYS 59 HZ2 LYS 59 116.053 13.545 -2.585
468 3HZ LYS 59 HZ3 LYS 59 114.776 12.805 -3.410
469 H ALA 60 HN ALA 60 112.438 16.910 2.309
470 HA ALA 60 HA ALA 60 113.161 16.570 4.443
471 1HB ALA 60 HB1 ALA 60 112.854 13.698 4.497
472 2HB ALA 60 HB2 ALA 60 111.507 14.476 3.665
473 3HB ALA 60 HB3 ALA 60 111.916 14.948 5.315
Start of MODEL 12
1 1H GLY -1 HT1 GLY -1 78.802 -3.874 -11.599
2 2H GLY -1 HT2 GLY -1 78.512 -2.988 -10.188
3 3H GLY -1 HT3 GLY -1 77.267 -3.225 -11.308
4 1HA GLY -1 HA1 GLY -1 77.028 -5.472 -10.791
5 2HA GLY -1 HA2 GLY -1 78.587 -5.509 -9.980
6 H SER 0 HN SER 0 77.666 -6.380 -8.095
7 HA SER 0 HA SER 0 75.569 -4.962 -6.719
8 1HB SER 0 HB2 SER 0 76.088 -6.642 -4.881
9 2HB SER 0 HB1 SER 0 75.574 -7.327 -6.422
10 HG SER 0 HG SER 0 78.186 -7.194 -5.344
11 H THR 1 HN THR 1 79.057 -5.150 -6.593
12 HA THR 1 HA THR 1 79.233 -2.736 -5.082
13 HB THR 1 HB THR 1 80.681 -3.971 -3.273
14 HG1 THR 1 HG1 THR 1 80.390 -6.040 -3.118
15 1HG2 THR 1 HG21 THR 1 79.054 -3.541 -1.817
16 2HG2 THR 1 HG22 THR 1 77.906 -4.592 -2.645
17 3HG2 THR 1 HG23 THR 1 78.156 -2.940 -3.211
18 H ALA 2 HN ALA 2 81.582 -2.248 -4.523
19 HA ALA 2 HA ALA 2 83.160 -2.129 -6.711
20 1HB ALA 2 HB1 ALA 2 83.880 -0.759 -5.047
21 2HB ALA 2 HB2 ALA 2 85.090 -2.036 -4.922
22 3HB ALA 2 HB3 ALA 2 83.727 -2.000 -3.804
23 H ASP 3 HN ASP 3 82.565 -5.055 -5.055
24 HA ASP 3 HA ASP 3 83.248 -7.161 -5.610
25 1HB ASP 3 HB2 ASP 3 83.977 -6.002 -7.843
26 2HB ASP 3 HB1 ASP 3 85.597 -6.151 -7.170
27 H ASN 4 HN ASN 4 86.071 -4.990 -5.201
28 HA ASN 4 HA ASN 4 87.480 -6.977 -3.686
29 1HB ASN 4 HB2 ASN 4 88.344 -4.891 -5.134
30 2HB ASN 4 HB1 ASN 4 88.316 -4.126 -3.548
31 1HD2 ASN 4 HD21 ASN 4 89.156 -7.385 -4.674
32 2HD2 ASN 4 HD22 ASN 4 90.729 -7.410 -3.960
33 H LYS 5 HN LYS 5 87.936 -6.981 -1.514
34 HA LYS 5 HA LYS 5 85.896 -6.231 0.236
35 1HB LYS 5 HB2 LYS 5 87.502 -8.046 0.676
36 2HB LYS 5 HB1 LYS 5 88.777 -6.856 0.897
37 1HG LYS 5 HG2 LYS 5 87.851 -7.734 3.015
38 2HG LYS 5 HG1 LYS 5 87.710 -5.983 2.854
39 1HD LYS 5 HD2 LYS 5 85.376 -6.219 2.191
40 2HD LYS 5 HD1 LYS 5 85.513 -7.976 2.296
41 1HE LYS 5 HE2 LYS 5 86.326 -6.500 4.708
42 2HE LYS 5 HE1 LYS 5 84.615 -6.387 4.298
43 1HZ LYS 5 HZ1 LYS 5 84.267 -8.507 4.858
44 2HZ LYS 5 HZ2 LYS 5 85.737 -8.400 5.688
45 3HZ LYS 5 HZ3 LYS 5 85.693 -9.056 4.130
46 H PHE 6 HN PHE 6 88.089 -4.162 -1.217
47 HA PHE 6 HA PHE 6 88.581 -2.441 1.011
48 1HB PHE 6 HB2 PHE 6 88.875 -1.832 -1.934
49 2HB PHE 6 HB1 PHE 6 89.582 -0.928 -0.605
50 HD1 PHE 6 HD1 PHE 6 91.496 -1.453 -2.413
51 HD2 PHE 6 HD2 PHE 6 89.863 -4.262 0.338
52 HE1 PHE 6 HE1 PHE 6 93.544 -2.802 -2.574
53 HE2 PHE 6 HE2 PHE 6 91.907 -5.612 0.176
54 HZ PHE 6 HZ PHE 6 93.749 -4.887 -1.273
55 H ASN 7 HN ASN 7 86.102 -2.567 1.423
56 HA ASN 7 HA ASN 7 84.406 -1.019 -0.201
57 1HB ASN 7 HB2 ASN 7 82.917 -1.043 1.903
58 2HB ASN 7 HB1 ASN 7 83.300 -2.568 1.122
59 1HD2 ASN 7 HD21 ASN 7 82.760 -1.444 3.988
60 2HD2 ASN 7 HD22 ASN 7 83.910 -2.311 4.942
61 H LYS 8 HN LYS 8 83.914 0.119 2.939
62 HA LYS 8 HA LYS 8 84.334 2.797 2.078
63 1HB LYS 8 HB2 LYS 8 83.600 3.300 4.497
64 2HB LYS 8 HB1 LYS 8 82.448 2.568 3.390
65 1HG LYS 8 HG2 LYS 8 82.148 0.876 4.784
66 2HG LYS 8 HG1 LYS 8 83.866 0.486 4.721
67 1HD LYS 8 HD2 LYS 8 83.878 2.638 6.376
68 2HD LYS 8 HD1 LYS 8 82.323 1.908 6.777
69 1HE LYS 8 HE2 LYS 8 85.013 0.545 6.823
70 2HE LYS 8 HE1 LYS 8 84.062 1.033 8.224
71 1HZ LYS 8 HZ1 LYS 8 83.954 -1.392 7.470
72 2HZ LYS 8 HZ2 LYS 8 82.958 -0.835 6.222
73 3HZ LYS 8 HZ3 LYS 8 82.496 -0.614 7.834
74 H GLU 9 HN GLU 9 85.642 1.149 4.989
75 HA GLU 9 HA GLU 9 87.484 3.278 5.443
76 1HB GLU 9 HB2 GLU 9 88.188 2.071 7.371
77 2HB GLU 9 HB1 GLU 9 86.447 1.879 7.230
78 1HG GLU 9 HG2 GLU 9 87.024 -0.259 7.703
79 2HG GLU 9 HG1 GLU 9 87.142 -0.314 5.944
80 H GLN 10 HN GLN 10 87.844 0.035 4.089
81 HA GLN 10 HA GLN 10 90.684 0.110 4.058
82 1HB GLN 10 HB2 GLN 10 89.766 -2.032 4.022
83 2HB GLN 10 HB1 GLN 10 88.616 -1.626 2.759
84 1HG GLN 10 HG2 GLN 10 90.258 -3.083 1.855
85 2HG GLN 10 HG1 GLN 10 90.506 -1.485 1.158
86 1HE2 GLN 10 HE21 GLN 10 91.849 -4.037 2.987
87 2HE2 GLN 10 HE22 GLN 10 93.394 -3.334 3.273
88 H GLN 11 HN GLN 11 88.227 0.861 1.607
89 HA GLN 11 HA GLN 11 89.918 1.194 -0.584
90 1HB GLN 11 HB2 GLN 11 87.415 1.175 -0.632
91 2HB GLN 11 HB1 GLN 11 87.435 2.816 -0.007
92 1HG GLN 11 HG2 GLN 11 89.116 2.503 -2.350
93 2HG GLN 11 HG1 GLN 11 87.438 2.061 -2.658
94 1HE2 GLN 11 HE21 GLN 11 85.817 3.669 -1.786
95 2HE2 GLN 11 HE22 GLN 11 86.182 5.340 -2.026
96 H ASN 12 HN ASN 12 89.224 3.332 2.103
97 HA ASN 12 HA ASN 12 90.100 5.754 1.103
98 1HB ASN 12 HB2 ASN 12 89.486 4.685 3.652
99 2HB ASN 12 HB1 ASN 12 91.066 5.449 3.796
100 1HD2 ASN 12 HD21 ASN 12 90.651 7.289 4.820
101 2HD2 ASN 12 HD22 ASN 12 89.517 8.486 4.306
102 H ALA 13 HN ALA 13 91.991 3.049 2.398
103 HA ALA 13 HA ALA 13 94.476 4.241 2.526
104 1HB ALA 13 HB1 ALA 13 94.161 2.031 3.375
105 2HB ALA 13 HB2 ALA 13 95.393 1.954 2.116
106 3HB ALA 13 HB3 ALA 13 93.748 1.417 1.774
107 H PHE 14 HN PHE 14 92.847 2.841 -0.319
108 HA PHE 14 HA PHE 14 94.944 2.897 -2.108
109 1HB PHE 14 HB2 PHE 14 92.790 1.911 -2.619
110 2HB PHE 14 HB1 PHE 14 92.023 3.486 -2.597
111 HD1 PHE 14 HD1 PHE 14 91.739 4.640 -4.562
112 HD2 PHE 14 HD2 PHE 14 94.739 1.629 -4.350
113 HE1 PHE 14 HE1 PHE 14 92.194 4.934 -6.960
114 HE2 PHE 14 HE2 PHE 14 95.203 1.920 -6.751
115 HZ PHE 14 HZ PHE 14 93.929 3.573 -8.058
116 H TRP 15 HN TRP 15 92.506 5.439 -1.678
117 HA TRP 15 HA TRP 15 93.683 7.287 -3.432
118 1HB TRP 15 HB2 TRP 15 91.438 7.215 -1.749
119 2HB TRP 15 HB1 TRP 15 92.350 8.641 -1.270
120 HD1 TRP 15 HD1 TRP 15 92.154 7.411 -4.914
121 HE1 TRP 15 HE1 TRP 15 90.958 9.223 -6.310
122 HE3 TRP 15 HE3 TRP 15 90.782 10.584 -1.140
123 HZ2 TRP 15 HZ2 TRP 15 89.613 11.670 -5.864
124 HZ3 TRP 15 HZ3 TRP 15 89.549 12.636 -1.708
125 HH2 TRP 15 HH2 TRP 15 88.978 13.166 -4.022
126 H GLU 16 HN GLU 16 93.816 7.283 0.136
127 HA GLU 16 HA GLU 16 95.640 9.367 0.439
128 1HB GLU 16 HB2 GLU 16 94.267 8.186 2.237
129 2HB GLU 16 HB1 GLU 16 95.533 6.965 2.256
130 1HG GLU 16 HG2 GLU 16 96.278 9.827 2.586
131 2HG GLU 16 HG1 GLU 16 95.566 8.956 3.944
132 H ILE 17 HN ILE 17 96.104 6.141 -0.527
133 HA ILE 17 HA ILE 17 98.973 6.055 -0.054
134 HB ILE 17 HB ILE 17 97.049 4.159 -1.373
135 1HG1 ILE 17 HG12 ILE 17 99.113 3.557 0.726
136 2HG1 ILE 17 HG11 ILE 17 97.580 4.307 1.160
137 1HG2 ILE 17 HG21 ILE 17 98.990 2.669 -1.849
138 2HG2 ILE 17 HG22 ILE 17 100.058 4.030 -1.504
139 3HG2 ILE 17 HG23 ILE 17 98.931 4.114 -2.859
140 1HD1 ILE 17 HD11 ILE 17 96.465 2.359 -0.012
141 2HD1 ILE 17 HD12 ILE 17 97.291 2.010 1.507
142 3HD1 ILE 17 HD13 ILE 17 98.055 1.598 -0.028
143 H LEU 18 HN LEU 18 96.775 6.328 -2.790
144 HA LEU 18 HA LEU 18 98.768 6.655 -4.780
145 1HB LEU 18 HB2 LEU 18 95.803 6.942 -4.604
146 2HB LEU 18 HB1 LEU 18 96.614 7.710 -5.958
147 HG LEU 18 HG LEU 18 95.738 5.490 -6.529
148 1HD1 LEU 18 HD11 LEU 18 97.718 4.624 -7.597
149 2HD1 LEU 18 HD12 LEU 18 98.749 5.563 -6.516
150 3HD1 LEU 18 HD13 LEU 18 97.714 6.385 -7.683
151 1HD2 LEU 18 HD21 LEU 18 95.791 4.167 -4.666
152 2HD2 LEU 18 HD22 LEU 18 97.408 4.691 -4.198
153 3HD2 LEU 18 HD23 LEU 18 97.200 3.563 -5.535
154 H HIS 19 HN HIS 19 97.072 8.834 -2.667
155 HA HIS 19 HA HIS 19 97.740 11.195 -4.124
156 1HB HIS 19 HB2 HIS 19 95.845 10.833 -2.378
157 2HB HIS 19 HB1 HIS 19 97.100 11.154 -1.187
158 HD1 HIS 19 HD1 HIS 19 97.425 13.541 -0.604
159 HD2 HIS 19 HD2 HIS 19 95.595 13.081 -4.306
160 HE1 HIS 19 HE1 HIS 19 96.857 15.868 -1.367
161 HE2 HIS 19 HE2 HIS 19 95.666 15.558 -3.565
162 H LEU 20 HN LEU 20 98.828 9.939 -0.964
163 HA LEU 20 HA LEU 20 100.628 10.921 0.242
164 1HB LEU 20 HB2 LEU 20 101.311 8.734 -1.621
165 2HB LEU 20 HB1 LEU 20 102.625 9.488 -0.749
166 HG LEU 20 HG LEU 20 100.224 8.123 0.464
167 1HD1 LEU 20 HD11 LEU 20 101.648 6.385 1.078
168 2HD1 LEU 20 HD12 LEU 20 103.097 7.339 0.768
169 3HD1 LEU 20 HD13 LEU 20 102.124 6.756 -0.579
170 1HD2 LEU 20 HD21 LEU 20 101.898 10.151 1.545
171 2HD2 LEU 20 HD22 LEU 20 102.267 8.632 2.360
172 3HD2 LEU 20 HD23 LEU 20 100.613 9.242 2.338
173 HA PRO 21 HA PRO 21 102.273 13.848 -3.063
174 1HB PRO 21 HB2 PRO 21 101.415 15.910 -1.143
175 2HB PRO 21 HB1 PRO 21 101.097 15.796 -2.876
176 1HG PRO 21 HG2 PRO 21 99.165 15.396 -1.049
177 2HG PRO 21 HG1 PRO 21 99.210 14.505 -2.582
178 1HD PRO 21 HD2 PRO 21 100.034 13.615 0.156
179 2HD PRO 21 HD1 PRO 21 99.165 12.721 -1.105
180 H ASN 22 HN ASN 22 104.315 13.083 -2.484
181 HA ASN 22 HA ASN 22 106.325 14.354 -1.622
182 1HB ASN 22 HB2 ASN 22 106.597 14.546 0.806
183 2HB ASN 22 HB1 ASN 22 105.190 15.452 0.267
184 1HD2 ASN 22 HD21 ASN 22 106.188 12.345 1.595
185 2HD2 ASN 22 HD22 ASN 22 104.773 12.103 2.540
186 H LEU 23 HN LEU 23 104.763 11.488 -1.493
187 HA LEU 23 HA LEU 23 107.047 10.056 -0.320
188 1HB LEU 23 HB2 LEU 23 104.846 9.483 0.603
189 2HB LEU 23 HB1 LEU 23 104.265 9.108 -1.005
190 HG LEU 23 HG LEU 23 106.585 7.519 -0.494
191 1HD1 LEU 23 HD11 LEU 23 106.430 7.337 1.751
192 2HD1 LEU 23 HD12 LEU 23 105.159 6.183 1.345
193 3HD1 LEU 23 HD13 LEU 23 104.739 7.838 1.783
194 1HD2 LEU 23 HD21 LEU 23 103.861 7.259 -1.443
195 2HD2 LEU 23 HD22 LEU 23 104.339 5.883 -0.449
196 3HD2 LEU 23 HD23 LEU 23 105.295 6.325 -1.862
197 H ASN 24 HN ASN 24 108.233 8.618 -1.572
198 HA ASN 24 HA ASN 24 108.432 9.060 -4.315
199 1HB ASN 24 HB2 ASN 24 109.354 6.958 -2.439
200 2HB ASN 24 HB1 ASN 24 109.245 6.462 -4.126
201 1HD2 ASN 24 HD21 ASN 24 111.499 6.233 -4.176
202 2HD2 ASN 24 HD22 ASN 24 112.537 7.607 -4.303
203 H GLU 25 HN GLU 25 106.820 8.729 -5.848
204 HA GLU 25 HA GLU 25 104.506 7.356 -5.259
205 1HB GLU 25 HB2 GLU 25 103.954 7.659 -7.582
206 2HB GLU 25 HB1 GLU 25 104.775 9.099 -6.969
207 1HG GLU 25 HG2 GLU 25 106.363 8.919 -8.508
208 2HG GLU 25 HG1 GLU 25 106.671 7.235 -8.085
209 H GLU 26 HN GLU 26 107.568 6.159 -6.201
210 HA GLU 26 HA GLU 26 106.773 3.645 -7.294
211 1HB GLU 26 HB2 GLU 26 109.281 4.912 -6.361
212 2HB GLU 26 HB1 GLU 26 109.230 3.162 -6.196
213 1HG GLU 26 HG2 GLU 26 108.744 2.943 -8.571
214 2HG GLU 26 HG1 GLU 26 108.763 4.697 -8.742
215 H GLN 27 HN GLN 27 107.031 5.053 -4.236
216 HA GLN 27 HA GLN 27 106.904 2.610 -2.659
217 1HB GLN 27 HB2 GLN 27 107.384 5.418 -2.093
218 2HB GLN 27 HB1 GLN 27 106.146 4.764 -1.032
219 1HG GLN 27 HG2 GLN 27 108.840 3.499 -1.434
220 2HG GLN 27 HG1 GLN 27 108.471 4.646 -0.146
221 1HE2 GLN 27 HE21 GLN 27 108.872 3.158 1.472
222 2HE2 GLN 27 HE22 GLN 27 107.810 1.837 1.804
223 H ARG 28 HN ARG 28 104.925 5.155 -3.951
224 HA ARG 28 HA ARG 28 102.484 4.567 -2.670
225 1HB ARG 28 HB2 ARG 28 103.275 6.049 -5.144
226 2HB ARG 28 HB1 ARG 28 101.584 5.678 -4.878
227 1HG ARG 28 HG2 ARG 28 102.073 6.753 -2.526
228 2HG ARG 28 HG1 ARG 28 103.372 7.542 -3.425
229 1HD ARG 28 HD2 ARG 28 100.465 7.556 -4.236
230 2HD ARG 28 HD1 ARG 28 101.255 8.854 -3.377
231 HE ARG 28 HE ARG 28 102.482 9.383 -5.301
232 1HH1 ARG 28 HH11 ARG 28 100.315 6.693 -5.849
233 2HH1 ARG 28 HH12 ARG 28 100.390 6.829 -7.570
234 1HH2 ARG 28 HH21 ARG 28 102.577 9.550 -7.562
235 2HH2 ARG 28 HH22 ARG 28 101.672 8.446 -8.543
236 H ASN 29 HN ASN 29 104.139 3.196 -5.451
237 HA ASN 29 HA ASN 29 101.826 1.792 -6.427
238 1HB ASN 29 HB2 ASN 29 103.347 2.266 -8.138
239 2HB ASN 29 HB1 ASN 29 104.744 1.885 -7.139
240 1HD2 ASN 29 HD21 ASN 29 102.204 0.599 -9.136
241 2HD2 ASN 29 HD22 ASN 29 102.861 -0.991 -9.302
242 H GLY 30 HN GLY 30 104.882 0.922 -4.792
243 1HA GLY 30 HA2 GLY 30 104.380 -1.798 -4.451
244 2HA GLY 30 HA1 GLY 30 105.343 -0.820 -3.350
245 H PHE 31 HN PHE 31 103.087 0.968 -2.789
246 HA PHE 31 HA PHE 31 101.990 -0.448 -0.573
247 1HB PHE 31 HB2 PHE 31 101.756 2.308 -1.695
248 2HB PHE 31 HB1 PHE 31 100.528 1.768 -0.551
249 HD1 PHE 31 HD1 PHE 31 101.927 0.198 1.345
250 HD2 PHE 31 HD2 PHE 31 103.208 3.751 -0.600
251 HE1 PHE 31 HE1 PHE 31 103.447 0.644 3.203
252 HE2 PHE 31 HE2 PHE 31 104.736 4.225 1.274
253 HZ PHE 31 HZ PHE 31 104.860 2.669 3.181
254 H ILE 32 HN ILE 32 100.798 0.463 -3.761
255 HA ILE 32 HA ILE 32 98.077 -0.208 -3.260
256 HB ILE 32 HB ILE 32 99.151 -0.463 -6.029
257 1HG1 ILE 32 HG12 ILE 32 98.968 2.144 -4.510
258 2HG1 ILE 32 HG11 ILE 32 100.383 1.453 -5.291
259 1HG2 ILE 32 HG21 ILE 32 96.628 0.132 -4.687
260 2HG2 ILE 32 HG22 ILE 32 96.934 -0.578 -6.272
261 3HG2 ILE 32 HG23 ILE 32 96.961 1.173 -6.070
262 1HD1 ILE 32 HD11 ILE 32 99.754 2.133 -7.359
263 2HD1 ILE 32 HD12 ILE 32 98.981 3.391 -6.395
264 3HD1 ILE 32 HD13 ILE 32 98.032 2.032 -6.993
265 H GLN 33 HN GLN 33 100.741 -1.935 -4.824
266 HA GLN 33 HA GLN 33 99.281 -4.270 -5.448
267 1HB GLN 33 HB2 GLN 33 101.500 -5.346 -5.694
268 2HB GLN 33 HB1 GLN 33 101.385 -3.810 -6.542
269 1HG GLN 33 HG2 GLN 33 102.519 -2.744 -4.584
270 2HG GLN 33 HG1 GLN 33 102.789 -4.363 -3.943
271 1HE2 GLN 33 HE21 GLN 33 103.444 -2.241 -6.671
272 2HE2 GLN 33 HE22 GLN 33 104.915 -3.009 -7.153
273 H SER 34 HN SER 34 101.442 -3.546 -2.707
274 HA SER 34 HA SER 34 101.189 -6.006 -1.408
275 1HB SER 34 HB2 SER 34 102.915 -4.716 -0.554
276 2HB SER 34 HB1 SER 34 101.947 -3.242 -0.541
277 HG SER 34 HG SER 34 102.041 -3.815 1.550
278 H LEU 35 HN LEU 35 99.253 -3.053 -1.151
279 HA LEU 35 HA LEU 35 97.502 -4.129 0.876
280 1HB LEU 35 HB2 LEU 35 97.764 -1.766 0.846
281 2HB LEU 35 HB1 LEU 35 97.392 -1.670 -0.866
282 HG LEU 35 HG LEU 35 95.074 -2.238 -0.444
283 1HD1 LEU 35 HD11 LEU 35 96.147 -3.014 2.167
284 2HD1 LEU 35 HD12 LEU 35 94.738 -3.611 1.292
285 3HD1 LEU 35 HD13 LEU 35 94.625 -2.126 2.236
286 1HD2 LEU 35 HD21 LEU 35 94.881 -0.025 -0.234
287 2HD2 LEU 35 HD22 LEU 35 96.382 0.087 0.690
288 3HD2 LEU 35 HD23 LEU 35 94.868 -0.285 1.513
289 H LYS 36 HN LYS 36 97.506 -3.885 -2.643
290 HA LYS 36 HA LYS 36 94.765 -4.542 -2.973
291 1HB LYS 36 HB2 LYS 36 96.900 -3.745 -4.666
292 2HB LYS 36 HB1 LYS 36 96.214 -5.216 -5.326
293 1HG LYS 36 HG2 LYS 36 94.283 -3.160 -4.473
294 2HG LYS 36 HG1 LYS 36 95.282 -2.767 -5.874
295 1HD LYS 36 HD2 LYS 36 94.511 -4.657 -7.073
296 2HD LYS 36 HD1 LYS 36 93.779 -5.362 -5.631
297 1HE LYS 36 HE2 LYS 36 92.498 -2.974 -5.751
298 2HE LYS 36 HE1 LYS 36 92.755 -3.302 -7.463
299 1HZ LYS 36 HZ1 LYS 36 91.547 -5.290 -7.327
300 2HZ LYS 36 HZ2 LYS 36 90.630 -4.172 -6.448
301 3HZ LYS 36 HZ3 LYS 36 91.580 -5.312 -5.635
302 H ASP 37 HN ASP 37 97.575 -6.605 -2.441
303 HA ASP 37 HA ASP 37 96.192 -8.861 -3.628
304 1HB ASP 37 HB2 ASP 37 98.919 -8.222 -2.912
305 2HB ASP 37 HB1 ASP 37 98.439 -9.760 -2.200
306 H ASP 38 HN ASP 38 96.191 -7.194 -0.724
307 HA ASP 38 HA ASP 38 94.668 -9.265 0.575
308 1HB ASP 38 HB2 ASP 38 97.255 -9.536 1.065
309 2HB ASP 38 HB1 ASP 38 96.942 -8.223 2.200
310 HA PRO 39 HA PRO 39 92.901 -5.420 2.024
311 1HB PRO 39 HB2 PRO 39 90.745 -6.438 3.244
312 2HB PRO 39 HB1 PRO 39 90.888 -6.449 1.484
313 1HG PRO 39 HG2 PRO 39 91.360 -8.664 3.436
314 2HG PRO 39 HG1 PRO 39 90.549 -8.713 1.860
315 1HD PRO 39 HD2 PRO 39 93.157 -9.487 2.291
316 2HD PRO 39 HD1 PRO 39 92.520 -8.946 0.726
317 H SER 40 HN SER 40 93.848 -8.108 3.998
318 HA SER 40 HA SER 40 93.321 -6.964 6.551
319 1HB SER 40 HB2 SER 40 94.715 -9.335 5.503
320 2HB SER 40 HB1 SER 40 95.380 -8.710 7.011
321 HG SER 40 HG SER 40 93.125 -8.743 7.768
322 H GLN 41 HN GLN 41 95.866 -6.663 4.230
323 HA GLN 41 HA GLN 41 97.882 -5.620 5.925
324 1HB GLN 41 HB2 GLN 41 97.376 -5.571 2.954
325 2HB GLN 41 HB1 GLN 41 98.720 -4.676 3.660
326 1HG GLN 41 HG2 GLN 41 99.043 -7.120 4.807
327 2HG GLN 41 HG1 GLN 41 98.401 -7.548 3.224
328 1HE2 GLN 41 HE21 GLN 41 101.114 -6.504 4.985
329 2HE2 GLN 41 HE22 GLN 41 102.202 -6.310 3.657
330 H SER 42 HN SER 42 94.990 -4.333 4.745
331 HA SER 42 HA SER 42 95.085 -1.793 4.094
332 1HB SER 42 HB2 SER 42 93.007 -1.493 5.053
333 2HB SER 42 HB1 SER 42 93.130 -3.247 5.122
334 HG SER 42 HG SER 42 93.208 -3.169 7.218
335 H ALA 43 HN ALA 43 95.141 -2.364 7.648
336 HA ALA 43 HA ALA 43 95.976 0.255 8.217
337 1HB ALA 43 HB1 ALA 43 94.802 -1.226 9.802
338 2HB ALA 43 HB2 ALA 43 96.252 -0.492 10.485
339 3HB ALA 43 HB3 ALA 43 96.278 -2.177 9.966
340 H ASN 44 HN ASN 44 97.820 -2.716 7.744
341 HA ASN 44 HA ASN 44 100.279 -1.757 8.730
342 1HB ASN 44 HB2 ASN 44 99.590 -3.902 6.718
343 2HB ASN 44 HB1 ASN 44 101.244 -3.579 7.231
344 1HD2 ASN 44 HD21 ASN 44 98.248 -5.026 8.022
345 2HD2 ASN 44 HD22 ASN 44 98.716 -5.696 9.545
346 H LEU 45 HN LEU 45 98.757 -1.630 5.598
347 HA LEU 45 HA LEU 45 100.977 -0.446 4.242
348 1HB LEU 45 HB2 LEU 45 98.123 -1.057 3.589
349 2HB LEU 45 HB1 LEU 45 99.068 -0.080 2.500
350 HG LEU 45 HG LEU 45 98.862 -2.701 2.202
351 1HD1 LEU 45 HD11 LEU 45 100.596 -2.565 0.728
352 2HD1 LEU 45 HD12 LEU 45 101.615 -1.644 1.837
353 3HD1 LEU 45 HD13 LEU 45 100.278 -0.852 0.996
354 1HD2 LEU 45 HD21 LEU 45 100.702 -3.915 3.174
355 2HD2 LEU 45 HD22 LEU 45 99.752 -3.178 4.464
356 3HD2 LEU 45 HD23 LEU 45 101.287 -2.459 3.979
357 H LEU 46 HN LEU 46 97.912 0.700 5.569
358 HA LEU 46 HA LEU 46 98.186 3.369 4.652
359 1HB LEU 46 HB2 LEU 46 96.228 1.812 5.951
360 2HB LEU 46 HB1 LEU 46 96.525 3.197 6.984
361 HG LEU 46 HG LEU 46 95.694 3.275 4.085
362 1HD1 LEU 46 HD11 LEU 46 93.823 4.644 5.474
363 2HD1 LEU 46 HD12 LEU 46 94.261 3.405 6.649
364 3HD1 LEU 46 HD13 LEU 46 93.688 2.938 5.048
365 1HD2 LEU 46 HD21 LEU 46 96.833 5.308 5.881
366 2HD2 LEU 46 HD22 LEU 46 95.395 5.798 4.986
367 3HD2 LEU 46 HD23 LEU 46 96.819 5.222 4.120
368 H ALA 47 HN ALA 47 99.196 1.741 7.622
369 HA ALA 47 HA ALA 47 99.741 4.189 9.015
370 1HB ALA 47 HB1 ALA 47 101.061 2.481 10.506
371 2HB ALA 47 HB2 ALA 47 100.155 1.295 9.566
372 3HB ALA 47 HB3 ALA 47 99.298 2.514 10.508
373 H GLU 48 HN GLU 48 101.804 1.674 7.534
374 HA GLU 48 HA GLU 48 104.225 3.046 8.055
375 1HB GLU 48 HB2 GLU 48 105.262 1.477 6.513
376 2HB GLU 48 HB1 GLU 48 104.153 0.631 7.583
377 1HG GLU 48 HG2 GLU 48 102.466 0.930 5.649
378 2HG GLU 48 HG1 GLU 48 103.907 1.235 4.686
379 H ALA 49 HN ALA 49 102.006 3.026 5.311
380 HA ALA 49 HA ALA 49 103.687 4.557 3.600
381 1HB ALA 49 HB1 ALA 49 101.773 3.097 2.869
382 2HB ALA 49 HB2 ALA 49 101.824 4.698 2.133
383 3HB ALA 49 HB3 ALA 49 100.687 4.363 3.438
384 H LYS 50 HN LYS 50 100.979 5.386 5.753
385 HA LYS 50 HA LYS 50 101.002 8.154 5.115
386 1HB LYS 50 HB2 LYS 50 99.056 6.975 6.111
387 2HB LYS 50 HB1 LYS 50 99.959 6.801 7.610
388 1HG LYS 50 HG2 LYS 50 98.331 8.666 7.625
389 2HG LYS 50 HG1 LYS 50 99.993 9.168 7.943
390 1HD LYS 50 HD2 LYS 50 100.236 10.106 5.803
391 2HD LYS 50 HD1 LYS 50 98.818 9.262 5.180
392 1HE LYS 50 HE2 LYS 50 98.115 10.924 7.428
393 2HE LYS 50 HE1 LYS 50 98.939 11.868 6.187
394 1HZ LYS 50 HZ1 LYS 50 97.234 11.641 4.765
395 2HZ LYS 50 HZ2 LYS 50 96.328 11.328 6.158
396 3HZ LYS 50 HZ3 LYS 50 96.903 10.045 5.219
397 H LYS 51 HN LYS 51 102.862 6.162 7.280
398 HA LYS 51 HA LYS 51 103.815 8.365 8.875
399 1HB LYS 51 HB2 LYS 51 104.600 5.457 8.683
400 2HB LYS 51 HB1 LYS 51 105.416 6.600 9.742
401 1HG LYS 51 HG2 LYS 51 102.512 6.612 10.032
402 2HG LYS 51 HG1 LYS 51 103.262 5.061 10.416
403 1HD LYS 51 HD2 LYS 51 104.909 6.427 11.828
404 2HD LYS 51 HD1 LYS 51 103.747 7.746 11.670
405 1HE LYS 51 HE2 LYS 51 103.294 6.606 13.721
406 2HE LYS 51 HE1 LYS 51 102.000 6.222 12.586
407 1HZ LYS 51 HZ1 LYS 51 102.436 4.132 13.229
408 2HZ LYS 51 HZ2 LYS 51 103.999 4.490 13.766
409 3HZ LYS 51 HZ3 LYS 51 103.712 4.226 12.121
410 H LEU 52 HN LEU 52 105.157 6.194 6.401
411 HA LEU 52 HA LEU 52 107.713 7.247 6.242
412 1HB LEU 52 HB2 LEU 52 106.426 5.278 4.935
413 2HB LEU 52 HB1 LEU 52 106.432 6.499 3.677
414 HG LEU 52 HG LEU 52 109.032 6.580 4.459
415 1HD1 LEU 52 HD11 LEU 52 109.879 4.544 5.081
416 2HD1 LEU 52 HD12 LEU 52 108.505 3.649 4.431
417 3HD1 LEU 52 HD13 LEU 52 108.341 4.540 5.944
418 1HD2 LEU 52 HD21 LEU 52 109.518 5.344 2.442
419 2HD2 LEU 52 HD22 LEU 52 108.137 6.406 2.164
420 3HD2 LEU 52 HD23 LEU 52 107.884 4.678 2.418
421 H ASN 53 HN ASN 53 104.769 8.287 4.581
422 HA ASN 53 HA ASN 53 105.800 10.208 2.879
423 1HB ASN 53 HB2 ASN 53 103.612 10.434 2.463
424 2HB ASN 53 HB1 ASN 53 103.256 9.443 3.869
425 1HD2 ASN 53 HD21 ASN 53 102.627 12.290 2.412
426 2HD2 ASN 53 HD22 ASN 53 102.124 13.225 3.778
427 H ASP 54 HN ASP 54 104.955 10.680 6.334
428 HA ASP 54 HA ASP 54 105.808 13.409 6.318
429 1HB ASP 54 HB2 ASP 54 105.360 13.367 8.696
430 2HB ASP 54 HB1 ASP 54 104.049 12.556 7.846
431 H ALA 55 HN ALA 55 107.306 10.358 6.821
432 HA ALA 55 HA ALA 55 109.575 11.355 8.297
433 1HB ALA 55 HB1 ALA 55 110.481 9.143 8.108
434 2HB ALA 55 HB2 ALA 55 109.335 8.732 6.832
435 3HB ALA 55 HB3 ALA 55 108.761 9.013 8.476
436 H GLN 56 HN GLN 56 108.999 10.364 4.946
437 HA GLN 56 HA GLN 56 111.610 11.417 4.174
438 1HB GLN 56 HB2 GLN 56 111.273 10.170 2.078
439 2HB GLN 56 HB1 GLN 56 111.180 9.135 3.494
440 1HG GLN 56 HG2 GLN 56 109.187 8.416 2.875
441 2HG GLN 56 HG1 GLN 56 108.562 10.063 2.875
442 1HE2 GLN 56 HE21 GLN 56 109.426 11.339 0.867
443 2HE2 GLN 56 HE22 GLN 56 109.216 10.525 -0.642
444 H ALA 57 HN ALA 57 108.612 12.693 4.420
445 HA ALA 57 HA ALA 57 107.904 13.768 1.986
446 1HB ALA 57 HB1 ALA 57 107.498 15.881 3.718
447 2HB ALA 57 HB2 ALA 57 107.479 14.469 4.775
448 3HB ALA 57 HB3 ALA 57 106.373 14.559 3.405
449 HA PRO 58 HA PRO 58 111.671 16.219 1.370
450 1HB PRO 58 HB2 PRO 58 111.802 16.008 -1.279
451 2HB PRO 58 HB1 PRO 58 112.181 14.628 -0.242
452 1HG PRO 58 HG2 PRO 58 109.713 15.192 -1.821
453 2HG PRO 58 HG1 PRO 58 110.530 13.647 -1.528
454 1HD PRO 58 HD2 PRO 58 108.291 14.613 -0.153
455 2HD PRO 58 HD1 PRO 58 109.335 13.278 0.365
456 H LYS 59 HN LYS 59 108.949 17.369 1.684
457 HA LYS 59 HA LYS 59 108.921 19.429 -0.397
458 1HB LYS 59 HB2 LYS 59 106.802 18.275 0.123
459 2HB LYS 59 HB1 LYS 59 106.911 18.840 1.784
460 1HG LYS 59 HG2 LYS 59 106.697 21.134 1.057
461 2HG LYS 59 HG1 LYS 59 106.695 20.624 -0.633
462 1HD LYS 59 HD2 LYS 59 104.426 21.086 0.182
463 2HD LYS 59 HD1 LYS 59 104.624 19.394 -0.276
464 1HE LYS 59 HE2 LYS 59 103.384 19.608 1.817
465 2HE LYS 59 HE1 LYS 59 104.920 18.781 2.063
466 1HZ LYS 59 HZ1 LYS 59 103.971 21.065 3.354
467 2HZ LYS 59 HZ2 LYS 59 105.310 21.537 2.435
468 3HZ LYS 59 HZ3 LYS 59 105.460 20.291 3.569
469 H ALA 60 HN ALA 60 111.005 20.166 0.675
470 HA ALA 60 HA ALA 60 110.376 22.418 2.373
471 1HB ALA 60 HB1 ALA 60 111.987 20.097 3.370
472 2HB ALA 60 HB2 ALA 60 110.682 20.973 4.170
473 3HB ALA 60 HB3 ALA 60 112.265 21.727 3.983
Start of MODEL 13
1 1H GLY -1 HT1 GLY -1 90.114 -18.534 11.216
2 2H GLY -1 HT2 GLY -1 89.251 -17.390 12.113
3 3H GLY -1 HT3 GLY -1 90.559 -16.903 11.158
4 1HA GLY -1 HA1 GLY -1 89.065 -18.075 9.300
5 2HA GLY -1 HA2 GLY -1 87.818 -17.504 10.398
6 H SER 0 HN SER 0 90.928 -16.168 9.283
7 HA SER 0 HA SER 0 89.554 -13.987 7.959
8 1HB SER 0 HB2 SER 0 89.891 -13.405 10.461
9 2HB SER 0 HB1 SER 0 91.596 -13.248 10.043
10 HG SER 0 HG SER 0 91.127 -11.572 8.714
11 H THR 1 HN THR 1 90.495 -14.302 6.030
12 HA THR 1 HA THR 1 93.439 -14.401 5.938
13 HB THR 1 HB THR 1 92.490 -16.439 5.064
14 HG1 THR 1 HG1 THR 1 94.230 -15.313 3.876
15 1HG2 THR 1 HG21 THR 1 90.282 -15.932 4.471
16 2HG2 THR 1 HG22 THR 1 91.097 -16.323 2.957
17 3HG2 THR 1 HG23 THR 1 90.783 -14.640 3.381
18 H ALA 2 HN ALA 2 90.864 -12.383 5.415
19 HA ALA 2 HA ALA 2 90.561 -10.428 4.298
20 1HB ALA 2 HB1 ALA 2 93.063 -10.339 5.322
21 2HB ALA 2 HB2 ALA 2 92.289 -9.001 4.474
22 3HB ALA 2 HB3 ALA 2 93.397 -10.068 3.612
23 H ASP 3 HN ASP 3 89.518 -11.680 2.596
24 HA ASP 3 HA ASP 3 90.975 -12.430 0.254
25 1HB ASP 3 HB2 ASP 3 88.656 -13.273 1.183
26 2HB ASP 3 HB1 ASP 3 88.022 -11.951 0.207
27 H ASN 4 HN ASN 4 88.469 -9.951 0.772
28 HA ASN 4 HA ASN 4 89.648 -7.722 -0.173
29 1HB ASN 4 HB2 ASN 4 90.233 -8.817 -2.267
30 2HB ASN 4 HB1 ASN 4 88.552 -9.267 -2.536
31 1HD2 ASN 4 HD21 ASN 4 87.036 -7.595 -2.990
32 2HD2 ASN 4 HD22 ASN 4 87.560 -6.098 -3.676
33 H LYS 5 HN LYS 5 88.103 -7.046 1.356
34 HA LYS 5 HA LYS 5 85.326 -6.962 0.379
35 1HB LYS 5 HB2 LYS 5 85.590 -8.069 2.552
36 2HB LYS 5 HB1 LYS 5 86.390 -6.641 3.194
37 1HG LYS 5 HG2 LYS 5 84.132 -6.663 3.969
38 2HG LYS 5 HG1 LYS 5 84.300 -5.358 2.792
39 1HD LYS 5 HD2 LYS 5 83.274 -6.725 1.078
40 2HD LYS 5 HD1 LYS 5 83.199 -8.101 2.181
41 1HE LYS 5 HE2 LYS 5 81.028 -7.099 2.091
42 2HE LYS 5 HE1 LYS 5 81.733 -6.742 3.668
43 1HZ LYS 5 HZ1 LYS 5 80.673 -4.795 2.727
44 2HZ LYS 5 HZ2 LYS 5 81.645 -4.892 1.346
45 3HZ LYS 5 HZ3 LYS 5 82.343 -4.546 2.848
46 H PHE 6 HN PHE 6 88.045 -5.115 1.454
47 HA PHE 6 HA PHE 6 88.240 -2.856 1.976
48 1HB PHE 6 HB2 PHE 6 87.761 -3.162 -0.976
49 2HB PHE 6 HB1 PHE 6 88.304 -1.650 -0.259
50 HD1 PHE 6 HD1 PHE 6 90.426 -1.730 1.178
51 HD2 PHE 6 HD2 PHE 6 89.329 -4.801 -1.555
52 HE1 PHE 6 HE1 PHE 6 92.750 -2.524 1.149
53 HE2 PHE 6 HE2 PHE 6 91.658 -5.603 -1.592
54 HZ PHE 6 HZ PHE 6 93.377 -4.470 -0.229
55 H ASN 7 HN ASN 7 85.829 -2.485 -0.584
56 HA ASN 7 HA ASN 7 83.786 -1.455 -0.609
57 1HB ASN 7 HB2 ASN 7 84.021 -2.268 2.135
58 2HB ASN 7 HB1 ASN 7 83.306 -0.668 2.078
59 1HD2 ASN 7 HD21 ASN 7 81.193 -0.608 1.873
60 2HD2 ASN 7 HD22 ASN 7 80.198 -1.850 1.201
61 H LYS 8 HN LYS 8 82.969 0.786 1.037
62 HA LYS 8 HA LYS 8 84.618 2.762 -0.202
63 1HB LYS 8 HB2 LYS 8 82.152 2.867 1.498
64 2HB LYS 8 HB1 LYS 8 83.019 4.338 1.078
65 1HG LYS 8 HG2 LYS 8 81.591 4.335 -0.661
66 2HG LYS 8 HG1 LYS 8 82.792 3.247 -1.359
67 1HD LYS 8 HD2 LYS 8 81.489 1.327 -0.466
68 2HD LYS 8 HD1 LYS 8 80.254 2.466 0.074
69 1HE LYS 8 HE2 LYS 8 79.962 3.215 -2.254
70 2HE LYS 8 HE1 LYS 8 81.153 2.023 -2.771
71 1HZ LYS 8 HZ1 LYS 8 78.383 1.658 -2.012
72 2HZ LYS 8 HZ2 LYS 8 79.446 0.498 -1.393
73 3HZ LYS 8 HZ3 LYS 8 79.349 0.749 -3.063
74 H GLU 9 HN GLU 9 84.320 1.492 3.042
75 HA GLU 9 HA GLU 9 85.714 3.659 4.295
76 1HB GLU 9 HB2 GLU 9 85.722 2.196 6.287
77 2HB GLU 9 HB1 GLU 9 84.126 2.388 5.576
78 1HG GLU 9 HG2 GLU 9 84.309 0.207 4.525
79 2HG GLU 9 HG1 GLU 9 85.934 0.015 5.180
80 H GLN 10 HN GLN 10 86.649 0.365 3.364
81 HA GLN 10 HA GLN 10 89.365 0.760 4.294
82 1HB GLN 10 HB2 GLN 10 87.829 -1.505 3.177
83 2HB GLN 10 HB1 GLN 10 89.560 -1.527 2.904
84 1HG GLN 10 HG2 GLN 10 88.341 -1.171 5.622
85 2HG GLN 10 HG1 GLN 10 88.714 -2.751 4.937
86 1HE2 GLN 10 HE21 GLN 10 90.847 -3.422 4.792
87 2HE2 GLN 10 HE22 GLN 10 92.138 -2.569 5.546
88 H GLN 11 HN GLN 11 87.661 0.840 1.229
89 HA GLN 11 HA GLN 11 89.882 0.730 -0.485
90 1HB GLN 11 HB2 GLN 11 87.634 0.425 -1.333
91 2HB GLN 11 HB1 GLN 11 87.210 2.077 -0.889
92 1HG GLN 11 HG2 GLN 11 87.995 2.873 -2.800
93 2HG GLN 11 HG1 GLN 11 89.534 2.039 -2.588
94 1HE2 GLN 11 HE21 GLN 11 86.901 2.321 -4.535
95 2HE2 GLN 11 HE22 GLN 11 86.986 0.805 -5.358
96 H ASN 12 HN ASN 12 88.656 3.299 1.499
97 HA ASN 12 HA ASN 12 89.597 5.541 0.181
98 1HB ASN 12 HB2 ASN 12 89.218 4.839 3.063
99 2HB ASN 12 HB1 ASN 12 90.092 6.317 2.674
100 1HD2 ASN 12 HD21 ASN 12 88.542 7.685 3.459
101 2HD2 ASN 12 HD22 ASN 12 86.999 7.896 2.710
102 H ALA 13 HN ALA 13 91.327 3.102 2.020
103 HA ALA 13 HA ALA 13 93.778 4.351 2.375
104 1HB ALA 13 HB1 ALA 13 93.298 1.440 1.732
105 2HB ALA 13 HB2 ALA 13 93.176 2.164 3.335
106 3HB ALA 13 HB3 ALA 13 94.730 2.118 2.505
107 H PHE 14 HN PHE 14 92.461 2.693 -0.469
108 HA PHE 14 HA PHE 14 94.683 2.503 -2.072
109 1HB PHE 14 HB2 PHE 14 92.488 1.581 -2.624
110 2HB PHE 14 HB1 PHE 14 91.842 3.191 -2.839
111 HD1 PHE 14 HD1 PHE 14 95.023 1.680 -4.073
112 HD2 PHE 14 HD2 PHE 14 91.248 3.386 -5.041
113 HE1 PHE 14 HE1 PHE 14 95.604 1.607 -6.466
114 HE2 PHE 14 HE2 PHE 14 91.824 3.318 -7.431
115 HZ PHE 14 HZ PHE 14 94.004 2.427 -8.145
116 H TRP 15 HN TRP 15 92.332 5.169 -2.075
117 HA TRP 15 HA TRP 15 93.751 6.784 -3.885
118 1HB TRP 15 HB2 TRP 15 91.463 7.126 -2.080
119 2HB TRP 15 HB1 TRP 15 92.358 8.609 -2.402
120 HD1 TRP 15 HD1 TRP 15 91.714 5.781 -4.954
121 HE1 TRP 15 HE1 TRP 15 90.395 6.778 -6.929
122 HE3 TRP 15 HE3 TRP 15 90.972 10.493 -3.126
123 HZ2 TRP 15 HZ2 TRP 15 89.200 9.244 -7.620
124 HZ3 TRP 15 HZ3 TRP 15 89.732 12.115 -4.506
125 HH2 TRP 15 HH2 TRP 15 88.867 11.501 -6.706
126 H GLU 16 HN GLU 16 93.521 7.107 -0.343
127 HA GLU 16 HA GLU 16 95.372 9.165 -0.032
128 1HB GLU 16 HB2 GLU 16 93.828 7.583 1.648
129 2HB GLU 16 HB1 GLU 16 95.476 7.222 2.140
130 1HG GLU 16 HG2 GLU 16 94.561 10.050 1.820
131 2HG GLU 16 HG1 GLU 16 94.213 9.144 3.292
132 H ILE 17 HN ILE 17 95.816 5.890 -0.725
133 HA ILE 17 HA ILE 17 98.638 5.782 0.013
134 HB ILE 17 HB ILE 17 96.749 3.750 -1.087
135 1HG1 ILE 17 HG12 ILE 17 98.903 3.131 0.850
136 2HG1 ILE 17 HG11 ILE 17 97.697 4.295 1.387
137 1HG2 ILE 17 HG21 ILE 17 98.560 3.563 -2.666
138 2HG2 ILE 17 HG22 ILE 17 98.658 2.220 -1.527
139 3HG2 ILE 17 HG23 ILE 17 99.749 3.597 -1.363
140 1HD1 ILE 17 HD11 ILE 17 96.578 2.495 2.060
141 2HD1 ILE 17 HD12 ILE 17 97.497 1.410 1.016
142 3HD1 ILE 17 HD13 ILE 17 96.138 2.322 0.362
143 H LEU 18 HN LEU 18 96.667 5.830 -2.900
144 HA LEU 18 HA LEU 18 98.797 5.883 -4.752
145 1HB LEU 18 HB2 LEU 18 95.874 6.161 -4.796
146 2HB LEU 18 HB1 LEU 18 96.692 7.046 -6.066
147 HG LEU 18 HG LEU 18 96.018 4.849 -6.846
148 1HD1 LEU 18 HD11 LEU 18 99.004 5.103 -6.493
149 2HD1 LEU 18 HD12 LEU 18 98.038 5.815 -7.786
150 3HD1 LEU 18 HD13 LEU 18 98.190 4.063 -7.664
151 1HD2 LEU 18 HD21 LEU 18 97.804 3.778 -4.667
152 2HD2 LEU 18 HD22 LEU 18 96.961 2.827 -5.887
153 3HD2 LEU 18 HD23 LEU 18 96.043 3.718 -4.677
154 H HIS 19 HN HIS 19 97.026 8.371 -3.055
155 HA HIS 19 HA HIS 19 98.142 10.505 -4.627
156 1HB HIS 19 HB2 HIS 19 96.285 10.278 -2.321
157 2HB HIS 19 HB1 HIS 19 97.197 11.778 -2.449
158 HD1 HIS 19 HD1 HIS 19 94.246 10.082 -3.747
159 HD2 HIS 19 HD2 HIS 19 96.751 13.157 -4.988
160 HE1 HIS 19 HE1 HIS 19 92.985 11.287 -5.558
161 HE2 HIS 19 HE2 HIS 19 94.485 13.195 -6.234
162 H LEU 20 HN LEU 20 98.378 9.670 -1.165
163 HA LEU 20 HA LEU 20 99.928 10.496 0.338
164 1HB LEU 20 HB2 LEU 20 100.695 8.193 -1.129
165 2HB LEU 20 HB1 LEU 20 102.142 9.077 -0.694
166 HG LEU 20 HG LEU 20 100.011 8.247 1.274
167 1HD1 LEU 20 HD11 LEU 20 101.995 6.662 -0.016
168 2HD1 LEU 20 HD12 LEU 20 100.843 6.198 1.235
169 3HD1 LEU 20 HD13 LEU 20 102.423 6.839 1.686
170 1HD2 LEU 20 HD21 LEU 20 102.662 9.603 1.485
171 2HD2 LEU 20 HD22 LEU 20 102.069 8.608 2.814
172 3HD2 LEU 20 HD23 LEU 20 101.134 10.000 2.269
173 HA PRO 21 HA PRO 21 102.048 13.582 -2.527
174 1HB PRO 21 HB2 PRO 21 100.686 15.522 -0.766
175 2HB PRO 21 HB1 PRO 21 100.767 15.478 -2.530
176 1HG PRO 21 HG2 PRO 21 98.502 14.898 -1.214
177 2HG PRO 21 HG1 PRO 21 98.953 14.060 -2.711
178 1HD PRO 21 HD2 PRO 21 99.190 13.131 0.127
179 2HD PRO 21 HD1 PRO 21 98.682 12.230 -1.313
180 H ASN 22 HN ASN 22 103.916 12.808 -1.502
181 HA ASN 22 HA ASN 22 105.555 14.329 -0.122
182 1HB ASN 22 HB2 ASN 22 103.414 13.994 1.702
183 2HB ASN 22 HB1 ASN 22 104.758 13.067 2.343
184 1HD2 ASN 22 HD21 ASN 22 104.695 14.643 4.065
185 2HD2 ASN 22 HD22 ASN 22 105.523 16.145 3.860
186 H LEU 23 HN LEU 23 104.586 11.305 -0.939
187 HA LEU 23 HA LEU 23 107.036 10.121 0.170
188 1HB LEU 23 HB2 LEU 23 105.255 9.061 1.319
189 2HB LEU 23 HB1 LEU 23 104.291 8.924 -0.137
190 HG LEU 23 HG LEU 23 106.796 7.481 -0.391
191 1HD1 LEU 23 HD11 LEU 23 104.985 6.244 1.615
192 2HD1 LEU 23 HD12 LEU 23 106.182 7.425 2.153
193 3HD1 LEU 23 HD13 LEU 23 106.700 5.964 1.312
194 1HD2 LEU 23 HD21 LEU 23 103.876 6.793 -0.577
195 2HD2 LEU 23 HD22 LEU 23 105.166 5.633 -0.889
196 3HD2 LEU 23 HD23 LEU 23 105.011 7.071 -1.895
197 H ASN 24 HN ASN 24 108.102 8.597 -1.219
198 HA ASN 24 HA ASN 24 108.176 9.336 -3.926
199 1HB ASN 24 HB2 ASN 24 109.581 7.539 -2.257
200 2HB ASN 24 HB1 ASN 24 108.953 6.567 -3.584
201 1HD2 ASN 24 HD21 ASN 24 109.796 6.797 -5.595
202 2HD2 ASN 24 HD22 ASN 24 111.146 7.810 -5.961
203 H GLU 25 HN GLU 25 106.490 9.103 -5.355
204 HA GLU 25 HA GLU 25 104.261 7.568 -4.849
205 1HB GLU 25 HB2 GLU 25 103.622 8.021 -7.134
206 2HB GLU 25 HB1 GLU 25 104.365 9.449 -6.409
207 1HG GLU 25 HG2 GLU 25 105.536 9.525 -8.312
208 2HG GLU 25 HG1 GLU 25 106.518 8.266 -7.564
209 H GLU 26 HN GLU 26 107.323 6.557 -6.014
210 HA GLU 26 HA GLU 26 106.480 4.123 -7.273
211 1HB GLU 26 HB2 GLU 26 109.157 4.933 -6.103
212 2HB GLU 26 HB1 GLU 26 108.878 3.476 -7.048
213 1HG GLU 26 HG2 GLU 26 107.883 5.485 -8.653
214 2HG GLU 26 HG1 GLU 26 109.314 6.207 -7.918
215 H GLN 27 HN GLN 27 107.076 5.266 -4.119
216 HA GLN 27 HA GLN 27 107.188 2.685 -2.806
217 1HB GLN 27 HB2 GLN 27 107.222 5.528 -1.898
218 2HB GLN 27 HB1 GLN 27 106.606 4.330 -0.770
219 1HG GLN 27 HG2 GLN 27 109.008 3.311 -1.851
220 2HG GLN 27 HG1 GLN 27 109.301 4.988 -1.394
221 1HE2 GLN 27 HE21 GLN 27 110.642 4.419 0.307
222 2HE2 GLN 27 HE22 GLN 27 110.041 3.715 1.765
223 H ARG 28 HN ARG 28 104.899 5.201 -3.641
224 HA ARG 28 HA ARG 28 102.665 4.276 -2.207
225 1HB ARG 28 HB2 ARG 28 102.940 5.852 -4.766
226 2HB ARG 28 HB1 ARG 28 101.364 5.372 -4.160
227 1HG ARG 28 HG2 ARG 28 102.056 6.521 -1.983
228 2HG ARG 28 HG1 ARG 28 103.348 7.251 -2.937
229 1HD ARG 28 HD2 ARG 28 100.876 7.503 -4.345
230 2HD ARG 28 HD1 ARG 28 100.657 8.083 -2.713
231 HE ARG 28 HE ARG 28 102.431 9.660 -3.090
232 1HH1 ARG 28 HH11 ARG 28 101.240 8.046 -5.956
233 2HH1 ARG 28 HH12 ARG 28 101.819 9.273 -7.029
234 1HH2 ARG 28 HH21 ARG 28 103.183 11.264 -4.506
235 2HH2 ARG 28 HH22 ARG 28 102.921 11.095 -6.210
236 H ASN 29 HN ASN 29 103.645 3.681 -5.623
237 HA ASN 29 HA ASN 29 101.730 1.876 -6.333
238 1HB ASN 29 HB2 ASN 29 103.726 2.837 -7.685
239 2HB ASN 29 HB1 ASN 29 104.601 1.427 -7.096
240 1HD2 ASN 29 HD21 ASN 29 104.785 0.171 -8.828
241 2HD2 ASN 29 HD22 ASN 29 103.473 -0.374 -9.811
242 H GLY 30 HN GLY 30 104.884 1.116 -4.811
243 1HA GLY 30 HA2 GLY 30 104.529 -1.639 -4.575
244 2HA GLY 30 HA1 GLY 30 105.453 -0.661 -3.440
245 H PHE 31 HN PHE 31 103.265 0.968 -2.588
246 HA PHE 31 HA PHE 31 102.217 -0.670 -0.515
247 1HB PHE 31 HB2 PHE 31 101.871 2.182 -1.351
248 2HB PHE 31 HB1 PHE 31 100.721 1.490 -0.214
249 HD1 PHE 31 HD1 PHE 31 103.659 3.310 -0.449
250 HD2 PHE 31 HD2 PHE 31 101.924 0.101 1.734
251 HE1 PHE 31 HE1 PHE 31 105.233 3.719 1.394
252 HE2 PHE 31 HE2 PHE 31 103.493 0.499 3.583
253 HZ PHE 31 HZ PHE 31 105.152 2.316 3.416
254 H ILE 32 HN ILE 32 100.993 0.413 -3.612
255 HA ILE 32 HA ILE 32 98.256 -0.208 -3.156
256 HB ILE 32 HB ILE 32 99.412 -0.424 -5.902
257 1HG1 ILE 32 HG12 ILE 32 98.981 2.200 -4.459
258 2HG1 ILE 32 HG11 ILE 32 100.542 1.523 -4.905
259 1HG2 ILE 32 HG21 ILE 32 96.914 0.910 -4.877
260 2HG2 ILE 32 HG22 ILE 32 97.002 -0.757 -5.447
261 3HG2 ILE 32 HG23 ILE 32 97.330 0.572 -6.558
262 1HD1 ILE 32 HD11 ILE 32 99.755 3.282 -6.439
263 2HD1 ILE 32 HD12 ILE 32 98.392 2.249 -6.871
264 3HD1 ILE 32 HD13 ILE 32 100.036 1.734 -7.234
265 H GLN 33 HN GLN 33 100.916 -1.978 -4.674
266 HA GLN 33 HA GLN 33 99.406 -4.249 -5.402
267 1HB GLN 33 HB2 GLN 33 102.346 -4.244 -4.718
268 2HB GLN 33 HB1 GLN 33 101.498 -5.350 -5.789
269 1HG GLN 33 HG2 GLN 33 101.840 -2.404 -6.300
270 2HG GLN 33 HG1 GLN 33 102.869 -3.668 -6.969
271 1HE2 GLN 33 HE21 GLN 33 102.307 -3.047 -9.068
272 2HE2 GLN 33 HE22 GLN 33 100.772 -3.445 -9.753
273 H SER 34 HN SER 34 101.488 -3.623 -2.573
274 HA SER 34 HA SER 34 101.027 -6.097 -1.313
275 1HB SER 34 HB2 SER 34 102.836 -4.364 -0.785
276 2HB SER 34 HB1 SER 34 101.600 -3.519 0.147
277 HG SER 34 HG SER 34 101.813 -4.946 1.669
278 H LEU 35 HN LEU 35 99.336 -3.001 -1.154
279 HA LEU 35 HA LEU 35 97.560 -3.795 0.937
280 1HB LEU 35 HB2 LEU 35 97.834 -1.477 0.727
281 2HB LEU 35 HB1 LEU 35 97.602 -1.512 -1.011
282 HG LEU 35 HG LEU 35 95.221 -1.992 -0.704
283 1HD1 LEU 35 HD11 LEU 35 94.621 -3.007 1.180
284 2HD1 LEU 35 HD12 LEU 35 94.684 -1.417 1.941
285 3HD1 LEU 35 HD13 LEU 35 96.081 -2.491 2.021
286 1HD2 LEU 35 HD21 LEU 35 95.526 0.309 1.100
287 2HD2 LEU 35 HD22 LEU 35 94.686 0.175 -0.445
288 3HD2 LEU 35 HD23 LEU 35 96.434 0.402 -0.409
289 H LYS 36 HN LYS 36 97.195 -3.513 -2.613
290 HA LYS 36 HA LYS 36 94.522 -4.195 -2.776
291 1HB LYS 36 HB2 LYS 36 95.879 -3.437 -4.695
292 2HB LYS 36 HB1 LYS 36 96.710 -4.986 -4.710
293 1HG LYS 36 HG2 LYS 36 95.106 -5.122 -6.410
294 2HG LYS 36 HG1 LYS 36 94.433 -6.043 -5.064
295 1HD LYS 36 HD2 LYS 36 92.591 -4.810 -5.436
296 2HD LYS 36 HD1 LYS 36 93.460 -3.558 -4.546
297 1HE LYS 36 HE2 LYS 36 92.555 -2.662 -6.616
298 2HE LYS 36 HE1 LYS 36 94.317 -2.662 -6.661
299 1HZ LYS 36 HZ1 LYS 36 93.083 -3.481 -8.711
300 2HZ LYS 36 HZ2 LYS 36 92.749 -4.881 -7.822
301 3HZ LYS 36 HZ3 LYS 36 94.352 -4.443 -8.139
302 H ASP 37 HN ASP 37 97.253 -6.509 -3.248
303 HA ASP 37 HA ASP 37 95.731 -8.786 -3.289
304 1HB ASP 37 HB2 ASP 37 98.389 -8.254 -3.422
305 2HB ASP 37 HB1 ASP 37 98.296 -9.067 -1.862
306 H ASP 38 HN ASP 38 96.312 -6.791 -0.531
307 HA ASP 38 HA ASP 38 94.854 -8.726 1.098
308 1HB ASP 38 HB2 ASP 38 97.481 -8.820 1.342
309 2HB ASP 38 HB1 ASP 38 97.209 -7.420 2.374
310 HA PRO 39 HA PRO 39 93.031 -4.691 2.089
311 1HB PRO 39 HB2 PRO 39 90.693 -5.636 3.008
312 2HB PRO 39 HB1 PRO 39 91.053 -5.598 1.279
313 1HG PRO 39 HG2 PRO 39 91.219 -7.894 3.195
314 2HG PRO 39 HG1 PRO 39 90.553 -7.857 1.552
315 1HD PRO 39 HD2 PRO 39 93.048 -8.793 2.141
316 2HD PRO 39 HD1 PRO 39 92.619 -8.072 0.577
317 H SER 40 HN SER 40 93.488 -7.490 4.086
318 HA SER 40 HA SER 40 92.836 -6.240 6.589
319 1HB SER 40 HB2 SER 40 92.683 -8.639 6.493
320 2HB SER 40 HB1 SER 40 94.341 -8.777 5.907
321 HG SER 40 HG SER 40 93.420 -8.099 8.483
322 H GLN 41 HN GLN 41 95.430 -6.194 4.428
323 HA GLN 41 HA GLN 41 97.441 -5.449 6.376
324 1HB GLN 41 HB2 GLN 41 97.471 -5.720 3.364
325 2HB GLN 41 HB1 GLN 41 98.869 -5.225 4.315
326 1HG GLN 41 HG2 GLN 41 97.451 -7.796 4.885
327 2HG GLN 41 HG1 GLN 41 98.672 -7.681 3.618
328 1HE2 GLN 41 HE21 GLN 41 98.086 -7.305 7.058
329 2HE2 GLN 41 HE22 GLN 41 99.725 -7.536 7.553
330 H SER 42 HN SER 42 94.977 -3.910 4.658
331 HA SER 42 HA SER 42 95.987 -1.550 3.709
332 1HB SER 42 HB2 SER 42 93.846 -0.697 3.814
333 2HB SER 42 HB1 SER 42 93.511 -2.420 3.984
334 HG SER 42 HG SER 42 93.626 -0.454 6.022
335 H ALA 43 HN ALA 43 95.798 -2.528 7.047
336 HA ALA 43 HA ALA 43 96.233 0.108 8.109
337 1HB ALA 43 HB1 ALA 43 96.818 -2.336 9.701
338 2HB ALA 43 HB2 ALA 43 95.152 -2.026 9.213
339 3HB ALA 43 HB3 ALA 43 96.023 -0.837 10.182
340 H ASN 44 HN ASN 44 98.207 -2.777 7.559
341 HA ASN 44 HA ASN 44 100.585 -1.726 8.680
342 1HB ASN 44 HB2 ASN 44 100.000 -4.175 8.209
343 2HB ASN 44 HB1 ASN 44 100.480 -3.850 6.547
344 1HD2 ASN 44 HD21 ASN 44 102.641 -3.383 6.091
345 2HD2 ASN 44 HD22 ASN 44 103.909 -3.782 7.196
346 H LEU 45 HN LEU 45 99.293 -1.781 5.389
347 HA LEU 45 HA LEU 45 101.654 -0.608 4.252
348 1HB LEU 45 HB2 LEU 45 98.900 -1.188 3.199
349 2HB LEU 45 HB1 LEU 45 100.074 -0.299 2.249
350 HG LEU 45 HG LEU 45 100.025 -2.664 1.625
351 1HD1 LEU 45 HD11 LEU 45 102.115 -1.872 1.147
352 2HD1 LEU 45 HD12 LEU 45 102.523 -3.153 2.289
353 3HD1 LEU 45 HD13 LEU 45 102.474 -1.476 2.827
354 1HD2 LEU 45 HD21 LEU 45 99.359 -3.411 3.945
355 2HD2 LEU 45 HD22 LEU 45 101.064 -3.293 4.372
356 3HD2 LEU 45 HD23 LEU 45 100.545 -4.414 3.112
357 H LEU 46 HN LEU 46 98.368 0.555 4.972
358 HA LEU 46 HA LEU 46 98.750 3.187 4.081
359 1HB LEU 46 HB2 LEU 46 96.549 2.159 4.576
360 2HB LEU 46 HB1 LEU 46 96.925 2.234 6.287
361 HG LEU 46 HG LEU 46 97.284 4.837 5.560
362 1HD1 LEU 46 HD11 LEU 46 96.478 5.004 3.457
363 2HD1 LEU 46 HD12 LEU 46 94.935 5.104 4.306
364 3HD1 LEU 46 HD13 LEU 46 95.463 3.571 3.612
365 1HD2 LEU 46 HD21 LEU 46 94.824 3.412 6.549
366 2HD2 LEU 46 HD22 LEU 46 94.978 5.169 6.507
367 3HD2 LEU 46 HD23 LEU 46 96.073 4.211 7.503
368 H ALA 47 HN ALA 47 99.425 1.655 7.185
369 HA ALA 47 HA ALA 47 100.014 4.091 8.552
370 1HB ALA 47 HB1 ALA 47 100.749 2.718 10.357
371 2HB ALA 47 HB2 ALA 47 100.941 1.323 9.296
372 3HB ALA 47 HB3 ALA 47 99.329 1.946 9.652
373 H GLU 48 HN GLU 48 101.996 1.556 7.048
374 HA GLU 48 HA GLU 48 104.496 2.719 7.669
375 1HB GLU 48 HB2 GLU 48 103.581 0.689 5.653
376 2HB GLU 48 HB1 GLU 48 105.236 1.282 5.634
377 1HG GLU 48 HG2 GLU 48 104.485 0.518 8.297
378 2HG GLU 48 HG1 GLU 48 104.179 -0.800 7.167
379 H ALA 49 HN ALA 49 102.320 3.021 4.911
380 HA ALA 49 HA ALA 49 104.085 4.548 3.294
381 1HB ALA 49 HB1 ALA 49 102.383 4.642 1.771
382 2HB ALA 49 HB2 ALA 49 101.141 4.846 3.006
383 3HB ALA 49 HB3 ALA 49 101.852 3.257 2.724
384 H LYS 50 HN LYS 50 101.512 5.406 5.572
385 HA LYS 50 HA LYS 50 101.553 8.179 5.083
386 1HB LYS 50 HB2 LYS 50 100.327 6.373 6.997
387 2HB LYS 50 HB1 LYS 50 100.838 7.868 7.766
388 1HG LYS 50 HG2 LYS 50 99.311 8.001 5.213
389 2HG LYS 50 HG1 LYS 50 98.458 7.654 6.719
390 1HD LYS 50 HD2 LYS 50 99.811 9.724 7.596
391 2HD LYS 50 HD1 LYS 50 99.912 10.122 5.880
392 1HE LYS 50 HE2 LYS 50 97.230 9.346 6.709
393 2HE LYS 50 HE1 LYS 50 97.836 10.755 7.579
394 1HZ LYS 50 HZ1 LYS 50 96.613 11.122 5.381
395 2HZ LYS 50 HZ2 LYS 50 98.037 10.590 4.639
396 3HZ LYS 50 HZ3 LYS 50 98.062 11.962 5.628
397 H LYS 51 HN LYS 51 103.053 6.328 7.780
398 HA LYS 51 HA LYS 51 104.392 8.444 8.940
399 1HB LYS 51 HB2 LYS 51 105.156 5.528 8.783
400 2HB LYS 51 HB1 LYS 51 105.940 6.695 9.839
401 1HG LYS 51 HG2 LYS 51 103.472 7.122 10.645
402 2HG LYS 51 HG1 LYS 51 103.232 5.490 10.019
403 1HD LYS 51 HD2 LYS 51 105.355 4.925 11.404
404 2HD LYS 51 HD1 LYS 51 104.982 6.422 12.261
405 1HE LYS 51 HE2 LYS 51 103.118 4.076 11.914
406 2HE LYS 51 HE1 LYS 51 104.017 4.466 13.380
407 1HZ LYS 51 HZ1 LYS 51 101.611 5.674 12.308
408 2HZ LYS 51 HZ2 LYS 51 102.745 6.768 12.923
409 3HZ LYS 51 HZ3 LYS 51 102.134 5.538 13.911
410 H LEU 52 HN LEU 52 105.570 6.192 6.447
411 HA LEU 52 HA LEU 52 108.151 7.166 6.202
412 1HB LEU 52 HB2 LEU 52 106.896 5.179 5.025
413 2HB LEU 52 HB1 LEU 52 106.640 6.359 3.755
414 HG LEU 52 HG LEU 52 109.419 6.259 4.630
415 1HD1 LEU 52 HD11 LEU 52 110.015 4.109 4.022
416 2HD1 LEU 52 HD12 LEU 52 108.504 3.823 3.159
417 3HD1 LEU 52 HD13 LEU 52 108.520 3.849 4.922
418 1HD2 LEU 52 HD21 LEU 52 108.129 7.155 2.468
419 2HD2 LEU 52 HD22 LEU 52 108.578 5.553 1.885
420 3HD2 LEU 52 HD23 LEU 52 109.824 6.670 2.441
421 H ASN 53 HN ASN 53 105.226 8.227 4.481
422 HA ASN 53 HA ASN 53 106.361 10.144 2.839
423 1HB ASN 53 HB2 ASN 53 104.228 10.446 2.223
424 2HB ASN 53 HB1 ASN 53 103.797 9.260 3.442
425 1HD2 ASN 53 HD21 ASN 53 102.809 12.008 2.267
426 2HD2 ASN 53 HD22 ASN 53 102.220 12.809 3.680
427 H ASP 54 HN ASP 54 105.312 10.466 6.200
428 HA ASP 54 HA ASP 54 105.886 13.262 6.330
429 1HB ASP 54 HB2 ASP 54 105.275 13.150 8.632
430 2HB ASP 54 HB1 ASP 54 104.163 12.119 7.744
431 H ALA 55 HN ALA 55 107.720 10.382 6.760
432 HA ALA 55 HA ALA 55 109.811 11.679 8.303
433 1HB ALA 55 HB1 ALA 55 110.550 9.615 8.777
434 2HB ALA 55 HB2 ALA 55 110.411 9.072 7.105
435 3HB ALA 55 HB3 ALA 55 108.988 9.092 8.147
436 H GLN 56 HN GLN 56 109.198 10.695 4.982
437 HA GLN 56 HA GLN 56 111.849 11.684 4.195
438 1HB GLN 56 HB2 GLN 56 111.374 10.512 2.032
439 2HB GLN 56 HB1 GLN 56 111.479 9.455 3.434
440 1HG GLN 56 HG2 GLN 56 109.435 8.687 3.093
441 2HG GLN 56 HG1 GLN 56 108.771 10.318 3.041
442 1HE2 GLN 56 HE21 GLN 56 109.372 11.483 0.907
443 2HE2 GLN 56 HE22 GLN 56 109.073 10.565 -0.525
444 H ALA 57 HN ALA 57 108.799 12.881 4.450
445 HA ALA 57 HA ALA 57 107.774 14.014 2.332
446 1HB ALA 57 HB1 ALA 57 107.478 16.145 3.542
447 2HB ALA 57 HB2 ALA 57 108.658 15.602 4.735
448 3HB ALA 57 HB3 ALA 57 107.136 14.731 4.539
449 HA PRO 58 HA PRO 58 111.366 15.734 0.180
450 1HB PRO 58 HB2 PRO 58 110.267 15.800 -2.266
451 2HB PRO 58 HB1 PRO 58 110.801 14.284 -1.529
452 1HG PRO 58 HG2 PRO 58 108.041 15.427 -1.727
453 2HG PRO 58 HG1 PRO 58 108.582 13.758 -1.988
454 1HD PRO 58 HD2 PRO 58 107.431 14.636 0.335
455 2HD PRO 58 HD1 PRO 58 108.564 13.276 0.253
456 H LYS 59 HN LYS 59 108.753 17.256 1.295
457 HA LYS 59 HA LYS 59 109.066 19.628 -0.402
458 1HB LYS 59 HB2 LYS 59 106.956 20.397 0.489
459 2HB LYS 59 HB1 LYS 59 106.769 18.747 -0.070
460 1HG LYS 59 HG2 LYS 59 106.526 17.900 2.049
461 2HG LYS 59 HG1 LYS 59 107.397 19.238 2.798
462 1HD LYS 59 HD2 LYS 59 105.399 20.082 3.324
463 2HD LYS 59 HD1 LYS 59 105.213 20.454 1.609
464 1HE LYS 59 HE2 LYS 59 103.367 19.190 1.750
465 2HE LYS 59 HE1 LYS 59 104.489 17.833 1.677
466 1HZ LYS 59 HZ1 LYS 59 104.535 17.845 4.125
467 2HZ LYS 59 HZ2 LYS 59 102.992 17.536 3.507
468 3HZ LYS 59 HZ3 LYS 59 103.360 19.063 4.132
469 H ALA 60 HN ALA 60 107.863 21.189 1.939
470 HA ALA 60 HA ALA 60 108.574 22.467 3.659
471 1HB ALA 60 HB1 ALA 60 110.730 21.284 4.850
472 2HB ALA 60 HB2 ALA 60 109.915 19.907 4.107
473 3HB ALA 60 HB3 ALA 60 109.043 20.945 5.235
Start of MODEL 14
1 1H GLY -1 HT1 GLY -1 76.718 -14.658 7.418
2 2H GLY -1 HT2 GLY -1 75.984 -14.417 8.923
3 3H GLY -1 HT3 GLY -1 77.432 -13.625 8.552
4 1HA GLY -1 HA1 GLY -1 75.021 -13.192 6.910
5 2HA GLY -1 HA2 GLY -1 75.248 -12.307 8.411
6 H SER 0 HN SER 0 77.369 -11.152 8.622
7 HA SER 0 HA SER 0 78.627 -10.402 6.113
8 1HB SER 0 HB2 SER 0 76.730 -8.679 7.579
9 2HB SER 0 HB1 SER 0 78.247 -7.902 7.126
10 HG SER 0 HG SER 0 76.561 -7.771 5.517
11 H THR 1 HN THR 1 80.677 -10.809 6.638
12 HA THR 1 HA THR 1 82.016 -9.209 8.576
13 HB THR 1 HB THR 1 82.096 -12.153 9.187
14 HG1 THR 1 HG1 THR 1 80.446 -10.217 10.434
15 1HG2 THR 1 HG21 THR 1 82.618 -11.138 11.497
16 2HG2 THR 1 HG22 THR 1 83.000 -9.678 10.584
17 3HG2 THR 1 HG23 THR 1 83.880 -11.174 10.265
18 H ALA 2 HN ALA 2 82.016 -10.969 5.790
19 HA ALA 2 HA ALA 2 84.941 -10.908 5.674
20 1HB ALA 2 HB1 ALA 2 83.186 -13.268 5.212
21 2HB ALA 2 HB2 ALA 2 84.768 -13.171 5.988
22 3HB ALA 2 HB3 ALA 2 84.640 -13.083 4.231
23 H ASP 3 HN ASP 3 83.776 -8.863 4.620
24 HA ASP 3 HA ASP 3 83.854 -9.367 1.733
25 1HB ASP 3 HB2 ASP 3 81.601 -8.251 3.286
26 2HB ASP 3 HB1 ASP 3 82.022 -7.363 1.825
27 H ASN 4 HN ASN 4 86.083 -8.553 2.475
28 HA ASN 4 HA ASN 4 86.628 -6.016 3.345
29 1HB ASN 4 HB2 ASN 4 88.692 -6.253 1.694
30 2HB ASN 4 HB1 ASN 4 88.559 -7.229 3.151
31 1HD2 ASN 4 HD21 ASN 4 89.467 -7.399 0.097
32 2HD2 ASN 4 HD22 ASN 4 89.062 -9.036 -0.279
33 H LYS 5 HN LYS 5 87.245 -6.609 -0.099
34 HA LYS 5 HA LYS 5 87.167 -5.112 -1.844
35 1HB LYS 5 HB2 LYS 5 84.697 -6.143 -1.233
36 2HB LYS 5 HB1 LYS 5 84.365 -4.419 -1.307
37 1HG LYS 5 HG2 LYS 5 85.552 -6.138 -3.472
38 2HG LYS 5 HG1 LYS 5 83.963 -5.372 -3.461
39 1HD LYS 5 HD2 LYS 5 84.994 -3.759 -4.646
40 2HD LYS 5 HD1 LYS 5 85.574 -3.225 -3.067
41 1HE LYS 5 HE2 LYS 5 87.371 -5.198 -3.818
42 2HE LYS 5 HE1 LYS 5 87.044 -4.326 -5.315
43 1HZ LYS 5 HZ1 LYS 5 87.782 -2.325 -4.383
44 2HZ LYS 5 HZ2 LYS 5 88.922 -3.470 -3.883
45 3HZ LYS 5 HZ3 LYS 5 87.740 -2.927 -2.802
46 H PHE 6 HN PHE 6 88.527 -3.656 -0.471
47 HA PHE 6 HA PHE 6 88.112 -1.647 1.110
48 1HB PHE 6 HB2 PHE 6 89.424 -1.056 -1.533
49 2HB PHE 6 HB1 PHE 6 89.751 -0.293 0.013
50 HD1 PHE 6 HD1 PHE 6 91.728 -1.577 -1.888
51 HD2 PHE 6 HD2 PHE 6 89.657 -3.055 1.519
52 HE1 PHE 6 HE1 PHE 6 93.546 -3.173 -1.483
53 HE2 PHE 6 HE2 PHE 6 91.473 -4.656 1.931
54 HZ PHE 6 HZ PHE 6 93.424 -4.720 0.428
55 H ASN 7 HN ASN 7 85.748 -1.169 0.958
56 HA ASN 7 HA ASN 7 85.027 0.602 -1.212
57 1HB ASN 7 HB2 ASN 7 83.601 -1.004 0.776
58 2HB ASN 7 HB1 ASN 7 82.885 0.585 0.521
59 1HD2 ASN 7 HD21 ASN 7 81.796 0.996 -1.321
60 2HD2 ASN 7 HD22 ASN 7 81.548 -0.160 -2.581
61 H LYS 8 HN LYS 8 84.006 1.056 2.155
62 HA LYS 8 HA LYS 8 84.455 3.883 1.910
63 1HB LYS 8 HB2 LYS 8 83.453 2.300 4.271
64 2HB LYS 8 HB1 LYS 8 83.342 4.041 4.057
65 1HG LYS 8 HG2 LYS 8 81.312 3.650 3.235
66 2HG LYS 8 HG1 LYS 8 82.142 3.083 1.785
67 1HD LYS 8 HD2 LYS 8 82.169 0.796 2.775
68 2HD LYS 8 HD1 LYS 8 81.191 1.410 4.108
69 1HE LYS 8 HE2 LYS 8 79.698 0.398 2.564
70 2HE LYS 8 HE1 LYS 8 79.503 2.143 2.399
71 1HZ LYS 8 HZ1 LYS 8 79.595 1.293 0.229
72 2HZ LYS 8 HZ2 LYS 8 80.910 0.286 0.572
73 3HZ LYS 8 HZ3 LYS 8 81.127 1.961 0.495
74 H GLU 9 HN GLU 9 85.449 1.554 4.424
75 HA GLU 9 HA GLU 9 87.310 3.382 5.565
76 1HB GLU 9 HB2 GLU 9 86.122 0.844 6.243
77 2HB GLU 9 HB1 GLU 9 87.832 0.871 6.650
78 1HG GLU 9 HG2 GLU 9 85.897 3.016 7.480
79 2HG GLU 9 HG1 GLU 9 86.276 1.604 8.466
80 H GLN 10 HN GLN 10 87.846 0.278 3.885
81 HA GLN 10 HA GLN 10 90.689 0.505 4.152
82 1HB GLN 10 HB2 GLN 10 89.139 -1.300 2.302
83 2HB GLN 10 HB1 GLN 10 90.837 -1.456 2.707
84 1HG GLN 10 HG2 GLN 10 88.707 -1.560 4.810
85 2HG GLN 10 HG1 GLN 10 89.164 -2.986 3.882
86 1HE2 GLN 10 HE21 GLN 10 91.109 -4.013 4.315
87 2HE2 GLN 10 HE22 GLN 10 92.119 -3.576 5.638
88 H GLN 11 HN GLN 11 88.425 1.206 1.538
89 HA GLN 11 HA GLN 11 90.216 1.583 -0.544
90 1HB GLN 11 HB2 GLN 11 87.560 1.787 -0.333
91 2HB GLN 11 HB1 GLN 11 87.955 3.496 -0.334
92 1HG GLN 11 HG2 GLN 11 89.283 1.909 -2.415
93 2HG GLN 11 HG1 GLN 11 87.529 2.025 -2.555
94 1HE2 GLN 11 HE21 GLN 11 89.840 3.192 -4.092
95 2HE2 GLN 11 HE22 GLN 11 89.488 4.881 -4.180
96 H ASN 12 HN ASN 12 89.381 3.769 2.089
97 HA ASN 12 HA ASN 12 90.333 6.161 1.105
98 1HB ASN 12 HB2 ASN 12 89.285 5.512 3.438
99 2HB ASN 12 HB1 ASN 12 90.972 5.425 3.934
100 1HD2 ASN 12 HD21 ASN 12 92.300 7.356 3.383
101 2HD2 ASN 12 HD22 ASN 12 91.559 8.906 3.556
102 H ALA 13 HN ALA 13 92.124 3.431 2.419
103 HA ALA 13 HA ALA 13 94.628 4.598 2.683
104 1HB ALA 13 HB1 ALA 13 95.532 2.397 2.605
105 2HB ALA 13 HB2 ALA 13 94.145 1.793 1.697
106 3HB ALA 13 HB3 ALA 13 93.953 2.280 3.381
107 H PHE 14 HN PHE 14 93.158 3.065 -0.206
108 HA PHE 14 HA PHE 14 95.302 3.222 -1.924
109 1HB PHE 14 HB2 PHE 14 93.122 2.081 -2.321
110 2HB PHE 14 HB1 PHE 14 92.399 3.648 -2.634
111 HD1 PHE 14 HD1 PHE 14 93.277 5.017 -4.564
112 HD2 PHE 14 HD2 PHE 14 94.225 0.904 -4.020
113 HE1 PHE 14 HE1 PHE 14 93.917 4.856 -6.934
114 HE2 PHE 14 HE2 PHE 14 94.867 0.736 -6.389
115 HZ PHE 14 HZ PHE 14 94.713 2.713 -7.850
116 H TRP 15 HN TRP 15 92.642 5.586 -1.717
117 HA TRP 15 HA TRP 15 93.743 7.366 -3.565
118 1HB TRP 15 HB2 TRP 15 91.478 7.323 -1.821
119 2HB TRP 15 HB1 TRP 15 92.239 8.910 -1.756
120 HD1 TRP 15 HD1 TRP 15 91.848 6.603 -4.842
121 HE1 TRP 15 HE1 TRP 15 90.596 7.920 -6.665
122 HE3 TRP 15 HE3 TRP 15 90.884 10.892 -2.229
123 HZ2 TRP 15 HZ2 TRP 15 89.365 10.446 -6.958
124 HZ3 TRP 15 HZ3 TRP 15 89.667 12.711 -3.354
125 HH2 TRP 15 HH2 TRP 15 88.925 12.491 -5.670
126 H GLU 16 HN GLU 16 94.106 7.313 -0.037
127 HA GLU 16 HA GLU 16 95.601 9.752 0.009
128 1HB GLU 16 HB2 GLU 16 95.967 9.402 2.278
129 2HB GLU 16 HB1 GLU 16 94.476 8.518 2.007
130 1HG GLU 16 HG2 GLU 16 95.672 6.426 1.975
131 2HG GLU 16 HG1 GLU 16 97.214 7.273 2.107
132 H ILE 17 HN ILE 17 96.611 6.354 0.229
133 HA ILE 17 HA ILE 17 99.334 6.665 0.110
134 HB ILE 17 HB ILE 17 97.684 4.496 -1.192
135 1HG1 ILE 17 HG12 ILE 17 99.298 4.281 1.335
136 2HG1 ILE 17 HG11 ILE 17 97.662 4.931 1.366
137 1HG2 ILE 17 HG21 ILE 17 99.542 3.726 -2.136
138 2HG2 ILE 17 HG22 ILE 17 100.234 3.516 -0.528
139 3HG2 ILE 17 HG23 ILE 17 100.495 5.020 -1.410
140 1HD1 ILE 17 HD11 ILE 17 98.587 2.167 0.731
141 2HD1 ILE 17 HD12 ILE 17 97.036 2.751 0.127
142 3HD1 ILE 17 HD13 ILE 17 97.346 2.703 1.863
143 H LEU 18 HN LEU 18 97.101 6.449 -2.635
144 HA LEU 18 HA LEU 18 99.010 6.693 -4.682
145 1HB LEU 18 HB2 LEU 18 96.056 6.986 -4.444
146 2HB LEU 18 HB1 LEU 18 96.819 7.679 -5.866
147 HG LEU 18 HG LEU 18 95.980 5.441 -6.326
148 1HD1 LEU 18 HD11 LEU 18 98.965 5.216 -6.248
149 2HD1 LEU 18 HD12 LEU 18 98.156 6.367 -7.312
150 3HD1 LEU 18 HD13 LEU 18 97.836 4.640 -7.475
151 1HD2 LEU 18 HD21 LEU 18 97.390 3.552 -5.206
152 2HD2 LEU 18 HD22 LEU 18 95.991 4.227 -4.377
153 3HD2 LEU 18 HD23 LEU 18 97.616 4.748 -3.932
154 H HIS 19 HN HIS 19 97.091 9.129 -2.988
155 HA HIS 19 HA HIS 19 97.886 11.300 -4.617
156 1HB HIS 19 HB2 HIS 19 95.996 11.879 -3.495
157 2HB HIS 19 HB1 HIS 19 96.393 10.887 -2.102
158 HD1 HIS 19 HD1 HIS 19 97.180 12.085 -0.066
159 HD2 HIS 19 HD2 HIS 19 97.306 14.487 -3.455
160 HE1 HIS 19 HE1 HIS 19 97.697 14.399 0.771
161 HE2 HIS 19 HE2 HIS 19 97.855 15.818 -1.305
162 H LEU 20 HN LEU 20 99.005 10.142 -1.465
163 HA LEU 20 HA LEU 20 100.615 11.477 -0.229
164 1HB LEU 20 HB2 LEU 20 101.723 9.137 -1.722
165 2HB LEU 20 HB1 LEU 20 102.563 9.928 -0.406
166 HG LEU 20 HG LEU 20 100.037 8.314 -0.307
167 1HD1 LEU 20 HD11 LEU 20 102.794 8.006 0.527
168 2HD1 LEU 20 HD12 LEU 20 101.529 6.794 0.337
169 3HD1 LEU 20 HD13 LEU 20 101.657 7.709 1.841
170 1HD2 LEU 20 HD21 LEU 20 101.030 10.232 1.792
171 2HD2 LEU 20 HD22 LEU 20 99.796 9.001 2.054
172 3HD2 LEU 20 HD23 LEU 20 99.501 10.317 0.918
173 HA PRO 21 HA PRO 21 102.582 14.081 -3.490
174 1HB PRO 21 HB2 PRO 21 102.166 16.118 -1.394
175 2HB PRO 21 HB1 PRO 21 101.757 16.182 -3.111
176 1HG PRO 21 HG2 PRO 21 99.872 15.945 -1.207
177 2HG PRO 21 HG1 PRO 21 99.707 15.181 -2.799
178 1HD PRO 21 HD2 PRO 21 100.464 13.960 -0.177
179 2HD PRO 21 HD1 PRO 21 99.468 13.295 -1.485
180 H ASN 22 HN ASN 22 104.579 13.229 -3.227
181 HA ASN 22 HA ASN 22 106.786 13.950 -2.483
182 1HB ASN 22 HB2 ASN 22 105.733 15.285 -0.577
183 2HB ASN 22 HB1 ASN 22 105.780 13.783 0.352
184 1HD2 ASN 22 HD21 ASN 22 107.240 16.529 0.224
185 2HD2 ASN 22 HD22 ASN 22 108.879 16.078 0.515
186 H LEU 23 HN LEU 23 104.673 11.524 -1.301
187 HA LEU 23 HA LEU 23 106.736 9.815 -0.269
188 1HB LEU 23 HB2 LEU 23 104.349 9.462 0.339
189 2HB LEU 23 HB1 LEU 23 104.037 8.955 -1.313
190 HG LEU 23 HG LEU 23 106.199 7.380 -0.404
191 1HD1 LEU 23 HD11 LEU 23 104.307 8.019 1.739
192 2HD1 LEU 23 HD12 LEU 23 105.942 7.367 1.819
193 3HD1 LEU 23 HD13 LEU 23 104.580 6.297 1.478
194 1HD2 LEU 23 HD21 LEU 23 103.301 6.849 -0.957
195 2HD2 LEU 23 HD22 LEU 23 104.426 5.565 -0.522
196 3HD2 LEU 23 HD23 LEU 23 104.697 6.517 -1.981
197 H ASN 24 HN ASN 24 107.951 8.243 -1.345
198 HA ASN 24 HA ASN 24 108.490 8.684 -4.056
199 1HB ASN 24 HB2 ASN 24 109.257 6.748 -2.033
200 2HB ASN 24 HB1 ASN 24 109.020 5.956 -3.587
201 1HD2 ASN 24 HD21 ASN 24 110.199 6.813 -5.422
202 2HD2 ASN 24 HD22 ASN 24 111.746 7.538 -5.165
203 H GLU 25 HN GLU 25 107.035 8.439 -5.754
204 HA GLU 25 HA GLU 25 104.604 7.193 -5.471
205 1HB GLU 25 HB2 GLU 25 104.363 7.472 -7.841
206 2HB GLU 25 HB1 GLU 25 105.236 8.860 -7.192
207 1HG GLU 25 HG2 GLU 25 106.745 6.537 -8.320
208 2HG GLU 25 HG1 GLU 25 106.023 7.732 -9.396
209 H GLU 26 HN GLU 26 107.700 5.848 -6.389
210 HA GLU 26 HA GLU 26 106.772 3.344 -7.353
211 1HB GLU 26 HB2 GLU 26 109.175 4.392 -7.407
212 2HB GLU 26 HB1 GLU 26 109.344 3.644 -5.826
213 1HG GLU 26 HG2 GLU 26 110.108 1.903 -7.004
214 2HG GLU 26 HG1 GLU 26 108.396 1.558 -7.246
215 H GLN 27 HN GLN 27 107.149 4.798 -4.301
216 HA GLN 27 HA GLN 27 106.907 2.416 -2.683
217 1HB GLN 27 HB2 GLN 27 107.683 5.066 -2.195
218 2HB GLN 27 HB1 GLN 27 106.159 4.883 -1.337
219 1HG GLN 27 HG2 GLN 27 107.374 4.042 0.320
220 2HG GLN 27 HG1 GLN 27 107.502 2.588 -0.669
221 1HE2 GLN 27 HE21 GLN 27 109.202 3.575 -2.657
222 2HE2 GLN 27 HE22 GLN 27 110.757 3.857 -1.959
223 H ARG 28 HN ARG 28 104.895 5.024 -3.909
224 HA ARG 28 HA ARG 28 102.497 4.422 -2.586
225 1HB ARG 28 HB2 ARG 28 103.089 5.741 -5.235
226 2HB ARG 28 HB1 ARG 28 101.439 5.496 -4.686
227 1HG ARG 28 HG2 ARG 28 102.197 6.727 -2.558
228 2HG ARG 28 HG1 ARG 28 103.565 7.257 -3.535
229 1HD ARG 28 HD2 ARG 28 100.691 7.640 -4.345
230 2HD ARG 28 HD1 ARG 28 101.601 8.829 -3.450
231 HE ARG 28 HE ARG 28 102.896 9.272 -5.334
232 1HH1 ARG 28 HH11 ARG 28 100.587 6.727 -5.971
233 2HH1 ARG 28 HH12 ARG 28 100.746 6.852 -7.689
234 1HH2 ARG 28 HH21 ARG 28 103.095 9.435 -7.586
235 2HH2 ARG 28 HH22 ARG 28 102.168 8.386 -8.607
236 H ASN 29 HN ASN 29 103.571 3.513 -5.857
237 HA ASN 29 HA ASN 29 101.477 1.821 -6.521
238 1HB ASN 29 HB2 ASN 29 103.531 2.681 -7.910
239 2HB ASN 29 HB1 ASN 29 104.271 1.170 -7.386
240 1HD2 ASN 29 HD21 ASN 29 104.082 -0.393 -8.799
241 2HD2 ASN 29 HD22 ASN 29 102.765 -0.637 -9.889
242 H GLY 30 HN GLY 30 104.562 1.039 -4.900
243 1HA GLY 30 HA2 GLY 30 104.178 -1.730 -4.700
244 2HA GLY 30 HA1 GLY 30 105.139 -0.763 -3.589
245 H PHE 31 HN PHE 31 103.023 0.905 -2.681
246 HA PHE 31 HA PHE 31 102.003 -0.679 -0.575
247 1HB PHE 31 HB2 PHE 31 101.744 2.137 -1.476
248 2HB PHE 31 HB1 PHE 31 100.446 1.525 -0.455
249 HD1 PHE 31 HD1 PHE 31 103.342 3.332 -0.335
250 HD2 PHE 31 HD2 PHE 31 101.502 0.001 1.565
251 HE1 PHE 31 HE1 PHE 31 104.727 3.710 1.662
252 HE2 PHE 31 HE2 PHE 31 102.883 0.371 3.566
253 HZ PHE 31 HZ PHE 31 104.499 2.229 3.617
254 H ILE 32 HN ILE 32 100.720 0.368 -3.647
255 HA ILE 32 HA ILE 32 98.009 -0.356 -3.156
256 HB ILE 32 HB ILE 32 99.027 -0.458 -5.949
257 1HG1 ILE 32 HG12 ILE 32 98.826 2.122 -4.375
258 2HG1 ILE 32 HG11 ILE 32 100.303 1.417 -5.020
259 1HG2 ILE 32 HG21 ILE 32 96.925 1.036 -6.160
260 2HG2 ILE 32 HG22 ILE 32 96.585 0.495 -4.516
261 3HG2 ILE 32 HG23 ILE 32 96.732 -0.684 -5.819
262 1HD1 ILE 32 HD11 ILE 32 97.984 2.336 -6.692
263 2HD1 ILE 32 HD12 ILE 32 99.549 1.763 -7.270
264 3HD1 ILE 32 HD13 ILE 32 99.440 3.278 -6.373
265 H GLN 33 HN GLN 33 100.762 -2.026 -4.592
266 HA GLN 33 HA GLN 33 99.310 -4.296 -5.478
267 1HB GLN 33 HB2 GLN 33 102.238 -4.063 -4.767
268 2HB GLN 33 HB1 GLN 33 101.510 -5.385 -5.669
269 1HG GLN 33 HG2 GLN 33 101.027 -3.987 -7.512
270 2HG GLN 33 HG1 GLN 33 101.394 -2.530 -6.590
271 1HE2 GLN 33 HE21 GLN 33 103.394 -1.740 -6.662
272 2HE2 GLN 33 HE22 GLN 33 104.754 -2.530 -7.377
273 H SER 34 HN SER 34 101.291 -3.756 -2.557
274 HA SER 34 HA SER 34 100.779 -6.301 -1.427
275 1HB SER 34 HB2 SER 34 102.647 -4.664 -0.813
276 2HB SER 34 HB1 SER 34 101.438 -3.809 0.145
277 HG SER 34 HG SER 34 102.599 -6.314 0.552
278 H LEU 35 HN LEU 35 99.205 -3.170 -1.145
279 HA LEU 35 HA LEU 35 97.378 -3.989 0.901
280 1HB LEU 35 HB2 LEU 35 97.912 -1.656 0.688
281 2HB LEU 35 HB1 LEU 35 97.408 -1.638 -0.992
282 HG LEU 35 HG LEU 35 95.119 -1.764 -0.426
283 1HD1 LEU 35 HD11 LEU 35 96.148 -2.830 2.131
284 2HD1 LEU 35 HD12 LEU 35 94.744 -3.310 1.183
285 3HD1 LEU 35 HD13 LEU 35 94.667 -1.874 2.202
286 1HD2 LEU 35 HD21 LEU 35 95.750 -0.042 1.848
287 2HD2 LEU 35 HD22 LEU 35 94.921 0.331 0.337
288 3HD2 LEU 35 HD23 LEU 35 96.683 0.327 0.398
289 H LYS 36 HN LYS 36 97.173 -3.619 -2.640
290 HA LYS 36 HA LYS 36 94.460 -4.142 -2.924
291 1HB LYS 36 HB2 LYS 36 96.017 -3.374 -4.735
292 2HB LYS 36 HB1 LYS 36 96.598 -5.029 -4.863
293 1HG LYS 36 HG2 LYS 36 95.034 -5.138 -6.478
294 2HG LYS 36 HG1 LYS 36 93.963 -5.456 -5.112
295 1HD LYS 36 HD2 LYS 36 92.884 -3.506 -5.362
296 2HD LYS 36 HD1 LYS 36 94.382 -2.611 -5.625
297 1HE LYS 36 HE2 LYS 36 93.357 -2.373 -7.669
298 2HE LYS 36 HE1 LYS 36 94.346 -3.806 -7.947
299 1HZ LYS 36 HZ1 LYS 36 91.725 -4.379 -6.898
300 2HZ LYS 36 HZ2 LYS 36 92.547 -5.082 -8.199
301 3HZ LYS 36 HZ3 LYS 36 91.697 -3.636 -8.418
302 H ASP 37 HN ASP 37 97.116 -6.573 -3.322
303 HA ASP 37 HA ASP 37 95.346 -8.737 -3.484
304 1HB ASP 37 HB2 ASP 37 97.270 -10.153 -3.195
305 2HB ASP 37 HB1 ASP 37 97.743 -8.773 -4.179
306 H ASP 38 HN ASP 38 97.151 -7.489 -0.688
307 HA ASP 38 HA ASP 38 95.596 -9.262 1.049
308 1HB ASP 38 HB2 ASP 38 98.284 -8.442 1.068
309 2HB ASP 38 HB1 ASP 38 97.538 -7.673 2.465
310 HA PRO 39 HA PRO 39 93.248 -5.531 2.021
311 1HB PRO 39 HB2 PRO 39 91.008 -6.738 2.808
312 2HB PRO 39 HB1 PRO 39 91.466 -6.703 1.100
313 1HG PRO 39 HG2 PRO 39 91.738 -8.917 3.090
314 2HG PRO 39 HG1 PRO 39 91.250 -8.994 1.388
315 1HD PRO 39 HD2 PRO 39 93.795 -9.547 2.339
316 2HD PRO 39 HD1 PRO 39 93.408 -9.108 0.665
317 H SER 40 HN SER 40 93.932 -8.269 4.065
318 HA SER 40 HA SER 40 93.042 -7.042 6.509
319 1HB SER 40 HB2 SER 40 93.135 -9.495 6.296
320 2HB SER 40 HB1 SER 40 94.880 -9.413 6.061
321 HG SER 40 HG SER 40 93.609 -8.374 8.365
322 H GLN 41 HN GLN 41 95.738 -6.809 4.472
323 HA GLN 41 HA GLN 41 97.570 -5.916 6.522
324 1HB GLN 41 HB2 GLN 41 97.803 -6.102 3.517
325 2HB GLN 41 HB1 GLN 41 99.089 -5.519 4.565
326 1HG GLN 41 HG2 GLN 41 98.910 -7.747 5.769
327 2HG GLN 41 HG1 GLN 41 97.937 -8.279 4.400
328 1HE2 GLN 41 HE21 GLN 41 100.947 -6.458 4.893
329 2HE2 GLN 41 HE22 GLN 41 101.871 -7.341 3.731
330 H SER 42 HN SER 42 95.031 -4.518 4.786
331 HA SER 42 HA SER 42 95.891 -2.080 3.908
332 1HB SER 42 HB2 SER 42 93.480 -3.056 4.121
333 2HB SER 42 HB1 SER 42 93.451 -2.168 5.645
334 HG SER 42 HG SER 42 92.995 -1.217 3.247
335 H ALA 43 HN ALA 43 95.752 -3.140 7.225
336 HA ALA 43 HA ALA 43 96.068 -0.516 8.348
337 1HB ALA 43 HB1 ALA 43 96.667 -3.109 9.744
338 2HB ALA 43 HB2 ALA 43 95.021 -2.528 9.492
339 3HB ALA 43 HB3 ALA 43 96.156 -1.575 10.448
340 H ASN 44 HN ASN 44 98.208 -3.265 7.701
341 HA ASN 44 HA ASN 44 100.534 -2.106 8.827
342 1HB ASN 44 HB2 ASN 44 99.825 -4.539 7.436
343 2HB ASN 44 HB1 ASN 44 101.360 -3.913 6.841
344 1HD2 ASN 44 HD21 ASN 44 103.124 -4.328 7.975
345 2HD2 ASN 44 HD22 ASN 44 103.162 -4.951 9.586
346 H LEU 45 HN LEU 45 99.199 -2.140 5.552
347 HA LEU 45 HA LEU 45 101.469 -0.807 4.407
348 1HB LEU 45 HB2 LEU 45 98.719 -1.476 3.393
349 2HB LEU 45 HB1 LEU 45 99.836 -0.512 2.448
350 HG LEU 45 HG LEU 45 99.802 -2.918 1.818
351 1HD1 LEU 45 HD11 LEU 45 101.748 -1.955 1.100
352 2HD1 LEU 45 HD12 LEU 45 102.389 -3.192 2.182
353 3HD1 LEU 45 HD13 LEU 45 102.265 -1.519 2.728
354 1HD2 LEU 45 HD21 LEU 45 101.236 -3.453 4.397
355 2HD2 LEU 45 HD22 LEU 45 100.574 -4.606 3.238
356 3HD2 LEU 45 HD23 LEU 45 99.491 -3.646 4.244
357 H LEU 46 HN LEU 46 98.194 0.151 5.369
358 HA LEU 46 HA LEU 46 98.263 2.797 4.499
359 1HB LEU 46 HB2 LEU 46 96.228 1.680 5.265
360 2HB LEU 46 HB1 LEU 46 96.853 1.630 6.901
361 HG LEU 46 HG LEU 46 95.118 3.405 6.398
362 1HD1 LEU 46 HD11 LEU 46 97.474 4.884 7.341
363 2HD1 LEU 46 HD12 LEU 46 97.149 3.365 8.175
364 3HD1 LEU 46 HD13 LEU 46 95.910 4.618 8.112
365 1HD2 LEU 46 HD21 LEU 46 95.486 5.078 4.950
366 2HD2 LEU 46 HD22 LEU 46 96.634 3.953 4.225
367 3HD2 LEU 46 HD23 LEU 46 97.200 5.188 5.349
368 H ALA 47 HN ALA 47 98.932 1.581 7.791
369 HA ALA 47 HA ALA 47 99.766 4.004 8.885
370 1HB ALA 47 HB1 ALA 47 99.894 2.749 10.710
371 2HB ALA 47 HB2 ALA 47 101.268 1.864 10.046
372 3HB ALA 47 HB3 ALA 47 99.624 1.319 9.716
373 H GLU 48 HN GLU 48 101.722 1.430 7.399
374 HA GLU 48 HA GLU 48 104.224 2.611 7.753
375 1HB GLU 48 HB2 GLU 48 103.145 0.666 5.733
376 2HB GLU 48 HB1 GLU 48 104.806 1.232 5.642
377 1HG GLU 48 HG2 GLU 48 103.925 0.232 8.268
378 2HG GLU 48 HG1 GLU 48 104.045 -0.963 6.977
379 H ALA 49 HN ALA 49 101.850 3.000 5.169
380 HA ALA 49 HA ALA 49 103.509 4.627 3.519
381 1HB ALA 49 HB1 ALA 49 101.733 3.447 2.473
382 2HB ALA 49 HB2 ALA 49 101.344 5.164 2.362
383 3HB ALA 49 HB3 ALA 49 100.537 4.152 3.559
384 H LYS 50 HN LYS 50 100.989 5.308 5.911
385 HA LYS 50 HA LYS 50 100.892 8.095 5.510
386 1HB LYS 50 HB2 LYS 50 99.669 6.189 7.229
387 2HB LYS 50 HB1 LYS 50 100.318 7.472 8.241
388 1HG LYS 50 HG2 LYS 50 98.713 8.173 5.828
389 2HG LYS 50 HG1 LYS 50 97.900 7.639 7.301
390 1HD LYS 50 HD2 LYS 50 98.660 9.467 8.527
391 2HD LYS 50 HD1 LYS 50 99.971 9.803 7.395
392 1HE LYS 50 HE2 LYS 50 98.376 11.491 7.021
393 2HE LYS 50 HE1 LYS 50 98.163 10.346 5.697
394 1HZ LYS 50 HZ1 LYS 50 96.056 11.093 6.699
395 2HZ LYS 50 HZ2 LYS 50 96.511 10.380 8.163
396 3HZ LYS 50 HZ3 LYS 50 96.266 9.417 6.795
397 H LYS 51 HN LYS 51 102.515 6.221 8.075
398 HA LYS 51 HA LYS 51 103.840 8.391 9.252
399 1HB LYS 51 HB2 LYS 51 104.453 5.439 9.200
400 2HB LYS 51 HB1 LYS 51 105.422 6.584 10.118
401 1HG LYS 51 HG2 LYS 51 103.959 6.599 11.783
402 2HG LYS 51 HG1 LYS 51 102.623 6.945 10.685
403 1HD LYS 51 HD2 LYS 51 101.865 4.875 10.981
404 2HD LYS 51 HD1 LYS 51 103.358 4.239 10.290
405 1HE LYS 51 HE2 LYS 51 103.168 3.239 12.413
406 2HE LYS 51 HE1 LYS 51 104.375 4.511 12.596
407 1HZ LYS 51 HZ1 LYS 51 102.402 5.928 13.357
408 2HZ LYS 51 HZ2 LYS 51 103.010 4.773 14.433
409 3HZ LYS 51 HZ3 LYS 51 101.590 4.459 13.569
410 H LEU 52 HN LEU 52 104.902 6.111 6.753
411 HA LEU 52 HA LEU 52 107.528 6.969 6.463
412 1HB LEU 52 HB2 LEU 52 106.728 4.964 5.387
413 2HB LEU 52 HB1 LEU 52 105.605 5.886 4.407
414 HG LEU 52 HG LEU 52 107.534 6.963 3.271
415 1HD1 LEU 52 HD11 LEU 52 109.276 6.850 4.837
416 2HD1 LEU 52 HD12 LEU 52 109.743 5.732 3.556
417 3HD1 LEU 52 HD13 LEU 52 109.073 5.114 5.065
418 1HD2 LEU 52 HD21 LEU 52 107.580 3.950 3.174
419 2HD2 LEU 52 HD22 LEU 52 108.117 5.054 1.908
420 3HD2 LEU 52 HD23 LEU 52 106.410 4.973 2.342
421 H ASN 53 HN ASN 53 104.693 8.000 4.567
422 HA ASN 53 HA ASN 53 105.860 9.884 2.949
423 1HB ASN 53 HB2 ASN 53 103.456 9.155 2.900
424 2HB ASN 53 HB1 ASN 53 103.155 10.230 4.257
425 1HD2 ASN 53 HD21 ASN 53 101.787 11.597 3.204
426 2HD2 ASN 53 HD22 ASN 53 102.283 12.637 1.917
427 H ASP 54 HN ASP 54 104.449 10.557 6.194
428 HA ASP 54 HA ASP 54 105.061 13.255 6.288
429 1HB ASP 54 HB2 ASP 54 105.186 11.366 8.644
430 2HB ASP 54 HB1 ASP 54 104.826 13.089 8.675
431 H ALA 55 HN ALA 55 107.043 10.510 7.404
432 HA ALA 55 HA ALA 55 109.191 11.937 8.393
433 1HB ALA 55 HB1 ALA 55 110.077 9.925 8.756
434 2HB ALA 55 HB2 ALA 55 109.968 9.464 7.058
435 3HB ALA 55 HB3 ALA 55 108.563 9.293 8.110
436 H GLN 56 HN GLN 56 108.600 10.942 5.020
437 HA GLN 56 HA GLN 56 111.103 12.293 4.302
438 1HB GLN 56 HB2 GLN 56 110.624 11.228 1.994
439 2HB GLN 56 HB1 GLN 56 111.216 10.220 3.302
440 1HG GLN 56 HG2 GLN 56 109.555 8.848 2.778
441 2HG GLN 56 HG1 GLN 56 108.501 10.010 3.573
442 1HE2 GLN 56 HE21 GLN 56 107.664 11.758 2.205
443 2HE2 GLN 56 HE22 GLN 56 107.220 11.376 0.585
444 H ALA 57 HN ALA 57 108.079 13.297 4.698
445 HA ALA 57 HA ALA 57 107.990 14.867 2.227
446 1HB ALA 57 HB1 ALA 57 105.992 13.518 3.348
447 2HB ALA 57 HB2 ALA 57 105.748 14.977 2.402
448 3HB ALA 57 HB3 ALA 57 105.773 15.063 4.165
449 HA PRO 58 HA PRO 58 108.734 18.790 4.122
450 1HB PRO 58 HB2 PRO 58 106.475 20.299 4.293
451 2HB PRO 58 HB1 PRO 58 107.332 19.989 2.780
452 1HG PRO 58 HG2 PRO 58 104.884 18.675 3.877
453 2HG PRO 58 HG1 PRO 58 105.240 19.172 2.212
454 1HD PRO 58 HD2 PRO 58 105.439 16.620 3.059
455 2HD PRO 58 HD1 PRO 58 106.473 17.281 1.782
456 H LYS 59 HN LYS 59 108.822 17.136 6.094
457 HA LYS 59 HA LYS 59 108.504 16.719 8.323
458 1HB LYS 59 HB2 LYS 59 108.950 19.623 7.948
459 2HB LYS 59 HB1 LYS 59 108.438 19.110 9.550
460 1HG LYS 59 HG2 LYS 59 110.473 17.337 8.737
461 2HG LYS 59 HG1 LYS 59 111.023 18.969 8.354
462 1HD LYS 59 HD2 LYS 59 111.698 18.318 10.610
463 2HD LYS 59 HD1 LYS 59 110.560 19.667 10.651
464 1HE LYS 59 HE2 LYS 59 109.556 18.395 12.225
465 2HE LYS 59 HE1 LYS 59 108.834 17.620 10.817
466 1HZ LYS 59 HZ1 LYS 59 111.212 16.321 11.164
467 2HZ LYS 59 HZ2 LYS 59 109.686 15.743 11.608
468 3HZ LYS 59 HZ3 LYS 59 110.648 16.548 12.743
469 H ALA 60 HN ALA 60 106.600 15.774 8.796
470 HA ALA 60 HA ALA 60 104.499 17.484 9.847
471 1HB ALA 60 HB1 ALA 60 104.253 16.614 7.260
472 2HB ALA 60 HB2 ALA 60 102.922 17.101 8.311
473 3HB ALA 60 HB3 ALA 60 103.351 15.397 8.164
Start of MODEL 15
1 1H GLY -1 HT1 GLY -1 84.625 -18.566 5.043
2 2H GLY -1 HT2 GLY -1 84.383 -16.897 4.923
3 3H GLY -1 HT3 GLY -1 85.048 -17.749 3.622
4 1HA GLY -1 HA1 GLY -1 82.729 -19.068 4.009
5 2HA GLY -1 HA2 GLY -1 82.288 -17.411 4.393
6 H SER 0 HN SER 0 82.545 -15.781 2.762
7 HA SER 0 HA SER 0 82.138 -16.853 0.093
8 1HB SER 0 HB2 SER 0 81.559 -14.491 -0.491
9 2HB SER 0 HB1 SER 0 80.577 -15.150 0.818
10 HG SER 0 HG SER 0 81.205 -13.230 1.594
11 H THR 1 HN THR 1 83.655 -13.704 0.518
12 HA THR 1 HA THR 1 86.069 -14.763 -0.792
13 HB THR 1 HB THR 1 84.766 -13.307 -2.277
14 HG1 THR 1 HG1 THR 1 87.174 -12.159 -1.324
15 1HG2 THR 1 HG21 THR 1 85.285 -11.052 -0.366
16 2HG2 THR 1 HG22 THR 1 83.741 -11.896 -0.481
17 3HG2 THR 1 HG23 THR 1 84.370 -11.014 -1.873
18 H ALA 2 HN ALA 2 87.985 -14.372 0.134
19 HA ALA 2 HA ALA 2 88.252 -13.669 2.779
20 1HB ALA 2 HB1 ALA 2 90.597 -13.059 1.118
21 2HB ALA 2 HB2 ALA 2 89.914 -14.672 0.912
22 3HB ALA 2 HB3 ALA 2 90.430 -14.131 2.509
23 H ASP 3 HN ASP 3 87.332 -11.798 3.453
24 HA ASP 3 HA ASP 3 86.905 -9.599 3.769
25 1HB ASP 3 HB2 ASP 3 89.413 -10.285 4.523
26 2HB ASP 3 HB1 ASP 3 89.730 -8.866 3.531
27 H ASN 4 HN ASN 4 89.271 -9.755 1.092
28 HA ASN 4 HA ASN 4 89.613 -7.499 -0.021
29 1HB ASN 4 HB2 ASN 4 89.941 -9.573 -1.246
30 2HB ASN 4 HB1 ASN 4 88.211 -9.677 -1.569
31 1HD2 ASN 4 HD21 ASN 4 88.759 -9.731 -3.803
32 2HD2 ASN 4 HD22 ASN 4 89.136 -8.273 -4.649
33 H LYS 5 HN LYS 5 88.154 -6.012 1.016
34 HA LYS 5 HA LYS 5 86.105 -5.117 -0.807
35 1HB LYS 5 HB2 LYS 5 85.173 -6.802 1.068
36 2HB LYS 5 HB1 LYS 5 85.125 -5.309 1.991
37 1HG LYS 5 HG2 LYS 5 83.901 -4.350 -0.071
38 2HG LYS 5 HG1 LYS 5 83.629 -6.045 -0.490
39 1HD LYS 5 HD2 LYS 5 81.761 -5.720 0.752
40 2HD LYS 5 HD1 LYS 5 82.864 -6.104 2.075
41 1HE LYS 5 HE2 LYS 5 83.314 -3.515 2.015
42 2HE LYS 5 HE1 LYS 5 81.734 -3.475 1.236
43 1HZ LYS 5 HZ1 LYS 5 81.194 -3.266 3.444
44 2HZ LYS 5 HZ2 LYS 5 82.429 -4.293 3.974
45 3HZ LYS 5 HZ3 LYS 5 81.049 -4.939 3.238
46 H PHE 6 HN PHE 6 87.879 -3.531 -0.852
47 HA PHE 6 HA PHE 6 88.414 -1.928 1.439
48 1HB PHE 6 HB2 PHE 6 89.045 -1.396 -1.467
49 2HB PHE 6 HB1 PHE 6 89.718 -0.525 -0.097
50 HD1 PHE 6 HD1 PHE 6 89.479 -3.712 1.092
51 HD2 PHE 6 HD2 PHE 6 91.702 -1.472 -1.758
52 HE1 PHE 6 HE1 PHE 6 91.302 -5.325 1.258
53 HE2 PHE 6 HE2 PHE 6 93.540 -3.095 -1.597
54 HZ PHE 6 HZ PHE 6 93.342 -5.038 -0.080
55 H ASN 7 HN ASN 7 86.028 -1.516 1.816
56 HA ASN 7 HA ASN 7 84.811 0.448 0.114
57 1HB ASN 7 HB2 ASN 7 83.130 0.534 2.119
58 2HB ASN 7 HB1 ASN 7 83.187 -0.882 1.082
59 1HD2 ASN 7 HD21 ASN 7 82.040 -1.476 3.253
60 2HD2 ASN 7 HD22 ASN 7 83.059 -2.257 4.411
61 H LYS 8 HN LYS 8 84.488 1.084 3.492
62 HA LYS 8 HA LYS 8 85.353 3.785 3.106
63 1HB LYS 8 HB2 LYS 8 83.707 2.391 4.952
64 2HB LYS 8 HB1 LYS 8 84.941 3.237 5.875
65 1HG LYS 8 HG2 LYS 8 82.934 4.592 5.606
66 2HG LYS 8 HG1 LYS 8 84.325 5.335 4.811
67 1HD LYS 8 HD2 LYS 8 83.504 4.167 2.690
68 2HD LYS 8 HD1 LYS 8 81.996 3.907 3.565
69 1HE LYS 8 HE2 LYS 8 81.351 6.025 3.267
70 2HE LYS 8 HE1 LYS 8 82.920 6.652 3.773
71 1HZ LYS 8 HZ1 LYS 8 82.723 5.434 1.120
72 2HZ LYS 8 HZ2 LYS 8 83.679 6.726 1.646
73 3HZ LYS 8 HZ3 LYS 8 82.034 6.965 1.334
74 H GLU 9 HN GLU 9 86.373 1.344 5.471
75 HA GLU 9 HA GLU 9 88.579 2.800 6.414
76 1HB GLU 9 HB2 GLU 9 87.817 -0.096 6.640
77 2HB GLU 9 HB1 GLU 9 89.240 0.569 7.429
78 1HG GLU 9 HG2 GLU 9 87.871 0.941 9.147
79 2HG GLU 9 HG1 GLU 9 87.313 2.326 8.210
80 H GLN 10 HN GLN 10 88.611 -0.034 4.199
81 HA GLN 10 HA GLN 10 91.470 0.113 3.976
82 1HB GLN 10 HB2 GLN 10 90.080 -1.429 1.893
83 2HB GLN 10 HB1 GLN 10 91.401 -1.892 2.949
84 1HG GLN 10 HG2 GLN 10 89.659 -2.048 4.797
85 2HG GLN 10 HG1 GLN 10 88.457 -1.953 3.509
86 1HE2 GLN 10 HE21 GLN 10 91.452 -3.761 4.278
87 2HE2 GLN 10 HE22 GLN 10 90.856 -5.280 3.730
88 H GLN 11 HN GLN 11 88.813 0.979 1.763
89 HA GLN 11 HA GLN 11 90.362 1.597 -0.462
90 1HB GLN 11 HB2 GLN 11 87.734 1.660 0.030
91 2HB GLN 11 HB1 GLN 11 88.063 3.384 0.085
92 1HG GLN 11 HG2 GLN 11 88.830 3.409 -2.139
93 2HG GLN 11 HG1 GLN 11 88.939 1.651 -2.200
94 1HE2 GLN 11 HE21 GLN 11 86.531 4.187 -1.572
95 2HE2 GLN 11 HE22 GLN 11 85.256 3.431 -2.461
96 H ASN 12 HN ASN 12 89.646 3.582 2.377
97 HA ASN 12 HA ASN 12 90.476 6.056 1.478
98 1HB ASN 12 HB2 ASN 12 89.507 5.718 3.707
99 2HB ASN 12 HB1 ASN 12 90.949 4.842 4.212
100 1HD2 ASN 12 HD21 ASN 12 90.630 7.814 2.323
101 2HD2 ASN 12 HD22 ASN 12 91.517 8.812 3.417
102 H ALA 13 HN ALA 13 92.384 3.292 2.490
103 HA ALA 13 HA ALA 13 94.882 4.497 2.680
104 1HB ALA 13 HB1 ALA 13 95.777 2.369 2.668
105 2HB ALA 13 HB2 ALA 13 94.602 1.768 1.499
106 3HB ALA 13 HB3 ALA 13 94.115 2.057 3.169
107 H PHE 14 HN PHE 14 93.260 3.082 -0.197
108 HA PHE 14 HA PHE 14 95.291 3.332 -2.021
109 1HB PHE 14 HB2 PHE 14 93.091 2.204 -2.318
110 2HB PHE 14 HB1 PHE 14 92.343 3.777 -2.501
111 HD1 PHE 14 HD1 PHE 14 92.417 4.950 -4.544
112 HD2 PHE 14 HD2 PHE 14 94.678 1.379 -4.048
113 HE1 PHE 14 HE1 PHE 14 92.819 4.874 -6.969
114 HE2 PHE 14 HE2 PHE 14 95.087 1.300 -6.475
115 HZ PHE 14 HZ PHE 14 94.157 3.048 -7.936
116 H TRP 15 HN TRP 15 92.648 5.674 -1.551
117 HA TRP 15 HA TRP 15 93.683 7.554 -3.363
118 1HB TRP 15 HB2 TRP 15 91.421 7.352 -1.641
119 2HB TRP 15 HB1 TRP 15 92.141 8.946 -1.447
120 HD1 TRP 15 HD1 TRP 15 90.738 6.674 -4.248
121 HE1 TRP 15 HE1 TRP 15 89.858 8.186 -6.135
122 HE3 TRP 15 HE3 TRP 15 92.205 11.212 -2.404
123 HZ2 TRP 15 HZ2 TRP 15 89.790 10.941 -6.758
124 HZ3 TRP 15 HZ3 TRP 15 91.695 13.236 -3.707
125 HH2 TRP 15 HH2 TRP 15 90.513 13.101 -5.839
126 H GLU 16 HN GLU 16 94.055 7.345 0.160
127 HA GLU 16 HA GLU 16 95.469 9.830 0.366
128 1HB GLU 16 HB2 GLU 16 94.463 8.817 2.351
129 2HB GLU 16 HB1 GLU 16 95.508 7.411 2.192
130 1HG GLU 16 HG2 GLU 16 97.069 9.826 2.303
131 2HG GLU 16 HG1 GLU 16 95.973 9.725 3.680
132 H ILE 17 HN ILE 17 96.547 6.467 0.453
133 HA ILE 17 HA ILE 17 99.263 6.822 0.390
134 HB ILE 17 HB ILE 17 97.625 4.665 -0.934
135 1HG1 ILE 17 HG12 ILE 17 99.325 4.507 1.554
136 2HG1 ILE 17 HG11 ILE 17 97.631 4.983 1.602
137 1HG2 ILE 17 HG21 ILE 17 99.930 3.423 -0.686
138 2HG2 ILE 17 HG22 ILE 17 100.575 5.058 -0.832
139 3HG2 ILE 17 HG23 ILE 17 99.569 4.389 -2.117
140 1HD1 ILE 17 HD11 ILE 17 96.893 2.878 0.999
141 2HD1 ILE 17 HD12 ILE 17 98.266 2.528 2.048
142 3HD1 ILE 17 HD13 ILE 17 98.445 2.424 0.297
143 H LEU 18 HN LEU 18 97.060 6.693 -2.389
144 HA LEU 18 HA LEU 18 98.956 6.901 -4.421
145 1HB LEU 18 HB2 LEU 18 96.056 7.192 -4.161
146 2HB LEU 18 HB1 LEU 18 96.738 8.214 -5.414
147 HG LEU 18 HG LEU 18 97.636 6.340 -6.593
148 1HD1 LEU 18 HD11 LEU 18 97.166 4.007 -5.715
149 2HD1 LEU 18 HD12 LEU 18 96.869 4.767 -4.154
150 3HD1 LEU 18 HD13 LEU 18 98.451 4.913 -4.918
151 1HD2 LEU 18 HD21 LEU 18 95.364 6.731 -7.128
152 2HD2 LEU 18 HD22 LEU 18 94.807 5.913 -5.667
153 3HD2 LEU 18 HD23 LEU 18 95.553 4.984 -6.969
154 H HIS 19 HN HIS 19 97.037 9.551 -2.967
155 HA HIS 19 HA HIS 19 98.165 11.613 -4.473
156 1HB HIS 19 HB2 HIS 19 96.458 11.359 -2.165
157 2HB HIS 19 HB1 HIS 19 97.621 12.653 -1.902
158 HD1 HIS 19 HD1 HIS 19 97.072 14.846 -2.934
159 HD2 HIS 19 HD2 HIS 19 94.921 11.729 -4.643
160 HE1 HIS 19 HE1 HIS 19 95.469 15.935 -4.537
161 HE2 HIS 19 HE2 HIS 19 94.098 14.037 -5.469
162 H LEU 20 HN LEU 20 99.019 10.434 -1.263
163 HA LEU 20 HA LEU 20 100.768 11.461 0.042
164 1HB LEU 20 HB2 LEU 20 101.529 9.096 -1.584
165 2HB LEU 20 HB1 LEU 20 102.629 9.738 -0.400
166 HG LEU 20 HG LEU 20 99.929 8.487 0.046
167 1HD1 LEU 20 HD11 LEU 20 101.642 6.870 -0.103
168 2HD1 LEU 20 HD12 LEU 20 101.299 7.075 1.615
169 3HD1 LEU 20 HD13 LEU 20 102.729 7.824 0.905
170 1HD2 LEU 20 HD21 LEU 20 101.313 9.247 2.473
171 2HD2 LEU 20 HD22 LEU 20 99.628 9.476 2.012
172 3HD2 LEU 20 HD23 LEU 20 100.843 10.645 1.513
173 HA PRO 21 HA PRO 21 103.003 13.936 -3.232
174 1HB PRO 21 HB2 PRO 21 102.381 16.153 -1.396
175 2HB PRO 21 HB1 PRO 21 102.109 16.039 -3.136
176 1HG PRO 21 HG2 PRO 21 100.081 15.972 -1.364
177 2HG PRO 21 HG1 PRO 21 100.040 15.059 -2.884
178 1HD PRO 21 HD2 PRO 21 100.624 14.103 -0.110
179 2HD PRO 21 HD1 PRO 21 99.686 13.320 -1.397
180 H ASN 22 HN ASN 22 104.895 12.918 -2.558
181 HA ASN 22 HA ASN 22 107.023 13.859 -1.622
182 1HB ASN 22 HB2 ASN 22 107.251 14.239 0.729
183 2HB ASN 22 HB1 ASN 22 105.871 15.178 0.176
184 1HD2 ASN 22 HD21 ASN 22 104.284 15.146 1.603
185 2HD2 ASN 22 HD22 ASN 22 103.846 13.811 2.608
186 H LEU 23 HN LEU 23 105.161 11.248 -1.708
187 HA LEU 23 HA LEU 23 107.093 9.610 -0.226
188 1HB LEU 23 HB2 LEU 23 104.715 9.289 0.427
189 2HB LEU 23 HB1 LEU 23 104.369 8.772 -1.213
190 HG LEU 23 HG LEU 23 106.508 7.163 -0.363
191 1HD1 LEU 23 HD11 LEU 23 106.391 7.214 1.864
192 2HD1 LEU 23 HD12 LEU 23 104.968 6.187 1.647
193 3HD1 LEU 23 HD13 LEU 23 104.777 7.930 1.868
194 1HD2 LEU 23 HD21 LEU 23 103.558 6.600 -0.579
195 2HD2 LEU 23 HD22 LEU 23 104.808 5.363 -0.432
196 3HD2 LEU 23 HD23 LEU 23 104.773 6.419 -1.846
197 H ASN 24 HN ASN 24 108.155 7.921 -1.279
198 HA ASN 24 HA ASN 24 108.800 8.302 -3.967
199 1HB ASN 24 HB2 ASN 24 109.415 6.374 -1.987
200 2HB ASN 24 HB1 ASN 24 108.794 5.467 -3.362
201 1HD2 ASN 24 HD21 ASN 24 110.950 4.604 -3.464
202 2HD2 ASN 24 HD22 ASN 24 112.186 5.489 -4.284
203 H GLU 25 HN GLU 25 107.456 8.173 -5.777
204 HA GLU 25 HA GLU 25 104.821 7.254 -5.485
205 1HB GLU 25 HB2 GLU 25 105.196 8.931 -7.073
206 2HB GLU 25 HB1 GLU 25 106.517 8.043 -7.832
207 1HG GLU 25 HG2 GLU 25 104.088 6.511 -7.981
208 2HG GLU 25 HG1 GLU 25 103.838 8.130 -8.631
209 H GLU 26 HN GLU 26 107.765 5.691 -6.107
210 HA GLU 26 HA GLU 26 106.704 3.272 -7.272
211 1HB GLU 26 HB2 GLU 26 108.945 2.396 -7.034
212 2HB GLU 26 HB1 GLU 26 109.061 4.036 -7.651
213 1HG GLU 26 HG2 GLU 26 110.402 4.585 -5.986
214 2HG GLU 26 HG1 GLU 26 109.154 4.157 -4.817
215 H GLN 27 HN GLN 27 107.194 4.706 -4.273
216 HA GLN 27 HA GLN 27 106.987 2.340 -2.606
217 1HB GLN 27 HB2 GLN 27 107.272 5.256 -2.122
218 2HB GLN 27 HB1 GLN 27 106.396 4.354 -0.897
219 1HG GLN 27 HG2 GLN 27 109.178 3.747 -1.870
220 2HG GLN 27 HG1 GLN 27 108.768 4.568 -0.365
221 1HE2 GLN 27 HE21 GLN 27 106.851 3.170 0.749
222 2HE2 GLN 27 HE22 GLN 27 107.317 1.530 1.031
223 H ARG 28 HN ARG 28 104.986 5.012 -3.726
224 HA ARG 28 HA ARG 28 102.593 4.415 -2.406
225 1HB ARG 28 HB2 ARG 28 103.096 5.664 -5.118
226 2HB ARG 28 HB1 ARG 28 101.501 5.564 -4.388
227 1HG ARG 28 HG2 ARG 28 102.771 6.743 -2.382
228 2HG ARG 28 HG1 ARG 28 103.803 7.293 -3.701
229 1HD ARG 28 HD2 ARG 28 100.842 7.531 -3.971
230 2HD ARG 28 HD1 ARG 28 101.692 8.664 -2.950
231 HE ARG 28 HE ARG 28 101.663 8.640 -5.777
232 1HH1 ARG 28 HH11 ARG 28 103.673 9.396 -3.032
233 2HH1 ARG 28 HH12 ARG 28 104.606 10.580 -3.883
234 1HH2 ARG 28 HH21 ARG 28 102.885 10.198 -6.902
235 2HH2 ARG 28 HH22 ARG 28 104.159 11.037 -6.080
236 H ASN 29 HN ASN 29 103.660 3.503 -5.671
237 HA ASN 29 HA ASN 29 101.555 1.830 -6.361
238 1HB ASN 29 HB2 ASN 29 102.953 2.297 -8.142
239 2HB ASN 29 HB1 ASN 29 104.417 2.060 -7.195
240 1HD2 ASN 29 HD21 ASN 29 105.459 0.194 -7.363
241 2HD2 ASN 29 HD22 ASN 29 104.868 -1.216 -8.170
242 H GLY 30 HN GLY 30 104.606 1.042 -4.697
243 1HA GLY 30 HA2 GLY 30 104.208 -1.722 -4.464
244 2HA GLY 30 HA1 GLY 30 105.174 -0.746 -3.368
245 H PHE 31 HN PHE 31 102.991 0.949 -2.547
246 HA PHE 31 HA PHE 31 101.977 -0.642 -0.417
247 1HB PHE 31 HB2 PHE 31 101.584 2.196 -1.311
248 2HB PHE 31 HB1 PHE 31 100.530 1.515 -0.076
249 HD1 PHE 31 HD1 PHE 31 103.010 3.687 -0.236
250 HD2 PHE 31 HD2 PHE 31 102.305 -0.137 1.484
251 HE1 PHE 31 HE1 PHE 31 104.709 4.147 1.481
252 HE2 PHE 31 HE2 PHE 31 104.000 0.312 3.203
253 HZ PHE 31 HZ PHE 31 105.207 2.460 3.205
254 H ILE 32 HN ILE 32 100.625 0.635 -3.394
255 HA ILE 32 HA ILE 32 97.938 -0.120 -2.915
256 HB ILE 32 HB ILE 32 98.759 -0.198 -5.743
257 1HG1 ILE 32 HG12 ILE 32 99.068 2.348 -4.136
258 2HG1 ILE 32 HG11 ILE 32 100.356 1.467 -4.948
259 1HG2 ILE 32 HG21 ILE 32 96.882 1.797 -5.337
260 2HG2 ILE 32 HG22 ILE 32 96.506 0.592 -4.107
261 3HG2 ILE 32 HG23 ILE 32 96.563 0.128 -5.807
262 1HD1 ILE 32 HD11 ILE 32 99.680 2.129 -7.038
263 2HD1 ILE 32 HD12 ILE 32 99.327 3.556 -6.064
264 3HD1 ILE 32 HD13 ILE 32 98.027 2.452 -6.517
265 H GLN 33 HN GLN 33 100.637 -1.800 -4.441
266 HA GLN 33 HA GLN 33 99.095 -4.020 -5.334
267 1HB GLN 33 HB2 GLN 33 101.289 -5.128 -5.676
268 2HB GLN 33 HB1 GLN 33 101.187 -3.538 -6.420
269 1HG GLN 33 HG2 GLN 33 102.427 -2.591 -4.530
270 2HG GLN 33 HG1 GLN 33 102.560 -4.202 -3.826
271 1HE2 GLN 33 HE21 GLN 33 103.473 -2.192 -6.553
272 2HE2 GLN 33 HE22 GLN 33 104.867 -3.107 -7.005
273 H SER 34 HN SER 34 101.244 -3.549 -2.525
274 HA SER 34 HA SER 34 100.929 -6.125 -1.453
275 1HB SER 34 HB2 SER 34 102.727 -4.729 -0.674
276 2HB SER 34 HB1 SER 34 101.597 -3.491 -0.126
277 HG SER 34 HG SER 34 102.515 -5.599 1.212
278 H LEU 35 HN LEU 35 99.094 -3.153 -1.032
279 HA LEU 35 HA LEU 35 97.392 -4.142 1.024
280 1HB LEU 35 HB2 LEU 35 97.589 -1.797 0.852
281 2HB LEU 35 HB1 LEU 35 97.251 -1.807 -0.867
282 HG LEU 35 HG LEU 35 94.937 -2.169 -0.518
283 1HD1 LEU 35 HD11 LEU 35 94.522 -3.708 1.079
284 2HD1 LEU 35 HD12 LEU 35 94.296 -2.282 2.090
285 3HD1 LEU 35 HD13 LEU 35 95.833 -3.147 2.113
286 1HD2 LEU 35 HD21 LEU 35 96.274 -0.079 1.065
287 2HD2 LEU 35 HD22 LEU 35 94.586 -0.382 1.477
288 3HD2 LEU 35 HD23 LEU 35 95.027 0.056 -0.174
289 H LYS 36 HN LYS 36 96.954 -3.718 -2.481
290 HA LYS 36 HA LYS 36 94.335 -4.607 -2.681
291 1HB LYS 36 HB2 LYS 36 96.661 -4.625 -4.549
292 2HB LYS 36 HB1 LYS 36 95.227 -5.535 -5.001
293 1HG LYS 36 HG2 LYS 36 94.005 -3.680 -5.392
294 2HG LYS 36 HG1 LYS 36 94.765 -2.772 -4.084
295 1HD LYS 36 HD2 LYS 36 96.222 -1.819 -5.481
296 2HD LYS 36 HD1 LYS 36 96.648 -3.371 -6.203
297 1HE LYS 36 HE2 LYS 36 94.245 -3.042 -7.316
298 2HE LYS 36 HE1 LYS 36 94.662 -1.347 -7.067
299 1HZ LYS 36 HZ1 LYS 36 95.926 -3.337 -8.807
300 2HZ LYS 36 HZ2 LYS 36 96.898 -2.116 -8.153
301 3HZ LYS 36 HZ3 LYS 36 95.565 -1.712 -9.113
302 H ASP 37 HN ASP 37 97.233 -6.652 -3.278
303 HA ASP 37 HA ASP 37 95.911 -9.061 -3.450
304 1HB ASP 37 HB2 ASP 37 98.058 -10.122 -2.956
305 2HB ASP 37 HB1 ASP 37 98.267 -8.757 -4.047
306 H ASP 38 HN ASP 38 96.716 -7.270 -0.553
307 HA ASP 38 HA ASP 38 95.469 -9.429 1.016
308 1HB ASP 38 HB2 ASP 38 98.043 -9.114 1.245
309 2HB ASP 38 HB1 ASP 38 97.611 -7.695 2.193
310 HA PRO 39 HA PRO 39 92.909 -5.845 2.024
311 1HB PRO 39 HB2 PRO 39 90.851 -7.220 3.069
312 2HB PRO 39 HB1 PRO 39 91.138 -7.173 1.324
313 1HG PRO 39 HG2 PRO 39 91.894 -9.296 3.304
314 2HG PRO 39 HG1 PRO 39 91.118 -9.477 1.718
315 1HD PRO 39 HD2 PRO 39 93.774 -9.856 2.086
316 2HD PRO 39 HD1 PRO 39 93.104 -9.212 0.573
317 H SER 40 HN SER 40 93.780 -8.490 4.154
318 HA SER 40 HA SER 40 93.040 -7.182 6.584
319 1HB SER 40 HB2 SER 40 93.760 -9.759 5.916
320 2HB SER 40 HB1 SER 40 95.173 -9.186 6.800
321 HG SER 40 HG SER 40 93.553 -8.456 8.416
322 H GLN 41 HN GLN 41 95.633 -6.903 4.407
323 HA GLN 41 HA GLN 41 97.523 -5.875 6.336
324 1HB GLN 41 HB2 GLN 41 97.591 -6.128 3.329
325 2HB GLN 41 HB1 GLN 41 98.899 -5.433 4.278
326 1HG GLN 41 HG2 GLN 41 97.932 -8.133 5.026
327 2HG GLN 41 HG1 GLN 41 98.900 -7.966 3.562
328 1HE2 GLN 41 HE21 GLN 41 101.005 -7.025 3.750
329 2HE2 GLN 41 HE22 GLN 41 101.888 -7.174 5.227
330 H SER 42 HN SER 42 94.848 -4.605 4.752
331 HA SER 42 HA SER 42 95.511 -2.154 3.768
332 1HB SER 42 HB2 SER 42 93.296 -1.353 4.747
333 2HB SER 42 HB1 SER 42 93.225 -2.789 3.726
334 HG SER 42 HG SER 42 92.189 -2.666 6.011
335 H ALA 43 HN ALA 43 95.543 -3.105 7.136
336 HA ALA 43 HA ALA 43 95.854 -0.434 8.143
337 1HB ALA 43 HB1 ALA 43 94.988 -1.676 9.820
338 2HB ALA 43 HB2 ALA 43 96.690 -1.957 10.191
339 3HB ALA 43 HB3 ALA 43 95.777 -3.157 9.276
340 H ASN 44 HN ASN 44 98.014 -3.144 7.448
341 HA ASN 44 HA ASN 44 100.354 -1.919 8.491
342 1HB ASN 44 HB2 ASN 44 99.959 -4.200 6.551
343 2HB ASN 44 HB1 ASN 44 101.540 -3.696 7.143
344 1HD2 ASN 44 HD21 ASN 44 101.948 -3.841 9.417
345 2HD2 ASN 44 HD22 ASN 44 101.113 -5.014 10.372
346 H LEU 45 HN LEU 45 98.839 -1.949 5.310
347 HA LEU 45 HA LEU 45 101.062 -0.668 4.016
348 1HB LEU 45 HB2 LEU 45 98.237 -1.262 3.176
349 2HB LEU 45 HB1 LEU 45 99.310 -0.319 2.170
350 HG LEU 45 HG LEU 45 99.325 -2.561 1.360
351 1HD1 LEU 45 HD11 LEU 45 101.771 -1.601 2.733
352 2HD1 LEU 45 HD12 LEU 45 101.461 -1.874 1.021
353 3HD1 LEU 45 HD13 LEU 45 101.771 -3.240 2.090
354 1HD2 LEU 45 HD21 LEU 45 100.008 -3.390 4.170
355 2HD2 LEU 45 HD22 LEU 45 99.968 -4.456 2.766
356 3HD2 LEU 45 HD23 LEU 45 98.486 -3.682 3.328
357 H LEU 46 HN LEU 46 97.792 0.385 4.957
358 HA LEU 46 HA LEU 46 98.026 3.045 4.165
359 1HB LEU 46 HB2 LEU 46 95.985 1.684 5.034
360 2HB LEU 46 HB1 LEU 46 96.474 2.280 6.609
361 HG LEU 46 HG LEU 46 95.986 4.161 4.316
362 1HD1 LEU 46 HD11 LEU 46 93.825 3.854 6.271
363 2HD1 LEU 46 HD12 LEU 46 94.036 2.478 5.189
364 3HD1 LEU 46 HD13 LEU 46 93.756 4.087 4.524
365 1HD2 LEU 46 HD21 LEU 46 96.484 4.353 7.214
366 2HD2 LEU 46 HD22 LEU 46 95.246 5.432 6.571
367 3HD2 LEU 46 HD23 LEU 46 96.882 5.475 5.913
368 H ALA 47 HN ALA 47 98.839 1.543 7.293
369 HA ALA 47 HA ALA 47 99.577 4.002 8.526
370 1HB ALA 47 HB1 ALA 47 98.896 1.782 9.636
371 2HB ALA 47 HB2 ALA 47 100.173 2.738 10.386
372 3HB ALA 47 HB3 ALA 47 100.585 1.324 9.415
373 H GLU 48 HN GLU 48 101.352 1.457 6.844
374 HA GLU 48 HA GLU 48 103.948 2.372 7.432
375 1HB GLU 48 HB2 GLU 48 102.750 0.610 5.338
376 2HB GLU 48 HB1 GLU 48 104.410 1.153 5.135
377 1HG GLU 48 HG2 GLU 48 103.710 0.037 7.774
378 2HG GLU 48 HG1 GLU 48 103.733 -1.092 6.420
379 H ALA 49 HN ALA 49 101.783 3.035 4.695
380 HA ALA 49 HA ALA 49 103.616 4.741 3.341
381 1HB ALA 49 HB1 ALA 49 101.360 3.502 2.585
382 2HB ALA 49 HB2 ALA 49 102.043 4.881 1.723
383 3HB ALA 49 HB3 ALA 49 100.726 5.123 2.870
384 H LYS 50 HN LYS 50 101.075 5.256 5.713
385 HA LYS 50 HA LYS 50 100.841 8.036 5.517
386 1HB LYS 50 HB2 LYS 50 100.372 6.079 7.747
387 2HB LYS 50 HB1 LYS 50 100.182 7.805 8.017
388 1HG LYS 50 HG2 LYS 50 98.793 6.752 5.651
389 2HG LYS 50 HG1 LYS 50 98.206 6.159 7.206
390 1HD LYS 50 HD2 LYS 50 98.695 9.078 6.894
391 2HD LYS 50 HD1 LYS 50 97.263 8.381 6.135
392 1HE LYS 50 HE2 LYS 50 98.003 8.143 9.050
393 2HE LYS 50 HE1 LYS 50 96.789 9.236 8.387
394 1HZ LYS 50 HZ1 LYS 50 95.602 7.395 9.152
395 2HZ LYS 50 HZ2 LYS 50 96.713 6.283 8.528
396 3HZ LYS 50 HZ3 LYS 50 95.703 7.146 7.481
397 H LYS 51 HN LYS 51 102.831 6.119 7.783
398 HA LYS 51 HA LYS 51 104.133 8.358 8.913
399 1HB LYS 51 HB2 LYS 51 105.785 6.664 9.756
400 2HB LYS 51 HB1 LYS 51 104.107 6.324 10.159
401 1HG LYS 51 HG2 LYS 51 104.545 4.268 9.418
402 2HG LYS 51 HG1 LYS 51 104.401 4.974 7.807
403 1HD LYS 51 HD2 LYS 51 106.574 4.681 7.385
404 2HD LYS 51 HD1 LYS 51 107.044 5.373 8.938
405 1HE LYS 51 HE2 LYS 51 106.028 2.558 8.591
406 2HE LYS 51 HE1 LYS 51 107.737 2.991 8.587
407 1HZ LYS 51 HZ1 LYS 51 107.754 3.092 10.792
408 2HZ LYS 51 HZ2 LYS 51 106.216 2.390 10.782
409 3HZ LYS 51 HZ3 LYS 51 106.376 4.072 10.850
410 H LEU 52 HN LEU 52 105.104 6.105 6.333
411 HA LEU 52 HA LEU 52 107.671 7.087 5.886
412 1HB LEU 52 HB2 LEU 52 106.224 5.102 4.822
413 2HB LEU 52 HB1 LEU 52 106.072 6.269 3.528
414 HG LEU 52 HG LEU 52 107.900 4.941 2.916
415 1HD1 LEU 52 HD11 LEU 52 109.442 7.074 4.306
416 2HD1 LEU 52 HD12 LEU 52 108.247 7.533 3.092
417 3HD1 LEU 52 HD13 LEU 52 109.584 6.469 2.655
418 1HD2 LEU 52 HD21 LEU 52 108.754 5.144 5.792
419 2HD2 LEU 52 HD22 LEU 52 109.801 4.524 4.515
420 3HD2 LEU 52 HD23 LEU 52 108.287 3.700 4.893
421 H ASN 53 HN ASN 53 104.672 7.987 4.149
422 HA ASN 53 HA ASN 53 105.694 10.003 2.539
423 1HB ASN 53 HB2 ASN 53 103.313 9.035 2.615
424 2HB ASN 53 HB1 ASN 53 103.001 10.193 3.902
425 1HD2 ASN 53 HD21 ASN 53 101.977 11.902 3.192
426 2HD2 ASN 53 HD22 ASN 53 102.205 12.679 1.669
427 H ASP 54 HN ASP 54 104.539 10.209 5.900
428 HA ASP 54 HA ASP 54 104.868 12.967 6.237
429 1HB ASP 54 HB2 ASP 54 104.942 10.642 8.148
430 2HB ASP 54 HB1 ASP 54 105.219 12.290 8.707
431 H ALA 55 HN ALA 55 107.135 10.294 6.950
432 HA ALA 55 HA ALA 55 109.240 11.795 7.902
433 1HB ALA 55 HB1 ALA 55 109.147 9.375 8.060
434 2HB ALA 55 HB2 ALA 55 110.662 9.892 7.320
435 3HB ALA 55 HB3 ALA 55 109.370 9.236 6.316
436 H GLN 56 HN GLN 56 108.326 11.236 4.519
437 HA GLN 56 HA GLN 56 110.728 12.729 3.717
438 1HB GLN 56 HB2 GLN 56 109.602 12.048 1.342
439 2HB GLN 56 HB1 GLN 56 110.840 11.118 2.166
440 1HG GLN 56 HG2 GLN 56 109.146 9.663 3.117
441 2HG GLN 56 HG1 GLN 56 107.875 10.626 2.363
442 1HE2 GLN 56 HE21 GLN 56 110.237 10.718 0.139
443 2HE2 GLN 56 HE22 GLN 56 109.834 9.330 -0.798
444 H ALA 57 HN ALA 57 107.648 13.397 4.566
445 HA ALA 57 HA ALA 57 106.842 15.199 2.507
446 1HB ALA 57 HB1 ALA 57 104.968 15.519 3.744
447 2HB ALA 57 HB2 ALA 57 105.862 15.654 5.256
448 3HB ALA 57 HB3 ALA 57 105.535 14.066 4.565
449 HA PRO 58 HA PRO 58 109.058 18.883 3.484
450 1HB PRO 58 HB2 PRO 58 107.127 20.816 3.436
451 2HB PRO 58 HB1 PRO 58 107.799 20.072 1.981
452 1HG PRO 58 HG2 PRO 58 105.243 19.463 3.413
453 2HG PRO 58 HG1 PRO 58 105.549 19.588 1.670
454 1HD PRO 58 HD2 PRO 58 105.362 17.210 2.926
455 2HD PRO 58 HD1 PRO 58 106.452 17.465 1.549
456 H LYS 59 HN LYS 59 109.284 17.903 5.718
457 HA LYS 59 HA LYS 59 108.961 19.830 7.695
458 1HB LYS 59 HB2 LYS 59 107.257 18.822 9.138
459 2HB LYS 59 HB1 LYS 59 106.593 19.333 7.608
460 1HG LYS 59 HG2 LYS 59 105.802 17.304 7.217
461 2HG LYS 59 HG1 LYS 59 107.421 16.621 7.377
462 1HD LYS 59 HD2 LYS 59 106.957 16.879 9.938
463 2HD LYS 59 HD1 LYS 59 105.268 16.913 9.430
464 1HE LYS 59 HE2 LYS 59 105.513 14.669 9.736
465 2HE LYS 59 HE1 LYS 59 106.024 14.781 8.052
466 1HZ LYS 59 HZ1 LYS 59 108.150 15.178 9.960
467 2HZ LYS 59 HZ2 LYS 59 108.107 14.210 8.574
468 3HZ LYS 59 HZ3 LYS 59 107.455 13.637 10.025
469 H ALA 60 HN ALA 60 111.147 18.553 7.207
470 HA ALA 60 HA ALA 60 111.280 16.533 9.320
471 1HB ALA 60 HB1 ALA 60 111.552 15.317 7.311
472 2HB ALA 60 HB2 ALA 60 113.170 15.493 7.991
473 3HB ALA 60 HB3 ALA 60 112.662 16.517 6.648
Start of MODEL 16
1 1H GLY -1 HT1 GLY -1 99.048 -7.620 -7.932
2 2H GLY -1 HT2 GLY -1 98.140 -8.977 -7.492
3 3H GLY -1 HT3 GLY -1 97.547 -7.424 -7.176
4 1HA GLY -1 HA1 GLY -1 96.845 -7.076 -9.277
5 2HA GLY -1 HA2 GLY -1 98.173 -8.005 -9.955
6 H SER 0 HN SER 0 94.900 -8.045 -8.922
7 HA SER 0 HA SER 0 94.421 -10.528 -10.253
8 1HB SER 0 HB2 SER 0 93.361 -11.523 -8.082
9 2HB SER 0 HB1 SER 0 95.098 -11.677 -8.342
10 HG SER 0 HG SER 0 93.953 -9.537 -6.886
11 H THR 1 HN THR 1 92.347 -10.677 -10.912
12 HA THR 1 HA THR 1 90.663 -8.575 -11.098
13 HB THR 1 HB THR 1 88.812 -10.218 -11.433
14 HG1 THR 1 HG1 THR 1 89.368 -12.429 -11.255
15 1HG2 THR 1 HG21 THR 1 91.446 -10.823 -12.743
16 2HG2 THR 1 HG22 THR 1 90.134 -9.814 -13.353
17 3HG2 THR 1 HG23 THR 1 89.921 -11.561 -13.232
18 H ALA 2 HN ALA 2 90.418 -11.071 -8.561
19 HA ALA 2 HA ALA 2 89.089 -11.120 -6.664
20 1HB ALA 2 HB1 ALA 2 91.197 -10.207 -5.935
21 2HB ALA 2 HB2 ALA 2 89.880 -9.449 -5.041
22 3HB ALA 2 HB3 ALA 2 90.668 -8.576 -6.355
23 H ASP 3 HN ASP 3 88.850 -7.933 -5.819
24 HA ASP 3 HA ASP 3 86.724 -6.895 -7.258
25 1HB ASP 3 HB2 ASP 3 84.864 -7.361 -5.580
26 2HB ASP 3 HB1 ASP 3 85.321 -8.706 -6.621
27 H ASN 4 HN ASN 4 88.385 -7.297 -4.228
28 HA ASN 4 HA ASN 4 89.017 -5.837 -2.606
29 1HB ASN 4 HB2 ASN 4 88.535 -3.941 -4.896
30 2HB ASN 4 HB1 ASN 4 89.111 -3.380 -3.330
31 1HD2 ASN 4 HD21 ASN 4 91.207 -3.623 -2.810
32 2HD2 ASN 4 HD22 ASN 4 92.388 -4.361 -3.831
33 H LYS 5 HN LYS 5 86.987 -6.560 -1.538
34 HA LYS 5 HA LYS 5 84.647 -4.969 -1.606
35 1HB LYS 5 HB2 LYS 5 85.237 -7.426 -0.649
36 2HB LYS 5 HB1 LYS 5 85.215 -6.510 0.852
37 1HG LYS 5 HG2 LYS 5 82.968 -6.510 -1.152
38 2HG LYS 5 HG1 LYS 5 83.048 -7.576 0.253
39 1HD LYS 5 HD2 LYS 5 83.295 -5.466 1.649
40 2HD LYS 5 HD1 LYS 5 82.829 -4.576 0.199
41 1HE LYS 5 HE2 LYS 5 80.893 -6.484 0.307
42 2HE LYS 5 HE1 LYS 5 81.209 -6.210 2.021
43 1HZ LYS 5 HZ1 LYS 5 79.504 -4.722 1.310
44 2HZ LYS 5 HZ2 LYS 5 80.431 -4.176 0.006
45 3HZ LYS 5 HZ3 LYS 5 80.900 -3.807 1.588
46 H PHE 6 HN PHE 6 87.098 -3.409 -1.083
47 HA PHE 6 HA PHE 6 87.277 -2.578 1.589
48 1HB PHE 6 HB2 PHE 6 87.971 -1.299 -1.048
49 2HB PHE 6 HB1 PHE 6 88.188 -0.429 0.466
50 HD1 PHE 6 HD1 PHE 6 88.747 -4.059 -0.069
51 HD2 PHE 6 HD2 PHE 6 90.528 -0.237 0.507
52 HE1 PHE 6 HE1 PHE 6 90.934 -5.128 0.253
53 HE2 PHE 6 HE2 PHE 6 92.719 -1.304 0.834
54 HZ PHE 6 HZ PHE 6 92.927 -3.757 0.712
55 H ASN 7 HN ASN 7 86.610 -0.457 2.441
56 HA ASN 7 HA ASN 7 84.030 0.442 1.341
57 1HB ASN 7 HB2 ASN 7 84.767 -0.273 4.161
58 2HB ASN 7 HB1 ASN 7 83.537 0.952 3.870
59 1HD2 ASN 7 HD21 ASN 7 81.754 -0.105 4.503
60 2HD2 ASN 7 HD22 ASN 7 81.177 -1.569 3.791
61 H LYS 8 HN LYS 8 83.554 2.596 2.983
62 HA LYS 8 HA LYS 8 85.123 4.592 1.874
63 1HB LYS 8 HB2 LYS 8 84.144 6.106 3.496
64 2HB LYS 8 HB1 LYS 8 82.919 4.981 2.930
65 1HG LYS 8 HG2 LYS 8 84.352 4.170 5.368
66 2HG LYS 8 HG1 LYS 8 83.332 5.598 5.517
67 1HD LYS 8 HD2 LYS 8 81.439 4.402 5.356
68 2HD LYS 8 HD1 LYS 8 82.081 3.385 4.065
69 1HE LYS 8 HE2 LYS 8 83.070 1.898 5.564
70 2HE LYS 8 HE1 LYS 8 83.021 3.057 6.891
71 1HZ LYS 8 HZ1 LYS 8 80.536 2.007 5.689
72 2HZ LYS 8 HZ2 LYS 8 80.759 2.710 7.211
73 3HZ LYS 8 HZ3 LYS 8 81.346 1.154 6.905
74 H GLU 9 HN GLU 9 85.581 2.730 4.800
75 HA GLU 9 HA GLU 9 87.759 4.330 5.767
76 1HB GLU 9 HB2 GLU 9 86.182 2.098 6.712
77 2HB GLU 9 HB1 GLU 9 87.893 1.817 6.998
78 1HG GLU 9 HG2 GLU 9 87.653 3.017 8.843
79 2HG GLU 9 HG1 GLU 9 87.536 4.430 7.795
80 H GLN 10 HN GLN 10 87.503 1.074 4.319
81 HA GLN 10 HA GLN 10 90.313 0.662 4.233
82 1HB GLN 10 HB2 GLN 10 88.268 -1.012 4.138
83 2HB GLN 10 HB1 GLN 10 88.453 -0.789 2.404
84 1HG GLN 10 HG2 GLN 10 89.875 -2.492 2.554
85 2HG GLN 10 HG1 GLN 10 91.013 -1.280 3.141
86 1HE2 GLN 10 HE21 GLN 10 91.443 -3.833 3.805
87 2HE2 GLN 10 HE22 GLN 10 91.106 -4.103 5.473
88 H GLN 11 HN GLN 11 87.923 1.470 1.722
89 HA GLN 11 HA GLN 11 89.668 1.554 -0.449
90 1HB GLN 11 HB2 GLN 11 87.021 1.841 -0.211
91 2HB GLN 11 HB1 GLN 11 87.458 3.538 -0.355
92 1HG GLN 11 HG2 GLN 11 88.136 3.328 -2.517
93 2HG GLN 11 HG1 GLN 11 88.610 1.642 -2.321
94 1HE2 GLN 11 HE21 GLN 11 87.227 0.081 -2.906
95 2HE2 GLN 11 HE22 GLN 11 85.615 0.350 -3.465
96 H ASN 12 HN ASN 12 88.982 3.931 2.031
97 HA ASN 12 HA ASN 12 90.032 6.217 0.880
98 1HB ASN 12 HB2 ASN 12 88.907 6.249 3.050
99 2HB ASN 12 HB1 ASN 12 90.224 5.327 3.768
100 1HD2 ASN 12 HD21 ASN 12 89.938 8.208 1.711
101 2HD2 ASN 12 HD22 ASN 12 90.979 9.201 2.668
102 H ALA 13 HN ALA 13 91.695 3.520 2.449
103 HA ALA 13 HA ALA 13 94.240 4.587 2.633
104 1HB ALA 13 HB1 ALA 13 93.619 1.733 1.894
105 2HB ALA 13 HB2 ALA 13 93.499 2.380 3.530
106 3HB ALA 13 HB3 ALA 13 95.059 2.341 2.709
107 H PHE 14 HN PHE 14 92.660 3.057 -0.176
108 HA PHE 14 HA PHE 14 94.827 2.864 -1.869
109 1HB PHE 14 HB2 PHE 14 92.677 1.946 -2.438
110 2HB PHE 14 HB1 PHE 14 91.946 3.536 -2.475
111 HD1 PHE 14 HD1 PHE 14 94.546 1.476 -4.160
112 HD2 PHE 14 HD2 PHE 14 91.814 4.725 -4.451
113 HE1 PHE 14 HE1 PHE 14 95.045 1.677 -6.563
114 HE2 PHE 14 HE2 PHE 14 92.302 4.930 -6.852
115 HZ PHE 14 HZ PHE 14 93.919 3.403 -7.911
116 H TRP 15 HN TRP 15 92.507 5.545 -1.734
117 HA TRP 15 HA TRP 15 93.848 7.192 -3.559
118 1HB TRP 15 HB2 TRP 15 91.511 7.359 -2.094
119 2HB TRP 15 HB1 TRP 15 92.474 8.702 -1.486
120 HD1 TRP 15 HD1 TRP 15 92.471 7.482 -5.138
121 HE1 TRP 15 HE1 TRP 15 91.650 9.408 -6.632
122 HE3 TRP 15 HE3 TRP 15 91.204 10.854 -1.502
123 HZ2 TRP 15 HZ2 TRP 15 90.607 12.008 -6.316
124 HZ3 TRP 15 HZ3 TRP 15 90.303 13.039 -2.189
125 HH2 TRP 15 HH2 TRP 15 90.012 13.602 -4.546
126 H GLU 16 HN GLU 16 93.865 7.447 -0.003
127 HA GLU 16 HA GLU 16 95.789 9.449 0.234
128 1HB GLU 16 HB2 GLU 16 94.386 7.698 1.976
129 2HB GLU 16 HB1 GLU 16 96.091 7.587 2.392
130 1HG GLU 16 HG2 GLU 16 95.358 9.296 3.746
131 2HG GLU 16 HG1 GLU 16 96.024 10.168 2.366
132 H ILE 17 HN ILE 17 96.087 6.172 -0.563
133 HA ILE 17 HA ILE 17 98.932 5.943 0.006
134 HB ILE 17 HB ILE 17 96.937 4.068 -1.213
135 1HG1 ILE 17 HG12 ILE 17 98.983 3.600 0.951
136 2HG1 ILE 17 HG11 ILE 17 97.406 4.306 1.288
137 1HG2 ILE 17 HG21 ILE 17 99.888 4.068 -1.604
138 2HG2 ILE 17 HG22 ILE 17 98.603 3.556 -2.700
139 3HG2 ILE 17 HG23 ILE 17 99.074 2.523 -1.348
140 1HD1 ILE 17 HD11 ILE 17 98.151 1.553 0.896
141 2HD1 ILE 17 HD12 ILE 17 96.845 2.030 -0.189
142 3HD1 ILE 17 HD13 ILE 17 96.666 2.240 1.553
143 H LEU 18 HN LEU 18 96.828 6.159 -2.802
144 HA LEU 18 HA LEU 18 98.893 6.266 -4.750
145 1HB LEU 18 HB2 LEU 18 95.935 6.708 -4.694
146 2HB LEU 18 HB1 LEU 18 96.837 7.321 -6.070
147 HG LEU 18 HG LEU 18 95.862 5.124 -6.524
148 1HD1 LEU 18 HD11 LEU 18 98.867 5.044 -6.341
149 2HD1 LEU 18 HD12 LEU 18 97.938 5.804 -7.632
150 3HD1 LEU 18 HD13 LEU 18 97.854 4.059 -7.397
151 1HD2 LEU 18 HD21 LEU 18 95.744 3.981 -4.523
152 2HD2 LEU 18 HD22 LEU 18 97.403 4.371 -4.077
153 3HD2 LEU 18 HD23 LEU 18 97.086 3.174 -5.329
154 H HIS 19 HN HIS 19 97.176 8.627 -2.855
155 HA HIS 19 HA HIS 19 98.014 10.864 -4.420
156 1HB HIS 19 HB2 HIS 19 96.069 10.479 -2.532
157 2HB HIS 19 HB1 HIS 19 97.283 11.361 -1.611
158 HD1 HIS 19 HD1 HIS 19 95.633 11.743 -5.030
159 HD2 HIS 19 HD2 HIS 19 96.904 14.021 -1.795
160 HE1 HIS 19 HE1 HIS 19 95.036 14.118 -5.603
161 HE2 HIS 19 HE2 HIS 19 95.853 15.484 -3.650
162 H LEU 20 HN LEU 20 98.804 9.861 -1.074
163 HA LEU 20 HA LEU 20 100.515 10.837 0.201
164 1HB LEU 20 HB2 LEU 20 101.397 8.641 -1.557
165 2HB LEU 20 HB1 LEU 20 102.645 9.485 -0.672
166 HG LEU 20 HG LEU 20 100.306 7.959 0.458
167 1HD1 LEU 20 HD11 LEU 20 103.277 7.575 0.428
168 2HD1 LEU 20 HD12 LEU 20 102.008 6.455 -0.074
169 3HD1 LEU 20 HD13 LEU 20 102.254 6.803 1.640
170 1HD2 LEU 20 HD21 LEU 20 101.960 8.718 2.559
171 2HD2 LEU 20 HD22 LEU 20 100.342 9.326 2.212
172 3HD2 LEU 20 HD23 LEU 20 101.756 10.184 1.601
173 HA PRO 21 HA PRO 21 102.086 13.799 -3.123
174 1HB PRO 21 HB2 PRO 21 100.974 15.807 -1.263
175 2HB PRO 21 HB1 PRO 21 100.796 15.681 -3.016
176 1HG PRO 21 HG2 PRO 21 98.764 15.130 -1.353
177 2HG PRO 21 HG1 PRO 21 99.005 14.235 -2.866
178 1HD PRO 21 HD2 PRO 21 99.659 13.430 -0.058
179 2HD PRO 21 HD1 PRO 21 98.986 12.461 -1.380
180 H ASN 22 HN ASN 22 104.157 13.203 -2.450
181 HA ASN 22 HA ASN 22 106.022 14.661 -1.586
182 1HB ASN 22 HB2 ASN 22 104.280 14.503 0.839
183 2HB ASN 22 HB1 ASN 22 106.018 14.595 1.055
184 1HD2 ASN 22 HD21 ASN 22 105.834 16.622 2.019
185 2HD2 ASN 22 HD22 ASN 22 105.530 18.044 1.088
186 H LEU 23 HN LEU 23 104.925 11.708 -1.755
187 HA LEU 23 HA LEU 23 107.271 10.555 -0.404
188 1HB LEU 23 HB2 LEU 23 105.365 9.806 0.804
189 2HB LEU 23 HB1 LEU 23 104.475 9.479 -0.667
190 HG LEU 23 HG LEU 23 106.945 7.911 -0.380
191 1HD1 LEU 23 HD11 LEU 23 106.539 7.628 1.859
192 2HD1 LEU 23 HD12 LEU 23 105.554 6.331 1.179
193 3HD1 LEU 23 HD13 LEU 23 104.796 7.842 1.683
194 1HD2 LEU 23 HD21 LEU 23 104.430 6.502 -0.685
195 2HD2 LEU 23 HD22 LEU 23 105.833 6.555 -1.747
196 3HD2 LEU 23 HD23 LEU 23 104.603 7.812 -1.854
197 H ASN 24 HN ASN 24 108.282 8.772 -1.508
198 HA ASN 24 HA ASN 24 108.509 9.109 -4.281
199 1HB ASN 24 HB2 ASN 24 110.009 7.798 -2.525
200 2HB ASN 24 HB1 ASN 24 109.048 6.427 -3.067
201 1HD2 ASN 24 HD21 ASN 24 110.613 9.227 -4.594
202 2HD2 ASN 24 HD22 ASN 24 111.410 8.318 -5.828
203 H GLU 25 HN GLU 25 106.813 8.848 -5.678
204 HA GLU 25 HA GLU 25 104.532 7.403 -5.143
205 1HB GLU 25 HB2 GLU 25 104.422 9.049 -6.792
206 2HB GLU 25 HB1 GLU 25 105.807 8.405 -7.664
207 1HG GLU 25 HG2 GLU 25 103.916 7.905 -8.974
208 2HG GLU 25 HG1 GLU 25 104.395 6.390 -8.212
209 H GLU 26 HN GLU 26 107.615 6.258 -6.147
210 HA GLU 26 HA GLU 26 106.779 3.765 -7.270
211 1HB GLU 26 HB2 GLU 26 109.054 4.791 -7.601
212 2HB GLU 26 HB1 GLU 26 109.412 4.413 -5.922
213 1HG GLU 26 HG2 GLU 26 108.595 1.995 -6.850
214 2HG GLU 26 HG1 GLU 26 109.363 2.679 -8.281
215 H GLN 27 HN GLN 27 107.215 5.100 -4.174
216 HA GLN 27 HA GLN 27 107.178 2.618 -2.684
217 1HB GLN 27 HB2 GLN 27 107.773 5.330 -2.065
218 2HB GLN 27 HB1 GLN 27 106.390 4.870 -1.084
219 1HG GLN 27 HG2 GLN 27 108.617 4.523 -0.012
220 2HG GLN 27 HG1 GLN 27 107.579 3.098 -0.065
221 1HE2 GLN 27 HE21 GLN 27 110.323 4.679 -1.592
222 2HE2 GLN 27 HE22 GLN 27 111.048 3.237 -2.209
223 H ARG 28 HN ARG 28 105.025 5.174 -3.745
224 HA ARG 28 HA ARG 28 102.702 4.449 -2.362
225 1HB ARG 28 HB2 ARG 28 103.161 5.785 -5.024
226 2HB ARG 28 HB1 ARG 28 101.537 5.430 -4.462
227 1HG ARG 28 HG2 ARG 28 102.384 6.712 -2.314
228 2HG ARG 28 HG1 ARG 28 103.495 7.429 -3.481
229 1HD ARG 28 HD2 ARG 28 100.604 7.284 -4.175
230 2HD ARG 28 HD1 ARG 28 101.108 8.479 -3.012
231 HE ARG 28 HE ARG 28 101.434 8.636 -5.794
232 1HH1 ARG 28 HH11 ARG 28 103.190 9.285 -2.851
233 2HH1 ARG 28 HH12 ARG 28 104.097 10.592 -3.533
234 1HH2 ARG 28 HH21 ARG 28 102.615 10.369 -6.688
235 2HH2 ARG 28 HH22 ARG 28 103.772 11.208 -5.710
236 H ASN 29 HN ASN 29 103.634 3.624 -5.730
237 HA ASN 29 HA ASN 29 101.656 1.814 -6.290
238 1HB ASN 29 HB2 ASN 29 104.120 2.592 -7.445
239 2HB ASN 29 HB1 ASN 29 104.136 0.833 -7.365
240 1HD2 ASN 29 HD21 ASN 29 103.903 0.463 -9.518
241 2HD2 ASN 29 HD22 ASN 29 102.474 0.855 -10.406
242 H GLY 30 HN GLY 30 104.878 1.070 -4.885
243 1HA GLY 30 HA2 GLY 30 104.516 -1.667 -4.535
244 2HA GLY 30 HA1 GLY 30 105.491 -0.657 -3.475
245 H PHE 31 HN PHE 31 103.367 1.016 -2.591
246 HA PHE 31 HA PHE 31 102.404 -0.520 -0.414
247 1HB PHE 31 HB2 PHE 31 102.184 2.288 -1.337
248 2HB PHE 31 HB1 PHE 31 100.894 1.718 -0.284
249 HD1 PHE 31 HD1 PHE 31 101.890 0.246 1.759
250 HD2 PHE 31 HD2 PHE 31 103.903 3.385 -0.281
251 HE1 PHE 31 HE1 PHE 31 103.329 0.583 3.721
252 HE2 PHE 31 HE2 PHE 31 105.347 3.737 1.679
253 HZ PHE 31 HZ PHE 31 105.062 2.335 3.685
254 H ILE 32 HN ILE 32 100.938 0.621 -3.424
255 HA ILE 32 HA ILE 32 98.280 -0.116 -2.785
256 HB ILE 32 HB ILE 32 99.172 -0.296 -5.624
257 1HG1 ILE 32 HG12 ILE 32 98.791 2.363 -4.238
258 2HG1 ILE 32 HG11 ILE 32 100.362 1.689 -4.651
259 1HG2 ILE 32 HG21 ILE 32 96.740 0.478 -4.104
260 2HG2 ILE 32 HG22 ILE 32 96.913 -0.582 -5.502
261 3HG2 ILE 32 HG23 ILE 32 96.986 1.168 -5.708
262 1HD1 ILE 32 HD11 ILE 32 99.803 1.728 -6.996
263 2HD1 ILE 32 HD12 ILE 32 99.599 3.327 -6.286
264 3HD1 ILE 32 HD13 ILE 32 98.187 2.324 -6.620
265 H GLN 33 HN GLN 33 100.825 -1.787 -4.597
266 HA GLN 33 HA GLN 33 99.354 -4.074 -5.265
267 1HB GLN 33 HB2 GLN 33 102.315 -4.012 -4.685
268 2HB GLN 33 HB1 GLN 33 101.457 -5.137 -5.728
269 1HG GLN 33 HG2 GLN 33 101.185 -2.293 -6.431
270 2HG GLN 33 HG1 GLN 33 102.799 -2.979 -6.608
271 1HE2 GLN 33 HE21 GLN 33 101.436 -2.068 -8.788
272 2HE2 GLN 33 HE22 GLN 33 100.970 -3.397 -9.789
273 H SER 34 HN SER 34 101.515 -3.508 -2.485
274 HA SER 34 HA SER 34 101.210 -6.011 -1.282
275 1HB SER 34 HB2 SER 34 102.923 -4.445 -0.541
276 2HB SER 34 HB1 SER 34 101.689 -3.312 0.011
277 HG SER 34 HG SER 34 102.601 -5.661 1.173
278 H LEU 35 HN LEU 35 99.277 -3.073 -1.017
279 HA LEU 35 HA LEU 35 97.457 -4.189 0.921
280 1HB LEU 35 HB2 LEU 35 97.712 -1.848 1.030
281 2HB LEU 35 HB1 LEU 35 97.488 -1.656 -0.699
282 HG LEU 35 HG LEU 35 95.127 -2.226 -0.490
283 1HD1 LEU 35 HD11 LEU 35 94.745 -3.677 1.198
284 2HD1 LEU 35 HD12 LEU 35 94.393 -2.195 2.084
285 3HD1 LEU 35 HD13 LEU 35 95.974 -2.964 2.238
286 1HD2 LEU 35 HD21 LEU 35 96.374 0.065 0.754
287 2HD2 LEU 35 HD22 LEU 35 94.819 -0.302 1.498
288 3HD2 LEU 35 HD23 LEU 35 94.920 -0.022 -0.242
289 H LYS 36 HN LYS 36 97.678 -3.986 -2.564
290 HA LYS 36 HA LYS 36 94.921 -4.489 -3.059
291 1HB LYS 36 HB2 LYS 36 96.869 -3.447 -4.567
292 2HB LYS 36 HB1 LYS 36 96.919 -5.101 -5.155
293 1HG LYS 36 HG2 LYS 36 95.267 -4.558 -6.527
294 2HG LYS 36 HG1 LYS 36 94.218 -4.456 -5.110
295 1HD LYS 36 HD2 LYS 36 95.840 -2.190 -6.272
296 2HD LYS 36 HD1 LYS 36 94.100 -2.419 -6.468
297 1HE LYS 36 HE2 LYS 36 95.433 -2.159 -3.782
298 2HE LYS 36 HE1 LYS 36 94.811 -0.776 -4.683
299 1HZ LYS 36 HZ1 LYS 36 93.392 -2.770 -3.173
300 2HZ LYS 36 HZ2 LYS 36 92.729 -2.501 -4.706
301 3HZ LYS 36 HZ3 LYS 36 92.912 -1.212 -3.626
302 H ASP 37 HN ASP 37 97.626 -6.631 -2.349
303 HA ASP 37 HA ASP 37 96.262 -8.865 -3.603
304 1HB ASP 37 HB2 ASP 37 98.804 -8.808 -1.965
305 2HB ASP 37 HB1 ASP 37 98.206 -10.162 -2.920
306 H ASP 38 HN ASP 38 96.192 -7.204 -0.670
307 HA ASP 38 HA ASP 38 94.586 -9.276 0.555
308 1HB ASP 38 HB2 ASP 38 97.187 -9.487 1.115
309 2HB ASP 38 HB1 ASP 38 96.764 -8.255 2.304
310 HA PRO 39 HA PRO 39 92.788 -5.496 2.123
311 1HB PRO 39 HB2 PRO 39 90.595 -6.536 3.214
312 2HB PRO 39 HB1 PRO 39 90.833 -6.575 1.463
313 1HG PRO 39 HG2 PRO 39 91.207 -8.755 3.471
314 2HG PRO 39 HG1 PRO 39 90.510 -8.837 1.844
315 1HD PRO 39 HD2 PRO 39 93.121 -9.526 2.511
316 2HD PRO 39 HD1 PRO 39 92.548 -9.139 0.877
317 H SER 40 HN SER 40 93.517 -8.278 4.122
318 HA SER 40 HA SER 40 92.990 -7.063 6.642
319 1HB SER 40 HB2 SER 40 94.310 -9.551 5.698
320 2HB SER 40 HB1 SER 40 94.763 -8.974 7.301
321 HG SER 40 HG SER 40 92.390 -8.843 7.650
322 H GLN 41 HN GLN 41 95.400 -6.552 4.356
323 HA GLN 41 HA GLN 41 97.430 -5.757 6.283
324 1HB GLN 41 HB2 GLN 41 97.473 -5.703 3.261
325 2HB GLN 41 HB1 GLN 41 98.852 -5.436 4.325
326 1HG GLN 41 HG2 GLN 41 97.311 -7.991 4.462
327 2HG GLN 41 HG1 GLN 41 98.536 -7.745 3.218
328 1HE2 GLN 41 HE21 GLN 41 100.696 -7.096 4.002
329 2HE2 GLN 41 HE22 GLN 41 101.263 -7.781 5.484
330 H SER 42 HN SER 42 94.823 -4.347 4.630
331 HA SER 42 HA SER 42 95.542 -1.873 3.792
332 1HB SER 42 HB2 SER 42 93.165 -3.049 4.409
333 2HB SER 42 HB1 SER 42 93.237 -1.768 5.618
334 HG SER 42 HG SER 42 92.775 -0.409 4.099
335 H ALA 43 HN ALA 43 95.480 -2.916 7.146
336 HA ALA 43 HA ALA 43 95.874 -0.271 8.200
337 1HB ALA 43 HB1 ALA 43 96.251 -1.458 10.345
338 2HB ALA 43 HB2 ALA 43 96.126 -2.989 9.479
339 3HB ALA 43 HB3 ALA 43 94.738 -1.904 9.555
340 H ASN 44 HN ASN 44 97.914 -3.122 7.682
341 HA ASN 44 HA ASN 44 100.280 -2.042 8.761
342 1HB ASN 44 HB2 ASN 44 99.954 -4.449 8.373
343 2HB ASN 44 HB1 ASN 44 99.965 -4.170 6.634
344 1HD2 ASN 44 HD21 ASN 44 101.933 -3.613 9.527
345 2HD2 ASN 44 HD22 ASN 44 103.453 -3.895 8.756
346 H LEU 45 HN LEU 45 98.928 -1.961 5.500
347 HA LEU 45 HA LEU 45 101.251 -0.723 4.358
348 1HB LEU 45 HB2 LEU 45 98.481 -1.319 3.382
349 2HB LEU 45 HB1 LEU 45 99.558 -0.308 2.441
350 HG LEU 45 HG LEU 45 99.589 -2.620 1.653
351 1HD1 LEU 45 HD11 LEU 45 102.127 -3.027 2.107
352 2HD1 LEU 45 HD12 LEU 45 102.050 -1.427 2.840
353 3HD1 LEU 45 HD13 LEU 45 101.604 -1.643 1.148
354 1HD2 LEU 45 HD21 LEU 45 100.230 -4.444 2.968
355 2HD2 LEU 45 HD22 LEU 45 99.105 -3.538 3.979
356 3HD2 LEU 45 HD23 LEU 45 100.841 -3.411 4.261
357 H LEU 46 HN LEU 46 98.030 0.362 5.364
358 HA LEU 46 HA LEU 46 98.165 2.996 4.497
359 1HB LEU 46 HB2 LEU 46 96.132 1.928 5.365
360 2HB LEU 46 HB1 LEU 46 96.820 1.928 6.978
361 HG LEU 46 HG LEU 46 96.981 4.536 6.541
362 1HD1 LEU 46 HD11 LEU 46 94.591 3.778 4.874
363 2HD1 LEU 46 HD12 LEU 46 96.143 4.281 4.205
364 3HD1 LEU 46 HD13 LEU 46 95.208 5.398 5.199
365 1HD2 LEU 46 HD21 LEU 46 95.152 2.785 7.845
366 2HD2 LEU 46 HD22 LEU 46 94.250 4.139 7.167
367 3HD2 LEU 46 HD23 LEU 46 95.594 4.439 8.268
368 H ALA 47 HN ALA 47 98.929 1.800 7.789
369 HA ALA 47 HA ALA 47 99.884 4.240 8.771
370 1HB ALA 47 HB1 ALA 47 101.286 2.399 10.217
371 2HB ALA 47 HB2 ALA 47 99.930 1.441 9.623
372 3HB ALA 47 HB3 ALA 47 99.631 2.908 10.554
373 H GLU 48 HN GLU 48 101.683 1.479 7.422
374 HA GLU 48 HA GLU 48 104.248 2.492 7.704
375 1HB GLU 48 HB2 GLU 48 103.032 0.608 5.698
376 2HB GLU 48 HB1 GLU 48 104.736 1.037 5.634
377 1HG GLU 48 HG2 GLU 48 103.414 -0.131 8.066
378 2HG GLU 48 HG1 GLU 48 104.201 -1.100 6.821
379 H ALA 49 HN ALA 49 101.948 2.959 5.044
380 HA ALA 49 HA ALA 49 103.772 4.501 3.472
381 1HB ALA 49 HB1 ALA 49 101.835 4.980 2.062
382 2HB ALA 49 HB2 ALA 49 100.770 4.276 3.277
383 3HB ALA 49 HB3 ALA 49 101.942 3.262 2.437
384 H LYS 50 HN LYS 50 101.271 5.212 5.824
385 HA LYS 50 HA LYS 50 101.137 7.997 5.349
386 1HB LYS 50 HB2 LYS 50 100.243 6.155 7.515
387 2HB LYS 50 HB1 LYS 50 100.286 7.879 7.860
388 1HG LYS 50 HG2 LYS 50 98.891 6.797 5.438
389 2HG LYS 50 HG1 LYS 50 98.096 6.884 7.010
390 1HD LYS 50 HD2 LYS 50 97.514 8.959 6.397
391 2HD LYS 50 HD1 LYS 50 99.185 9.385 6.772
392 1HE LYS 50 HE2 LYS 50 98.340 10.146 4.523
393 2HE LYS 50 HE1 LYS 50 99.835 9.213 4.502
394 1HZ LYS 50 HZ1 LYS 50 97.818 8.692 2.895
395 2HZ LYS 50 HZ2 LYS 50 97.342 7.729 4.201
396 3HZ LYS 50 HZ3 LYS 50 98.846 7.477 3.470
397 H LYS 51 HN LYS 51 103.134 6.022 7.516
398 HA LYS 51 HA LYS 51 104.278 8.325 8.800
399 1HB LYS 51 HB2 LYS 51 105.789 6.679 9.870
400 2HB LYS 51 HB1 LYS 51 104.089 6.279 10.065
401 1HG LYS 51 HG2 LYS 51 104.322 4.329 9.024
402 2HG LYS 51 HG1 LYS 51 105.253 5.046 7.711
403 1HD LYS 51 HD2 LYS 51 106.661 3.460 8.797
404 2HD LYS 51 HD1 LYS 51 107.234 5.069 9.243
405 1HE LYS 51 HE2 LYS 51 107.244 3.803 11.234
406 2HE LYS 51 HE1 LYS 51 105.827 4.847 11.332
407 1HZ LYS 51 HZ1 LYS 51 105.239 2.648 12.027
408 2HZ LYS 51 HZ2 LYS 51 105.857 1.969 10.606
409 3HZ LYS 51 HZ3 LYS 51 104.485 2.955 10.544
410 H LEU 52 HN LEU 52 105.191 6.127 6.193
411 HA LEU 52 HA LEU 52 107.867 6.953 5.928
412 1HB LEU 52 HB2 LEU 52 106.363 5.046 4.750
413 2HB LEU 52 HB1 LEU 52 106.399 6.231 3.460
414 HG LEU 52 HG LEU 52 109.009 5.573 4.692
415 1HD1 LEU 52 HD11 LEU 52 109.024 3.590 2.963
416 2HD1 LEU 52 HD12 LEU 52 107.297 3.567 3.318
417 3HD1 LEU 52 HD13 LEU 52 108.467 3.355 4.620
418 1HD2 LEU 52 HD21 LEU 52 108.301 7.060 2.603
419 2HD2 LEU 52 HD22 LEU 52 108.468 5.509 1.780
420 3HD2 LEU 52 HD23 LEU 52 109.832 6.188 2.668
421 H ASN 53 HN ASN 53 104.907 8.076 4.313
422 HA ASN 53 HA ASN 53 106.114 10.018 2.690
423 1HB ASN 53 HB2 ASN 53 103.902 9.523 2.103
424 2HB ASN 53 HB1 ASN 53 103.337 9.626 3.763
425 1HD2 ASN 53 HD21 ASN 53 103.470 11.182 0.824
426 2HD2 ASN 53 HD22 ASN 53 103.041 12.773 1.341
427 H ASP 54 HN ASP 54 105.112 10.091 6.058
428 HA ASP 54 HA ASP 54 105.393 12.930 6.331
429 1HB ASP 54 HB2 ASP 54 104.033 11.128 7.756
430 2HB ASP 54 HB1 ASP 54 105.512 11.145 8.711
431 H ALA 55 HN ALA 55 107.494 10.171 6.649
432 HA ALA 55 HA ALA 55 109.509 11.584 8.155
433 1HB ALA 55 HB1 ALA 55 109.069 8.844 7.225
434 2HB ALA 55 HB2 ALA 55 109.823 9.436 8.705
435 3HB ALA 55 HB3 ALA 55 110.758 9.353 7.212
436 H GLN 56 HN GLN 56 108.845 10.913 4.786
437 HA GLN 56 HA GLN 56 111.390 12.222 4.076
438 1HB GLN 56 HB2 GLN 56 111.130 11.041 1.866
439 2HB GLN 56 HB1 GLN 56 111.441 9.999 3.247
440 1HG GLN 56 HG2 GLN 56 109.566 8.870 2.918
441 2HG GLN 56 HG1 GLN 56 108.612 10.351 2.857
442 1HE2 GLN 56 HE21 GLN 56 109.715 11.567 0.639
443 2HE2 GLN 56 HE22 GLN 56 109.344 10.633 -0.765
444 H ALA 57 HN ALA 57 108.223 12.959 4.343
445 HA ALA 57 HA ALA 57 107.484 14.056 1.888
446 1HB ALA 57 HB1 ALA 57 106.312 15.746 3.700
447 2HB ALA 57 HB2 ALA 57 106.597 14.292 4.657
448 3HB ALA 57 HB3 ALA 57 105.657 14.197 3.168
449 HA PRO 58 HA PRO 58 110.602 17.344 1.847
450 1HB PRO 58 HB2 PRO 58 110.104 18.148 -0.698
451 2HB PRO 58 HB1 PRO 58 111.099 16.736 -0.320
452 1HG PRO 58 HG2 PRO 58 108.222 16.860 -1.144
453 2HG PRO 58 HG1 PRO 58 109.495 15.751 -1.687
454 1HD PRO 58 HD2 PRO 58 107.651 15.051 0.160
455 2HD PRO 58 HD1 PRO 58 109.306 14.420 0.185
456 H LYS 59 HN LYS 59 110.306 19.405 2.508
457 HA LYS 59 HA LYS 59 108.164 21.037 1.536
458 1HB LYS 59 HB2 LYS 59 107.531 19.406 3.697
459 2HB LYS 59 HB1 LYS 59 107.887 20.962 4.435
460 1HG LYS 59 HG2 LYS 59 106.197 22.045 3.179
461 2HG LYS 59 HG1 LYS 59 105.985 20.641 2.131
462 1HD LYS 59 HD2 LYS 59 104.175 20.787 3.757
463 2HD LYS 59 HD1 LYS 59 105.156 19.347 4.041
464 1HE LYS 59 HE2 LYS 59 104.532 20.599 6.110
465 2HE LYS 59 HE1 LYS 59 106.267 20.380 5.884
466 1HZ LYS 59 HZ1 LYS 59 105.452 22.667 6.581
467 2HZ LYS 59 HZ2 LYS 59 104.894 22.841 4.994
468 3HZ LYS 59 HZ3 LYS 59 106.543 22.602 5.290
469 H ALA 60 HN ALA 60 110.797 21.496 1.335
470 HA ALA 60 HA ALA 60 111.504 23.370 3.480
471 1HB ALA 60 HB1 ALA 60 113.403 22.168 3.234
472 2HB ALA 60 HB2 ALA 60 113.704 23.336 1.946
473 3HB ALA 60 HB3 ALA 60 113.048 21.746 1.558
Start of MODEL 17
1 1H GLY -1 HT1 GLY -1 81.033 -14.023 9.247
2 2H GLY -1 HT2 GLY -1 80.672 -15.530 8.568
3 3H GLY -1 HT3 GLY -1 81.170 -14.253 7.576
4 1HA GLY -1 HA1 GLY -1 83.025 -14.898 9.691
5 2HA GLY -1 HA2 GLY -1 82.788 -16.187 8.520
6 H SER 0 HN SER 0 85.192 -15.528 8.347
7 HA SER 0 HA SER 0 85.563 -13.243 6.560
8 1HB SER 0 HB2 SER 0 87.662 -15.037 7.801
9 2HB SER 0 HB1 SER 0 87.940 -13.504 6.974
10 HG SER 0 HG SER 0 87.183 -12.426 8.671
11 H THR 1 HN THR 1 84.153 -15.017 5.221
12 HA THR 1 HA THR 1 85.516 -17.104 3.935
13 HB THR 1 HB THR 1 83.430 -15.625 2.418
14 HG1 THR 1 HG1 THR 1 83.014 -16.815 4.946
15 1HG2 THR 1 HG21 THR 1 83.138 -18.458 3.189
16 2HG2 THR 1 HG22 THR 1 84.447 -18.059 2.077
17 3HG2 THR 1 HG23 THR 1 82.782 -17.648 1.664
18 H ALA 2 HN ALA 2 84.578 -14.011 2.429
19 HA ALA 2 HA ALA 2 86.923 -14.245 0.676
20 1HB ALA 2 HB1 ALA 2 85.344 -13.876 -0.869
21 2HB ALA 2 HB2 ALA 2 85.437 -12.193 -0.352
22 3HB ALA 2 HB3 ALA 2 84.197 -13.254 0.317
23 H ASP 3 HN ASP 3 88.584 -13.318 1.753
24 HA ASP 3 HA ASP 3 88.580 -11.256 3.549
25 1HB ASP 3 HB2 ASP 3 90.939 -10.731 2.480
26 2HB ASP 3 HB1 ASP 3 90.661 -12.217 3.380
27 H ASN 4 HN ASN 4 89.629 -10.680 0.189
28 HA ASN 4 HA ASN 4 89.690 -8.033 0.030
29 1HB ASN 4 HB2 ASN 4 88.756 -8.261 -2.343
30 2HB ASN 4 HB1 ASN 4 90.178 -9.217 -1.934
31 1HD2 ASN 4 HD21 ASN 4 90.046 -11.412 -1.892
32 2HD2 ASN 4 HD22 ASN 4 88.654 -12.294 -2.408
33 H LYS 5 HN LYS 5 88.304 -6.981 1.424
34 HA LYS 5 HA LYS 5 85.628 -6.495 0.341
35 1HB LYS 5 HB2 LYS 5 85.248 -8.084 2.130
36 2HB LYS 5 HB1 LYS 5 86.253 -7.150 3.229
37 1HG LYS 5 HG2 LYS 5 84.206 -5.445 2.247
38 2HG LYS 5 HG1 LYS 5 83.462 -6.955 2.776
39 1HD LYS 5 HD2 LYS 5 83.858 -6.519 4.940
40 2HD LYS 5 HD1 LYS 5 85.498 -5.952 4.617
41 1HE LYS 5 HE2 LYS 5 83.433 -4.138 3.639
42 2HE LYS 5 HE1 LYS 5 83.370 -4.386 5.383
43 1HZ LYS 5 HZ1 LYS 5 85.058 -2.992 5.585
44 2HZ LYS 5 HZ2 LYS 5 85.159 -2.805 3.907
45 3HZ LYS 5 HZ3 LYS 5 86.044 -4.025 4.675
46 H PHE 6 HN PHE 6 87.448 -4.796 -0.297
47 HA PHE 6 HA PHE 6 88.152 -2.859 1.623
48 1HB PHE 6 HB2 PHE 6 88.176 -2.822 -1.388
49 2HB PHE 6 HB1 PHE 6 88.726 -1.461 -0.418
50 HD1 PHE 6 HD1 PHE 6 90.905 -1.358 0.298
51 HD2 PHE 6 HD2 PHE 6 89.289 -5.105 -0.903
52 HE1 PHE 6 HE1 PHE 6 93.124 -2.382 0.518
53 HE2 PHE 6 HE2 PHE 6 91.509 -6.139 -0.681
54 HZ PHE 6 HZ PHE 6 93.428 -4.780 0.037
55 H ASN 7 HN ASN 7 85.969 -2.557 -1.149
56 HA ASN 7 HA ASN 7 84.277 -1.159 -1.610
57 1HB ASN 7 HB2 ASN 7 82.654 -0.707 0.333
58 2HB ASN 7 HB1 ASN 7 82.901 -2.354 -0.178
59 1HD2 ASN 7 HD21 ASN 7 82.914 -0.228 2.412
60 2HD2 ASN 7 HD22 ASN 7 83.606 -1.276 3.596
61 H LYS 8 HN LYS 8 83.427 0.739 0.888
62 HA LYS 8 HA LYS 8 84.871 2.919 -0.219
63 1HB LYS 8 HB2 LYS 8 83.027 2.964 2.161
64 2HB LYS 8 HB1 LYS 8 83.489 4.324 1.148
65 1HG LYS 8 HG2 LYS 8 81.937 3.860 -0.390
66 2HG LYS 8 HG1 LYS 8 82.260 2.127 -0.334
67 1HD LYS 8 HD2 LYS 8 81.001 3.043 2.106
68 2HD LYS 8 HD1 LYS 8 80.034 3.461 0.691
69 1HE LYS 8 HE2 LYS 8 79.381 1.350 0.431
70 2HE LYS 8 HE1 LYS 8 81.045 0.770 0.478
71 1HZ LYS 8 HZ1 LYS 8 80.830 0.130 2.592
72 2HZ LYS 8 HZ2 LYS 8 79.162 0.261 2.348
73 3HZ LYS 8 HZ3 LYS 8 80.016 1.539 3.054
74 H GLU 9 HN GLU 9 84.601 1.683 3.102
75 HA GLU 9 HA GLU 9 86.348 3.374 4.357
76 1HB GLU 9 HB2 GLU 9 85.413 0.609 4.915
77 2HB GLU 9 HB1 GLU 9 86.700 1.276 5.911
78 1HG GLU 9 HG2 GLU 9 84.676 1.721 7.034
79 2HG GLU 9 HG1 GLU 9 85.210 3.249 6.336
80 H GLN 10 HN GLN 10 87.303 0.175 3.020
81 HA GLN 10 HA GLN 10 90.048 0.649 3.777
82 1HB GLN 10 HB2 GLN 10 88.900 -1.528 2.051
83 2HB GLN 10 HB1 GLN 10 90.534 -1.484 2.677
84 1HG GLN 10 HG2 GLN 10 88.190 -1.421 4.527
85 2HG GLN 10 HG1 GLN 10 88.771 -2.942 3.848
86 1HE2 GLN 10 HE21 GLN 10 90.978 -3.587 4.323
87 2HE2 GLN 10 HE22 GLN 10 91.741 -3.026 5.761
88 H GLN 11 HN GLN 11 88.178 0.970 0.818
89 HA GLN 11 HA GLN 11 90.319 0.995 -0.995
90 1HB GLN 11 HB2 GLN 11 87.982 0.753 -1.688
91 2HB GLN 11 HB1 GLN 11 87.663 2.417 -1.208
92 1HG GLN 11 HG2 GLN 11 89.393 3.128 -2.875
93 2HG GLN 11 HG1 GLN 11 89.446 1.456 -3.430
94 1HE2 GLN 11 HE21 GLN 11 88.767 3.637 -5.049
95 2HE2 GLN 11 HE22 GLN 11 87.117 3.463 -5.533
96 H ASN 12 HN ASN 12 89.172 3.374 1.243
97 HA ASN 12 HA ASN 12 90.078 5.715 0.078
98 1HB ASN 12 HB2 ASN 12 90.157 6.658 2.291
99 2HB ASN 12 HB1 ASN 12 88.802 5.537 2.231
100 1HD2 ASN 12 HD21 ASN 12 90.197 6.501 4.545
101 2HD2 ASN 12 HD22 ASN 12 90.861 5.121 5.345
102 H ALA 13 HN ALA 13 91.901 3.281 1.951
103 HA ALA 13 HA ALA 13 94.302 4.625 2.168
104 1HB ALA 13 HB1 ALA 13 93.906 2.519 3.283
105 2HB ALA 13 HB2 ALA 13 95.360 2.398 2.293
106 3HB ALA 13 HB3 ALA 13 93.851 1.675 1.735
107 H PHE 14 HN PHE 14 93.010 2.885 -0.620
108 HA PHE 14 HA PHE 14 95.291 2.700 -2.194
109 1HB PHE 14 HB2 PHE 14 93.279 1.639 -2.893
110 2HB PHE 14 HB1 PHE 14 92.393 3.145 -2.899
111 HD1 PHE 14 HD1 PHE 14 95.762 2.820 -4.340
112 HD2 PHE 14 HD2 PHE 14 91.580 2.937 -5.124
113 HE1 PHE 14 HE1 PHE 14 96.220 3.117 -6.741
114 HE2 PHE 14 HE2 PHE 14 92.033 3.231 -7.523
115 HZ PHE 14 HZ PHE 14 94.356 3.322 -8.334
116 H TRP 15 HN TRP 15 92.830 5.232 -2.265
117 HA TRP 15 HA TRP 15 94.114 6.955 -4.049
118 1HB TRP 15 HB2 TRP 15 92.003 7.246 -1.994
119 2HB TRP 15 HB1 TRP 15 92.793 8.723 -2.529
120 HD1 TRP 15 HD1 TRP 15 91.896 5.755 -4.834
121 HE1 TRP 15 HE1 TRP 15 90.245 6.613 -6.615
122 HE3 TRP 15 HE3 TRP 15 91.204 10.495 -3.067
123 HZ2 TRP 15 HZ2 TRP 15 88.833 8.993 -7.190
124 HZ3 TRP 15 HZ3 TRP 15 89.685 12.003 -4.287
125 HH2 TRP 15 HH2 TRP 15 88.526 11.265 -6.307
126 H GLU 16 HN GLU 16 94.016 7.229 -0.486
127 HA GLU 16 HA GLU 16 95.788 9.330 -0.193
128 1HB GLU 16 HB2 GLU 16 95.462 7.000 1.702
129 2HB GLU 16 HB1 GLU 16 96.039 8.610 2.109
130 1HG GLU 16 HG2 GLU 16 93.798 9.484 1.398
131 2HG GLU 16 HG1 GLU 16 93.265 7.808 1.278
132 H ILE 17 HN ILE 17 96.406 6.072 -0.976
133 HA ILE 17 HA ILE 17 99.227 6.106 -0.259
134 HB ILE 17 HB ILE 17 97.602 4.139 -1.889
135 1HG1 ILE 17 HG12 ILE 17 97.259 3.487 0.295
136 2HG1 ILE 17 HG11 ILE 17 98.752 2.626 -0.029
137 1HG2 ILE 17 HG21 ILE 17 99.701 2.789 -2.007
138 2HG2 ILE 17 HG22 ILE 17 100.578 4.215 -1.458
139 3HG2 ILE 17 HG23 ILE 17 99.709 4.251 -2.990
140 1HD1 ILE 17 HD11 ILE 17 98.321 5.092 1.601
141 2HD1 ILE 17 HD12 ILE 17 99.914 4.687 0.961
142 3HD1 ILE 17 HD13 ILE 17 99.093 3.573 2.054
143 H LEU 18 HN LEU 18 97.138 6.479 -3.031
144 HA LEU 18 HA LEU 18 99.278 7.186 -4.841
145 1HB LEU 18 HB2 LEU 18 96.496 6.465 -5.028
146 2HB LEU 18 HB1 LEU 18 96.726 8.017 -5.807
147 HG LEU 18 HG LEU 18 98.133 7.160 -7.450
148 1HD1 LEU 18 HD11 LEU 18 98.763 4.576 -7.122
149 2HD1 LEU 18 HD12 LEU 18 98.754 5.102 -5.439
150 3HD1 LEU 18 HD13 LEU 18 99.799 5.905 -6.607
151 1HD2 LEU 18 HD21 LEU 18 96.172 6.374 -8.244
152 2HD2 LEU 18 HD22 LEU 18 95.814 5.466 -6.776
153 3HD2 LEU 18 HD23 LEU 18 96.944 4.814 -7.962
154 H HIS 19 HN HIS 19 97.410 8.716 -2.466
155 HA HIS 19 HA HIS 19 97.665 11.339 -3.700
156 1HB HIS 19 HB2 HIS 19 95.789 10.100 -1.855
157 2HB HIS 19 HB1 HIS 19 96.321 11.683 -1.302
158 HD1 HIS 19 HD1 HIS 19 93.459 11.525 -1.998
159 HD2 HIS 19 HD2 HIS 19 96.359 12.315 -4.867
160 HE1 HIS 19 HE1 HIS 19 92.244 12.655 -3.886
161 HE2 HIS 19 HE2 HIS 19 94.002 13.039 -5.650
162 H LEU 20 HN LEU 20 99.598 9.495 -1.703
163 HA LEU 20 HA LEU 20 100.229 11.452 0.270
164 1HB LEU 20 HB2 LEU 20 101.593 8.960 -0.675
165 2HB LEU 20 HB1 LEU 20 102.389 10.038 0.453
166 HG LEU 20 HG LEU 20 99.998 8.295 0.874
167 1HD1 LEU 20 HD11 LEU 20 102.630 8.089 1.561
168 2HD1 LEU 20 HD12 LEU 20 101.295 7.226 2.322
169 3HD1 LEU 20 HD13 LEU 20 101.896 8.724 3.033
170 1HD2 LEU 20 HD21 LEU 20 98.993 10.181 1.725
171 2HD2 LEU 20 HD22 LEU 20 100.525 10.922 2.182
172 3HD2 LEU 20 HD23 LEU 20 99.865 9.598 3.141
173 HA PRO 21 HA PRO 21 102.563 13.817 -2.850
174 1HB PRO 21 HB2 PRO 21 102.060 16.130 -1.170
175 2HB PRO 21 HB1 PRO 21 101.470 15.809 -2.803
176 1HG PRO 21 HG2 PRO 21 99.842 15.868 -0.624
177 2HG PRO 21 HG1 PRO 21 99.515 14.869 -2.053
178 1HD PRO 21 HD2 PRO 21 100.757 14.083 0.564
179 2HD PRO 21 HD1 PRO 21 99.518 13.237 -0.378
180 H ASN 22 HN ASN 22 104.469 12.808 -2.222
181 HA ASN 22 HA ASN 22 106.629 13.943 -1.434
182 1HB ASN 22 HB2 ASN 22 104.941 14.114 1.012
183 2HB ASN 22 HB1 ASN 22 106.614 13.654 1.257
184 1HD2 ASN 22 HD21 ASN 22 107.989 15.228 1.546
185 2HD2 ASN 22 HD22 ASN 22 107.780 16.867 1.057
186 H LEU 23 HN LEU 23 104.746 11.267 -1.265
187 HA LEU 23 HA LEU 23 106.856 9.628 -0.051
188 1HB LEU 23 HB2 LEU 23 104.689 9.112 0.831
189 2HB LEU 23 HB1 LEU 23 103.990 9.027 -0.774
190 HG LEU 23 HG LEU 23 105.411 7.019 -1.224
191 1HD1 LEU 23 HD11 LEU 23 107.160 7.447 0.412
192 2HD1 LEU 23 HD12 LEU 23 106.415 5.868 0.682
193 3HD1 LEU 23 HD13 LEU 23 105.998 7.229 1.724
194 1HD2 LEU 23 HD21 LEU 23 103.839 6.363 1.205
195 2HD2 LEU 23 HD22 LEU 23 103.836 5.607 -0.388
196 3HD2 LEU 23 HD23 LEU 23 102.992 7.134 -0.136
197 H ASN 24 HN ASN 24 108.090 8.264 -1.309
198 HA ASN 24 HA ASN 24 108.414 8.678 -4.021
199 1HB ASN 24 HB2 ASN 24 109.274 6.690 -2.137
200 2HB ASN 24 HB1 ASN 24 108.726 5.861 -3.591
201 1HD2 ASN 24 HD21 ASN 24 110.753 5.206 -4.197
202 2HD2 ASN 24 HD22 ASN 24 111.962 6.298 -4.774
203 H GLU 25 HN GLU 25 107.066 8.204 -5.856
204 HA GLU 25 HA GLU 25 104.486 7.225 -5.244
205 1HB GLU 25 HB2 GLU 25 104.011 7.656 -7.553
206 2HB GLU 25 HB1 GLU 25 105.002 8.975 -6.919
207 1HG GLU 25 HG2 GLU 25 106.395 6.707 -8.250
208 2HG GLU 25 HG1 GLU 25 105.483 7.819 -9.269
209 H GLU 26 HN GLU 26 107.454 5.852 -6.263
210 HA GLU 26 HA GLU 26 106.445 3.371 -7.272
211 1HB GLU 26 HB2 GLU 26 109.013 4.600 -6.889
212 2HB GLU 26 HB1 GLU 26 109.030 3.006 -6.148
213 1HG GLU 26 HG2 GLU 26 108.659 1.922 -8.153
214 2HG GLU 26 HG1 GLU 26 107.976 3.356 -8.917
215 H GLN 27 HN GLN 27 106.997 4.852 -4.313
216 HA GLN 27 HA GLN 27 106.916 2.477 -2.625
217 1HB GLN 27 HB2 GLN 27 107.452 5.319 -2.209
218 2HB GLN 27 HB1 GLN 27 106.354 4.671 -1.003
219 1HG GLN 27 HG2 GLN 27 109.063 3.542 -1.674
220 2HG GLN 27 HG1 GLN 27 108.696 4.575 -0.293
221 1HE2 GLN 27 HE21 GLN 27 108.329 1.418 -1.696
222 2HE2 GLN 27 HE22 GLN 27 107.780 0.622 -0.264
223 H ARG 28 HN ARG 28 104.893 5.103 -3.766
224 HA ARG 28 HA ARG 28 102.605 4.536 -2.230
225 1HB ARG 28 HB2 ARG 28 102.854 5.919 -4.911
226 2HB ARG 28 HB1 ARG 28 101.396 5.903 -3.929
227 1HG ARG 28 HG2 ARG 28 102.978 6.881 -2.092
228 2HG ARG 28 HG1 ARG 28 103.974 7.329 -3.471
229 1HD ARG 28 HD2 ARG 28 101.355 8.101 -4.132
230 2HD ARG 28 HD1 ARG 28 101.577 8.565 -2.464
231 HE ARG 28 HE ARG 28 103.203 10.086 -3.102
232 1HH1 ARG 28 HH11 ARG 28 102.153 8.194 -5.842
233 2HH1 ARG 28 HH12 ARG 28 102.879 9.251 -7.004
234 1HH2 ARG 28 HH21 ARG 28 104.154 11.474 -4.631
235 2HH2 ARG 28 HH22 ARG 28 104.017 11.110 -6.319
236 H ASN 29 HN ASN 29 103.211 3.749 -5.726
237 HA ASN 29 HA ASN 29 100.945 2.159 -5.980
238 1HB ASN 29 HB2 ASN 29 102.083 1.151 -7.940
239 2HB ASN 29 HB1 ASN 29 102.142 2.910 -7.940
240 1HD2 ASN 29 HD21 ASN 29 103.996 0.022 -7.162
241 2HD2 ASN 29 HD22 ASN 29 105.547 0.726 -7.451
242 H GLY 30 HN GLY 30 104.290 1.248 -5.073
243 1HA GLY 30 HA2 GLY 30 103.868 -1.518 -4.902
244 2HA GLY 30 HA1 GLY 30 105.041 -0.619 -3.947
245 H PHE 31 HN PHE 31 103.047 1.073 -2.713
246 HA PHE 31 HA PHE 31 102.411 -0.541 -0.463
247 1HB PHE 31 HB2 PHE 31 102.021 2.291 -1.260
248 2HB PHE 31 HB1 PHE 31 100.900 1.661 -0.058
249 HD1 PHE 31 HD1 PHE 31 103.532 3.659 -0.172
250 HD2 PHE 31 HD2 PHE 31 102.511 -0.095 1.545
251 HE1 PHE 31 HE1 PHE 31 105.220 4.005 1.582
252 HE2 PHE 31 HE2 PHE 31 104.196 0.240 3.301
253 HZ PHE 31 HZ PHE 31 105.555 2.295 3.323
254 H ILE 32 HN ILE 32 100.600 0.653 -3.233
255 HA ILE 32 HA ILE 32 98.034 -0.138 -2.316
256 HB ILE 32 HB ILE 32 98.620 -0.100 -5.242
257 1HG1 ILE 32 HG12 ILE 32 98.486 2.364 -3.495
258 2HG1 ILE 32 HG11 ILE 32 99.882 1.811 -4.412
259 1HG2 ILE 32 HG21 ILE 32 96.420 0.901 -5.355
260 2HG2 ILE 32 HG22 ILE 32 96.352 1.006 -3.596
261 3HG2 ILE 32 HG23 ILE 32 96.368 -0.571 -4.386
262 1HD1 ILE 32 HD11 ILE 32 97.730 3.478 -5.241
263 2HD1 ILE 32 HD12 ILE 32 97.774 2.026 -6.242
264 3HD1 ILE 32 HD13 ILE 32 99.206 3.043 -6.102
265 H GLN 33 HN GLN 33 100.375 -1.677 -4.499
266 HA GLN 33 HA GLN 33 98.840 -3.928 -5.137
267 1HB GLN 33 HB2 GLN 33 101.847 -3.773 -4.857
268 2HB GLN 33 HB1 GLN 33 100.957 -5.021 -5.718
269 1HG GLN 33 HG2 GLN 33 100.141 -3.359 -7.303
270 2HG GLN 33 HG1 GLN 33 101.014 -2.097 -6.433
271 1HE2 GLN 33 HE21 GLN 33 103.087 -1.731 -6.921
272 2HE2 GLN 33 HE22 GLN 33 104.033 -2.684 -8.007
273 H SER 34 HN SER 34 101.261 -3.511 -2.545
274 HA SER 34 HA SER 34 100.966 -6.075 -1.439
275 1HB SER 34 HB2 SER 34 102.848 -4.672 -0.820
276 2HB SER 34 HB1 SER 34 101.766 -3.474 -0.109
277 HG SER 34 HG SER 34 102.790 -5.004 1.384
278 H LEU 35 HN LEU 35 99.197 -3.084 -0.956
279 HA LEU 35 HA LEU 35 97.548 -4.100 1.186
280 1HB LEU 35 HB2 LEU 35 97.780 -1.788 1.271
281 2HB LEU 35 HB1 LEU 35 97.601 -1.601 -0.464
282 HG LEU 35 HG LEU 35 95.213 -2.052 -0.301
283 1HD1 LEU 35 HD11 LEU 35 94.510 -3.326 1.378
284 2HD1 LEU 35 HD12 LEU 35 94.614 -1.893 2.397
285 3HD1 LEU 35 HD13 LEU 35 95.968 -3.022 2.319
286 1HD2 LEU 35 HD21 LEU 35 96.550 0.177 0.977
287 2HD2 LEU 35 HD22 LEU 35 94.944 -0.100 1.651
288 3HD2 LEU 35 HD23 LEU 35 95.139 0.163 -0.084
289 H LYS 36 HN LYS 36 97.349 -3.822 -2.312
290 HA LYS 36 HA LYS 36 94.573 -4.353 -2.503
291 1HB LYS 36 HB2 LYS 36 96.468 -3.400 -4.234
292 2HB LYS 36 HB1 LYS 36 96.155 -5.005 -4.874
293 1HG LYS 36 HG2 LYS 36 93.630 -4.101 -4.413
294 2HG LYS 36 HG1 LYS 36 94.466 -2.615 -4.867
295 1HD LYS 36 HD2 LYS 36 94.844 -5.083 -6.509
296 2HD LYS 36 HD1 LYS 36 93.373 -4.128 -6.699
297 1HE LYS 36 HE2 LYS 36 96.210 -3.159 -7.033
298 2HE LYS 36 HE1 LYS 36 95.029 -3.422 -8.316
299 1HZ LYS 36 HZ1 LYS 36 95.334 -1.183 -6.532
300 2HZ LYS 36 HZ2 LYS 36 93.738 -1.728 -6.657
301 3HZ LYS 36 HZ3 LYS 36 94.583 -1.265 -8.047
302 H ASP 37 HN ASP 37 97.307 -6.503 -2.102
303 HA ASP 37 HA ASP 37 95.809 -8.721 -3.230
304 1HB ASP 37 HB2 ASP 37 97.767 -10.048 -2.784
305 2HB ASP 37 HB1 ASP 37 98.289 -8.539 -3.525
306 H ASP 38 HN ASP 38 95.900 -7.015 -0.369
307 HA ASP 38 HA ASP 38 94.367 -9.016 1.018
308 1HB ASP 38 HB2 ASP 38 97.024 -9.250 1.407
309 2HB ASP 38 HB1 ASP 38 96.647 -8.056 2.648
310 HA PRO 39 HA PRO 39 92.787 -4.998 2.315
311 1HB PRO 39 HB2 PRO 39 90.548 -5.893 3.518
312 2HB PRO 39 HB1 PRO 39 90.703 -5.822 1.761
313 1HG PRO 39 HG2 PRO 39 91.005 -8.167 3.595
314 2HG PRO 39 HG1 PRO 39 90.182 -8.072 2.028
315 1HD PRO 39 HD2 PRO 39 92.688 -9.097 2.342
316 2HD PRO 39 HD1 PRO 39 92.134 -8.317 0.848
317 H SER 40 HN SER 40 93.350 -7.789 4.329
318 HA SER 40 HA SER 40 92.920 -6.561 6.849
319 1HB SER 40 HB2 SER 40 92.960 -9.019 6.515
320 2HB SER 40 HB1 SER 40 94.690 -8.929 6.188
321 HG SER 40 HG SER 40 94.948 -9.037 8.259
322 H GLN 41 HN GLN 41 95.645 -6.781 4.683
323 HA GLN 41 HA GLN 41 97.591 -5.786 6.522
324 1HB GLN 41 HB2 GLN 41 97.543 -6.030 3.514
325 2HB GLN 41 HB1 GLN 41 98.934 -5.432 4.410
326 1HG GLN 41 HG2 GLN 41 98.647 -7.685 5.726
327 2HG GLN 41 HG1 GLN 41 97.818 -8.179 4.250
328 1HE2 GLN 41 HE21 GLN 41 100.840 -7.272 5.677
329 2HE2 GLN 41 HE22 GLN 41 101.844 -7.736 4.350
330 H SER 42 HN SER 42 95.008 -4.334 4.983
331 HA SER 42 HA SER 42 95.783 -1.924 3.994
332 1HB SER 42 HB2 SER 42 93.638 -1.020 4.707
333 2HB SER 42 HB1 SER 42 93.434 -2.683 4.162
334 HG SER 42 HG SER 42 93.642 -3.237 6.469
335 H ALA 43 HN ALA 43 95.986 -2.903 7.340
336 HA ALA 43 HA ALA 43 96.387 -0.233 8.331
337 1HB ALA 43 HB1 ALA 43 96.177 -2.919 9.456
338 2HB ALA 43 HB2 ALA 43 95.678 -1.366 10.125
339 3HB ALA 43 HB3 ALA 43 97.353 -1.896 10.281
340 H ASN 44 HN ASN 44 98.449 -3.042 7.679
341 HA ASN 44 HA ASN 44 100.865 -1.847 8.516
342 1HB ASN 44 HB2 ASN 44 100.599 -4.276 8.273
343 2HB ASN 44 HB1 ASN 44 100.434 -4.089 6.530
344 1HD2 ASN 44 HD21 ASN 44 102.226 -3.803 5.288
345 2HD2 ASN 44 HD22 ASN 44 103.838 -3.891 5.901
346 H LEU 45 HN LEU 45 99.185 -1.884 5.426
347 HA LEU 45 HA LEU 45 101.369 -0.693 3.998
348 1HB LEU 45 HB2 LEU 45 98.507 -1.277 3.317
349 2HB LEU 45 HB1 LEU 45 99.530 -0.359 2.235
350 HG LEU 45 HG LEU 45 99.484 -2.653 1.514
351 1HD1 LEU 45 HD11 LEU 45 101.975 -3.240 1.936
352 2HD1 LEU 45 HD12 LEU 45 102.036 -1.656 2.698
353 3HD1 LEU 45 HD13 LEU 45 101.564 -1.801 1.008
354 1HD2 LEU 45 HD21 LEU 45 100.494 -3.356 4.262
355 2HD2 LEU 45 HD22 LEU 45 100.234 -4.475 2.924
356 3HD2 LEU 45 HD23 LEU 45 98.863 -3.646 3.660
357 H LEU 46 HN LEU 46 98.219 0.483 5.185
358 HA LEU 46 HA LEU 46 98.603 3.136 4.265
359 1HB LEU 46 HB2 LEU 46 96.519 1.717 5.353
360 2HB LEU 46 HB1 LEU 46 96.904 2.848 6.633
361 HG LEU 46 HG LEU 46 96.134 3.526 3.795
362 1HD1 LEU 46 HD11 LEU 46 94.736 4.011 6.422
363 2HD1 LEU 46 HD12 LEU 46 94.278 2.811 5.214
364 3HD1 LEU 46 HD13 LEU 46 94.172 4.529 4.833
365 1HD2 LEU 46 HD21 LEU 46 96.576 5.508 6.000
366 2HD2 LEU 46 HD22 LEU 46 96.454 5.786 4.263
367 3HD2 LEU 46 HD23 LEU 46 97.889 5.013 4.932
368 H ALA 47 HN ALA 47 99.558 1.464 7.192
369 HA ALA 47 HA ALA 47 100.201 3.869 8.632
370 1HB ALA 47 HB1 ALA 47 99.558 1.651 9.675
371 2HB ALA 47 HB2 ALA 47 100.970 2.453 10.363
372 3HB ALA 47 HB3 ALA 47 101.178 1.093 9.259
373 H GLU 48 HN GLU 48 102.016 1.327 6.962
374 HA GLU 48 HA GLU 48 104.589 2.328 7.425
375 1HB GLU 48 HB2 GLU 48 103.377 0.529 5.364
376 2HB GLU 48 HB1 GLU 48 105.034 1.080 5.155
377 1HG GLU 48 HG2 GLU 48 104.544 0.087 7.832
378 2HG GLU 48 HG1 GLU 48 104.190 -1.119 6.595
379 H ALA 49 HN ALA 49 102.270 2.979 4.830
380 HA ALA 49 HA ALA 49 104.059 4.700 3.397
381 1HB ALA 49 HB1 ALA 49 102.418 4.860 1.804
382 2HB ALA 49 HB2 ALA 49 101.110 4.784 2.984
383 3HB ALA 49 HB3 ALA 49 101.995 3.321 2.554
384 H LYS 50 HN LYS 50 101.583 5.114 5.852
385 HA LYS 50 HA LYS 50 101.279 7.920 5.508
386 1HB LYS 50 HB2 LYS 50 99.586 6.553 6.637
387 2HB LYS 50 HB1 LYS 50 100.721 6.206 7.935
388 1HG LYS 50 HG2 LYS 50 99.525 7.894 8.885
389 2HG LYS 50 HG1 LYS 50 100.805 8.830 8.110
390 1HD LYS 50 HD2 LYS 50 99.017 10.004 7.337
391 2HD LYS 50 HD1 LYS 50 99.072 8.761 6.085
392 1HE LYS 50 HE2 LYS 50 97.447 7.439 7.466
393 2HE LYS 50 HE1 LYS 50 97.288 8.849 8.511
394 1HZ LYS 50 HZ1 LYS 50 96.001 9.891 7.029
395 2HZ LYS 50 HZ2 LYS 50 95.771 8.362 6.344
396 3HZ LYS 50 HZ3 LYS 50 96.935 9.408 5.702
397 H LYS 51 HN LYS 51 103.402 5.920 7.517
398 HA LYS 51 HA LYS 51 104.486 8.197 8.900
399 1HB LYS 51 HB2 LYS 51 105.993 6.613 9.954
400 2HB LYS 51 HB1 LYS 51 104.349 5.994 9.988
401 1HG LYS 51 HG2 LYS 51 104.860 4.539 8.089
402 2HG LYS 51 HG1 LYS 51 106.514 5.154 8.072
403 1HD LYS 51 HD2 LYS 51 107.028 3.505 9.485
404 2HD LYS 51 HD1 LYS 51 106.099 4.376 10.707
405 1HE LYS 51 HE2 LYS 51 104.169 3.041 9.250
406 2HE LYS 51 HE1 LYS 51 105.499 1.887 9.327
407 1HZ LYS 51 HZ1 LYS 51 105.447 1.889 11.655
408 2HZ LYS 51 HZ2 LYS 51 103.822 1.816 11.193
409 3HZ LYS 51 HZ3 LYS 51 104.481 3.276 11.733
410 H LEU 52 HN LEU 52 105.596 5.993 6.337
411 HA LEU 52 HA LEU 52 108.166 7.005 6.004
412 1HB LEU 52 HB2 LEU 52 106.632 5.106 4.748
413 2HB LEU 52 HB1 LEU 52 106.827 6.310 3.491
414 HG LEU 52 HG LEU 52 109.086 4.972 4.984
415 1HD1 LEU 52 HD11 LEU 52 107.926 3.418 3.512
416 2HD1 LEU 52 HD12 LEU 52 109.517 3.824 2.869
417 3HD1 LEU 52 HD13 LEU 52 108.072 4.559 2.175
418 1HD2 LEU 52 HD21 LEU 52 110.556 6.278 3.862
419 2HD2 LEU 52 HD22 LEU 52 109.203 7.409 3.887
420 3HD2 LEU 52 HD23 LEU 52 109.511 6.434 2.450
421 H ASN 53 HN ASN 53 105.171 7.982 4.334
422 HA ASN 53 HA ASN 53 106.239 9.995 2.741
423 1HB ASN 53 HB2 ASN 53 103.904 9.119 2.623
424 2HB ASN 53 HB1 ASN 53 103.523 10.042 4.072
425 1HD2 ASN 53 HD21 ASN 53 102.166 11.543 3.334
426 2HD2 ASN 53 HD22 ASN 53 102.520 12.663 2.069
427 H ASP 54 HN ASP 54 105.487 9.949 6.170
428 HA ASP 54 HA ASP 54 105.768 12.785 6.532
429 1HB ASP 54 HB2 ASP 54 105.462 10.429 8.393
430 2HB ASP 54 HB1 ASP 54 105.854 12.034 9.003
431 H ALA 55 HN ALA 55 107.713 9.882 6.588
432 HA ALA 55 HA ALA 55 110.004 10.866 7.919
433 1HB ALA 55 HB1 ALA 55 110.640 9.193 5.620
434 2HB ALA 55 HB2 ALA 55 109.333 8.505 6.583
435 3HB ALA 55 HB3 ALA 55 110.884 8.871 7.337
436 H GLN 56 HN GLN 56 108.506 11.240 4.863
437 HA GLN 56 HA GLN 56 110.583 12.965 3.791
438 1HB GLN 56 HB2 GLN 56 107.936 12.471 2.450
439 2HB GLN 56 HB1 GLN 56 109.520 12.705 1.721
440 1HG GLN 56 HG2 GLN 56 109.942 10.381 3.005
441 2HG GLN 56 HG1 GLN 56 108.215 10.243 2.698
442 1HE2 GLN 56 HE21 GLN 56 110.799 11.684 0.739
443 2HE2 GLN 56 HE22 GLN 56 110.553 10.666 -0.634
444 H ALA 57 HN ALA 57 107.428 14.034 2.891
445 HA ALA 57 HA ALA 57 106.674 15.409 5.221
446 1HB ALA 57 HB1 ALA 57 108.797 16.662 3.622
447 2HB ALA 57 HB2 ALA 57 108.405 16.833 5.333
448 3HB ALA 57 HB3 ALA 57 107.479 17.721 4.123
449 HA PRO 58 HA PRO 58 103.459 15.102 1.742
450 1HB PRO 58 HB2 PRO 58 101.732 15.655 3.995
451 2HB PRO 58 HB1 PRO 58 101.815 14.200 3.003
452 1HG PRO 58 HG2 PRO 58 103.083 14.774 5.604
453 2HG PRO 58 HG1 PRO 58 102.702 13.211 4.858
454 1HD PRO 58 HD2 PRO 58 105.234 14.057 5.060
455 2HD PRO 58 HD1 PRO 58 104.672 13.188 3.620
456 H LYS 59 HN LYS 59 102.910 16.852 0.600
457 HA LYS 59 HA LYS 59 102.546 19.016 0.003
458 1HB LYS 59 HB2 LYS 59 101.018 18.548 2.450
459 2HB LYS 59 HB1 LYS 59 101.391 20.247 2.192
460 1HG LYS 59 HG2 LYS 59 100.412 20.089 -0.065
461 2HG LYS 59 HG1 LYS 59 99.974 18.413 0.270
462 1HD LYS 59 HD2 LYS 59 99.088 20.660 2.054
463 2HD LYS 59 HD1 LYS 59 98.179 20.213 0.609
464 1HE LYS 59 HE2 LYS 59 98.930 18.001 2.413
465 2HE LYS 59 HE1 LYS 59 97.742 19.143 3.040
466 1HZ LYS 59 HZ1 LYS 59 96.465 17.559 1.966
467 2HZ LYS 59 HZ2 LYS 59 97.545 17.390 0.676
468 3HZ LYS 59 HZ3 LYS 59 96.586 18.777 0.798
469 H ALA 60 HN ALA 60 104.936 19.224 0.102
470 HA ALA 60 HA ALA 60 105.866 20.902 2.323
471 1HB ALA 60 HB1 ALA 60 107.174 18.876 1.723
472 2HB ALA 60 HB2 ALA 60 108.103 20.372 1.632
473 3HB ALA 60 HB3 ALA 60 107.513 19.608 0.156
Start of MODEL 18
1 1H GLY -1 HT1 GLY -1 84.886 -12.374 -5.805
2 2H GLY -1 HT2 GLY -1 86.460 -12.748 -5.311
3 3H GLY -1 HT3 GLY -1 85.396 -13.987 -5.750
4 1HA GLY -1 HA1 GLY -1 85.417 -13.362 -8.016
5 2HA GLY -1 HA2 GLY -1 86.264 -11.871 -7.631
6 H SER 0 HN SER 0 86.661 -15.387 -7.193
7 HA SER 0 HA SER 0 88.462 -16.752 -7.439
8 1HB SER 0 HB2 SER 0 88.436 -15.866 -9.746
9 2HB SER 0 HB1 SER 0 89.493 -14.547 -9.241
10 HG SER 0 HG SER 0 91.133 -15.965 -8.939
11 H THR 1 HN THR 1 88.439 -14.436 -5.445
12 HA THR 1 HA THR 1 91.009 -14.971 -4.328
13 HB THR 1 HB THR 1 90.535 -12.079 -5.017
14 HG1 THR 1 HG1 THR 1 92.049 -13.951 -6.513
15 1HG2 THR 1 HG21 THR 1 92.178 -12.233 -3.369
16 2HG2 THR 1 HG22 THR 1 93.071 -12.082 -4.882
17 3HG2 THR 1 HG23 THR 1 92.910 -13.658 -4.107
18 H ALA 2 HN ALA 2 91.328 -13.671 -2.269
19 HA ALA 2 HA ALA 2 89.320 -14.040 -0.478
20 1HB ALA 2 HB1 ALA 2 91.241 -13.535 0.608
21 2HB ALA 2 HB2 ALA 2 90.480 -11.946 0.700
22 3HB ALA 2 HB3 ALA 2 91.689 -12.274 -0.541
23 H ASP 3 HN ASP 3 89.964 -10.998 -2.202
24 HA ASP 3 HA ASP 3 88.741 -9.073 -2.380
25 1HB ASP 3 HB2 ASP 3 86.668 -9.374 -3.501
26 2HB ASP 3 HB1 ASP 3 87.683 -10.730 -3.977
27 H ASN 4 HN ASN 4 89.118 -9.575 0.266
28 HA ASN 4 HA ASN 4 87.171 -9.922 2.065
29 1HB ASN 4 HB2 ASN 4 89.588 -9.013 2.363
30 2HB ASN 4 HB1 ASN 4 88.817 -7.430 2.341
31 1HD2 ASN 4 HD21 ASN 4 88.899 -6.773 4.382
32 2HD2 ASN 4 HD22 ASN 4 88.307 -7.656 5.744
33 H LYS 5 HN LYS 5 87.405 -7.159 -0.073
34 HA LYS 5 HA LYS 5 85.353 -6.164 -0.865
35 1HB LYS 5 HB2 LYS 5 83.529 -5.671 0.497
36 2HB LYS 5 HB1 LYS 5 84.068 -7.231 1.093
37 1HG LYS 5 HG2 LYS 5 85.327 -5.983 2.889
38 2HG LYS 5 HG1 LYS 5 84.494 -4.528 2.344
39 1HD LYS 5 HD2 LYS 5 82.738 -6.828 2.828
40 2HD LYS 5 HD1 LYS 5 83.571 -6.227 4.263
41 1HE LYS 5 HE2 LYS 5 81.750 -4.713 2.405
42 2HE LYS 5 HE1 LYS 5 81.501 -5.065 4.114
43 1HZ LYS 5 HZ1 LYS 5 82.249 -2.946 4.274
44 2HZ LYS 5 HZ2 LYS 5 83.174 -3.026 2.860
45 3HZ LYS 5 HZ3 LYS 5 83.752 -3.723 4.289
46 H PHE 6 HN PHE 6 87.192 -5.238 1.992
47 HA PHE 6 HA PHE 6 88.222 -3.260 2.567
48 1HB PHE 6 HB2 PHE 6 87.869 -2.866 -0.403
49 2HB PHE 6 HB1 PHE 6 88.499 -1.571 0.604
50 HD1 PHE 6 HD1 PHE 6 89.290 -4.546 -1.202
51 HD2 PHE 6 HD2 PHE 6 90.558 -2.057 2.002
52 HE1 PHE 6 HE1 PHE 6 91.552 -5.511 -1.350
53 HE2 PHE 6 HE2 PHE 6 92.815 -3.015 1.864
54 HZ PHE 6 HZ PHE 6 93.320 -4.744 0.190
55 H ASN 7 HN ASN 7 87.464 -1.445 3.586
56 HA ASN 7 HA ASN 7 84.799 -0.505 2.753
57 1HB ASN 7 HB2 ASN 7 84.933 0.125 5.434
58 2HB ASN 7 HB1 ASN 7 84.074 -1.247 4.745
59 1HD2 ASN 7 HD21 ASN 7 84.339 -2.643 6.408
60 2HD2 ASN 7 HD22 ASN 7 85.870 -3.260 6.919
61 H LYS 8 HN LYS 8 84.398 1.631 4.186
62 HA LYS 8 HA LYS 8 85.813 3.657 2.937
63 1HB LYS 8 HB2 LYS 8 83.606 3.759 4.291
64 2HB LYS 8 HB1 LYS 8 84.645 4.047 5.679
65 1HG LYS 8 HG2 LYS 8 85.596 5.850 3.852
66 2HG LYS 8 HG1 LYS 8 83.864 5.836 3.515
67 1HD LYS 8 HD2 LYS 8 83.841 5.925 6.217
68 2HD LYS 8 HD1 LYS 8 85.330 6.809 5.879
69 1HE LYS 8 HE2 LYS 8 82.808 7.455 4.402
70 2HE LYS 8 HE1 LYS 8 83.086 8.101 6.019
71 1HZ LYS 8 HZ1 LYS 8 84.486 8.692 3.515
72 2HZ LYS 8 HZ2 LYS 8 85.365 8.774 4.957
73 3HZ LYS 8 HZ3 LYS 8 83.993 9.741 4.747
74 H GLU 9 HN GLU 9 86.558 1.891 5.841
75 HA GLU 9 HA GLU 9 88.629 3.687 6.697
76 1HB GLU 9 HB2 GLU 9 89.213 1.654 8.203
77 2HB GLU 9 HB1 GLU 9 87.728 2.545 8.495
78 1HG GLU 9 HG2 GLU 9 86.434 0.791 8.013
79 2HG GLU 9 HG1 GLU 9 87.428 0.305 6.642
80 H GLN 10 HN GLN 10 88.583 0.466 5.148
81 HA GLN 10 HA GLN 10 91.447 0.406 4.924
82 1HB GLN 10 HB2 GLN 10 89.485 -1.393 3.510
83 2HB GLN 10 HB1 GLN 10 91.170 -1.723 3.882
84 1HG GLN 10 HG2 GLN 10 89.398 -1.162 6.174
85 2HG GLN 10 HG1 GLN 10 89.129 -2.676 5.312
86 1HE2 GLN 10 HE21 GLN 10 91.314 -3.844 4.799
87 2HE2 GLN 10 HE22 GLN 10 92.392 -3.974 6.136
88 H GLN 11 HN GLN 11 88.788 0.680 2.563
89 HA GLN 11 HA GLN 11 90.332 0.832 0.268
90 1HB GLN 11 HB2 GLN 11 88.391 1.208 -0.820
91 2HB GLN 11 HB1 GLN 11 87.693 0.792 0.737
92 1HG GLN 11 HG2 GLN 11 87.519 3.176 1.285
93 2HG GLN 11 HG1 GLN 11 88.199 3.578 -0.292
94 1HE2 GLN 11 HE21 GLN 11 85.759 1.220 0.745
95 2HE2 GLN 11 HE22 GLN 11 84.512 1.790 -0.307
96 H ASN 12 HN ASN 12 89.563 3.416 2.546
97 HA ASN 12 HA ASN 12 90.231 5.624 1.005
98 1HB ASN 12 HB2 ASN 12 90.102 6.811 2.937
99 2HB ASN 12 HB1 ASN 12 89.477 5.300 3.580
100 1HD2 ASN 12 HD21 ASN 12 91.876 7.658 3.812
101 2HD2 ASN 12 HD22 ASN 12 92.882 6.877 4.979
102 H ALA 13 HN ALA 13 92.259 3.186 2.377
103 HA ALA 13 HA ALA 13 94.714 4.453 2.499
104 1HB ALA 13 HB1 ALA 13 94.563 2.280 3.386
105 2HB ALA 13 HB2 ALA 13 95.650 2.144 2.005
106 3HB ALA 13 HB3 ALA 13 93.976 1.610 1.864
107 H PHE 14 HN PHE 14 93.095 2.979 -0.320
108 HA PHE 14 HA PHE 14 95.131 3.043 -2.145
109 1HB PHE 14 HB2 PHE 14 92.871 2.101 -2.491
110 2HB PHE 14 HB1 PHE 14 92.226 3.723 -2.637
111 HD1 PHE 14 HD1 PHE 14 95.415 2.476 -4.060
112 HD2 PHE 14 HD2 PHE 14 91.407 3.690 -4.827
113 HE1 PHE 14 HE1 PHE 14 95.873 2.454 -6.478
114 HE2 PHE 14 HE2 PHE 14 91.860 3.669 -7.245
115 HZ PHE 14 HZ PHE 14 94.094 3.050 -8.074
116 H TRP 15 HN TRP 15 92.720 5.633 -1.678
117 HA TRP 15 HA TRP 15 93.951 7.423 -3.483
118 1HB TRP 15 HB2 TRP 15 91.832 7.604 -1.432
119 2HB TRP 15 HB1 TRP 15 92.626 9.116 -1.856
120 HD1 TRP 15 HD1 TRP 15 91.030 6.160 -3.815
121 HE1 TRP 15 HE1 TRP 15 89.727 7.152 -5.801
122 HE3 TRP 15 HE3 TRP 15 92.090 11.107 -3.089
123 HZ2 TRP 15 HZ2 TRP 15 89.216 9.696 -6.911
124 HZ3 TRP 15 HZ3 TRP 15 91.155 12.756 -4.658
125 HH2 TRP 15 HH2 TRP 15 89.748 12.064 -6.529
126 H GLU 16 HN GLU 16 93.954 7.501 0.090
127 HA GLU 16 HA GLU 16 95.754 9.608 0.403
128 1HB GLU 16 HB2 GLU 16 95.046 7.267 2.152
129 2HB GLU 16 HB1 GLU 16 96.240 8.455 2.659
130 1HG GLU 16 HG2 GLU 16 93.985 9.888 1.762
131 2HG GLU 16 HG1 GLU 16 93.396 8.587 2.795
132 H ILE 17 HN ILE 17 96.286 6.390 -0.467
133 HA ILE 17 HA ILE 17 99.180 6.351 0.090
134 HB ILE 17 HB ILE 17 97.338 4.330 -1.210
135 1HG1 ILE 17 HG12 ILE 17 99.271 3.979 1.080
136 2HG1 ILE 17 HG11 ILE 17 97.631 4.571 1.324
137 1HG2 ILE 17 HG21 ILE 17 99.296 4.253 -2.575
138 2HG2 ILE 17 HG22 ILE 17 99.362 2.882 -1.469
139 3HG2 ILE 17 HG23 ILE 17 100.351 4.310 -1.163
140 1HD1 ILE 17 HD11 ILE 17 97.607 2.255 1.771
141 2HD1 ILE 17 HD12 ILE 17 98.492 1.887 0.291
142 3HD1 ILE 17 HD13 ILE 17 96.829 2.469 0.203
143 H LEU 18 HN LEU 18 96.998 6.410 -2.700
144 HA LEU 18 HA LEU 18 98.982 6.643 -4.685
145 1HB LEU 18 HB2 LEU 18 96.079 6.740 -4.517
146 2HB LEU 18 HB1 LEU 18 96.698 7.897 -5.679
147 HG LEU 18 HG LEU 18 97.661 6.225 -7.023
148 1HD1 LEU 18 HD11 LEU 18 98.810 4.841 -5.539
149 2HD1 LEU 18 HD12 LEU 18 97.571 3.793 -6.235
150 3HD1 LEU 18 HD13 LEU 18 97.352 4.463 -4.619
151 1HD2 LEU 18 HD21 LEU 18 95.793 4.660 -7.442
152 2HD2 LEU 18 HD22 LEU 18 95.266 6.336 -7.282
153 3HD2 LEU 18 HD23 LEU 18 95.036 5.207 -5.947
154 H HIS 19 HN HIS 19 97.198 9.027 -2.813
155 HA HIS 19 HA HIS 19 98.123 11.248 -4.331
156 1HB HIS 19 HB2 HIS 19 96.233 10.845 -2.304
157 2HB HIS 19 HB1 HIS 19 97.437 11.915 -1.592
158 HD1 HIS 19 HD1 HIS 19 94.951 11.741 -4.411
159 HD2 HIS 19 HD2 HIS 19 97.439 14.506 -2.561
160 HE1 HIS 19 HE1 HIS 19 94.285 13.978 -5.349
161 HE2 HIS 19 HE2 HIS 19 95.861 15.626 -4.277
162 H LEU 20 HN LEU 20 98.955 10.001 -1.089
163 HA LEU 20 HA LEU 20 100.661 11.057 0.203
164 1HB LEU 20 HB2 LEU 20 101.257 8.650 -1.299
165 2HB LEU 20 HB1 LEU 20 102.689 9.479 -0.741
166 HG LEU 20 HG LEU 20 102.398 8.237 1.121
167 1HD1 LEU 20 HD11 LEU 20 101.539 9.421 2.822
168 2HD1 LEU 20 HD12 LEU 20 99.943 9.439 2.095
169 3HD1 LEU 20 HD13 LEU 20 101.135 10.639 1.620
170 1HD2 LEU 20 HD21 LEU 20 99.796 7.840 -0.031
171 2HD2 LEU 20 HD22 LEU 20 100.034 7.464 1.680
172 3HD2 LEU 20 HD23 LEU 20 101.032 6.680 0.453
173 HA PRO 21 HA PRO 21 102.531 13.865 -2.958
174 1HB PRO 21 HB2 PRO 21 101.845 15.844 -0.873
175 2HB PRO 21 HB1 PRO 21 101.504 15.884 -2.606
176 1HG PRO 21 HG2 PRO 21 99.553 15.464 -0.815
177 2HG PRO 21 HG1 PRO 21 99.560 14.641 -2.387
178 1HD PRO 21 HD2 PRO 21 100.381 13.596 0.302
179 2HD PRO 21 HD1 PRO 21 99.436 12.782 -0.967
180 H ASN 22 HN ASN 22 104.540 12.949 -2.515
181 HA ASN 22 HA ASN 22 106.670 13.967 -1.679
182 1HB ASN 22 HB2 ASN 22 107.050 14.189 0.679
183 2HB ASN 22 HB1 ASN 22 105.618 15.115 0.266
184 1HD2 ASN 22 HD21 ASN 22 104.364 15.040 2.005
185 2HD2 ASN 22 HD22 ASN 22 103.931 13.612 2.875
186 H LEU 23 HN LEU 23 104.835 11.254 -1.441
187 HA LEU 23 HA LEU 23 106.974 9.631 -0.281
188 1HB LEU 23 HB2 LEU 23 104.633 9.166 0.407
189 2HB LEU 23 HB1 LEU 23 104.252 8.774 -1.258
190 HG LEU 23 HG LEU 23 106.345 7.090 -0.800
191 1HD1 LEU 23 HD11 LEU 23 105.214 7.822 1.795
192 2HD1 LEU 23 HD12 LEU 23 106.744 7.039 1.396
193 3HD1 LEU 23 HD13 LEU 23 105.258 6.084 1.483
194 1HD2 LEU 23 HD21 LEU 23 104.448 5.400 -0.287
195 2HD2 LEU 23 HD22 LEU 23 104.484 6.216 -1.849
196 3HD2 LEU 23 HD23 LEU 23 103.383 6.773 -0.588
197 H ASN 24 HN ASN 24 108.236 8.268 -1.499
198 HA ASN 24 HA ASN 24 108.596 8.768 -4.217
199 1HB ASN 24 HB2 ASN 24 109.440 6.694 -2.313
200 2HB ASN 24 HB1 ASN 24 109.277 6.089 -3.958
201 1HD2 ASN 24 HD21 ASN 24 110.552 7.019 -5.604
202 2HD2 ASN 24 HD22 ASN 24 112.018 7.854 -5.231
203 H GLU 25 HN GLU 25 107.015 8.540 -5.806
204 HA GLU 25 HA GLU 25 104.643 7.250 -5.337
205 1HB GLU 25 HB2 GLU 25 104.750 8.910 -6.989
206 2HB GLU 25 HB1 GLU 25 106.036 8.077 -7.862
207 1HG GLU 25 HG2 GLU 25 104.547 6.398 -8.646
208 2HG GLU 25 HG1 GLU 25 103.265 6.949 -7.568
209 H GLU 26 HN GLU 26 107.668 5.930 -6.369
210 HA GLU 26 HA GLU 26 106.712 3.446 -7.398
211 1HB GLU 26 HB2 GLU 26 109.006 2.648 -7.056
212 2HB GLU 26 HB1 GLU 26 109.015 4.235 -7.813
213 1HG GLU 26 HG2 GLU 26 109.584 5.284 -5.730
214 2HG GLU 26 HG1 GLU 26 109.423 3.752 -4.872
215 H GLN 27 HN GLN 27 107.162 4.854 -4.373
216 HA GLN 27 HA GLN 27 106.979 2.452 -2.750
217 1HB GLN 27 HB2 GLN 27 107.735 5.144 -2.268
218 2HB GLN 27 HB1 GLN 27 106.304 4.843 -1.293
219 1HG GLN 27 HG2 GLN 27 108.799 3.160 -1.277
220 2HG GLN 27 HG1 GLN 27 108.401 4.404 -0.093
221 1HE2 GLN 27 HE21 GLN 27 107.631 1.236 -1.299
222 2HE2 GLN 27 HE22 GLN 27 106.669 0.735 0.046
223 H ARG 28 HN ARG 28 105.019 5.132 -3.866
224 HA ARG 28 HA ARG 28 102.615 4.543 -2.541
225 1HB ARG 28 HB2 ARG 28 103.288 6.047 -5.054
226 2HB ARG 28 HB1 ARG 28 101.612 5.759 -4.624
227 1HG ARG 28 HG2 ARG 28 102.364 6.772 -2.323
228 2HG ARG 28 HG1 ARG 28 103.638 7.493 -3.309
229 1HD ARG 28 HD2 ARG 28 100.844 7.692 -4.297
230 2HD ARG 28 HD1 ARG 28 101.280 8.670 -2.916
231 HE ARG 28 HE ARG 28 102.808 9.859 -4.236
232 1HH1 ARG 28 HH11 ARG 28 101.079 7.444 -6.084
233 2HH1 ARG 28 HH12 ARG 28 101.461 8.166 -7.609
234 1HH2 ARG 28 HH21 ARG 28 103.301 10.801 -6.244
235 2HH2 ARG 28 HH22 ARG 28 102.722 10.066 -7.702
236 H ASN 29 HN ASN 29 104.107 3.226 -5.429
237 HA ASN 29 HA ASN 29 101.741 1.890 -6.347
238 1HB ASN 29 HB2 ASN 29 103.575 2.604 -7.870
239 2HB ASN 29 HB1 ASN 29 104.631 1.420 -7.106
240 1HD2 ASN 29 HD21 ASN 29 104.969 0.062 -8.763
241 2HD2 ASN 29 HD22 ASN 29 103.728 -0.828 -9.570
242 H GLY 30 HN GLY 30 104.773 0.895 -4.756
243 1HA GLY 30 HA2 GLY 30 104.242 -1.840 -4.564
244 2HA GLY 30 HA1 GLY 30 105.232 -0.933 -3.426
245 H PHE 31 HN PHE 31 103.099 0.852 -2.654
246 HA PHE 31 HA PHE 31 101.989 -0.661 -0.533
247 1HB PHE 31 HB2 PHE 31 101.690 2.152 -1.525
248 2HB PHE 31 HB1 PHE 31 100.537 1.541 -0.344
249 HD1 PHE 31 HD1 PHE 31 102.377 -0.202 1.236
250 HD2 PHE 31 HD2 PHE 31 102.871 3.758 -0.246
251 HE1 PHE 31 HE1 PHE 31 103.963 0.272 3.049
252 HE2 PHE 31 HE2 PHE 31 104.457 4.237 1.565
253 HZ PHE 31 HZ PHE 31 105.007 2.497 3.216
254 H ILE 32 HN ILE 32 100.854 0.272 -3.692
255 HA ILE 32 HA ILE 32 98.096 -0.352 -3.271
256 HB ILE 32 HB ILE 32 99.255 -0.550 -6.008
257 1HG1 ILE 32 HG12 ILE 32 98.918 2.076 -4.541
258 2HG1 ILE 32 HG11 ILE 32 100.450 1.362 -5.031
259 1HG2 ILE 32 HG21 ILE 32 97.145 0.955 -6.336
260 2HG2 ILE 32 HG22 ILE 32 96.715 0.347 -4.737
261 3HG2 ILE 32 HG23 ILE 32 96.975 -0.780 -6.068
262 1HD1 ILE 32 HD11 ILE 32 98.290 2.076 -6.982
263 2HD1 ILE 32 HD12 ILE 32 99.973 1.673 -7.318
264 3HD1 ILE 32 HD13 ILE 32 99.574 3.187 -6.507
265 H GLN 33 HN GLN 33 100.823 -2.108 -4.693
266 HA GLN 33 HA GLN 33 99.321 -4.369 -5.507
267 1HB GLN 33 HB2 GLN 33 102.245 -4.333 -4.745
268 2HB GLN 33 HB1 GLN 33 101.439 -5.486 -5.800
269 1HG GLN 33 HG2 GLN 33 101.727 -2.549 -6.390
270 2HG GLN 33 HG1 GLN 33 102.801 -3.806 -6.999
271 1HE2 GLN 33 HE21 GLN 33 102.104 -2.883 -9.076
272 2HE2 GLN 33 HE22 GLN 33 100.655 -3.487 -9.797
273 H SER 34 HN SER 34 101.328 -3.804 -2.624
274 HA SER 34 HA SER 34 100.813 -6.287 -1.396
275 1HB SER 34 HB2 SER 34 102.677 -4.827 -0.722
276 2HB SER 34 HB1 SER 34 101.528 -3.635 -0.115
277 HG SER 34 HG SER 34 102.538 -5.327 1.372
278 H LEU 35 HN LEU 35 99.195 -3.170 -1.256
279 HA LEU 35 HA LEU 35 97.347 -3.930 0.785
280 1HB LEU 35 HB2 LEU 35 97.821 -1.616 0.547
281 2HB LEU 35 HB1 LEU 35 97.442 -1.639 -1.164
282 HG LEU 35 HG LEU 35 95.125 -1.728 -0.777
283 1HD1 LEU 35 HD11 LEU 35 94.569 -1.813 1.890
284 2HD1 LEU 35 HD12 LEU 35 95.925 -2.934 1.764
285 3HD1 LEU 35 HD13 LEU 35 94.479 -3.187 0.789
286 1HD2 LEU 35 HD21 LEU 35 95.686 -0.021 1.556
287 2HD2 LEU 35 HD22 LEU 35 94.813 0.338 0.066
288 3HD2 LEU 35 HD23 LEU 35 96.577 0.372 0.086
289 H LYS 36 HN LYS 36 97.091 -3.628 -2.781
290 HA LYS 36 HA LYS 36 94.386 -4.224 -2.944
291 1HB LYS 36 HB2 LYS 36 94.650 -4.508 -5.236
292 2HB LYS 36 HB1 LYS 36 95.975 -3.441 -4.809
293 1HG LYS 36 HG2 LYS 36 97.520 -5.326 -4.868
294 2HG LYS 36 HG1 LYS 36 96.187 -6.410 -5.270
295 1HD LYS 36 HD2 LYS 36 96.439 -4.063 -7.017
296 2HD LYS 36 HD1 LYS 36 97.792 -5.192 -7.094
297 1HE LYS 36 HE2 LYS 36 96.245 -5.892 -8.743
298 2HE LYS 36 HE1 LYS 36 96.093 -7.027 -7.403
299 1HZ LYS 36 HZ1 LYS 36 94.305 -4.688 -7.745
300 2HZ LYS 36 HZ2 LYS 36 94.095 -6.007 -6.707
301 3HZ LYS 36 HZ3 LYS 36 93.953 -6.216 -8.380
302 H ASP 37 HN ASP 37 97.076 -6.634 -3.417
303 HA ASP 37 HA ASP 37 95.345 -8.819 -3.496
304 1HB ASP 37 HB2 ASP 37 97.711 -8.869 -4.211
305 2HB ASP 37 HB1 ASP 37 98.209 -8.755 -2.526
306 H ASP 38 HN ASP 38 97.168 -7.502 -0.756
307 HA ASP 38 HA ASP 38 95.685 -9.259 1.056
308 1HB ASP 38 HB2 ASP 38 98.338 -8.432 1.005
309 2HB ASP 38 HB1 ASP 38 97.628 -7.513 2.327
310 HA PRO 39 HA PRO 39 93.222 -5.561 1.923
311 1HB PRO 39 HB2 PRO 39 91.008 -6.814 2.734
312 2HB PRO 39 HB1 PRO 39 91.450 -6.763 1.023
313 1HG PRO 39 HG2 PRO 39 91.804 -8.974 3.007
314 2HG PRO 39 HG1 PRO 39 91.282 -9.061 1.315
315 1HD PRO 39 HD2 PRO 39 93.849 -9.577 2.188
316 2HD PRO 39 HD1 PRO 39 93.427 -9.086 0.536
317 H SER 40 HN SER 40 93.906 -8.291 3.992
318 HA SER 40 HA SER 40 93.030 -7.049 6.416
319 1HB SER 40 HB2 SER 40 94.918 -9.376 5.961
320 2HB SER 40 HB1 SER 40 94.273 -8.890 7.530
321 HG SER 40 HG SER 40 92.925 -10.460 6.812
322 H GLN 41 HN GLN 41 95.636 -6.599 4.350
323 HA GLN 41 HA GLN 41 97.465 -5.635 6.399
324 1HB GLN 41 HB2 GLN 41 97.703 -5.964 3.410
325 2HB GLN 41 HB1 GLN 41 98.945 -5.204 4.397
326 1HG GLN 41 HG2 GLN 41 98.104 -7.827 5.371
327 2HG GLN 41 HG1 GLN 41 98.839 -7.847 3.769
328 1HE2 GLN 41 HE21 GLN 41 100.974 -7.133 3.519
329 2HE2 GLN 41 HE22 GLN 41 102.062 -7.055 4.859
330 H SER 42 HN SER 42 94.906 -4.387 4.597
331 HA SER 42 HA SER 42 95.638 -1.995 3.568
332 1HB SER 42 HB2 SER 42 93.254 -3.029 4.019
333 2HB SER 42 HB1 SER 42 93.292 -1.950 5.413
334 HG SER 42 HG SER 42 92.825 -1.353 2.845
335 H ALA 43 HN ALA 43 95.291 -2.691 7.028
336 HA ALA 43 HA ALA 43 95.772 -0.010 7.860
337 1HB ALA 43 HB1 ALA 43 94.599 -1.369 9.382
338 2HB ALA 43 HB2 ALA 43 96.188 -1.122 10.105
339 3HB ALA 43 HB3 ALA 43 95.812 -2.647 9.302
340 H ASN 44 HN ASN 44 97.797 -2.884 7.485
341 HA ASN 44 HA ASN 44 100.156 -1.809 8.589
342 1HB ASN 44 HB2 ASN 44 99.404 -4.262 7.596
343 2HB ASN 44 HB1 ASN 44 100.552 -3.707 6.381
344 1HD2 ASN 44 HD21 ASN 44 100.118 -4.283 9.822
345 2HD2 ASN 44 HD22 ASN 44 101.785 -4.576 10.171
346 H LEU 45 HN LEU 45 98.832 -1.793 5.314
347 HA LEU 45 HA LEU 45 101.118 -0.496 4.176
348 1HB LEU 45 HB2 LEU 45 98.325 -0.995 3.169
349 2HB LEU 45 HB1 LEU 45 99.507 -0.107 2.239
350 HG LEU 45 HG LEU 45 99.496 -2.322 1.404
351 1HD1 LEU 45 HD11 LEU 45 101.818 -1.286 2.748
352 2HD1 LEU 45 HD12 LEU 45 101.696 -2.154 1.220
353 3HD1 LEU 45 HD13 LEU 45 101.841 -3.048 2.732
354 1HD2 LEU 45 HD21 LEU 45 99.835 -4.279 2.813
355 2HD2 LEU 45 HD22 LEU 45 98.385 -3.389 3.281
356 3HD2 LEU 45 HD23 LEU 45 99.856 -3.249 4.244
357 H LEU 46 HN LEU 46 97.937 0.538 5.332
358 HA LEU 46 HA LEU 46 98.018 3.199 4.489
359 1HB LEU 46 HB2 LEU 46 96.294 1.631 6.009
360 2HB LEU 46 HB1 LEU 46 96.808 2.883 7.121
361 HG LEU 46 HG LEU 46 95.821 3.650 4.403
362 1HD1 LEU 46 HD11 LEU 46 93.937 3.386 6.709
363 2HD1 LEU 46 HD12 LEU 46 94.241 2.011 5.646
364 3HD1 LEU 46 HD13 LEU 46 93.588 3.509 4.985
365 1HD2 LEU 46 HD21 LEU 46 96.042 4.915 7.111
366 2HD2 LEU 46 HD22 LEU 46 94.954 5.568 5.885
367 3HD2 LEU 46 HD23 LEU 46 96.686 5.473 5.567
368 H ALA 47 HN ALA 47 98.996 1.815 7.621
369 HA ALA 47 HA ALA 47 99.957 4.172 8.770
370 1HB ALA 47 HB1 ALA 47 101.521 1.952 9.659
371 2HB ALA 47 HB2 ALA 47 99.842 1.448 9.468
372 3HB ALA 47 HB3 ALA 47 100.239 2.820 10.503
373 H GLU 48 HN GLU 48 101.707 1.641 6.987
374 HA GLU 48 HA GLU 48 104.254 2.713 7.144
375 1HB GLU 48 HB2 GLU 48 102.907 1.024 5.050
376 2HB GLU 48 HB1 GLU 48 104.593 1.500 4.901
377 1HG GLU 48 HG2 GLU 48 104.141 0.443 7.515
378 2HG GLU 48 HG1 GLU 48 103.515 -0.682 6.310
379 H ALA 49 HN ALA 49 101.677 3.442 4.821
380 HA ALA 49 HA ALA 49 103.321 5.181 3.246
381 1HB ALA 49 HB1 ALA 49 101.669 4.430 1.907
382 2HB ALA 49 HB2 ALA 49 100.864 5.891 2.483
383 3HB ALA 49 HB3 ALA 49 100.496 4.330 3.220
384 H LYS 50 HN LYS 50 100.856 5.695 5.757
385 HA LYS 50 HA LYS 50 100.942 8.540 5.491
386 1HB LYS 50 HB2 LYS 50 99.556 8.568 7.518
387 2HB LYS 50 HB1 LYS 50 98.936 7.444 6.318
388 1HG LYS 50 HG2 LYS 50 100.365 5.713 7.688
389 2HG LYS 50 HG1 LYS 50 100.161 6.908 8.970
390 1HD LYS 50 HD2 LYS 50 97.646 6.529 7.685
391 2HD LYS 50 HD1 LYS 50 98.314 4.944 8.071
392 1HE LYS 50 HE2 LYS 50 98.776 6.572 10.320
393 2HE LYS 50 HE1 LYS 50 97.118 6.884 9.810
394 1HZ LYS 50 HZ1 LYS 50 96.465 4.834 10.395
395 2HZ LYS 50 HZ2 LYS 50 97.846 4.844 11.371
396 3HZ LYS 50 HZ3 LYS 50 97.889 4.092 9.857
397 H LYS 51 HN LYS 51 102.768 6.206 7.337
398 HA LYS 51 HA LYS 51 103.820 8.184 9.165
399 1HB LYS 51 HB2 LYS 51 104.150 5.251 8.759
400 2HB LYS 51 HB1 LYS 51 105.460 6.119 9.547
401 1HG LYS 51 HG2 LYS 51 104.308 6.387 11.446
402 2HG LYS 51 HG1 LYS 51 102.801 6.744 10.599
403 1HD LYS 51 HD2 LYS 51 102.443 4.716 11.768
404 2HD LYS 51 HD1 LYS 51 102.660 4.276 10.073
405 1HE LYS 51 HE2 LYS 51 105.056 3.800 10.580
406 2HE LYS 51 HE1 LYS 51 104.698 4.074 12.285
407 1HZ LYS 51 HZ1 LYS 51 104.237 1.908 12.335
408 2HZ LYS 51 HZ2 LYS 51 104.160 1.777 10.651
409 3HZ LYS 51 HZ3 LYS 51 102.803 2.287 11.521
410 H LEU 52 HN LEU 52 105.014 6.205 6.489
411 HA LEU 52 HA LEU 52 107.610 7.277 6.401
412 1HB LEU 52 HB2 LEU 52 107.142 5.161 5.381
413 2HB LEU 52 HB1 LEU 52 105.950 5.878 4.315
414 HG LEU 52 HG LEU 52 107.689 7.069 3.104
415 1HD1 LEU 52 HD11 LEU 52 109.356 6.126 5.357
416 2HD1 LEU 52 HD12 LEU 52 109.419 7.635 4.447
417 3HD1 LEU 52 HD13 LEU 52 110.104 6.162 3.761
418 1HD2 LEU 52 HD21 LEU 52 108.804 5.170 2.081
419 2HD2 LEU 52 HD22 LEU 52 107.116 4.785 2.416
420 3HD2 LEU 52 HD23 LEU 52 108.388 4.158 3.464
421 H ASN 53 HN ASN 53 104.785 7.987 4.332
422 HA ASN 53 HA ASN 53 105.944 9.893 2.699
423 1HB ASN 53 HB2 ASN 53 103.803 9.225 2.073
424 2HB ASN 53 HB1 ASN 53 103.123 9.452 3.670
425 1HD2 ASN 53 HD21 ASN 53 103.093 10.571 0.667
426 2HD2 ASN 53 HD22 ASN 53 102.641 12.215 0.935
427 H ASP 54 HN ASP 54 104.437 10.441 5.903
428 HA ASP 54 HA ASP 54 104.798 13.233 5.898
429 1HB ASP 54 HB2 ASP 54 103.568 11.455 7.563
430 2HB ASP 54 HB1 ASP 54 104.980 11.897 8.518
431 H ALA 55 HN ALA 55 106.739 10.687 7.484
432 HA ALA 55 HA ALA 55 108.754 12.401 8.418
433 1HB ALA 55 HB1 ALA 55 108.370 10.152 9.301
434 2HB ALA 55 HB2 ALA 55 110.050 10.389 8.820
435 3HB ALA 55 HB3 ALA 55 108.960 9.461 7.789
436 H GLN 56 HN GLN 56 108.354 10.831 5.310
437 HA GLN 56 HA GLN 56 111.037 11.658 4.517
438 1HB GLN 56 HB2 GLN 56 110.846 10.213 2.640
439 2HB GLN 56 HB1 GLN 56 110.250 9.333 4.035
440 1HG GLN 56 HG2 GLN 56 108.296 8.982 3.062
441 2HG GLN 56 HG1 GLN 56 108.092 10.697 2.714
442 1HE2 GLN 56 HE21 GLN 56 109.984 11.281 0.958
443 2HE2 GLN 56 HE22 GLN 56 109.831 10.335 -0.479
444 H ALA 57 HN ALA 57 108.091 13.073 4.595
445 HA ALA 57 HA ALA 57 107.759 14.165 2.041
446 1HB ALA 57 HB1 ALA 57 106.056 14.318 3.793
447 2HB ALA 57 HB2 ALA 57 106.442 15.906 3.130
448 3HB ALA 57 HB3 ALA 57 107.090 15.423 4.697
449 HA PRO 58 HA PRO 58 111.153 16.963 1.614
450 1HB PRO 58 HB2 PRO 58 110.063 18.903 0.064
451 2HB PRO 58 HB1 PRO 58 110.470 17.298 -0.553
452 1HG PRO 58 HG2 PRO 58 107.815 18.360 0.343
453 2HG PRO 58 HG1 PRO 58 108.206 17.407 -1.101
454 1HD PRO 58 HD2 PRO 58 107.142 16.279 1.101
455 2HD PRO 58 HD1 PRO 58 108.319 15.425 0.083
456 H LYS 59 HN LYS 59 111.965 19.005 2.209
457 HA LYS 59 HA LYS 59 110.633 21.198 3.172
458 1HB LYS 59 HB2 LYS 59 110.497 18.976 5.030
459 2HB LYS 59 HB1 LYS 59 111.329 20.347 5.749
460 1HG LYS 59 HG2 LYS 59 108.666 20.612 4.388
461 2HG LYS 59 HG1 LYS 59 108.830 20.218 6.101
462 1HD LYS 59 HD2 LYS 59 110.285 22.304 6.273
463 2HD LYS 59 HD1 LYS 59 109.680 22.722 4.668
464 1HE LYS 59 HE2 LYS 59 107.599 21.956 6.584
465 2HE LYS 59 HE1 LYS 59 108.491 23.411 7.026
466 1HZ LYS 59 HZ1 LYS 59 107.979 24.334 4.847
467 2HZ LYS 59 HZ2 LYS 59 106.563 23.947 5.687
468 3HZ LYS 59 HZ3 LYS 59 107.107 22.942 4.440
469 H ALA 60 HN ALA 60 112.137 22.077 5.285
470 HA ALA 60 HA ALA 60 114.163 22.956 5.839
471 1HB ALA 60 HB1 ALA 60 115.247 21.052 6.378
472 2HB ALA 60 HB2 ALA 60 116.157 21.398 4.908
473 3HB ALA 60 HB3 ALA 60 114.817 20.252 4.866
Start of MODEL 19
1 1H GLY -1 HT1 GLY -1 83.025 -3.415 11.987
2 2H GLY -1 HT2 GLY -1 84.150 -3.408 10.724
3 3H GLY -1 HT3 GLY -1 83.904 -4.815 11.629
4 1HA GLY -1 HA1 GLY -1 81.855 -5.259 10.684
5 2HA GLY -1 HA2 GLY -1 81.668 -3.597 10.147
6 H SER 0 HN SER 0 83.618 -6.515 9.630
7 HA SER 0 HA SER 0 83.855 -5.738 6.796
8 1HB SER 0 HB2 SER 0 85.981 -5.792 8.420
9 2HB SER 0 HB1 SER 0 85.936 -7.501 7.990
10 HG SER 0 HG SER 0 86.326 -7.010 5.920
11 H THR 1 HN THR 1 84.057 -7.567 5.285
12 HA THR 1 HA THR 1 82.719 -9.978 6.325
13 HB THR 1 HB THR 1 82.284 -9.824 3.543
14 HG1 THR 1 HG1 THR 1 81.656 -7.821 3.150
15 1HG2 THR 1 HG21 THR 1 80.175 -8.878 5.392
16 2HG2 THR 1 HG22 THR 1 80.782 -10.522 5.593
17 3HG2 THR 1 HG23 THR 1 80.086 -10.021 4.052
18 H ALA 2 HN ALA 2 84.460 -9.054 3.356
19 HA ALA 2 HA ALA 2 86.785 -10.447 3.603
20 1HB ALA 2 HB1 ALA 2 84.562 -12.276 2.709
21 2HB ALA 2 HB2 ALA 2 85.723 -12.520 4.015
22 3HB ALA 2 HB3 ALA 2 86.257 -12.593 2.339
23 H ASP 3 HN ASP 3 87.006 -11.722 1.044
24 HA ASP 3 HA ASP 3 87.726 -11.005 -1.019
25 1HB ASP 3 HB2 ASP 3 84.800 -10.810 -0.822
26 2HB ASP 3 HB1 ASP 3 85.491 -9.890 -2.155
27 H ASN 4 HN ASN 4 89.109 -9.384 -0.123
28 HA ASN 4 HA ASN 4 89.621 -7.120 0.519
29 1HB ASN 4 HB2 ASN 4 90.623 -7.952 -1.671
30 2HB ASN 4 HB1 ASN 4 89.386 -7.000 -2.485
31 1HD2 ASN 4 HD21 ASN 4 92.474 -6.989 -1.270
32 2HD2 ASN 4 HD22 ASN 4 92.745 -5.283 -1.232
33 H LYS 5 HN LYS 5 86.926 -7.163 1.005
34 HA LYS 5 HA LYS 5 85.573 -5.204 -0.601
35 1HB LYS 5 HB2 LYS 5 84.522 -7.203 0.588
36 2HB LYS 5 HB1 LYS 5 84.633 -6.245 2.059
37 1HG LYS 5 HG2 LYS 5 82.470 -5.869 1.307
38 2HG LYS 5 HG1 LYS 5 83.358 -4.449 0.752
39 1HD LYS 5 HD2 LYS 5 83.550 -6.461 -1.252
40 2HD LYS 5 HD1 LYS 5 81.857 -6.314 -0.780
41 1HE LYS 5 HE2 LYS 5 81.710 -4.512 -2.069
42 2HE LYS 5 HE1 LYS 5 82.825 -3.691 -0.979
43 1HZ LYS 5 HZ1 LYS 5 84.587 -4.967 -2.406
44 2HZ LYS 5 HZ2 LYS 5 83.935 -3.503 -2.946
45 3HZ LYS 5 HZ3 LYS 5 83.353 -4.966 -3.564
46 H PHE 6 HN PHE 6 87.717 -3.848 0.174
47 HA PHE 6 HA PHE 6 87.816 -2.527 2.566
48 1HB PHE 6 HB2 PHE 6 88.319 -1.401 -0.198
49 2HB PHE 6 HB1 PHE 6 88.831 -0.634 1.301
50 HD1 PHE 6 HD1 PHE 6 90.866 -1.071 -0.601
51 HD2 PHE 6 HD2 PHE 6 89.234 -3.857 2.174
52 HE1 PHE 6 HE1 PHE 6 92.965 -2.353 -0.655
53 HE2 PHE 6 HE2 PHE 6 91.325 -5.134 2.127
54 HZ PHE 6 HZ PHE 6 93.202 -4.392 0.715
55 H ASN 7 HN ASN 7 86.934 -0.599 3.389
56 HA ASN 7 HA ASN 7 84.454 0.291 2.072
57 1HB ASN 7 HB2 ASN 7 84.855 0.127 5.062
58 2HB ASN 7 HB1 ASN 7 83.352 0.415 4.192
59 1HD2 ASN 7 HD21 ASN 7 82.541 -1.339 2.856
60 2HD2 ASN 7 HD22 ASN 7 82.826 -2.970 3.349
61 H LYS 8 HN LYS 8 83.848 2.288 3.984
62 HA LYS 8 HA LYS 8 85.176 4.490 2.959
63 1HB LYS 8 HB2 LYS 8 84.065 4.473 5.757
64 2HB LYS 8 HB1 LYS 8 84.082 5.792 4.597
65 1HG LYS 8 HG2 LYS 8 82.341 3.342 4.583
66 2HG LYS 8 HG1 LYS 8 81.850 5.027 4.744
67 1HD LYS 8 HD2 LYS 8 83.256 4.930 2.343
68 2HD LYS 8 HD1 LYS 8 82.296 3.450 2.356
69 1HE LYS 8 HE2 LYS 8 81.165 6.187 2.914
70 2HE LYS 8 HE1 LYS 8 81.174 5.440 1.317
71 1HZ LYS 8 HZ1 LYS 8 79.993 4.028 3.620
72 2HZ LYS 8 HZ2 LYS 8 79.671 3.829 1.972
73 3HZ LYS 8 HZ3 LYS 8 79.100 5.198 2.785
74 H GLU 9 HN GLU 9 85.931 2.538 5.798
75 HA GLU 9 HA GLU 9 88.079 4.241 6.651
76 1HB GLU 9 HB2 GLU 9 86.609 2.552 8.030
77 2HB GLU 9 HB1 GLU 9 87.838 1.396 7.535
78 1HG GLU 9 HG2 GLU 9 89.542 3.019 8.467
79 2HG GLU 9 HG1 GLU 9 88.182 3.872 9.195
80 H GLN 10 HN GLN 10 87.939 0.980 5.162
81 HA GLN 10 HA GLN 10 90.766 0.777 4.906
82 1HB GLN 10 HB2 GLN 10 88.871 -1.048 5.008
83 2HB GLN 10 HB1 GLN 10 88.871 -0.850 3.263
84 1HG GLN 10 HG2 GLN 10 90.863 -1.865 3.007
85 2HG GLN 10 HG1 GLN 10 91.504 -1.241 4.526
86 1HE2 GLN 10 HE21 GLN 10 91.976 -3.834 3.832
87 2HE2 GLN 10 HE22 GLN 10 91.102 -4.889 4.872
88 H GLN 11 HN GLN 11 88.163 1.293 2.522
89 HA GLN 11 HA GLN 11 89.718 1.401 0.241
90 1HB GLN 11 HB2 GLN 11 87.210 1.368 0.366
91 2HB GLN 11 HB1 GLN 11 87.265 3.088 0.730
92 1HG GLN 11 HG2 GLN 11 88.763 2.296 -1.659
93 2HG GLN 11 HG1 GLN 11 87.023 2.031 -1.753
94 1HE2 GLN 11 HE21 GLN 11 86.421 3.626 -3.094
95 2HE2 GLN 11 HE22 GLN 11 86.664 5.310 -2.792
96 H ASN 12 HN ASN 12 89.055 3.987 2.564
97 HA ASN 12 HA ASN 12 89.961 6.176 1.126
98 1HB ASN 12 HB2 ASN 12 88.929 6.402 3.327
99 2HB ASN 12 HB1 ASN 12 90.301 5.594 4.079
100 1HD2 ASN 12 HD21 ASN 12 90.109 8.133 1.615
101 2HD2 ASN 12 HD22 ASN 12 91.051 9.289 2.488
102 H ALA 13 HN ALA 13 91.735 3.559 2.545
103 HA ALA 13 HA ALA 13 94.275 4.624 2.773
104 1HB ALA 13 HB1 ALA 13 93.482 1.839 1.938
105 2HB ALA 13 HB2 ALA 13 93.723 2.415 3.587
106 3HB ALA 13 HB3 ALA 13 95.090 2.320 2.477
107 H PHE 14 HN PHE 14 92.745 3.164 -0.136
108 HA PHE 14 HA PHE 14 94.872 3.133 -1.846
109 1HB PHE 14 HB2 PHE 14 92.669 2.233 -2.336
110 2HB PHE 14 HB1 PHE 14 91.986 3.840 -2.386
111 HD1 PHE 14 HD1 PHE 14 91.129 3.956 -4.523
112 HD2 PHE 14 HD2 PHE 14 95.154 2.695 -3.970
113 HE1 PHE 14 HE1 PHE 14 91.482 4.036 -6.955
114 HE2 PHE 14 HE2 PHE 14 95.510 2.768 -6.404
115 HZ PHE 14 HZ PHE 14 93.676 3.442 -7.898
116 H TRP 15 HN TRP 15 92.519 5.800 -1.616
117 HA TRP 15 HA TRP 15 93.873 7.515 -3.373
118 1HB TRP 15 HB2 TRP 15 91.662 7.736 -1.510
119 2HB TRP 15 HB1 TRP 15 92.635 9.203 -1.536
120 HD1 TRP 15 HD1 TRP 15 91.683 6.922 -4.528
121 HE1 TRP 15 HE1 TRP 15 90.500 8.384 -6.286
122 HE3 TRP 15 HE3 TRP 15 91.571 11.346 -1.965
123 HZ2 TRP 15 HZ2 TRP 15 89.633 11.057 -6.550
124 HZ3 TRP 15 HZ3 TRP 15 90.548 13.307 -3.043
125 HH2 TRP 15 HH2 TRP 15 89.600 13.164 -5.288
126 H GLU 16 HN GLU 16 94.049 7.254 0.151
127 HA GLU 16 HA GLU 16 95.899 9.323 0.597
128 1HB GLU 16 HB2 GLU 16 94.483 7.504 2.158
129 2HB GLU 16 HB1 GLU 16 96.170 7.130 2.481
130 1HG GLU 16 HG2 GLU 16 95.343 8.733 4.083
131 2HG GLU 16 HG1 GLU 16 96.573 9.473 3.060
132 H ILE 17 HN ILE 17 96.298 6.152 -0.581
133 HA ILE 17 HA ILE 17 99.164 6.007 -0.035
134 HB ILE 17 HB ILE 17 97.494 4.190 -1.791
135 1HG1 ILE 17 HG12 ILE 17 96.821 3.428 0.252
136 2HG1 ILE 17 HG11 ILE 17 98.377 2.618 0.225
137 1HG2 ILE 17 HG21 ILE 17 99.956 4.460 -2.363
138 2HG2 ILE 17 HG22 ILE 17 99.400 2.816 -2.043
139 3HG2 ILE 17 HG23 ILE 17 100.295 3.701 -0.808
140 1HD1 ILE 17 HD11 ILE 17 97.597 5.104 1.700
141 2HD1 ILE 17 HD12 ILE 17 99.284 4.670 1.424
142 3HD1 ILE 17 HD13 ILE 17 98.233 3.589 2.338
143 H LEU 18 HN LEU 18 97.022 6.303 -2.814
144 HA LEU 18 HA LEU 18 99.013 6.843 -4.743
145 1HB LEU 18 HB2 LEU 18 96.047 7.169 -4.542
146 2HB LEU 18 HB1 LEU 18 96.892 7.945 -5.864
147 HG LEU 18 HG LEU 18 96.021 5.809 -6.589
148 1HD1 LEU 18 HD11 LEU 18 99.006 5.577 -6.239
149 2HD1 LEU 18 HD12 LEU 18 98.230 6.609 -7.440
150 3HD1 LEU 18 HD13 LEU 18 98.015 4.860 -7.510
151 1HD2 LEU 18 HD21 LEU 18 97.587 4.748 -4.253
152 2HD2 LEU 18 HD22 LEU 18 96.952 3.730 -5.545
153 3HD2 LEU 18 HD23 LEU 18 95.852 4.653 -4.524
154 H HIS 19 HN HIS 19 97.326 8.745 -2.429
155 HA HIS 19 HA HIS 19 97.780 11.294 -3.551
156 1HB HIS 19 HB2 HIS 19 96.075 11.417 -2.048
157 2HB HIS 19 HB1 HIS 19 96.742 10.155 -1.029
158 HD1 HIS 19 HD1 HIS 19 96.779 13.861 -1.537
159 HD2 HIS 19 HD2 HIS 19 98.294 11.032 1.104
160 HE1 HIS 19 HE1 HIS 19 97.605 15.167 0.448
161 HE2 HIS 19 HE2 HIS 19 98.467 13.430 2.057
162 H LEU 20 HN LEU 20 99.230 9.845 -0.628
163 HA LEU 20 HA LEU 20 101.042 11.051 0.459
164 1HB LEU 20 HB2 LEU 20 102.094 8.897 -1.338
165 2HB LEU 20 HB1 LEU 20 102.897 9.510 0.090
166 HG LEU 20 HG LEU 20 100.387 7.865 -0.078
167 1HD1 LEU 20 HD11 LEU 20 101.799 6.728 1.831
168 2HD1 LEU 20 HD12 LEU 20 103.133 7.530 1.001
169 3HD1 LEU 20 HD13 LEU 20 102.110 6.389 0.129
170 1HD2 LEU 20 HD21 LEU 20 99.925 9.727 1.443
171 2HD2 LEU 20 HD22 LEU 20 101.397 9.358 2.342
172 3HD2 LEU 20 HD23 LEU 20 100.067 8.201 2.315
173 HA PRO 21 HA PRO 21 102.242 13.879 -3.147
174 1HB PRO 21 HB2 PRO 21 101.920 15.771 -0.872
175 2HB PRO 21 HB1 PRO 21 101.445 15.953 -2.565
176 1HG PRO 21 HG2 PRO 21 99.630 15.453 -0.682
177 2HG PRO 21 HG1 PRO 21 99.507 14.719 -2.292
178 1HD PRO 21 HD2 PRO 21 100.375 13.500 0.287
179 2HD PRO 21 HD1 PRO 21 99.475 12.788 -1.055
180 H ASN 22 HN ASN 22 104.287 13.017 -3.152
181 HA ASN 22 HA ASN 22 106.492 14.101 -2.856
182 1HB ASN 22 HB2 ASN 22 105.597 13.992 0.009
183 2HB ASN 22 HB1 ASN 22 107.308 13.898 -0.379
184 1HD2 ASN 22 HD21 ASN 22 107.511 15.892 0.790
185 2HD2 ASN 22 HD22 ASN 22 107.144 17.387 0.008
186 H LEU 23 HN LEU 23 105.253 11.603 -0.614
187 HA LEU 23 HA LEU 23 107.309 9.942 -0.388
188 1HB LEU 23 HB2 LEU 23 105.006 9.449 0.397
189 2HB LEU 23 HB1 LEU 23 104.582 8.964 -1.234
190 HG LEU 23 HG LEU 23 106.804 7.408 -0.676
191 1HD1 LEU 23 HD11 LEU 23 105.775 6.329 1.523
192 2HD1 LEU 23 HD12 LEU 23 105.325 8.011 1.817
193 3HD1 LEU 23 HD13 LEU 23 107.020 7.582 1.579
194 1HD2 LEU 23 HD21 LEU 23 105.123 6.351 -1.802
195 2HD2 LEU 23 HD22 LEU 23 103.869 6.985 -0.741
196 3HD2 LEU 23 HD23 LEU 23 104.896 5.665 -0.194
197 H ASN 24 HN ASN 24 108.358 8.325 -1.525
198 HA ASN 24 HA ASN 24 108.719 8.830 -4.301
199 1HB ASN 24 HB2 ASN 24 109.814 6.438 -4.224
200 2HB ASN 24 HB1 ASN 24 110.607 7.789 -3.427
201 1HD2 ASN 24 HD21 ASN 24 111.024 5.069 -2.853
202 2HD2 ASN 24 HD22 ASN 24 110.510 4.780 -1.229
203 H GLU 25 HN GLU 25 107.255 8.390 -5.849
204 HA GLU 25 HA GLU 25 104.903 7.060 -5.349
205 1HB GLU 25 HB2 GLU 25 104.524 7.150 -7.761
206 2HB GLU 25 HB1 GLU 25 105.191 8.664 -7.142
207 1HG GLU 25 HG2 GLU 25 106.347 8.286 -9.130
208 2HG GLU 25 HG1 GLU 25 107.461 7.749 -7.874
209 H GLU 26 HN GLU 26 107.966 5.702 -6.034
210 HA GLU 26 HA GLU 26 107.075 3.143 -6.983
211 1HB GLU 26 HB2 GLU 26 109.358 3.777 -7.434
212 2HB GLU 26 HB1 GLU 26 109.663 4.103 -5.735
213 1HG GLU 26 HG2 GLU 26 109.064 1.548 -5.489
214 2HG GLU 26 HG1 GLU 26 109.547 1.513 -7.183
215 H GLN 27 HN GLN 27 107.389 4.787 -4.079
216 HA GLN 27 HA GLN 27 107.178 2.526 -2.263
217 1HB GLN 27 HB2 GLN 27 108.335 4.697 -1.672
218 2HB GLN 27 HB1 GLN 27 106.752 5.429 -1.572
219 1HG GLN 27 HG2 GLN 27 106.869 4.866 0.586
220 2HG GLN 27 HG1 GLN 27 106.418 3.260 0.015
221 1HE2 GLN 27 HE21 GLN 27 108.639 5.015 1.764
222 2HE2 GLN 27 HE22 GLN 27 109.908 3.845 1.843
223 H ARG 28 HN ARG 28 105.153 5.156 -3.507
224 HA ARG 28 HA ARG 28 102.788 4.494 -2.142
225 1HB ARG 28 HB2 ARG 28 103.333 5.962 -4.721
226 2HB ARG 28 HB1 ARG 28 101.683 5.648 -4.198
227 1HG ARG 28 HG2 ARG 28 102.374 6.763 -1.997
228 2HG ARG 28 HG1 ARG 28 103.772 7.355 -2.892
229 1HD ARG 28 HD2 ARG 28 101.246 7.819 -4.271
230 2HD ARG 28 HD1 ARG 28 101.312 8.579 -2.707
231 HE ARG 28 HE ARG 28 103.144 9.875 -3.417
232 1HH1 ARG 28 HH11 ARG 28 101.865 7.867 -5.979
233 2HH1 ARG 28 HH12 ARG 28 102.580 8.815 -7.237
234 1HH2 ARG 28 HH21 ARG 28 104.078 11.110 -5.071
235 2HH2 ARG 28 HH22 ARG 28 103.836 10.653 -6.725
236 H ASN 29 HN ASN 29 103.721 3.735 -5.510
237 HA ASN 29 HA ASN 29 101.659 2.021 -6.173
238 1HB ASN 29 HB2 ASN 29 103.821 2.896 -7.489
239 2HB ASN 29 HB1 ASN 29 104.389 1.277 -7.090
240 1HD2 ASN 29 HD21 ASN 29 101.651 3.006 -8.509
241 2HD2 ASN 29 HD22 ASN 29 101.245 1.778 -9.654
242 H GLY 30 HN GLY 30 104.798 1.167 -4.677
243 1HA GLY 30 HA2 GLY 30 104.342 -1.586 -4.465
244 2HA GLY 30 HA1 GLY 30 105.372 -0.653 -3.386
245 H PHE 31 HN PHE 31 103.231 1.085 -2.504
246 HA PHE 31 HA PHE 31 102.247 -0.511 -0.354
247 1HB PHE 31 HB2 PHE 31 102.175 2.350 -1.127
248 2HB PHE 31 HB1 PHE 31 100.863 1.795 -0.090
249 HD1 PHE 31 HD1 PHE 31 103.757 3.498 0.146
250 HD2 PHE 31 HD2 PHE 31 102.005 -0.065 1.683
251 HE1 PHE 31 HE1 PHE 31 105.238 3.612 2.104
252 HE2 PHE 31 HE2 PHE 31 103.481 0.044 3.642
253 HZ PHE 31 HZ PHE 31 105.103 1.887 3.857
254 H ILE 32 HN ILE 32 100.881 0.810 -3.299
255 HA ILE 32 HA ILE 32 98.165 0.138 -2.747
256 HB ILE 32 HB ILE 32 98.689 0.027 -5.581
257 1HG1 ILE 32 HG12 ILE 32 100.653 1.506 -4.569
258 2HG1 ILE 32 HG11 ILE 32 99.886 1.844 -6.097
259 1HG2 ILE 32 HG21 ILE 32 97.040 1.764 -5.681
260 2HG2 ILE 32 HG22 ILE 32 97.236 2.105 -3.962
261 3HG2 ILE 32 HG23 ILE 32 96.553 0.566 -4.483
262 1HD1 ILE 32 HD11 ILE 32 100.259 3.648 -4.118
263 2HD1 ILE 32 HD12 ILE 32 98.606 3.130 -3.805
264 3HD1 ILE 32 HD13 ILE 32 99.044 3.781 -5.383
265 H GLN 33 HN GLN 33 100.688 -1.378 -4.670
266 HA GLN 33 HA GLN 33 99.219 -3.605 -5.559
267 1HB GLN 33 HB2 GLN 33 102.186 -3.390 -5.021
268 2HB GLN 33 HB1 GLN 33 101.420 -4.690 -5.923
269 1HG GLN 33 HG2 GLN 33 101.585 -1.785 -6.677
270 2HG GLN 33 HG1 GLN 33 102.349 -3.155 -7.482
271 1HE2 GLN 33 HE21 GLN 33 100.118 -0.996 -8.006
272 2HE2 GLN 33 HE22 GLN 33 98.930 -1.909 -8.866
273 H SER 34 HN SER 34 101.369 -3.299 -2.731
274 HA SER 34 HA SER 34 100.974 -5.919 -1.772
275 1HB SER 34 HB2 SER 34 102.501 -3.700 -1.015
276 2HB SER 34 HB1 SER 34 101.455 -4.016 0.368
277 HG SER 34 HG SER 34 103.439 -5.620 -0.780
278 H LEU 35 HN LEU 35 99.235 -2.915 -1.254
279 HA LEU 35 HA LEU 35 97.540 -3.919 0.825
280 1HB LEU 35 HB2 LEU 35 97.800 -1.581 0.775
281 2HB LEU 35 HB1 LEU 35 97.504 -1.497 -0.952
282 HG LEU 35 HG LEU 35 95.157 -1.851 -0.656
283 1HD1 LEU 35 HD11 LEU 35 96.000 -2.847 1.972
284 2HD1 LEU 35 HD12 LEU 35 94.648 -3.329 0.953
285 3HD1 LEU 35 HD13 LEU 35 94.514 -1.897 1.972
286 1HD2 LEU 35 HD21 LEU 35 94.928 0.306 -0.189
287 2HD2 LEU 35 HD22 LEU 35 96.544 0.330 0.518
288 3HD2 LEU 35 HD23 LEU 35 95.145 -0.032 1.529
289 H LYS 36 HN LYS 36 97.201 -3.474 -2.691
290 HA LYS 36 HA LYS 36 94.508 -4.147 -2.901
291 1HB LYS 36 HB2 LYS 36 95.643 -3.192 -4.778
292 2HB LYS 36 HB1 LYS 36 96.806 -4.508 -4.824
293 1HG LYS 36 HG2 LYS 36 95.319 -4.859 -6.618
294 2HG LYS 36 HG1 LYS 36 94.887 -6.039 -5.380
295 1HD LYS 36 HD2 LYS 36 93.070 -4.556 -4.631
296 2HD LYS 36 HD1 LYS 36 93.490 -3.417 -5.912
297 1HE LYS 36 HE2 LYS 36 93.205 -5.926 -7.147
298 2HE LYS 36 HE1 LYS 36 91.848 -5.768 -6.034
299 1HZ LYS 36 HZ1 LYS 36 91.231 -4.857 -8.137
300 2HZ LYS 36 HZ2 LYS 36 92.609 -3.877 -8.191
301 3HZ LYS 36 HZ3 LYS 36 91.400 -3.573 -7.048
302 H ASP 37 HN ASP 37 97.286 -6.354 -3.588
303 HA ASP 37 HA ASP 37 95.683 -8.640 -3.716
304 1HB ASP 37 HB2 ASP 37 98.617 -8.167 -3.351
305 2HB ASP 37 HB1 ASP 37 97.970 -9.799 -3.212
306 H ASP 38 HN ASP 38 96.798 -6.921 -0.952
307 HA ASP 38 HA ASP 38 95.892 -9.156 0.739
308 1HB ASP 38 HB2 ASP 38 98.465 -7.965 0.677
309 2HB ASP 38 HB1 ASP 38 97.705 -7.491 2.191
310 HA PRO 39 HA PRO 39 93.187 -5.755 1.966
311 1HB PRO 39 HB2 PRO 39 91.166 -7.251 2.880
312 2HB PRO 39 HB1 PRO 39 91.477 -7.051 1.151
313 1HG PRO 39 HG2 PRO 39 92.161 -9.342 2.948
314 2HG PRO 39 HG1 PRO 39 91.529 -9.369 1.292
315 1HD PRO 39 HD2 PRO 39 94.183 -9.709 1.953
316 2HD PRO 39 HD1 PRO 39 93.608 -9.141 0.374
317 H SER 40 HN SER 40 93.900 -8.583 3.996
318 HA SER 40 HA SER 40 93.175 -7.346 6.443
319 1HB SER 40 HB2 SER 40 95.023 -9.680 5.884
320 2HB SER 40 HB1 SER 40 94.472 -9.205 7.490
321 HG SER 40 HG SER 40 92.884 -10.105 5.320
322 H GLN 41 HN GLN 41 95.785 -6.874 4.362
323 HA GLN 41 HA GLN 41 97.663 -6.015 6.406
324 1HB GLN 41 HB2 GLN 41 97.831 -6.022 3.391
325 2HB GLN 41 HB1 GLN 41 99.148 -5.595 4.477
326 1HG GLN 41 HG2 GLN 41 97.815 -8.266 4.651
327 2HG GLN 41 HG1 GLN 41 99.101 -7.954 3.487
328 1HE2 GLN 41 HE21 GLN 41 98.324 -7.819 6.927
329 2HE2 GLN 41 HE22 GLN 41 99.932 -8.116 7.484
330 H SER 42 HN SER 42 95.139 -4.664 4.642
331 HA SER 42 HA SER 42 95.770 -2.224 3.754
332 1HB SER 42 HB2 SER 42 93.557 -1.423 4.765
333 2HB SER 42 HB1 SER 42 93.502 -2.815 3.683
334 HG SER 42 HG SER 42 93.347 -4.159 5.464
335 H ALA 43 HN ALA 43 95.569 -3.002 7.235
336 HA ALA 43 HA ALA 43 95.993 -0.273 8.004
337 1HB ALA 43 HB1 ALA 43 94.980 -1.220 9.767
338 2HB ALA 43 HB2 ALA 43 96.609 -1.714 10.227
339 3HB ALA 43 HB3 ALA 43 95.560 -2.835 9.359
340 H ASN 44 HN ASN 44 97.996 -3.162 7.723
341 HA ASN 44 HA ASN 44 100.342 -2.061 8.840
342 1HB ASN 44 HB2 ASN 44 99.553 -4.544 7.844
343 2HB ASN 44 HB1 ASN 44 100.859 -4.043 6.775
344 1HD2 ASN 44 HD21 ASN 44 100.571 -6.101 8.961
345 2HD2 ASN 44 HD22 ASN 44 101.943 -5.833 9.976
346 H LEU 45 HN LEU 45 99.096 -2.209 5.539
347 HA LEU 45 HA LEU 45 101.418 -0.948 4.405
348 1HB LEU 45 HB2 LEU 45 98.736 -1.768 3.343
349 2HB LEU 45 HB1 LEU 45 99.810 -0.767 2.384
350 HG LEU 45 HG LEU 45 99.937 -3.201 1.855
351 1HD1 LEU 45 HD11 LEU 45 102.487 -3.306 2.102
352 2HD1 LEU 45 HD12 LEU 45 102.346 -1.699 2.813
353 3HD1 LEU 45 HD13 LEU 45 101.797 -1.984 1.161
354 1HD2 LEU 45 HD21 LEU 45 100.623 -4.785 3.350
355 2HD2 LEU 45 HD22 LEU 45 99.741 -3.705 4.431
356 3HD2 LEU 45 HD23 LEU 45 101.501 -3.625 4.348
357 H LEU 46 HN LEU 46 98.056 0.028 5.032
358 HA LEU 46 HA LEU 46 98.202 2.617 4.035
359 1HB LEU 46 HB2 LEU 46 96.103 1.547 4.642
360 2HB LEU 46 HB1 LEU 46 96.555 1.575 6.335
361 HG LEU 46 HG LEU 46 94.888 3.336 5.513
362 1HD1 LEU 46 HD11 LEU 46 97.046 4.847 6.783
363 2HD1 LEU 46 HD12 LEU 46 96.674 3.312 7.568
364 3HD1 LEU 46 HD13 LEU 46 95.406 4.516 7.340
365 1HD2 LEU 46 HD21 LEU 46 95.609 5.170 4.307
366 2HD2 LEU 46 HD22 LEU 46 96.462 3.848 3.512
367 3HD2 LEU 46 HD23 LEU 46 97.309 4.874 4.670
368 H ALA 47 HN ALA 47 98.518 1.657 7.482
369 HA ALA 47 HA ALA 47 99.217 4.196 8.406
370 1HB ALA 47 HB1 ALA 47 99.775 1.452 9.504
371 2HB ALA 47 HB2 ALA 47 98.498 2.574 9.974
372 3HB ALA 47 HB3 ALA 47 100.180 2.938 10.364
373 H GLU 48 HN GLU 48 101.225 1.548 7.202
374 HA GLU 48 HA GLU 48 103.715 2.675 7.886
375 1HB GLU 48 HB2 GLU 48 102.797 0.561 5.998
376 2HB GLU 48 HB1 GLU 48 104.420 1.198 5.793
377 1HG GLU 48 HG2 GLU 48 104.181 -0.881 7.208
378 2HG GLU 48 HG1 GLU 48 105.108 0.448 7.900
379 H ALA 49 HN ALA 49 101.736 2.901 4.957
380 HA ALA 49 HA ALA 49 103.631 4.494 3.530
381 1HB ALA 49 HB1 ALA 49 100.713 4.438 2.876
382 2HB ALA 49 HB2 ALA 49 101.717 3.013 2.610
383 3HB ALA 49 HB3 ALA 49 102.101 4.527 1.791
384 H LYS 50 HN LYS 50 100.820 5.168 5.537
385 HA LYS 50 HA LYS 50 100.526 7.886 4.928
386 1HB LYS 50 HB2 LYS 50 99.422 6.031 6.786
387 2HB LYS 50 HB1 LYS 50 99.898 7.468 7.680
388 1HG LYS 50 HG2 LYS 50 98.366 7.808 5.154
389 2HG LYS 50 HG1 LYS 50 97.516 7.257 6.600
390 1HD LYS 50 HD2 LYS 50 97.821 9.237 7.700
391 2HD LYS 50 HD1 LYS 50 99.330 9.597 6.860
392 1HE LYS 50 HE2 LYS 50 98.282 10.754 5.261
393 2HE LYS 50 HE1 LYS 50 97.037 9.521 5.069
394 1HZ LYS 50 HZ1 LYS 50 95.630 10.636 6.376
395 2HZ LYS 50 HZ2 LYS 50 96.631 11.972 6.104
396 3HZ LYS 50 HZ3 LYS 50 96.820 11.048 7.507
397 H LYS 51 HN LYS 51 102.336 6.334 7.583
398 HA LYS 51 HA LYS 51 103.410 8.780 8.555
399 1HB LYS 51 HB2 LYS 51 104.894 7.334 9.902
400 2HB LYS 51 HB1 LYS 51 103.204 6.866 10.024
401 1HG LYS 51 HG2 LYS 51 103.934 4.798 9.636
402 2HG LYS 51 HG1 LYS 51 104.081 5.311 7.954
403 1HD LYS 51 HD2 LYS 51 106.424 6.060 8.507
404 2HD LYS 51 HD1 LYS 51 106.233 5.247 10.061
405 1HE LYS 51 HE2 LYS 51 105.482 3.574 7.798
406 2HE LYS 51 HE1 LYS 51 107.161 4.104 7.732
407 1HZ LYS 51 HZ1 LYS 51 106.126 3.053 10.265
408 2HZ LYS 51 HZ2 LYS 51 107.690 2.974 9.624
409 3HZ LYS 51 HZ3 LYS 51 106.479 1.956 9.025
410 H LEU 52 HN LEU 52 104.584 6.296 6.331
411 HA LEU 52 HA LEU 52 107.235 7.084 6.105
412 1HB LEU 52 HB2 LEU 52 105.681 5.213 4.876
413 2HB LEU 52 HB1 LEU 52 105.954 6.338 3.563
414 HG LEU 52 HG LEU 52 107.626 4.635 3.441
415 1HD1 LEU 52 HD11 LEU 52 109.620 5.937 3.482
416 2HD1 LEU 52 HD12 LEU 52 108.943 7.044 4.676
417 3HD1 LEU 52 HD13 LEU 52 108.295 7.012 3.036
418 1HD2 LEU 52 HD21 LEU 52 108.106 5.255 6.347
419 2HD2 LEU 52 HD22 LEU 52 109.232 4.331 5.354
420 3HD2 LEU 52 HD23 LEU 52 107.600 3.724 5.634
421 H ASN 53 HN ASN 53 104.505 8.110 4.063
422 HA ASN 53 HA ASN 53 105.884 9.953 2.512
423 1HB ASN 53 HB2 ASN 53 103.616 9.177 1.996
424 2HB ASN 53 HB1 ASN 53 102.990 10.054 3.388
425 1HD2 ASN 53 HD21 ASN 53 101.889 11.733 2.709
426 2HD2 ASN 53 HD22 ASN 53 102.367 12.831 1.464
427 H ASP 54 HN ASP 54 104.524 10.337 5.745
428 HA ASP 54 HA ASP 54 104.635 13.152 5.843
429 1HB ASP 54 HB2 ASP 54 104.505 10.983 7.903
430 2HB ASP 54 HB1 ASP 54 104.804 12.644 8.409
431 H ALA 55 HN ALA 55 106.902 10.744 7.211
432 HA ALA 55 HA ALA 55 108.828 12.781 7.849
433 1HB ALA 55 HB1 ALA 55 109.731 9.980 7.768
434 2HB ALA 55 HB2 ALA 55 108.361 10.312 8.828
435 3HB ALA 55 HB3 ALA 55 109.877 11.187 9.045
436 H GLN 56 HN GLN 56 108.302 10.566 5.218
437 HA GLN 56 HA GLN 56 110.892 10.901 4.039
438 1HB GLN 56 HB2 GLN 56 109.310 8.887 3.821
439 2HB GLN 56 HB1 GLN 56 108.445 9.854 2.634
440 1HG GLN 56 HG2 GLN 56 111.176 9.958 1.954
441 2HG GLN 56 HG1 GLN 56 110.793 8.276 2.306
442 1HE2 GLN 56 HE21 GLN 56 111.193 10.167 -0.169
443 2HE2 GLN 56 HE22 GLN 56 109.961 9.615 -1.247
444 H ALA 57 HN ALA 57 107.961 12.685 4.001
445 HA ALA 57 HA ALA 57 108.151 13.834 1.417
446 1HB ALA 57 HB1 ALA 57 106.073 14.208 2.269
447 2HB ALA 57 HB2 ALA 57 106.830 15.734 2.728
448 3HB ALA 57 HB3 ALA 57 106.668 14.438 3.913
449 HA PRO 58 HA PRO 58 111.803 16.264 2.446
450 1HB PRO 58 HB2 PRO 58 112.110 17.386 -0.027
451 2HB PRO 58 HB1 PRO 58 112.671 15.760 0.380
452 1HG PRO 58 HG2 PRO 58 110.177 16.605 -1.038
453 2HG PRO 58 HG1 PRO 58 111.268 15.254 -1.398
454 1HD PRO 58 HD2 PRO 58 108.915 14.915 -0.113
455 2HD PRO 58 HD1 PRO 58 110.334 13.904 0.222
456 H LYS 59 HN LYS 59 110.007 17.351 3.713
457 HA LYS 59 HA LYS 59 110.252 20.013 3.851
458 1HB LYS 59 HB2 LYS 59 108.288 20.996 2.729
459 2HB LYS 59 HB1 LYS 59 109.374 20.269 1.567
460 1HG LYS 59 HG2 LYS 59 107.891 18.228 1.631
461 2HG LYS 59 HG1 LYS 59 106.742 19.212 2.540
462 1HD LYS 59 HD2 LYS 59 107.089 20.893 0.554
463 2HD LYS 59 HD1 LYS 59 107.609 19.443 -0.306
464 1HE LYS 59 HE2 LYS 59 105.302 19.653 -0.745
465 2HE LYS 59 HE1 LYS 59 105.444 18.375 0.462
466 1HZ LYS 59 HZ1 LYS 59 104.558 21.172 0.868
467 2HZ LYS 59 HZ2 LYS 59 104.996 20.165 2.155
468 3HZ LYS 59 HZ3 LYS 59 103.691 19.749 1.163
469 H ALA 60 HN ALA 60 107.377 20.694 4.245
470 HA ALA 60 HA ALA 60 105.668 20.351 5.708
471 1HB ALA 60 HB1 ALA 60 106.553 17.735 5.148
472 2HB ALA 60 HB2 ALA 60 105.004 18.232 5.839
473 3HB ALA 60 HB3 ALA 60 106.357 17.835 6.900
Start of MODEL 20
1 1H GLY -1 HT1 GLY -1 76.207 -6.466 -4.951
2 2H GLY -1 HT2 GLY -1 74.747 -7.058 -4.336
3 3H GLY -1 HT3 GLY -1 75.570 -7.920 -5.537
4 1HA GLY -1 HA1 GLY -1 75.728 -8.450 -2.910
5 2HA GLY -1 HA2 GLY -1 76.933 -8.917 -4.100
6 H SER 0 HN SER 0 77.104 -8.145 -1.198
7 HA SER 0 HA SER 0 78.656 -5.695 -1.278
8 1HB SER 0 HB2 SER 0 77.246 -5.935 0.641
9 2HB SER 0 HB1 SER 0 77.874 -7.548 0.978
10 HG SER 0 HG SER 0 79.733 -6.689 1.709
11 H THR 1 HN THR 1 79.612 -8.442 0.709
12 HA THR 1 HA THR 1 82.336 -8.140 0.032
13 HB THR 1 HB THR 1 81.710 -9.017 2.195
14 HG1 THR 1 HG1 THR 1 82.979 -10.943 2.175
15 1HG2 THR 1 HG21 THR 1 79.829 -10.547 0.806
16 2HG2 THR 1 HG22 THR 1 80.138 -10.526 2.542
17 3HG2 THR 1 HG23 THR 1 80.967 -11.693 1.513
18 H ALA 2 HN ALA 2 83.643 -10.125 -0.691
19 HA ALA 2 HA ALA 2 82.540 -12.083 -2.312
20 1HB ALA 2 HB1 ALA 2 82.384 -11.291 -4.414
21 2HB ALA 2 HB2 ALA 2 83.760 -10.207 -4.215
22 3HB ALA 2 HB3 ALA 2 82.179 -9.751 -3.581
23 H ASP 3 HN ASP 3 85.097 -10.581 -0.919
24 HA ASP 3 HA ASP 3 86.925 -12.486 -0.795
25 1HB ASP 3 HB2 ASP 3 86.860 -11.494 -3.572
26 2HB ASP 3 HB1 ASP 3 88.465 -11.516 -2.848
27 H ASN 4 HN ASN 4 86.048 -9.261 -1.012
28 HA ASN 4 HA ASN 4 87.777 -8.365 0.968
29 1HB ASN 4 HB2 ASN 4 89.207 -6.800 -0.508
30 2HB ASN 4 HB1 ASN 4 89.678 -8.489 -0.388
31 1HD2 ASN 4 HD21 ASN 4 89.593 -9.780 -2.169
32 2HD2 ASN 4 HD22 ASN 4 89.241 -9.194 -3.755
33 H LYS 5 HN LYS 5 86.645 -7.001 -2.134
34 HA LYS 5 HA LYS 5 85.091 -5.405 -2.601
35 1HB LYS 5 HB2 LYS 5 83.820 -6.548 -0.705
36 2HB LYS 5 HB1 LYS 5 84.411 -5.255 0.328
37 1HG LYS 5 HG2 LYS 5 82.181 -4.751 -0.432
38 2HG LYS 5 HG1 LYS 5 83.327 -3.609 -1.137
39 1HD LYS 5 HD2 LYS 5 82.864 -6.004 -2.759
40 2HD LYS 5 HD1 LYS 5 81.432 -4.998 -2.530
41 1HE LYS 5 HE2 LYS 5 83.959 -3.619 -3.228
42 2HE LYS 5 HE1 LYS 5 83.196 -4.585 -4.490
43 1HZ LYS 5 HZ1 LYS 5 81.359 -3.239 -4.539
44 2HZ LYS 5 HZ2 LYS 5 82.560 -2.101 -4.186
45 3HZ LYS 5 HZ3 LYS 5 81.563 -2.687 -2.952
46 H PHE 6 HN PHE 6 86.711 -4.678 0.509
47 HA PHE 6 HA PHE 6 87.868 -2.873 1.219
48 1HB PHE 6 HB2 PHE 6 88.165 -2.660 -1.737
49 2HB PHE 6 HB1 PHE 6 88.591 -1.252 -0.773
50 HD1 PHE 6 HD1 PHE 6 90.767 -1.064 -0.075
51 HD2 PHE 6 HD2 PHE 6 89.157 -4.938 -0.775
52 HE1 PHE 6 HE1 PHE 6 92.959 -2.059 0.427
53 HE2 PHE 6 HE2 PHE 6 91.347 -5.945 -0.274
54 HZ PHE 6 HZ PHE 6 93.257 -4.507 0.333
55 H ASN 7 HN ASN 7 85.566 -2.461 1.992
56 HA ASN 7 HA ASN 7 83.786 -0.703 0.893
57 1HB ASN 7 HB2 ASN 7 84.545 -0.985 3.804
58 2HB ASN 7 HB1 ASN 7 83.103 -0.155 3.225
59 1HD2 ASN 7 HD21 ASN 7 81.320 -1.305 3.006
60 2HD2 ASN 7 HD22 ASN 7 81.226 -3.030 2.975
61 H LYS 8 HN LYS 8 83.299 1.508 2.147
62 HA LYS 8 HA LYS 8 84.952 3.429 1.044
63 1HB LYS 8 HB2 LYS 8 83.754 5.054 2.393
64 2HB LYS 8 HB1 LYS 8 82.639 3.842 1.777
65 1HG LYS 8 HG2 LYS 8 83.768 3.294 4.440
66 2HG LYS 8 HG1 LYS 8 82.692 4.686 4.330
67 1HD LYS 8 HD2 LYS 8 80.880 3.395 4.099
68 2HD LYS 8 HD1 LYS 8 81.670 2.359 2.909
69 1HE LYS 8 HE2 LYS 8 81.840 0.764 4.443
70 2HE LYS 8 HE1 LYS 8 82.875 1.818 5.405
71 1HZ LYS 8 HZ1 LYS 8 79.966 2.172 5.554
72 2HZ LYS 8 HZ2 LYS 8 81.146 2.458 6.732
73 3HZ LYS 8 HZ3 LYS 8 80.669 0.874 6.381
74 H GLU 9 HN GLU 9 85.217 1.828 4.133
75 HA GLU 9 HA GLU 9 87.103 3.688 5.233
76 1HB GLU 9 HB2 GLU 9 86.094 0.979 6.046
77 2HB GLU 9 HB1 GLU 9 87.458 1.713 6.879
78 1HG GLU 9 HG2 GLU 9 86.058 3.654 7.425
79 2HG GLU 9 HG1 GLU 9 84.692 2.875 6.629
80 H GLN 10 HN GLN 10 87.307 0.477 3.755
81 HA GLN 10 HA GLN 10 90.139 0.279 4.060
82 1HB GLN 10 HB2 GLN 10 88.275 -1.561 3.760
83 2HB GLN 10 HB1 GLN 10 88.638 -1.336 2.055
84 1HG GLN 10 HG2 GLN 10 90.262 -2.814 2.324
85 2HG GLN 10 HG1 GLN 10 91.124 -1.569 3.226
86 1HE2 GLN 10 HE21 GLN 10 91.690 -4.119 3.785
87 2HE2 GLN 10 HE22 GLN 10 91.049 -4.572 5.318
88 H GLN 11 HN GLN 11 88.016 0.910 1.264
89 HA GLN 11 HA GLN 11 90.042 1.064 -0.661
90 1HB GLN 11 HB2 GLN 11 87.722 0.866 -1.305
91 2HB GLN 11 HB1 GLN 11 87.341 2.414 -0.563
92 1HG GLN 11 HG2 GLN 11 88.004 3.562 -2.355
93 2HG GLN 11 HG1 GLN 11 89.454 2.581 -2.563
94 1HE2 GLN 11 HE21 GLN 11 86.822 3.536 -4.116
95 2HE2 GLN 11 HE22 GLN 11 86.516 2.165 -5.123
96 H ASN 12 HN ASN 12 88.980 3.342 1.737
97 HA ASN 12 HA ASN 12 89.856 5.744 0.678
98 1HB ASN 12 HB2 ASN 12 88.674 5.240 2.933
99 2HB ASN 12 HB1 ASN 12 90.305 5.058 3.573
100 1HD2 ASN 12 HD21 ASN 12 91.579 6.838 3.852
101 2HD2 ASN 12 HD22 ASN 12 91.001 8.456 3.673
102 H ALA 13 HN ALA 13 91.698 3.175 2.265
103 HA ALA 13 HA ALA 13 94.126 4.477 2.592
104 1HB ALA 13 HB1 ALA 13 93.478 1.599 2.011
105 2HB ALA 13 HB2 ALA 13 93.885 2.340 3.558
106 3HB ALA 13 HB3 ALA 13 95.123 2.158 2.316
107 H PHE 14 HN PHE 14 92.797 2.875 -0.277
108 HA PHE 14 HA PHE 14 95.037 2.927 -1.920
109 1HB PHE 14 HB2 PHE 14 93.005 1.759 -2.531
110 2HB PHE 14 HB1 PHE 14 92.114 3.263 -2.607
111 HD1 PHE 14 HD1 PHE 14 92.115 4.600 -4.537
112 HD2 PHE 14 HD2 PHE 14 94.776 1.292 -4.248
113 HE1 PHE 14 HE1 PHE 14 92.656 4.833 -6.925
114 HE2 PHE 14 HE2 PHE 14 95.321 1.522 -6.639
115 HZ PHE 14 HZ PHE 14 94.261 3.292 -7.978
116 H TRP 15 HN TRP 15 92.396 5.272 -1.808
117 HA TRP 15 HA TRP 15 93.446 7.103 -3.605
118 1HB TRP 15 HB2 TRP 15 91.183 6.956 -1.999
119 2HB TRP 15 HB1 TRP 15 91.981 8.445 -1.502
120 HD1 TRP 15 HD1 TRP 15 91.404 6.861 -5.008
121 HE1 TRP 15 HE1 TRP 15 90.420 8.683 -6.540
122 HE3 TRP 15 HE3 TRP 15 91.151 10.704 -1.644
123 HZ2 TRP 15 HZ2 TRP 15 89.643 11.391 -6.347
124 HZ3 TRP 15 HZ3 TRP 15 90.279 12.878 -2.399
125 HH2 TRP 15 HH2 TRP 15 89.541 13.212 -4.702
126 H GLU 16 HN GLU 16 93.809 7.135 -0.050
127 HA GLU 16 HA GLU 16 95.362 9.525 -0.076
128 1HB GLU 16 HB2 GLU 16 95.606 9.283 2.191
129 2HB GLU 16 HB1 GLU 16 94.235 8.218 1.942
130 1HG GLU 16 HG2 GLU 16 95.640 6.282 2.050
131 2HG GLU 16 HG1 GLU 16 97.092 7.282 2.081
132 H ILE 17 HN ILE 17 96.375 6.133 0.261
133 HA ILE 17 HA ILE 17 99.090 6.443 0.132
134 HB ILE 17 HB ILE 17 97.478 4.225 -1.142
135 1HG1 ILE 17 HG12 ILE 17 98.942 4.107 1.481
136 2HG1 ILE 17 HG11 ILE 17 97.311 4.762 1.393
137 1HG2 ILE 17 HG21 ILE 17 99.440 2.896 -1.196
138 2HG2 ILE 17 HG22 ILE 17 100.365 4.099 -0.297
139 3HG2 ILE 17 HG23 ILE 17 99.859 4.432 -1.953
140 1HD1 ILE 17 HD11 ILE 17 98.183 1.985 0.637
141 2HD1 ILE 17 HD12 ILE 17 96.556 2.626 0.408
142 3HD1 ILE 17 HD13 ILE 17 97.216 2.455 2.035
143 H LEU 18 HN LEU 18 96.843 6.272 -2.602
144 HA LEU 18 HA LEU 18 98.697 6.281 -4.668
145 1HB LEU 18 HB2 LEU 18 95.838 6.878 -4.354
146 2HB LEU 18 HB1 LEU 18 96.594 7.717 -5.698
147 HG LEU 18 HG LEU 18 95.624 5.676 -6.503
148 1HD1 LEU 18 HD11 LEU 18 97.490 6.045 -7.775
149 2HD1 LEU 18 HD12 LEU 18 97.840 4.438 -7.142
150 3HD1 LEU 18 HD13 LEU 18 98.597 5.856 -6.415
151 1HD2 LEU 18 HD21 LEU 18 95.411 4.281 -4.665
152 2HD2 LEU 18 HD22 LEU 18 97.107 4.446 -4.214
153 3HD2 LEU 18 HD23 LEU 18 96.659 3.488 -5.624
154 H HIS 19 HN HIS 19 97.362 8.976 -2.846
155 HA HIS 19 HA HIS 19 98.521 10.965 -4.552
156 1HB HIS 19 HB2 HIS 19 96.502 10.985 -2.723
157 2HB HIS 19 HB1 HIS 19 97.790 11.767 -1.814
158 HD1 HIS 19 HD1 HIS 19 96.316 12.112 -5.316
159 HD2 HIS 19 HD2 HIS 19 97.768 14.434 -2.191
160 HE1 HIS 19 HE1 HIS 19 96.034 14.496 -6.062
161 HE2 HIS 19 HE2 HIS 19 96.831 15.884 -4.116
162 H LEU 20 HN LEU 20 99.149 10.082 -1.166
163 HA LEU 20 HA LEU 20 100.862 10.921 0.157
164 1HB LEU 20 HB2 LEU 20 102.070 8.856 -1.631
165 2HB LEU 20 HB1 LEU 20 102.883 9.492 -0.228
166 HG LEU 20 HG LEU 20 100.692 7.533 -0.399
167 1HD1 LEU 20 HD11 LEU 20 101.898 7.234 2.005
168 2HD1 LEU 20 HD12 LEU 20 103.185 7.999 1.072
169 3HD1 LEU 20 HD13 LEU 20 102.460 6.495 0.505
170 1HD2 LEU 20 HD21 LEU 20 99.427 9.309 0.623
171 2HD2 LEU 20 HD22 LEU 20 100.732 9.633 1.763
172 3HD2 LEU 20 HD23 LEU 20 99.839 8.115 1.854
173 HA PRO 21 HA PRO 21 102.734 13.927 -2.910
174 1HB PRO 21 HB2 PRO 21 101.842 15.810 -0.807
175 2HB PRO 21 HB1 PRO 21 101.660 15.920 -2.560
176 1HG PRO 21 HG2 PRO 21 99.573 15.380 -0.967
177 2HG PRO 21 HG1 PRO 21 99.732 14.649 -2.575
178 1HD PRO 21 HD2 PRO 21 100.257 13.454 0.115
179 2HD PRO 21 HD1 PRO 21 99.538 12.714 -1.329
180 H ASN 22 HN ASN 22 104.752 13.130 -2.386
181 HA ASN 22 HA ASN 22 106.778 14.230 -1.444
182 1HB ASN 22 HB2 ASN 22 107.061 14.436 0.942
183 2HB ASN 22 HB1 ASN 22 105.607 15.294 0.457
184 1HD2 ASN 22 HD21 ASN 22 105.190 15.130 2.772
185 2HD2 ASN 22 HD22 ASN 22 104.413 13.714 3.378
186 H LEU 23 HN LEU 23 105.125 11.419 -1.411
187 HA LEU 23 HA LEU 23 107.410 9.888 -0.358
188 1HB LEU 23 HB2 LEU 23 105.321 9.251 0.684
189 2HB LEU 23 HB1 LEU 23 104.548 9.086 -0.880
190 HG LEU 23 HG LEU 23 106.650 7.312 -1.064
191 1HD1 LEU 23 HD11 LEU 23 107.377 7.015 1.044
192 2HD1 LEU 23 HD12 LEU 23 105.945 5.990 1.175
193 3HD1 LEU 23 HD13 LEU 23 105.897 7.655 1.759
194 1HD2 LEU 23 HD21 LEU 23 104.453 5.847 -0.129
195 2HD2 LEU 23 HD22 LEU 23 104.881 6.194 -1.804
196 3HD2 LEU 23 HD23 LEU 23 103.782 7.264 -0.935
197 H ASN 24 HN ASN 24 108.433 8.367 -1.717
198 HA ASN 24 HA ASN 24 108.557 8.975 -4.437
199 1HB ASN 24 HB2 ASN 24 110.040 7.380 -2.876
200 2HB ASN 24 HB1 ASN 24 109.021 6.143 -3.604
201 1HD2 ASN 24 HD21 ASN 24 110.531 9.116 -4.819
202 2HD2 ASN 24 HD22 ASN 24 111.337 8.364 -6.149
203 H GLU 25 HN GLU 25 106.894 8.828 -5.890
204 HA GLU 25 HA GLU 25 104.509 7.560 -5.341
205 1HB GLU 25 HB2 GLU 25 103.925 7.995 -7.627
206 2HB GLU 25 HB1 GLU 25 104.878 9.346 -7.007
207 1HG GLU 25 HG2 GLU 25 106.371 7.199 -8.393
208 2HG GLU 25 HG1 GLU 25 105.309 8.193 -9.390
209 H GLU 26 HN GLU 26 107.475 6.228 -6.431
210 HA GLU 26 HA GLU 26 106.441 3.790 -7.533
211 1HB GLU 26 HB2 GLU 26 108.749 4.748 -7.984
212 2HB GLU 26 HB1 GLU 26 109.188 4.260 -6.353
213 1HG GLU 26 HG2 GLU 26 108.379 1.916 -7.112
214 2HG GLU 26 HG1 GLU 26 108.590 2.568 -8.737
215 H GLN 27 HN GLN 27 107.162 5.085 -4.469
216 HA GLN 27 HA GLN 27 107.137 2.606 -2.975
217 1HB GLN 27 HB2 GLN 27 107.740 5.355 -2.393
218 2HB GLN 27 HB1 GLN 27 106.509 4.796 -1.272
219 1HG GLN 27 HG2 GLN 27 107.897 3.305 -0.267
220 2HG GLN 27 HG1 GLN 27 108.856 3.045 -1.723
221 1HE2 GLN 27 HE21 GLN 27 110.835 3.376 -0.831
222 2HE2 GLN 27 HE22 GLN 27 111.363 4.895 -0.200
223 H ARG 28 HN ARG 28 104.982 5.245 -3.815
224 HA ARG 28 HA ARG 28 102.733 4.531 -2.315
225 1HB ARG 28 HB2 ARG 28 103.084 5.965 -4.942
226 2HB ARG 28 HB1 ARG 28 101.476 5.618 -4.322
227 1HG ARG 28 HG2 ARG 28 102.255 6.796 -2.186
228 2HG ARG 28 HG1 ARG 28 103.586 7.405 -3.172
229 1HD ARG 28 HD2 ARG 28 101.115 7.771 -4.564
230 2HD ARG 28 HD1 ARG 28 100.962 8.429 -2.957
231 HE ARG 28 HE ARG 28 102.837 9.861 -3.424
232 1HH1 ARG 28 HH11 ARG 28 101.485 8.220 -6.203
233 2HH1 ARG 28 HH12 ARG 28 102.139 9.351 -7.336
234 1HH2 ARG 28 HH21 ARG 28 103.691 11.338 -4.919
235 2HH2 ARG 28 HH22 ARG 28 103.391 11.117 -6.611
236 H ASN 29 HN ASN 29 103.609 3.701 -5.668
237 HA ASN 29 HA ASN 29 101.515 1.999 -6.263
238 1HB ASN 29 HB2 ASN 29 103.237 2.809 -7.877
239 2HB ASN 29 HB1 ASN 29 104.383 1.675 -7.167
240 1HD2 ASN 29 HD21 ASN 29 101.017 1.583 -8.300
241 2HD2 ASN 29 HD22 ASN 29 101.198 0.150 -9.248
242 H GLY 30 HN GLY 30 104.677 1.204 -4.801
243 1HA GLY 30 HA2 GLY 30 104.325 -1.553 -4.562
244 2HA GLY 30 HA1 GLY 30 105.292 -0.573 -3.468
245 H PHE 31 HN PHE 31 103.223 1.057 -2.483
246 HA PHE 31 HA PHE 31 102.237 -0.550 -0.381
247 1HB PHE 31 HB2 PHE 31 102.067 2.276 -1.202
248 2HB PHE 31 HB1 PHE 31 100.685 1.699 -0.277
249 HD1 PHE 31 HD1 PHE 31 103.769 3.249 0.006
250 HD2 PHE 31 HD2 PHE 31 101.419 0.199 1.816
251 HE1 PHE 31 HE1 PHE 31 105.041 3.511 2.091
252 HE2 PHE 31 HE2 PHE 31 102.688 0.450 3.905
253 HZ PHE 31 HZ PHE 31 104.503 2.114 4.048
254 H ILE 32 HN ILE 32 100.906 0.499 -3.434
255 HA ILE 32 HA ILE 32 98.198 -0.195 -2.870
256 HB ILE 32 HB ILE 32 99.198 -0.251 -5.678
257 1HG1 ILE 32 HG12 ILE 32 98.950 2.252 -3.994
258 2HG1 ILE 32 HG11 ILE 32 100.401 1.644 -4.781
259 1HG2 ILE 32 HG21 ILE 32 96.722 0.701 -4.269
260 2HG2 ILE 32 HG22 ILE 32 96.887 -0.620 -5.425
261 3HG2 ILE 32 HG23 ILE 32 97.047 1.050 -5.967
262 1HD1 ILE 32 HD11 ILE 32 99.101 3.593 -5.853
263 2HD1 ILE 32 HD12 ILE 32 97.998 2.334 -6.407
264 3HD1 ILE 32 HD13 ILE 32 99.695 2.288 -6.879
265 H GLN 33 HN GLN 33 100.830 -1.852 -4.569
266 HA GLN 33 HA GLN 33 99.309 -4.097 -5.339
267 1HB GLN 33 HB2 GLN 33 101.611 -5.271 -5.374
268 2HB GLN 33 HB1 GLN 33 101.312 -3.950 -6.491
269 1HG GLN 33 HG2 GLN 33 102.409 -2.500 -4.624
270 2HG GLN 33 HG1 GLN 33 103.071 -4.043 -4.090
271 1HE2 GLN 33 HE21 GLN 33 102.706 -2.022 -6.972
272 2HE2 GLN 33 HE22 GLN 33 104.225 -2.446 -7.678
273 H SER 34 HN SER 34 101.424 -3.605 -2.520
274 HA SER 34 HA SER 34 100.993 -6.141 -1.377
275 1HB SER 34 HB2 SER 34 102.737 -4.287 -0.789
276 2HB SER 34 HB1 SER 34 101.490 -3.706 0.315
277 HG SER 34 HG SER 34 103.072 -5.962 0.455
278 H LEU 35 HN LEU 35 99.298 -3.064 -0.943
279 HA LEU 35 HA LEU 35 97.496 -4.094 1.044
280 1HB LEU 35 HB2 LEU 35 97.824 -1.804 1.232
281 2HB LEU 35 HB1 LEU 35 97.738 -1.544 -0.498
282 HG LEU 35 HG LEU 35 95.337 -1.818 -0.480
283 1HD1 LEU 35 HD11 LEU 35 94.449 -3.172 1.041
284 2HD1 LEU 35 HD12 LEU 35 94.578 -1.835 2.182
285 3HD1 LEU 35 HD13 LEU 35 95.860 -3.042 2.089
286 1HD2 LEU 35 HD21 LEU 35 96.737 0.259 0.828
287 2HD2 LEU 35 HD22 LEU 35 95.262 -0.038 1.748
288 3HD2 LEU 35 HD23 LEU 35 95.168 0.334 0.027
289 H LYS 36 HN LYS 36 97.351 -3.516 -2.443
290 HA LYS 36 HA LYS 36 94.593 -3.966 -2.697
291 1HB LYS 36 HB2 LYS 36 94.869 -3.881 -5.017
292 2HB LYS 36 HB1 LYS 36 96.088 -2.803 -4.364
293 1HG LYS 36 HG2 LYS 36 97.540 -3.864 -5.658
294 2HG LYS 36 HG1 LYS 36 97.396 -5.232 -4.552
295 1HD LYS 36 HD2 LYS 36 95.184 -5.343 -6.311
296 2HD LYS 36 HD1 LYS 36 96.614 -5.038 -7.298
297 1HE LYS 36 HE2 LYS 36 96.474 -7.206 -5.218
298 2HE LYS 36 HE1 LYS 36 96.038 -7.462 -6.906
299 1HZ LYS 36 HZ1 LYS 36 98.223 -7.048 -7.597
300 2HZ LYS 36 HZ2 LYS 36 98.388 -8.043 -6.240
301 3HZ LYS 36 HZ3 LYS 36 98.676 -6.382 -6.109
302 H ASP 37 HN ASP 37 97.286 -6.394 -2.705
303 HA ASP 37 HA ASP 37 95.392 -8.375 -3.642
304 1HB ASP 37 HB2 ASP 37 97.418 -9.899 -3.268
305 2HB ASP 37 HB1 ASP 37 97.551 -8.695 -4.543
306 H ASP 38 HN ASP 38 96.386 -6.984 -0.724
307 HA ASP 38 HA ASP 38 95.161 -9.191 0.780
308 1HB ASP 38 HB2 ASP 38 97.829 -8.823 0.837
309 2HB ASP 38 HB1 ASP 38 97.355 -7.715 2.121
310 HA PRO 39 HA PRO 39 92.980 -5.558 2.309
311 1HB PRO 39 HB2 PRO 39 90.841 -6.829 3.281
312 2HB PRO 39 HB1 PRO 39 91.091 -6.663 1.539
313 1HG PRO 39 HG2 PRO 39 91.586 -9.021 3.308
314 2HG PRO 39 HG1 PRO 39 90.897 -8.971 1.676
315 1HD PRO 39 HD2 PRO 39 93.529 -9.595 2.263
316 2HD PRO 39 HD1 PRO 39 92.954 -9.010 0.691
317 H SER 40 HN SER 40 93.836 -8.447 4.090
318 HA SER 40 HA SER 40 93.238 -7.417 6.688
319 1HB SER 40 HB2 SER 40 93.644 -9.897 5.889
320 2HB SER 40 HB1 SER 40 95.327 -9.522 6.261
321 HG SER 40 HG SER 40 94.875 -9.558 8.320
322 H GLN 41 HN GLN 41 95.619 -6.736 4.421
323 HA GLN 41 HA GLN 41 97.613 -5.923 6.388
324 1HB GLN 41 HB2 GLN 41 97.695 -5.914 3.365
325 2HB GLN 41 HB1 GLN 41 99.042 -5.520 4.429
326 1HG GLN 41 HG2 GLN 41 97.659 -8.182 4.474
327 2HG GLN 41 HG1 GLN 41 99.045 -7.832 3.442
328 1HE2 GLN 41 HE21 GLN 41 97.937 -8.155 6.740
329 2HE2 GLN 41 HE22 GLN 41 99.496 -8.377 7.449
330 H SER 42 HN SER 42 94.962 -4.596 4.783
331 HA SER 42 HA SER 42 95.584 -2.132 3.880
332 1HB SER 42 HB2 SER 42 93.267 -3.335 4.525
333 2HB SER 42 HB1 SER 42 93.341 -2.134 5.813
334 HG SER 42 HG SER 42 92.660 -0.779 4.375
335 H ALA 43 HN ALA 43 95.286 -2.947 7.333
336 HA ALA 43 HA ALA 43 95.797 -0.305 8.237
337 1HB ALA 43 HB1 ALA 43 95.548 -1.138 10.338
338 2HB ALA 43 HB2 ALA 43 96.451 -2.611 9.982
339 3HB ALA 43 HB3 ALA 43 94.782 -2.445 9.435
340 H ASN 44 HN ASN 44 97.836 -3.124 7.667
341 HA ASN 44 HA ASN 44 100.195 -2.051 8.811
342 1HB ASN 44 HB2 ASN 44 99.422 -4.497 7.733
343 2HB ASN 44 HB1 ASN 44 100.685 -3.932 6.645
344 1HD2 ASN 44 HD21 ASN 44 100.072 -5.601 9.420
345 2HD2 ASN 44 HD22 ASN 44 101.639 -5.532 10.144
346 H LEU 45 HN LEU 45 98.870 -2.007 5.535
347 HA LEU 45 HA LEU 45 101.186 -0.747 4.405
348 1HB LEU 45 HB2 LEU 45 98.433 -1.385 3.405
349 2HB LEU 45 HB1 LEU 45 99.495 -0.357 2.471
350 HG LEU 45 HG LEU 45 99.609 -2.624 1.644
351 1HD1 LEU 45 HD11 LEU 45 101.966 -1.360 2.883
352 2HD1 LEU 45 HD12 LEU 45 101.680 -1.847 1.215
353 3HD1 LEU 45 HD13 LEU 45 102.146 -3.050 2.417
354 1HD2 LEU 45 HD21 LEU 45 100.380 -4.461 3.019
355 2HD2 LEU 45 HD22 LEU 45 98.921 -3.743 3.704
356 3HD2 LEU 45 HD23 LEU 45 100.496 -3.390 4.417
357 H LEU 46 HN LEU 46 97.934 0.314 5.329
358 HA LEU 46 HA LEU 46 98.110 2.961 4.482
359 1HB LEU 46 HB2 LEU 46 96.088 1.661 5.361
360 2HB LEU 46 HB1 LEU 46 96.647 2.099 6.964
361 HG LEU 46 HG LEU 46 94.843 3.568 6.051
362 1HD1 LEU 46 HD11 LEU 46 97.034 5.467 6.325
363 2HD1 LEU 46 HD12 LEU 46 97.038 4.214 7.565
364 3HD1 LEU 46 HD13 LEU 46 95.610 5.222 7.335
365 1HD2 LEU 46 HD21 LEU 46 95.145 4.948 4.229
366 2HD2 LEU 46 HD22 LEU 46 95.965 3.478 3.702
367 3HD2 LEU 46 HD23 LEU 46 96.904 4.844 4.306
368 H ALA 47 HN ALA 47 98.688 1.686 7.770
369 HA ALA 47 HA ALA 47 99.548 4.090 8.901
370 1HB ALA 47 HB1 ALA 47 98.938 2.267 10.313
371 2HB ALA 47 HB2 ALA 47 100.635 2.637 10.618
372 3HB ALA 47 HB3 ALA 47 100.200 1.242 9.630
373 H GLU 48 HN GLU 48 101.490 1.432 7.528
374 HA GLU 48 HA GLU 48 104.009 2.506 7.980
375 1HB GLU 48 HB2 GLU 48 102.915 0.631 5.913
376 2HB GLU 48 HB1 GLU 48 104.585 1.171 5.809
377 1HG GLU 48 HG2 GLU 48 103.928 0.277 8.475
378 2HG GLU 48 HG1 GLU 48 103.606 -0.970 7.272
379 H ALA 49 HN ALA 49 101.817 3.015 5.243
380 HA ALA 49 HA ALA 49 103.588 4.601 3.714
381 1HB ALA 49 HB1 ALA 49 101.888 4.778 2.230
382 2HB ALA 49 HB2 ALA 49 100.690 5.127 3.477
383 3HB ALA 49 HB3 ALA 49 101.214 3.466 3.197
384 H LYS 50 HN LYS 50 101.292 5.333 6.266
385 HA LYS 50 HA LYS 50 101.221 8.126 5.973
386 1HB LYS 50 HB2 LYS 50 100.042 6.275 7.652
387 2HB LYS 50 HB1 LYS 50 101.063 7.200 8.743
388 1HG LYS 50 HG2 LYS 50 99.547 8.806 8.798
389 2HG LYS 50 HG1 LYS 50 99.731 9.043 7.059
390 1HD LYS 50 HD2 LYS 50 98.140 7.021 6.845
391 2HD LYS 50 HD1 LYS 50 97.749 7.345 8.535
392 1HE LYS 50 HE2 LYS 50 97.531 9.342 6.285
393 2HE LYS 50 HE1 LYS 50 96.184 8.430 6.965
394 1HZ LYS 50 HZ1 LYS 50 96.944 10.860 7.799
395 2HZ LYS 50 HZ2 LYS 50 97.768 9.879 8.902
396 3HZ LYS 50 HZ3 LYS 50 96.088 9.754 8.752
397 H LYS 51 HN LYS 51 103.222 6.091 8.101
398 HA LYS 51 HA LYS 51 104.712 8.164 9.249
399 1HB LYS 51 HB2 LYS 51 105.789 5.399 8.755
400 2HB LYS 51 HB1 LYS 51 106.148 6.485 10.089
401 1HG LYS 51 HG2 LYS 51 103.413 5.328 9.652
402 2HG LYS 51 HG1 LYS 51 104.652 4.506 10.591
403 1HD LYS 51 HD2 LYS 51 104.044 5.702 12.364
404 2HD LYS 51 HD1 LYS 51 104.573 7.161 11.524
405 1HE LYS 51 HE2 LYS 51 102.296 7.185 10.417
406 2HE LYS 51 HE1 LYS 51 101.824 5.939 11.571
407 1HZ LYS 51 HZ1 LYS 51 101.589 8.575 12.001
408 2HZ LYS 51 HZ2 LYS 51 103.074 8.264 12.749
409 3HZ LYS 51 HZ3 LYS 51 101.691 7.417 13.230
410 H LEU 52 HN LEU 52 105.315 6.164 6.401
411 HA LEU 52 HA LEU 52 107.879 7.062 5.787
412 1HB LEU 52 HB2 LEU 52 106.299 5.200 4.733
413 2HB LEU 52 HB1 LEU 52 105.993 6.471 3.564
414 HG LEU 52 HG LEU 52 108.352 6.588 3.005
415 1HD1 LEU 52 HD11 LEU 52 108.634 4.620 5.252
416 2HD1 LEU 52 HD12 LEU 52 109.476 6.151 5.010
417 3HD1 LEU 52 HD13 LEU 52 109.849 4.767 3.981
418 1HD2 LEU 52 HD21 LEU 52 108.064 3.679 2.903
419 2HD2 LEU 52 HD22 LEU 52 108.225 4.853 1.597
420 3HD2 LEU 52 HD23 LEU 52 106.649 4.565 2.334
421 H ASN 53 HN ASN 53 104.779 8.195 4.465
422 HA ASN 53 HA ASN 53 105.669 10.201 2.816
423 1HB ASN 53 HB2 ASN 53 103.396 9.712 2.688
424 2HB ASN 53 HB1 ASN 53 103.170 9.817 4.428
425 1HD2 ASN 53 HD21 ASN 53 102.528 11.286 1.581
426 2HD2 ASN 53 HD22 ASN 53 102.262 12.901 2.133
427 H ASP 54 HN ASP 54 104.702 10.682 6.253
428 HA ASP 54 HA ASP 54 105.354 13.383 6.366
429 1HB ASP 54 HB2 ASP 54 105.651 13.031 8.838
430 2HB ASP 54 HB1 ASP 54 104.129 12.440 8.181
431 H ALA 55 HN ALA 55 107.437 10.589 7.138
432 HA ALA 55 HA ALA 55 109.717 12.147 7.761
433 1HB ALA 55 HB1 ALA 55 110.770 10.174 8.109
434 2HB ALA 55 HB2 ALA 55 110.143 9.452 6.627
435 3HB ALA 55 HB3 ALA 55 109.121 9.551 8.061
436 H GLN 56 HN GLN 56 108.426 10.889 4.764
437 HA GLN 56 HA GLN 56 110.773 11.535 3.227
438 1HB GLN 56 HB2 GLN 56 108.342 10.023 2.838
439 2HB GLN 56 HB1 GLN 56 108.636 11.084 1.472
440 1HG GLN 56 HG2 GLN 56 111.107 9.974 1.955
441 2HG GLN 56 HG1 GLN 56 109.988 8.647 2.264
442 1HE2 GLN 56 HE21 GLN 56 110.013 11.332 -0.058
443 2HE2 GLN 56 HE22 GLN 56 109.843 10.342 -1.463
444 H ALA 57 HN ALA 57 108.290 13.374 4.466
445 HA ALA 57 HA ALA 57 107.159 15.059 2.814
446 1HB ALA 57 HB1 ALA 57 108.162 16.989 4.339
447 2HB ALA 57 HB2 ALA 57 108.678 15.599 5.295
448 3HB ALA 57 HB3 ALA 57 106.967 15.835 4.932
449 HA PRO 58 HA PRO 58 110.108 16.900 0.108
450 1HB PRO 58 HB2 PRO 58 108.650 18.958 -0.859
451 2HB PRO 58 HB1 PRO 58 108.299 17.271 -1.238
452 1HG PRO 58 HG2 PRO 58 106.852 19.139 0.526
453 2HG PRO 58 HG1 PRO 58 106.265 17.694 -0.308
454 1HD PRO 58 HD2 PRO 58 107.032 17.950 2.432
455 2HD PRO 58 HD1 PRO 58 106.504 16.487 1.587
456 H LYS 59 HN LYS 59 108.599 19.974 0.835
457 HA LYS 59 HA LYS 59 109.580 21.978 1.357
458 1HB LYS 59 HB2 LYS 59 109.196 20.543 3.569
459 2HB LYS 59 HB1 LYS 59 110.948 20.666 3.658
460 1HG LYS 59 HG2 LYS 59 110.608 22.600 4.701
461 2HG LYS 59 HG1 LYS 59 110.181 23.249 3.117
462 1HD LYS 59 HD2 LYS 59 107.810 22.491 3.599
463 2HD LYS 59 HD1 LYS 59 108.338 22.212 5.259
464 1HE LYS 59 HE2 LYS 59 107.610 24.350 5.494
465 2HE LYS 59 HE1 LYS 59 109.256 24.690 4.964
466 1HZ LYS 59 HZ1 LYS 59 107.930 24.468 2.630
467 2HZ LYS 59 HZ2 LYS 59 108.257 25.929 3.416
468 3HZ LYS 59 HZ3 LYS 59 106.755 25.179 3.619
469 H ALA 60 HN ALA 60 112.114 22.264 2.903
470 HA ALA 60 HA ALA 60 114.331 22.572 2.508
471 1HB ALA 60 HB1 ALA 60 114.407 20.135 2.499
472 2HB ALA 60 HB2 ALA 60 115.550 20.804 1.334
473 3HB ALA 60 HB3 ALA 60 114.022 20.120 0.779
Start of MODEL 21
1 1H GLY -1 HT1 GLY -1 89.297 -5.864 -9.791
2 2H GLY -1 HT2 GLY -1 89.062 -7.497 -9.420
3 3H GLY -1 HT3 GLY -1 88.091 -6.747 -10.584
4 1HA GLY -1 HA1 GLY -1 90.417 -6.277 -11.698
5 2HA GLY -1 HA2 GLY -1 90.842 -7.717 -10.787
6 H SER 0 HN SER 0 89.619 -9.674 -11.189
7 HA SER 0 HA SER 0 88.369 -9.707 -13.858
8 1HB SER 0 HB2 SER 0 90.680 -10.713 -13.802
9 2HB SER 0 HB1 SER 0 90.052 -11.937 -12.698
10 HG SER 0 HG SER 0 89.431 -12.951 -14.418
11 H THR 1 HN THR 1 88.789 -11.849 -11.040
12 HA THR 1 HA THR 1 85.891 -12.376 -11.137
13 HB THR 1 HB THR 1 87.943 -14.354 -10.153
14 HG1 THR 1 HG1 THR 1 88.462 -14.556 -12.171
15 1HG2 THR 1 HG21 THR 1 85.174 -14.363 -10.008
16 2HG2 THR 1 HG22 THR 1 86.256 -15.736 -9.776
17 3HG2 THR 1 HG23 THR 1 85.558 -15.422 -11.364
18 H ALA 2 HN ALA 2 88.677 -11.653 -9.184
19 HA ALA 2 HA ALA 2 87.049 -10.725 -7.044
20 1HB ALA 2 HB1 ALA 2 88.103 -12.306 -5.334
21 2HB ALA 2 HB2 ALA 2 88.477 -13.344 -6.709
22 3HB ALA 2 HB3 ALA 2 86.800 -12.942 -6.338
23 H ASP 3 HN ASP 3 88.593 -10.369 -5.030
24 HA ASP 3 HA ASP 3 91.263 -10.058 -5.025
25 1HB ASP 3 HB2 ASP 3 91.584 -7.637 -5.785
26 2HB ASP 3 HB1 ASP 3 91.406 -8.842 -7.056
27 H ASN 4 HN ASN 4 88.534 -7.775 -4.733
28 HA ASN 4 HA ASN 4 88.290 -7.841 -1.990
29 1HB ASN 4 HB2 ASN 4 90.704 -6.579 -2.675
30 2HB ASN 4 HB1 ASN 4 89.605 -5.276 -2.231
31 1HD2 ASN 4 HD21 ASN 4 88.950 -5.058 -0.144
32 2HD2 ASN 4 HD22 ASN 4 89.585 -5.993 1.159
33 H LYS 5 HN LYS 5 87.374 -5.622 -1.129
34 HA LYS 5 HA LYS 5 85.966 -4.121 -3.178
35 1HB LYS 5 HB2 LYS 5 83.762 -4.512 -2.099
36 2HB LYS 5 HB1 LYS 5 84.441 -5.964 -2.823
37 1HG LYS 5 HG2 LYS 5 85.350 -6.431 -0.447
38 2HG LYS 5 HG1 LYS 5 84.130 -5.262 0.062
39 1HD LYS 5 HD2 LYS 5 83.325 -7.464 -1.776
40 2HD LYS 5 HD1 LYS 5 83.585 -7.837 -0.071
41 1HE LYS 5 HE2 LYS 5 81.376 -7.288 0.006
42 2HE LYS 5 HE1 LYS 5 82.076 -5.689 0.253
43 1HZ LYS 5 HZ1 LYS 5 81.288 -4.970 -1.693
44 2HZ LYS 5 HZ2 LYS 5 80.264 -6.315 -1.646
45 3HZ LYS 5 HZ3 LYS 5 81.712 -6.385 -2.518
46 H PHE 6 HN PHE 6 87.761 -2.837 -1.974
47 HA PHE 6 HA PHE 6 87.543 -1.934 0.624
48 1HB PHE 6 HB2 PHE 6 88.543 -0.607 -1.888
49 2HB PHE 6 HB1 PHE 6 88.587 0.226 -0.339
50 HD1 PHE 6 HD1 PHE 6 89.232 -3.377 -1.008
51 HD2 PHE 6 HD2 PHE 6 90.873 0.391 0.090
52 HE1 PHE 6 HE1 PHE 6 91.367 -4.471 -0.475
53 HE2 PHE 6 HE2 PHE 6 93.014 -0.697 0.630
54 HZ PHE 6 HZ PHE 6 93.268 -3.135 0.350
55 H ASN 7 HN ASN 7 86.276 -0.454 1.705
56 HA ASN 7 HA ASN 7 84.233 0.916 0.090
57 1HB ASN 7 HB2 ASN 7 83.909 -0.687 2.606
58 2HB ASN 7 HB1 ASN 7 82.740 0.560 2.175
59 1HD2 ASN 7 HD21 ASN 7 83.250 -2.617 2.059
60 2HD2 ASN 7 HD22 ASN 7 82.355 -3.033 0.641
61 H LYS 8 HN LYS 8 83.980 1.316 3.491
62 HA LYS 8 HA LYS 8 84.512 4.120 3.209
63 1HB LYS 8 HB2 LYS 8 84.101 3.918 5.837
64 2HB LYS 8 HB1 LYS 8 82.792 3.933 4.668
65 1HG LYS 8 HG2 LYS 8 82.422 1.642 4.871
66 2HG LYS 8 HG1 LYS 8 84.002 1.356 5.600
67 1HD LYS 8 HD2 LYS 8 82.199 3.188 7.056
68 2HD LYS 8 HD1 LYS 8 81.721 1.490 7.014
69 1HE LYS 8 HE2 LYS 8 83.045 1.429 8.861
70 2HE LYS 8 HE1 LYS 8 84.283 1.159 7.635
71 1HZ LYS 8 HZ1 LYS 8 84.685 2.936 9.420
72 2HZ LYS 8 HZ2 LYS 8 83.621 3.893 8.519
73 3HZ LYS 8 HZ3 LYS 8 85.047 3.321 7.812
74 H GLU 9 HN GLU 9 85.845 1.720 5.500
75 HA GLU 9 HA GLU 9 87.985 3.474 6.220
76 1HB GLU 9 HB2 GLU 9 86.986 0.838 7.059
77 2HB GLU 9 HB1 GLU 9 88.722 1.058 7.234
78 1HG GLU 9 HG2 GLU 9 87.841 3.365 8.304
79 2HG GLU 9 HG1 GLU 9 86.496 2.296 8.700
80 H GLN 10 HN GLN 10 87.867 0.363 4.484
81 HA GLN 10 HA GLN 10 90.605 0.157 3.996
82 1HB GLN 10 HB2 GLN 10 88.483 -1.448 3.597
83 2HB GLN 10 HB1 GLN 10 88.770 -0.924 1.944
84 1HG GLN 10 HG2 GLN 10 90.457 -2.330 1.743
85 2HG GLN 10 HG1 GLN 10 91.254 -1.636 3.152
86 1HE2 GLN 10 HE21 GLN 10 92.012 -3.756 3.593
87 2HE2 GLN 10 HE22 GLN 10 91.001 -4.902 4.387
88 H GLN 11 HN GLN 11 88.059 1.388 1.816
89 HA GLN 11 HA GLN 11 89.635 1.919 -0.384
90 1HB GLN 11 HB2 GLN 11 87.159 2.084 -0.315
91 2HB GLN 11 HB1 GLN 11 87.318 3.599 0.565
92 1HG GLN 11 HG2 GLN 11 88.728 3.362 -2.029
93 2HG GLN 11 HG1 GLN 11 86.972 3.518 -2.052
94 1HE2 GLN 11 HE21 GLN 11 86.386 5.219 -0.113
95 2HE2 GLN 11 HE22 GLN 11 87.144 6.752 -0.357
96 H ASN 12 HN ASN 12 89.015 4.050 2.401
97 HA ASN 12 HA ASN 12 90.229 6.352 1.485
98 1HB ASN 12 HB2 ASN 12 89.055 5.999 3.715
99 2HB ASN 12 HB1 ASN 12 90.564 5.308 4.303
100 1HD2 ASN 12 HD21 ASN 12 91.549 6.711 5.550
101 2HD2 ASN 12 HD22 ASN 12 91.722 8.403 5.246
102 H ALA 13 HN ALA 13 91.673 3.426 2.815
103 HA ALA 13 HA ALA 13 94.296 4.273 3.068
104 1HB ALA 13 HB1 ALA 13 93.320 2.034 3.722
105 2HB ALA 13 HB2 ALA 13 94.931 1.995 3.005
106 3HB ALA 13 HB3 ALA 13 93.523 1.554 2.037
107 H PHE 14 HN PHE 14 92.740 2.796 0.160
108 HA PHE 14 HA PHE 14 94.901 2.832 -1.521
109 1HB PHE 14 HB2 PHE 14 92.745 1.780 -2.008
110 2HB PHE 14 HB1 PHE 14 91.997 3.354 -2.171
111 HD1 PHE 14 HD1 PHE 14 94.628 1.186 -3.657
112 HD2 PHE 14 HD2 PHE 14 91.925 4.425 -4.220
113 HE1 PHE 14 HE1 PHE 14 95.159 1.211 -6.062
114 HE2 PHE 14 HE2 PHE 14 92.452 4.453 -6.623
115 HZ PHE 14 HZ PHE 14 94.068 2.843 -7.546
116 H TRP 15 HN TRP 15 92.383 5.332 -1.353
117 HA TRP 15 HA TRP 15 93.499 7.063 -3.204
118 1HB TRP 15 HB2 TRP 15 91.415 7.199 -1.237
119 2HB TRP 15 HB1 TRP 15 92.310 8.714 -1.277
120 HD1 TRP 15 HD1 TRP 15 91.545 6.501 -4.347
121 HE1 TRP 15 HE1 TRP 15 90.156 7.894 -6.008
122 HE3 TRP 15 HE3 TRP 15 90.880 10.706 -1.518
123 HZ2 TRP 15 HZ2 TRP 15 88.938 10.442 -6.104
124 HZ3 TRP 15 HZ3 TRP 15 89.591 12.577 -2.467
125 HH2 TRP 15 HH2 TRP 15 88.642 12.446 -4.714
126 H GLU 16 HN GLU 16 94.183 6.862 0.280
127 HA GLU 16 HA GLU 16 95.855 9.173 0.313
128 1HB GLU 16 HB2 GLU 16 95.011 7.179 2.192
129 2HB GLU 16 HB1 GLU 16 96.761 7.322 2.280
130 1HG GLU 16 HG2 GLU 16 96.636 9.252 3.359
131 2HG GLU 16 HG1 GLU 16 95.503 9.917 2.185
132 H ILE 17 HN ILE 17 96.561 5.715 0.231
133 HA ILE 17 HA ILE 17 99.308 5.795 -0.066
134 HB ILE 17 HB ILE 17 97.424 3.856 -1.431
135 1HG1 ILE 17 HG12 ILE 17 97.053 3.417 0.801
136 2HG1 ILE 17 HG11 ILE 17 98.439 2.381 0.509
137 1HG2 ILE 17 HG21 ILE 17 99.364 2.351 -1.572
138 2HG2 ILE 17 HG22 ILE 17 100.395 3.650 -0.972
139 3HG2 ILE 17 HG23 ILE 17 99.578 3.819 -2.526
140 1HD1 ILE 17 HD11 ILE 17 99.762 4.517 1.297
141 2HD1 ILE 17 HD12 ILE 17 99.080 3.366 2.444
142 3HD1 ILE 17 HD13 ILE 17 98.230 4.871 2.096
143 H LEU 18 HN LEU 18 96.914 5.738 -2.684
144 HA LEU 18 HA LEU 18 98.598 5.994 -4.839
145 1HB LEU 18 HB2 LEU 18 95.741 6.513 -4.292
146 2HB LEU 18 HB1 LEU 18 96.404 7.320 -5.709
147 HG LEU 18 HG LEU 18 95.394 5.195 -6.324
148 1HD1 LEU 18 HD11 LEU 18 97.530 4.112 -7.285
149 2HD1 LEU 18 HD12 LEU 18 98.367 5.499 -6.574
150 3HD1 LEU 18 HD13 LEU 18 97.107 5.749 -7.786
151 1HD2 LEU 18 HD21 LEU 18 95.557 3.902 -4.367
152 2HD2 LEU 18 HD22 LEU 18 97.307 4.099 -4.284
153 3HD2 LEU 18 HD23 LEU 18 96.593 3.097 -5.546
154 H HIS 19 HN HIS 19 97.128 8.622 -2.953
155 HA HIS 19 HA HIS 19 98.217 10.639 -4.661
156 1HB HIS 19 HB2 HIS 19 96.507 10.528 -2.293
157 2HB HIS 19 HB1 HIS 19 97.605 11.902 -2.275
158 HD1 HIS 19 HD1 HIS 19 97.536 12.408 -5.390
159 HD2 HIS 19 HD2 HIS 19 94.225 11.947 -2.922
160 HE1 HIS 19 HE1 HIS 19 95.641 13.546 -6.588
161 HE2 HIS 19 HE2 HIS 19 93.672 13.341 -5.030
162 H LEU 20 HN LEU 20 98.914 9.678 -1.324
163 HA LEU 20 HA LEU 20 100.614 10.573 0.016
164 1HB LEU 20 HB2 LEU 20 101.399 8.302 -1.661
165 2HB LEU 20 HB1 LEU 20 102.679 9.069 -0.753
166 HG LEU 20 HG LEU 20 100.156 7.858 0.368
167 1HD1 LEU 20 HD11 LEU 20 102.378 6.552 -0.420
168 2HD1 LEU 20 HD12 LEU 20 101.336 6.029 0.900
169 3HD1 LEU 20 HD13 LEU 20 102.805 6.943 1.246
170 1HD2 LEU 20 HD21 LEU 20 101.925 8.383 2.446
171 2HD2 LEU 20 HD22 LEU 20 100.420 9.231 2.092
172 3HD2 LEU 20 HD23 LEU 20 101.947 9.845 1.459
173 HA PRO 21 HA PRO 21 102.726 13.381 -3.151
174 1HB PRO 21 HB2 PRO 21 101.486 15.532 -1.567
175 2HB PRO 21 HB1 PRO 21 101.495 15.301 -3.318
176 1HG PRO 21 HG2 PRO 21 99.265 14.968 -1.843
177 2HG PRO 21 HG1 PRO 21 99.596 14.000 -3.292
178 1HD PRO 21 HD2 PRO 21 99.925 13.270 -0.404
179 2HD PRO 21 HD1 PRO 21 99.307 12.298 -1.748
180 H ASN 22 HN ASN 22 104.670 12.707 -2.119
181 HA ASN 22 HA ASN 22 106.254 14.228 -0.798
182 1HB ASN 22 HB2 ASN 22 104.198 13.358 1.187
183 2HB ASN 22 HB1 ASN 22 105.882 13.361 1.706
184 1HD2 ASN 22 HD21 ASN 22 106.709 15.601 0.137
185 2HD2 ASN 22 HD22 ASN 22 105.981 17.007 0.820
186 H LEU 23 HN LEU 23 104.676 11.196 -0.037
187 HA LEU 23 HA LEU 23 107.130 9.699 0.297
188 1HB LEU 23 HB2 LEU 23 105.052 8.784 1.218
189 2HB LEU 23 HB1 LEU 23 104.338 8.748 -0.380
190 HG LEU 23 HG LEU 23 106.697 7.219 -0.554
191 1HD1 LEU 23 HD11 LEU 23 106.482 5.585 1.176
192 2HD1 LEU 23 HD12 LEU 23 105.051 6.389 1.824
193 3HD1 LEU 23 HD13 LEU 23 106.625 7.176 1.923
194 1HD2 LEU 23 HD21 LEU 23 104.169 5.776 -0.187
195 2HD2 LEU 23 HD22 LEU 23 105.302 5.760 -1.541
196 3HD2 LEU 23 HD23 LEU 23 104.119 7.063 -1.395
197 H ASN 24 HN ASN 24 108.058 8.117 -1.641
198 HA ASN 24 HA ASN 24 107.737 9.655 -4.009
199 1HB ASN 24 HB2 ASN 24 109.436 7.505 -2.989
200 2HB ASN 24 HB1 ASN 24 109.002 7.284 -4.681
201 1HD2 ASN 24 HD21 ASN 24 110.653 7.921 -5.859
202 2HD2 ASN 24 HD22 ASN 24 111.534 9.394 -5.662
203 H GLU 25 HN GLU 25 106.441 9.243 -5.723
204 HA GLU 25 HA GLU 25 104.176 7.710 -5.479
205 1HB GLU 25 HB2 GLU 25 104.287 9.469 -7.074
206 2HB GLU 25 HB1 GLU 25 105.646 8.721 -7.902
207 1HG GLU 25 HG2 GLU 25 103.275 7.024 -7.799
208 2HG GLU 25 HG1 GLU 25 103.028 8.541 -8.662
209 H GLU 26 HN GLU 26 107.377 6.669 -6.317
210 HA GLU 26 HA GLU 26 106.551 4.253 -7.630
211 1HB GLU 26 HB2 GLU 26 108.882 3.570 -7.474
212 2HB GLU 26 HB1 GLU 26 108.789 5.236 -8.023
213 1HG GLU 26 HG2 GLU 26 110.094 5.889 -6.367
214 2HG GLU 26 HG1 GLU 26 108.986 5.210 -5.181
215 H GLN 27 HN GLN 27 107.310 5.286 -4.385
216 HA GLN 27 HA GLN 27 107.237 2.686 -3.194
217 1HB GLN 27 HB2 GLN 27 107.351 5.495 -2.221
218 2HB GLN 27 HB1 GLN 27 106.697 4.298 -1.112
219 1HG GLN 27 HG2 GLN 27 109.362 4.008 -2.471
220 2HG GLN 27 HG1 GLN 27 109.151 4.769 -0.895
221 1HE2 GLN 27 HE21 GLN 27 107.647 3.314 0.564
222 2HE2 GLN 27 HE22 GLN 27 108.158 1.667 0.671
223 H ARG 28 HN ARG 28 104.983 5.225 -3.973
224 HA ARG 28 HA ARG 28 102.747 4.390 -2.503
225 1HB ARG 28 HB2 ARG 28 103.073 5.849 -5.119
226 2HB ARG 28 HB1 ARG 28 101.478 5.419 -4.528
227 1HG ARG 28 HG2 ARG 28 102.153 6.650 -2.386
228 2HG ARG 28 HG1 ARG 28 103.463 7.328 -3.355
229 1HD ARG 28 HD2 ARG 28 100.955 7.500 -4.762
230 2HD ARG 28 HD1 ARG 28 100.812 8.241 -3.190
231 HE ARG 28 HE ARG 28 102.775 9.616 -3.816
232 1HH1 ARG 28 HH11 ARG 28 100.857 8.150 -6.348
233 2HH1 ARG 28 HH12 ARG 28 101.245 9.369 -7.511
234 1HH2 ARG 28 HH21 ARG 28 103.273 11.218 -5.350
235 2HH2 ARG 28 HH22 ARG 28 102.615 11.106 -6.949
236 H ASN 29 HN ASN 29 103.625 3.741 -5.897
237 HA ASN 29 HA ASN 29 101.691 1.924 -6.564
238 1HB ASN 29 HB2 ASN 29 103.224 2.774 -8.216
239 2HB ASN 29 HB1 ASN 29 104.596 2.027 -7.401
240 1HD2 ASN 29 HD21 ASN 29 105.224 0.104 -8.091
241 2HD2 ASN 29 HD22 ASN 29 104.308 -0.960 -9.097
242 H GLY 30 HN GLY 30 104.860 1.227 -5.043
243 1HA GLY 30 HA2 GLY 30 104.523 -1.570 -4.918
244 2HA GLY 30 HA1 GLY 30 105.545 -0.623 -3.843
245 H PHE 31 HN PHE 31 103.515 1.007 -2.755
246 HA PHE 31 HA PHE 31 102.609 -0.620 -0.633
247 1HB PHE 31 HB2 PHE 31 102.461 2.209 -1.404
248 2HB PHE 31 HB1 PHE 31 101.064 1.656 -0.487
249 HD1 PHE 31 HD1 PHE 31 104.456 2.746 -0.321
250 HD2 PHE 31 HD2 PHE 31 101.489 0.487 1.719
251 HE1 PHE 31 HE1 PHE 31 105.741 2.954 1.766
252 HE2 PHE 31 HE2 PHE 31 102.768 0.681 3.807
253 HZ PHE 31 HZ PHE 31 104.898 1.922 3.837
254 H ILE 32 HN ILE 32 101.065 0.620 -3.543
255 HA ILE 32 HA ILE 32 98.415 -0.136 -2.880
256 HB ILE 32 HB ILE 32 99.205 -0.185 -5.745
257 1HG1 ILE 32 HG12 ILE 32 99.333 2.297 -4.023
258 2HG1 ILE 32 HG11 ILE 32 100.601 1.626 -5.040
259 1HG2 ILE 32 HG21 ILE 32 97.113 0.940 -6.039
260 2HG2 ILE 32 HG22 ILE 32 96.973 1.235 -4.306
261 3HG2 ILE 32 HG23 ILE 32 96.873 -0.411 -4.932
262 1HD1 ILE 32 HD11 ILE 32 98.147 2.321 -6.471
263 2HD1 ILE 32 HD12 ILE 32 99.834 2.628 -6.877
264 3HD1 ILE 32 HD13 ILE 32 98.997 3.679 -5.737
265 H GLN 33 HN GLN 33 101.058 -1.778 -4.507
266 HA GLN 33 HA GLN 33 99.581 -4.018 -5.398
267 1HB GLN 33 HB2 GLN 33 102.520 -3.688 -4.791
268 2HB GLN 33 HB1 GLN 33 101.832 -5.124 -5.536
269 1HG GLN 33 HG2 GLN 33 101.152 -3.891 -7.458
270 2HG GLN 33 HG1 GLN 33 101.575 -2.361 -6.691
271 1HE2 GLN 33 HE21 GLN 33 103.665 -1.679 -6.698
272 2HE2 GLN 33 HE22 GLN 33 104.936 -2.489 -7.544
273 H SER 34 HN SER 34 101.637 -3.545 -2.497
274 HA SER 34 HA SER 34 101.256 -6.087 -1.407
275 1HB SER 34 HB2 SER 34 102.945 -4.312 -0.708
276 2HB SER 34 HB1 SER 34 101.637 -3.553 0.203
277 HG SER 34 HG SER 34 103.128 -5.742 0.809
278 H LEU 35 HN LEU 35 99.362 -3.118 -1.096
279 HA LEU 35 HA LEU 35 97.574 -4.212 0.865
280 1HB LEU 35 HB2 LEU 35 97.893 -1.829 0.793
281 2HB LEU 35 HB1 LEU 35 97.423 -1.774 -0.896
282 HG LEU 35 HG LEU 35 95.147 -2.160 -0.395
283 1HD1 LEU 35 HD11 LEU 35 94.911 -3.823 1.137
284 2HD1 LEU 35 HD12 LEU 35 94.623 -2.442 2.192
285 3HD1 LEU 35 HD13 LEU 35 96.207 -3.212 2.165
286 1HD2 LEU 35 HD21 LEU 35 95.149 0.019 0.096
287 2HD2 LEU 35 HD22 LEU 35 96.590 -0.114 1.104
288 3HD2 LEU 35 HD23 LEU 35 95.005 -0.498 1.776
289 H LYS 36 HN LYS 36 97.557 -3.774 -2.643
290 HA LYS 36 HA LYS 36 94.910 -4.352 -3.168
291 1HB LYS 36 HB2 LYS 36 96.587 -3.587 -4.840
292 2HB LYS 36 HB1 LYS 36 97.270 -5.208 -4.848
293 1HG LYS 36 HG2 LYS 36 94.740 -5.836 -5.382
294 2HG LYS 36 HG1 LYS 36 94.758 -4.197 -6.036
295 1HD LYS 36 HD2 LYS 36 95.375 -5.516 -7.855
296 2HD LYS 36 HD1 LYS 36 96.918 -4.928 -7.233
297 1HE LYS 36 HE2 LYS 36 97.621 -7.003 -6.852
298 2HE LYS 36 HE1 LYS 36 96.175 -7.372 -5.913
299 1HZ LYS 36 HZ1 LYS 36 96.006 -7.338 -8.845
300 2HZ LYS 36 HZ2 LYS 36 95.105 -8.233 -7.729
301 3HZ LYS 36 HZ3 LYS 36 96.698 -8.679 -8.080
302 H ASP 37 HN ASP 37 97.616 -6.756 -3.312
303 HA ASP 37 HA ASP 37 95.941 -8.938 -3.668
304 1HB ASP 37 HB2 ASP 37 98.751 -8.464 -3.134
305 2HB ASP 37 HB1 ASP 37 98.182 -9.934 -2.351
306 H ASP 38 HN ASP 38 96.618 -7.248 -0.693
307 HA ASP 38 HA ASP 38 95.051 -9.313 0.695
308 1HB ASP 38 HB2 ASP 38 97.779 -8.938 1.072
309 2HB ASP 38 HB1 ASP 38 97.036 -8.120 2.442
310 HA PRO 39 HA PRO 39 92.928 -5.654 2.124
311 1HB PRO 39 HB2 PRO 39 90.887 -6.863 3.342
312 2HB PRO 39 HB1 PRO 39 91.058 -6.881 1.585
313 1HG PRO 39 HG2 PRO 39 91.683 -9.024 3.568
314 2HG PRO 39 HG1 PRO 39 90.944 -9.165 1.963
315 1HD PRO 39 HD2 PRO 39 93.617 -9.641 2.540
316 2HD PRO 39 HD1 PRO 39 92.968 -9.285 0.928
317 H SER 40 HN SER 40 93.646 -8.365 4.310
318 HA SER 40 HA SER 40 93.272 -6.854 6.696
319 1HB SER 40 HB2 SER 40 94.340 -9.533 5.999
320 2HB SER 40 HB1 SER 40 94.904 -8.837 7.518
321 HG SER 40 HG SER 40 92.571 -8.448 7.921
322 H GLN 41 HN GLN 41 95.288 -6.095 4.410
323 HA GLN 41 HA GLN 41 97.604 -5.564 6.125
324 1HB GLN 41 HB2 GLN 41 97.286 -5.861 3.141
325 2HB GLN 41 HB1 GLN 41 98.718 -5.140 3.861
326 1HG GLN 41 HG2 GLN 41 98.729 -7.651 3.252
327 2HG GLN 41 HG1 GLN 41 99.457 -7.113 4.762
328 1HE2 GLN 41 HE21 GLN 41 98.976 -8.303 6.447
329 2HE2 GLN 41 HE22 GLN 41 97.532 -9.222 6.676
330 H SER 42 HN SER 42 94.949 -4.117 4.551
331 HA SER 42 HA SER 42 95.714 -1.683 3.647
332 1HB SER 42 HB2 SER 42 93.527 -0.804 4.499
333 2HB SER 42 HB1 SER 42 93.390 -2.328 3.623
334 HG SER 42 HG SER 42 92.637 -1.782 6.114
335 H ALA 43 HN ALA 43 95.169 -2.446 7.091
336 HA ALA 43 HA ALA 43 95.781 0.146 8.031
337 1HB ALA 43 HB1 ALA 43 94.594 -1.200 9.523
338 2HB ALA 43 HB2 ALA 43 96.211 -1.115 10.223
339 3HB ALA 43 HB3 ALA 43 95.709 -2.554 9.335
340 H ASN 44 HN ASN 44 97.740 -2.694 7.401
341 HA ASN 44 HA ASN 44 100.123 -1.716 8.600
342 1HB ASN 44 HB2 ASN 44 99.527 -4.140 8.029
343 2HB ASN 44 HB1 ASN 44 100.014 -3.751 6.382
344 1HD2 ASN 44 HD21 ASN 44 102.104 -3.829 5.871
345 2HD2 ASN 44 HD22 ASN 44 103.395 -4.061 6.995
346 H LEU 45 HN LEU 45 98.840 -1.619 5.295
347 HA LEU 45 HA LEU 45 101.219 -0.398 4.239
348 1HB LEU 45 HB2 LEU 45 98.491 -0.957 3.114
349 2HB LEU 45 HB1 LEU 45 99.639 0.034 2.237
350 HG LEU 45 HG LEU 45 99.697 -2.245 1.412
351 1HD1 LEU 45 HD11 LEU 45 101.802 -1.396 1.119
352 2HD1 LEU 45 HD12 LEU 45 102.158 -2.796 2.130
353 3HD1 LEU 45 HD13 LEU 45 102.082 -1.188 2.846
354 1HD2 LEU 45 HD21 LEU 45 100.286 -4.113 2.788
355 2HD2 LEU 45 HD22 LEU 45 98.895 -3.290 3.495
356 3HD2 LEU 45 HD23 LEU 45 100.499 -3.065 4.191
357 H LEU 46 HN LEU 46 97.914 0.711 4.917
358 HA LEU 46 HA LEU 46 98.204 3.368 4.170
359 1HB LEU 46 HB2 LEU 46 96.039 2.442 4.657
360 2HB LEU 46 HB1 LEU 46 96.494 2.134 6.322
361 HG LEU 46 HG LEU 46 96.696 4.608 6.657
362 1HD1 LEU 46 HD11 LEU 46 95.017 5.436 4.514
363 2HD1 LEU 46 HD12 LEU 46 96.431 4.625 3.840
364 3HD1 LEU 46 HD13 LEU 46 96.637 5.994 4.932
365 1HD2 LEU 46 HD21 LEU 46 93.924 4.284 5.748
366 2HD2 LEU 46 HD22 LEU 46 94.559 4.681 7.344
367 3HD2 LEU 46 HD23 LEU 46 94.512 3.002 6.806
368 H ALA 47 HN ALA 47 98.586 1.975 7.431
369 HA ALA 47 HA ALA 47 99.381 4.357 8.686
370 1HB ALA 47 HB1 ALA 47 100.344 1.671 9.592
371 2HB ALA 47 HB2 ALA 47 98.641 2.112 9.713
372 3HB ALA 47 HB3 ALA 47 99.860 3.066 10.557
373 H GLU 48 HN GLU 48 101.314 1.720 7.298
374 HA GLU 48 HA GLU 48 103.832 2.769 7.972
375 1HB GLU 48 HB2 GLU 48 102.908 0.833 5.864
376 2HB GLU 48 HB1 GLU 48 104.596 1.308 5.989
377 1HG GLU 48 HG2 GLU 48 103.307 0.399 8.482
378 2HG GLU 48 HG1 GLU 48 103.556 -0.820 7.233
379 H ALA 49 HN ALA 49 101.814 3.195 5.100
380 HA ALA 49 HA ALA 49 103.756 4.719 3.671
381 1HB ALA 49 HB1 ALA 49 100.916 5.068 2.963
382 2HB ALA 49 HB2 ALA 49 101.527 3.414 2.919
383 3HB ALA 49 HB3 ALA 49 102.303 4.665 1.950
384 H LYS 50 HN LYS 50 101.012 5.522 5.747
385 HA LYS 50 HA LYS 50 101.007 8.292 5.207
386 1HB LYS 50 HB2 LYS 50 99.825 6.519 7.262
387 2HB LYS 50 HB1 LYS 50 100.020 8.205 7.722
388 1HG LYS 50 HG2 LYS 50 98.450 7.112 5.400
389 2HG LYS 50 HG1 LYS 50 97.827 7.926 6.836
390 1HD LYS 50 HD2 LYS 50 99.639 9.737 5.787
391 2HD LYS 50 HD1 LYS 50 98.866 9.044 4.360
392 1HE LYS 50 HE2 LYS 50 96.668 9.462 5.697
393 2HE LYS 50 HE1 LYS 50 97.659 10.599 6.608
394 1HZ LYS 50 HZ1 LYS 50 97.771 12.018 4.884
395 2HZ LYS 50 HZ2 LYS 50 96.354 11.241 4.385
396 3HZ LYS 50 HZ3 LYS 50 97.842 10.795 3.717
397 H LYS 51 HN LYS 51 102.459 6.441 7.889
398 HA LYS 51 HA LYS 51 103.725 8.688 9.059
399 1HB LYS 51 HB2 LYS 51 105.067 7.028 10.311
400 2HB LYS 51 HB1 LYS 51 103.344 6.693 10.376
401 1HG LYS 51 HG2 LYS 51 103.695 4.648 9.618
402 2HG LYS 51 HG1 LYS 51 104.432 5.294 8.154
403 1HD LYS 51 HD2 LYS 51 106.290 5.508 10.324
404 2HD LYS 51 HD1 LYS 51 105.672 3.857 10.244
405 1HE LYS 51 HE2 LYS 51 106.590 5.252 7.761
406 2HE LYS 51 HE1 LYS 51 107.763 4.514 8.850
407 1HZ LYS 51 HZ1 LYS 51 107.292 2.835 7.357
408 2HZ LYS 51 HZ2 LYS 51 105.647 3.218 7.259
409 3HZ LYS 51 HZ3 LYS 51 106.257 2.459 8.642
410 H LEU 52 HN LEU 52 104.709 6.314 6.668
411 HA LEU 52 HA LEU 52 107.428 6.992 6.517
412 1HB LEU 52 HB2 LEU 52 106.506 4.945 5.534
413 2HB LEU 52 HB1 LEU 52 105.608 5.899 4.368
414 HG LEU 52 HG LEU 52 107.639 6.614 3.298
415 1HD1 LEU 52 HD11 LEU 52 109.499 6.829 4.474
416 2HD1 LEU 52 HD12 LEU 52 109.660 5.072 4.466
417 3HD1 LEU 52 HD13 LEU 52 108.830 5.875 5.798
418 1HD2 LEU 52 HD21 LEU 52 107.967 4.701 2.158
419 2HD2 LEU 52 HD22 LEU 52 106.636 4.121 3.158
420 3HD2 LEU 52 HD23 LEU 52 108.301 3.764 3.614
421 H ASN 53 HN ASN 53 104.696 8.015 4.482
422 HA ASN 53 HA ASN 53 105.970 9.720 2.780
423 1HB ASN 53 HB2 ASN 53 103.773 9.580 2.195
424 2HB ASN 53 HB1 ASN 53 103.231 9.480 3.860
425 1HD2 ASN 53 HD21 ASN 53 101.499 10.883 3.115
426 2HD2 ASN 53 HD22 ASN 53 101.764 12.585 3.040
427 H ASP 54 HN ASP 54 104.483 10.761 5.884
428 HA ASP 54 HA ASP 54 105.335 13.399 5.753
429 1HB ASP 54 HB2 ASP 54 104.686 13.607 7.994
430 2HB ASP 54 HB1 ASP 54 103.678 12.303 7.379
431 H ALA 55 HN ALA 55 106.974 10.626 7.285
432 HA ALA 55 HA ALA 55 109.153 12.168 8.236
433 1HB ALA 55 HB1 ALA 55 108.686 10.105 9.303
434 2HB ALA 55 HB2 ALA 55 110.256 9.933 8.520
435 3HB ALA 55 HB3 ALA 55 108.822 9.214 7.787
436 H GLN 56 HN GLN 56 108.633 10.388 5.227
437 HA GLN 56 HA GLN 56 111.362 10.967 4.398
438 1HB GLN 56 HB2 GLN 56 111.081 9.348 2.679
439 2HB GLN 56 HB1 GLN 56 110.394 8.665 4.145
440 1HG GLN 56 HG2 GLN 56 108.514 8.271 3.052
441 2HG GLN 56 HG1 GLN 56 108.295 10.000 2.829
442 1HE2 GLN 56 HE21 GLN 56 110.183 10.666 1.004
443 2HE2 GLN 56 HE22 GLN 56 109.928 9.819 -0.476
444 H ALA 57 HN ALA 57 108.611 12.896 4.146
445 HA ALA 57 HA ALA 57 108.367 13.320 1.439
446 1HB ALA 57 HB1 ALA 57 108.101 15.258 3.729
447 2HB ALA 57 HB2 ALA 57 106.836 14.204 3.101
448 3HB ALA 57 HB3 ALA 57 107.480 15.504 2.101
449 HA PRO 58 HA PRO 58 112.284 15.378 0.637
450 1HB PRO 58 HB2 PRO 58 112.170 15.323 -2.009
451 2HB PRO 58 HB1 PRO 58 112.315 13.807 -1.106
452 1HG PRO 58 HG2 PRO 58 109.876 15.058 -2.323
453 2HG PRO 58 HG1 PRO 58 110.402 13.365 -2.370
454 1HD PRO 58 HD2 PRO 58 108.532 14.378 -0.596
455 2HD PRO 58 HD1 PRO 58 109.492 12.910 -0.325
456 H LYS 59 HN LYS 59 110.257 17.059 1.534
457 HA LYS 59 HA LYS 59 109.103 18.904 -0.081
458 1HB LYS 59 HB2 LYS 59 110.231 19.008 2.657
459 2HB LYS 59 HB1 LYS 59 109.887 20.554 1.894
460 1HG LYS 59 HG2 LYS 59 107.910 20.138 2.967
461 2HG LYS 59 HG1 LYS 59 107.576 19.455 1.375
462 1HD LYS 59 HD2 LYS 59 106.829 17.822 2.881
463 2HD LYS 59 HD1 LYS 59 108.408 17.241 2.350
464 1HE LYS 59 HE2 LYS 59 108.320 18.967 4.761
465 2HE LYS 59 HE1 LYS 59 107.702 17.323 4.916
466 1HZ LYS 59 HZ1 LYS 59 110.424 18.251 4.536
467 2HZ LYS 59 HZ2 LYS 59 109.997 16.883 3.638
468 3HZ LYS 59 HZ3 LYS 59 109.850 16.867 5.323
469 H ALA 60 HN ALA 60 112.078 19.920 1.560
470 HA ALA 60 HA ALA 60 113.872 21.134 0.859
471 1HB ALA 60 HB1 ALA 60 113.844 19.212 -0.885
472 2HB ALA 60 HB2 ALA 60 114.835 20.640 -1.185
473 3HB ALA 60 HB3 ALA 60 113.278 20.462 -1.993
Start of MODEL 22
1 1H GLY -1 HT1 GLY -1 94.190 -4.985 -12.099
2 2H GLY -1 HT2 GLY -1 95.315 -6.239 -12.246
3 3H GLY -1 HT3 GLY -1 94.495 -6.007 -10.786
4 1HA GLY -1 HA1 GLY -1 93.663 -7.396 -13.168
5 2HA GLY -1 HA2 GLY -1 93.131 -7.605 -11.507
6 H SER 0 HN SER 0 92.775 -5.551 -14.363
7 HA SER 0 HA SER 0 90.923 -4.567 -15.261
8 1HB SER 0 HB2 SER 0 89.735 -6.623 -14.269
9 2HB SER 0 HB1 SER 0 89.257 -5.552 -12.952
10 HG SER 0 HG SER 0 88.796 -4.896 -15.663
11 H THR 1 HN THR 1 90.605 -4.374 -11.698
12 HA THR 1 HA THR 1 91.325 -1.660 -11.566
13 HB THR 1 HB THR 1 89.386 -0.863 -12.487
14 HG1 THR 1 HG1 THR 1 89.499 -0.314 -10.168
15 1HG2 THR 1 HG21 THR 1 87.886 -2.360 -13.142
16 2HG2 THR 1 HG22 THR 1 87.147 -2.146 -11.555
17 3HG2 THR 1 HG23 THR 1 88.286 -3.465 -11.827
18 H ALA 2 HN ALA 2 88.621 -3.220 -9.861
19 HA ALA 2 HA ALA 2 89.826 -2.662 -7.327
20 1HB ALA 2 HB1 ALA 2 87.495 -2.515 -7.330
21 2HB ALA 2 HB2 ALA 2 87.831 -4.022 -6.477
22 3HB ALA 2 HB3 ALA 2 87.306 -4.059 -8.161
23 H ASP 3 HN ASP 3 88.392 -5.827 -7.982
24 HA ASP 3 HA ASP 3 89.344 -7.917 -8.083
25 1HB ASP 3 HB2 ASP 3 91.588 -6.527 -8.590
26 2HB ASP 3 HB1 ASP 3 91.979 -7.120 -6.978
27 H ASN 4 HN ASN 4 88.932 -5.830 -5.559
28 HA ASN 4 HA ASN 4 88.635 -8.003 -3.688
29 1HB ASN 4 HB2 ASN 4 89.998 -6.651 -1.940
30 2HB ASN 4 HB1 ASN 4 90.867 -7.651 -3.099
31 1HD2 ASN 4 HD21 ASN 4 89.601 -4.353 -2.771
32 2HD2 ASN 4 HD22 ASN 4 90.963 -3.577 -3.498
33 H LYS 5 HN LYS 5 87.407 -7.420 -1.821
34 HA LYS 5 HA LYS 5 85.243 -5.809 -2.215
35 1HB LYS 5 HB2 LYS 5 86.160 -7.394 -0.156
36 2HB LYS 5 HB1 LYS 5 86.099 -5.802 0.587
37 1HG LYS 5 HG2 LYS 5 83.987 -6.465 1.034
38 2HG LYS 5 HG1 LYS 5 83.708 -5.782 -0.569
39 1HD LYS 5 HD2 LYS 5 83.507 -7.849 -1.562
40 2HD LYS 5 HD1 LYS 5 84.491 -8.650 -0.336
41 1HE LYS 5 HE2 LYS 5 82.197 -7.588 0.950
42 2HE LYS 5 HE1 LYS 5 81.656 -8.442 -0.494
43 1HZ LYS 5 HZ1 LYS 5 82.402 -10.432 0.289
44 2HZ LYS 5 HZ2 LYS 5 82.015 -9.691 1.760
45 3HZ LYS 5 HZ3 LYS 5 83.624 -9.748 1.239
46 H PHE 6 HN PHE 6 87.717 -4.848 0.143
47 HA PHE 6 HA PHE 6 88.355 -2.792 0.895
48 1HB PHE 6 HB2 PHE 6 88.598 -2.707 -2.072
49 2HB PHE 6 HB1 PHE 6 88.828 -1.204 -1.189
50 HD1 PHE 6 HD1 PHE 6 89.762 -4.114 0.670
51 HD2 PHE 6 HD2 PHE 6 91.136 -1.325 -2.238
52 HE1 PHE 6 HE1 PHE 6 92.076 -4.748 1.161
53 HE2 PHE 6 HE2 PHE 6 93.463 -1.961 -1.747
54 HZ PHE 6 HZ PHE 6 93.938 -3.677 -0.041
55 H ASN 7 HN ASN 7 85.916 -2.737 1.580
56 HA ASN 7 HA ASN 7 83.940 -1.286 0.445
57 1HB ASN 7 HB2 ASN 7 84.799 -1.210 3.342
58 2HB ASN 7 HB1 ASN 7 83.259 -0.592 2.753
59 1HD2 ASN 7 HD21 ASN 7 85.181 -3.430 3.330
60 2HD2 ASN 7 HD22 ASN 7 83.894 -4.575 3.196
61 H LYS 8 HN LYS 8 83.171 1.005 1.363
62 HA LYS 8 HA LYS 8 84.718 2.933 0.100
63 1HB LYS 8 HB2 LYS 8 82.799 3.503 2.354
64 2HB LYS 8 HB1 LYS 8 83.213 4.546 1.001
65 1HG LYS 8 HG2 LYS 8 81.318 3.794 0.097
66 2HG LYS 8 HG1 LYS 8 82.250 2.343 -0.279
67 1HD LYS 8 HD2 LYS 8 81.524 1.715 2.204
68 2HD LYS 8 HD1 LYS 8 80.188 2.797 1.809
69 1HE LYS 8 HE2 LYS 8 79.208 1.190 0.633
70 2HE LYS 8 HE1 LYS 8 80.628 1.059 -0.404
71 1HZ LYS 8 HZ1 LYS 8 81.163 -0.861 0.536
72 2HZ LYS 8 HZ2 LYS 8 79.686 -0.833 1.359
73 3HZ LYS 8 HZ3 LYS 8 81.075 -0.213 2.097
74 H GLU 9 HN GLU 9 84.726 1.887 3.458
75 HA GLU 9 HA GLU 9 86.425 4.019 4.350
76 1HB GLU 9 HB2 GLU 9 85.688 1.398 5.662
77 2HB GLU 9 HB1 GLU 9 86.565 2.704 6.448
78 1HG GLU 9 HG2 GLU 9 84.474 3.173 7.181
79 2HG GLU 9 HG1 GLU 9 84.460 4.101 5.681
80 H GLN 10 HN GLN 10 86.899 0.678 3.330
81 HA GLN 10 HA GLN 10 89.685 0.653 4.043
82 1HB GLN 10 HB2 GLN 10 88.186 -1.377 3.977
83 2HB GLN 10 HB1 GLN 10 88.238 -1.272 2.223
84 1HG GLN 10 HG2 GLN 10 90.039 -2.551 2.289
85 2HG GLN 10 HG1 GLN 10 90.900 -1.188 3.003
86 1HE2 GLN 10 HE21 GLN 10 91.723 -3.723 3.537
87 2HE2 GLN 10 HE22 GLN 10 91.377 -4.128 5.175
88 H GLN 11 HN GLN 11 87.832 0.998 1.044
89 HA GLN 11 HA GLN 11 89.999 0.971 -0.738
90 1HB GLN 11 HB2 GLN 11 87.771 0.738 -1.590
91 2HB GLN 11 HB1 GLN 11 87.291 2.295 -0.929
92 1HG GLN 11 HG2 GLN 11 89.510 2.710 -2.650
93 2HG GLN 11 HG1 GLN 11 88.342 1.692 -3.490
94 1HE2 GLN 11 HE21 GLN 11 88.449 4.605 -1.465
95 2HE2 GLN 11 HE22 GLN 11 87.259 5.479 -2.360
96 H ASN 12 HN ASN 12 88.810 3.423 1.411
97 HA ASN 12 HA ASN 12 89.781 5.735 0.238
98 1HB ASN 12 HB2 ASN 12 88.418 5.717 2.289
99 2HB ASN 12 HB1 ASN 12 89.772 5.033 3.184
100 1HD2 ASN 12 HD21 ASN 12 88.591 7.857 1.497
101 2HD2 ASN 12 HD22 ASN 12 89.671 8.987 2.232
102 H ALA 13 HN ALA 13 91.480 3.241 2.060
103 HA ALA 13 HA ALA 13 93.898 4.518 2.506
104 1HB ALA 13 HB1 ALA 13 93.526 1.607 1.818
105 2HB ALA 13 HB2 ALA 13 93.269 2.310 3.415
106 3HB ALA 13 HB3 ALA 13 94.879 2.322 2.695
107 H PHE 14 HN PHE 14 92.750 2.876 -0.424
108 HA PHE 14 HA PHE 14 95.095 2.737 -1.875
109 1HB PHE 14 HB2 PHE 14 93.319 1.706 -2.896
110 2HB PHE 14 HB1 PHE 14 92.202 2.991 -2.528
111 HD1 PHE 14 HD1 PHE 14 91.230 3.634 -4.503
112 HD2 PHE 14 HD2 PHE 14 95.440 3.038 -4.371
113 HE1 PHE 14 HE1 PHE 14 91.416 4.479 -6.805
114 HE2 PHE 14 HE2 PHE 14 95.634 3.877 -6.675
115 HZ PHE 14 HZ PHE 14 93.621 4.602 -7.895
116 H TRP 15 HN TRP 15 92.668 5.289 -2.071
117 HA TRP 15 HA TRP 15 94.131 7.004 -3.736
118 1HB TRP 15 HB2 TRP 15 91.630 7.053 -2.509
119 2HB TRP 15 HB1 TRP 15 92.453 8.481 -1.894
120 HD1 TRP 15 HD1 TRP 15 93.170 7.293 -5.447
121 HE1 TRP 15 HE1 TRP 15 92.223 9.024 -7.102
122 HE3 TRP 15 HE3 TRP 15 90.619 10.254 -2.153
123 HZ2 TRP 15 HZ2 TRP 15 90.607 11.340 -7.020
124 HZ3 TRP 15 HZ3 TRP 15 89.399 12.207 -3.020
125 HH2 TRP 15 HH2 TRP 15 89.395 12.738 -5.404
126 H GLU 16 HN GLU 16 93.720 7.178 -0.209
127 HA GLU 16 HA GLU 16 95.454 9.295 0.307
128 1HB GLU 16 HB2 GLU 16 94.813 6.885 2.018
129 2HB GLU 16 HB1 GLU 16 95.634 8.327 2.598
130 1HG GLU 16 HG2 GLU 16 92.976 8.593 1.281
131 2HG GLU 16 HG1 GLU 16 93.069 8.018 2.945
132 H ILE 17 HN ILE 17 96.078 6.096 -0.592
133 HA ILE 17 HA ILE 17 98.861 6.044 0.282
134 HB ILE 17 HB ILE 17 97.062 4.052 -0.981
135 1HG1 ILE 17 HG12 ILE 17 99.270 3.071 0.624
136 2HG1 ILE 17 HG11 ILE 17 98.440 4.391 1.440
137 1HG2 ILE 17 HG21 ILE 17 98.624 3.930 -2.708
138 2HG2 ILE 17 HG22 ILE 17 99.175 2.693 -1.576
139 3HG2 ILE 17 HG23 ILE 17 99.982 4.262 -1.631
140 1HD1 ILE 17 HD11 ILE 17 96.712 2.320 0.266
141 2HD1 ILE 17 HD12 ILE 17 96.590 3.171 1.806
142 3HD1 ILE 17 HD13 ILE 17 97.713 1.822 1.630
143 H LEU 18 HN LEU 18 97.003 6.235 -2.710
144 HA LEU 18 HA LEU 18 99.252 6.644 -4.414
145 1HB LEU 18 HB2 LEU 18 96.314 6.568 -4.665
146 2HB LEU 18 HB1 LEU 18 97.118 7.633 -5.806
147 HG LEU 18 HG LEU 18 96.774 5.441 -6.788
148 1HD1 LEU 18 HD11 LEU 18 99.420 6.610 -6.378
149 2HD1 LEU 18 HD12 LEU 18 98.620 6.098 -7.863
150 3HD1 LEU 18 HD13 LEU 18 99.453 4.913 -6.858
151 1HD2 LEU 18 HD21 LEU 18 97.602 3.443 -5.891
152 2HD2 LEU 18 HD22 LEU 18 96.878 4.283 -4.520
153 3HD2 LEU 18 HD23 LEU 18 98.628 4.286 -4.731
154 H HIS 19 HN HIS 19 97.178 8.684 -2.531
155 HA HIS 19 HA HIS 19 97.776 11.115 -3.883
156 1HB HIS 19 HB2 HIS 19 95.891 10.407 -2.068
157 2HB HIS 19 HB1 HIS 19 97.043 11.217 -1.013
158 HD1 HIS 19 HD1 HIS 19 97.807 13.302 -3.414
159 HD2 HIS 19 HD2 HIS 19 94.071 12.532 -1.767
160 HE1 HIS 19 HE1 HIS 19 96.431 15.355 -3.880
161 HE2 HIS 19 HE2 HIS 19 94.151 14.834 -2.943
162 H LEU 20 HN LEU 20 98.704 9.914 -0.653
163 HA LEU 20 HA LEU 20 100.356 11.057 0.669
164 1HB LEU 20 HB2 LEU 20 101.342 8.881 -1.116
165 2HB LEU 20 HB1 LEU 20 102.480 9.695 -0.057
166 HG LEU 20 HG LEU 20 100.045 8.114 0.755
167 1HD1 LEU 20 HD11 LEU 20 102.112 6.873 0.133
168 2HD1 LEU 20 HD12 LEU 20 101.602 6.640 1.805
169 3HD1 LEU 20 HD13 LEU 20 102.950 7.716 1.436
170 1HD2 LEU 20 HD21 LEU 20 101.824 9.924 2.362
171 2HD2 LEU 20 HD22 LEU 20 100.911 8.606 3.096
172 3HD2 LEU 20 HD23 LEU 20 100.062 9.911 2.268
173 HA PRO 21 HA PRO 21 101.896 14.008 -2.658
174 1HB PRO 21 HB2 PRO 21 101.043 15.962 -0.600
175 2HB PRO 21 HB1 PRO 21 100.753 15.969 -2.343
176 1HG PRO 21 HG2 PRO 21 98.788 15.419 -0.613
177 2HG PRO 21 HG1 PRO 21 98.904 14.589 -2.176
178 1HD PRO 21 HD2 PRO 21 99.659 13.614 0.551
179 2HD PRO 21 HD1 PRO 21 98.877 12.742 -0.781
180 H ASN 22 HN ASN 22 103.978 13.275 -2.205
181 HA ASN 22 HA ASN 22 106.017 14.502 -1.462
182 1HB ASN 22 HB2 ASN 22 104.481 14.512 1.106
183 2HB ASN 22 HB1 ASN 22 106.234 14.438 1.164
184 1HD2 ASN 22 HD21 ASN 22 107.122 16.329 1.451
185 2HD2 ASN 22 HD22 ASN 22 106.564 17.833 0.810
186 H LEU 23 HN LEU 23 104.734 11.699 -1.692
187 HA LEU 23 HA LEU 23 106.956 10.311 -0.358
188 1HB LEU 23 HB2 LEU 23 104.908 9.601 0.681
189 2HB LEU 23 HB1 LEU 23 104.140 9.374 -0.877
190 HG LEU 23 HG LEU 23 106.357 7.678 -0.945
191 1HD1 LEU 23 HD11 LEU 23 105.185 7.845 1.787
192 2HD1 LEU 23 HD12 LEU 23 106.863 7.614 1.293
193 3HD1 LEU 23 HD13 LEU 23 105.705 6.280 1.154
194 1HD2 LEU 23 HD21 LEU 23 104.087 6.185 -0.182
195 2HD2 LEU 23 HD22 LEU 23 104.726 6.450 -1.803
196 3HD2 LEU 23 HD23 LEU 23 103.516 7.548 -1.143
197 H ASN 24 HN ASN 24 107.976 8.631 -1.568
198 HA ASN 24 HA ASN 24 108.149 9.212 -4.325
199 1HB ASN 24 HB2 ASN 24 109.239 6.843 -4.426
200 2HB ASN 24 HB1 ASN 24 110.068 8.136 -3.572
201 1HD2 ASN 24 HD21 ASN 24 110.462 5.363 -3.233
202 2HD2 ASN 24 HD22 ASN 24 110.031 4.965 -1.611
203 H GLU 25 HN GLU 25 106.563 8.952 -5.723
204 HA GLU 25 HA GLU 25 104.268 7.558 -5.220
205 1HB GLU 25 HB2 GLU 25 104.211 9.293 -6.779
206 2HB GLU 25 HB1 GLU 25 105.510 8.585 -7.741
207 1HG GLU 25 HG2 GLU 25 103.600 8.187 -9.006
208 2HG GLU 25 HG1 GLU 25 103.886 6.652 -8.188
209 H GLU 26 HN GLU 26 107.297 6.377 -6.219
210 HA GLU 26 HA GLU 26 106.439 3.920 -7.420
211 1HB GLU 26 HB2 GLU 26 108.789 3.251 -7.208
212 2HB GLU 26 HB1 GLU 26 108.661 4.866 -7.890
213 1HG GLU 26 HG2 GLU 26 109.592 5.861 -6.076
214 2HG GLU 26 HG1 GLU 26 108.982 4.645 -4.955
215 H GLN 27 HN GLN 27 106.916 5.152 -4.283
216 HA GLN 27 HA GLN 27 107.083 2.627 -2.886
217 1HB GLN 27 HB2 GLN 27 107.768 5.102 -2.123
218 2HB GLN 27 HB1 GLN 27 106.147 5.061 -1.460
219 1HG GLN 27 HG2 GLN 27 107.683 4.387 0.235
220 2HG GLN 27 HG1 GLN 27 106.747 2.979 -0.263
221 1HE2 GLN 27 HE21 GLN 27 109.140 2.743 1.088
222 2HE2 GLN 27 HE22 GLN 27 110.322 2.050 0.036
223 H ARG 28 HN ARG 28 104.647 5.068 -3.671
224 HA ARG 28 HA ARG 28 102.524 3.862 -2.238
225 1HB ARG 28 HB2 ARG 28 101.583 4.996 -4.752
226 2HB ARG 28 HB1 ARG 28 101.188 5.443 -3.105
227 1HG ARG 28 HG2 ARG 28 103.759 6.431 -3.517
228 2HG ARG 28 HG1 ARG 28 102.881 6.751 -5.011
229 1HD ARG 28 HD2 ARG 28 101.137 7.887 -3.779
230 2HD ARG 28 HD1 ARG 28 101.914 7.474 -2.257
231 HE ARG 28 HE ARG 28 103.600 9.050 -2.704
232 1HH1 ARG 28 HH11 ARG 28 101.158 8.997 -5.206
233 2HH1 ARG 28 HH12 ARG 28 101.612 10.540 -5.845
234 1HH2 ARG 28 HH21 ARG 28 104.191 11.071 -3.553
235 2HH2 ARG 28 HH22 ARG 28 103.331 11.714 -4.911
236 H ASN 29 HN ASN 29 103.401 3.565 -5.708
237 HA ASN 29 HA ASN 29 101.565 1.677 -6.444
238 1HB ASN 29 HB2 ASN 29 103.173 2.779 -7.985
239 2HB ASN 29 HB1 ASN 29 104.463 1.774 -7.330
240 1HD2 ASN 29 HD21 ASN 29 104.568 -0.382 -7.874
241 2HD2 ASN 29 HD22 ASN 29 103.636 -1.066 -9.158
242 H GLY 30 HN GLY 30 104.736 1.133 -4.877
243 1HA GLY 30 HA2 GLY 30 104.530 -1.706 -4.863
244 2HA GLY 30 HA1 GLY 30 105.532 -0.745 -3.777
245 H PHE 31 HN PHE 31 103.412 0.838 -2.751
246 HA PHE 31 HA PHE 31 102.552 -0.745 -0.572
247 1HB PHE 31 HB2 PHE 31 102.300 2.038 -1.465
248 2HB PHE 31 HB1 PHE 31 100.908 1.460 -0.554
249 HD1 PHE 31 HD1 PHE 31 103.527 3.436 -0.022
250 HD2 PHE 31 HD2 PHE 31 102.087 -0.319 1.389
251 HE1 PHE 31 HE1 PHE 31 104.754 3.751 2.083
252 HE2 PHE 31 HE2 PHE 31 103.309 -0.006 3.492
253 HZ PHE 31 HZ PHE 31 104.649 2.034 3.845
254 H ILE 32 HN ILE 32 100.767 0.741 -3.260
255 HA ILE 32 HA ILE 32 98.232 -0.158 -2.635
256 HB ILE 32 HB ILE 32 98.544 1.494 -4.373
257 1HG1 ILE 32 HG12 ILE 32 97.517 -0.278 -6.296
258 2HG1 ILE 32 HG11 ILE 32 97.097 -0.953 -4.727
259 1HG2 ILE 32 HG21 ILE 32 99.576 1.041 -6.466
260 2HG2 ILE 32 HG22 ILE 32 99.839 -0.647 -6.022
261 3HG2 ILE 32 HG23 ILE 32 100.689 0.635 -5.165
262 1HD1 ILE 32 HD11 ILE 32 96.518 1.878 -5.522
263 2HD1 ILE 32 HD12 ILE 32 95.908 1.006 -4.114
264 3HD1 ILE 32 HD13 ILE 32 95.379 0.548 -5.734
265 H GLN 33 HN GLN 33 100.699 -1.697 -4.595
266 HA GLN 33 HA GLN 33 99.187 -3.922 -5.433
267 1HB GLN 33 HB2 GLN 33 102.177 -3.693 -5.037
268 2HB GLN 33 HB1 GLN 33 101.372 -4.998 -5.898
269 1HG GLN 33 HG2 GLN 33 101.091 -2.121 -6.703
270 2HG GLN 33 HG1 GLN 33 102.387 -3.156 -7.301
271 1HE2 GLN 33 HE21 GLN 33 101.606 -2.908 -9.417
272 2HE2 GLN 33 HE22 GLN 33 100.206 -3.757 -9.968
273 H SER 34 HN SER 34 101.481 -3.552 -2.728
274 HA SER 34 HA SER 34 101.173 -6.139 -1.672
275 1HB SER 34 HB2 SER 34 102.450 -3.667 -0.897
276 2HB SER 34 HB1 SER 34 101.660 -4.402 0.498
277 HG SER 34 HG SER 34 103.959 -5.052 -0.349
278 H LEU 35 HN LEU 35 99.402 -3.152 -1.160
279 HA LEU 35 HA LEU 35 97.720 -4.156 0.929
280 1HB LEU 35 HB2 LEU 35 98.020 -1.812 0.847
281 2HB LEU 35 HB1 LEU 35 97.643 -1.744 -0.864
282 HG LEU 35 HG LEU 35 95.304 -2.183 -0.421
283 1HD1 LEU 35 HD11 LEU 35 94.645 -2.114 2.090
284 2HD1 LEU 35 HD12 LEU 35 96.299 -2.672 2.349
285 3HD1 LEU 35 HD13 LEU 35 95.190 -3.629 1.371
286 1HD2 LEU 35 HD21 LEU 35 95.169 -0.182 1.468
287 2HD2 LEU 35 HD22 LEU 35 95.271 0.045 -0.279
288 3HD2 LEU 35 HD23 LEU 35 96.736 0.088 0.704
289 H LYS 36 HN LYS 36 97.400 -3.739 -2.583
290 HA LYS 36 HA LYS 36 94.714 -4.317 -2.870
291 1HB LYS 36 HB2 LYS 36 96.197 -3.558 -4.698
292 2HB LYS 36 HB1 LYS 36 96.950 -5.146 -4.730
293 1HG LYS 36 HG2 LYS 36 95.258 -6.071 -5.876
294 2HG LYS 36 HG1 LYS 36 94.028 -5.152 -5.008
295 1HD LYS 36 HD2 LYS 36 95.669 -3.447 -6.684
296 2HD LYS 36 HD1 LYS 36 94.891 -4.728 -7.614
297 1HE LYS 36 HE2 LYS 36 93.081 -3.426 -7.643
298 2HE LYS 36 HE1 LYS 36 92.885 -3.834 -5.940
299 1HZ LYS 36 HZ1 LYS 36 94.006 -1.870 -5.298
300 2HZ LYS 36 HZ2 LYS 36 92.874 -1.407 -6.466
301 3HZ LYS 36 HZ3 LYS 36 94.509 -1.539 -6.879
302 H ASP 37 HN ASP 37 97.387 -6.716 -3.272
303 HA ASP 37 HA ASP 37 95.680 -8.920 -3.357
304 1HB ASP 37 HB2 ASP 37 97.763 -10.211 -2.603
305 2HB ASP 37 HB1 ASP 37 97.884 -9.283 -4.093
306 H ASP 38 HN ASP 38 97.435 -7.565 -0.592
307 HA ASP 38 HA ASP 38 95.915 -9.306 1.207
308 1HB ASP 38 HB2 ASP 38 98.571 -8.472 1.205
309 2HB ASP 38 HB1 ASP 38 97.828 -7.543 2.502
310 HA PRO 39 HA PRO 39 93.429 -5.574 1.857
311 1HB PRO 39 HB2 PRO 39 91.212 -6.807 2.733
312 2HB PRO 39 HB1 PRO 39 91.648 -6.792 1.019
313 1HG PRO 39 HG2 PRO 39 92.028 -8.955 3.053
314 2HG PRO 39 HG1 PRO 39 91.481 -9.084 1.372
315 1HD PRO 39 HD2 PRO 39 94.048 -9.600 2.187
316 2HD PRO 39 HD1 PRO 39 93.618 -9.071 0.549
317 H SER 40 HN SER 40 94.042 -8.208 4.088
318 HA SER 40 HA SER 40 93.123 -6.870 6.431
319 1HB SER 40 HB2 SER 40 94.963 -8.665 7.366
320 2HB SER 40 HB1 SER 40 93.285 -9.060 6.998
321 HG SER 40 HG SER 40 93.913 -10.161 5.312
322 H GLN 41 HN GLN 41 95.791 -6.431 4.430
323 HA GLN 41 HA GLN 41 97.596 -5.464 6.467
324 1HB GLN 41 HB2 GLN 41 97.704 -5.743 3.480
325 2HB GLN 41 HB1 GLN 41 98.901 -4.774 4.329
326 1HG GLN 41 HG2 GLN 41 99.037 -6.991 5.809
327 2HG GLN 41 HG1 GLN 41 98.525 -7.701 4.280
328 1HE2 GLN 41 HE21 GLN 41 101.083 -6.268 6.039
329 2HE2 GLN 41 HE22 GLN 41 102.298 -6.390 4.817
330 H SER 42 HN SER 42 95.033 -4.192 4.625
331 HA SER 42 HA SER 42 95.585 -1.680 3.868
332 1HB SER 42 HB2 SER 42 93.321 -1.016 4.521
333 2HB SER 42 HB1 SER 42 93.326 -2.641 3.837
334 HG SER 42 HG SER 42 92.687 -1.801 6.367
335 H ALA 43 HN ALA 43 95.405 -2.694 7.239
336 HA ALA 43 HA ALA 43 95.603 -0.031 8.278
337 1HB ALA 43 HB1 ALA 43 96.435 -2.259 10.011
338 2HB ALA 43 HB2 ALA 43 94.808 -2.380 9.343
339 3HB ALA 43 HB3 ALA 43 95.267 -0.969 10.296
340 H ASN 44 HN ASN 44 97.877 -2.732 7.928
341 HA ASN 44 HA ASN 44 100.102 -1.357 9.030
342 1HB ASN 44 HB2 ASN 44 99.853 -3.816 7.304
343 2HB ASN 44 HB1 ASN 44 101.415 -3.199 7.834
344 1HD2 ASN 44 HD21 ASN 44 98.302 -4.385 8.963
345 2HD2 ASN 44 HD22 ASN 44 98.873 -4.979 10.482
346 H LEU 45 HN LEU 45 98.758 -1.577 5.817
347 HA LEU 45 HA LEU 45 101.041 -0.457 4.494
348 1HB LEU 45 HB2 LEU 45 98.201 -0.967 3.632
349 2HB LEU 45 HB1 LEU 45 99.381 -0.212 2.581
350 HG LEU 45 HG LEU 45 98.858 -2.898 2.713
351 1HD1 LEU 45 HD11 LEU 45 100.337 -3.023 1.019
352 2HD1 LEU 45 HD12 LEU 45 101.594 -2.157 1.904
353 3HD1 LEU 45 HD13 LEU 45 100.278 -1.265 1.140
354 1HD2 LEU 45 HD21 LEU 45 100.877 -3.952 3.638
355 2HD2 LEU 45 HD22 LEU 45 99.911 -3.158 4.881
356 3HD2 LEU 45 HD23 LEU 45 101.383 -2.391 4.284
357 H LEU 46 HN LEU 46 97.800 0.751 5.332
358 HA LEU 46 HA LEU 46 98.136 3.352 4.367
359 1HB LEU 46 HB2 LEU 46 95.984 2.274 5.085
360 2HB LEU 46 HB1 LEU 46 96.469 2.549 6.747
361 HG LEU 46 HG LEU 46 96.432 4.954 6.405
362 1HD1 LEU 46 HD11 LEU 46 95.596 5.888 4.277
363 2HD1 LEU 46 HD12 LEU 46 95.683 4.276 3.567
364 3HD1 LEU 46 HD13 LEU 46 97.155 5.080 4.113
365 1HD2 LEU 46 HD21 LEU 46 93.861 4.713 5.291
366 2HD2 LEU 46 HD22 LEU 46 94.300 4.795 6.997
367 3HD2 LEU 46 HD23 LEU 46 94.155 3.230 6.198
368 H ALA 47 HN ALA 47 98.887 1.959 7.539
369 HA ALA 47 HA ALA 47 99.640 4.448 8.712
370 1HB ALA 47 HB1 ALA 47 99.778 3.275 10.608
371 2HB ALA 47 HB2 ALA 47 100.864 2.081 9.897
372 3HB ALA 47 HB3 ALA 47 99.121 1.932 9.674
373 H GLU 48 HN GLU 48 101.523 1.688 7.457
374 HA GLU 48 HA GLU 48 104.062 2.724 7.910
375 1HB GLU 48 HB2 GLU 48 102.930 0.715 6.024
376 2HB GLU 48 HB1 GLU 48 104.561 1.294 5.721
377 1HG GLU 48 HG2 GLU 48 104.361 -0.813 7.080
378 2HG GLU 48 HG1 GLU 48 105.353 0.468 7.772
379 H ALA 49 HN ALA 49 101.951 3.099 5.085
380 HA ALA 49 HA ALA 49 103.809 4.665 3.597
381 1HB ALA 49 HB1 ALA 49 101.649 3.335 2.855
382 2HB ALA 49 HB2 ALA 49 102.213 4.745 1.958
383 3HB ALA 49 HB3 ALA 49 100.884 4.904 3.107
384 H LYS 50 HN LYS 50 101.180 5.381 5.817
385 HA LYS 50 HA LYS 50 101.032 8.151 5.364
386 1HB LYS 50 HB2 LYS 50 100.147 6.295 7.508
387 2HB LYS 50 HB1 LYS 50 100.221 8.005 7.907
388 1HG LYS 50 HG2 LYS 50 98.712 6.876 5.561
389 2HG LYS 50 HG1 LYS 50 97.995 7.242 7.132
390 1HD LYS 50 HD2 LYS 50 98.084 9.490 6.801
391 2HD LYS 50 HD1 LYS 50 99.555 9.398 5.831
392 1HE LYS 50 HE2 LYS 50 98.021 9.970 4.224
393 2HE LYS 50 HE1 LYS 50 97.978 8.212 4.109
394 1HZ LYS 50 HZ1 LYS 50 95.841 9.872 4.534
395 2HZ LYS 50 HZ2 LYS 50 96.131 9.184 6.051
396 3HZ LYS 50 HZ3 LYS 50 95.855 8.190 4.711
397 H LYS 51 HN LYS 51 103.003 6.235 7.627
398 HA LYS 51 HA LYS 51 104.154 8.567 8.839
399 1HB LYS 51 HB2 LYS 51 104.660 5.613 9.033
400 2HB LYS 51 HB1 LYS 51 105.775 6.762 9.760
401 1HG LYS 51 HG2 LYS 51 104.364 7.277 11.434
402 2HG LYS 51 HG1 LYS 51 102.934 7.173 10.405
403 1HD LYS 51 HD2 LYS 51 103.158 4.693 10.456
404 2HD LYS 51 HD1 LYS 51 104.473 4.880 11.617
405 1HE LYS 51 HE2 LYS 51 102.998 4.986 13.272
406 2HE LYS 51 HE1 LYS 51 102.277 6.419 12.540
407 1HZ LYS 51 HZ1 LYS 51 101.512 3.899 11.335
408 2HZ LYS 51 HZ2 LYS 51 100.564 5.243 11.729
409 3HZ LYS 51 HZ3 LYS 51 100.976 4.120 12.925
410 H LEU 52 HN LEU 52 105.151 6.194 6.404
411 HA LEU 52 HA LEU 52 107.808 6.924 6.103
412 1HB LEU 52 HB2 LEU 52 106.151 5.182 4.828
413 2HB LEU 52 HB1 LEU 52 106.363 6.399 3.585
414 HG LEU 52 HG LEU 52 108.624 4.953 4.967
415 1HD1 LEU 52 HD11 LEU 52 107.309 4.488 2.299
416 2HD1 LEU 52 HD12 LEU 52 107.426 3.363 3.652
417 3HD1 LEU 52 HD13 LEU 52 108.876 3.820 2.759
418 1HD2 LEU 52 HD21 LEU 52 109.698 5.895 2.725
419 2HD2 LEU 52 HD22 LEU 52 109.660 6.833 4.218
420 3HD2 LEU 52 HD23 LEU 52 108.460 7.128 2.959
421 H ASN 53 HN ASN 53 104.995 8.182 4.319
422 HA ASN 53 HA ASN 53 106.271 10.095 2.808
423 1HB ASN 53 HB2 ASN 53 103.920 9.573 2.484
424 2HB ASN 53 HB1 ASN 53 103.526 10.239 4.065
425 1HD2 ASN 53 HD21 ASN 53 102.088 11.718 3.203
426 2HD2 ASN 53 HD22 ASN 53 102.609 13.108 2.318
427 H ASP 54 HN ASP 54 105.419 10.191 6.186
428 HA ASP 54 HA ASP 54 105.991 12.980 6.538
429 1HB ASP 54 HB2 ASP 54 105.329 10.688 8.349
430 2HB ASP 54 HB1 ASP 54 105.998 12.166 9.034
431 H ALA 55 HN ALA 55 107.764 10.027 6.585
432 HA ALA 55 HA ALA 55 110.030 11.089 8.052
433 1HB ALA 55 HB1 ALA 55 110.835 8.953 8.105
434 2HB ALA 55 HB2 ALA 55 110.202 8.559 6.504
435 3HB ALA 55 HB3 ALA 55 109.115 8.616 7.895
436 H GLN 56 HN GLN 56 109.188 10.316 4.723
437 HA GLN 56 HA GLN 56 111.802 11.293 3.841
438 1HB GLN 56 HB2 GLN 56 111.791 9.427 2.637
439 2HB GLN 56 HB1 GLN 56 110.161 9.065 3.149
440 1HG GLN 56 HG2 GLN 56 110.403 10.999 0.945
441 2HG GLN 56 HG1 GLN 56 110.922 9.360 0.609
442 1HE2 GLN 56 HE21 GLN 56 108.249 11.192 1.999
443 2HE2 GLN 56 HE22 GLN 56 107.010 10.138 1.429
444 H ALA 57 HN ALA 57 108.734 12.465 4.195
445 HA ALA 57 HA ALA 57 107.857 13.688 1.968
446 1HB ALA 57 HB1 ALA 57 106.542 14.387 3.637
447 2HB ALA 57 HB2 ALA 57 107.634 15.769 3.708
448 3HB ALA 57 HB3 ALA 57 107.864 14.406 4.803
449 HA PRO 58 HA PRO 58 111.518 16.162 0.894
450 1HB PRO 58 HB2 PRO 58 111.271 16.006 -1.755
451 2HB PRO 58 HB1 PRO 58 111.831 14.615 -0.818
452 1HG PRO 58 HG2 PRO 58 109.141 15.150 -1.996
453 2HG PRO 58 HG1 PRO 58 110.034 13.624 -1.886
454 1HD PRO 58 HD2 PRO 58 108.003 14.447 -0.161
455 2HD PRO 58 HD1 PRO 58 109.184 13.166 0.172
456 H LYS 59 HN LYS 59 111.505 18.337 0.803
457 HA LYS 59 HA LYS 59 109.139 19.825 0.615
458 1HB LYS 59 HB2 LYS 59 111.986 20.765 0.230
459 2HB LYS 59 HB1 LYS 59 110.601 21.802 0.544
460 1HG LYS 59 HG2 LYS 59 111.191 19.616 2.468
461 2HG LYS 59 HG1 LYS 59 112.223 21.047 2.471
462 1HD LYS 59 HD2 LYS 59 110.543 21.524 4.037
463 2HD LYS 59 HD1 LYS 59 110.058 22.397 2.583
464 1HE LYS 59 HE2 LYS 59 108.254 21.087 3.829
465 2HE LYS 59 HE1 LYS 59 108.366 20.858 2.085
466 1HZ LYS 59 HZ1 LYS 59 109.738 19.043 3.972
467 2HZ LYS 59 HZ2 LYS 59 109.338 18.771 2.351
468 3HZ LYS 59 HZ3 LYS 59 108.123 18.798 3.527
469 H ALA 60 HN ALA 60 107.919 20.084 -1.118
470 HA ALA 60 HA ALA 60 109.135 20.944 -3.618
471 1HB ALA 60 HB1 ALA 60 108.425 19.223 -4.954
472 2HB ALA 60 HB2 ALA 60 107.124 18.761 -3.856
473 3HB ALA 60 HB3 ALA 60 108.793 18.339 -3.473
Start of MODEL 23
1 1H GLY -1 HT1 GLY -1 92.535 -8.896 -11.451
2 2H GLY -1 HT2 GLY -1 93.147 -9.062 -9.883
3 3H GLY -1 HT3 GLY -1 92.360 -10.362 -10.624
4 1HA GLY -1 HA1 GLY -1 94.338 -9.765 -12.391
5 2HA GLY -1 HA2 GLY -1 95.096 -9.523 -10.825
6 H SER 0 HN SER 0 95.026 -11.305 -9.291
7 HA SER 0 HA SER 0 94.644 -13.932 -10.553
8 1HB SER 0 HB2 SER 0 96.736 -14.685 -9.336
9 2HB SER 0 HB1 SER 0 97.000 -13.588 -10.690
10 HG SER 0 HG SER 0 98.026 -13.216 -8.451
11 H THR 1 HN THR 1 93.540 -12.021 -8.225
12 HA THR 1 HA THR 1 92.829 -14.277 -6.523
13 HB THR 1 HB THR 1 93.257 -12.360 -4.614
14 HG1 THR 1 HG1 THR 1 95.478 -12.254 -6.368
15 1HG2 THR 1 HG21 THR 1 94.987 -14.614 -5.545
16 2HG2 THR 1 HG22 THR 1 93.959 -14.514 -4.115
17 3HG2 THR 1 HG23 THR 1 95.461 -13.591 -4.189
18 H ALA 2 HN ALA 2 90.850 -14.087 -5.537
19 HA ALA 2 HA ALA 2 89.250 -11.756 -6.343
20 1HB ALA 2 HB1 ALA 2 88.751 -14.343 -6.868
21 2HB ALA 2 HB2 ALA 2 87.486 -13.126 -6.696
22 3HB ALA 2 HB3 ALA 2 87.891 -14.176 -5.338
23 H ASP 3 HN ASP 3 87.106 -12.563 -4.451
24 HA ASP 3 HA ASP 3 86.402 -12.216 -2.326
25 1HB ASP 3 HB2 ASP 3 89.288 -12.801 -1.840
26 2HB ASP 3 HB1 ASP 3 88.339 -12.114 -0.529
27 H ASN 4 HN ASN 4 89.060 -10.223 -3.474
28 HA ASN 4 HA ASN 4 89.179 -8.160 -1.739
29 1HB ASN 4 HB2 ASN 4 90.544 -8.157 -3.712
30 2HB ASN 4 HB1 ASN 4 89.132 -8.023 -4.757
31 1HD2 ASN 4 HD21 ASN 4 88.058 -6.047 -4.911
32 2HD2 ASN 4 HD22 ASN 4 88.795 -4.566 -4.412
33 H LYS 5 HN LYS 5 88.026 -6.445 -1.121
34 HA LYS 5 HA LYS 5 85.747 -5.445 -2.508
35 1HB LYS 5 HB2 LYS 5 84.094 -5.948 -0.710
36 2HB LYS 5 HB1 LYS 5 84.635 -7.378 -1.579
37 1HG LYS 5 HG2 LYS 5 86.223 -7.833 0.279
38 2HG LYS 5 HG1 LYS 5 85.506 -6.481 1.158
39 1HD LYS 5 HD2 LYS 5 84.141 -8.055 2.007
40 2HD LYS 5 HD1 LYS 5 83.290 -7.888 0.470
41 1HE LYS 5 HE2 LYS 5 85.583 -9.749 0.503
42 2HE LYS 5 HE1 LYS 5 84.170 -10.236 1.438
43 1HZ LYS 5 HZ1 LYS 5 84.489 -9.976 -1.442
44 2HZ LYS 5 HZ2 LYS 5 82.999 -9.484 -0.811
45 3HZ LYS 5 HZ3 LYS 5 83.547 -11.062 -0.549
46 H PHE 6 HN PHE 6 87.668 -3.928 -2.069
47 HA PHE 6 HA PHE 6 87.950 -2.830 0.543
48 1HB PHE 6 HB2 PHE 6 88.918 -2.012 -2.184
49 2HB PHE 6 HB1 PHE 6 89.201 -1.005 -0.767
50 HD1 PHE 6 HD1 PHE 6 89.287 -4.715 -1.088
51 HD2 PHE 6 HD2 PHE 6 91.470 -1.131 -0.388
52 HE1 PHE 6 HE1 PHE 6 91.278 -6.043 -0.532
53 HE2 PHE 6 HE2 PHE 6 93.462 -2.453 0.164
54 HZ PHE 6 HZ PHE 6 93.374 -4.913 0.097
55 H ASN 7 HN ASN 7 85.788 -2.268 1.115
56 HA ASN 7 HA ASN 7 84.120 -0.553 -0.299
57 1HB ASN 7 HB2 ASN 7 84.375 -0.730 2.711
58 2HB ASN 7 HB1 ASN 7 82.969 -0.175 1.808
59 1HD2 ASN 7 HD21 ASN 7 84.736 -2.882 2.959
60 2HD2 ASN 7 HD22 ASN 7 83.633 -4.104 2.435
61 H LYS 8 HN LYS 8 83.565 1.596 1.430
62 HA LYS 8 HA LYS 8 85.176 3.604 0.416
63 1HB LYS 8 HB2 LYS 8 83.063 3.389 2.398
64 2HB LYS 8 HB1 LYS 8 84.233 4.632 2.822
65 1HG LYS 8 HG2 LYS 8 82.856 5.891 1.552
66 2HG LYS 8 HG1 LYS 8 83.887 5.268 0.262
67 1HD LYS 8 HD2 LYS 8 82.050 3.295 0.416
68 2HD LYS 8 HD1 LYS 8 81.067 4.682 0.890
69 1HE LYS 8 HE2 LYS 8 81.267 5.696 -1.152
70 2HE LYS 8 HE1 LYS 8 82.830 4.953 -1.488
71 1HZ LYS 8 HZ1 LYS 8 81.266 3.956 -2.925
72 2HZ LYS 8 HZ2 LYS 8 80.153 3.696 -1.679
73 3HZ LYS 8 HZ3 LYS 8 81.591 2.807 -1.727
74 H GLU 9 HN GLU 9 85.218 2.434 3.789
75 HA GLU 9 HA GLU 9 87.401 3.879 4.668
76 1HB GLU 9 HB2 GLU 9 85.818 1.696 5.617
77 2HB GLU 9 HB1 GLU 9 87.510 1.351 5.947
78 1HG GLU 9 HG2 GLU 9 86.521 4.059 6.616
79 2HG GLU 9 HG1 GLU 9 85.970 2.717 7.618
80 H GLN 10 HN GLN 10 87.424 0.567 3.345
81 HA GLN 10 HA GLN 10 90.209 0.218 3.539
82 1HB GLN 10 HB2 GLN 10 88.201 -1.455 3.077
83 2HB GLN 10 HB1 GLN 10 88.668 -1.181 1.406
84 1HG GLN 10 HG2 GLN 10 90.122 -2.831 1.698
85 2HG GLN 10 HG1 GLN 10 91.073 -1.679 2.636
86 1HE2 GLN 10 HE21 GLN 10 91.808 -3.798 3.583
87 2HE2 GLN 10 HE22 GLN 10 90.923 -4.406 4.929
88 H GLN 11 HN GLN 11 88.192 1.074 0.707
89 HA GLN 11 HA GLN 11 90.289 1.282 -1.127
90 1HB GLN 11 HB2 GLN 11 88.755 2.158 -2.607
91 2HB GLN 11 HB1 GLN 11 87.700 1.333 -1.475
92 1HG GLN 11 HG2 GLN 11 86.732 3.233 -0.793
93 2HG GLN 11 HG1 GLN 11 88.243 4.137 -0.810
94 1HE2 GLN 11 HE21 GLN 11 86.199 2.494 -3.205
95 2HE2 GLN 11 HE22 GLN 11 86.169 3.806 -4.328
96 H ASN 12 HN ASN 12 89.242 3.437 1.373
97 HA ASN 12 HA ASN 12 90.188 5.872 0.485
98 1HB ASN 12 HB2 ASN 12 88.966 5.631 2.591
99 2HB ASN 12 HB1 ASN 12 90.309 4.734 3.289
100 1HD2 ASN 12 HD21 ASN 12 90.355 7.651 1.296
101 2HD2 ASN 12 HD22 ASN 12 91.108 8.658 2.480
102 H ALA 13 HN ALA 13 91.974 3.214 2.053
103 HA ALA 13 HA ALA 13 94.427 4.468 2.310
104 1HB ALA 13 HB1 ALA 13 95.278 2.011 1.809
105 2HB ALA 13 HB2 ALA 13 93.562 1.644 1.985
106 3HB ALA 13 HB3 ALA 13 94.439 2.415 3.307
107 H PHE 14 HN PHE 14 93.015 2.880 -0.533
108 HA PHE 14 HA PHE 14 95.221 2.846 -2.198
109 1HB PHE 14 HB2 PHE 14 93.040 1.807 -2.678
110 2HB PHE 14 HB1 PHE 14 92.346 3.395 -2.959
111 HD1 PHE 14 HD1 PHE 14 93.375 4.813 -4.822
112 HD2 PHE 14 HD2 PHE 14 94.030 0.626 -4.431
113 HE1 PHE 14 HE1 PHE 14 94.038 4.701 -7.188
114 HE2 PHE 14 HE2 PHE 14 94.696 0.506 -6.797
115 HZ PHE 14 HZ PHE 14 94.701 2.545 -8.178
116 H TRP 15 HN TRP 15 92.711 5.366 -2.078
117 HA TRP 15 HA TRP 15 94.029 7.123 -3.845
118 1HB TRP 15 HB2 TRP 15 91.628 7.143 -2.325
119 2HB TRP 15 HB1 TRP 15 92.478 8.650 -2.009
120 HD1 TRP 15 HD1 TRP 15 92.656 6.943 -5.430
121 HE1 TRP 15 HE1 TRP 15 91.510 8.456 -7.166
122 HE3 TRP 15 HE3 TRP 15 90.717 10.474 -2.278
123 HZ2 TRP 15 HZ2 TRP 15 89.986 10.833 -7.198
124 HZ3 TRP 15 HZ3 TRP 15 89.429 12.336 -3.245
125 HH2 TRP 15 HH2 TRP 15 89.073 12.510 -5.654
126 H GLU 16 HN GLU 16 93.789 7.291 -0.282
127 HA GLU 16 HA GLU 16 95.518 9.408 0.145
128 1HB GLU 16 HB2 GLU 16 94.006 7.980 1.767
129 2HB GLU 16 HB1 GLU 16 95.506 7.108 2.051
130 1HG GLU 16 HG2 GLU 16 95.734 8.639 3.680
131 2HG GLU 16 HG1 GLU 16 96.403 9.603 2.364
132 H ILE 17 HN ILE 17 96.181 6.215 -0.790
133 HA ILE 17 HA ILE 17 99.002 6.242 -0.044
134 HB ILE 17 HB ILE 17 97.296 4.278 -1.571
135 1HG1 ILE 17 HG12 ILE 17 97.244 3.488 0.568
136 2HG1 ILE 17 HG11 ILE 17 98.781 2.780 0.108
137 1HG2 ILE 17 HG21 ILE 17 100.210 4.676 -1.840
138 2HG2 ILE 17 HG22 ILE 17 99.036 4.030 -2.988
139 3HG2 ILE 17 HG23 ILE 17 99.644 3.013 -1.681
140 1HD1 ILE 17 HD11 ILE 17 98.280 5.219 1.768
141 2HD1 ILE 17 HD12 ILE 17 99.861 4.848 1.076
142 3HD1 ILE 17 HD13 ILE 17 99.110 3.728 2.214
143 H LEU 18 HN LEU 18 96.937 6.681 -2.839
144 HA LEU 18 HA LEU 18 99.113 7.216 -4.647
145 1HB LEU 18 HB2 LEU 18 96.276 6.742 -4.822
146 2HB LEU 18 HB1 LEU 18 96.667 8.223 -5.678
147 HG LEU 18 HG LEU 18 98.239 7.069 -7.101
148 1HD1 LEU 18 HD11 LEU 18 97.555 4.608 -5.508
149 2HD1 LEU 18 HD12 LEU 18 99.097 5.464 -5.493
150 3HD1 LEU 18 HD13 LEU 18 98.551 4.656 -6.962
151 1HD2 LEU 18 HD21 LEU 18 96.660 6.250 -8.472
152 2HD2 LEU 18 HD22 LEU 18 95.543 6.831 -7.237
153 3HD2 LEU 18 HD23 LEU 18 96.033 5.137 -7.257
154 H HIS 19 HN HIS 19 97.204 9.017 -2.441
155 HA HIS 19 HA HIS 19 97.505 11.560 -3.697
156 1HB HIS 19 HB2 HIS 19 95.675 11.103 -2.119
157 2HB HIS 19 HB1 HIS 19 96.843 10.814 -0.836
158 HD1 HIS 19 HD1 HIS 19 95.838 13.663 -3.150
159 HD2 HIS 19 HD2 HIS 19 97.332 13.005 0.670
160 HE1 HIS 19 HE1 HIS 19 95.926 15.928 -2.063
161 HE2 HIS 19 HE2 HIS 19 96.730 15.490 0.283
162 H LEU 20 HN LEU 20 98.801 10.247 -0.658
163 HA LEU 20 HA LEU 20 100.480 11.585 0.449
164 1HB LEU 20 HB2 LEU 20 101.228 9.067 -0.888
165 2HB LEU 20 HB1 LEU 20 102.455 9.942 0.003
166 HG LEU 20 HG LEU 20 99.957 8.637 1.032
167 1HD1 LEU 20 HD11 LEU 20 101.790 8.004 2.793
168 2HD1 LEU 20 HD12 LEU 20 102.882 8.385 1.462
169 3HD1 LEU 20 HD13 LEU 20 101.651 7.136 1.265
170 1HD2 LEU 20 HD21 LEU 20 100.593 9.710 3.259
171 2HD2 LEU 20 HD22 LEU 20 99.747 10.718 2.085
172 3HD2 LEU 20 HD23 LEU 20 101.490 10.886 2.297
173 HA PRO 21 HA PRO 21 102.409 13.988 -3.011
174 1HB PRO 21 HB2 PRO 21 101.954 16.202 -1.118
175 2HB PRO 21 HB1 PRO 21 101.524 16.093 -2.827
176 1HG PRO 21 HG2 PRO 21 99.666 16.010 -0.879
177 2HG PRO 21 HG1 PRO 21 99.493 15.100 -2.391
178 1HD PRO 21 HD2 PRO 21 100.317 14.136 0.319
179 2HD PRO 21 HD1 PRO 21 99.289 13.348 -0.894
180 H ASN 22 HN ASN 22 104.372 13.072 -2.589
181 HA ASN 22 HA ASN 22 106.563 14.008 -1.806
182 1HB ASN 22 HB2 ASN 22 107.008 14.199 0.559
183 2HB ASN 22 HB1 ASN 22 105.629 15.210 0.158
184 1HD2 ASN 22 HD21 ASN 22 106.548 12.067 1.441
185 2HD2 ASN 22 HD22 ASN 22 105.196 11.906 2.493
186 H LEU 23 HN LEU 23 104.537 11.410 -1.366
187 HA LEU 23 HA LEU 23 106.619 9.627 -0.371
188 1HB LEU 23 HB2 LEU 23 104.262 9.286 0.352
189 2HB LEU 23 HB1 LEU 23 103.814 8.986 -1.316
190 HG LEU 23 HG LEU 23 105.334 7.005 -1.316
191 1HD1 LEU 23 HD11 LEU 23 105.660 6.291 1.261
192 2HD1 LEU 23 HD12 LEU 23 105.894 8.037 1.380
193 3HD1 LEU 23 HD13 LEU 23 106.904 7.083 0.293
194 1HD2 LEU 23 HD21 LEU 23 103.643 5.688 -0.649
195 2HD2 LEU 23 HD22 LEU 23 102.776 7.206 -0.419
196 3HD2 LEU 23 HD23 LEU 23 103.566 6.425 0.951
197 H ASN 24 HN ASN 24 107.899 8.434 -1.726
198 HA ASN 24 HA ASN 24 108.071 9.047 -4.442
199 1HB ASN 24 HB2 ASN 24 109.826 7.826 -3.100
200 2HB ASN 24 HB1 ASN 24 108.822 6.386 -3.196
201 1HD2 ASN 24 HD21 ASN 24 110.425 8.810 -5.204
202 2HD2 ASN 24 HD22 ASN 24 110.788 7.741 -6.512
203 H GLU 25 HN GLU 25 106.474 8.740 -5.975
204 HA GLU 25 HA GLU 25 104.202 7.295 -5.497
205 1HB GLU 25 HB2 GLU 25 103.642 7.753 -7.753
206 2HB GLU 25 HB1 GLU 25 104.581 9.121 -7.145
207 1HG GLU 25 HG2 GLU 25 105.909 6.895 -8.657
208 2HG GLU 25 HG1 GLU 25 105.075 8.194 -9.508
209 H GLU 26 HN GLU 26 107.281 6.139 -6.479
210 HA GLU 26 HA GLU 26 106.378 3.646 -7.598
211 1HB GLU 26 HB2 GLU 26 108.753 4.930 -7.693
212 2HB GLU 26 HB1 GLU 26 109.072 3.841 -6.351
213 1HG GLU 26 HG2 GLU 26 107.900 2.701 -8.826
214 2HG GLU 26 HG1 GLU 26 109.598 3.173 -8.842
215 H GLN 27 HN GLN 27 107.026 5.012 -4.556
216 HA GLN 27 HA GLN 27 107.024 2.547 -3.022
217 1HB GLN 27 HB2 GLN 27 108.047 4.978 -2.444
218 2HB GLN 27 HB1 GLN 27 106.477 5.133 -1.671
219 1HG GLN 27 HG2 GLN 27 107.128 3.898 0.044
220 2HG GLN 27 HG1 GLN 27 107.663 2.600 -1.022
221 1HE2 GLN 27 HE21 GLN 27 108.670 5.821 0.075
222 2HE2 GLN 27 HE22 GLN 27 110.351 5.442 0.196
223 H ARG 28 HN ARG 28 104.903 5.240 -3.827
224 HA ARG 28 HA ARG 28 102.670 4.546 -2.299
225 1HB ARG 28 HB2 ARG 28 102.713 5.881 -5.024
226 2HB ARG 28 HB1 ARG 28 101.361 5.892 -3.901
227 1HG ARG 28 HG2 ARG 28 103.254 6.913 -2.315
228 2HG ARG 28 HG1 ARG 28 103.869 7.451 -3.866
229 1HD ARG 28 HD2 ARG 28 101.146 8.031 -3.958
230 2HD ARG 28 HD1 ARG 28 101.617 8.420 -2.328
231 HE ARG 28 HE ARG 28 102.874 10.172 -3.118
232 1HH1 ARG 28 HH11 ARG 28 101.890 8.139 -5.780
233 2HH1 ARG 28 HH12 ARG 28 102.397 9.267 -6.992
234 1HH2 ARG 28 HH21 ARG 28 103.542 11.656 -4.713
235 2HH2 ARG 28 HH22 ARG 28 103.336 11.263 -6.387
236 H ASN 29 HN ASN 29 103.378 3.786 -5.730
237 HA ASN 29 HA ASN 29 101.208 2.130 -6.201
238 1HB ASN 29 HB2 ASN 29 102.925 3.034 -7.866
239 2HB ASN 29 HB1 ASN 29 103.941 1.677 -7.389
240 1HD2 ASN 29 HD21 ASN 29 103.904 0.305 -9.024
241 2HD2 ASN 29 HD22 ASN 29 102.485 -0.290 -9.810
242 H GLY 30 HN GLY 30 104.486 1.274 -5.063
243 1HA GLY 30 HA2 GLY 30 104.150 -1.486 -4.891
244 2HA GLY 30 HA1 GLY 30 105.206 -0.544 -3.847
245 H PHE 31 HN PHE 31 103.156 1.060 -2.699
246 HA PHE 31 HA PHE 31 102.379 -0.593 -0.540
247 1HB PHE 31 HB2 PHE 31 102.092 2.240 -1.303
248 2HB PHE 31 HB1 PHE 31 100.792 1.624 -0.287
249 HD1 PHE 31 HD1 PHE 31 103.549 3.496 -0.016
250 HD2 PHE 31 HD2 PHE 31 102.029 -0.164 1.531
251 HE1 PHE 31 HE1 PHE 31 104.976 3.741 1.971
252 HE2 PHE 31 HE2 PHE 31 103.447 0.066 3.513
253 HZ PHE 31 HZ PHE 31 104.930 2.032 3.744
254 H ILE 32 HN ILE 32 100.761 0.537 -3.433
255 HA ILE 32 HA ILE 32 98.134 -0.244 -2.698
256 HB ILE 32 HB ILE 32 98.941 -0.349 -5.568
257 1HG1 ILE 32 HG12 ILE 32 98.631 2.234 -4.025
258 2HG1 ILE 32 HG11 ILE 32 100.139 1.614 -4.690
259 1HG2 ILE 32 HG21 ILE 32 96.770 0.202 -5.987
260 2HG2 ILE 32 HG22 ILE 32 96.603 1.143 -4.505
261 3HG2 ILE 32 HG23 ILE 32 96.579 -0.619 -4.438
262 1HD1 ILE 32 HD11 ILE 32 97.788 2.763 -6.099
263 2HD1 ILE 32 HD12 ILE 32 98.836 1.616 -6.933
264 3HD1 ILE 32 HD13 ILE 32 99.505 3.116 -6.293
265 H GLN 33 HN GLN 33 100.710 -1.857 -4.503
266 HA GLN 33 HA GLN 33 99.231 -4.156 -5.194
267 1HB GLN 33 HB2 GLN 33 102.004 -4.836 -4.778
268 2HB GLN 33 HB1 GLN 33 101.093 -4.751 -6.275
269 1HG GLN 33 HG2 GLN 33 101.545 -2.339 -6.390
270 2HG GLN 33 HG1 GLN 33 102.498 -2.467 -4.912
271 1HE2 GLN 33 HE21 GLN 33 102.732 -2.262 -8.143
272 2HE2 GLN 33 HE22 GLN 33 104.244 -3.059 -8.395
273 H SER 34 HN SER 34 101.462 -3.587 -2.474
274 HA SER 34 HA SER 34 101.176 -6.125 -1.308
275 1HB SER 34 HB2 SER 34 102.241 -3.506 -0.490
276 2HB SER 34 HB1 SER 34 101.663 -4.500 0.847
277 HG SER 34 HG SER 34 103.942 -4.717 -0.464
278 H LEU 35 HN LEU 35 99.350 -3.140 -0.874
279 HA LEU 35 HA LEU 35 97.611 -4.208 1.159
280 1HB LEU 35 HB2 LEU 35 97.838 -1.893 1.277
281 2HB LEU 35 HB1 LEU 35 97.712 -1.686 -0.459
282 HG LEU 35 HG LEU 35 95.316 -2.197 -0.350
283 1HD1 LEU 35 HD11 LEU 35 96.039 -2.967 2.373
284 2HD1 LEU 35 HD12 LEU 35 94.682 -3.475 1.369
285 3HD1 LEU 35 HD13 LEU 35 94.590 -1.965 2.274
286 1HD2 LEU 35 HD21 LEU 35 95.098 -0.166 1.592
287 2HD2 LEU 35 HD22 LEU 35 95.093 0.005 -0.165
288 3HD2 LEU 35 HD23 LEU 35 96.611 0.112 0.730
289 H LYS 36 HN LYS 36 97.555 -3.858 -2.334
290 HA LYS 36 HA LYS 36 94.790 -4.429 -2.631
291 1HB LYS 36 HB2 LYS 36 96.035 -3.130 -4.289
292 2HB LYS 36 HB1 LYS 36 96.994 -4.549 -4.686
293 1HG LYS 36 HG2 LYS 36 95.302 -4.263 -6.352
294 2HG LYS 36 HG1 LYS 36 94.915 -5.694 -5.395
295 1HD LYS 36 HD2 LYS 36 93.390 -4.230 -4.026
296 2HD LYS 36 HD1 LYS 36 93.651 -2.964 -5.226
297 1HE LYS 36 HE2 LYS 36 92.977 -4.959 -6.866
298 2HE LYS 36 HE1 LYS 36 92.115 -5.491 -5.423
299 1HZ LYS 36 HZ1 LYS 36 90.558 -3.978 -5.787
300 2HZ LYS 36 HZ2 LYS 36 91.304 -3.583 -7.253
301 3HZ LYS 36 HZ3 LYS 36 91.695 -2.725 -5.849
302 H ASP 37 HN ASP 37 97.575 -6.570 -2.247
303 HA ASP 37 HA ASP 37 96.093 -8.762 -3.440
304 1HB ASP 37 HB2 ASP 37 98.879 -8.395 -2.380
305 2HB ASP 37 HB1 ASP 37 98.212 -10.014 -2.569
306 H ASP 38 HN ASP 38 96.407 -7.175 -0.488
307 HA ASP 38 HA ASP 38 95.009 -9.318 0.909
308 1HB ASP 38 HB2 ASP 38 97.677 -9.181 1.254
309 2HB ASP 38 HB1 ASP 38 97.169 -8.003 2.463
310 HA PRO 39 HA PRO 39 92.995 -5.529 2.251
311 1HB PRO 39 HB2 PRO 39 90.789 -6.631 3.277
312 2HB PRO 39 HB1 PRO 39 91.072 -6.615 1.532
313 1HG PRO 39 HG2 PRO 39 91.447 -8.841 3.493
314 2HG PRO 39 HG1 PRO 39 90.778 -8.894 1.852
315 1HD PRO 39 HD2 PRO 39 93.375 -9.577 2.520
316 2HD PRO 39 HD1 PRO 39 92.842 -9.091 0.899
317 H SER 40 HN SER 40 93.777 -8.282 4.243
318 HA SER 40 HA SER 40 93.117 -7.112 6.759
319 1HB SER 40 HB2 SER 40 94.377 -8.969 7.735
320 2HB SER 40 HB1 SER 40 93.325 -9.555 6.447
321 HG SER 40 HG SER 40 95.017 -10.129 5.333
322 H GLN 41 HN GLN 41 95.672 -6.676 4.555
323 HA GLN 41 HA GLN 41 97.589 -5.767 6.523
324 1HB GLN 41 HB2 GLN 41 97.587 -5.968 3.520
325 2HB GLN 41 HB1 GLN 41 98.859 -5.109 4.379
326 1HG GLN 41 HG2 GLN 41 98.291 -7.810 5.379
327 2HG GLN 41 HG1 GLN 41 98.942 -7.730 3.742
328 1HE2 GLN 41 HE21 GLN 41 99.490 -6.479 7.009
329 2HE2 GLN 41 HE22 GLN 41 101.215 -6.474 6.907
330 H SER 42 HN SER 42 94.943 -4.442 4.878
331 HA SER 42 HA SER 42 95.485 -1.954 4.055
332 1HB SER 42 HB2 SER 42 93.196 -3.220 4.905
333 2HB SER 42 HB1 SER 42 93.303 -1.842 5.998
334 HG SER 42 HG SER 42 92.761 -0.592 4.408
335 H ALA 43 HN ALA 43 95.468 -2.870 7.485
336 HA ALA 43 HA ALA 43 95.885 -0.202 8.414
337 1HB ALA 43 HB1 ALA 43 94.902 -2.230 9.675
338 2HB ALA 43 HB2 ALA 43 95.914 -1.084 10.553
339 3HB ALA 43 HB3 ALA 43 96.586 -2.625 10.020
340 H ASN 44 HN ASN 44 98.018 -2.996 7.931
341 HA ASN 44 HA ASN 44 100.360 -1.740 8.922
342 1HB ASN 44 HB2 ASN 44 100.176 -4.169 8.780
343 2HB ASN 44 HB1 ASN 44 100.040 -4.078 7.027
344 1HD2 ASN 44 HD21 ASN 44 101.826 -4.447 5.945
345 2HD2 ASN 44 HD22 ASN 44 103.438 -4.240 6.531
346 H LEU 45 HN LEU 45 98.833 -1.873 5.787
347 HA LEU 45 HA LEU 45 101.061 -0.781 4.360
348 1HB LEU 45 HB2 LEU 45 98.197 -1.353 3.699
349 2HB LEU 45 HB1 LEU 45 99.189 -0.422 2.597
350 HG LEU 45 HG LEU 45 98.922 -3.051 2.369
351 1HD1 LEU 45 HD11 LEU 45 100.412 -1.190 1.188
352 2HD1 LEU 45 HD12 LEU 45 100.574 -2.906 0.839
353 3HD1 LEU 45 HD13 LEU 45 101.697 -2.125 1.953
354 1HD2 LEU 45 HD21 LEU 45 99.845 -3.415 4.676
355 2HD2 LEU 45 HD22 LEU 45 101.398 -2.838 4.070
356 3HD2 LEU 45 HD23 LEU 45 100.673 -4.295 3.392
357 H LEU 46 HN LEU 46 97.931 0.502 5.465
358 HA LEU 46 HA LEU 46 98.257 3.090 4.460
359 1HB LEU 46 HB2 LEU 46 96.299 1.752 5.853
360 2HB LEU 46 HB1 LEU 46 96.823 2.963 7.006
361 HG LEU 46 HG LEU 46 96.001 3.637 4.186
362 1HD1 LEU 46 HD11 LEU 46 94.297 2.564 6.006
363 2HD1 LEU 46 HD12 LEU 46 93.829 3.701 4.742
364 3HD1 LEU 46 HD13 LEU 46 94.159 4.283 6.374
365 1HD2 LEU 46 HD21 LEU 46 96.501 5.233 6.684
366 2HD2 LEU 46 HD22 LEU 46 95.617 5.875 5.299
367 3HD2 LEU 46 HD23 LEU 46 97.297 5.372 5.117
368 H ALA 47 HN ALA 47 98.793 1.971 7.838
369 HA ALA 47 HA ALA 47 99.836 4.345 8.809
370 1HB ALA 47 HB1 ALA 47 100.803 3.023 10.602
371 2HB ALA 47 HB2 ALA 47 100.584 1.550 9.657
372 3HB ALA 47 HB3 ALA 47 99.178 2.455 10.219
373 H GLU 48 HN GLU 48 101.625 1.569 7.468
374 HA GLU 48 HA GLU 48 104.196 2.551 7.782
375 1HB GLU 48 HB2 GLU 48 102.966 0.689 5.775
376 2HB GLU 48 HB1 GLU 48 104.665 1.128 5.666
377 1HG GLU 48 HG2 GLU 48 103.491 0.028 8.192
378 2HG GLU 48 HG1 GLU 48 104.053 -1.024 6.894
379 H ALA 49 HN ALA 49 101.955 3.046 5.084
380 HA ALA 49 HA ALA 49 103.796 4.595 3.554
381 1HB ALA 49 HB1 ALA 49 101.985 4.982 2.052
382 2HB ALA 49 HB2 ALA 49 100.797 4.558 3.285
383 3HB ALA 49 HB3 ALA 49 101.857 3.316 2.617
384 H LYS 50 HN LYS 50 101.312 5.339 5.924
385 HA LYS 50 HA LYS 50 101.291 8.142 5.398
386 1HB LYS 50 HB2 LYS 50 100.282 6.503 7.718
387 2HB LYS 50 HB1 LYS 50 100.120 8.251 7.648
388 1HG LYS 50 HG2 LYS 50 98.910 6.233 5.779
389 2HG LYS 50 HG1 LYS 50 98.070 7.275 6.925
390 1HD LYS 50 HD2 LYS 50 99.655 8.243 4.546
391 2HD LYS 50 HD1 LYS 50 97.903 8.063 4.586
392 1HE LYS 50 HE2 LYS 50 99.350 9.749 6.601
393 2HE LYS 50 HE1 LYS 50 98.896 10.390 5.024
394 1HZ LYS 50 HZ1 LYS 50 97.305 10.156 7.298
395 2HZ LYS 50 HZ2 LYS 50 96.678 9.083 6.151
396 3HZ LYS 50 HZ3 LYS 50 96.854 10.721 5.769
397 H LYS 51 HN LYS 51 103.170 6.087 7.611
398 HA LYS 51 HA LYS 51 104.241 8.380 8.985
399 1HB LYS 51 HB2 LYS 51 105.831 6.669 9.967
400 2HB LYS 51 HB1 LYS 51 104.127 6.424 10.313
401 1HG LYS 51 HG2 LYS 51 104.379 4.901 8.108
402 2HG LYS 51 HG1 LYS 51 106.007 4.772 8.766
403 1HD LYS 51 HD2 LYS 51 103.669 4.421 10.587
404 2HD LYS 51 HD1 LYS 51 104.131 3.098 9.518
405 1HE LYS 51 HE2 LYS 51 106.538 3.855 10.565
406 2HE LYS 51 HE1 LYS 51 105.445 4.126 11.921
407 1HZ LYS 51 HZ1 LYS 51 104.643 1.723 11.072
408 2HZ LYS 51 HZ2 LYS 51 105.799 1.955 12.284
409 3HZ LYS 51 HZ3 LYS 51 106.291 1.644 10.697
410 H LEU 52 HN LEU 52 105.242 6.152 6.447
411 HA LEU 52 HA LEU 52 107.891 7.000 6.146
412 1HB LEU 52 HB2 LEU 52 107.239 5.030 5.008
413 2HB LEU 52 HB1 LEU 52 105.887 5.828 4.231
414 HG LEU 52 HG LEU 52 107.360 7.030 2.752
415 1HD1 LEU 52 HD11 LEU 52 109.840 5.692 3.521
416 2HD1 LEU 52 HD12 LEU 52 109.238 6.827 4.727
417 3HD1 LEU 52 HD13 LEU 52 109.543 7.374 3.080
418 1HD2 LEU 52 HD21 LEU 52 108.751 4.638 2.203
419 2HD2 LEU 52 HD22 LEU 52 107.275 5.239 1.452
420 3HD2 LEU 52 HD23 LEU 52 107.178 4.184 2.860
421 H ASN 53 HN ASN 53 104.929 8.099 4.537
422 HA ASN 53 HA ASN 53 106.012 10.095 2.918
423 1HB ASN 53 HB2 ASN 53 103.847 10.377 2.363
424 2HB ASN 53 HB1 ASN 53 103.472 9.122 3.527
425 1HD2 ASN 53 HD21 ASN 53 103.343 12.478 2.804
426 2HD2 ASN 53 HD22 ASN 53 102.424 12.963 4.184
427 H ASP 54 HN ASP 54 105.151 10.137 6.331
428 HA ASP 54 HA ASP 54 105.532 12.957 6.632
429 1HB ASP 54 HB2 ASP 54 104.450 10.830 8.181
430 2HB ASP 54 HB1 ASP 54 105.715 11.597 9.135
431 H ALA 55 HN ALA 55 107.529 10.133 6.773
432 HA ALA 55 HA ALA 55 109.663 11.447 8.231
433 1HB ALA 55 HB1 ALA 55 108.947 8.765 7.683
434 2HB ALA 55 HB2 ALA 55 110.261 9.361 8.697
435 3HB ALA 55 HB3 ALA 55 110.545 9.039 6.987
436 H GLN 56 HN GLN 56 108.845 10.625 4.918
437 HA GLN 56 HA GLN 56 111.389 11.761 4.006
438 1HB GLN 56 HB2 GLN 56 111.060 10.607 1.933
439 2HB GLN 56 HB1 GLN 56 110.783 9.470 3.243
440 1HG GLN 56 HG2 GLN 56 108.620 9.175 2.716
441 2HG GLN 56 HG1 GLN 56 108.387 10.858 2.255
442 1HE2 GLN 56 HE21 GLN 56 110.227 11.203 0.292
443 2HE2 GLN 56 HE22 GLN 56 109.871 10.177 -1.050
444 H ALA 57 HN ALA 57 108.354 12.848 4.596
445 HA ALA 57 HA ALA 57 107.576 14.196 2.280
446 1HB ALA 57 HB1 ALA 57 106.766 15.900 4.234
447 2HB ALA 57 HB2 ALA 57 106.991 14.407 5.145
448 3HB ALA 57 HB3 ALA 57 105.904 14.437 3.757
449 HA PRO 58 HA PRO 58 110.402 17.491 1.558
450 1HB PRO 58 HB2 PRO 58 108.693 19.672 1.400
451 2HB PRO 58 HB1 PRO 58 109.051 18.563 0.074
452 1HG PRO 58 HG2 PRO 58 106.712 18.606 1.932
453 2HG PRO 58 HG1 PRO 58 106.760 18.257 0.194
454 1HD PRO 58 HD2 PRO 58 106.539 16.291 1.998
455 2HD PRO 58 HD1 PRO 58 107.510 16.086 0.524
456 H LYS 59 HN LYS 59 111.647 17.856 3.313
457 HA LYS 59 HA LYS 59 110.833 18.634 5.846
458 1HB LYS 59 HB2 LYS 59 113.406 18.765 4.347
459 2HB LYS 59 HB1 LYS 59 113.286 19.652 5.860
460 1HG LYS 59 HG2 LYS 59 113.900 17.752 6.839
461 2HG LYS 59 HG1 LYS 59 112.256 17.196 6.520
462 1HD LYS 59 HD2 LYS 59 113.274 15.507 5.441
463 2HD LYS 59 HD1 LYS 59 113.464 16.682 4.138
464 1HE LYS 59 HE2 LYS 59 115.512 16.472 6.312
465 2HE LYS 59 HE1 LYS 59 115.529 15.345 4.956
466 1HZ LYS 59 HZ1 LYS 59 115.393 18.236 4.433
467 2HZ LYS 59 HZ2 LYS 59 116.034 17.002 3.470
468 3HZ LYS 59 HZ3 LYS 59 116.881 17.534 4.833
469 H ALA 60 HN ALA 60 112.328 20.748 3.389
470 HA ALA 60 HA ALA 60 111.795 23.146 4.773
471 1HB ALA 60 HB1 ALA 60 112.037 24.007 2.238
472 2HB ALA 60 HB2 ALA 60 112.759 22.404 2.086
473 3HB ALA 60 HB3 ALA 60 113.410 23.558 3.250
Start of MODEL 24
1 1H GLY -1 HT1 GLY -1 86.865 -0.970 -15.575
2 2H GLY -1 HT2 GLY -1 85.961 -0.032 -16.654
3 3H GLY -1 HT3 GLY -1 87.548 -0.470 -17.040
4 1HA GLY -1 HA1 GLY -1 85.158 -1.857 -17.577
5 2HA GLY -1 HA2 GLY -1 86.792 -2.243 -18.094
6 H SER 0 HN SER 0 88.180 -3.273 -16.338
7 HA SER 0 HA SER 0 86.770 -4.790 -14.328
8 1HB SER 0 HB2 SER 0 87.616 -6.995 -15.265
9 2HB SER 0 HB1 SER 0 86.285 -6.253 -16.152
10 HG SER 0 HG SER 0 87.787 -5.492 -17.664
11 H THR 1 HN THR 1 88.766 -2.908 -14.045
12 HA THR 1 HA THR 1 91.375 -3.972 -13.983
13 HB THR 1 HB THR 1 91.425 -1.677 -13.882
14 HG1 THR 1 HG1 THR 1 92.724 -1.664 -12.261
15 1HG2 THR 1 HG21 THR 1 88.927 -1.900 -12.410
16 2HG2 THR 1 HG22 THR 1 89.508 -0.629 -13.485
17 3HG2 THR 1 HG23 THR 1 90.000 -0.645 -11.791
18 H ALA 2 HN ALA 2 89.565 -3.056 -11.049
19 HA ALA 2 HA ALA 2 89.591 -5.593 -9.866
20 1HB ALA 2 HB1 ALA 2 91.893 -3.827 -9.047
21 2HB ALA 2 HB2 ALA 2 91.990 -5.401 -9.837
22 3HB ALA 2 HB3 ALA 2 91.380 -5.279 -8.187
23 H ASP 3 HN ASP 3 90.680 -3.420 -7.512
24 HA ASP 3 HA ASP 3 89.661 -2.190 -5.897
25 1HB ASP 3 HB2 ASP 3 87.376 -1.975 -7.873
26 2HB ASP 3 HB1 ASP 3 87.552 -1.024 -6.402
27 H ASN 4 HN ASN 4 89.547 -4.968 -5.884
28 HA ASN 4 HA ASN 4 87.425 -6.469 -5.563
29 1HB ASN 4 HB2 ASN 4 89.526 -6.286 -3.398
30 2HB ASN 4 HB1 ASN 4 88.548 -7.694 -3.806
31 1HD2 ASN 4 HD21 ASN 4 91.528 -6.534 -4.039
32 2HD2 ASN 4 HD22 ASN 4 92.047 -7.266 -5.515
33 H LYS 5 HN LYS 5 87.533 -6.861 -2.490
34 HA LYS 5 HA LYS 5 85.042 -5.572 -1.985
35 1HB LYS 5 HB2 LYS 5 85.895 -7.862 -1.154
36 2HB LYS 5 HB1 LYS 5 86.708 -6.940 0.103
37 1HG LYS 5 HG2 LYS 5 84.810 -7.278 1.238
38 2HG LYS 5 HG1 LYS 5 84.211 -5.923 0.279
39 1HD LYS 5 HD2 LYS 5 82.587 -7.653 0.125
40 2HD LYS 5 HD1 LYS 5 83.435 -7.608 -1.421
41 1HE LYS 5 HE2 LYS 5 83.153 -9.900 -0.738
42 2HE LYS 5 HE1 LYS 5 84.861 -9.475 -0.648
43 1HZ LYS 5 HZ1 LYS 5 83.719 -8.913 1.834
44 2HZ LYS 5 HZ2 LYS 5 84.849 -10.114 1.458
45 3HZ LYS 5 HZ3 LYS 5 83.195 -10.459 1.388
46 H PHE 6 HN PHE 6 88.050 -4.273 -1.910
47 HA PHE 6 HA PHE 6 88.516 -3.019 0.449
48 1HB PHE 6 HB2 PHE 6 88.852 -2.136 -2.389
49 2HB PHE 6 HB1 PHE 6 89.176 -0.986 -1.099
50 HD1 PHE 6 HD1 PHE 6 89.845 -4.446 -0.321
51 HD2 PHE 6 HD2 PHE 6 91.496 -0.905 -2.007
52 HE1 PHE 6 HE1 PHE 6 92.108 -5.369 -0.040
53 HE2 PHE 6 HE2 PHE 6 93.761 -1.822 -1.724
54 HZ PHE 6 HZ PHE 6 94.071 -4.061 -0.726
55 H ASN 7 HN ASN 7 86.545 -2.695 1.528
56 HA ASN 7 HA ASN 7 84.435 -1.099 0.644
57 1HB ASN 7 HB2 ASN 7 84.379 -0.688 3.361
58 2HB ASN 7 HB1 ASN 7 83.662 -2.058 2.528
59 1HD2 ASN 7 HD21 ASN 7 84.607 -4.058 2.684
60 2HD2 ASN 7 HD22 ASN 7 85.878 -4.412 3.798
61 H LYS 8 HN LYS 8 83.926 0.892 2.383
62 HA LYS 8 HA LYS 8 85.301 3.063 1.307
63 1HB LYS 8 HB2 LYS 8 83.958 3.197 3.991
64 2HB LYS 8 HB1 LYS 8 84.052 4.435 2.748
65 1HG LYS 8 HG2 LYS 8 81.959 3.821 2.275
66 2HG LYS 8 HG1 LYS 8 82.714 2.463 1.439
67 1HD LYS 8 HD2 LYS 8 82.642 1.398 3.858
68 2HD LYS 8 HD1 LYS 8 81.321 2.549 4.067
69 1HE LYS 8 HE2 LYS 8 80.336 0.528 3.329
70 2HE LYS 8 HE1 LYS 8 80.329 1.620 1.945
71 1HZ LYS 8 HZ1 LYS 8 82.377 0.500 1.173
72 2HZ LYS 8 HZ2 LYS 8 81.038 -0.533 1.232
73 3HZ LYS 8 HZ3 LYS 8 82.222 -0.614 2.438
74 H GLU 9 HN GLU 9 85.690 1.485 4.460
75 HA GLU 9 HA GLU 9 87.685 3.231 5.422
76 1HB GLU 9 HB2 GLU 9 86.194 1.354 6.584
77 2HB GLU 9 HB1 GLU 9 87.647 0.398 6.327
78 1HG GLU 9 HG2 GLU 9 87.876 1.267 8.476
79 2HG GLU 9 HG1 GLU 9 88.904 2.287 7.471
80 H GLN 10 HN GLN 10 87.885 0.147 3.680
81 HA GLN 10 HA GLN 10 90.752 0.076 3.827
82 1HB GLN 10 HB2 GLN 10 89.888 -2.056 3.738
83 2HB GLN 10 HB1 GLN 10 88.598 -1.605 2.640
84 1HG GLN 10 HG2 GLN 10 90.041 -3.046 1.477
85 2HG GLN 10 HG1 GLN 10 90.322 -1.427 0.843
86 1HE2 GLN 10 HE21 GLN 10 91.570 -3.915 2.986
87 2HE2 GLN 10 HE22 GLN 10 93.215 -3.408 2.929
88 H GLN 11 HN GLN 11 88.366 0.762 1.286
89 HA GLN 11 HA GLN 11 90.149 1.151 -0.832
90 1HB GLN 11 HB2 GLN 11 87.673 0.955 -1.036
91 2HB GLN 11 HB1 GLN 11 87.529 2.591 -0.414
92 1HG GLN 11 HG2 GLN 11 87.355 2.749 -2.755
93 2HG GLN 11 HG1 GLN 11 88.968 3.328 -2.340
94 1HE2 GLN 11 HE21 GLN 11 90.761 1.953 -2.734
95 2HE2 GLN 11 HE22 GLN 11 90.677 0.714 -3.935
96 H ASN 12 HN ASN 12 89.159 3.306 1.753
97 HA ASN 12 HA ASN 12 89.983 5.748 0.730
98 1HB ASN 12 HB2 ASN 12 88.807 5.505 2.881
99 2HB ASN 12 HB1 ASN 12 90.240 4.760 3.582
100 1HD2 ASN 12 HD21 ASN 12 91.555 6.039 4.645
101 2HD2 ASN 12 HD22 ASN 12 91.654 7.757 4.490
102 H ALA 13 HN ALA 13 91.848 3.131 2.165
103 HA ALA 13 HA ALA 13 94.287 4.388 2.511
104 1HB ALA 13 HB1 ALA 13 93.360 1.822 2.765
105 2HB ALA 13 HB2 ALA 13 95.027 2.340 3.017
106 3HB ALA 13 HB3 ALA 13 94.535 1.678 1.458
107 H PHE 14 HN PHE 14 92.904 2.972 -0.447
108 HA PHE 14 HA PHE 14 95.098 3.036 -2.101
109 1HB PHE 14 HB2 PHE 14 92.898 2.077 -2.638
110 2HB PHE 14 HB1 PHE 14 92.230 3.689 -2.787
111 HD1 PHE 14 HD1 PHE 14 95.495 2.457 -4.073
112 HD2 PHE 14 HD2 PHE 14 91.554 3.769 -4.996
113 HE1 PHE 14 HE1 PHE 14 96.060 2.466 -6.468
114 HE2 PHE 14 HE2 PHE 14 92.115 3.791 -7.388
115 HZ PHE 14 HZ PHE 14 94.372 3.139 -8.128
116 H TRP 15 HN TRP 15 92.639 5.592 -1.826
117 HA TRP 15 HA TRP 15 93.956 7.427 -3.505
118 1HB TRP 15 HB2 TRP 15 92.294 8.479 -1.266
119 2HB TRP 15 HB1 TRP 15 92.316 8.941 -2.964
120 HD1 TRP 15 HD1 TRP 15 91.692 6.131 -4.278
121 HE1 TRP 15 HE1 TRP 15 89.342 5.103 -4.023
122 HE3 TRP 15 HE3 TRP 15 90.150 8.673 -0.122
123 HZ2 TRP 15 HZ2 TRP 15 87.125 5.343 -2.278
124 HZ3 TRP 15 HZ3 TRP 15 87.903 8.216 0.780
125 HH2 TRP 15 HH2 TRP 15 86.425 6.585 -0.277
126 H GLU 16 HN GLU 16 93.786 7.422 0.048
127 HA GLU 16 HA GLU 16 95.586 9.501 0.511
128 1HB GLU 16 HB2 GLU 16 94.368 7.340 2.072
129 2HB GLU 16 HB1 GLU 16 95.936 7.850 2.683
130 1HG GLU 16 HG2 GLU 16 94.569 9.254 3.838
131 2HG GLU 16 HG1 GLU 16 94.906 10.247 2.422
132 H ILE 17 HN ILE 17 96.106 6.309 -0.465
133 HA ILE 17 HA ILE 17 98.908 6.130 0.323
134 HB ILE 17 HB ILE 17 97.092 4.268 -1.178
135 1HG1 ILE 17 HG12 ILE 17 98.983 3.583 1.049
136 2HG1 ILE 17 HG11 ILE 17 97.463 4.398 1.404
137 1HG2 ILE 17 HG21 ILE 17 98.851 3.820 -2.541
138 2HG2 ILE 17 HG22 ILE 17 99.345 2.830 -1.168
139 3HG2 ILE 17 HG23 ILE 17 100.039 4.437 -1.392
140 1HD1 ILE 17 HD11 ILE 17 96.549 2.407 -0.129
141 2HD1 ILE 17 HD12 ILE 17 96.736 2.281 1.620
142 3HD1 ILE 17 HD13 ILE 17 97.978 1.627 0.551
143 H LEU 18 HN LEU 18 97.040 6.396 -2.666
144 HA LEU 18 HA LEU 18 99.304 6.781 -4.352
145 1HB LEU 18 HB2 LEU 18 96.343 6.915 -4.641
146 2HB LEU 18 HB1 LEU 18 97.306 7.734 -5.849
147 HG LEU 18 HG LEU 18 96.798 5.572 -6.695
148 1HD1 LEU 18 HD11 LEU 18 98.923 4.788 -7.239
149 2HD1 LEU 18 HD12 LEU 18 99.592 5.227 -5.667
150 3HD1 LEU 18 HD13 LEU 18 99.201 6.484 -6.841
151 1HD2 LEU 18 HD21 LEU 18 97.900 4.487 -4.110
152 2HD2 LEU 18 HD22 LEU 18 97.327 3.528 -5.473
153 3HD2 LEU 18 HD23 LEU 18 96.201 4.541 -4.572
154 H HIS 19 HN HIS 19 97.193 8.882 -2.534
155 HA HIS 19 HA HIS 19 97.904 11.286 -3.867
156 1HB HIS 19 HB2 HIS 19 95.947 10.705 -2.134
157 2HB HIS 19 HB1 HIS 19 97.122 11.355 -0.995
158 HD1 HIS 19 HD1 HIS 19 94.777 13.040 -1.066
159 HD2 HIS 19 HD2 HIS 19 97.715 13.411 -3.981
160 HE1 HIS 19 HE1 HIS 19 94.481 15.344 -2.032
161 HE2 HIS 19 HE2 HIS 19 96.315 15.572 -3.743
162 H LEU 20 HN LEU 20 98.750 10.113 -0.596
163 HA LEU 20 HA LEU 20 100.443 11.121 0.734
164 1HB LEU 20 HB2 LEU 20 101.286 8.999 -1.134
165 2HB LEU 20 HB1 LEU 20 102.554 9.782 -0.220
166 HG LEU 20 HG LEU 20 100.176 8.287 0.873
167 1HD1 LEU 20 HD11 LEU 20 101.558 6.560 0.674
168 2HD1 LEU 20 HD12 LEU 20 102.487 7.291 1.988
169 3HD1 LEU 20 HD13 LEU 20 102.937 7.602 0.307
170 1HD2 LEU 20 HD21 LEU 20 100.312 9.558 2.687
171 2HD2 LEU 20 HD22 LEU 20 101.741 10.390 2.074
172 3HD2 LEU 20 HD23 LEU 20 101.914 8.876 2.964
173 HA PRO 21 HA PRO 21 101.636 14.364 -2.593
174 1HB PRO 21 HB2 PRO 21 101.165 15.884 -0.057
175 2HB PRO 21 HB1 PRO 21 100.826 16.354 -1.727
176 1HG PRO 21 HG2 PRO 21 98.872 15.506 -0.128
177 2HG PRO 21 HG1 PRO 21 98.909 15.063 -1.844
178 1HD PRO 21 HD2 PRO 21 99.489 13.409 0.550
179 2HD PRO 21 HD1 PRO 21 98.865 12.927 -1.036
180 H ASN 22 HN ASN 22 103.725 13.446 -2.605
181 HA ASN 22 HA ASN 22 105.913 14.596 -2.213
182 1HB ASN 22 HB2 ASN 22 104.921 14.303 0.589
183 2HB ASN 22 HB1 ASN 22 106.637 14.078 0.306
184 1HD2 ASN 22 HD21 ASN 22 107.724 15.824 0.764
185 2HD2 ASN 22 HD22 ASN 22 107.249 17.447 0.419
186 H LEU 23 HN LEU 23 104.794 11.923 -0.145
187 HA LEU 23 HA LEU 23 106.893 10.296 -0.085
188 1HB LEU 23 HB2 LEU 23 104.574 9.827 0.767
189 2HB LEU 23 HB1 LEU 23 104.187 9.234 -0.836
190 HG LEU 23 HG LEU 23 106.587 8.014 0.315
191 1HD1 LEU 23 HD11 LEU 23 104.591 6.539 1.554
192 2HD1 LEU 23 HD12 LEU 23 104.215 8.221 1.943
193 3HD1 LEU 23 HD13 LEU 23 105.800 7.562 2.335
194 1HD2 LEU 23 HD21 LEU 23 104.500 6.196 -0.365
195 2HD2 LEU 23 HD22 LEU 23 106.024 6.508 -1.197
196 3HD2 LEU 23 HD23 LEU 23 104.596 7.457 -1.596
197 H ASN 24 HN ASN 24 107.689 8.500 -1.259
198 HA ASN 24 HA ASN 24 108.100 9.047 -4.021
199 1HB ASN 24 HB2 ASN 24 109.249 7.319 -2.121
200 2HB ASN 24 HB1 ASN 24 108.577 6.259 -3.358
201 1HD2 ASN 24 HD21 ASN 24 110.342 5.606 -4.415
202 2HD2 ASN 24 HD22 ASN 24 111.481 6.653 -5.184
203 H GLU 25 HN GLU 25 106.575 8.787 -5.592
204 HA GLU 25 HA GLU 25 104.162 7.461 -5.138
205 1HB GLU 25 HB2 GLU 25 103.667 7.923 -7.423
206 2HB GLU 25 HB1 GLU 25 104.599 9.282 -6.792
207 1HG GLU 25 HG2 GLU 25 106.007 7.061 -8.214
208 2HG GLU 25 HG1 GLU 25 105.134 8.279 -9.142
209 H GLU 26 HN GLU 26 107.244 6.333 -6.170
210 HA GLU 26 HA GLU 26 106.396 3.831 -7.287
211 1HB GLU 26 HB2 GLU 26 108.591 4.851 -7.836
212 2HB GLU 26 HB1 GLU 26 109.093 4.645 -6.164
213 1HG GLU 26 HG2 GLU 26 109.909 2.670 -6.730
214 2HG GLU 26 HG1 GLU 26 108.253 2.118 -6.975
215 H GLN 27 HN GLN 27 106.991 5.149 -4.218
216 HA GLN 27 HA GLN 27 107.164 2.644 -2.752
217 1HB GLN 27 HB2 GLN 27 107.382 5.494 -2.091
218 2HB GLN 27 HB1 GLN 27 106.479 4.575 -0.895
219 1HG GLN 27 HG2 GLN 27 109.282 4.028 -1.843
220 2HG GLN 27 HG1 GLN 27 108.803 4.683 -0.278
221 1HE2 GLN 27 HE21 GLN 27 106.904 3.159 0.647
222 2HE2 GLN 27 HE22 GLN 27 107.378 1.502 0.763
223 H ARG 28 HN ARG 28 104.860 5.148 -3.576
224 HA ARG 28 HA ARG 28 102.637 4.244 -2.120
225 1HB ARG 28 HB2 ARG 28 102.704 5.640 -4.811
226 2HB ARG 28 HB1 ARG 28 101.284 5.477 -3.790
227 1HG ARG 28 HG2 ARG 28 102.653 6.716 -2.016
228 2HG ARG 28 HG1 ARG 28 103.732 7.141 -3.344
229 1HD ARG 28 HD2 ARG 28 100.790 7.617 -3.587
230 2HD ARG 28 HD1 ARG 28 101.786 8.738 -2.690
231 HE ARG 28 HE ARG 28 102.298 8.074 -5.503
232 1HH1 ARG 28 HH11 ARG 28 102.049 10.425 -2.924
233 2HH1 ARG 28 HH12 ARG 28 102.425 11.764 -3.953
234 1HH2 ARG 28 HH21 ARG 28 102.766 9.842 -6.845
235 2HH2 ARG 28 HH22 ARG 28 102.833 11.435 -6.170
236 H ASN 29 HN ASN 29 103.608 3.630 -5.507
237 HA ASN 29 HA ASN 29 101.637 1.858 -6.241
238 1HB ASN 29 HB2 ASN 29 103.846 2.822 -7.452
239 2HB ASN 29 HB1 ASN 29 104.392 1.182 -7.113
240 1HD2 ASN 29 HD21 ASN 29 102.955 -0.564 -7.827
241 2HD2 ASN 29 HD22 ASN 29 102.090 -0.360 -9.307
242 H GLY 30 HN GLY 30 104.772 1.119 -4.694
243 1HA GLY 30 HA2 GLY 30 104.460 -1.649 -4.491
244 2HA GLY 30 HA1 GLY 30 105.393 -0.664 -3.372
245 H PHE 31 HN PHE 31 103.183 0.933 -2.484
246 HA PHE 31 HA PHE 31 102.219 -0.715 -0.381
247 1HB PHE 31 HB2 PHE 31 101.679 2.100 -1.271
248 2HB PHE 31 HB1 PHE 31 100.662 1.364 -0.040
249 HD1 PHE 31 HD1 PHE 31 102.968 3.691 -0.176
250 HD2 PHE 31 HD2 PHE 31 102.568 -0.199 1.504
251 HE1 PHE 31 HE1 PHE 31 104.630 4.262 1.539
252 HE2 PHE 31 HE2 PHE 31 104.233 0.365 3.221
253 HZ PHE 31 HZ PHE 31 105.265 2.602 3.241
254 H ILE 32 HN ILE 32 100.861 0.426 -3.406
255 HA ILE 32 HA ILE 32 98.185 -0.378 -2.959
256 HB ILE 32 HB ILE 32 99.270 -0.509 -5.731
257 1HG1 ILE 32 HG12 ILE 32 98.884 2.095 -4.239
258 2HG1 ILE 32 HG11 ILE 32 100.428 1.437 -4.766
259 1HG2 ILE 32 HG21 ILE 32 97.141 -0.212 -6.306
260 2HG2 ILE 32 HG22 ILE 32 96.941 1.146 -5.197
261 3HG2 ILE 32 HG23 ILE 32 96.759 -0.508 -4.609
262 1HD1 ILE 32 HD11 ILE 32 98.175 2.210 -6.596
263 2HD1 ILE 32 HD12 ILE 32 99.774 1.639 -7.075
264 3HD1 ILE 32 HD13 ILE 32 99.602 3.190 -6.253
265 H GLN 33 HN GLN 33 100.933 -2.017 -4.452
266 HA GLN 33 HA GLN 33 99.527 -4.329 -5.268
267 1HB GLN 33 HB2 GLN 33 102.461 -3.993 -4.615
268 2HB GLN 33 HB1 GLN 33 101.762 -5.365 -5.463
269 1HG GLN 33 HG2 GLN 33 101.096 -3.945 -7.297
270 2HG GLN 33 HG1 GLN 33 101.672 -2.518 -6.436
271 1HE2 GLN 33 HE21 GLN 33 103.745 -1.935 -6.638
272 2HE2 GLN 33 HE22 GLN 33 104.950 -2.839 -7.484
273 H SER 34 HN SER 34 101.545 -3.700 -2.398
274 HA SER 34 HA SER 34 101.185 -6.233 -1.222
275 1HB SER 34 HB2 SER 34 102.975 -4.800 -0.469
276 2HB SER 34 HB1 SER 34 101.833 -3.550 0.023
277 HG SER 34 HG SER 34 102.533 -5.924 1.279
278 H LEU 35 HN LEU 35 99.397 -3.202 -0.901
279 HA LEU 35 HA LEU 35 97.614 -4.124 1.117
280 1HB LEU 35 HB2 LEU 35 97.796 -1.802 0.947
281 2HB LEU 35 HB1 LEU 35 97.616 -1.815 -0.797
282 HG LEU 35 HG LEU 35 95.251 -2.307 -0.594
283 1HD1 LEU 35 HD11 LEU 35 94.770 -1.907 2.164
284 2HD1 LEU 35 HD12 LEU 35 95.992 -3.171 2.016
285 3HD1 LEU 35 HD13 LEU 35 94.441 -3.340 1.191
286 1HD2 LEU 35 HD21 LEU 35 95.029 -0.195 1.266
287 2HD2 LEU 35 HD22 LEU 35 94.976 -0.105 -0.495
288 3HD2 LEU 35 HD23 LEU 35 96.514 0.072 0.353
289 H LYS 36 HN LYS 36 97.227 -3.739 -2.426
290 HA LYS 36 HA LYS 36 94.609 -4.594 -2.641
291 1HB LYS 36 HB2 LYS 36 96.166 -3.693 -4.462
292 2HB LYS 36 HB1 LYS 36 96.725 -5.350 -4.646
293 1HG LYS 36 HG2 LYS 36 95.012 -5.811 -5.964
294 2HG LYS 36 HG1 LYS 36 93.877 -5.341 -4.697
295 1HD LYS 36 HD2 LYS 36 95.147 -3.082 -6.063
296 2HD LYS 36 HD1 LYS 36 94.153 -4.092 -7.116
297 1HE LYS 36 HE2 LYS 36 93.285 -2.802 -4.530
298 2HE LYS 36 HE1 LYS 36 92.830 -2.291 -6.156
299 1HZ LYS 36 HZ1 LYS 36 91.985 -4.689 -4.666
300 2HZ LYS 36 HZ2 LYS 36 91.944 -4.684 -6.357
301 3HZ LYS 36 HZ3 LYS 36 91.036 -3.553 -5.487
302 H ASP 37 HN ASP 37 97.481 -6.715 -3.190
303 HA ASP 37 HA ASP 37 96.106 -9.077 -3.398
304 1HB ASP 37 HB2 ASP 37 98.747 -8.370 -3.392
305 2HB ASP 37 HB1 ASP 37 98.636 -9.332 -1.921
306 H ASP 38 HN ASP 38 96.495 -7.199 -0.541
307 HA ASP 38 HA ASP 38 95.112 -9.286 0.951
308 1HB ASP 38 HB2 ASP 38 97.782 -9.107 1.267
309 2HB ASP 38 HB1 ASP 38 97.254 -7.931 2.467
310 HA PRO 39 HA PRO 39 92.988 -5.349 1.830
311 1HB PRO 39 HB2 PRO 39 90.741 -6.532 2.825
312 2HB PRO 39 HB1 PRO 39 91.023 -6.297 1.098
313 1HG PRO 39 HG2 PRO 39 91.423 -8.747 2.766
314 2HG PRO 39 HG1 PRO 39 90.721 -8.599 1.144
315 1HD PRO 39 HD2 PRO 39 93.256 -9.432 1.544
316 2HD PRO 39 HD1 PRO 39 92.789 -8.473 0.123
317 H SER 40 HN SER 40 93.480 -8.132 3.892
318 HA SER 40 HA SER 40 92.791 -6.861 6.352
319 1HB SER 40 HB2 SER 40 92.797 -9.322 6.064
320 2HB SER 40 HB1 SER 40 94.551 -9.280 5.889
321 HG SER 40 HG SER 40 93.855 -9.777 8.035
322 H GLN 41 HN GLN 41 95.361 -6.405 4.270
323 HA GLN 41 HA GLN 41 97.290 -5.760 6.356
324 1HB GLN 41 HB2 GLN 41 97.464 -5.889 3.345
325 2HB GLN 41 HB1 GLN 41 98.779 -5.310 4.366
326 1HG GLN 41 HG2 GLN 41 98.733 -7.500 5.556
327 2HG GLN 41 HG1 GLN 41 97.584 -8.066 4.346
328 1HE2 GLN 41 HE21 GLN 41 98.758 -6.701 2.130
329 2HE2 GLN 41 HE22 GLN 41 100.251 -7.489 1.771
330 H SER 42 HN SER 42 94.819 -4.203 4.743
331 HA SER 42 HA SER 42 95.611 -1.794 3.850
332 1HB SER 42 HB2 SER 42 93.524 -0.999 5.456
333 2HB SER 42 HB1 SER 42 93.367 -1.700 3.851
334 HG SER 42 HG SER 42 93.006 -2.883 6.360
335 H ALA 43 HN ALA 43 95.545 -2.647 7.320
336 HA ALA 43 HA ALA 43 96.158 -0.020 8.203
337 1HB ALA 43 HB1 ALA 43 96.532 -1.031 10.363
338 2HB ALA 43 HB2 ALA 43 96.613 -2.634 9.633
339 3HB ALA 43 HB3 ALA 43 95.095 -1.735 9.621
340 H ASN 44 HN ASN 44 98.144 -2.892 7.571
341 HA ASN 44 HA ASN 44 100.572 -1.784 8.489
342 1HB ASN 44 HB2 ASN 44 99.714 -4.196 7.086
343 2HB ASN 44 HB1 ASN 44 101.292 -3.629 6.547
344 1HD2 ASN 44 HD21 ASN 44 99.514 -5.135 9.041
345 2HD2 ASN 44 HD22 ASN 44 100.826 -5.390 10.136
346 H LEU 45 HN LEU 45 99.015 -1.824 5.325
347 HA LEU 45 HA LEU 45 101.225 -0.536 4.010
348 1HB LEU 45 HB2 LEU 45 98.409 -1.166 3.161
349 2HB LEU 45 HB1 LEU 45 99.524 -0.303 2.132
350 HG LEU 45 HG LEU 45 99.484 -2.613 1.475
351 1HD1 LEU 45 HD11 LEU 45 101.927 -3.244 2.175
352 2HD1 LEU 45 HD12 LEU 45 101.950 -1.595 2.791
353 3HD1 LEU 45 HD13 LEU 45 101.617 -1.894 1.086
354 1HD2 LEU 45 HD21 LEU 45 98.682 -3.500 3.625
355 2HD2 LEU 45 HD22 LEU 45 100.303 -3.288 4.291
356 3HD2 LEU 45 HD23 LEU 45 100.034 -4.417 2.961
357 H LEU 46 HN LEU 46 97.941 0.446 4.945
358 HA LEU 46 HA LEU 46 98.109 3.103 4.091
359 1HB LEU 46 HB2 LEU 46 96.039 1.833 4.764
360 2HB LEU 46 HB1 LEU 46 96.495 2.109 6.433
361 HG LEU 46 HG LEU 46 96.046 4.366 4.488
362 1HD1 LEU 46 HD11 LEU 46 93.808 4.580 5.334
363 2HD1 LEU 46 HD12 LEU 46 94.046 3.217 6.427
364 3HD1 LEU 46 HD13 LEU 46 94.017 2.954 4.684
365 1HD2 LEU 46 HD21 LEU 46 96.600 4.102 7.386
366 2HD2 LEU 46 HD22 LEU 46 95.452 5.350 6.893
367 3HD2 LEU 46 HD23 LEU 46 97.093 5.353 6.243
368 H ALA 47 HN ALA 47 98.910 1.659 7.248
369 HA ALA 47 HA ALA 47 99.498 4.167 8.472
370 1HB ALA 47 HB1 ALA 47 100.051 2.960 10.372
371 2HB ALA 47 HB2 ALA 47 100.589 1.557 9.449
372 3HB ALA 47 HB3 ALA 47 98.868 1.920 9.580
373 H GLU 48 HN GLU 48 101.461 1.613 6.987
374 HA GLU 48 HA GLU 48 103.976 2.697 7.621
375 1HB GLU 48 HB2 GLU 48 102.998 0.822 5.490
376 2HB GLU 48 HB1 GLU 48 104.663 1.383 5.481
377 1HG GLU 48 HG2 GLU 48 103.555 0.232 7.989
378 2HG GLU 48 HG1 GLU 48 103.983 -0.852 6.666
379 H ALA 49 HN ALA 49 101.826 3.182 4.860
380 HA ALA 49 HA ALA 49 103.622 4.853 3.414
381 1HB ALA 49 HB1 ALA 49 102.058 4.839 1.797
382 2HB ALA 49 HB2 ALA 49 100.741 5.184 2.918
383 3HB ALA 49 HB3 ALA 49 101.357 3.539 2.762
384 H LYS 50 HN LYS 50 100.991 5.457 5.702
385 HA LYS 50 HA LYS 50 100.785 8.226 5.378
386 1HB LYS 50 HB2 LYS 50 100.207 6.356 7.649
387 2HB LYS 50 HB1 LYS 50 100.071 8.092 7.889
388 1HG LYS 50 HG2 LYS 50 98.662 6.703 5.639
389 2HG LYS 50 HG1 LYS 50 97.962 6.802 7.256
390 1HD LYS 50 HD2 LYS 50 97.870 9.161 7.175
391 2HD LYS 50 HD1 LYS 50 98.923 9.229 5.761
392 1HE LYS 50 HE2 LYS 50 97.125 9.234 4.460
393 2HE LYS 50 HE1 LYS 50 96.714 7.625 5.055
394 1HZ LYS 50 HZ1 LYS 50 95.588 10.206 5.761
395 2HZ LYS 50 HZ2 LYS 50 95.816 9.134 7.050
396 3HZ LYS 50 HZ3 LYS 50 94.862 8.676 5.731
397 H LYS 51 HN LYS 51 102.653 6.431 7.844
398 HA LYS 51 HA LYS 51 103.961 8.732 8.836
399 1HB LYS 51 HB2 LYS 51 105.386 7.198 10.055
400 2HB LYS 51 HB1 LYS 51 103.718 6.652 10.135
401 1HG LYS 51 HG2 LYS 51 104.584 4.660 9.606
402 2HG LYS 51 HG1 LYS 51 104.599 5.295 7.961
403 1HD LYS 51 HD2 LYS 51 106.757 4.375 8.392
404 2HD LYS 51 HD1 LYS 51 106.921 6.132 8.401
405 1HE LYS 51 HE2 LYS 51 108.103 5.597 10.289
406 2HE LYS 51 HE1 LYS 51 106.497 5.836 10.976
407 1HZ LYS 51 HZ1 LYS 51 106.206 3.607 11.311
408 2HZ LYS 51 HZ2 LYS 51 107.876 3.723 11.550
409 3HZ LYS 51 HZ3 LYS 51 107.272 3.151 10.078
410 H LEU 52 HN LEU 52 104.793 6.382 6.353
411 HA LEU 52 HA LEU 52 107.467 7.003 5.970
412 1HB LEU 52 HB2 LEU 52 106.313 5.139 4.867
413 2HB LEU 52 HB1 LEU 52 105.421 6.278 3.876
414 HG LEU 52 HG LEU 52 107.572 7.031 2.884
415 1HD1 LEU 52 HD11 LEU 52 108.817 6.016 4.985
416 2HD1 LEU 52 HD12 LEU 52 109.601 6.133 3.410
417 3HD1 LEU 52 HD13 LEU 52 108.911 4.599 3.939
418 1HD2 LEU 52 HD21 LEU 52 107.991 4.639 1.812
419 2HD2 LEU 52 HD22 LEU 52 106.558 5.601 1.444
420 3HD2 LEU 52 HD23 LEU 52 106.465 4.296 2.629
421 H ASN 53 HN ASN 53 104.691 8.372 4.218
422 HA ASN 53 HA ASN 53 105.976 10.192 2.639
423 1HB ASN 53 HB2 ASN 53 103.648 9.963 2.335
424 2HB ASN 53 HB1 ASN 53 103.297 10.341 4.011
425 1HD2 ASN 53 HD21 ASN 53 103.183 11.491 0.950
426 2HD2 ASN 53 HD22 ASN 53 103.151 13.186 1.271
427 H ASP 54 HN ASP 54 104.805 10.878 5.948
428 HA ASP 54 HA ASP 54 105.885 13.488 6.045
429 1HB ASP 54 HB2 ASP 54 105.330 13.461 8.395
430 2HB ASP 54 HB1 ASP 54 104.030 12.699 7.488
431 H ALA 55 HN ALA 55 107.271 10.387 6.569
432 HA ALA 55 HA ALA 55 109.516 11.358 8.131
433 1HB ALA 55 HB1 ALA 55 110.316 8.915 7.582
434 2HB ALA 55 HB2 ALA 55 108.618 8.700 7.157
435 3HB ALA 55 HB3 ALA 55 109.062 9.221 8.782
436 H GLN 56 HN GLN 56 109.046 10.123 4.821
437 HA GLN 56 HA GLN 56 111.804 10.812 4.161
438 1HB GLN 56 HB2 GLN 56 111.293 9.638 1.996
439 2HB GLN 56 HB1 GLN 56 111.208 8.633 3.434
440 1HG GLN 56 HG2 GLN 56 109.154 8.034 2.910
441 2HG GLN 56 HG1 GLN 56 108.631 9.714 2.981
442 1HE2 GLN 56 HE21 GLN 56 109.228 10.998 0.975
443 2HE2 GLN 56 HE22 GLN 56 108.914 10.225 -0.538
444 H ALA 57 HN ALA 57 108.921 12.433 4.099
445 HA ALA 57 HA ALA 57 108.314 13.566 1.797
446 1HB ALA 57 HB1 ALA 57 108.424 15.868 3.032
447 2HB ALA 57 HB2 ALA 57 108.834 14.871 4.428
448 3HB ALA 57 HB3 ALA 57 107.309 14.616 3.578
449 HA PRO 58 HA PRO 58 112.434 14.722 0.222
450 1HB PRO 58 HB2 PRO 58 111.763 14.746 -2.384
451 2HB PRO 58 HB1 PRO 58 112.051 13.238 -1.505
452 1HG PRO 58 HG2 PRO 58 109.451 14.569 -2.183
453 2HG PRO 58 HG1 PRO 58 109.898 12.858 -2.320
454 1HD PRO 58 HD2 PRO 58 108.456 13.839 -0.241
455 2HD PRO 58 HD1 PRO 58 109.562 12.464 -0.079
456 H LYS 59 HN LYS 59 113.305 16.616 -0.514
457 HA LYS 59 HA LYS 59 112.267 18.664 -1.935
458 1HB LYS 59 HB2 LYS 59 110.945 18.552 0.623
459 2HB LYS 59 HB1 LYS 59 111.872 20.041 0.505
460 1HG LYS 59 HG2 LYS 59 110.416 20.945 -0.904
461 2HG LYS 59 HG1 LYS 59 110.413 19.512 -1.932
462 1HD LYS 59 HD2 LYS 59 109.009 18.846 0.432
463 2HD LYS 59 HD1 LYS 59 108.415 20.420 -0.099
464 1HE LYS 59 HE2 LYS 59 108.367 17.795 -1.545
465 2HE LYS 59 HE1 LYS 59 107.037 18.902 -1.212
466 1HZ LYS 59 HZ1 LYS 59 108.890 18.869 -3.415
467 2HZ LYS 59 HZ2 LYS 59 108.700 20.402 -2.725
468 3HZ LYS 59 HZ3 LYS 59 107.351 19.564 -3.306
469 H ALA 60 HN ALA 60 113.155 20.959 -0.670
470 HA ALA 60 HA ALA 60 115.042 22.129 -0.160
471 1HB ALA 60 HB1 ALA 60 115.945 19.541 1.101
472 2HB ALA 60 HB2 ALA 60 115.002 20.801 1.898
473 3HB ALA 60 HB3 ALA 60 116.653 21.134 1.373
Start of MODEL 25
1 1H GLY -1 HT1 GLY -1 90.650 -14.288 -5.814
2 2H GLY -1 HT2 GLY -1 92.252 -14.387 -6.347
3 3H GLY -1 HT3 GLY -1 91.744 -15.311 -5.025
4 1HA GLY -1 HA1 GLY -1 91.879 -16.179 -7.588
5 2HA GLY -1 HA2 GLY -1 90.972 -16.946 -6.293
6 H SER 0 HN SER 0 88.778 -16.952 -6.360
7 HA SER 0 HA SER 0 87.546 -16.202 -8.846
8 1HB SER 0 HB2 SER 0 85.440 -17.035 -7.581
9 2HB SER 0 HB1 SER 0 86.696 -18.206 -7.981
10 HG SER 0 HG SER 0 86.427 -16.877 -5.486
11 H THR 1 HN THR 1 86.430 -14.419 -9.296
12 HA THR 1 HA THR 1 85.554 -12.332 -9.098
13 HB THR 1 HB THR 1 83.851 -12.020 -7.459
14 HG1 THR 1 HG1 THR 1 84.406 -12.543 -5.510
15 1HG2 THR 1 HG21 THR 1 82.705 -13.539 -8.603
16 2HG2 THR 1 HG22 THR 1 83.072 -14.633 -7.269
17 3HG2 THR 1 HG23 THR 1 84.086 -14.631 -8.713
18 H ALA 2 HN ALA 2 87.982 -11.863 -8.801
19 HA ALA 2 HA ALA 2 89.011 -11.115 -6.286
20 1HB ALA 2 HB1 ALA 2 90.101 -11.393 -8.719
21 2HB ALA 2 HB2 ALA 2 90.873 -10.495 -7.413
22 3HB ALA 2 HB3 ALA 2 89.966 -9.636 -8.658
23 H ASP 3 HN ASP 3 87.079 -10.046 -5.452
24 HA ASP 3 HA ASP 3 86.908 -7.237 -6.312
25 1HB ASP 3 HB2 ASP 3 84.861 -9.126 -5.191
26 2HB ASP 3 HB1 ASP 3 84.665 -7.388 -4.986
27 H ASN 4 HN ASN 4 88.755 -6.735 -4.999
28 HA ASN 4 HA ASN 4 89.205 -7.230 -2.367
29 1HB ASN 4 HB2 ASN 4 90.506 -5.188 -2.305
30 2HB ASN 4 HB1 ASN 4 90.704 -5.963 -3.872
31 1HD2 ASN 4 HD21 ASN 4 91.116 -3.188 -3.130
32 2HD2 ASN 4 HD22 ASN 4 90.071 -2.257 -4.142
33 H LYS 5 HN LYS 5 86.497 -5.557 -3.542
34 HA LYS 5 HA LYS 5 84.734 -4.556 -2.538
35 1HB LYS 5 HB2 LYS 5 84.824 -6.484 -1.066
36 2HB LYS 5 HB1 LYS 5 86.001 -5.677 -0.041
37 1HG LYS 5 HG2 LYS 5 84.363 -4.014 0.590
38 2HG LYS 5 HG1 LYS 5 83.180 -4.732 -0.505
39 1HD LYS 5 HD2 LYS 5 84.397 -6.559 1.469
40 2HD LYS 5 HD1 LYS 5 83.332 -5.312 2.123
41 1HE LYS 5 HE2 LYS 5 82.465 -6.951 -0.223
42 2HE LYS 5 HE1 LYS 5 82.348 -7.612 1.407
43 1HZ LYS 5 HZ1 LYS 5 80.612 -6.316 1.882
44 2HZ LYS 5 HZ2 LYS 5 80.473 -6.082 0.212
45 3HZ LYS 5 HZ3 LYS 5 81.293 -4.945 1.159
46 H PHE 6 HN PHE 6 87.901 -3.637 -1.414
47 HA PHE 6 HA PHE 6 87.860 -1.748 0.366
48 1HB PHE 6 HB2 PHE 6 89.016 -1.554 -2.392
49 2HB PHE 6 HB1 PHE 6 89.168 -0.200 -1.286
50 HD1 PHE 6 HD1 PHE 6 89.654 -3.908 -1.173
51 HD2 PHE 6 HD2 PHE 6 91.147 -0.057 -0.161
52 HE1 PHE 6 HE1 PHE 6 91.651 -4.947 -0.187
53 HE2 PHE 6 HE2 PHE 6 93.146 -1.089 0.836
54 HZ PHE 6 HZ PHE 6 93.403 -3.541 0.825
55 H ASN 7 HN ASN 7 85.546 -1.113 0.585
56 HA ASN 7 HA ASN 7 84.594 0.763 -1.385
57 1HB ASN 7 HB2 ASN 7 82.751 0.745 0.733
58 2HB ASN 7 HB1 ASN 7 82.632 -0.089 -0.804
59 1HD2 ASN 7 HD21 ASN 7 84.025 -0.449 2.436
60 2HD2 ASN 7 HD22 ASN 7 83.774 -2.154 2.536
61 H LYS 8 HN LYS 8 83.828 1.404 1.993
62 HA LYS 8 HA LYS 8 84.541 4.146 1.579
63 1HB LYS 8 HB2 LYS 8 83.708 4.386 3.969
64 2HB LYS 8 HB1 LYS 8 82.551 3.861 2.755
65 1HG LYS 8 HG2 LYS 8 83.661 1.513 3.805
66 2HG LYS 8 HG1 LYS 8 83.369 2.571 5.185
67 1HD LYS 8 HD2 LYS 8 81.360 1.415 4.949
68 2HD LYS 8 HD1 LYS 8 81.051 2.950 4.134
69 1HE LYS 8 HE2 LYS 8 82.039 0.557 2.622
70 2HE LYS 8 HE1 LYS 8 80.324 0.769 2.973
71 1HZ LYS 8 HZ1 LYS 8 80.563 3.024 1.914
72 2HZ LYS 8 HZ2 LYS 8 80.686 1.704 0.864
73 3HZ LYS 8 HZ3 LYS 8 82.080 2.522 1.358
74 H GLU 9 HN GLU 9 85.490 1.899 4.209
75 HA GLU 9 HA GLU 9 87.546 3.677 5.071
76 1HB GLU 9 HB2 GLU 9 86.252 2.212 6.590
77 2HB GLU 9 HB1 GLU 9 87.064 0.817 5.892
78 1HG GLU 9 HG2 GLU 9 88.979 2.783 6.754
79 2HG GLU 9 HG1 GLU 9 87.887 2.348 8.067
80 H GLN 10 HN GLN 10 87.681 0.417 3.616
81 HA GLN 10 HA GLN 10 90.465 0.228 3.612
82 1HB GLN 10 HB2 GLN 10 88.436 -1.438 2.925
83 2HB GLN 10 HB1 GLN 10 89.090 -1.041 1.342
84 1HG GLN 10 HG2 GLN 10 90.451 -2.763 1.742
85 2HG GLN 10 HG1 GLN 10 91.363 -1.579 2.675
86 1HE2 GLN 10 HE21 GLN 10 91.953 -3.890 3.490
87 2HE2 GLN 10 HE22 GLN 10 91.109 -4.390 4.906
88 H GLN 11 HN GLN 11 88.310 1.255 0.957
89 HA GLN 11 HA GLN 11 90.281 1.759 -0.934
90 1HB GLN 11 HB2 GLN 11 87.908 1.737 -1.480
91 2HB GLN 11 HB1 GLN 11 87.659 3.198 -0.540
92 1HG GLN 11 HG2 GLN 11 89.562 4.052 -2.232
93 2HG GLN 11 HG1 GLN 11 88.769 2.844 -3.241
94 1HE2 GLN 11 HE21 GLN 11 87.891 5.450 -0.994
95 2HE2 GLN 11 HE22 GLN 11 86.614 6.089 -1.966
96 H ASN 12 HN ASN 12 89.243 3.679 1.801
97 HA ASN 12 HA ASN 12 90.195 6.178 1.113
98 1HB ASN 12 HB2 ASN 12 88.994 5.684 3.227
99 2HB ASN 12 HB1 ASN 12 90.424 4.853 3.831
100 1HD2 ASN 12 HD21 ASN 12 91.892 5.997 4.893
101 2HD2 ASN 12 HD22 ASN 12 91.949 7.721 4.979
102 H ALA 13 HN ALA 13 91.952 3.398 2.454
103 HA ALA 13 HA ALA 13 94.451 4.583 2.709
104 1HB ALA 13 HB1 ALA 13 95.267 2.472 3.016
105 2HB ALA 13 HB2 ALA 13 94.316 1.792 1.695
106 3HB ALA 13 HB3 ALA 13 93.548 2.146 3.243
107 H PHE 14 HN PHE 14 92.981 2.963 -0.138
108 HA PHE 14 HA PHE 14 95.119 3.114 -1.865
109 1HB PHE 14 HB2 PHE 14 92.964 1.912 -2.215
110 2HB PHE 14 HB1 PHE 14 92.201 3.452 -2.564
111 HD1 PHE 14 HD1 PHE 14 92.847 4.724 -4.583
112 HD2 PHE 14 HD2 PHE 14 94.265 0.778 -3.848
113 HE1 PHE 14 HE1 PHE 14 93.480 4.514 -6.952
114 HE2 PHE 14 HE2 PHE 14 94.899 0.562 -6.216
115 HZ PHE 14 HZ PHE 14 94.507 2.430 -7.770
116 H TRP 15 HN TRP 15 92.413 5.415 -1.674
117 HA TRP 15 HA TRP 15 93.415 7.198 -3.567
118 1HB TRP 15 HB2 TRP 15 91.335 7.284 -1.491
119 2HB TRP 15 HB1 TRP 15 91.970 8.852 -1.982
120 HD1 TRP 15 HD1 TRP 15 91.002 5.690 -4.031
121 HE1 TRP 15 HE1 TRP 15 89.495 6.448 -5.975
122 HE3 TRP 15 HE3 TRP 15 90.802 10.690 -2.993
123 HZ2 TRP 15 HZ2 TRP 15 88.367 8.852 -6.939
124 HZ3 TRP 15 HZ3 TRP 15 89.488 12.151 -4.475
125 HH2 TRP 15 HH2 TRP 15 88.297 11.250 -6.407
126 H GLU 16 HN GLU 16 93.861 7.212 -0.055
127 HA GLU 16 HA GLU 16 95.342 9.660 -0.034
128 1HB GLU 16 HB2 GLU 16 94.363 8.814 2.031
129 2HB GLU 16 HB1 GLU 16 95.340 7.357 1.935
130 1HG GLU 16 HG2 GLU 16 97.027 9.674 1.872
131 2HG GLU 16 HG1 GLU 16 95.939 9.751 3.256
132 H ILE 17 HN ILE 17 96.368 6.284 0.231
133 HA ILE 17 HA ILE 17 99.089 6.583 0.106
134 HB ILE 17 HB ILE 17 97.416 4.378 -1.097
135 1HG1 ILE 17 HG12 ILE 17 99.094 4.238 1.393
136 2HG1 ILE 17 HG11 ILE 17 97.468 4.911 1.446
137 1HG2 ILE 17 HG21 ILE 17 99.840 3.245 -0.577
138 2HG2 ILE 17 HG22 ILE 17 100.309 4.833 -1.183
139 3HG2 ILE 17 HG23 ILE 17 99.295 3.778 -2.167
140 1HD1 ILE 17 HD11 ILE 17 96.868 2.803 1.877
141 2HD1 ILE 17 HD12 ILE 17 98.356 2.134 1.208
142 3HD1 ILE 17 HD13 ILE 17 97.030 2.580 0.135
143 H LEU 18 HN LEU 18 96.884 6.243 -2.647
144 HA LEU 18 HA LEU 18 98.658 6.257 -4.731
145 1HB LEU 18 HB2 LEU 18 95.822 6.890 -4.359
146 2HB LEU 18 HB1 LEU 18 96.545 7.706 -5.734
147 HG LEU 18 HG LEU 18 95.521 5.637 -6.445
148 1HD1 LEU 18 HD11 LEU 18 97.820 4.448 -7.117
149 2HD1 LEU 18 HD12 LEU 18 98.446 6.019 -6.611
150 3HD1 LEU 18 HD13 LEU 18 97.232 5.920 -7.888
151 1HD2 LEU 18 HD21 LEU 18 95.529 4.330 -4.475
152 2HD2 LEU 18 HD22 LEU 18 97.282 4.399 -4.349
153 3HD2 LEU 18 HD23 LEU 18 96.526 3.472 -5.645
154 H HIS 19 HN HIS 19 97.308 9.112 -3.109
155 HA HIS 19 HA HIS 19 98.618 10.900 -4.939
156 1HB HIS 19 HB2 HIS 19 96.627 11.083 -2.859
157 2HB HIS 19 HB1 HIS 19 97.830 12.353 -2.668
158 HD1 HIS 19 HD1 HIS 19 98.298 13.699 -5.067
159 HD2 HIS 19 HD2 HIS 19 94.658 11.753 -4.579
160 HE1 HIS 19 HE1 HIS 19 96.749 14.736 -6.756
161 HE2 HIS 19 HE2 HIS 19 94.532 13.595 -6.391
162 H LEU 20 HN LEU 20 99.043 10.050 -1.540
163 HA LEU 20 HA LEU 20 100.597 11.036 -0.104
164 1HB LEU 20 HB2 LEU 20 101.884 8.854 -1.668
165 2HB LEU 20 HB1 LEU 20 102.642 9.580 -0.270
166 HG LEU 20 HG LEU 20 100.104 7.981 -0.361
167 1HD1 LEU 20 HD11 LEU 20 101.669 7.127 1.728
168 2HD1 LEU 20 HD12 LEU 20 102.846 7.541 0.485
169 3HD1 LEU 20 HD13 LEU 20 101.572 6.376 0.134
170 1HD2 LEU 20 HD21 LEU 20 101.112 9.785 1.820
171 2HD2 LEU 20 HD22 LEU 20 99.986 8.460 2.112
172 3HD2 LEU 20 HD23 LEU 20 99.527 9.789 1.047
173 HA PRO 21 HA PRO 21 102.668 14.069 -2.940
174 1HB PRO 21 HB2 PRO 21 102.012 15.726 -0.560
175 2HB PRO 21 HB1 PRO 21 101.831 16.105 -2.276
176 1HG PRO 21 HG2 PRO 21 99.706 15.528 -0.763
177 2HG PRO 21 HG1 PRO 21 99.812 14.984 -2.448
178 1HD PRO 21 HD2 PRO 21 100.214 13.435 0.074
179 2HD PRO 21 HD1 PRO 21 99.475 12.927 -1.458
180 H ASN 22 HN ASN 22 104.654 13.190 -2.692
181 HA ASN 22 HA ASN 22 106.835 13.883 -1.855
182 1HB ASN 22 HB2 ASN 22 105.376 13.884 0.749
183 2HB ASN 22 HB1 ASN 22 107.096 13.531 0.744
184 1HD2 ASN 22 HD21 ASN 22 104.666 15.944 0.183
185 2HD2 ASN 22 HD22 ASN 22 105.741 17.291 0.068
186 H LEU 23 HN LEU 23 104.794 11.351 -0.564
187 HA LEU 23 HA LEU 23 106.905 9.551 0.034
188 1HB LEU 23 HB2 LEU 23 104.498 9.222 0.737
189 2HB LEU 23 HB1 LEU 23 104.157 8.751 -0.919
190 HG LEU 23 HG LEU 23 106.357 7.191 -0.002
191 1HD1 LEU 23 HD11 LEU 23 105.130 5.924 1.786
192 2HD1 LEU 23 HD12 LEU 23 104.028 7.294 1.894
193 3HD1 LEU 23 HD13 LEU 23 105.738 7.510 2.260
194 1HD2 LEU 23 HD21 LEU 23 104.225 6.869 -1.606
195 2HD2 LEU 23 HD22 LEU 23 103.717 5.933 -0.205
196 3HD2 LEU 23 HD23 LEU 23 105.230 5.551 -1.022
197 H ASN 24 HN ASN 24 108.061 8.116 -1.333
198 HA ASN 24 HA ASN 24 108.360 8.828 -4.007
199 1HB ASN 24 HB2 ASN 24 108.878 6.274 -2.499
200 2HB ASN 24 HB1 ASN 24 109.114 6.330 -4.243
201 1HD2 ASN 24 HD21 ASN 24 110.664 7.797 -5.093
202 2HD2 ASN 24 HD22 ASN 24 111.996 8.318 -4.125
203 H GLU 25 HN GLU 25 107.042 8.494 -5.846
204 HA GLU 25 HA GLU 25 104.476 7.431 -5.431
205 1HB GLU 25 HB2 GLU 25 104.576 9.067 -7.061
206 2HB GLU 25 HB1 GLU 25 106.055 8.426 -7.765
207 1HG GLU 25 HG2 GLU 25 104.330 8.047 -9.334
208 2HG GLU 25 HG1 GLU 25 104.711 6.484 -8.615
209 H GLU 26 HN GLU 26 107.504 6.073 -6.381
210 HA GLU 26 HA GLU 26 106.495 3.641 -7.504
211 1HB GLU 26 HB2 GLU 26 109.089 4.819 -6.942
212 2HB GLU 26 HB1 GLU 26 109.047 3.135 -6.440
213 1HG GLU 26 HG2 GLU 26 109.542 2.644 -8.544
214 2HG GLU 26 HG1 GLU 26 107.872 3.066 -8.921
215 H GLN 27 HN GLN 27 107.122 4.929 -4.395
216 HA GLN 27 HA GLN 27 107.017 2.431 -2.947
217 1HB GLN 27 HB2 GLN 27 107.118 5.324 -2.173
218 2HB GLN 27 HB1 GLN 27 106.565 4.146 -0.992
219 1HG GLN 27 HG2 GLN 27 109.134 3.705 -2.440
220 2HG GLN 27 HG1 GLN 27 109.064 4.826 -1.081
221 1HE2 GLN 27 HE21 GLN 27 109.780 3.909 0.694
222 2HE2 GLN 27 HE22 GLN 27 109.489 2.281 1.195
223 H ARG 28 HN ARG 28 104.886 5.064 -3.874
224 HA ARG 28 HA ARG 28 102.595 4.344 -2.427
225 1HB ARG 28 HB2 ARG 28 102.928 5.721 -5.100
226 2HB ARG 28 HB1 ARG 28 101.352 5.470 -4.365
227 1HG ARG 28 HG2 ARG 28 102.299 6.704 -2.339
228 2HG ARG 28 HG1 ARG 28 103.611 7.192 -3.413
229 1HD ARG 28 HD2 ARG 28 101.117 7.665 -4.709
230 2HD ARG 28 HD1 ARG 28 101.057 8.369 -3.120
231 HE ARG 28 HE ARG 28 103.173 9.528 -3.734
232 1HH1 ARG 28 HH11 ARG 28 100.964 8.475 -6.234
233 2HH1 ARG 28 HH12 ARG 28 101.499 9.664 -7.370
234 1HH2 ARG 28 HH21 ARG 28 103.864 11.085 -5.233
235 2HH2 ARG 28 HH22 ARG 28 103.140 11.143 -6.805
236 H ASN 29 HN ASN 29 103.531 3.552 -5.776
237 HA ASN 29 HA ASN 29 101.487 1.814 -6.425
238 1HB ASN 29 HB2 ASN 29 103.241 2.670 -7.984
239 2HB ASN 29 HB1 ASN 29 104.373 1.525 -7.271
240 1HD2 ASN 29 HD21 ASN 29 101.103 1.573 -8.651
241 2HD2 ASN 29 HD22 ASN 29 101.279 0.109 -9.552
242 H GLY 30 HN GLY 30 104.611 1.043 -4.870
243 1HA GLY 30 HA2 GLY 30 104.280 -1.728 -4.712
244 2HA GLY 30 HA1 GLY 30 105.214 -0.766 -3.575
245 H PHE 31 HN PHE 31 103.096 0.822 -2.594
246 HA PHE 31 HA PHE 31 102.093 -0.855 -0.552
247 1HB PHE 31 HB2 PHE 31 101.655 1.994 -1.362
248 2HB PHE 31 HB1 PHE 31 100.583 1.268 -0.169
249 HD1 PHE 31 HD1 PHE 31 102.393 -0.437 1.339
250 HD2 PHE 31 HD2 PHE 31 102.987 3.490 -0.186
251 HE1 PHE 31 HE1 PHE 31 104.057 -0.010 3.098
252 HE2 PHE 31 HE2 PHE 31 104.652 3.924 1.571
253 HZ PHE 31 HZ PHE 31 105.191 2.173 3.216
254 H ILE 32 HN ILE 32 100.802 0.232 -3.592
255 HA ILE 32 HA ILE 32 98.078 -0.461 -3.077
256 HB ILE 32 HB ILE 32 98.869 -0.586 -5.896
257 1HG1 ILE 32 HG12 ILE 32 100.212 1.347 -4.376
258 2HG1 ILE 32 HG11 ILE 32 100.103 1.225 -6.116
259 1HG2 ILE 32 HG21 ILE 32 96.983 0.889 -6.171
260 2HG2 ILE 32 HG22 ILE 32 96.918 1.179 -4.433
261 3HG2 ILE 32 HG23 ILE 32 96.559 -0.425 -5.073
262 1HD1 ILE 32 HD11 ILE 32 98.298 2.746 -6.186
263 2HD1 ILE 32 HD12 ILE 32 99.515 3.444 -5.116
264 3HD1 ILE 32 HD13 ILE 32 98.086 2.666 -4.437
265 H GLN 33 HN GLN 33 100.750 -2.026 -4.738
266 HA GLN 33 HA GLN 33 99.339 -4.300 -5.628
267 1HB GLN 33 HB2 GLN 33 102.249 -3.786 -5.065
268 2HB GLN 33 HB1 GLN 33 101.688 -5.371 -5.582
269 1HG GLN 33 HG2 GLN 33 101.345 -4.708 -7.700
270 2HG GLN 33 HG1 GLN 33 100.761 -3.115 -7.220
271 1HE2 GLN 33 HE21 GLN 33 102.327 -3.167 -9.346
272 2HE2 GLN 33 HE22 GLN 33 103.913 -2.584 -8.990
273 H SER 34 HN SER 34 101.329 -3.803 -2.715
274 HA SER 34 HA SER 34 100.844 -6.379 -1.632
275 1HB SER 34 HB2 SER 34 102.771 -4.944 -0.992
276 2HB SER 34 HB1 SER 34 101.655 -3.853 -0.171
277 HG SER 34 HG SER 34 101.269 -5.362 1.344
278 H LEU 35 HN LEU 35 99.308 -3.232 -1.179
279 HA LEU 35 HA LEU 35 97.551 -4.094 0.904
280 1HB LEU 35 HB2 LEU 35 98.065 -1.761 0.727
281 2HB LEU 35 HB1 LEU 35 97.521 -1.706 -0.939
282 HG LEU 35 HG LEU 35 95.233 -1.922 -0.296
283 1HD1 LEU 35 HD11 LEU 35 94.694 -2.032 2.199
284 2HD1 LEU 35 HD12 LEU 35 96.357 -2.586 2.401
285 3HD1 LEU 35 HD13 LEU 35 95.233 -3.515 1.412
286 1HD2 LEU 35 HD21 LEU 35 96.920 0.161 0.803
287 2HD2 LEU 35 HD22 LEU 35 95.447 -0.057 1.748
288 3HD2 LEU 35 HD23 LEU 35 95.344 0.280 0.019
289 H LYS 36 HN LYS 36 97.153 -3.583 -2.605
290 HA LYS 36 HA LYS 36 94.428 -4.155 -2.692
291 1HB LYS 36 HB2 LYS 36 94.638 -4.370 -5.052
292 2HB LYS 36 HB1 LYS 36 95.756 -3.118 -4.538
293 1HG LYS 36 HG2 LYS 36 97.562 -4.872 -4.599
294 2HG LYS 36 HG1 LYS 36 96.391 -5.924 -5.395
295 1HD LYS 36 HD2 LYS 36 96.095 -3.841 -6.976
296 2HD LYS 36 HD1 LYS 36 97.712 -3.445 -6.391
297 1HE LYS 36 HE2 LYS 36 98.156 -5.982 -6.984
298 2HE LYS 36 HE1 LYS 36 96.796 -5.720 -8.075
299 1HZ LYS 36 HZ1 LYS 36 99.294 -5.219 -8.760
300 2HZ LYS 36 HZ2 LYS 36 98.906 -3.710 -8.102
301 3HZ LYS 36 HZ3 LYS 36 97.990 -4.335 -9.379
302 H ASP 37 HN ASP 37 97.116 -6.473 -3.547
303 HA ASP 37 HA ASP 37 95.413 -8.645 -3.819
304 1HB ASP 37 HB2 ASP 37 98.303 -8.209 -3.522
305 2HB ASP 37 HB1 ASP 37 97.751 -9.788 -2.972
306 H ASP 38 HN ASP 38 96.416 -7.056 -0.939
307 HA ASP 38 HA ASP 38 95.104 -9.164 0.618
308 1HB ASP 38 HB2 ASP 38 97.800 -9.030 0.596
309 2HB ASP 38 HB1 ASP 38 97.449 -7.913 1.912
310 HA PRO 39 HA PRO 39 93.306 -5.272 2.085
311 1HB PRO 39 HB2 PRO 39 91.005 -6.318 2.988
312 2HB PRO 39 HB1 PRO 39 91.296 -6.082 1.261
313 1HG PRO 39 HG2 PRO 39 91.505 -8.581 2.891
314 2HG PRO 39 HG1 PRO 39 90.810 -8.353 1.277
315 1HD PRO 39 HD2 PRO 39 93.323 -9.349 1.729
316 2HD PRO 39 HD1 PRO 39 92.850 -8.497 0.246
317 H SER 40 HN SER 40 94.027 -8.219 3.752
318 HA SER 40 HA SER 40 93.307 -7.377 6.379
319 1HB SER 40 HB2 SER 40 93.712 -9.779 5.546
320 2HB SER 40 HB1 SER 40 95.428 -9.424 5.744
321 HG SER 40 HG SER 40 93.478 -9.860 7.646
322 H GLN 41 HN GLN 41 95.792 -6.511 4.270
323 HA GLN 41 HA GLN 41 97.654 -5.786 6.390
324 1HB GLN 41 HB2 GLN 41 97.930 -5.453 3.401
325 2HB GLN 41 HB1 GLN 41 99.204 -5.269 4.603
326 1HG GLN 41 HG2 GLN 41 98.903 -7.668 5.192
327 2HG GLN 41 HG1 GLN 41 97.784 -7.805 3.837
328 1HE2 GLN 41 HE21 GLN 41 101.087 -7.438 4.807
329 2HE2 GLN 41 HE22 GLN 41 101.794 -7.716 3.256
330 H SER 42 HN SER 42 95.058 -4.399 4.728
331 HA SER 42 HA SER 42 95.620 -1.869 4.046
332 1HB SER 42 HB2 SER 42 93.312 -3.207 4.778
333 2HB SER 42 HB1 SER 42 93.361 -1.837 5.885
334 HG SER 42 HG SER 42 92.690 -0.690 4.272
335 H ALA 43 HN ALA 43 95.330 -2.904 7.443
336 HA ALA 43 HA ALA 43 95.777 -0.297 8.492
337 1HB ALA 43 HB1 ALA 43 95.288 -2.946 9.530
338 2HB ALA 43 HB2 ALA 43 94.932 -1.373 10.243
339 3HB ALA 43 HB3 ALA 43 96.520 -2.105 10.470
340 H ASN 44 HN ASN 44 97.874 -3.085 7.912
341 HA ASN 44 HA ASN 44 100.192 -2.011 9.111
342 1HB ASN 44 HB2 ASN 44 99.688 -4.210 7.132
343 2HB ASN 44 HB1 ASN 44 101.335 -3.726 7.523
344 1HD2 ASN 44 HD21 ASN 44 101.588 -3.429 10.029
345 2HD2 ASN 44 HD22 ASN 44 101.033 -4.773 10.960
346 H LEU 45 HN LEU 45 98.983 -1.915 5.780
347 HA LEU 45 HA LEU 45 101.304 -0.617 4.747
348 1HB LEU 45 HB2 LEU 45 98.567 -1.198 3.699
349 2HB LEU 45 HB1 LEU 45 99.582 -0.063 2.842
350 HG LEU 45 HG LEU 45 100.099 -1.954 1.688
351 1HD1 LEU 45 HD11 LEU 45 102.248 -2.576 2.138
352 2HD1 LEU 45 HD12 LEU 45 101.968 -2.707 3.874
353 3HD1 LEU 45 HD13 LEU 45 102.130 -1.119 3.125
354 1HD2 LEU 45 HD21 LEU 45 98.782 -3.220 3.802
355 2HD2 LEU 45 HD22 LEU 45 100.350 -4.014 3.666
356 3HD2 LEU 45 HD23 LEU 45 99.283 -3.925 2.265
357 H LEU 46 HN LEU 46 98.053 0.529 5.629
358 HA LEU 46 HA LEU 46 98.407 3.195 4.889
359 1HB LEU 46 HB2 LEU 46 96.390 1.713 6.056
360 2HB LEU 46 HB1 LEU 46 96.804 2.867 7.306
361 HG LEU 46 HG LEU 46 96.364 3.900 4.548
362 1HD1 LEU 46 HD11 LEU 46 94.519 2.263 5.039
363 2HD1 LEU 46 HD12 LEU 46 94.003 3.925 4.754
364 3HD1 LEU 46 HD13 LEU 46 94.072 3.293 6.399
365 1HD2 LEU 46 HD21 LEU 46 96.404 4.885 7.304
366 2HD2 LEU 46 HD22 LEU 46 95.074 5.513 6.331
367 3HD2 LEU 46 HD23 LEU 46 96.739 5.726 5.790
368 H ALA 47 HN ALA 47 99.170 1.554 7.940
369 HA ALA 47 HA ALA 47 99.917 3.895 9.345
370 1HB ALA 47 HB1 ALA 47 100.169 0.984 9.765
371 2HB ALA 47 HB2 ALA 47 99.572 2.242 10.846
372 3HB ALA 47 HB3 ALA 47 101.308 2.006 10.641
373 H GLU 48 HN GLU 48 101.898 1.417 7.699
374 HA GLU 48 HA GLU 48 104.366 2.675 8.205
375 1HB GLU 48 HB2 GLU 48 105.255 1.215 6.418
376 2HB GLU 48 HB1 GLU 48 104.285 0.340 7.594
377 1HG GLU 48 HG2 GLU 48 102.361 0.581 5.956
378 2HG GLU 48 HG1 GLU 48 103.571 1.098 4.784
379 H ALA 49 HN ALA 49 102.159 2.854 5.444
380 HA ALA 49 HA ALA 49 103.781 4.442 3.789
381 1HB ALA 49 HB1 ALA 49 100.801 4.686 3.763
382 2HB ALA 49 HB2 ALA 49 101.574 3.179 3.271
383 3HB ALA 49 HB3 ALA 49 101.935 4.677 2.414
384 H LYS 50 HN LYS 50 101.291 5.329 6.157
385 HA LYS 50 HA LYS 50 101.322 8.088 5.736
386 1HB LYS 50 HB2 LYS 50 100.292 6.257 7.743
387 2HB LYS 50 HB1 LYS 50 100.831 7.767 8.461
388 1HG LYS 50 HG2 LYS 50 99.114 8.917 7.618
389 2HG LYS 50 HG1 LYS 50 99.239 8.133 6.042
390 1HD LYS 50 HD2 LYS 50 97.133 7.510 6.919
391 2HD LYS 50 HD1 LYS 50 98.178 6.102 7.117
392 1HE LYS 50 HE2 LYS 50 98.639 7.184 9.467
393 2HE LYS 50 HE1 LYS 50 97.089 7.970 9.169
394 1HZ LYS 50 HZ1 LYS 50 96.015 5.885 9.009
395 2HZ LYS 50 HZ2 LYS 50 96.977 5.813 10.398
396 3HZ LYS 50 HZ3 LYS 50 97.479 5.037 8.981
397 H LYS 51 HN LYS 51 103.159 6.161 8.119
398 HA LYS 51 HA LYS 51 104.554 8.353 9.203
399 1HB LYS 51 HB2 LYS 51 106.090 6.688 10.153
400 2HB LYS 51 HB1 LYS 51 104.408 6.236 10.388
401 1HG LYS 51 HG2 LYS 51 104.533 4.478 8.904
402 2HG LYS 51 HG1 LYS 51 105.915 5.160 8.049
403 1HD LYS 51 HD2 LYS 51 106.699 3.296 9.316
404 2HD LYS 51 HD1 LYS 51 107.282 4.763 10.105
405 1HE LYS 51 HE2 LYS 51 106.513 3.442 11.868
406 2HE LYS 51 HE1 LYS 51 105.192 4.572 11.574
407 1HZ LYS 51 HZ1 LYS 51 103.829 2.928 10.973
408 2HZ LYS 51 HZ2 LYS 51 104.938 1.890 11.716
409 3HZ LYS 51 HZ3 LYS 51 105.003 2.139 10.045
410 H LEU 52 HN LEU 52 105.309 6.184 6.513
411 HA LEU 52 HA LEU 52 107.947 7.092 6.092
412 1HB LEU 52 HB2 LEU 52 106.294 5.173 4.968
413 2HB LEU 52 HB1 LEU 52 106.542 6.311 3.658
414 HG LEU 52 HG LEU 52 108.803 5.064 5.217
415 1HD1 LEU 52 HD11 LEU 52 109.096 3.628 3.208
416 2HD1 LEU 52 HD12 LEU 52 107.528 4.191 2.632
417 3HD1 LEU 52 HD13 LEU 52 107.637 3.275 4.135
418 1HD2 LEU 52 HD21 LEU 52 110.232 6.035 3.702
419 2HD2 LEU 52 HD22 LEU 52 108.988 7.278 3.835
420 3HD2 LEU 52 HD23 LEU 52 108.991 6.177 2.457
421 H ASN 53 HN ASN 53 104.936 7.916 4.369
422 HA ASN 53 HA ASN 53 105.911 9.867 2.701
423 1HB ASN 53 HB2 ASN 53 103.632 9.064 2.516
424 2HB ASN 53 HB1 ASN 53 103.219 9.755 4.079
425 1HD2 ASN 53 HD21 ASN 53 101.631 11.098 3.350
426 2HD2 ASN 53 HD22 ASN 53 101.924 12.455 2.321
427 H ASP 54 HN ASP 54 104.791 10.277 6.061
428 HA ASP 54 HA ASP 54 105.102 13.060 6.161
429 1HB ASP 54 HB2 ASP 54 104.564 12.883 8.367
430 2HB ASP 54 HB1 ASP 54 104.111 11.253 7.886
431 H ALA 55 HN ALA 55 107.384 10.452 6.919
432 HA ALA 55 HA ALA 55 109.499 12.037 7.832
433 1HB ALA 55 HB1 ALA 55 110.838 9.974 6.786
434 2HB ALA 55 HB2 ALA 55 109.214 9.286 6.792
435 3HB ALA 55 HB3 ALA 55 109.931 9.867 8.295
436 H GLN 56 HN GLN 56 108.525 11.197 4.553
437 HA GLN 56 HA GLN 56 110.858 12.632 3.492
438 1HB GLN 56 HB2 GLN 56 109.448 11.691 1.292
439 2HB GLN 56 HB1 GLN 56 110.868 10.951 2.013
440 1HG GLN 56 HG2 GLN 56 109.591 9.405 3.217
441 2HG GLN 56 HG1 GLN 56 108.106 10.319 2.975
442 1HE2 GLN 56 HE21 GLN 56 107.652 7.931 2.440
443 2HE2 GLN 56 HE22 GLN 56 107.711 7.552 0.761
444 H ALA 57 HN ALA 57 107.831 13.405 4.450
445 HA ALA 57 HA ALA 57 107.551 15.472 2.368
446 1HB ALA 57 HB1 ALA 57 105.735 13.647 2.608
447 2HB ALA 57 HB2 ALA 57 105.241 15.332 2.453
448 3HB ALA 57 HB3 ALA 57 105.245 14.556 4.037
449 HA PRO 58 HA PRO 58 107.969 18.475 5.578
450 1HB PRO 58 HB2 PRO 58 106.803 20.604 4.417
451 2HB PRO 58 HB1 PRO 58 108.339 19.951 3.835
452 1HG PRO 58 HG2 PRO 58 105.575 19.532 2.760
453 2HG PRO 58 HG1 PRO 58 107.080 19.852 1.879
454 1HD PRO 58 HD2 PRO 58 106.012 17.355 2.157
455 2HD PRO 58 HD1 PRO 58 107.752 17.659 1.980
456 H LYS 59 HN LYS 59 104.769 17.996 4.174
457 HA LYS 59 HA LYS 59 103.168 19.413 5.890
458 1HB LYS 59 HB2 LYS 59 102.498 16.606 5.008
459 2HB LYS 59 HB1 LYS 59 101.386 17.928 5.334
460 1HG LYS 59 HG2 LYS 59 101.436 18.511 3.202
461 2HG LYS 59 HG1 LYS 59 103.178 18.773 3.300
462 1HD LYS 59 HD2 LYS 59 102.555 17.160 1.536
463 2HD LYS 59 HD1 LYS 59 103.594 16.447 2.772
464 1HE LYS 59 HE2 LYS 59 101.922 15.126 3.611
465 2HE LYS 59 HE1 LYS 59 100.647 16.239 3.116
466 1HZ LYS 59 HZ1 LYS 59 100.844 14.059 1.864
467 2HZ LYS 59 HZ2 LYS 59 102.226 14.710 1.139
468 3HZ LYS 59 HZ3 LYS 59 100.727 15.465 0.931
469 H ALA 60 HN ALA 60 102.904 19.426 8.013
470 HA ALA 60 HA ALA 60 102.403 18.494 10.105
471 1HB ALA 60 HB1 ALA 60 102.306 16.203 8.944
472 2HB ALA 60 HB2 ALA 60 102.731 16.249 10.655
473 3HB ALA 60 HB3 ALA 60 103.991 16.038 9.438
Start of MODEL 26
1 1H GLY -1 HT1 GLY -1 85.099 -2.454 10.133
2 2H GLY -1 HT2 GLY -1 86.658 -2.115 10.694
3 3H GLY -1 HT3 GLY -1 85.378 -2.254 11.790
4 1HA GLY -1 HA1 GLY -1 86.784 -4.367 10.298
5 2HA GLY -1 HA2 GLY -1 86.444 -4.277 12.019
6 H SER 0 HN SER 0 84.543 -5.099 12.809
7 HA SER 0 HA SER 0 82.745 -6.505 12.867
8 1HB SER 0 HB2 SER 0 80.881 -5.903 11.469
9 2HB SER 0 HB1 SER 0 81.735 -4.417 11.889
10 HG SER 0 HG SER 0 82.512 -4.273 9.864
11 H THR 1 HN THR 1 81.231 -7.822 11.020
12 HA THR 1 HA THR 1 83.220 -9.566 9.742
13 HB THR 1 HB THR 1 81.272 -11.220 9.712
14 HG1 THR 1 HG1 THR 1 79.719 -9.472 10.181
15 1HG2 THR 1 HG21 THR 1 81.351 -11.374 12.369
16 2HG2 THR 1 HG22 THR 1 82.733 -10.310 12.109
17 3HG2 THR 1 HG23 THR 1 82.685 -11.896 11.340
18 H ALA 2 HN ALA 2 83.488 -9.049 7.668
19 HA ALA 2 HA ALA 2 81.080 -8.669 6.013
20 1HB ALA 2 HB1 ALA 2 82.665 -7.156 4.605
21 2HB ALA 2 HB2 ALA 2 83.574 -7.026 6.110
22 3HB ALA 2 HB3 ALA 2 81.890 -6.507 6.050
23 H ASP 3 HN ASP 3 84.501 -9.547 6.054
24 HA ASP 3 HA ASP 3 85.127 -11.732 5.144
25 1HB ASP 3 HB2 ASP 3 83.026 -12.043 3.869
26 2HB ASP 3 HB1 ASP 3 83.554 -10.814 2.722
27 H ASN 4 HN ASN 4 85.106 -8.500 4.115
28 HA ASN 4 HA ASN 4 87.457 -7.591 4.021
29 1HB ASN 4 HB2 ASN 4 87.497 -9.583 1.752
30 2HB ASN 4 HB1 ASN 4 88.549 -8.167 1.741
31 1HD2 ASN 4 HD21 ASN 4 89.206 -8.003 4.423
32 2HD2 ASN 4 HD22 ASN 4 90.149 -9.381 4.858
33 H LYS 5 HN LYS 5 87.058 -7.708 0.629
34 HA LYS 5 HA LYS 5 86.259 -6.192 -0.851
35 1HB LYS 5 HB2 LYS 5 84.007 -5.987 1.157
36 2HB LYS 5 HB1 LYS 5 83.947 -5.426 -0.509
37 1HG LYS 5 HG2 LYS 5 84.568 -8.286 0.091
38 2HG LYS 5 HG1 LYS 5 82.901 -7.709 0.110
39 1HD LYS 5 HD2 LYS 5 83.448 -6.723 -2.209
40 2HD LYS 5 HD1 LYS 5 84.838 -7.811 -2.177
41 1HE LYS 5 HE2 LYS 5 83.028 -9.596 -1.530
42 2HE LYS 5 HE1 LYS 5 81.925 -8.449 -2.289
43 1HZ LYS 5 HZ1 LYS 5 82.490 -9.595 -4.126
44 2HZ LYS 5 HZ2 LYS 5 83.959 -10.138 -3.490
45 3HZ LYS 5 HZ3 LYS 5 83.841 -8.576 -4.126
46 H PHE 6 HN PHE 6 87.603 -4.510 -0.909
47 HA PHE 6 HA PHE 6 88.002 -2.645 1.167
48 1HB PHE 6 HB2 PHE 6 88.590 -2.473 -1.799
49 2HB PHE 6 HB1 PHE 6 89.137 -1.294 -0.616
50 HD1 PHE 6 HD1 PHE 6 89.074 -5.020 -0.328
51 HD2 PHE 6 HD2 PHE 6 91.438 -1.496 -0.630
52 HE1 PHE 6 HE1 PHE 6 91.085 -6.341 0.111
53 HE2 PHE 6 HE2 PHE 6 93.453 -2.822 -0.189
54 HZ PHE 6 HZ PHE 6 93.285 -5.248 0.204
55 H ASN 7 HN ASN 7 87.125 -0.599 1.502
56 HA ASN 7 HA ASN 7 85.341 0.577 -0.394
57 1HB ASN 7 HB2 ASN 7 83.466 0.501 1.530
58 2HB ASN 7 HB1 ASN 7 83.556 -0.674 0.225
59 1HD2 ASN 7 HD21 ASN 7 82.970 -2.545 1.071
60 2HD2 ASN 7 HD22 ASN 7 83.610 -3.244 2.515
61 H LYS 8 HN LYS 8 84.967 0.759 3.124
62 HA LYS 8 HA LYS 8 85.352 3.601 3.003
63 1HB LYS 8 HB2 LYS 8 85.117 3.231 5.615
64 2HB LYS 8 HB1 LYS 8 83.727 3.180 4.542
65 1HG LYS 8 HG2 LYS 8 83.384 0.975 4.871
66 2HG LYS 8 HG1 LYS 8 85.105 0.611 4.988
67 1HD LYS 8 HD2 LYS 8 85.080 1.707 7.249
68 2HD LYS 8 HD1 LYS 8 83.321 1.771 7.119
69 1HE LYS 8 HE2 LYS 8 83.726 -0.191 8.322
70 2HE LYS 8 HE1 LYS 8 83.455 -0.750 6.672
71 1HZ LYS 8 HZ1 LYS 8 85.336 -1.889 7.178
72 2HZ LYS 8 HZ2 LYS 8 85.924 -0.711 8.240
73 3HZ LYS 8 HZ3 LYS 8 86.050 -0.481 6.569
74 H GLU 9 HN GLU 9 86.910 1.109 5.032
75 HA GLU 9 HA GLU 9 89.047 2.882 5.709
76 1HB GLU 9 HB2 GLU 9 88.139 1.207 7.279
77 2HB GLU 9 HB1 GLU 9 88.779 -0.072 6.257
78 1HG GLU 9 HG2 GLU 9 91.044 1.149 6.606
79 2HG GLU 9 HG1 GLU 9 90.230 1.863 7.998
80 H GLN 10 HN GLN 10 88.927 -0.155 3.851
81 HA GLN 10 HA GLN 10 91.702 -0.059 3.223
82 1HB GLN 10 HB2 GLN 10 90.081 -1.698 1.428
83 2HB GLN 10 HB1 GLN 10 91.434 -2.151 2.450
84 1HG GLN 10 HG2 GLN 10 89.659 -1.921 4.363
85 2HG GLN 10 HG1 GLN 10 88.518 -2.137 3.035
86 1HE2 GLN 10 HE21 GLN 10 91.452 -3.606 4.437
87 2HE2 GLN 10 HE22 GLN 10 90.981 -5.224 4.105
88 H GLN 11 HN GLN 11 88.817 0.500 1.197
89 HA GLN 11 HA GLN 11 90.175 1.015 -1.179
90 1HB GLN 11 HB2 GLN 11 87.622 0.807 -0.688
91 2HB GLN 11 HB1 GLN 11 87.702 2.556 -0.501
92 1HG GLN 11 HG2 GLN 11 88.540 2.796 -2.753
93 2HG GLN 11 HG1 GLN 11 88.585 1.044 -2.946
94 1HE2 GLN 11 HE21 GLN 11 86.230 3.446 -1.806
95 2HE2 GLN 11 HE22 GLN 11 84.913 2.859 -2.758
96 H ASN 12 HN ASN 12 89.294 3.251 1.426
97 HA ASN 12 HA ASN 12 90.095 5.632 0.248
98 1HB ASN 12 HB2 ASN 12 89.239 4.831 2.774
99 2HB ASN 12 HB1 ASN 12 90.830 5.525 3.059
100 1HD2 ASN 12 HD21 ASN 12 91.209 7.692 2.440
101 2HD2 ASN 12 HD22 ASN 12 89.901 8.812 2.298
102 H ALA 13 HN ALA 13 92.024 3.128 1.833
103 HA ALA 13 HA ALA 13 94.411 4.532 2.088
104 1HB ALA 13 HB1 ALA 13 93.612 1.722 2.074
105 2HB ALA 13 HB2 ALA 13 94.730 2.582 3.130
106 3HB ALA 13 HB3 ALA 13 95.273 2.004 1.557
107 H PHE 14 HN PHE 14 93.040 2.907 -0.752
108 HA PHE 14 HA PHE 14 95.241 2.776 -2.385
109 1HB PHE 14 HB2 PHE 14 93.020 1.883 -2.908
110 2HB PHE 14 HB1 PHE 14 92.403 3.510 -3.120
111 HD1 PHE 14 HD1 PHE 14 93.755 0.707 -4.755
112 HD2 PHE 14 HD2 PHE 14 93.614 4.956 -4.918
113 HE1 PHE 14 HE1 PHE 14 94.350 0.633 -7.141
114 HE2 PHE 14 HE2 PHE 14 94.212 4.891 -7.300
115 HZ PHE 14 HZ PHE 14 94.580 2.727 -8.418
116 H TRP 15 HN TRP 15 92.895 5.457 -2.296
117 HA TRP 15 HA TRP 15 94.433 7.111 -4.014
118 1HB TRP 15 HB2 TRP 15 92.500 8.236 -2.013
119 2HB TRP 15 HB1 TRP 15 92.857 8.788 -3.647
120 HD1 TRP 15 HD1 TRP 15 92.235 6.517 -5.495
121 HE1 TRP 15 HE1 TRP 15 89.930 5.387 -5.630
122 HE3 TRP 15 HE3 TRP 15 90.424 7.876 -0.922
123 HZ2 TRP 15 HZ2 TRP 15 87.624 5.123 -4.003
124 HZ3 TRP 15 HZ3 TRP 15 88.155 7.152 -0.284
125 HH2 TRP 15 HH2 TRP 15 86.787 5.803 -1.794
126 H GLU 16 HN GLU 16 93.954 7.253 -0.466
127 HA GLU 16 HA GLU 16 95.685 9.340 0.076
128 1HB GLU 16 HB2 GLU 16 95.221 6.903 1.801
129 2HB GLU 16 HB1 GLU 16 95.798 8.471 2.347
130 1HG GLU 16 HG2 GLU 16 93.203 8.419 0.936
131 2HG GLU 16 HG1 GLU 16 93.260 7.708 2.549
132 H ILE 17 HN ILE 17 96.357 6.144 -0.851
133 HA ILE 17 HA ILE 17 99.151 6.175 -0.001
134 HB ILE 17 HB ILE 17 97.562 4.119 -1.535
135 1HG1 ILE 17 HG12 ILE 17 97.231 3.470 0.629
136 2HG1 ILE 17 HG11 ILE 17 98.834 2.782 0.453
137 1HG2 ILE 17 HG21 ILE 17 99.715 2.788 -1.527
138 2HG2 ILE 17 HG22 ILE 17 100.539 4.302 -1.154
139 3HG2 ILE 17 HG23 ILE 17 99.640 4.137 -2.662
140 1HD1 ILE 17 HD11 ILE 17 98.176 5.449 1.680
141 2HD1 ILE 17 HD12 ILE 17 99.796 4.777 1.488
142 3HD1 ILE 17 HD13 ILE 17 98.629 3.978 2.542
143 H LEU 18 HN LEU 18 97.155 6.481 -2.858
144 HA LEU 18 HA LEU 18 99.293 6.834 -4.715
145 1HB LEU 18 HB2 LEU 18 96.726 6.208 -5.036
146 2HB LEU 18 HB1 LEU 18 96.566 7.943 -5.198
147 HG LEU 18 HG LEU 18 98.189 7.916 -7.060
148 1HD1 LEU 18 HD11 LEU 18 97.974 4.919 -6.945
149 2HD1 LEU 18 HD12 LEU 18 99.346 5.825 -6.296
150 3HD1 LEU 18 HD13 LEU 18 98.975 5.896 -8.019
151 1HD2 LEU 18 HD21 LEU 18 95.761 6.151 -7.305
152 2HD2 LEU 18 HD22 LEU 18 96.698 6.733 -8.682
153 3HD2 LEU 18 HD23 LEU 18 95.874 7.881 -7.627
154 H HIS 19 HN HIS 19 97.497 8.871 -2.583
155 HA HIS 19 HA HIS 19 98.099 11.342 -3.852
156 1HB HIS 19 HB2 HIS 19 96.145 11.077 -2.405
157 2HB HIS 19 HB1 HIS 19 97.189 10.715 -1.037
158 HD1 HIS 19 HD1 HIS 19 97.189 13.599 -3.535
159 HD2 HIS 19 HD2 HIS 19 97.165 12.885 0.558
160 HE1 HIS 19 HE1 HIS 19 97.272 15.868 -2.456
161 HE2 HIS 19 HE2 HIS 19 97.350 15.407 0.019
162 H LEU 20 HN LEU 20 99.160 10.018 -0.709
163 HA LEU 20 HA LEU 20 100.856 11.266 0.503
164 1HB LEU 20 HB2 LEU 20 102.000 8.962 -1.038
165 2HB LEU 20 HB1 LEU 20 102.752 9.691 0.362
166 HG LEU 20 HG LEU 20 100.343 7.939 0.208
167 1HD1 LEU 20 HD11 LEU 20 102.036 6.666 0.989
168 2HD1 LEU 20 HD12 LEU 20 101.552 7.380 2.527
169 3HD1 LEU 20 HD13 LEU 20 102.921 8.045 1.639
170 1HD2 LEU 20 HD21 LEU 20 99.640 8.639 2.448
171 2HD2 LEU 20 HD22 LEU 20 99.473 9.948 1.279
172 3HD2 LEU 20 HD23 LEU 20 100.825 9.945 2.412
173 HA PRO 21 HA PRO 21 102.651 13.796 -2.946
174 1HB PRO 21 HB2 PRO 21 101.921 15.990 -1.119
175 2HB PRO 21 HB1 PRO 21 101.575 15.805 -2.840
176 1HG PRO 21 HG2 PRO 21 99.654 15.577 -0.980
177 2HG PRO 21 HG1 PRO 21 99.647 14.599 -2.461
178 1HD PRO 21 HD2 PRO 21 100.477 13.837 0.314
179 2HD PRO 21 HD1 PRO 21 99.559 12.901 -0.881
180 H ASN 22 HN ASN 22 104.671 13.038 -2.434
181 HA ASN 22 HA ASN 22 106.779 14.178 -1.777
182 1HB ASN 22 HB2 ASN 22 105.311 14.419 0.837
183 2HB ASN 22 HB1 ASN 22 107.066 14.449 0.771
184 1HD2 ASN 22 HD21 ASN 22 107.870 16.385 0.797
185 2HD2 ASN 22 HD22 ASN 22 107.143 17.801 0.143
186 H LEU 23 HN LEU 23 105.298 11.478 -1.742
187 HA LEU 23 HA LEU 23 107.415 10.037 -0.294
188 1HB LEU 23 HB2 LEU 23 105.505 9.323 0.822
189 2HB LEU 23 HB1 LEU 23 104.496 9.456 -0.600
190 HG LEU 23 HG LEU 23 105.811 7.405 -1.477
191 1HD1 LEU 23 HD11 LEU 23 107.591 7.409 0.190
192 2HD1 LEU 23 HD12 LEU 23 106.644 5.918 0.273
193 3HD1 LEU 23 HD13 LEU 23 106.396 7.187 1.471
194 1HD2 LEU 23 HD21 LEU 23 104.173 6.681 0.884
195 2HD2 LEU 23 HD22 LEU 23 104.122 6.061 -0.766
196 3HD2 LEU 23 HD23 LEU 23 103.426 7.639 -0.393
197 H ASN 24 HN ASN 24 108.317 8.224 -1.405
198 HA ASN 24 HA ASN 24 108.702 8.608 -4.163
199 1HB ASN 24 HB2 ASN 24 109.266 6.426 -2.247
200 2HB ASN 24 HB1 ASN 24 109.088 5.908 -3.921
201 1HD2 ASN 24 HD21 ASN 24 110.915 5.814 -4.982
202 2HD2 ASN 24 HD22 ASN 24 112.299 6.817 -4.732
203 H GLU 25 HN GLU 25 107.193 8.409 -5.805
204 HA GLU 25 HA GLU 25 104.619 7.459 -5.271
205 1HB GLU 25 HB2 GLU 25 104.673 9.013 -6.952
206 2HB GLU 25 HB1 GLU 25 106.116 8.328 -7.690
207 1HG GLU 25 HG2 GLU 25 104.345 7.937 -9.196
208 2HG GLU 25 HG1 GLU 25 104.701 6.387 -8.438
209 H GLU 26 HN GLU 26 107.464 5.922 -6.559
210 HA GLU 26 HA GLU 26 106.299 3.485 -7.431
211 1HB GLU 26 HB2 GLU 26 108.789 4.502 -7.593
212 2HB GLU 26 HB1 GLU 26 109.010 3.443 -6.207
213 1HG GLU 26 HG2 GLU 26 108.570 1.526 -7.441
214 2HG GLU 26 HG1 GLU 26 107.760 2.422 -8.726
215 H GLN 27 HN GLN 27 106.983 4.905 -4.485
216 HA GLN 27 HA GLN 27 106.883 2.531 -2.807
217 1HB GLN 27 HB2 GLN 27 107.731 5.178 -2.384
218 2HB GLN 27 HB1 GLN 27 106.314 4.974 -1.368
219 1HG GLN 27 HG2 GLN 27 107.395 3.662 0.069
220 2HG GLN 27 HG1 GLN 27 108.162 2.731 -1.216
221 1HE2 GLN 27 HE21 GLN 27 110.275 2.873 -1.297
222 2HE2 GLN 27 HE22 GLN 27 111.235 4.195 -0.736
223 H ARG 28 HN ARG 28 104.823 5.215 -3.780
224 HA ARG 28 HA ARG 28 102.559 4.591 -2.242
225 1HB ARG 28 HB2 ARG 28 102.763 5.993 -4.923
226 2HB ARG 28 HB1 ARG 28 101.305 5.940 -3.942
227 1HG ARG 28 HG2 ARG 28 102.846 6.951 -2.108
228 2HG ARG 28 HG1 ARG 28 103.852 7.419 -3.472
229 1HD ARG 28 HD2 ARG 28 101.278 8.181 -4.211
230 2HD ARG 28 HD1 ARG 28 101.364 8.559 -2.505
231 HE ARG 28 HE ARG 28 103.042 10.118 -2.928
232 1HH1 ARG 28 HH11 ARG 28 102.057 8.502 -5.861
233 2HH1 ARG 28 HH12 ARG 28 102.792 9.676 -6.899
234 1HH2 ARG 28 HH21 ARG 28 104.010 11.658 -4.294
235 2HH2 ARG 28 HH22 ARG 28 103.904 11.463 -6.012
236 H ASN 29 HN ASN 29 103.202 3.918 -5.677
237 HA ASN 29 HA ASN 29 101.006 2.323 -6.207
238 1HB ASN 29 HB2 ASN 29 102.614 3.208 -7.895
239 2HB ASN 29 HB1 ASN 29 103.763 1.975 -7.388
240 1HD2 ASN 29 HD21 ASN 29 100.701 2.575 -8.936
241 2HD2 ASN 29 HD22 ASN 29 100.578 1.046 -9.731
242 H GLY 30 HN GLY 30 104.246 1.294 -5.116
243 1HA GLY 30 HA2 GLY 30 103.706 -1.463 -5.057
244 2HA GLY 30 HA1 GLY 30 104.922 -0.647 -4.080
245 H PHE 31 HN PHE 31 103.027 1.088 -2.765
246 HA PHE 31 HA PHE 31 102.343 -0.568 -0.573
247 1HB PHE 31 HB2 PHE 31 102.017 2.306 -1.282
248 2HB PHE 31 HB1 PHE 31 100.952 1.666 -0.034
249 HD1 PHE 31 HD1 PHE 31 102.524 -0.158 1.447
250 HD2 PHE 31 HD2 PHE 31 103.723 3.550 -0.278
251 HE1 PHE 31 HE1 PHE 31 104.331 0.025 3.102
252 HE2 PHE 31 HE2 PHE 31 105.525 3.736 1.378
253 HZ PHE 31 HZ PHE 31 105.835 1.977 3.070
254 H ILE 32 HN ILE 32 100.440 0.942 -3.141
255 HA ILE 32 HA ILE 32 97.899 0.110 -2.245
256 HB ILE 32 HB ILE 32 98.404 0.294 -5.179
257 1HG1 ILE 32 HG12 ILE 32 98.529 2.611 -3.253
258 2HG1 ILE 32 HG11 ILE 32 99.751 2.115 -4.419
259 1HG2 ILE 32 HG21 ILE 32 96.232 1.372 -3.396
260 2HG2 ILE 32 HG22 ILE 32 96.163 -0.135 -4.310
261 3HG2 ILE 32 HG23 ILE 32 96.254 1.408 -5.159
262 1HD1 ILE 32 HD11 ILE 32 97.171 3.533 -4.872
263 2HD1 ILE 32 HD12 ILE 32 97.923 2.610 -6.173
264 3HD1 ILE 32 HD13 ILE 32 98.793 3.948 -5.422
265 H GLN 33 HN GLN 33 100.260 -1.404 -4.362
266 HA GLN 33 HA GLN 33 98.665 -3.561 -5.226
267 1HB GLN 33 HB2 GLN 33 101.552 -2.913 -5.208
268 2HB GLN 33 HB1 GLN 33 101.141 -4.615 -5.369
269 1HG GLN 33 HG2 GLN 33 101.464 -3.344 -7.512
270 2HG GLN 33 HG1 GLN 33 99.957 -4.248 -7.369
271 1HE2 GLN 33 HE21 GLN 33 101.214 -1.444 -8.416
272 2HE2 GLN 33 HE22 GLN 33 99.835 -0.413 -8.272
273 H SER 34 HN SER 34 101.062 -3.408 -2.572
274 HA SER 34 HA SER 34 100.694 -6.070 -1.712
275 1HB SER 34 HB2 SER 34 102.624 -4.795 -0.959
276 2HB SER 34 HB1 SER 34 101.582 -3.622 -0.151
277 HG SER 34 HG SER 34 101.838 -6.376 0.502
278 H LEU 35 HN LEU 35 99.038 -3.080 -1.001
279 HA LEU 35 HA LEU 35 97.346 -4.171 1.057
280 1HB LEU 35 HB2 LEU 35 97.588 -1.865 1.216
281 2HB LEU 35 HB1 LEU 35 97.465 -1.638 -0.520
282 HG LEU 35 HG LEU 35 95.053 -2.117 -0.398
283 1HD1 LEU 35 HD11 LEU 35 95.771 -2.884 2.313
284 2HD1 LEU 35 HD12 LEU 35 94.356 -3.313 1.359
285 3HD1 LEU 35 HD13 LEU 35 94.387 -1.794 2.255
286 1HD2 LEU 35 HD21 LEU 35 94.872 0.088 -0.253
287 2HD2 LEU 35 HD22 LEU 35 96.410 0.180 0.610
288 3HD2 LEU 35 HD23 LEU 35 94.909 -0.042 1.507
289 H LYS 36 HN LYS 36 97.221 -3.630 -2.409
290 HA LYS 36 HA LYS 36 94.533 -3.983 -2.871
291 1HB LYS 36 HB2 LYS 36 95.116 -3.828 -5.030
292 2HB LYS 36 HB1 LYS 36 96.748 -3.602 -4.442
293 1HG LYS 36 HG2 LYS 36 97.042 -5.190 -6.060
294 2HG LYS 36 HG1 LYS 36 96.891 -6.194 -4.628
295 1HD LYS 36 HD2 LYS 36 95.556 -7.114 -6.422
296 2HD LYS 36 HD1 LYS 36 94.497 -6.516 -5.143
297 1HE LYS 36 HE2 LYS 36 95.089 -4.455 -7.086
298 2HE LYS 36 HE1 LYS 36 94.380 -5.878 -7.850
299 1HZ LYS 36 HZ1 LYS 36 92.421 -5.593 -6.773
300 2HZ LYS 36 HZ2 LYS 36 92.911 -3.975 -6.801
301 3HZ LYS 36 HZ3 LYS 36 93.126 -4.898 -5.401
302 H ASP 37 HN ASP 37 97.025 -6.602 -3.073
303 HA ASP 37 HA ASP 37 94.994 -8.578 -3.220
304 1HB ASP 37 HB2 ASP 37 97.043 -10.109 -2.788
305 2HB ASP 37 HB1 ASP 37 96.975 -9.185 -4.283
306 H ASP 38 HN ASP 38 96.387 -6.935 -0.554
307 HA ASP 38 HA ASP 38 95.330 -9.032 1.224
308 1HB ASP 38 HB2 ASP 38 97.962 -7.913 1.115
309 2HB ASP 38 HB1 ASP 38 97.225 -7.512 2.662
310 HA PRO 39 HA PRO 39 92.790 -5.503 2.456
311 1HB PRO 39 HB2 PRO 39 90.828 -6.965 3.591
312 2HB PRO 39 HB1 PRO 39 90.978 -6.783 1.845
313 1HG PRO 39 HG2 PRO 39 91.739 -9.075 3.585
314 2HG PRO 39 HG1 PRO 39 91.036 -9.084 1.960
315 1HD PRO 39 HD2 PRO 39 93.707 -9.482 2.524
316 2HD PRO 39 HD1 PRO 39 93.070 -8.946 0.959
317 H SER 40 HN SER 40 93.618 -8.270 4.486
318 HA SER 40 HA SER 40 93.073 -7.008 6.977
319 1HB SER 40 HB2 SER 40 93.779 -9.590 6.130
320 2HB SER 40 HB1 SER 40 95.095 -9.071 7.181
321 HG SER 40 HG SER 40 92.328 -9.134 7.803
322 H GLN 41 HN GLN 41 95.557 -6.665 4.718
323 HA GLN 41 HA GLN 41 97.545 -5.802 6.654
324 1HB GLN 41 HB2 GLN 41 97.587 -6.068 3.649
325 2HB GLN 41 HB1 GLN 41 98.935 -5.446 4.591
326 1HG GLN 41 HG2 GLN 41 98.540 -7.732 5.902
327 2HG GLN 41 HG1 GLN 41 97.944 -8.209 4.314
328 1HE2 GLN 41 HE21 GLN 41 100.663 -6.396 5.706
329 2HE2 GLN 41 HE22 GLN 41 101.874 -7.110 4.703
330 H SER 42 HN SER 42 94.981 -4.433 4.924
331 HA SER 42 HA SER 42 95.778 -2.010 3.995
332 1HB SER 42 HB2 SER 42 93.544 -1.132 4.856
333 2HB SER 42 HB1 SER 42 93.476 -2.569 3.837
334 HG SER 42 HG SER 42 93.166 -2.368 6.635
335 H ALA 43 HN ALA 43 95.676 -2.983 7.351
336 HA ALA 43 HA ALA 43 96.017 -0.311 8.372
337 1HB ALA 43 HB1 ALA 43 96.739 -1.924 10.434
338 2HB ALA 43 HB2 ALA 43 95.712 -3.010 9.497
339 3HB ALA 43 HB3 ALA 43 95.078 -1.464 10.062
340 H ASN 44 HN ASN 44 98.060 -3.156 7.879
341 HA ASN 44 HA ASN 44 100.429 -2.079 8.953
342 1HB ASN 44 HB2 ASN 44 99.832 -4.323 7.047
343 2HB ASN 44 HB1 ASN 44 101.498 -3.853 7.375
344 1HD2 ASN 44 HD21 ASN 44 102.446 -4.502 9.206
345 2HD2 ASN 44 HD22 ASN 44 101.670 -5.430 10.439
346 H LEU 45 HN LEU 45 99.068 -1.995 5.685
347 HA LEU 45 HA LEU 45 101.389 -0.734 4.552
348 1HB LEU 45 HB2 LEU 45 98.624 -1.302 3.529
349 2HB LEU 45 HB1 LEU 45 99.761 -0.357 2.601
350 HG LEU 45 HG LEU 45 99.732 -2.671 1.850
351 1HD1 LEU 45 HD11 LEU 45 102.277 -3.128 2.657
352 2HD1 LEU 45 HD12 LEU 45 102.130 -1.398 2.962
353 3HD1 LEU 45 HD13 LEU 45 101.823 -2.038 1.348
354 1HD2 LEU 45 HD21 LEU 45 99.054 -3.628 4.026
355 2HD2 LEU 45 HD22 LEU 45 100.701 -3.386 4.608
356 3HD2 LEU 45 HD23 LEU 45 100.392 -4.488 3.265
357 H LEU 46 HN LEU 46 98.135 0.310 5.472
358 HA LEU 46 HA LEU 46 98.342 2.970 4.636
359 1HB LEU 46 HB2 LEU 46 96.235 1.820 5.236
360 2HB LEU 46 HB1 LEU 46 96.712 1.862 6.921
361 HG LEU 46 HG LEU 46 95.025 3.609 6.116
362 1HD1 LEU 46 HD11 LEU 46 95.646 4.990 7.818
363 2HD1 LEU 46 HD12 LEU 46 97.349 4.972 7.363
364 3HD1 LEU 46 HD13 LEU 46 96.646 3.588 8.198
365 1HD2 LEU 46 HD21 LEU 46 96.084 5.666 5.192
366 2HD2 LEU 46 HD22 LEU 46 96.052 4.304 4.072
367 3HD2 LEU 46 HD23 LEU 46 97.547 4.725 4.907
368 H ALA 47 HN ALA 47 99.296 1.432 7.672
369 HA ALA 47 HA ALA 47 99.855 3.902 9.005
370 1HB ALA 47 HB1 ALA 47 99.565 2.412 10.654
371 2HB ALA 47 HB2 ALA 47 101.273 2.047 10.403
372 3HB ALA 47 HB3 ALA 47 100.036 1.050 9.638
373 H GLU 48 HN GLU 48 101.926 1.370 7.581
374 HA GLU 48 HA GLU 48 104.357 2.714 8.082
375 1HB GLU 48 HB2 GLU 48 105.362 1.123 6.544
376 2HB GLU 48 HB1 GLU 48 104.222 0.303 7.602
377 1HG GLU 48 HG2 GLU 48 102.539 0.500 5.742
378 2HG GLU 48 HG1 GLU 48 103.867 1.039 4.720
379 H ALA 49 HN ALA 49 102.148 2.731 5.336
380 HA ALA 49 HA ALA 49 103.841 4.262 3.635
381 1HB ALA 49 HB1 ALA 49 102.122 2.883 2.672
382 2HB ALA 49 HB2 ALA 49 101.802 4.568 2.266
383 3HB ALA 49 HB3 ALA 49 100.869 3.775 3.536
384 H LYS 50 HN LYS 50 101.081 5.086 5.721
385 HA LYS 50 HA LYS 50 100.949 7.808 5.083
386 1HB LYS 50 HB2 LYS 50 100.108 6.197 7.472
387 2HB LYS 50 HB1 LYS 50 99.964 7.950 7.495
388 1HG LYS 50 HG2 LYS 50 98.738 6.181 5.394
389 2HG LYS 50 HG1 LYS 50 97.890 6.760 6.828
390 1HD LYS 50 HD2 LYS 50 98.055 9.017 6.121
391 2HD LYS 50 HD1 LYS 50 99.210 8.607 4.853
392 1HE LYS 50 HE2 LYS 50 96.364 7.621 4.928
393 2HE LYS 50 HE1 LYS 50 96.890 9.050 4.041
394 1HZ LYS 50 HZ1 LYS 50 98.407 6.642 3.507
395 2HZ LYS 50 HZ2 LYS 50 97.822 7.816 2.439
396 3HZ LYS 50 HZ3 LYS 50 96.793 6.595 2.999
397 H LYS 51 HN LYS 51 102.889 6.084 7.496
398 HA LYS 51 HA LYS 51 103.964 8.481 8.635
399 1HB LYS 51 HB2 LYS 51 104.761 5.579 8.866
400 2HB LYS 51 HB1 LYS 51 105.566 6.875 9.739
401 1HG LYS 51 HG2 LYS 51 103.168 7.442 10.571
402 2HG LYS 51 HG1 LYS 51 102.813 5.783 10.088
403 1HD LYS 51 HD2 LYS 51 105.239 5.729 11.539
404 2HD LYS 51 HD1 LYS 51 104.109 6.730 12.453
405 1HE LYS 51 HE2 LYS 51 102.593 4.556 11.619
406 2HE LYS 51 HE1 LYS 51 104.150 3.859 12.062
407 1HZ LYS 51 HZ1 LYS 51 103.429 5.718 14.027
408 2HZ LYS 51 HZ2 LYS 51 103.581 4.041 14.179
409 3HZ LYS 51 HZ3 LYS 51 102.092 4.718 13.750
410 H LEU 52 HN LEU 52 104.905 6.258 6.095
411 HA LEU 52 HA LEU 52 107.592 7.018 5.835
412 1HB LEU 52 HB2 LEU 52 106.456 5.054 4.728
413 2HB LEU 52 HB1 LEU 52 105.787 6.188 3.570
414 HG LEU 52 HG LEU 52 107.944 6.714 2.698
415 1HD1 LEU 52 HD11 LEU 52 109.897 5.259 3.773
416 2HD1 LEU 52 HD12 LEU 52 108.897 5.470 5.210
417 3HD1 LEU 52 HD13 LEU 52 109.499 6.881 4.340
418 1HD2 LEU 52 HD21 LEU 52 106.917 4.062 2.743
419 2HD2 LEU 52 HD22 LEU 52 108.678 3.979 2.739
420 3HD2 LEU 52 HD23 LEU 52 107.835 4.872 1.475
421 H ASN 53 HN ASN 53 104.707 8.194 4.106
422 HA ASN 53 HA ASN 53 105.876 10.096 2.488
423 1HB ASN 53 HB2 ASN 53 103.614 9.811 2.085
424 2HB ASN 53 HB1 ASN 53 103.195 9.867 3.791
425 1HD2 ASN 53 HD21 ASN 53 103.715 11.678 0.910
426 2HD2 ASN 53 HD22 ASN 53 103.207 13.211 1.523
427 H ASP 54 HN ASP 54 105.077 10.274 5.923
428 HA ASP 54 HA ASP 54 105.778 13.030 6.218
429 1HB ASP 54 HB2 ASP 54 104.944 10.800 8.036
430 2HB ASP 54 HB1 ASP 54 105.728 12.218 8.725
431 H ALA 55 HN ALA 55 107.349 9.923 6.355
432 HA ALA 55 HA ALA 55 109.655 10.616 7.844
433 1HB ALA 55 HB1 ALA 55 110.316 8.531 7.297
434 2HB ALA 55 HB2 ALA 55 110.269 8.910 5.575
435 3HB ALA 55 HB3 ALA 55 108.808 8.368 6.398
436 H GLN 56 HN GLN 56 108.423 11.155 4.687
437 HA GLN 56 HA GLN 56 110.708 12.823 3.931
438 1HB GLN 56 HB2 GLN 56 108.374 11.949 2.193
439 2HB GLN 56 HB1 GLN 56 109.857 12.722 1.655
440 1HG GLN 56 HG2 GLN 56 110.901 10.766 1.452
441 2HG GLN 56 HG1 GLN 56 110.368 10.227 3.045
442 1HE2 GLN 56 HE21 GLN 56 107.824 9.923 2.980
443 2HE2 GLN 56 HE22 GLN 56 107.286 8.872 1.725
444 H ALA 57 HN ALA 57 107.897 13.700 2.292
445 HA ALA 57 HA ALA 57 107.236 15.959 2.404
446 1HB ALA 57 HB1 ALA 57 105.073 15.609 2.515
447 2HB ALA 57 HB2 ALA 57 105.145 15.029 4.183
448 3HB ALA 57 HB3 ALA 57 105.499 13.930 2.849
449 HA PRO 58 HA PRO 58 108.763 17.501 6.423
450 1HB PRO 58 HB2 PRO 58 110.064 19.622 5.401
451 2HB PRO 58 HB1 PRO 58 110.784 18.007 5.404
452 1HG PRO 58 HG2 PRO 58 109.383 19.452 3.182
453 2HG PRO 58 HG1 PRO 58 110.896 18.527 3.130
454 1HD PRO 58 HD2 PRO 58 108.511 17.494 2.324
455 2HD PRO 58 HD1 PRO 58 109.801 16.503 3.038
456 H LYS 59 HN LYS 59 106.802 18.676 3.861
457 HA LYS 59 HA LYS 59 106.069 21.146 5.193
458 1HB LYS 59 HB2 LYS 59 106.268 21.010 2.721
459 2HB LYS 59 HB1 LYS 59 104.926 19.874 2.697
460 1HG LYS 59 HG2 LYS 59 104.253 22.301 4.124
461 2HG LYS 59 HG1 LYS 59 104.777 22.628 2.471
462 1HD LYS 59 HD2 LYS 59 102.956 20.354 2.686
463 2HD LYS 59 HD1 LYS 59 102.247 21.874 3.234
464 1HE LYS 59 HE2 LYS 59 103.700 21.631 0.614
465 2HE LYS 59 HE1 LYS 59 101.977 21.286 0.769
466 1HZ LYS 59 HZ1 LYS 59 102.314 23.551 0.066
467 2HZ LYS 59 HZ2 LYS 59 103.312 23.864 1.395
468 3HZ LYS 59 HZ3 LYS 59 101.669 23.544 1.631
469 H ALA 60 HN ALA 60 104.782 17.934 4.658
470 HA ALA 60 HA ALA 60 102.233 18.602 5.888
471 1HB ALA 60 HB1 ALA 60 101.814 16.114 5.497
472 2HB ALA 60 HB2 ALA 60 103.338 16.119 4.611
473 3HB ALA 60 HB3 ALA 60 102.002 17.134 4.071
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