NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
11566 |
1rpr   |
cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Orig H atom name
Start of MODEL 1
Raw file had 988 H/Q atoms
Start of MODEL 1
1 1H MET 1 HT1 MET 1 -23.171 -3.604 -6.215
2 2H MET 1 HT3 MET 1 -23.897 -2.076 -6.256
3 3H MET 1 HT2 MET 1 -24.843 -3.498 -6.273
4 HA MET 1 HA MET 1 -24.819 -3.598 -8.432
5 1HB MET 1 HB2 MET 1 -23.030 -1.147 -8.270
6 2HB MET 1 HB1 MET 1 -23.707 -1.783 -9.756
7 1HG MET 1 HG2 MET 1 -25.119 0.021 -8.875
8 2HG MET 1 HG1 MET 1 -25.965 -1.501 -8.890
9 1HE MET 1 HE2 MET 1 -23.676 0.644 -6.575
10 2HE MET 1 HE1 MET 1 -25.119 1.626 -6.937
11 3HE MET 1 HE3 MET 1 -24.810 1.044 -5.308
12 H THR 2 HN THR 2 -21.827 -3.702 -6.811
13 HA THR 2 HA THR 2 -19.950 -4.890 -7.170
14 HB THR 2 HB THR 2 -21.497 -6.237 -9.512
15 HG1 THR 2 HG1 THR 2 -22.081 -6.092 -6.908
16 1HG2 THR 2 HG22 THR 2 -19.034 -6.968 -9.192
17 2HG2 THR 2 HG21 THR 2 -19.492 -7.436 -7.558
18 3HG2 THR 2 HG23 THR 2 -20.221 -8.230 -8.931
19 H LYS 3 HN LYS 3 -20.858 -2.497 -8.794
20 HA LYS 3 HA LYS 3 -19.043 -2.642 -11.112
21 1HB LYS 3 HB2 LYS 3 -21.298 -1.646 -11.332
22 2HB LYS 3 HB1 LYS 3 -20.917 -0.432 -10.140
23 1HG LYS 3 HG2 LYS 3 -19.131 0.474 -11.679
24 2HG LYS 3 HG1 LYS 3 -19.525 -0.784 -12.832
25 1HD LYS 3 HD2 LYS 3 -21.784 0.058 -13.112
26 2HD LYS 3 HD1 LYS 3 -21.579 1.224 -11.821
27 1HE LYS 3 HE2 LYS 3 -20.020 1.172 -14.453
28 2HE LYS 3 HE1 LYS 3 -21.290 2.312 -14.040
29 1HZ LYS 3 HZ1 LYS 3 -19.397 2.364 -11.988
30 2HZ LYS 3 HZ3 LYS 3 -18.566 2.486 -13.464
31 3HZ LYS 3 HZ2 LYS 3 -19.801 3.585 -13.081
32 H GLN 4 HN GLN 4 -19.334 0.427 -9.681
33 HA GLN 4 HA GLN 4 -16.534 0.826 -9.530
34 1HB GLN 4 HB2 GLN 4 -17.121 2.839 -8.079
35 2HB GLN 4 HB1 GLN 4 -17.848 2.829 -9.665
36 1HG GLN 4 HG2 GLN 4 -19.328 1.728 -7.247
37 2HG GLN 4 HG1 GLN 4 -19.338 3.443 -7.612
38 1HE2 GLN 4 HE21 GLN 4 -22.165 1.527 -9.356
39 2HE2 GLN 4 HE22 GLN 4 -21.556 1.378 -7.783
40 H GLU 5 HN GLU 5 -18.819 -0.367 -7.289
41 HA GLU 5 HA GLU 5 -17.389 -0.017 -4.886
42 1HB GLU 5 HB2 GLU 5 -18.740 -2.210 -4.281
43 2HB GLU 5 HB1 GLU 5 -19.643 -0.769 -4.688
44 1HG GLU 5 HG2 GLU 5 -18.983 -2.412 -7.054
45 2HG GLU 5 HG1 GLU 5 -19.960 -3.209 -5.842
46 H LYS 6 HN LYS 6 -17.245 -2.466 -7.393
47 HA LYS 6 HA LYS 6 -15.241 -3.995 -5.951
48 1HB LYS 6 HB2 LYS 6 -16.621 -4.233 -8.543
49 2HB LYS 6 HB1 LYS 6 -14.923 -4.651 -8.627
50 1HG LYS 6 HG2 LYS 6 -15.981 -6.699 -8.090
51 2HG LYS 6 HG1 LYS 6 -15.318 -6.154 -6.570
52 1HD LYS 6 HD2 LYS 6 -18.131 -5.591 -7.397
53 2HD LYS 6 HD1 LYS 6 -17.691 -7.082 -6.593
54 1HE LYS 6 HE2 LYS 6 -16.767 -5.653 -4.662
55 2HE LYS 6 HE1 LYS 6 -17.506 -4.266 -5.434
56 1HZ LYS 6 HZ1 LYS 6 -19.467 -6.247 -5.247
57 2HZ LYS 6 HZ3 LYS 6 -18.671 -6.106 -3.762
58 3HZ LYS 6 HZ2 LYS 6 -19.364 -4.749 -4.477
59 H THR 7 HN THR 7 -15.294 -1.345 -8.206
60 HA THR 7 HA THR 7 -12.599 -1.649 -9.086
61 HB THR 7 HB THR 7 -14.101 1.004 -8.682
62 HG1 THR 7 HG1 THR 7 -14.793 -1.245 -9.973
63 1HG2 THR 7 HG22 THR 7 -11.693 1.039 -9.612
64 2HG2 THR 7 HG21 THR 7 -12.236 -0.024 -10.897
65 3HG2 THR 7 HG23 THR 7 -12.894 1.599 -10.764
66 H ALA 8 HN ALA 8 -14.006 0.166 -6.358
67 HA ALA 8 HA ALA 8 -11.476 1.090 -5.381
68 1HB ALA 8 HB1 ALA 8 -13.994 0.441 -3.793
69 2HB ALA 8 HB3 ALA 8 -12.655 1.421 -3.214
70 3HB ALA 8 HB2 ALA 8 -13.655 2.002 -4.536
71 H LEU 9 HN LEU 9 -13.430 -1.720 -4.782
72 HA LEU 9 HA LEU 9 -11.812 -2.892 -2.769
73 1HB LEU 9 HB2 LEU 9 -14.173 -3.568 -3.439
74 2HB LEU 9 HB1 LEU 9 -13.494 -4.243 -4.907
75 HG LEU 9 HG LEU 9 -12.236 -5.898 -3.652
76 1HD1 LEU 9 HD11 LEU 9 -13.615 -4.697 -1.210
77 2HD1 LEU 9 HD13 LEU 9 -12.645 -6.159 -1.204
78 3HD1 LEU 9 HD12 LEU 9 -11.888 -4.614 -1.533
79 1HD2 LEU 9 HD21 LEU 9 -14.532 -6.417 -4.387
80 2HD2 LEU 9 HD23 LEU 9 -14.178 -7.222 -2.878
81 3HD2 LEU 9 HD22 LEU 9 -15.177 -5.782 -2.882
82 H ASN 10 HN ASN 10 -11.508 -2.691 -6.199
83 HA ASN 10 HA ASN 10 -9.507 -4.805 -6.396
84 1HB ASN 10 HB2 ASN 10 -10.217 -2.592 -8.362
85 2HB ASN 10 HB1 ASN 10 -9.067 -3.877 -8.673
86 1HD2 ASN 10 HD21 ASN 10 -12.546 -4.797 -9.921
87 2HD2 ASN 10 HD22 ASN 10 -11.607 -3.401 -10.127
88 H MET 11 HN MET 11 -9.588 -1.339 -5.967
89 HA MET 11 HA MET 11 -6.793 -0.960 -6.488
90 1HB MET 11 HB2 MET 11 -8.671 0.634 -4.696
91 2HB MET 11 HB1 MET 11 -7.036 1.119 -5.094
92 1HG MET 11 HG2 MET 11 -9.278 0.633 -7.067
93 2HG MET 11 HG1 MET 11 -8.666 2.192 -6.594
94 1HE MET 11 HE2 MET 11 -6.825 3.429 -7.626
95 2HE MET 11 HE1 MET 11 -5.718 2.349 -6.740
96 3HE MET 11 HE3 MET 11 -5.461 2.694 -8.441
97 H ALA 12 HN ALA 12 -8.599 -1.413 -3.474
98 HA ALA 12 HA ALA 12 -6.269 -1.381 -1.817
99 1HB ALA 12 HB1 ALA 12 -8.858 -2.927 -1.394
100 2HB ALA 12 HB3 ALA 12 -7.655 -2.590 -0.156
101 3HB ALA 12 HB2 ALA 12 -8.570 -1.271 -0.881
102 NH1 ARG 13 NH1 ARG 13 -10.696 -6.740 -5.629
103 NH2 ARG 13 NH2 ARG 13 -10.726 -8.383 -7.262
104 H ARG 13 HN ARG 13 -7.962 -3.953 -3.489
105 HA ARG 13 HA ARG 13 -6.327 -6.068 -2.469
106 1HB ARG 13 HB2 ARG 13 -8.551 -6.273 -3.722
107 2HB ARG 13 HB1 ARG 13 -7.671 -5.954 -5.180
108 1HG ARG 13 HG2 ARG 13 -6.316 -7.969 -4.905
109 2HG ARG 13 HG1 ARG 13 -7.018 -8.256 -3.322
110 1HD ARG 13 HD2 ARG 13 -8.091 -9.597 -5.233
111 2HD ARG 13 HD1 ARG 13 -9.232 -8.665 -4.270
112 HE ARG 13 HE ARG 13 -8.138 -7.548 -6.810
113 1HH1 ARG 13 HH12 ARG 13 -10.190 -6.209 -4.944
114 2HH1 ARG 13 HH11 ARG 13 -11.675 -6.544 -5.742
115 1HH2 ARG 13 HH22 ARG 13 -10.240 -9.080 -7.794
116 2HH2 ARG 13 HH21 ARG 13 -11.705 -8.253 -7.439
117 H PHE 14 HN PHE 14 -6.004 -3.806 -5.076
118 HA PHE 14 HA PHE 14 -3.835 -5.179 -6.365
119 1HB PHE 14 HB2 PHE 14 -5.111 -3.514 -7.630
120 2HB PHE 14 HB1 PHE 14 -4.686 -2.259 -6.470
121 HD1 PHE 14 HD2 PHE 14 -2.731 -4.920 -8.294
122 HD2 PHE 14 HD1 PHE 14 -3.134 -0.789 -7.317
123 HE1 PHE 14 HE2 PHE 14 -0.681 -4.424 -9.533
124 HE2 PHE 14 HE1 PHE 14 -1.072 -0.300 -8.560
125 HZ PHE 14 HZ PHE 14 0.154 -2.112 -9.668
126 H ILE 15 HN ILE 15 -4.000 -2.536 -4.001
127 HA ILE 15 HA ILE 15 -1.193 -2.089 -3.990
128 HB ILE 15 HB ILE 15 -3.265 -1.735 -1.776
129 1HG1 ILE 15 HG12 ILE 15 -1.969 0.103 -3.834
130 2HG1 ILE 15 HG11 ILE 15 -3.649 -0.384 -3.823
131 1HG2 ILE 15 HG21 ILE 15 -0.415 -0.680 -1.974
132 2HG2 ILE 15 HG23 ILE 15 -1.550 -0.263 -0.695
133 3HG2 ILE 15 HG22 ILE 15 -0.955 -1.893 -0.828
134 1HD1 ILE 15 HD2 ILE 15 -3.963 0.801 -1.655
135 2HD1 ILE 15 HD1 ILE 15 -2.291 1.341 -1.721
136 3HD1 ILE 15 HD3 ILE 15 -3.418 1.873 -2.939
137 NH1 ARG 16 NH1 ARG 16 -6.363 -7.897 -0.357
138 NH2 ARG 16 NH2 ARG 16 -6.245 -9.404 1.409
139 H ARG 16 HN ARG 16 -3.249 -4.403 -2.310
140 HA ARG 16 HA ARG 16 -1.209 -5.378 -0.568
141 1HB ARG 16 HB2 ARG 16 -3.628 -6.112 -0.448
142 2HB ARG 16 HB1 ARG 16 -3.386 -7.017 -1.942
143 1HG ARG 16 HG2 ARG 16 -1.568 -8.326 -0.858
144 2HG ARG 16 HG1 ARG 16 -1.844 -7.470 0.648
145 1HD ARG 16 HD2 ARG 16 -3.867 -9.212 -0.834
146 2HD ARG 16 HD1 ARG 16 -3.047 -9.635 0.661
147 HE ARG 16 HE ARG 16 -4.240 -7.424 1.503
148 1HH1 ARG 16 HH12 ARG 16 -5.900 -7.206 -0.915
149 2HH1 ARG 16 HH11 ARG 16 -7.318 -8.123 -0.572
150 1HH2 ARG 16 HH22 ARG 16 -5.707 -9.815 2.153
151 2HH2 ARG 16 HH21 ARG 16 -7.188 -9.724 1.299
152 H SER 17 HN SER 17 -2.145 -6.230 -3.865
153 HA SER 17 HA SER 17 -0.214 -8.256 -4.246
154 1HB SER 17 HB2 SER 17 -1.244 -6.315 -6.368
155 2HB SER 17 HB1 SER 17 -0.745 -8.004 -6.587
156 HG SER 17 HG1 SER 17 -3.074 -7.005 -5.585
157 H GLN 18 HN GLN 18 0.027 -4.731 -4.763
158 HA GLN 18 HA GLN 18 2.650 -4.861 -5.878
159 1HB GLN 18 HB2 GLN 18 1.454 -2.648 -4.152
160 2HB GLN 18 HB1 GLN 18 2.909 -2.490 -5.119
161 1HG GLN 18 HG2 GLN 18 1.486 -3.133 -7.153
162 2HG GLN 18 HG1 GLN 18 0.075 -2.893 -6.125
163 1HE2 GLN 18 HE21 GLN 18 1.285 0.655 -5.578
164 2HE2 GLN 18 HE22 GLN 18 1.174 -0.674 -4.542
165 H THR 19 HN THR 19 1.456 -4.701 -2.577
166 HA THR 19 HA THR 19 4.028 -4.420 -1.389
167 HB THR 19 HB THR 19 1.504 -5.698 -0.195
168 HG1 THR 19 HG1 THR 19 0.791 -3.756 -0.654
169 1HG2 THR 19 HG21 THR 19 3.788 -4.017 0.982
170 2HG2 THR 19 HG23 THR 19 2.438 -4.694 1.877
171 3HG2 THR 19 HG22 THR 19 3.662 -5.752 1.203
172 H LEU 20 HN LEU 20 2.216 -7.169 -2.589
173 HA LEU 20 HA LEU 20 3.875 -9.120 -1.256
174 1HB LEU 20 HB2 LEU 20 1.563 -9.500 -2.427
175 2HB LEU 20 HB1 LEU 20 2.439 -9.464 -3.936
176 HG LEU 20 HG LEU 20 1.979 -11.779 -3.170
177 1HD1 LEU 20 HD12 LEU 20 3.978 -11.386 -4.602
178 2HD1 LEU 20 HD11 LEU 20 4.977 -11.182 -3.174
179 3HD1 LEU 20 HD13 LEU 20 4.222 -12.718 -3.494
180 1HD2 LEU 20 HD21 LEU 20 2.108 -11.428 -0.726
181 2HD2 LEU 20 HD23 LEU 20 3.184 -12.712 -1.227
182 3HD2 LEU 20 HD22 LEU 20 3.835 -11.138 -0.830
183 H THR 21 HN THR 21 3.743 -7.928 -4.607
184 HA THR 21 HA THR 21 6.193 -9.086 -5.378
185 HB THR 21 HB THR 21 5.014 -6.481 -6.478
186 HG1 THR 21 HG1 THR 21 4.085 -9.075 -6.159
187 1HG2 THR 21 HG21 THR 21 6.176 -9.005 -7.805
188 2HG2 THR 21 HG23 THR 21 5.715 -7.525 -8.635
189 3HG2 THR 21 HG22 THR 21 7.116 -7.536 -7.572
190 H LEU 22 HN LEU 22 5.525 -6.371 -3.394
191 HA LEU 22 HA LEU 22 8.080 -5.082 -3.852
192 1HB LEU 22 HB2 LEU 22 6.040 -3.890 -2.857
193 2HB LEU 22 HB1 LEU 22 6.234 -4.880 -1.421
194 HG LEU 22 HG LEU 22 8.460 -3.897 -1.018
195 1HD1 LEU 22 HD11 LEU 22 7.819 -2.173 -3.446
196 2HD1 LEU 22 HD13 LEU 22 9.187 -1.929 -2.371
197 3HD1 LEU 22 HD12 LEU 22 9.107 -3.363 -3.368
198 1HD2 LEU 22 HD21 LEU 22 6.456 -2.817 -0.031
199 2HD2 LEU 22 HD23 LEU 22 7.675 -1.618 -0.423
200 3HD2 LEU 22 HD22 LEU 22 6.275 -1.820 -1.466
201 H LEU 23 HN LEU 23 6.653 -7.259 -1.504
202 HA LEU 23 HA LEU 23 8.781 -7.576 0.268
203 1HB LEU 23 HB2 LEU 23 6.433 -8.690 0.354
204 2HB LEU 23 HB1 LEU 23 7.026 -9.842 -0.812
205 HG LEU 23 HG LEU 23 6.998 -10.686 1.522
206 1HD1 LEU 23 HD12 LEU 23 8.483 -11.753 -0.112
207 2HD1 LEU 23 HD11 LEU 23 9.776 -10.639 0.290
208 3HD1 LEU 23 HD13 LEU 23 9.188 -11.760 1.492
209 1HD2 LEU 23 HD21 LEU 23 7.629 -8.639 2.692
210 2HD2 LEU 23 HD23 LEU 23 8.725 -9.939 3.097
211 3HD2 LEU 23 HD22 LEU 23 9.238 -8.681 1.986
212 H GLU 24 HN GLU 24 8.084 -9.226 -2.745
213 HA GLU 24 HA GLU 24 10.292 -10.913 -2.914
214 1HB GLU 24 HB2 GLU 24 9.060 -9.332 -5.159
215 2HB GLU 24 HB1 GLU 24 10.060 -10.771 -5.348
216 1HG GLU 24 HG2 GLU 24 8.350 -12.125 -4.278
217 2HG GLU 24 HG1 GLU 24 7.404 -10.696 -3.858
218 H LYS 25 HN LYS 25 10.059 -7.829 -4.549
219 HA LYS 25 HA LYS 25 12.750 -7.687 -5.384
220 1HB LYS 25 HB2 LYS 25 10.989 -5.352 -4.606
221 2HB LYS 25 HB1 LYS 25 12.391 -5.283 -5.651
222 1HG LYS 25 HG2 LYS 25 9.854 -6.872 -6.252
223 2HG LYS 25 HG1 LYS 25 10.223 -5.319 -6.953
224 1HD LYS 25 HD2 LYS 25 11.064 -6.575 -8.670
225 2HD LYS 25 HD1 LYS 25 12.474 -6.665 -7.648
226 1HE LYS 25 HE2 LYS 25 11.765 -8.912 -8.490
227 2HE LYS 25 HE1 LYS 25 11.733 -8.865 -6.738
228 1HZ LYS 25 HZ2 LYS 25 9.214 -8.061 -7.698
229 2HZ LYS 25 HZ1 LYS 25 9.667 -9.512 -8.456
230 3HZ LYS 25 HZ3 LYS 25 9.637 -9.425 -6.798
231 H LEU 26 HN LEU 26 11.348 -6.749 -2.332
232 HA LEU 26 HA LEU 26 13.719 -5.392 -1.420
233 1HB LEU 26 HB2 LEU 26 11.251 -6.535 -0.151
234 2HB LEU 26 HB1 LEU 26 12.613 -6.187 0.890
235 HG LEU 26 HG LEU 26 12.561 -3.856 0.404
236 1HD1 LEU 26 HD11 LEU 26 10.647 -4.384 -1.918
237 2HD1 LEU 26 HD13 LEU 26 11.212 -2.824 -1.372
238 3HD1 LEU 26 HD12 LEU 26 12.335 -3.946 -2.099
239 1HD2 LEU 26 HD22 LEU 26 9.695 -4.881 0.377
240 2HD2 LEU 26 HD21 LEU 26 10.682 -4.623 1.800
241 3HD2 LEU 26 HD23 LEU 26 10.180 -3.250 0.826
242 H ASN 27 HN ASN 27 12.528 -8.691 -1.267
243 HA ASN 27 HA ASN 27 14.678 -9.610 0.405
244 1HB ASN 27 HB2 ASN 27 12.941 -11.103 -1.602
245 2HB ASN 27 HB1 ASN 27 14.182 -11.888 -0.639
246 1HD2 ASN 27 HD21 ASN 27 11.408 -10.121 1.785
247 2HD2 ASN 27 HD22 ASN 27 12.249 -9.177 0.661
248 H GLU 28 HN GLU 28 14.377 -8.959 -3.016
249 HA GLU 28 HA GLU 28 16.704 -10.426 -3.810
250 1HB GLU 28 HB2 GLU 28 15.719 -7.794 -4.991
251 2HB GLU 28 HB1 GLU 28 16.756 -8.955 -5.782
252 1HG GLU 28 HG2 GLU 28 14.981 -10.657 -5.726
253 2HG GLU 28 HG1 GLU 28 13.900 -9.516 -4.944
254 H LEU 29 HN LEU 29 16.139 -7.202 -2.597
255 HA LEU 29 HA LEU 29 19.033 -6.619 -2.623
256 1HB LEU 29 HB2 LEU 29 16.722 -4.944 -1.603
257 2HB LEU 29 HB1 LEU 29 18.366 -4.385 -1.834
258 HG LEU 29 HG LEU 29 16.552 -5.415 -4.070
259 1HD1 LEU 29 HD11 LEU 29 15.835 -3.217 -3.178
260 2HD1 LEU 29 HD13 LEU 29 17.461 -2.586 -3.391
261 3HD1 LEU 29 HD12 LEU 29 16.499 -3.039 -4.790
262 1HD2 LEU 29 HD22 LEU 29 19.328 -4.142 -4.159
263 2HD2 LEU 29 HD21 LEU 29 18.974 -5.827 -4.518
264 3HD2 LEU 29 HD23 LEU 29 18.364 -4.565 -5.562
265 H ASP 30 HN ASP 30 18.091 -8.727 -0.910
266 HA ASP 30 HA ASP 30 18.107 -9.420 1.339
267 1HB ASP 30 HB2 ASP 30 20.558 -7.636 1.218
268 2HB ASP 30 HB1 ASP 30 20.217 -8.779 2.516
269 H ALA 31 HN ALA 31 16.435 -7.225 0.924
270 HA ALA 31 HA ALA 31 16.940 -5.391 3.187
271 1HB ALA 31 HB2 ALA 31 16.032 -4.459 1.072
272 2HB ALA 31 HB1 ALA 31 14.608 -5.478 1.247
273 3HB ALA 31 HB3 ALA 31 14.939 -4.215 2.424
274 H ASP 32 HN ASP 32 16.858 -7.534 4.342
275 HA ASP 32 HA ASP 32 14.556 -8.988 4.951
276 1HB ASP 32 HB2 ASP 32 15.612 -9.299 7.238
277 2HB ASP 32 HB1 ASP 32 16.747 -9.610 5.927
278 H GLU 33 HN GLU 33 15.795 -6.087 6.234
279 HA GLU 33 HA GLU 33 13.967 -5.453 8.231
280 1HB GLU 33 HB2 GLU 33 15.971 -4.245 8.030
281 2HB GLU 33 HB1 GLU 33 15.771 -3.985 6.311
282 1HG GLU 33 HG2 GLU 33 13.870 -2.338 7.029
283 2HG GLU 33 HG1 GLU 33 14.707 -2.403 8.593
284 H GLN 34 HN GLN 34 14.017 -4.013 5.067
285 HA GLN 34 HA GLN 34 11.412 -2.926 5.205
286 1HB GLN 34 HB2 GLN 34 12.886 -3.850 2.711
287 2HB GLN 34 HB1 GLN 34 11.593 -2.669 2.771
288 1HG GLN 34 HG2 GLN 34 12.883 -1.078 3.928
289 2HG GLN 34 HG1 GLN 34 14.108 -2.245 4.405
290 1HE2 GLN 34 HE21 GLN 34 15.935 -0.978 1.682
291 2HE2 GLN 34 HE22 GLN 34 15.773 -1.022 3.375
292 H ALA 35 HN ALA 35 12.486 -6.152 4.603
293 HA ALA 35 HA ALA 35 10.100 -6.970 3.204
294 1HB ALA 35 HB2 ALA 35 12.180 -8.386 3.174
295 2HB ALA 35 HB1 ALA 35 11.967 -8.703 4.890
296 3HB ALA 35 HB3 ALA 35 10.780 -9.282 3.751
297 H ASP 36 HN ASP 36 11.132 -7.045 6.626
298 HA ASP 36 HA ASP 36 8.753 -8.348 7.545
299 1HB ASP 36 HB2 ASP 36 10.470 -8.046 9.214
300 2HB ASP 36 HB1 ASP 36 10.499 -6.294 8.960
301 H ILE 37 HN ILE 37 9.650 -5.016 7.450
302 HA ILE 37 HA ILE 37 7.187 -3.900 8.237
303 HB ILE 37 HB ILE 37 9.110 -2.757 6.167
304 1HG1 ILE 37 HG12 ILE 37 10.372 -3.462 8.207
305 2HG1 ILE 37 HG11 ILE 37 10.331 -1.721 8.071
306 1HG2 ILE 37 HG22 ILE 37 7.017 -1.499 6.397
307 2HG2 ILE 37 HG21 ILE 37 7.247 -1.369 8.123
308 3HG2 ILE 37 HG23 ILE 37 8.367 -0.572 7.025
309 1HD1 ILE 37 HD1 ILE 37 8.514 -3.386 9.866
310 2HD1 ILE 37 HD3 ILE 37 9.899 -2.453 10.374
311 3HD1 ILE 37 HD2 ILE 37 8.490 -1.632 9.747
312 H CYS 38 HN CYS 38 8.261 -5.124 5.169
313 HA CYS 38 HA CYS 38 6.041 -4.062 3.660
314 1HB CYS 38 HB2 CYS 38 8.112 -4.867 2.564
315 2HB CYS 38 HB1 CYS 38 7.743 -6.495 3.074
316 HG CYS 38 HG1 CYS 38 6.099 -6.742 1.216
317 H GLU 39 HN GLU 39 6.567 -7.142 5.382
318 HA GLU 39 HA GLU 39 4.066 -8.208 4.407
319 1HB GLU 39 HB2 GLU 39 5.652 -8.889 6.941
320 2HB GLU 39 HB1 GLU 39 4.338 -9.854 6.281
321 1HG GLU 39 HG2 GLU 39 6.888 -9.224 4.753
322 2HG GLU 39 HG1 GLU 39 6.553 -10.742 5.574
323 H SER 40 HN SER 40 5.037 -6.255 7.144
324 HA SER 40 HA SER 40 2.486 -6.392 8.440
325 1HB SER 40 HB2 SER 40 4.564 -4.135 8.426
326 2HB SER 40 HB1 SER 40 3.344 -4.428 9.686
327 HG SER 40 HG1 SER 40 5.708 -5.728 9.273
328 H LEU 41 HN LEU 41 3.834 -4.567 5.803
329 HA LEU 41 HA LEU 41 1.595 -2.744 5.598
330 1HB LEU 41 HB2 LEU 41 3.936 -2.420 4.599
331 2HB LEU 41 HB1 LEU 41 3.489 -3.581 3.385
332 HG LEU 41 HG LEU 41 1.506 -2.192 2.733
333 1HD1 LEU 41 HD11 LEU 41 2.788 -0.160 4.589
334 2HD1 LEU 41 HD13 LEU 41 1.458 0.181 3.490
335 3HD1 LEU 41 HD12 LEU 41 1.226 -0.911 4.839
336 1HD2 LEU 41 HD22 LEU 41 4.186 -0.784 2.519
337 2HD2 LEU 41 HD21 LEU 41 3.592 -2.015 1.427
338 3HD2 LEU 41 HD23 LEU 41 2.783 -0.469 1.513
339 H HIS 42 HN HIS 42 2.516 -5.777 4.398
340 HA HIS 42 HA HIS 42 0.586 -6.080 2.311
341 1HB HIS 42 HB2 HIS 42 2.537 -7.705 2.781
342 2HB HIS 42 HB1 HIS 42 1.576 -8.338 4.112
343 HD1 HIS 42 HD1 HIS 42 1.909 -8.686 0.530
344 HD2 HIS 42 HD2 HIS 42 -1.019 -9.428 3.289
345 HE1 HIS 42 HE1 HIS 42 0.279 -10.179 -0.565
346 H ASP 43 HN ASP 43 0.559 -7.007 5.706
347 HA ASP 43 HA ASP 43 -2.134 -7.959 5.736
348 1HB ASP 43 HB2 ASP 43 -0.827 -8.428 7.719
349 2HB ASP 43 HB1 ASP 43 -0.538 -6.702 7.994
350 H HIS 44 HN HIS 44 -0.793 -4.813 6.653
351 HA HIS 44 HA HIS 44 -3.348 -3.663 7.175
352 1HB HIS 44 HB2 HIS 44 -0.733 -2.392 6.357
353 2HB HIS 44 HB1 HIS 44 -2.171 -1.454 6.772
354 HD1 HIS 44 HD1 HIS 44 -1.973 -4.499 8.749
355 HD2 HIS 44 HD2 HIS 44 -0.494 -0.690 9.117
356 HE1 HIS 44 HE1 HIS 44 -1.303 -4.240 11.075
357 H ALA 45 HN ALA 45 -1.722 -4.353 4.224
358 HA ALA 45 HA ALA 45 -3.236 -2.423 2.655
359 1HB ALA 45 HB2 ALA 45 -1.147 -3.555 1.718
360 2HB ALA 45 HB1 ALA 45 -2.026 -5.079 1.723
361 3HB ALA 45 HB3 ALA 45 -2.555 -3.765 0.686
362 H ASP 46 HN ASP 46 -3.473 -5.653 3.873
363 HA ASP 46 HA ASP 46 -5.964 -6.180 2.476
364 1HB ASP 46 HB2 ASP 46 -4.600 -8.118 3.275
365 2HB ASP 46 HB1 ASP 46 -4.785 -7.605 4.924
366 H GLU 47 HN GLU 47 -5.014 -4.799 5.630
367 HA GLU 47 HA GLU 47 -7.572 -4.941 6.824
368 1HB GLU 47 HB2 GLU 47 -5.523 -2.673 6.972
369 2HB GLU 47 HB1 GLU 47 -6.924 -2.776 8.007
370 1HG GLU 47 HG2 GLU 47 -4.830 -4.984 7.854
371 2HG GLU 47 HG1 GLU 47 -4.767 -3.688 9.034
372 H LEU 48 HN LEU 48 -6.184 -2.780 4.471
373 HA LEU 48 HA LEU 48 -8.500 -1.081 4.382
374 1HB LEU 48 HB2 LEU 48 -6.279 -0.395 3.439
375 2HB LEU 48 HB1 LEU 48 -6.414 -1.651 2.224
376 HG LEU 48 HG LEU 48 -8.440 -0.555 1.293
377 1HD1 LEU 48 HD11 LEU 48 -7.870 1.594 3.380
378 2HD1 LEU 48 HD13 LEU 48 -9.058 1.702 2.094
379 3HD1 LEU 48 HD12 LEU 48 -9.276 0.540 3.380
380 1HD2 LEU 48 HD21 LEU 48 -6.199 0.059 0.415
381 2HD2 LEU 48 HD23 LEU 48 -7.292 1.432 0.360
382 3HD2 LEU 48 HD22 LEU 48 -6.077 1.331 1.622
383 OH TYR 49 OH TYR 49 -11.203 -9.030 -2.515
384 H TYR 49 HN TYR 49 -7.380 -3.794 2.463
385 HA TYR 49 HA TYR 49 -9.514 -3.926 0.628
386 1HB TYR 49 HB2 TYR 49 -7.417 -5.192 0.362
387 2HB TYR 49 HB1 TYR 49 -7.864 -6.195 1.736
388 HD1 TYR 49 HD2 TYR 49 -9.171 -5.125 -1.594
389 HD2 TYR 49 HD1 TYR 49 -9.105 -8.149 1.402
390 HE1 TYR 49 HE2 TYR 49 -10.437 -6.602 -3.047
391 HE2 TYR 49 HE1 TYR 49 -10.370 -9.630 -0.071
392 HH TYR 49 HH TYR 49 -12.109 -9.093 -2.194
393 NH1 ARG 50 NH1 ARG 50 -7.211 -7.966 8.806
394 NH2 ARG 50 NH2 ARG 50 -5.856 -7.144 7.145
395 H ARG 50 HN ARG 50 -9.167 -6.099 3.434
396 HA ARG 50 HA ARG 50 -11.659 -7.313 3.221
397 1HB ARG 50 HB2 ARG 50 -11.399 -7.876 5.593
398 2HB ARG 50 HB1 ARG 50 -9.819 -7.958 4.831
399 1HG ARG 50 HG2 ARG 50 -9.457 -5.536 5.643
400 2HG ARG 50 HG1 ARG 50 -10.919 -5.729 6.578
401 1HD ARG 50 HD2 ARG 50 -9.070 -6.257 8.037
402 2HD ARG 50 HD1 ARG 50 -9.931 -7.750 7.696
403 HE ARG 50 HE ARG 50 -8.001 -7.964 5.851
404 1HH1 ARG 50 HH12 ARG 50 -8.098 -8.294 9.126
405 2HH1 ARG 50 HH11 ARG 50 -6.440 -7.939 9.451
406 1HH2 ARG 50 HH22 ARG 50 -5.713 -6.843 6.203
407 2HH2 ARG 50 HH21 ARG 50 -5.063 -7.114 7.765
408 H SER 51 HN SER 51 -10.815 -4.208 4.738
409 HA SER 51 HA SER 51 -13.501 -3.788 5.706
410 1HB SER 51 HB2 SER 51 -11.239 -1.829 5.113
411 2HB SER 51 HB1 SER 51 -12.704 -1.442 6.047
412 HG SER 51 HG1 SER 51 -10.528 -2.809 6.832
413 H CYS 52 HN CYS 52 -11.815 -3.164 2.700
414 HA CYS 52 HA CYS 52 -13.904 -1.482 1.608
415 1HB CYS 52 HB2 CYS 52 -11.976 -3.311 0.143
416 2HB CYS 52 HB1 CYS 52 -12.943 -2.082 -0.604
417 HG CYS 52 HG1 CYS 52 -10.279 -1.627 0.835
418 H LEU 53 HN LEU 53 -13.433 -4.841 2.189
419 HA LEU 53 HA LEU 53 -15.613 -5.587 0.351
420 1HB LEU 53 HB2 LEU 53 -13.577 -7.125 0.992
421 2HB LEU 53 HB1 LEU 53 -14.376 -7.292 2.546
422 HG LEU 53 HG LEU 53 -16.443 -8.132 1.355
423 1HD1 LEU 53 HD12 LEU 53 -15.949 -7.185 -0.916
424 2HD1 LEU 53 HD11 LEU 53 -14.563 -8.254 -1.032
425 3HD1 LEU 53 HD13 LEU 53 -16.185 -8.915 -0.977
426 1HD2 LEU 53 HD22 LEU 53 -13.879 -9.709 0.898
427 2HD2 LEU 53 HD21 LEU 53 -14.808 -9.688 2.391
428 3HD2 LEU 53 HD23 LEU 53 -15.503 -10.381 0.936
429 H ALA 54 HN ALA 54 -15.058 -4.629 3.620
430 HA ALA 54 HA ALA 54 -17.474 -5.768 4.697
431 1HB ALA 54 HB2 ALA 54 -15.694 -4.784 6.187
432 2HB ALA 54 HB1 ALA 54 -16.088 -3.184 5.560
433 3HB ALA 54 HB3 ALA 54 -17.276 -4.078 6.489
434 NH1 ARG 55 NH2 ARG 55 -20.666 2.933 2.118
435 NH2 ARG 55 NH1 ARG 55 -19.589 4.318 3.613
436 H ARG 55 HN ARG 55 -16.640 -2.804 3.061
437 HA ARG 55 HA ARG 55 -19.437 -1.882 3.207
438 1HB ARG 55 HB2 ARG 55 -17.808 -0.127 3.456
439 2HB ARG 55 HB1 ARG 55 -16.897 -0.689 2.064
440 1HG ARG 55 HG2 ARG 55 -18.587 0.010 0.528
441 2HG ARG 55 HG1 ARG 55 -19.759 0.259 1.815
442 1HD ARG 55 HD2 ARG 55 -17.123 1.769 1.696
443 2HD ARG 55 HD1 ARG 55 -18.551 2.376 0.875
444 HE ARG 55 HE ARG 55 -18.255 2.066 3.827
445 1HH1 ARG 55 HH22 ARG 55 -20.699 2.080 1.597
446 2HH1 ARG 55 HH21 ARG 55 -21.425 3.585 2.022
447 1HH2 ARG 55 HH12 ARG 55 -18.815 4.509 4.217
448 2HH2 ARG 55 HH11 ARG 55 -20.319 5.007 3.556
449 H PHE 56 HN PHE 56 -17.078 -2.407 0.637
450 HA PHE 56 HA PHE 56 -19.211 -2.594 -1.358
451 1HB PHE 56 HB2 PHE 56 -16.248 -3.175 -1.714
452 2HB PHE 56 HB1 PHE 56 -17.410 -2.908 -2.980
453 HD1 PHE 56 HD1 PHE 56 -18.879 -0.591 -2.504
454 HD2 PHE 56 HD2 PHE 56 -14.878 -1.359 -1.255
455 HE1 PHE 56 HE1 PHE 56 -18.449 1.819 -2.380
456 HE2 PHE 56 HE2 PHE 56 -14.456 1.054 -1.131
457 HZ PHE 56 HZ PHE 56 -16.244 2.649 -1.699
458 H GLY 57 HN GLY 57 -19.078 -4.656 0.775
459 1HA GLY 57 HA2 GLY 57 -18.126 -7.070 -0.513
460 2HA GLY 57 HA1 GLY 57 -19.098 -6.997 0.952
461 H ASP 58 HN ASP 58 -20.210 -5.410 -1.942
462 HA ASP 58 HA ASP 58 -22.542 -7.199 -1.965
463 1HB ASP 58 HB2 ASP 58 -23.370 -5.657 -3.748
464 2HB ASP 58 HB1 ASP 58 -22.877 -4.749 -2.317
465 H ASP 59 HN ASP 59 -19.713 -7.926 -2.756
466 HA ASP 59 HA ASP 59 -19.601 -8.335 -5.569
467 1HB ASP 59 HB2 ASP 59 -18.353 -10.031 -3.365
468 2HB ASP 59 HB1 ASP 59 -17.907 -10.098 -5.060
469 H GLY 60 HN GLY 60 -21.644 -9.157 -6.250
470 1HA GLY 60 HA2 GLY 60 -21.819 -11.992 -6.252
471 2HA GLY 60 HA1 GLY 60 -22.889 -11.384 -4.984
472 H GLU 61 HN GLU 61 -23.210 -8.853 -6.726
473 HA GLU 61 HA GLU 61 -25.617 -9.756 -7.998
474 1HB GLU 61 HB2 GLU 61 -23.977 -7.220 -8.465
475 2HB GLU 61 HB1 GLU 61 -25.645 -7.458 -8.955
476 1HG GLU 61 HG2 GLU 61 -26.438 -7.538 -6.728
477 2HG GLU 61 HG1 GLU 61 -24.842 -7.866 -6.055
478 H ASN 62 HN ASN 62 -22.292 -9.538 -8.876
479 HA ASN 62 HA ASN 62 -22.849 -9.981 -11.744
480 1HB ASN 62 HB2 ASN 62 -20.687 -8.833 -11.003
481 2HB ASN 62 HB1 ASN 62 -20.194 -10.375 -10.296
482 1HD2 ASN 62 HD21 ASN 62 -20.064 -11.926 -13.673
483 2HD2 ASN 62 HD22 ASN 62 -20.719 -12.325 -12.177
484 H LEU 63 HN LEU 63 -23.388 -11.899 -12.443
485 HA LEU 63 HA LEU 63 -22.388 -14.331 -11.047
486 1HB LEU 63 HB2 LEU 63 -25.129 -13.909 -12.322
487 2HB LEU 63 HB1 LEU 63 -24.584 -15.382 -11.545
488 HG LEU 63 HG LEU 63 -24.817 -12.704 -10.082
489 1HD1 LEU 63 HD11 LEU 63 -26.732 -15.075 -10.074
490 2HD1 LEU 63 HD13 LEU 63 -26.870 -13.642 -9.062
491 3HD1 LEU 63 HD12 LEU 63 -27.051 -13.507 -10.803
492 1HD2 LEU 63 HD22 LEU 63 -24.457 -15.563 -9.080
493 2HD2 LEU 63 HD21 LEU 63 -23.213 -14.325 -9.081
494 3HD2 LEU 63 HD23 LEU 63 -24.623 -14.139 -8.062
495 1H MET 1 HT1 MET 1 20.724 2.812 -5.193
496 2H MET 1 HT3 MET 1 21.964 2.990 -4.060
497 3H MET 1 HT2 MET 1 20.966 4.308 -4.438
498 HA MET 1 HA MET 1 22.211 4.937 -6.088
499 1HB MET 1 HB2 MET 1 23.885 2.476 -5.375
500 2HB MET 1 HB1 MET 1 24.418 3.776 -6.423
501 1HG MET 1 HG2 MET 1 23.650 4.046 -3.494
502 2HG MET 1 HG1 MET 1 25.269 4.044 -4.129
503 1HE MET 1 HE3 MET 1 21.924 5.835 -3.813
504 2HE MET 1 HE2 MET 1 22.928 6.382 -2.452
505 3HE MET 1 HE1 MET 1 22.418 7.502 -3.708
506 H THR 2 HN THR 2 22.423 1.420 -6.224
507 HA THR 2 HA THR 2 22.268 1.182 -9.010
508 HB THR 2 HB THR 2 21.156 -0.833 -6.971
509 HG1 THR 2 HG1 THR 2 23.027 -0.513 -6.077
510 1HG2 THR 2 HG21 THR 2 23.041 -1.100 -9.392
511 2HG2 THR 2 HG23 THR 2 22.339 -2.426 -8.480
512 3HG2 THR 2 HG22 THR 2 21.321 -1.435 -9.513
513 H LYS 3 HN LYS 3 20.491 0.921 -10.396
514 HA LYS 3 HA LYS 3 18.219 2.466 -9.737
515 1HB LYS 3 HB2 LYS 3 17.114 1.545 -11.726
516 2HB LYS 3 HB1 LYS 3 18.769 1.974 -12.090
517 1HG LYS 3 HG2 LYS 3 19.465 -0.210 -12.365
518 2HG LYS 3 HG1 LYS 3 18.349 -0.886 -11.205
519 1HD LYS 3 HD2 LYS 3 17.106 0.334 -13.631
520 2HD LYS 3 HD1 LYS 3 18.059 -1.108 -13.890
521 1HE LYS 3 HE2 LYS 3 15.586 -1.555 -13.374
522 2HE LYS 3 HE1 LYS 3 16.720 -2.424 -12.360
523 1HZ LYS 3 HZ1 LYS 3 16.122 0.020 -11.105
524 2HZ LYS 3 HZ3 LYS 3 14.676 -0.709 -11.557
525 3HZ LYS 3 HZ2 LYS 3 15.769 -1.565 -10.619
526 H GLN 4 HN GLN 4 18.911 -0.814 -8.934
527 HA GLN 4 HA GLN 4 16.118 -1.589 -8.794
528 1HB GLN 4 HB2 GLN 4 18.251 -3.171 -8.776
529 2HB GLN 4 HB1 GLN 4 18.322 -2.781 -7.063
530 1HG GLN 4 HG2 GLN 4 17.049 -4.815 -7.211
531 2HG GLN 4 HG1 GLN 4 15.853 -3.553 -6.955
532 1HE2 GLN 4 HE21 GLN 4 14.914 -5.780 -9.871
533 2HE2 GLN 4 HE22 GLN 4 15.369 -6.119 -8.280
534 H GLU 5 HN GLU 5 18.496 -0.265 -6.585
535 HA GLU 5 HA GLU 5 16.851 -0.320 -4.268
536 1HB GLU 5 HB2 GLU 5 18.894 1.794 -5.086
537 2HB GLU 5 HB1 GLU 5 18.295 1.514 -3.468
538 1HG GLU 5 HG2 GLU 5 19.373 -0.636 -3.357
539 2HG GLU 5 HG1 GLU 5 19.747 -0.629 -5.082
540 H LYS 6 HN LYS 6 17.352 1.988 -6.833
541 HA LYS 6 HA LYS 6 15.526 3.950 -5.942
542 1HB LYS 6 HB2 LYS 6 17.155 4.340 -7.843
543 2HB LYS 6 HB1 LYS 6 16.282 3.167 -8.780
544 1HG LYS 6 HG2 LYS 6 15.703 5.454 -9.448
545 2HG LYS 6 HG1 LYS 6 14.313 4.531 -8.943
546 1HD LYS 6 HD2 LYS 6 14.071 6.720 -8.041
547 2HD LYS 6 HD1 LYS 6 14.470 5.716 -6.677
548 1HE LYS 6 HE2 LYS 6 16.485 7.381 -8.260
549 2HE LYS 6 HE1 LYS 6 15.713 7.898 -6.782
550 1HZ LYS 6 HZ1 LYS 6 16.883 5.397 -6.292
551 2HZ LYS 6 HZ3 LYS 6 18.028 6.369 -7.058
552 3HZ LYS 6 HZ2 LYS 6 17.291 6.903 -5.657
553 H THR 7 HN THR 7 14.957 1.043 -7.889
554 HA THR 7 HA THR 7 12.247 1.818 -8.473
555 HB THR 7 HB THR 7 13.371 -1.047 -8.396
556 HG1 THR 7 HG1 THR 7 14.188 1.144 -9.670
557 1HG2 THR 7 HG22 THR 7 10.879 -0.661 -8.966
558 2HG2 THR 7 HG21 THR 7 11.399 0.390 -10.272
559 3HG2 THR 7 HG23 THR 7 11.793 -1.325 -10.310
560 H ALA 8 HN ALA 8 13.780 -0.111 -5.966
561 HA ALA 8 HA ALA 8 11.397 -1.045 -4.729
562 1HB ALA 8 HB1 ALA 8 14.065 -0.370 -3.423
563 2HB ALA 8 HB3 ALA 8 12.799 -1.347 -2.700
564 3HB ALA 8 HB2 ALA 8 13.645 -1.926 -4.129
565 H LEU 9 HN LEU 9 13.436 1.673 -4.080
566 HA LEU 9 HA LEU 9 12.025 2.863 -1.968
567 1HB LEU 9 HB2 LEU 9 14.288 3.553 -2.909
568 2HB LEU 9 HB1 LEU 9 13.428 4.317 -4.231
569 HG LEU 9 HG LEU 9 12.100 5.364 -2.056
570 1HD1 LEU 9 HD11 LEU 9 15.042 5.078 -1.330
571 2HD1 LEU 9 HD13 LEU 9 13.891 6.060 -0.457
572 3HD1 LEU 9 HD12 LEU 9 13.705 4.320 -0.487
573 1HD2 LEU 9 HD21 LEU 9 12.922 6.539 -4.067
574 2HD2 LEU 9 HD23 LEU 9 13.373 7.403 -2.608
575 3HD2 LEU 9 HD22 LEU 9 14.557 6.433 -3.467
576 H ASN 10 HN ASN 10 11.789 3.329 -5.425
577 HA ASN 10 HA ASN 10 9.709 5.250 -5.346
578 1HB ASN 10 HB2 ASN 10 10.559 3.312 -7.503
579 2HB ASN 10 HB1 ASN 10 9.281 4.508 -7.741
580 1HD2 ASN 10 HD21 ASN 10 12.066 6.575 -8.703
581 2HD2 ASN 10 HD22 ASN 10 10.864 5.562 -9.342
582 H MET 11 HN MET 11 9.529 1.715 -5.294
583 HA MET 11 HA MET 11 6.678 1.804 -5.838
584 1HB MET 11 HB2 MET 11 8.396 -0.317 -4.527
585 2HB MET 11 HB1 MET 11 6.676 -0.521 -4.810
586 1HG MET 11 HG2 MET 11 7.070 -0.036 -7.232
587 2HG MET 11 HG1 MET 11 8.784 -0.010 -6.935
588 1HE MET 11 HE2 MET 11 9.677 -1.895 -5.384
589 2HE MET 11 HE1 MET 11 9.578 -3.561 -5.872
590 3HE MET 11 HE3 MET 11 10.327 -2.387 -6.962
591 H ALA 12 HN ALA 12 8.703 1.929 -2.975
592 HA ALA 12 HA ALA 12 6.536 1.604 -1.109
593 1HB ALA 12 HB1 ALA 12 9.086 3.249 -0.765
594 2HB ALA 12 HB3 ALA 12 8.010 2.732 0.522
595 3HB ALA 12 HB2 ALA 12 8.937 1.538 -0.381
596 NH1 ARG 13 NH2 ARG 13 11.014 7.724 -4.899
597 NH2 ARG 13 NH1 ARG 13 11.971 9.533 -3.816
598 H ARG 13 HN ARG 13 8.211 4.374 -2.362
599 HA ARG 13 HA ARG 13 6.553 6.398 -1.289
600 1HB ARG 13 HB2 ARG 13 8.780 6.818 -2.300
601 2HB ARG 13 HB1 ARG 13 8.197 6.348 -3.877
602 1HG ARG 13 HG2 ARG 13 6.551 8.269 -3.779
603 2HG ARG 13 HG1 ARG 13 7.294 8.769 -2.272
604 1HD ARG 13 HD2 ARG 13 8.669 8.571 -5.012
605 2HD ARG 13 HD1 ARG 13 8.352 10.042 -4.102
606 HE ARG 13 HE ARG 13 9.902 8.859 -2.334
607 1HH1 ARG 13 HH22 ARG 13 10.241 7.106 -5.028
608 2HH1 ARG 13 HH21 ARG 13 11.829 7.573 -5.471
609 1HH2 ARG 13 HH12 ARG 13 11.917 10.266 -3.135
610 2HH2 ARG 13 HH11 ARG 13 12.834 9.470 -4.332
611 H PHE 14 HN PHE 14 6.215 4.304 -4.063
612 HA PHE 14 HA PHE 14 4.127 5.813 -5.320
613 1HB PHE 14 HB2 PHE 14 5.236 3.905 -6.572
614 2HB PHE 14 HB1 PHE 14 4.489 2.783 -5.431
615 HD1 PHE 14 HD1 PHE 14 3.333 5.772 -7.427
616 HD2 PHE 14 HD2 PHE 14 2.601 1.766 -6.178
617 HE1 PHE 14 HE1 PHE 14 1.236 5.759 -8.691
618 HE2 PHE 14 HE2 PHE 14 0.506 1.752 -7.453
619 HZ PHE 14 HZ PHE 14 -0.185 3.750 -8.711
620 H ILE 15 HN ILE 15 4.040 2.960 -3.239
621 HA ILE 15 HA ILE 15 1.222 2.838 -3.123
622 HB ILE 15 HB ILE 15 3.272 2.007 -1.020
623 1HG1 ILE 15 HG12 ILE 15 1.864 0.435 -3.212
624 2HG1 ILE 15 HG11 ILE 15 3.516 0.985 -3.342
625 1HG2 ILE 15 HG21 ILE 15 0.366 1.184 -1.444
626 2HG2 ILE 15 HG23 ILE 15 1.421 0.484 -0.226
627 3HG2 ILE 15 HG22 ILE 15 0.941 2.157 -0.111
628 1HD1 ILE 15 HD2 ILE 15 4.108 -0.363 -1.321
629 2HD1 ILE 15 HD1 ILE 15 2.464 -0.981 -1.257
630 3HD1 ILE 15 HD3 ILE 15 3.487 -1.359 -2.625
631 NH1 ARG 16 NH2 ARG 16 2.670 8.947 4.681
632 NH2 ARG 16 NH1 ARG 16 4.909 9.486 4.617
633 H ARG 16 HN ARG 16 3.520 4.832 -1.345
634 HA ARG 16 HA ARG 16 1.659 5.598 0.679
635 1HB ARG 16 HB2 ARG 16 4.097 6.200 0.765
636 2HB ARG 16 HB1 ARG 16 3.848 7.325 -0.567
637 1HG ARG 16 HG2 ARG 16 2.180 8.533 0.769
638 2HG ARG 16 HG1 ARG 16 2.412 7.424 2.110
639 1HD ARG 16 HD2 ARG 16 4.848 8.142 2.157
640 2HD ARG 16 HD1 ARG 16 4.491 9.327 0.914
641 HE ARG 16 HE ARG 16 3.222 10.587 2.507
642 1HH1 ARG 16 HH22 ARG 16 1.785 8.866 4.219
643 2HH1 ARG 16 HH21 ARG 16 2.730 8.681 5.650
644 1HH2 ARG 16 HH12 ARG 16 5.717 9.811 4.118
645 2HH2 ARG 16 HH11 ARG 16 5.043 9.232 5.581
646 H SER 17 HN SER 17 2.569 7.327 -2.285
647 HA SER 17 HA SER 17 0.523 9.263 -2.121
648 1HB SER 17 HB2 SER 17 1.825 8.127 -4.626
649 2HB SER 17 HB1 SER 17 1.186 9.772 -4.402
650 HG SER 17 HG1 SER 17 3.030 10.204 -3.505
651 H GLN 18 HN GLN 18 0.573 6.142 -3.648
652 HA GLN 18 HA GLN 18 -1.840 6.255 -5.087
653 1HB GLN 18 HB2 GLN 18 -0.088 4.401 -5.152
654 2HB GLN 18 HB1 GLN 18 -0.702 3.849 -3.605
655 1HG GLN 18 HG2 GLN 18 -2.919 3.428 -4.641
656 2HG GLN 18 HG1 GLN 18 -2.266 3.960 -6.197
657 1HE2 GLN 18 HE21 GLN 18 -1.536 0.417 -6.433
658 2HE2 GLN 18 HE22 GLN 18 -2.749 1.546 -6.796
659 H THR 19 HN THR 19 -1.235 4.910 -1.894
660 HA THR 19 HA THR 19 -3.923 4.507 -1.189
661 HB THR 19 HB THR 19 -1.487 5.085 0.578
662 HG1 THR 19 HG1 THR 19 -0.911 3.294 -0.378
663 1HG2 THR 19 HG22 THR 19 -3.778 4.923 1.746
664 2HG2 THR 19 HG21 THR 19 -3.974 3.338 1.012
665 3HG2 THR 19 HG23 THR 19 -2.664 3.627 2.152
666 H LEU 20 HN LEU 20 -1.975 7.397 -1.175
667 HA LEU 20 HA LEU 20 -3.616 8.925 0.620
668 1HB LEU 20 HB2 LEU 20 -1.291 9.531 -0.511
669 2HB LEU 20 HB1 LEU 20 -2.273 10.102 -1.841
670 HG LEU 20 HG LEU 20 -2.599 11.139 0.992
671 1HD1 LEU 20 HD11 LEU 20 -1.127 12.346 -1.396
672 2HD1 LEU 20 HD13 LEU 20 -1.395 13.146 0.143
673 3HD1 LEU 20 HD12 LEU 20 -0.369 11.728 0.064
674 1HD2 LEU 20 HD22 LEU 20 -3.629 12.197 -1.688
675 2HD2 LEU 20 HD21 LEU 20 -4.626 11.474 -0.441
676 3HD2 LEU 20 HD23 LEU 20 -3.823 12.990 -0.136
677 H THR 21 HN THR 21 -3.488 8.674 -2.896
678 HA THR 21 HA THR 21 -5.818 10.146 -3.435
679 HB THR 21 HB THR 21 -4.767 7.784 -5.088
680 HG1 THR 21 HG1 THR 21 -3.627 10.089 -4.106
681 1HG2 THR 21 HG22 THR 21 -6.723 9.245 -5.977
682 2HG2 THR 21 HG21 THR 21 -5.654 10.630 -5.841
683 3HG2 THR 21 HG23 THR 21 -5.275 9.334 -6.968
684 H LEU 22 HN LEU 22 -5.445 6.882 -2.262
685 HA LEU 22 HA LEU 22 -8.210 6.233 -3.006
686 1HB LEU 22 HB2 LEU 22 -6.327 4.832 -1.076
687 2HB LEU 22 HB1 LEU 22 -7.901 4.230 -1.542
688 HG LEU 22 HG LEU 22 -5.580 4.715 -3.472
689 1HD1 LEU 22 HD12 LEU 22 -5.243 2.786 -1.943
690 2HD1 LEU 22 HD11 LEU 22 -6.810 2.138 -2.399
691 3HD1 LEU 22 HD13 LEU 22 -5.521 2.238 -3.590
692 1HD2 LEU 22 HD22 LEU 22 -8.312 3.428 -3.934
693 2HD2 LEU 22 HD21 LEU 22 -7.820 4.990 -4.576
694 3HD2 LEU 22 HD23 LEU 22 -7.017 3.535 -5.114
695 H LEU 23 HN LEU 23 -6.515 7.547 -0.244
696 HA LEU 23 HA LEU 23 -8.664 7.094 1.590
697 1HB LEU 23 HB2 LEU 23 -6.328 7.896 2.260
698 2HB LEU 23 HB1 LEU 23 -6.677 9.434 1.507
699 HG LEU 23 HG LEU 23 -8.461 8.415 3.745
700 1HD1 LEU 23 HD11 LEU 23 -5.878 10.023 4.002
701 2HD1 LEU 23 HD13 LEU 23 -6.990 9.670 5.313
702 3HD1 LEU 23 HD12 LEU 23 -6.102 8.369 4.542
703 1HD2 LEU 23 HD22 LEU 23 -7.674 11.227 2.837
704 2HD2 LEU 23 HD21 LEU 23 -9.225 10.484 2.488
705 3HD2 LEU 23 HD23 LEU 23 -8.784 10.839 4.137
706 H GLU 24 HN GLU 24 -7.778 9.972 -0.273
707 HA GLU 24 HA GLU 24 -10.158 11.369 0.358
708 1HB GLU 24 HB2 GLU 24 -9.607 12.453 -2.026
709 2HB GLU 24 HB1 GLU 24 -8.587 12.782 -0.642
710 1HG GLU 24 HG2 GLU 24 -6.871 11.451 -1.429
711 2HG GLU 24 HG1 GLU 24 -7.936 10.403 -2.355
712 H LYS 25 HN LYS 25 -9.476 9.696 -2.718
713 HA LYS 25 HA LYS 25 -12.079 10.043 -3.716
714 1HB LYS 25 HB2 LYS 25 -10.114 7.785 -4.242
715 2HB LYS 25 HB1 LYS 25 -11.503 8.156 -5.255
716 1HG LYS 25 HG2 LYS 25 -9.373 10.234 -4.569
717 2HG LYS 25 HG1 LYS 25 -9.263 9.231 -5.989
718 1HD LYS 25 HD2 LYS 25 -10.929 10.328 -7.085
719 2HD LYS 25 HD1 LYS 25 -11.902 10.607 -5.665
720 1HE LYS 25 HE2 LYS 25 -9.358 12.114 -6.451
721 2HE LYS 25 HE1 LYS 25 -10.998 12.751 -6.509
722 1HZ LYS 25 HZ1 LYS 25 -10.496 11.808 -3.918
723 2HZ LYS 25 HZ3 LYS 25 -9.223 12.822 -4.388
724 3HZ LYS 25 HZ2 LYS 25 -10.829 13.358 -4.421
725 H LEU 26 HN LEU 26 -10.954 7.394 -1.610
726 HA LEU 26 HA LEU 26 -13.487 6.014 -2.024
727 1HB LEU 26 HB2 LEU 26 -11.223 5.689 -0.045
728 2HB LEU 26 HB1 LEU 26 -12.762 4.996 0.336
729 HG LEU 26 HG LEU 26 -12.836 3.799 -1.837
730 1HD1 LEU 26 HD11 LEU 26 -10.047 4.906 -2.341
731 2HD1 LEU 26 HD13 LEU 26 -10.864 3.704 -3.321
732 3HD1 LEU 26 HD12 LEU 26 -11.491 5.336 -3.243
733 1HD2 LEU 26 HD22 LEU 26 -10.280 3.306 -0.279
734 2HD2 LEU 26 HD21 LEU 26 -11.876 2.646 0.059
735 3HD2 LEU 26 HD23 LEU 26 -11.025 2.163 -1.392
736 H ASN 27 HN ASN 27 -12.244 8.486 0.064
737 HA ASN 27 HA ASN 27 -14.356 8.427 2.003
738 1HB ASN 27 HB2 ASN 27 -12.204 9.868 2.128
739 2HB ASN 27 HB1 ASN 27 -13.000 10.954 0.989
740 1HD2 ASN 27 HD21 ASN 27 -14.144 10.870 4.870
741 2HD2 ASN 27 HD22 ASN 27 -12.973 9.808 4.284
742 H GLU 28 HN GLU 28 -13.821 10.090 -0.996
743 HA GLU 28 HA GLU 28 -16.314 11.459 -1.166
744 1HB GLU 28 HB2 GLU 28 -14.345 10.589 -3.313
745 2HB GLU 28 HB1 GLU 28 -15.613 11.779 -3.548
746 1HG GLU 28 HG2 GLU 28 -14.624 13.336 -2.101
747 2HG GLU 28 HG1 GLU 28 -13.658 12.140 -1.258
748 H LEU 29 HN LEU 29 -15.285 8.262 -1.943
749 HA LEU 29 HA LEU 29 -17.744 7.733 -3.477
750 1HB LEU 29 HB2 LEU 29 -15.407 6.754 -4.047
751 2HB LEU 29 HB1 LEU 29 -15.594 5.762 -2.613
752 HG LEU 29 HG LEU 29 -17.584 4.643 -3.590
753 1HD1 LEU 29 HD11 LEU 29 -17.035 6.378 -6.040
754 2HD1 LEU 29 HD13 LEU 29 -18.216 5.081 -5.945
755 3HD1 LEU 29 HD12 LEU 29 -18.438 6.530 -4.996
756 1HD2 LEU 29 HD22 LEU 29 -15.205 4.701 -5.476
757 2HD2 LEU 29 HD21 LEU 29 -15.347 3.712 -4.031
758 3HD2 LEU 29 HD23 LEU 29 -16.420 3.433 -5.391
759 H ASP 30 HN ASP 30 -17.490 8.420 -0.548
760 HA ASP 30 HA ASP 30 -18.410 7.820 1.476
761 1HB ASP 30 HB2 ASP 30 -20.581 7.846 0.210
762 2HB ASP 30 HB1 ASP 30 -20.312 6.162 -0.257
763 H ALA 31 HN ALA 31 -16.436 6.711 1.707
764 HA ALA 31 HA ALA 31 -16.846 3.988 2.656
765 1HB ALA 31 HB1 ALA 31 -14.796 4.557 0.455
766 2HB ALA 31 HB3 ALA 31 -14.972 3.026 1.293
767 3HB ALA 31 HB2 ALA 31 -16.249 3.598 0.229
768 H ASP 32 HN ASP 32 -16.599 6.161 3.928
769 HA ASP 32 HA ASP 32 -14.020 7.276 4.322
770 1HB ASP 32 HB2 ASP 32 -16.038 8.364 5.266
771 2HB ASP 32 HB1 ASP 32 -16.243 6.993 6.367
772 H GLU 33 HN GLU 33 -15.560 4.482 5.721
773 HA GLU 33 HA GLU 33 -13.670 4.036 7.806
774 1HB GLU 33 HB2 GLU 33 -14.561 1.601 6.303
775 2HB GLU 33 HB1 GLU 33 -14.556 1.893 8.020
776 1HG GLU 33 HG2 GLU 33 -16.867 1.854 7.529
777 2HG GLU 33 HG1 GLU 33 -16.501 3.575 7.549
778 H GLN 34 HN GLN 34 -13.748 3.040 4.414
779 HA GLN 34 HA GLN 34 -11.183 1.745 4.557
780 1HB GLN 34 HB2 GLN 34 -12.705 2.965 2.235
781 2HB GLN 34 HB1 GLN 34 -11.081 2.353 2.029
782 1HG GLN 34 HG2 GLN 34 -12.609 0.622 1.375
783 2HG GLN 34 HG1 GLN 34 -11.905 0.108 2.900
784 1HE2 GLN 34 HE21 GLN 34 -15.005 0.406 4.655
785 2HE2 GLN 34 HE22 GLN 34 -13.320 0.352 4.864
786 H ALA 35 HN ALA 35 -12.214 5.061 4.097
787 HA ALA 35 HA ALA 35 -9.694 6.058 3.199
788 1HB ALA 35 HB2 ALA 35 -11.778 7.447 3.137
789 2HB ALA 35 HB1 ALA 35 -11.773 7.522 4.894
790 3HB ALA 35 HB3 ALA 35 -10.496 8.283 3.992
791 H ASP 36 HN ASP 36 -11.037 5.542 6.397
792 HA ASP 36 HA ASP 36 -8.978 6.726 7.935
793 1HB ASP 36 HB2 ASP 36 -10.871 5.978 9.190
794 2HB ASP 36 HB1 ASP 36 -10.793 4.357 8.502
795 H ILE 37 HN ILE 37 -9.455 3.380 7.076
796 HA ILE 37 HA ILE 37 -6.912 2.517 7.999
797 HB ILE 37 HB ILE 37 -8.610 1.365 5.744
798 1HG1 ILE 37 HG12 ILE 37 -8.581 0.821 8.759
799 2HG1 ILE 37 HG11 ILE 37 -9.834 1.718 7.939
800 1HG2 ILE 37 HG21 ILE 37 -6.517 0.105 7.565
801 2HG2 ILE 37 HG23 ILE 37 -7.450 -0.766 6.361
802 3HG2 ILE 37 HG22 ILE 37 -6.296 0.444 5.857
803 1HD1 ILE 37 HD2 ILE 37 -10.372 -0.272 6.565
804 2HD1 ILE 37 HD1 ILE 37 -9.163 -1.207 7.441
805 3HD1 ILE 37 HD3 ILE 37 -10.563 -0.582 8.282
806 H CYS 38 HN CYS 38 -7.923 4.005 5.027
807 HA CYS 38 HA CYS 38 -5.519 3.371 3.566
808 1HB CYS 38 HB2 CYS 38 -7.323 5.792 3.242
809 2HB CYS 38 HB1 CYS 38 -6.023 5.386 2.171
810 HG CYS 38 HG1 CYS 38 -8.806 4.116 2.137
811 H GLU 39 HN GLU 39 -6.373 5.779 5.952
812 HA GLU 39 HA GLU 39 -4.077 7.444 5.375
813 1HB GLU 39 HB2 GLU 39 -6.241 8.043 6.786
814 2HB GLU 39 HB1 GLU 39 -5.393 7.267 8.104
815 1HG GLU 39 HG2 GLU 39 -3.507 8.786 7.890
816 2HG GLU 39 HG1 GLU 39 -4.223 9.525 6.456
817 H SER 40 HN SER 40 -4.773 4.786 7.608
818 HA SER 40 HA SER 40 -2.162 5.006 8.842
819 1HB SER 40 HB2 SER 40 -3.385 2.291 8.803
820 2HB SER 40 HB1 SER 40 -3.054 3.331 10.207
821 HG SER 40 HG1 SER 40 -5.073 4.004 10.072
822 H LEU 41 HN LEU 41 -3.492 3.304 6.167
823 HA LEU 41 HA LEU 41 -1.186 1.672 5.652
824 1HB LEU 41 HB2 LEU 41 -3.534 1.298 4.831
825 2HB LEU 41 HB1 LEU 41 -3.342 2.636 3.751
826 HG LEU 41 HG LEU 41 -1.451 1.482 2.581
827 1HD1 LEU 41 HD11 LEU 41 -2.149 -0.837 4.428
828 2HD1 LEU 41 HD13 LEU 41 -1.005 -0.907 3.096
829 3HD1 LEU 41 HD12 LEU 41 -0.660 0.084 4.494
830 1HD2 LEU 41 HD22 LEU 41 -3.977 -0.200 2.815
831 2HD2 LEU 41 HD21 LEU 41 -3.766 1.181 1.752
832 3HD2 LEU 41 HD23 LEU 41 -2.819 -0.271 1.493
833 H HIS 42 HN HIS 42 -2.307 4.735 4.798
834 HA HIS 42 HA HIS 42 -0.617 5.491 2.654
835 1HB HIS 42 HB2 HIS 42 -2.449 6.969 3.537
836 2HB HIS 42 HB1 HIS 42 -1.500 7.258 4.972
837 HD1 HIS 42 HD1 HIS 42 -0.618 7.672 1.296
838 HD2 HIS 42 HD2 HIS 42 -0.376 9.632 4.885
839 HE1 HIS 42 HE1 HIS 42 0.500 9.810 0.852
840 H ASP 43 HN ASP 43 -0.057 6.124 6.115
841 HA ASP 43 HA ASP 43 2.736 6.740 5.415
842 1HB ASP 43 HB2 ASP 43 1.533 7.883 7.363
843 2HB ASP 43 HB1 ASP 43 1.672 6.341 8.218
844 H HIS 44 HN HIS 44 1.034 3.926 6.504
845 HA HIS 44 HA HIS 44 3.398 2.664 7.582
846 1HB HIS 44 HB2 HIS 44 1.050 1.699 7.911
847 2HB HIS 44 HB1 HIS 44 1.062 1.254 6.205
848 HD1 HIS 44 HD1 HIS 44 4.364 0.836 7.606
849 HD2 HIS 44 HD2 HIS 44 0.990 -1.472 7.438
850 HE1 HIS 44 HE1 HIS 44 5.061 -1.466 8.106
851 H ALA 45 HN ALA 45 2.015 3.170 4.453
852 HA ALA 45 HA ALA 45 3.734 1.319 3.045
853 1HB ALA 45 HB1 ALA 45 2.476 3.904 2.022
854 2HB ALA 45 HB3 ALA 45 3.147 2.627 1.025
855 3HB ALA 45 HB2 ALA 45 1.687 2.332 1.967
856 H ASP 46 HN ASP 46 3.771 4.614 4.071
857 HA ASP 46 HA ASP 46 6.220 5.329 2.771
858 1HB ASP 46 HB2 ASP 46 4.606 6.963 3.829
859 2HB ASP 46 HB1 ASP 46 5.209 6.465 5.395
860 H GLU 47 HN GLU 47 5.503 3.470 5.639
861 HA GLU 47 HA GLU 47 8.015 3.823 6.924
862 1HB GLU 47 HB2 GLU 47 6.284 1.302 6.767
863 2HB GLU 47 HB1 GLU 47 7.713 1.414 7.740
864 1HG GLU 47 HG2 GLU 47 5.559 3.484 8.109
865 2HG GLU 47 HG1 GLU 47 5.415 1.907 8.884
866 H LEU 48 HN LEU 48 7.035 1.915 4.185
867 HA LEU 48 HA LEU 48 9.551 0.490 4.067
868 1HB LEU 48 HB2 LEU 48 7.479 1.086 1.910
869 2HB LEU 48 HB1 LEU 48 8.921 0.150 1.603
870 HG LEU 48 HG LEU 48 6.955 -1.315 2.015
871 1HD1 LEU 48 HD12 LEU 48 9.213 -2.128 2.630
872 2HD1 LEU 48 HD11 LEU 48 9.031 -1.474 4.249
873 3HD1 LEU 48 HD13 LEU 48 7.995 -2.772 3.708
874 1HD2 LEU 48 HD21 LEU 48 5.724 0.179 3.583
875 2HD2 LEU 48 HD23 LEU 48 5.919 -1.439 4.233
876 3HD2 LEU 48 HD22 LEU 48 6.918 -0.134 4.823
877 OH TYR 49 OH TYR 49 11.461 9.985 -1.175
878 H TYR 49 HN TYR 49 8.305 3.500 2.802
879 HA TYR 49 HA TYR 49 10.520 4.033 1.072
880 1HB TYR 49 HB2 TYR 49 8.302 5.318 1.161
881 2HB TYR 49 HB1 TYR 49 8.862 6.043 2.650
882 HD1 TYR 49 HD1 TYR 49 11.821 5.905 0.721
883 HD2 TYR 49 HD2 TYR 49 8.060 7.905 0.909
884 HE1 TYR 49 HE1 TYR 49 12.751 7.789 -0.495
885 HE2 TYR 49 HE2 TYR 49 8.997 9.779 -0.307
886 HH TYR 49 HH TYR 49 12.423 9.898 -1.202
887 NH1 ARG 50 NH2 ARG 50 6.552 6.230 7.270
888 NH2 ARG 50 NH1 ARG 50 6.658 5.790 9.522
889 H ARG 50 HN ARG 50 9.840 4.992 4.417
890 HA ARG 50 HA ARG 50 12.250 6.298 4.966
891 1HB ARG 50 HB2 ARG 50 10.509 4.595 6.810
892 2HB ARG 50 HB1 ARG 50 11.752 5.700 7.377
893 1HG ARG 50 HG2 ARG 50 10.580 7.573 6.155
894 2HG ARG 50 HG1 ARG 50 9.310 6.469 5.697
895 1HD ARG 50 HD2 ARG 50 10.045 7.188 8.572
896 2HD ARG 50 HD1 ARG 50 8.655 7.790 7.684
897 HE ARG 50 HE ARG 50 8.960 4.907 8.420
898 1HH1 ARG 50 HH22 ARG 50 7.010 6.334 6.385
899 2HH1 ARG 50 HH21 ARG 50 5.556 6.362 7.302
900 1HH2 ARG 50 HH12 ARG 50 7.186 5.533 10.334
901 2HH2 ARG 50 HH11 ARG 50 5.670 5.930 9.628
902 H SER 51 HN SER 51 11.485 2.900 5.684
903 HA SER 51 HA SER 51 14.097 2.198 6.497
904 1HB SER 51 HB2 SER 51 11.989 0.439 5.170
905 2HB SER 51 HB1 SER 51 13.262 -0.089 6.297
906 HG SER 51 HG1 SER 51 10.897 1.113 6.828
907 H CYS 52 HN CYS 52 12.706 2.457 3.280
908 HA CYS 52 HA CYS 52 14.934 1.059 2.037
909 1HB CYS 52 HB2 CYS 52 12.848 2.934 0.906
910 2HB CYS 52 HB1 CYS 52 14.041 2.137 -0.076
911 HG CYS 52 HG1 CYS 52 12.767 -0.021 0.069
912 H LEU 53 HN LEU 53 14.174 4.287 3.009
913 HA LEU 53 HA LEU 53 16.345 5.447 1.467
914 1HB LEU 53 HB2 LEU 53 14.298 6.750 2.315
915 2HB LEU 53 HB1 LEU 53 14.935 6.562 3.939
916 HG LEU 53 HG LEU 53 17.014 7.791 3.253
917 1HD1 LEU 53 HD11 LEU 53 15.485 8.275 0.648
918 2HD1 LEU 53 HD13 LEU 53 17.011 9.014 1.087
919 3HD1 LEU 53 HD12 LEU 53 16.933 7.296 0.779
920 1HD2 LEU 53 HD22 LEU 53 14.404 9.261 2.719
921 2HD2 LEU 53 HD21 LEU 53 15.123 8.996 4.301
922 3HD2 LEU 53 HD23 LEU 53 15.935 10.017 3.129
923 H ALA 54 HN ALA 54 15.876 3.799 4.443
924 HA ALA 54 HA ALA 54 18.370 4.761 5.613
925 1HB ALA 54 HB2 ALA 54 16.533 3.942 7.086
926 2HB ALA 54 HB1 ALA 54 16.678 2.336 6.382
927 3HB ALA 54 HB3 ALA 54 18.002 3.004 7.317
928 NH1 ARG 55 NH1 ARG 55 18.776 -5.042 4.732
929 NH2 ARG 55 NH2 ARG 55 18.121 -4.512 6.889
930 H ARG 55 HN ARG 55 17.298 1.570 4.595
931 HA ARG 55 HA ARG 55 19.854 0.390 4.565
932 1HB ARG 55 HB2 ARG 55 17.551 -0.783 4.368
933 2HB ARG 55 HB1 ARG 55 17.614 -0.334 2.672
934 1HG ARG 55 HG2 ARG 55 18.441 -2.557 2.707
935 2HG ARG 55 HG1 ARG 55 19.862 -1.547 2.530
936 1HD ARG 55 HD2 ARG 55 20.314 -3.230 4.286
937 2HD ARG 55 HD1 ARG 55 20.197 -1.657 5.049
938 HE ARG 55 HE ARG 55 17.849 -2.248 5.681
939 1HH1 ARG 55 HH12 ARG 55 19.034 -4.761 3.805
940 2HH1 ARG 55 HH11 ARG 55 18.755 -6.032 4.918
941 1HH2 ARG 55 HH22 ARG 55 17.896 -3.808 7.571
942 2HH2 ARG 55 HH21 ARG 55 18.064 -5.479 7.172
943 H PHE 56 HN PHE 56 18.088 2.013 1.972
944 HA PHE 56 HA PHE 56 20.424 1.551 0.196
945 1HB PHE 56 HB2 PHE 56 17.835 2.910 -0.565
946 2HB PHE 56 HB1 PHE 56 19.045 2.217 -1.614
947 HD1 PHE 56 HD2 PHE 56 19.596 -0.415 -0.262
948 HD2 PHE 56 HD1 PHE 56 15.927 1.642 -0.943
949 HE1 PHE 56 HE2 PHE 56 18.383 -2.540 -0.167
950 HE2 PHE 56 HE1 PHE 56 14.717 -0.492 -0.847
951 HZ PHE 56 HZ PHE 56 15.939 -2.585 -0.460
952 H GLY 57 HN GLY 57 18.426 4.285 1.291
953 1HA GLY 57 HA2 GLY 57 19.085 6.565 1.458
954 2HA GLY 57 HA1 GLY 57 20.767 5.982 1.386
955 H ASP 58 HN ASP 58 18.410 4.986 -0.902
956 HA ASP 58 HA ASP 58 19.846 6.489 -3.029
957 1HB ASP 58 HB2 ASP 58 19.667 3.916 -3.225
958 2HB ASP 58 HB1 ASP 58 17.935 4.151 -3.355
959 H ASP 59 HN ASP 59 18.735 8.110 -3.977
960 HA ASP 59 HA ASP 59 15.781 8.007 -4.179
961 1HB ASP 59 HB2 ASP 59 16.656 9.340 -1.972
962 2HB ASP 59 HB1 ASP 59 16.988 10.587 -3.170
963 H GLY 60 HN GLY 60 15.444 10.369 -5.468
964 1HA GLY 60 HA2 GLY 60 16.766 11.867 -6.985
965 2HA GLY 60 HA1 GLY 60 17.691 10.424 -7.451
966 H GLU 61 HN GLU 61 14.410 11.685 -7.214
967 HA GLU 61 HA GLU 61 13.454 9.736 -9.183
968 1HB GLU 61 HB2 GLU 61 11.921 12.145 -8.145
969 2HB GLU 61 HB1 GLU 61 11.289 10.591 -8.667
970 1HG GLU 61 HG2 GLU 61 12.904 11.137 -6.132
971 2HG GLU 61 HG1 GLU 61 11.238 10.591 -6.247
972 H ASN 62 HN ASN 62 14.695 10.254 -10.975
973 HA ASN 62 HA ASN 62 13.620 12.498 -12.523
974 1HB ASN 62 HB2 ASN 62 15.828 13.446 -13.064
975 2HB ASN 62 HB1 ASN 62 15.641 13.494 -11.311
976 1HD2 ASN 62 HD21 ASN 62 18.358 10.923 -13.005
977 2HD2 ASN 62 HD22 ASN 62 17.221 11.699 -13.984
978 H LEU 63 HN LEU 63 14.756 12.409 -14.700
979 HA LEU 63 HA LEU 63 15.372 9.582 -15.425
980 1HB LEU 63 HB2 LEU 63 14.034 11.723 -17.159
981 2HB LEU 63 HB1 LEU 63 14.408 10.097 -17.660
982 HG LEU 63 HG LEU 63 12.065 10.134 -17.265
983 1HD1 LEU 63 HD12 LEU 63 13.153 8.118 -16.422
984 2HD1 LEU 63 HD11 LEU 63 13.370 8.848 -14.842
985 3HD1 LEU 63 HD13 LEU 63 11.756 8.501 -15.432
986 1HD2 LEU 63 HD21 LEU 63 11.882 12.185 -15.929
987 2HD2 LEU 63 HD23 LEU 63 10.989 10.871 -15.186
988 3HD2 LEU 63 HD22 LEU 63 12.529 11.364 -14.519
Start of MODEL 2
Raw file had 988 H/Q atoms
Start of MODEL 2
1 1H MET 1 HT1 MET 1 -22.451 0.245 -4.541
2 2H MET 1 HT3 MET 1 -22.705 0.927 -3.018
3 3H MET 1 HT2 MET 1 -23.689 -0.355 -3.561
4 HA MET 1 HA MET 1 -25.096 0.994 -4.499
5 1HB MET 1 HB2 MET 1 -23.144 3.215 -3.688
6 2HB MET 1 HB1 MET 1 -24.724 3.502 -4.377
7 1HG MET 1 HG2 MET 1 -25.784 2.383 -2.469
8 2HG MET 1 HG1 MET 1 -24.233 2.015 -1.781
9 1HE MET 1 HE2 MET 1 -22.522 3.586 -1.305
10 2HE MET 1 HE1 MET 1 -22.758 5.140 -0.550
11 3HE MET 1 HE3 MET 1 -23.251 3.675 0.304
12 H THR 2 HN THR 2 -21.917 2.398 -5.092
13 HA THR 2 HA THR 2 -22.583 2.741 -7.917
14 HB THR 2 HB THR 2 -19.790 3.301 -6.890
15 HG1 THR 2 HG1 THR 2 -20.677 3.955 -5.055
16 1HG2 THR 2 HG21 THR 2 -22.034 5.122 -7.924
17 2HG2 THR 2 HG23 THR 2 -20.324 5.516 -7.832
18 3HG2 THR 2 HG22 THR 2 -20.887 4.344 -9.008
19 H LYS 3 HN LYS 3 -21.203 1.674 -9.532
20 HA LYS 3 HA LYS 3 -20.558 -1.043 -8.583
21 1HB LYS 3 HB2 LYS 3 -20.717 0.206 -11.366
22 2HB LYS 3 HB1 LYS 3 -20.250 -1.464 -11.078
23 1HG LYS 3 HG2 LYS 3 -22.592 -1.646 -11.421
24 2HG LYS 3 HG1 LYS 3 -22.453 -1.664 -9.683
25 1HD LYS 3 HD2 LYS 3 -22.947 0.974 -9.891
26 2HD LYS 3 HD1 LYS 3 -23.468 0.527 -11.498
27 1HE LYS 3 HE2 LYS 3 -25.389 0.468 -9.969
28 2HE LYS 3 HE1 LYS 3 -25.033 -1.162 -10.515
29 1HZ LYS 3 HZ1 LYS 3 -23.555 -0.680 -8.162
30 2HZ LYS 3 HZ3 LYS 3 -25.139 -0.211 -7.888
31 3HZ LYS 3 HZ2 LYS 3 -24.789 -1.778 -8.406
32 H GLN 4 HN GLN 4 -19.229 1.954 -9.366
33 HA GLN 4 HA GLN 4 -16.556 1.233 -10.066
34 1HB GLN 4 HB2 GLN 4 -17.567 3.728 -8.641
35 2HB GLN 4 HB1 GLN 4 -16.024 3.564 -9.457
36 1HG GLN 4 HG2 GLN 4 -17.075 3.327 -11.609
37 2HG GLN 4 HG1 GLN 4 -18.676 3.154 -10.894
38 1HE2 GLN 4 HE21 GLN 4 -17.138 6.855 -11.432
39 2HE2 GLN 4 HE22 GLN 4 -16.292 5.473 -11.931
40 H GLU 5 HN GLU 5 -18.327 1.061 -7.183
41 HA GLU 5 HA GLU 5 -16.268 1.463 -5.263
42 1HB GLU 5 HB2 GLU 5 -18.551 -0.548 -5.141
43 2HB GLU 5 HB1 GLU 5 -17.704 0.178 -3.778
44 1HG GLU 5 HG2 GLU 5 -18.515 2.373 -4.294
45 2HG GLU 5 HG1 GLU 5 -19.301 1.780 -5.748
46 H LYS 6 HN LYS 6 -17.274 -1.260 -7.214
47 HA LYS 6 HA LYS 6 -15.435 -3.130 -6.031
48 1HB LYS 6 HB2 LYS 6 -16.912 -3.104 -8.685
49 2HB LYS 6 HB1 LYS 6 -15.920 -4.455 -8.140
50 1HG LYS 6 HG2 LYS 6 -17.248 -4.802 -6.176
51 2HG LYS 6 HG1 LYS 6 -17.971 -3.219 -6.338
52 1HD LYS 6 HD2 LYS 6 -18.460 -5.090 -8.595
53 2HD LYS 6 HD1 LYS 6 -19.228 -5.527 -7.081
54 1HE LYS 6 HE2 LYS 6 -19.456 -2.857 -8.537
55 2HE LYS 6 HE1 LYS 6 -20.743 -4.036 -8.322
56 1HZ LYS 6 HZ1 LYS 6 -19.737 -3.398 -5.789
57 2HZ LYS 6 HZ3 LYS 6 -20.086 -1.942 -6.594
58 3HZ LYS 6 HZ2 LYS 6 -21.260 -3.143 -6.435
59 H THR 7 HN THR 7 -15.129 -0.606 -8.332
60 HA THR 7 HA THR 7 -12.756 -1.688 -9.591
61 HB THR 7 HB THR 7 -13.620 1.270 -9.385
62 HG1 THR 7 HG1 THR 7 -14.848 -0.985 -10.317
63 1HG2 THR 7 HG22 THR 7 -11.460 0.628 -10.687
64 2HG2 THR 7 HG21 THR 7 -12.467 -0.398 -11.696
65 3HG2 THR 7 HG23 THR 7 -12.712 1.341 -11.689
66 H ALA 8 HN ALA 8 -13.532 0.607 -7.018
67 HA ALA 8 HA ALA 8 -10.827 1.138 -6.244
68 1HB ALA 8 HB1 ALA 8 -13.342 1.186 -4.531
69 2HB ALA 8 HB3 ALA 8 -11.809 1.933 -4.110
70 3HB ALA 8 HB2 ALA 8 -12.742 2.548 -5.467
71 H LEU 9 HN LEU 9 -13.129 -1.299 -5.423
72 HA LEU 9 HA LEU 9 -11.779 -2.457 -3.216
73 1HB LEU 9 HB2 LEU 9 -14.107 -3.129 -3.927
74 2HB LEU 9 HB1 LEU 9 -13.442 -3.774 -5.412
75 HG LEU 9 HG LEU 9 -12.271 -5.521 -4.252
76 1HD1 LEU 9 HD11 LEU 9 -13.425 -4.317 -1.703
77 2HD1 LEU 9 HD13 LEU 9 -12.506 -5.809 -1.790
78 3HD1 LEU 9 HD12 LEU 9 -11.719 -4.283 -2.122
79 1HD2 LEU 9 HD22 LEU 9 -15.130 -5.257 -3.279
80 2HD2 LEU 9 HD21 LEU 9 -14.624 -5.916 -4.826
81 3HD2 LEU 9 HD23 LEU 9 -14.198 -6.745 -3.341
82 H ASN 10 HN ASN 10 -11.704 -3.129 -6.648
83 HA ASN 10 HA ASN 10 -9.636 -5.066 -6.538
84 1HB ASN 10 HB2 ASN 10 -10.769 -3.337 -8.697
85 2HB ASN 10 HB1 ASN 10 -9.209 -4.105 -8.993
86 1HD2 ASN 10 HD21 ASN 10 -12.534 -6.384 -9.026
87 2HD2 ASN 10 HD22 ASN 10 -12.615 -4.694 -8.916
88 H MET 11 HN MET 11 -9.496 -1.552 -6.727
89 HA MET 11 HA MET 11 -6.695 -1.472 -7.326
90 1HB MET 11 HB2 MET 11 -8.474 0.520 -5.879
91 2HB MET 11 HB1 MET 11 -6.776 0.814 -6.219
92 1HG MET 11 HG2 MET 11 -7.217 0.361 -8.630
93 2HG MET 11 HG1 MET 11 -8.913 0.202 -8.283
94 1HE MET 11 HE2 MET 11 -10.446 1.650 -8.518
95 2HE MET 11 HE1 MET 11 -10.356 2.963 -7.333
96 3HE MET 11 HE3 MET 11 -10.323 3.296 -9.072
97 H ALA 12 HN ALA 12 -8.491 -1.563 -4.294
98 HA ALA 12 HA ALA 12 -6.239 -1.250 -2.591
99 1HB ALA 12 HB3 ALA 12 -8.708 -2.965 -2.100
100 2HB ALA 12 HB2 ALA 12 -7.585 -2.428 -0.867
101 3HB ALA 12 HB1 ALA 12 -8.584 -1.256 -1.714
102 NH1 ARG 13 NH1 ARG 13 -8.622 -8.046 -6.849
103 NH2 ARG 13 NH2 ARG 13 -7.371 -6.484 -8.020
104 H ARG 13 HN ARG 13 -7.680 -4.124 -4.051
105 HA ARG 13 HA ARG 13 -5.849 -5.942 -2.799
106 1HB ARG 13 HB2 ARG 13 -7.860 -6.751 -3.927
107 2HB ARG 13 HB1 ARG 13 -7.276 -6.149 -5.458
108 1HG ARG 13 HG2 ARG 13 -5.577 -8.077 -3.871
109 2HG ARG 13 HG1 ARG 13 -6.999 -8.736 -4.638
110 1HD ARG 13 HD2 ARG 13 -4.954 -7.129 -6.263
111 2HD ARG 13 HD1 ARG 13 -4.757 -8.841 -5.968
112 HE ARG 13 HE ARG 13 -6.183 -9.078 -7.773
113 1HH1 ARG 13 HH12 ARG 13 -8.663 -8.901 -6.326
114 2HH1 ARG 13 HH11 ARG 13 -9.478 -7.535 -6.972
115 1HH2 ARG 13 HH22 ARG 13 -6.483 -6.176 -8.375
116 2HH2 ARG 13 HH21 ARG 13 -8.167 -5.900 -8.195
117 H PHE 14 HN PHE 14 -5.717 -4.072 -5.798
118 HA PHE 14 HA PHE 14 -3.309 -5.327 -6.691
119 1HB PHE 14 HB2 PHE 14 -4.489 -2.576 -7.257
120 2HB PHE 14 HB1 PHE 14 -2.984 -3.105 -7.983
121 HD1 PHE 14 HD2 PHE 14 -3.369 -5.882 -8.697
122 HD2 PHE 14 HD1 PHE 14 -6.224 -2.717 -8.864
123 HE1 PHE 14 HE2 PHE 14 -4.610 -7.083 -10.421
124 HE2 PHE 14 HE1 PHE 14 -7.459 -3.928 -10.591
125 HZ PHE 14 HZ PHE 14 -6.659 -6.116 -11.380
126 H ILE 15 HN ILE 15 -3.937 -2.710 -4.433
127 HA ILE 15 HA ILE 15 -1.220 -1.830 -4.312
128 HB ILE 15 HB ILE 15 -3.408 -1.892 -2.169
129 1HG1 ILE 15 HG12 ILE 15 -2.451 0.091 -4.229
130 2HG1 ILE 15 HG11 ILE 15 -4.083 -0.434 -3.896
131 1HG2 ILE 15 HG22 ILE 15 -1.199 -1.826 -1.070
132 2HG2 ILE 15 HG21 ILE 15 -0.745 -0.452 -2.053
133 3HG2 ILE 15 HG23 ILE 15 -2.026 -0.305 -0.863
134 1HD1 ILE 15 HD2 ILE 15 -4.062 0.765 -1.730
135 2HD1 ILE 15 HD1 ILE 15 -2.448 1.369 -2.084
136 3HD1 ILE 15 HD3 ILE 15 -3.794 1.845 -3.090
137 NH1 ARG 16 NH1 ARG 16 -1.782 -9.890 2.848
138 NH2 ARG 16 NH2 ARG 16 -3.948 -10.161 2.081
139 H ARG 16 HN ARG 16 -3.072 -4.325 -2.663
140 HA ARG 16 HA ARG 16 -0.944 -5.213 -1.003
141 1HB ARG 16 HB2 ARG 16 -3.280 -6.015 -0.671
142 2HB ARG 16 HB1 ARG 16 -3.219 -6.867 -2.208
143 1HG ARG 16 HG2 ARG 16 -1.394 -8.235 -1.448
144 2HG ARG 16 HG1 ARG 16 -1.317 -7.367 0.084
145 1HD ARG 16 HD2 ARG 16 -3.682 -8.146 0.486
146 2HD ARG 16 HD1 ARG 16 -3.560 -9.155 -0.945
147 HE ARG 16 HE ARG 16 -1.541 -10.218 0.230
148 1HH1 ARG 16 HH12 ARG 16 -0.809 -9.711 2.680
149 2HH1 ARG 16 HH11 ARG 16 -2.065 -10.041 3.802
150 1HH2 ARG 16 HH22 ARG 16 -4.613 -10.173 1.327
151 2HH2 ARG 16 HH21 ARG 16 -4.304 -10.329 3.006
152 H SER 17 HN SER 17 -1.876 -6.049 -4.286
153 HA SER 17 HA SER 17 -0.055 -8.192 -4.644
154 1HB SER 17 HB2 SER 17 -0.930 -6.203 -6.797
155 2HB SER 17 HB1 SER 17 -0.500 -7.907 -7.010
156 HG SER 17 HG1 SER 17 -2.349 -7.624 -5.053
157 H GLN 18 HN GLN 18 0.316 -4.748 -5.352
158 HA GLN 18 HA GLN 18 2.968 -4.940 -6.352
159 1HB GLN 18 HB2 GLN 18 1.623 -2.656 -4.846
160 2HB GLN 18 HB1 GLN 18 3.108 -2.515 -5.773
161 1HG GLN 18 HG2 GLN 18 1.969 -3.051 -7.832
162 2HG GLN 18 HG1 GLN 18 0.504 -3.533 -6.986
163 1HE2 GLN 18 HE21 GLN 18 1.458 0.465 -7.007
164 2HE2 GLN 18 HE22 GLN 18 2.711 -0.675 -6.993
165 H THR 19 HN THR 19 1.695 -4.387 -3.122
166 HA THR 19 HA THR 19 4.180 -4.044 -1.849
167 HB THR 19 HB THR 19 1.588 -5.272 -0.766
168 HG1 THR 19 HG1 THR 19 0.993 -3.307 -1.269
169 1HG2 THR 19 HG21 THR 19 3.842 -3.671 0.566
170 2HG2 THR 19 HG23 THR 19 2.395 -4.286 1.354
171 3HG2 THR 19 HG22 THR 19 3.629 -5.398 0.785
172 H LEU 20 HN LEU 20 2.558 -6.951 -2.979
173 HA LEU 20 HA LEU 20 4.178 -8.763 -1.451
174 1HB LEU 20 HB2 LEU 20 2.124 -9.461 -2.870
175 2HB LEU 20 HB1 LEU 20 3.133 -9.216 -4.281
176 HG LEU 20 HG LEU 20 4.737 -10.927 -3.496
177 1HD1 LEU 20 HD11 LEU 20 2.708 -11.404 -1.260
178 2HD1 LEU 20 HD13 LEU 20 4.106 -12.407 -1.607
179 3HD1 LEU 20 HD12 LEU 20 4.331 -10.775 -1.025
180 1HD2 LEU 20 HD22 LEU 20 1.845 -11.872 -3.625
181 2HD2 LEU 20 HD21 LEU 20 2.888 -11.549 -5.002
182 3HD2 LEU 20 HD23 LEU 20 3.264 -12.869 -3.910
183 H THR 21 HN THR 21 4.414 -7.299 -4.650
184 HA THR 21 HA THR 21 6.893 -8.470 -5.337
185 HB THR 21 HB THR 21 6.006 -5.656 -6.158
186 HG1 THR 21 HG1 THR 21 4.832 -8.164 -6.306
187 1HG2 THR 21 HG21 THR 21 7.106 -8.077 -7.708
188 2HG2 THR 21 HG23 THR 21 6.856 -6.463 -8.361
189 3HG2 THR 21 HG22 THR 21 8.125 -6.748 -7.179
190 H LEU 22 HN LEU 22 6.113 -5.604 -3.399
191 HA LEU 22 HA LEU 22 8.884 -4.808 -3.218
192 1HB LEU 22 HB2 LEU 22 6.406 -4.125 -1.632
193 2HB LEU 22 HB1 LEU 22 7.966 -3.715 -0.967
194 HG LEU 22 HG LEU 22 6.950 -1.819 -2.219
195 1HD1 LEU 22 HD12 LEU 22 9.400 -1.958 -2.030
196 2HD1 LEU 22 HD11 LEU 22 9.495 -2.905 -3.507
197 3HD1 LEU 22 HD13 LEU 22 8.934 -1.249 -3.561
198 1HD2 LEU 22 HD22 LEU 22 7.250 -3.602 -4.675
199 2HD2 LEU 22 HD21 LEU 22 5.739 -3.075 -3.943
200 3HD2 LEU 22 HD23 LEU 22 6.809 -1.902 -4.681
201 H LEU 23 HN LEU 23 6.874 -7.059 -1.557
202 HA LEU 23 HA LEU 23 8.463 -7.373 0.783
203 1HB LEU 23 HB2 LEU 23 6.149 -8.486 0.255
204 2HB LEU 23 HB1 LEU 23 7.043 -9.625 -0.733
205 HG LEU 23 HG LEU 23 8.415 -10.248 1.284
206 1HD1 LEU 23 HD12 LEU 23 7.924 -8.183 2.603
207 2HD1 LEU 23 HD11 LEU 23 6.239 -8.660 2.701
208 3HD1 LEU 23 HD13 LEU 23 7.477 -9.627 3.487
209 1HD2 LEU 23 HD21 LEU 23 6.464 -11.603 0.487
210 2HD2 LEU 23 HD23 LEU 23 6.596 -11.649 2.238
211 3HD2 LEU 23 HD22 LEU 23 5.391 -10.626 1.477
212 H GLU 24 HN GLU 24 8.423 -8.866 -2.348
213 HA GLU 24 HA GLU 24 10.687 -10.544 -2.032
214 1HB GLU 24 HB2 GLU 24 9.832 -9.103 -4.552
215 2HB GLU 24 HB1 GLU 24 10.764 -10.590 -4.493
216 1HG GLU 24 HG2 GLU 24 8.870 -11.856 -3.829
217 2HG GLU 24 HG1 GLU 24 7.946 -10.430 -3.372
218 H LYS 25 HN LYS 25 10.541 -7.524 -3.842
219 HA LYS 25 HA LYS 25 13.262 -7.261 -4.337
220 1HB LYS 25 HB2 LYS 25 11.282 -5.022 -3.734
221 2HB LYS 25 HB1 LYS 25 12.806 -4.838 -4.582
222 1HG LYS 25 HG2 LYS 25 10.565 -6.699 -5.550
223 2HG LYS 25 HG1 LYS 25 10.805 -5.073 -6.133
224 1HD LYS 25 HD2 LYS 25 12.491 -5.679 -7.475
225 2HD LYS 25 HD1 LYS 25 13.301 -6.609 -6.253
226 1HE LYS 25 HE2 LYS 25 10.938 -7.507 -7.992
227 2HE LYS 25 HE1 LYS 25 12.586 -8.110 -8.067
228 1HZ LYS 25 HZ1 LYS 25 11.722 -8.469 -5.458
229 2HZ LYS 25 HZ3 LYS 25 10.488 -9.054 -6.476
230 3HZ LYS 25 HZ2 LYS 25 12.067 -9.624 -6.625
231 H LEU 26 HN LEU 26 11.577 -5.958 -1.493
232 HA LEU 26 HA LEU 26 13.955 -4.813 -0.402
233 1HB LEU 26 HB2 LEU 26 11.349 -5.778 0.779
234 2HB LEU 26 HB1 LEU 26 12.673 -5.394 1.854
235 HG LEU 26 HG LEU 26 12.795 -3.103 1.074
236 1HD1 LEU 26 HD11 LEU 26 10.690 -3.803 -1.027
237 2HD1 LEU 26 HD13 LEU 26 11.362 -2.215 -0.726
238 3HD1 LEU 26 HD12 LEU 26 12.380 -3.478 -1.381
239 1HD2 LEU 26 HD22 LEU 26 9.882 -3.934 1.351
240 2HD2 LEU 26 HD21 LEU 26 10.978 -3.589 2.675
241 3HD2 LEU 26 HD23 LEU 26 10.492 -2.305 1.584
242 H ASN 27 HN ASN 27 12.567 -8.022 -0.273
243 HA ASN 27 HA ASN 27 14.392 -9.126 1.624
244 1HB ASN 27 HB2 ASN 27 12.276 -10.256 0.696
245 2HB ASN 27 HB1 ASN 27 13.238 -10.646 -0.731
246 1HD2 ASN 27 HD21 ASN 27 13.777 -12.710 2.682
247 2HD2 ASN 27 HD22 ASN 27 12.706 -11.403 2.610
248 H GLU 28 HN GLU 28 14.520 -8.777 -1.875
249 HA GLU 28 HA GLU 28 16.922 -10.238 -2.313
250 1HB GLU 28 HB2 GLU 28 15.935 -7.793 -3.818
251 2HB GLU 28 HB1 GLU 28 17.094 -8.959 -4.421
252 1HG GLU 28 HG2 GLU 28 15.428 -10.738 -4.408
253 2HG GLU 28 HG1 GLU 28 14.230 -9.680 -3.682
254 H LEU 29 HN LEU 29 16.226 -6.988 -1.413
255 HA LEU 29 HA LEU 29 19.064 -6.182 -1.448
256 1HB LEU 29 HB2 LEU 29 16.629 -4.697 -0.421
257 2HB LEU 29 HB1 LEU 29 18.177 -3.985 -0.825
258 HG LEU 29 HG LEU 29 16.536 -5.494 -2.918
259 1HD1 LEU 29 HD12 LEU 29 15.191 -3.601 -2.012
260 2HD1 LEU 29 HD11 LEU 29 16.524 -2.508 -2.351
261 3HD1 LEU 29 HD13 LEU 29 15.683 -3.322 -3.668
262 1HD2 LEU 29 HD22 LEU 29 18.745 -3.431 -3.100
263 2HD2 LEU 29 HD21 LEU 29 18.926 -5.147 -3.400
264 3HD2 LEU 29 HD23 LEU 29 17.938 -4.176 -4.472
265 H ASP 30 HN ASP 30 18.152 -8.311 0.187
266 HA ASP 30 HA ASP 30 18.062 -9.180 2.303
267 1HB ASP 30 HB2 ASP 30 20.070 -8.828 3.616
268 2HB ASP 30 HB1 ASP 30 20.557 -8.781 1.929
269 H ALA 31 HN ALA 31 16.768 -6.488 1.876
270 HA ALA 31 HA ALA 31 16.803 -5.380 4.575
271 1HB ALA 31 HB2 ALA 31 16.657 -3.842 2.606
272 2HB ALA 31 HB1 ALA 31 15.132 -4.593 2.149
273 3HB ALA 31 HB3 ALA 31 15.249 -3.683 3.648
274 H ASP 32 HN ASP 32 16.123 -7.846 4.822
275 HA ASP 32 HA ASP 32 13.406 -8.505 4.208
276 1HB ASP 32 HB2 ASP 32 15.159 -10.236 4.762
277 2HB ASP 32 HB1 ASP 32 15.065 -9.692 6.446
278 H GLU 33 HN GLU 33 14.942 -6.930 6.973
279 HA GLU 33 HA GLU 33 12.565 -7.240 8.598
280 1HB GLU 33 HB2 GLU 33 13.678 -4.800 9.408
281 2HB GLU 33 HB1 GLU 33 14.040 -6.350 10.134
282 1HG GLU 33 HG2 GLU 33 16.131 -5.283 9.635
283 2HG GLU 33 HG1 GLU 33 15.967 -6.547 8.427
284 H GLN 34 HN GLN 34 13.650 -5.052 6.099
285 HA GLN 34 HA GLN 34 11.406 -3.237 6.521
286 1HB GLN 34 HB2 GLN 34 13.000 -3.716 3.955
287 2HB GLN 34 HB1 GLN 34 11.914 -2.378 4.279
288 1HG GLN 34 HG2 GLN 34 14.353 -2.967 5.947
289 2HG GLN 34 HG1 GLN 34 14.315 -1.772 4.658
290 1HE2 GLN 34 HE21 GLN 34 13.000 -0.664 8.221
291 2HE2 GLN 34 HE22 GLN 34 14.099 -1.919 7.919
292 H ALA 35 HN ALA 35 12.063 -6.205 4.869
293 HA ALA 35 HA ALA 35 9.698 -6.147 3.223
294 1HB ALA 35 HB2 ALA 35 11.561 -7.812 2.812
295 2HB ALA 35 HB1 ALA 35 11.140 -8.616 4.318
296 3HB ALA 35 HB3 ALA 35 10.006 -8.598 2.994
297 H ASP 36 HN ASP 36 10.447 -7.025 6.537
298 HA ASP 36 HA ASP 36 7.986 -8.381 7.099
299 1HB ASP 36 HB2 ASP 36 9.572 -8.470 8.900
300 2HB ASP 36 HB1 ASP 36 9.773 -6.715 8.916
301 H ILE 37 HN ILE 37 9.017 -5.069 7.485
302 HA ILE 37 HA ILE 37 6.506 -4.042 8.308
303 HB ILE 37 HB ILE 37 8.642 -2.664 6.601
304 1HG1 ILE 37 HG12 ILE 37 8.317 -2.766 9.634
305 2HG1 ILE 37 HG11 ILE 37 9.501 -3.697 8.753
306 1HG2 ILE 37 HG22 ILE 37 6.470 -1.425 6.720
307 2HG2 ILE 37 HG21 ILE 37 6.535 -1.495 8.473
308 3HG2 ILE 37 HG23 ILE 37 7.723 -0.558 7.575
309 1HD1 ILE 37 HD2 ILE 37 10.518 -1.597 7.884
310 2HD1 ILE 37 HD1 ILE 37 9.371 -0.652 8.822
311 3HD1 ILE 37 HD3 ILE 37 10.541 -1.669 9.636
312 H CYS 38 HN CYS 38 7.836 -4.868 5.207
313 HA CYS 38 HA CYS 38 5.701 -3.642 3.686
314 1HB CYS 38 HB2 CYS 38 7.960 -4.197 2.743
315 2HB CYS 38 HB1 CYS 38 7.542 -5.888 2.851
316 HG CYS 38 HG1 CYS 38 6.163 -5.758 0.807
317 H GLU 39 HN GLU 39 6.100 -6.767 5.250
318 HA GLU 39 HA GLU 39 3.909 -7.932 3.735
319 1HB GLU 39 HB2 GLU 39 5.525 -9.473 4.779
320 2HB GLU 39 HB1 GLU 39 5.256 -8.748 6.354
321 1HG GLU 39 HG2 GLU 39 4.077 -10.964 5.968
322 2HG GLU 39 HG1 GLU 39 3.015 -9.660 6.476
323 H SER 40 HN SER 40 4.490 -6.375 6.805
324 HA SER 40 HA SER 40 1.838 -6.572 7.777
325 1HB SER 40 HB2 SER 40 3.914 -4.324 8.173
326 2HB SER 40 HB1 SER 40 2.570 -4.701 9.274
327 HG SER 40 HG1 SER 40 4.956 -6.011 8.973
328 H LEU 41 HN LEU 41 3.427 -4.530 5.441
329 HA LEU 41 HA LEU 41 1.178 -2.710 5.164
330 1HB LEU 41 HB2 LEU 41 3.644 -2.323 4.409
331 2HB LEU 41 HB1 LEU 41 3.257 -3.328 3.039
332 HG LEU 41 HG LEU 41 1.279 -1.754 2.551
333 1HD1 LEU 41 HD12 LEU 41 1.276 -0.635 4.797
334 2HD1 LEU 41 HD11 LEU 41 2.871 0.003 4.442
335 3HD1 LEU 41 HD13 LEU 41 1.488 0.521 3.494
336 1HD2 LEU 41 HD22 LEU 41 4.096 -0.615 2.387
337 2HD2 LEU 41 HD21 LEU 41 3.377 -1.711 1.218
338 3HD2 LEU 41 HD23 LEU 41 2.723 -0.101 1.419
339 H HIS 42 HN HIS 42 2.312 -5.631 3.773
340 HA HIS 42 HA HIS 42 0.656 -5.858 1.497
341 1HB HIS 42 HB2 HIS 42 2.644 -7.341 2.190
342 2HB HIS 42 HB1 HIS 42 1.542 -8.158 3.266
343 HD1 HIS 42 HD1 HIS 42 1.008 -7.383 -0.414
344 HD2 HIS 42 HD2 HIS 42 1.112 -10.550 2.178
345 HE1 HIS 42 HE1 HIS 42 0.398 -9.376 -1.709
346 H ASP 43 HN ASP 43 0.078 -7.370 4.726
347 HA ASP 43 HA ASP 43 -2.667 -7.892 3.822
348 1HB ASP 43 HB2 ASP 43 -1.397 -9.359 5.563
349 2HB ASP 43 HB1 ASP 43 -1.827 -8.082 6.710
350 H HIS 44 HN HIS 44 -1.106 -5.383 5.654
351 HA HIS 44 HA HIS 44 -3.511 -4.429 6.930
352 1HB HIS 44 HB2 HIS 44 -1.226 -3.580 7.521
353 2HB HIS 44 HB1 HIS 44 -1.102 -2.815 5.941
354 HD1 HIS 44 HD1 HIS 44 -4.032 -1.512 6.087
355 HD2 HIS 44 HD2 HIS 44 -1.211 -1.325 9.043
356 HE1 HIS 44 HE1 HIS 44 -4.575 0.452 7.447
357 H ALA 45 HN ALA 45 -2.001 -4.094 3.806
358 HA ALA 45 HA ALA 45 -3.853 -2.115 2.810
359 1HB ALA 45 HB2 ALA 45 -1.692 -2.677 1.585
360 2HB ALA 45 HB1 ALA 45 -2.358 -4.265 1.235
361 3HB ALA 45 HB3 ALA 45 -3.107 -2.833 0.549
362 H ASP 46 HN ASP 46 -3.669 -5.556 3.051
363 HA ASP 46 HA ASP 46 -6.019 -6.075 1.476
364 1HB ASP 46 HB2 ASP 46 -4.191 -7.731 2.290
365 2HB ASP 46 HB1 ASP 46 -5.174 -7.847 3.726
366 H GLU 47 HN GLU 47 -5.533 -5.022 4.769
367 HA GLU 47 HA GLU 47 -8.081 -5.955 5.714
368 1HB GLU 47 HB2 GLU 47 -6.421 -3.504 6.502
369 2HB GLU 47 HB1 GLU 47 -7.940 -3.878 7.268
370 1HG GLU 47 HG2 GLU 47 -5.756 -5.963 7.159
371 2HG GLU 47 HG1 GLU 47 -5.746 -4.719 8.406
372 H LEU 48 HN LEU 48 -6.890 -3.143 4.114
373 HA LEU 48 HA LEU 48 -9.356 -1.732 3.993
374 1HB LEU 48 HB2 LEU 48 -6.921 -0.971 3.246
375 2HB LEU 48 HB1 LEU 48 -7.335 -1.740 1.724
376 HG LEU 48 HG LEU 48 -9.406 -0.289 1.622
377 1HD1 LEU 48 HD11 LEU 48 -7.984 1.159 3.901
378 2HD1 LEU 48 HD13 LEU 48 -9.395 1.751 3.051
379 3HD1 LEU 48 HD12 LEU 48 -9.515 0.318 4.040
380 1HD2 LEU 48 HD21 LEU 48 -7.339 0.222 0.330
381 2HD2 LEU 48 HD23 LEU 48 -8.131 1.698 0.845
382 3HD2 LEU 48 HD22 LEU 48 -6.706 1.130 1.697
383 OH TYR 49 OH TYR 49 -10.583 -8.844 -4.173
384 H TYR 49 HN TYR 49 -7.860 -4.187 1.998
385 HA TYR 49 HA TYR 49 -9.813 -4.218 -0.063
386 1HB TYR 49 HB2 TYR 49 -7.562 -5.404 -0.133
387 2HB TYR 49 HB1 TYR 49 -8.221 -6.597 0.974
388 HD1 TYR 49 HD2 TYR 49 -9.545 -4.963 -2.130
389 HD2 TYR 49 HD1 TYR 49 -8.676 -8.582 -0.068
390 HE1 TYR 49 HE2 TYR 49 -10.439 -6.238 -3.998
391 HE2 TYR 49 HE1 TYR 49 -9.577 -9.865 -1.933
392 HH TYR 49 HH TYR 49 -11.034 -9.620 -3.829
393 NH1 ARG 50 NH1 ARG 50 -6.715 -8.444 5.309
394 NH2 ARG 50 NH2 ARG 50 -6.981 -8.584 7.586
395 H ARG 50 HN ARG 50 -9.676 -5.909 3.011
396 HA ARG 50 HA ARG 50 -11.972 -7.553 2.512
397 1HB ARG 50 HB2 ARG 50 -10.636 -6.657 5.102
398 2HB ARG 50 HB1 ARG 50 -11.940 -7.833 5.042
399 1HG ARG 50 HG2 ARG 50 -10.588 -9.269 3.535
400 2HG ARG 50 HG1 ARG 50 -9.285 -8.108 3.546
401 1HD ARG 50 HD2 ARG 50 -10.325 -9.577 6.024
402 2HD ARG 50 HD1 ARG 50 -8.860 -9.983 5.133
403 HE ARG 50 HE ARG 50 -9.190 -7.406 6.623
404 1HH1 ARG 50 HH12 ARG 50 -7.108 -8.298 4.398
405 2HH1 ARG 50 HH11 ARG 50 -5.727 -8.614 5.375
406 1HH2 ARG 50 HH22 ARG 50 -7.568 -8.530 8.398
407 2HH2 ARG 50 HH21 ARG 50 -6.003 -8.767 7.725
408 H SER 51 HN SER 51 -11.585 -4.776 4.665
409 HA SER 51 HA SER 51 -14.298 -4.398 5.218
410 1HB SER 51 HB2 SER 51 -12.171 -2.254 4.906
411 2HB SER 51 HB1 SER 51 -13.562 -2.241 6.023
412 HG SER 51 HG1 SER 51 -12.170 -3.263 7.283
413 H CYS 52 HN CYS 52 -12.394 -3.420 2.450
414 HA CYS 52 HA CYS 52 -14.402 -1.647 1.394
415 1HB CYS 52 HB2 CYS 52 -12.186 -3.225 0.076
416 2HB CYS 52 HB1 CYS 52 -13.293 -2.261 -0.853
417 HG CYS 52 HG1 CYS 52 -10.968 -1.181 0.837
418 H LEU 53 HN LEU 53 -13.629 -5.062 0.764
419 HA LEU 53 HA LEU 53 -15.634 -5.556 -1.113
420 1HB LEU 53 HB2 LEU 53 -14.023 -7.314 -0.437
421 2HB LEU 53 HB1 LEU 53 -14.710 -7.347 1.174
422 HG LEU 53 HG LEU 53 -16.876 -8.179 0.269
423 1HD1 LEU 53 HD11 LEU 53 -15.424 -8.271 -2.412
424 2HD1 LEU 53 HD13 LEU 53 -17.028 -8.897 -2.085
425 3HD1 LEU 53 HD12 LEU 53 -16.741 -7.172 -2.022
426 1HD2 LEU 53 HD22 LEU 53 -14.461 -9.794 -0.614
427 2HD2 LEU 53 HD21 LEU 53 -15.161 -9.786 0.999
428 3HD2 LEU 53 HD23 LEU 53 -16.080 -10.429 -0.352
429 H ALA 54 HN ALA 54 -15.914 -5.411 2.370
430 HA ALA 54 HA ALA 54 -18.537 -6.330 2.686
431 1HB ALA 54 HB2 ALA 54 -17.154 -5.568 4.623
432 2HB ALA 54 HB1 ALA 54 -17.350 -3.900 4.098
433 3HB ALA 54 HB3 ALA 54 -18.743 -4.817 4.628
434 NH1 ARG 55 NH1 ARG 55 -18.509 1.898 6.659
435 NH2 ARG 55 NH2 ARG 55 -19.054 3.425 5.005
436 H ARG 55 HN ARG 55 -17.676 -2.894 2.242
437 HA ARG 55 HA ARG 55 -20.471 -2.330 1.593
438 1HB ARG 55 HB2 ARG 55 -17.993 -0.582 1.409
439 2HB ARG 55 HB1 ARG 55 -19.610 -0.025 1.031
440 1HG ARG 55 HG2 ARG 55 -20.283 -0.868 3.362
441 2HG ARG 55 HG1 ARG 55 -18.562 -1.009 3.692
442 1HD ARG 55 HD2 ARG 55 -18.232 1.413 3.271
443 2HD ARG 55 HD1 ARG 55 -19.912 1.576 2.764
444 HE ARG 55 HE ARG 55 -20.330 0.691 5.230
445 1HH1 ARG 55 HH12 ARG 55 -18.563 0.953 7.000
446 2HH1 ARG 55 HH11 ARG 55 -18.035 2.583 7.220
447 1HH2 ARG 55 HH22 ARG 55 -19.483 3.634 4.121
448 2HH2 ARG 55 HH21 ARG 55 -18.628 4.195 5.490
449 H PHE 56 HN PHE 56 -17.470 -1.957 -0.134
450 HA PHE 56 HA PHE 56 -18.459 -1.272 -2.616
451 1HB PHE 56 HB2 PHE 56 -15.976 -2.915 -2.013
452 2HB PHE 56 HB1 PHE 56 -16.342 -2.194 -3.560
453 HD1 PHE 56 HD2 PHE 56 -17.620 0.126 -1.162
454 HD2 PHE 56 HD1 PHE 56 -13.955 -1.321 -2.818
455 HE1 PHE 56 HE2 PHE 56 -16.508 2.184 -0.532
456 HE2 PHE 56 HE1 PHE 56 -12.854 0.761 -2.176
457 HZ PHE 56 HZ PHE 56 -14.130 2.522 -1.041
458 H GLY 57 HN GLY 57 -19.017 -4.295 -1.255
459 1HA GLY 57 HA2 GLY 57 -18.894 -6.045 -3.455
460 2HA GLY 57 HA1 GLY 57 -20.238 -6.072 -2.276
461 H ASP 58 HN ASP 58 -21.090 -3.593 -2.506
462 HA ASP 58 HA ASP 58 -21.598 -2.008 -4.587
463 1HB ASP 58 HB2 ASP 58 -22.636 -4.321 -5.750
464 2HB ASP 58 HB1 ASP 58 -24.017 -3.825 -4.796
465 H ASP 59 HN ASP 59 -21.460 -1.274 -2.505
466 HA ASP 59 HA ASP 59 -22.790 -1.740 -0.214
467 1HB ASP 59 HB2 ASP 59 -21.220 0.158 -0.594
468 2HB ASP 59 HB1 ASP 59 -22.530 1.085 -1.296
469 H GLY 60 HN GLY 60 -24.576 -1.492 0.736
470 1HA GLY 60 HA2 GLY 60 -26.858 0.010 -0.199
471 2HA GLY 60 HA1 GLY 60 -27.067 -1.767 -0.381
472 H GLU 61 HN GLU 61 -25.730 -2.858 1.463
473 HA GLU 61 HA GLU 61 -27.003 -2.056 3.993
474 1HB GLU 61 HB2 GLU 61 -24.977 -4.313 3.603
475 2HB GLU 61 HB1 GLU 61 -26.277 -4.214 4.781
476 1HG GLU 61 HG2 GLU 61 -26.578 -4.646 1.778
477 2HG GLU 61 HG1 GLU 61 -27.006 -5.758 3.073
478 H ASN 62 HN ASN 62 -25.828 -0.024 3.774
479 HA ASN 62 HA ASN 62 -22.974 0.084 3.796
480 1HB ASN 62 HB2 ASN 62 -24.430 2.067 3.293
481 2HB ASN 62 HB1 ASN 62 -24.876 2.112 5.005
482 1HD2 ASN 62 HD21 ASN 62 -21.143 3.255 3.826
483 2HD2 ASN 62 HD22 ASN 62 -22.153 2.417 2.749
484 H LEU 63 HN LEU 63 -21.810 -0.885 5.207
485 HA LEU 63 HA LEU 63 -22.231 -0.299 8.079
486 1HB LEU 63 HB2 LEU 63 -21.585 -3.045 6.907
487 2HB LEU 63 HB1 LEU 63 -21.675 -2.667 8.616
488 HG LEU 63 HG LEU 63 -24.043 -2.383 6.703
489 1HD1 LEU 63 HD11 LEU 63 -23.406 -4.624 8.667
490 2HD1 LEU 63 HD13 LEU 63 -24.884 -4.477 7.725
491 3HD1 LEU 63 HD12 LEU 63 -23.352 -4.753 6.914
492 1HD2 LEU 63 HD22 LEU 63 -23.888 -2.415 9.751
493 2HD2 LEU 63 HD21 LEU 63 -24.166 -0.983 8.774
494 3HD2 LEU 63 HD23 LEU 63 -25.361 -2.265 8.800
495 1H MET 1 HT1 MET 1 22.840 -0.072 -5.417
496 2H MET 1 HT3 MET 1 24.123 -0.435 -4.370
497 3H MET 1 HT2 MET 1 23.776 1.174 -4.795
498 HA MET 1 HA MET 1 25.029 1.095 -6.564
499 1HB MET 1 HB2 MET 1 25.392 -1.878 -5.973
500 2HB MET 1 HB1 MET 1 26.385 -0.919 -7.055
501 1HG MET 1 HG2 MET 1 26.955 0.566 -5.089
502 2HG MET 1 HG1 MET 1 26.106 -0.550 -4.062
503 1HE MET 1 HE1 MET 1 28.937 -0.379 -6.743
504 2HE MET 1 HE3 MET 1 29.386 0.580 -5.310
505 3HE MET 1 HE2 MET 1 30.281 -0.869 -5.731
506 H THR 2 HN THR 2 22.768 -1.606 -6.172
507 HA THR 2 HA THR 2 22.576 -2.011 -9.019
508 HB THR 2 HB THR 2 20.723 -2.929 -6.726
509 HG1 THR 2 HG1 THR 2 22.410 -4.195 -6.231
510 1HG2 THR 2 HG21 THR 2 21.770 -4.355 -9.247
511 2HG2 THR 2 HG23 THR 2 20.560 -4.964 -8.131
512 3HG2 THR 2 HG22 THR 2 20.168 -3.631 -9.204
513 H LYS 3 HN LYS 3 20.329 -1.660 -10.011
514 HA LYS 3 HA LYS 3 19.514 1.111 -9.340
515 1HB LYS 3 HB2 LYS 3 18.447 -0.694 -11.547
516 2HB LYS 3 HB1 LYS 3 18.300 1.049 -11.455
517 1HG LYS 3 HG2 LYS 3 20.913 -0.510 -11.816
518 2HG LYS 3 HG1 LYS 3 20.083 0.418 -13.044
519 1HD LYS 3 HD2 LYS 3 20.430 2.508 -11.666
520 2HD LYS 3 HD1 LYS 3 21.283 1.550 -10.466
521 1HE LYS 3 HE2 LYS 3 22.873 2.657 -12.025
522 2HE LYS 3 HE1 LYS 3 23.009 0.906 -12.069
523 1HZ LYS 3 HZ1 LYS 3 21.100 1.711 -13.971
524 2HZ LYS 3 HZ3 LYS 3 22.496 2.649 -14.166
525 3HZ LYS 3 HZ2 LYS 3 22.604 0.959 -14.216
526 H GLN 4 HN GLN 4 18.451 -2.133 -9.472
527 HA GLN 4 HA GLN 4 15.742 -2.079 -9.019
528 1HB GLN 4 HB2 GLN 4 17.390 -4.109 -9.187
529 2HB GLN 4 HB1 GLN 4 17.571 -3.926 -7.454
530 1HG GLN 4 HG2 GLN 4 14.838 -4.250 -8.684
531 2HG GLN 4 HG1 GLN 4 15.830 -5.642 -8.295
532 1HE2 GLN 4 HE21 GLN 4 15.543 -5.174 -4.745
533 2HE2 GLN 4 HE22 GLN 4 16.564 -5.799 -5.939
534 H GLU 5 HN GLU 5 18.285 -1.675 -6.581
535 HA GLU 5 HA GLU 5 16.578 -1.599 -4.352
536 1HB GLU 5 HB2 GLU 5 18.522 -0.455 -3.261
537 2HB GLU 5 HB1 GLU 5 19.062 -1.719 -4.350
538 1HG GLU 5 HG2 GLU 5 19.257 0.057 -6.126
539 2HG GLU 5 HG1 GLU 5 19.083 1.236 -4.808
540 H LYS 6 HN LYS 6 17.583 1.069 -6.460
541 HA LYS 6 HA LYS 6 15.958 2.949 -4.943
542 1HB LYS 6 HB2 LYS 6 16.900 3.274 -7.825
543 2HB LYS 6 HB1 LYS 6 16.326 4.544 -6.767
544 1HG LYS 6 HG2 LYS 6 18.569 4.908 -6.388
545 2HG LYS 6 HG1 LYS 6 18.365 3.597 -5.239
546 1HD LYS 6 HD2 LYS 6 19.153 1.962 -6.938
547 2HD LYS 6 HD1 LYS 6 19.190 3.224 -8.143
548 1HE LYS 6 HE2 LYS 6 21.462 2.729 -7.130
549 2HE LYS 6 HE1 LYS 6 20.984 4.412 -7.004
550 1HZ LYS 6 HZ1 LYS 6 20.097 3.008 -4.705
551 2HZ LYS 6 HZ3 LYS 6 21.722 2.681 -5.019
552 3HZ LYS 6 HZ2 LYS 6 21.242 4.273 -4.858
553 H THR 7 HN THR 7 15.439 0.633 -7.446
554 HA THR 7 HA THR 7 13.106 1.891 -8.551
555 HB THR 7 HB THR 7 13.620 -1.148 -8.413
556 HG1 THR 7 HG1 THR 7 15.205 0.837 -9.278
557 1HG2 THR 7 HG22 THR 7 11.515 -0.249 -9.592
558 2HG2 THR 7 HG21 THR 7 12.573 0.688 -10.638
559 3HG2 THR 7 HG23 THR 7 12.627 -1.069 -10.676
560 H ALA 8 HN ALA 8 13.419 -0.857 -6.336
561 HA ALA 8 HA ALA 8 10.763 -1.042 -5.511
562 1HB ALA 8 HB2 ALA 8 12.516 -2.666 -4.837
563 2HB ALA 8 HB1 ALA 8 13.242 -1.452 -3.796
564 3HB ALA 8 HB3 ALA 8 11.644 -2.075 -3.430
565 H LEU 9 HN LEU 9 13.319 1.035 -4.363
566 HA LEU 9 HA LEU 9 11.949 2.118 -2.138
567 1HB LEU 9 HB2 LEU 9 14.392 2.502 -2.762
568 2HB LEU 9 HB1 LEU 9 13.843 3.580 -4.026
569 HG LEU 9 HG LEU 9 12.681 4.955 -2.270
570 1HD1 LEU 9 HD11 LEU 9 14.281 3.215 -0.350
571 2HD1 LEU 9 HD13 LEU 9 13.379 4.655 0.077
572 3HD1 LEU 9 HD12 LEU 9 12.530 3.232 -0.472
573 1HD2 LEU 9 HD21 LEU 9 14.872 5.606 -3.192
574 2HD2 LEU 9 HD23 LEU 9 14.759 6.029 -1.493
575 3HD2 LEU 9 HD22 LEU 9 15.680 4.615 -1.986
576 H ASN 10 HN ASN 10 12.228 3.421 -5.412
577 HA ASN 10 HA ASN 10 10.327 5.505 -5.005
578 1HB ASN 10 HB2 ASN 10 11.316 4.121 -7.505
579 2HB ASN 10 HB1 ASN 10 10.095 5.386 -7.578
580 1HD2 ASN 10 HD21 ASN 10 13.838 6.434 -6.175
581 2HD2 ASN 10 HD22 ASN 10 13.270 4.865 -5.893
582 H MET 11 HN MET 11 9.947 2.133 -5.685
583 HA MET 11 HA MET 11 7.234 2.395 -6.637
584 1HB MET 11 HB2 MET 11 8.758 0.051 -5.459
585 2HB MET 11 HB1 MET 11 7.080 -0.068 -5.941
586 1HG MET 11 HG2 MET 11 9.379 0.774 -7.724
587 2HG MET 11 HG1 MET 11 8.612 -0.789 -7.754
588 1HE MET 11 HE2 MET 11 6.234 -1.207 -8.275
589 2HE MET 11 HE1 MET 11 5.373 0.180 -7.566
590 3HE MET 11 HE3 MET 11 5.215 -0.202 -9.279
591 H ALA 12 HN ALA 12 8.744 1.899 -3.500
592 HA ALA 12 HA ALA 12 6.335 1.381 -2.061
593 1HB ALA 12 HB1 ALA 12 8.764 2.964 -1.089
594 2HB ALA 12 HB3 ALA 12 7.527 2.261 -0.067
595 3HB ALA 12 HB2 ALA 12 8.607 1.215 -0.980
596 NH1 ARG 13 NH2 ARG 13 10.598 8.209 -5.089
597 NH2 ARG 13 NH1 ARG 13 9.731 8.826 -7.142
598 H ARG 13 HN ARG 13 8.070 4.291 -2.861
599 HA ARG 13 HA ARG 13 6.276 6.150 -1.675
600 1HB ARG 13 HB2 ARG 13 8.490 6.792 -2.595
601 2HB ARG 13 HB1 ARG 13 7.910 6.453 -4.216
602 1HG ARG 13 HG2 ARG 13 6.133 8.274 -3.827
603 2HG ARG 13 HG1 ARG 13 6.936 8.619 -2.307
604 1HD ARG 13 HD2 ARG 13 7.712 10.090 -4.223
605 2HD ARG 13 HD1 ARG 13 9.029 9.181 -3.489
606 HE ARG 13 HE ARG 13 7.629 8.006 -5.835
607 1HH1 ARG 13 HH22 ARG 13 10.465 7.975 -4.123
608 2HH1 ARG 13 HH21 ARG 13 11.540 8.216 -5.436
609 1HH2 ARG 13 HH12 ARG 13 8.945 9.059 -7.720
610 2HH2 ARG 13 HH11 ARG 13 10.644 8.850 -7.563
611 H PHE 14 HN PHE 14 6.285 4.636 -4.848
612 HA PHE 14 HA PHE 14 4.131 6.155 -5.924
613 1HB PHE 14 HB2 PHE 14 5.668 4.494 -7.195
614 2HB PHE 14 HB1 PHE 14 4.601 3.234 -6.580
615 HD1 PHE 14 HD2 PHE 14 4.655 6.383 -8.542
616 HD2 PHE 14 HD1 PHE 14 2.436 2.893 -7.523
617 HE1 PHE 14 HE2 PHE 14 3.019 6.913 -10.289
618 HE2 PHE 14 HE1 PHE 14 0.802 3.428 -9.273
619 HZ PHE 14 HZ PHE 14 1.088 5.435 -10.658
620 H ILE 15 HN ILE 15 4.173 3.049 -4.276
621 HA ILE 15 HA ILE 15 1.408 2.544 -4.391
622 HB ILE 15 HB ILE 15 3.428 1.802 -2.216
623 1HG1 ILE 15 HG12 ILE 15 2.368 0.223 -4.606
624 2HG1 ILE 15 HG11 ILE 15 3.911 1.039 -4.632
625 1HG2 ILE 15 HG21 ILE 15 0.732 0.610 -2.924
626 2HG2 ILE 15 HG23 ILE 15 1.802 -0.022 -1.678
627 3HG2 ILE 15 HG22 ILE 15 1.052 1.541 -1.470
628 1HD1 ILE 15 HD2 ILE 15 4.645 -0.342 -2.680
629 2HD1 ILE 15 HD1 ILE 15 3.116 -1.211 -2.728
630 3HD1 ILE 15 HD3 ILE 15 4.229 -1.321 -4.074
631 NH1 ARG 16 NH2 ARG 16 3.807 9.445 3.888
632 NH2 ARG 16 NH1 ARG 16 1.624 9.082 4.557
633 H ARG 16 HN ARG 16 3.310 4.509 -2.145
634 HA ARG 16 HA ARG 16 1.194 4.934 -0.296
635 1HB ARG 16 HB2 ARG 16 3.510 5.779 0.194
636 2HB ARG 16 HB1 ARG 16 3.368 6.919 -1.139
637 1HG ARG 16 HG2 ARG 16 1.677 8.144 -0.117
638 2HG ARG 16 HG1 ARG 16 1.294 6.847 1.020
639 1HD ARG 16 HD2 ARG 16 3.349 7.237 2.198
640 2HD ARG 16 HD1 ARG 16 3.845 8.520 1.091
641 HE ARG 16 HE ARG 16 1.463 9.476 1.945
642 1HH1 ARG 16 HH22 ARG 16 4.509 9.519 3.176
643 2HH1 ARG 16 HH21 ARG 16 4.122 9.586 4.833
644 1HH2 ARG 16 HH12 ARG 16 0.657 8.880 4.361
645 2HH2 ARG 16 HH11 ARG 16 1.865 9.209 5.524
646 H SER 17 HN SER 17 2.181 6.778 -3.137
647 HA SER 17 HA SER 17 0.193 8.733 -3.119
648 1HB SER 17 HB2 SER 17 1.199 7.352 -5.642
649 2HB SER 17 HB1 SER 17 0.813 9.069 -5.404
650 HG SER 17 HG1 SER 17 3.060 7.696 -4.722
651 H GLN 18 HN GLN 18 0.026 5.461 -4.456
652 HA GLN 18 HA GLN 18 -2.567 5.704 -5.591
653 1HB GLN 18 HB2 GLN 18 -1.378 3.263 -4.242
654 2HB GLN 18 HB1 GLN 18 -2.723 3.262 -5.371
655 1HG GLN 18 HG2 GLN 18 -1.271 4.148 -7.151
656 2HG GLN 18 HG1 GLN 18 0.093 4.211 -6.042
657 1HE2 GLN 18 HE21 GLN 18 -0.887 0.370 -5.953
658 2HE2 GLN 18 HE22 GLN 18 -1.656 1.560 -5.037
659 H THR 19 HN THR 19 -1.541 4.575 -2.434
660 HA THR 19 HA THR 19 -4.059 4.050 -1.350
661 HB THR 19 HB THR 19 -1.607 5.164 0.116
662 HG1 THR 19 HG1 THR 19 -0.742 3.467 -0.810
663 1HG2 THR 19 HG21 THR 19 -3.683 3.029 0.849
664 2HG2 THR 19 HG23 THR 19 -2.365 3.607 1.862
665 3HG2 THR 19 HG22 THR 19 -3.712 4.663 1.490
666 H LEU 20 HN LEU 20 -2.426 7.118 -1.848
667 HA LEU 20 HA LEU 20 -4.126 8.627 -0.088
668 1HB LEU 20 HB2 LEU 20 -1.974 9.302 -1.693
669 2HB LEU 20 HB1 LEU 20 -3.299 9.916 -2.644
670 HG LEU 20 HG LEU 20 -2.913 10.616 0.289
671 1HD1 LEU 20 HD11 LEU 20 -2.324 12.235 -2.225
672 2HD1 LEU 20 HD13 LEU 20 -2.207 12.833 -0.575
673 3HD1 LEU 20 HD12 LEU 20 -1.119 11.574 -1.130
674 1HD2 LEU 20 HD22 LEU 20 -4.798 11.745 -1.831
675 2HD2 LEU 20 HD21 LEU 20 -5.281 10.761 -0.459
676 3HD2 LEU 20 HD23 LEU 20 -4.620 12.355 -0.193
677 H THR 21 HN THR 21 -4.115 8.079 -3.540
678 HA THR 21 HA THR 21 -6.510 9.292 -4.240
679 HB THR 21 HB THR 21 -5.617 6.654 -5.495
680 HG1 THR 21 HG1 THR 21 -3.692 7.566 -5.320
681 1HG2 THR 21 HG21 THR 21 -6.194 9.466 -6.612
682 2HG2 THR 21 HG23 THR 21 -5.970 8.005 -7.564
683 3HG2 THR 21 HG22 THR 21 -7.414 8.203 -6.580
684 H LEU 22 HN LEU 22 -6.022 6.085 -2.801
685 HA LEU 22 HA LEU 22 -8.840 5.420 -3.136
686 1HB LEU 22 HB2 LEU 22 -6.848 4.235 -1.178
687 2HB LEU 22 HB1 LEU 22 -8.415 3.567 -1.584
688 HG LEU 22 HG LEU 22 -6.029 3.871 -3.463
689 1HD1 LEU 22 HD12 LEU 22 -5.930 1.982 -1.866
690 2HD1 LEU 22 HD11 LEU 22 -7.511 1.435 -2.394
691 3HD1 LEU 22 HD13 LEU 22 -6.152 1.388 -3.505
692 1HD2 LEU 22 HD22 LEU 22 -8.826 2.804 -4.078
693 2HD2 LEU 22 HD21 LEU 22 -8.150 4.292 -4.727
694 3HD2 LEU 22 HD23 LEU 22 -7.452 2.755 -5.169
695 H LEU 23 HN LEU 23 -6.861 6.672 -0.536
696 HA LEU 23 HA LEU 23 -8.724 6.608 1.562
697 1HB LEU 23 HB2 LEU 23 -6.286 7.359 1.655
698 2HB LEU 23 HB1 LEU 23 -6.788 8.878 0.943
699 HG LEU 23 HG LEU 23 -8.113 7.910 3.478
700 1HD1 LEU 23 HD11 LEU 23 -5.513 9.492 3.242
701 2HD1 LEU 23 HD13 LEU 23 -6.399 9.185 4.726
702 3HD1 LEU 23 HD12 LEU 23 -5.658 7.855 3.857
703 1HD2 LEU 23 HD22 LEU 23 -7.466 10.685 2.368
704 2HD2 LEU 23 HD21 LEU 23 -9.050 9.940 2.294
705 3HD2 LEU 23 HD23 LEU 23 -8.360 10.356 3.842
706 H GLU 24 HN GLU 24 -8.101 9.035 -0.832
707 HA GLU 24 HA GLU 24 -10.148 10.858 -0.237
708 1HB GLU 24 HB2 GLU 24 -8.345 11.286 -1.857
709 2HB GLU 24 HB1 GLU 24 -8.908 9.982 -2.869
710 1HG GLU 24 HG2 GLU 24 -11.114 11.416 -3.064
711 2HG GLU 24 HG1 GLU 24 -10.132 12.710 -2.394
712 H LYS 25 HN LYS 25 -10.192 8.264 -2.655
713 HA LYS 25 HA LYS 25 -12.965 8.508 -3.198
714 1HB LYS 25 HB2 LYS 25 -10.934 6.359 -3.660
715 2HB LYS 25 HB1 LYS 25 -12.614 5.888 -3.719
716 1HG LYS 25 HG2 LYS 25 -12.286 6.421 -5.945
717 2HG LYS 25 HG1 LYS 25 -12.889 7.936 -5.353
718 1HD LYS 25 HD2 LYS 25 -9.929 7.340 -5.655
719 2HD LYS 25 HD1 LYS 25 -10.885 8.031 -6.940
720 1HE LYS 25 HE2 LYS 25 -10.280 9.306 -4.245
721 2HE LYS 25 HE1 LYS 25 -9.723 9.820 -5.808
722 1HZ LYS 25 HZ1 LYS 25 -12.550 9.809 -5.855
723 2HZ LYS 25 HZ3 LYS 25 -12.018 10.590 -4.473
724 3HZ LYS 25 HZ2 LYS 25 -11.461 11.116 -5.939
725 H LEU 26 HN LEU 26 -11.440 7.109 -0.445
726 HA LEU 26 HA LEU 26 -13.729 5.378 0.121
727 1HB LEU 26 HB2 LEU 26 -11.351 6.304 1.799
728 2HB LEU 26 HB1 LEU 26 -12.619 5.293 2.450
729 HG LEU 26 HG LEU 26 -11.196 4.493 -0.119
730 1HD1 LEU 26 HD11 LEU 26 -10.454 3.730 2.736
731 2HD1 LEU 26 HD13 LEU 26 -9.734 3.074 1.274
732 3HD1 LEU 26 HD12 LEU 26 -9.478 4.751 1.696
733 1HD2 LEU 26 HD21 LEU 26 -13.342 3.381 0.547
734 2HD2 LEU 26 HD23 LEU 26 -11.987 2.265 0.559
735 3HD2 LEU 26 HD22 LEU 26 -12.615 2.914 2.061
736 H ASN 27 HN ASN 27 -12.558 8.570 0.862
737 HA ASN 27 HA ASN 27 -14.543 9.158 2.855
738 1HB ASN 27 HB2 ASN 27 -13.260 11.077 0.852
739 2HB ASN 27 HB1 ASN 27 -14.139 11.556 2.293
740 1HD2 ASN 27 HD21 ASN 27 -11.470 10.135 4.443
741 2HD2 ASN 27 HD22 ASN 27 -13.138 9.953 4.317
742 H GLU 28 HN GLU 28 -14.352 9.405 -0.627
743 HA GLU 28 HA GLU 28 -16.895 10.625 -1.037
744 1HB GLU 28 HB2 GLU 28 -15.373 8.720 -2.847
745 2HB GLU 28 HB1 GLU 28 -16.656 9.796 -3.365
746 1HG GLU 28 HG2 GLU 28 -15.348 11.760 -2.639
747 2HG GLU 28 HG1 GLU 28 -14.037 10.721 -2.108
748 H LEU 29 HN LEU 29 -15.879 7.263 -0.932
749 HA LEU 29 HA LEU 29 -18.688 6.384 -1.201
750 1HB LEU 29 HB2 LEU 29 -16.141 4.769 -0.818
751 2HB LEU 29 HB1 LEU 29 -17.727 4.104 -1.179
752 HG LEU 29 HG LEU 29 -16.245 6.066 -2.997
753 1HD1 LEU 29 HD11 LEU 29 -16.616 3.056 -3.250
754 2HD1 LEU 29 HD13 LEU 29 -15.868 4.094 -4.457
755 3HD1 LEU 29 HD12 LEU 29 -15.101 3.875 -2.894
756 1HD2 LEU 29 HD22 LEU 29 -18.762 4.405 -3.445
757 2HD2 LEU 29 HD21 LEU 29 -18.722 6.151 -3.255
758 3HD2 LEU 29 HD23 LEU 29 -17.979 5.412 -4.655
759 H ASP 30 HN ASP 30 -18.180 7.904 0.903
760 HA ASP 30 HA ASP 30 -18.181 8.191 3.180
761 1HB ASP 30 HB2 ASP 30 -20.261 7.643 4.037
762 2HB ASP 30 HB1 ASP 30 -20.576 7.440 2.322
763 H ALA 31 HN ALA 31 -16.523 5.821 2.332
764 HA ALA 31 HA ALA 31 -16.668 4.189 4.787
765 1HB ALA 31 HB2 ALA 31 -16.226 3.053 2.592
766 2HB ALA 31 HB1 ALA 31 -14.761 4.014 2.414
767 3HB ALA 31 HB3 ALA 31 -14.885 2.829 3.709
768 H ASP 32 HN ASP 32 -16.253 6.559 5.580
769 HA ASP 32 HA ASP 32 -13.609 7.614 5.340
770 1HB ASP 32 HB2 ASP 32 -15.527 8.977 6.234
771 2HB ASP 32 HB1 ASP 32 -15.475 7.989 7.702
772 H GLU 33 HN GLU 33 -15.052 5.334 7.606
773 HA GLU 33 HA GLU 33 -12.802 5.395 9.384
774 1HB GLU 33 HB2 GLU 33 -13.595 3.220 10.233
775 2HB GLU 33 HB1 GLU 33 -14.984 4.248 9.964
776 1HG GLU 33 HG2 GLU 33 -14.059 2.043 8.096
777 2HG GLU 33 HG1 GLU 33 -15.409 1.939 9.214
778 H GLN 34 HN GLN 34 -13.481 3.764 6.351
779 HA GLN 34 HA GLN 34 -11.003 2.223 6.534
780 1HB GLN 34 HB2 GLN 34 -12.705 2.912 4.107
781 2HB GLN 34 HB1 GLN 34 -11.364 1.786 4.076
782 1HG GLN 34 HG2 GLN 34 -13.967 1.443 5.597
783 2HG GLN 34 HG1 GLN 34 -13.365 0.470 4.268
784 1HE2 GLN 34 HE21 GLN 34 -12.405 -0.680 7.892
785 2HE2 GLN 34 HE22 GLN 34 -13.782 0.212 7.453
786 H ALA 35 HN ALA 35 -11.951 5.385 5.563
787 HA ALA 35 HA ALA 35 -9.672 5.908 3.878
788 1HB ALA 35 HB2 ALA 35 -11.643 7.493 4.008
789 2HB ALA 35 HB1 ALA 35 -11.167 7.906 5.651
790 3HB ALA 35 HB3 ALA 35 -10.120 8.310 4.313
791 H ASP 36 HN ASP 36 -10.358 6.064 7.307
792 HA ASP 36 HA ASP 36 -7.889 7.236 8.146
793 1HB ASP 36 HB2 ASP 36 -9.517 6.994 9.883
794 2HB ASP 36 HB1 ASP 36 -9.737 5.274 9.548
795 H ILE 37 HN ILE 37 -8.927 3.918 8.062
796 HA ILE 37 HA ILE 37 -6.456 2.711 8.640
797 HB ILE 37 HB ILE 37 -8.742 1.745 6.846
798 1HG1 ILE 37 HG12 ILE 37 -8.124 1.275 9.807
799 2HG1 ILE 37 HG11 ILE 37 -9.315 2.415 9.233
800 1HG2 ILE 37 HG23 ILE 37 -6.681 0.374 6.520
801 2HG2 ILE 37 HG22 ILE 37 -6.600 0.104 8.256
802 3HG2 ILE 37 HG21 ILE 37 -7.929 -0.550 7.313
803 1HD1 ILE 37 HD2 ILE 37 -10.570 0.577 8.151
804 2HD1 ILE 37 HD1 ILE 37 -9.410 -0.598 8.761
805 3HD1 ILE 37 HD3 ILE 37 -10.401 0.321 9.878
806 H CYS 38 HN CYS 38 -7.690 4.126 5.724
807 HA CYS 38 HA CYS 38 -5.666 2.977 4.006
808 1HB CYS 38 HB2 CYS 38 -7.892 3.988 3.272
809 2HB CYS 38 HB1 CYS 38 -7.177 5.558 3.547
810 HG CYS 38 HG1 CYS 38 -6.653 3.768 1.134
811 H GLU 39 HN GLU 39 -5.924 5.984 5.900
812 HA GLU 39 HA GLU 39 -3.556 7.130 4.755
813 1HB GLU 39 HB2 GLU 39 -5.003 8.585 6.136
814 2HB GLU 39 HB1 GLU 39 -4.778 7.535 7.524
815 1HG GLU 39 HG2 GLU 39 -3.363 9.632 7.563
816 2HG GLU 39 HG1 GLU 39 -2.414 8.161 7.685
817 H SER 40 HN SER 40 -4.185 5.126 7.594
818 HA SER 40 HA SER 40 -1.551 5.049 8.545
819 1HB SER 40 HB2 SER 40 -3.557 2.717 8.399
820 2HB SER 40 HB1 SER 40 -2.274 2.919 9.614
821 HG SER 40 HG1 SER 40 -4.706 4.156 9.473
822 H LEU 41 HN LEU 41 -3.082 3.060 6.059
823 HA LEU 41 HA LEU 41 -0.729 1.572 5.444
824 1HB LEU 41 HB2 LEU 41 -3.171 1.198 4.676
825 2HB LEU 41 HB1 LEU 41 -2.845 2.386 3.440
826 HG LEU 41 HG LEU 41 -0.769 0.934 2.834
827 1HD1 LEU 41 HD12 LEU 41 -0.845 -0.478 4.890
828 2HD1 LEU 41 HD11 LEU 41 -2.413 -1.085 4.405
829 3HD1 LEU 41 HD13 LEU 41 -0.990 -1.455 3.443
830 1HD2 LEU 41 HD22 LEU 41 -3.588 -0.086 2.333
831 2HD2 LEU 41 HD21 LEU 41 -2.749 1.133 1.394
832 3HD2 LEU 41 HD23 LEU 41 -2.165 -0.515 1.392
833 H HIS 42 HN HIS 42 -1.977 4.595 4.380
834 HA HIS 42 HA HIS 42 -0.304 5.167 2.183
835 1HB HIS 42 HB2 HIS 42 -2.370 6.479 3.058
836 2HB HIS 42 HB1 HIS 42 -1.293 7.203 4.221
837 HD1 HIS 42 HD1 HIS 42 -0.862 6.974 0.460
838 HD2 HIS 42 HD2 HIS 42 -0.894 9.733 3.477
839 HE1 HIS 42 HE1 HIS 42 -0.331 9.139 -0.558
840 H ASP 43 HN ASP 43 0.174 6.258 5.602
841 HA ASP 43 HA ASP 43 2.886 7.064 4.927
842 1HB ASP 43 HB2 ASP 43 1.577 7.972 6.971
843 2HB ASP 43 HB1 ASP 43 1.986 6.436 7.739
844 H HIS 44 HN HIS 44 1.512 4.079 6.080
845 HA HIS 44 HA HIS 44 3.983 3.039 7.095
846 1HB HIS 44 HB2 HIS 44 1.688 1.582 5.731
847 2HB HIS 44 HB1 HIS 44 3.002 0.775 6.587
848 HD1 HIS 44 HD1 HIS 44 2.441 3.598 8.562
849 HD2 HIS 44 HD2 HIS 44 0.283 0.167 8.004
850 HE1 HIS 44 HE1 HIS 44 0.957 3.385 10.512
851 H ALA 45 HN ALA 45 2.632 3.346 3.885
852 HA ALA 45 HA ALA 45 4.656 1.714 2.620
853 1HB ALA 45 HB1 ALA 45 3.093 4.062 1.457
854 2HB ALA 45 HB3 ALA 45 3.989 2.877 0.517
855 3HB ALA 45 HB2 ALA 45 2.557 2.387 1.413
856 H ASP 46 HN ASP 46 4.331 5.036 3.569
857 HA ASP 46 HA ASP 46 6.742 5.970 2.287
858 1HB ASP 46 HB2 ASP 46 4.903 7.456 3.214
859 2HB ASP 46 HB1 ASP 46 5.480 7.083 4.816
860 H GLU 47 HN GLU 47 5.986 4.357 5.279
861 HA GLU 47 HA GLU 47 8.440 4.960 6.580
862 1HB GLU 47 HB2 GLU 47 6.468 3.788 7.714
863 2HB GLU 47 HB1 GLU 47 6.860 2.345 6.786
864 1HG GLU 47 HG2 GLU 47 7.813 2.188 9.044
865 2HG GLU 47 HG1 GLU 47 9.112 2.279 7.861
866 H LEU 48 HN LEU 48 7.459 2.526 4.271
867 HA LEU 48 HA LEU 48 10.001 1.163 4.315
868 1HB LEU 48 HB2 LEU 48 8.098 1.486 1.957
869 2HB LEU 48 HB1 LEU 48 9.351 0.276 2.089
870 HG LEU 48 HG LEU 48 6.928 0.506 3.941
871 1HD1 LEU 48 HD12 LEU 48 6.367 -0.282 1.648
872 2HD1 LEU 48 HD11 LEU 48 7.603 -1.525 1.772
873 3HD1 LEU 48 HD13 LEU 48 6.197 -1.578 2.821
874 1HD2 LEU 48 HD23 LEU 48 9.118 -1.617 3.784
875 2HD2 LEU 48 HD22 LEU 48 8.915 -0.471 5.101
876 3HD2 LEU 48 HD21 LEU 48 7.695 -1.691 4.806
877 OH TYR 49 OH TYR 49 12.066 8.817 -2.921
878 H TYR 49 HN TYR 49 8.654 3.892 2.581
879 HA TYR 49 HA TYR 49 10.862 4.274 0.820
880 1HB TYR 49 HB2 TYR 49 8.550 5.515 0.827
881 2HB TYR 49 HB1 TYR 49 9.304 6.547 2.034
882 HD1 TYR 49 HD2 TYR 49 10.141 5.085 -1.276
883 HD2 TYR 49 HD1 TYR 49 10.372 8.473 1.273
884 HE1 TYR 49 HE2 TYR 49 11.249 6.334 -3.057
885 HE2 TYR 49 HE1 TYR 49 11.482 9.737 -0.496
886 HH TYR 49 HH TYR 49 12.701 9.420 -2.521
887 NH1 ARG 50 NH1 ARG 50 7.016 7.774 6.577
888 NH2 ARG 50 NH2 ARG 50 7.214 6.761 8.630
889 H ARG 50 HN ARG 50 10.381 4.966 4.169
890 HA ARG 50 HA ARG 50 12.823 6.619 4.279
891 1HB ARG 50 HB2 ARG 50 10.865 5.734 6.438
892 2HB ARG 50 HB1 ARG 50 12.200 6.833 6.720
893 1HG ARG 50 HG2 ARG 50 11.244 8.442 5.098
894 2HG ARG 50 HG1 ARG 50 9.940 7.352 4.711
895 1HD ARG 50 HD2 ARG 50 10.448 8.695 7.408
896 2HD ARG 50 HD1 ARG 50 9.089 8.980 6.329
897 HE ARG 50 HE ARG 50 9.535 6.336 7.656
898 1HH1 ARG 50 HH12 ARG 50 7.431 8.119 5.733
899 2HH1 ARG 50 HH11 ARG 50 6.019 7.865 6.672
900 1HH2 ARG 50 HH22 ARG 50 7.787 6.338 9.339
901 2HH2 ARG 50 HH21 ARG 50 6.225 6.815 8.793
902 H SER 51 HN SER 51 11.746 4.049 6.454
903 HA SER 51 HA SER 51 14.266 3.285 7.285
904 1HB SER 51 HB2 SER 51 11.737 1.630 6.941
905 2HB SER 51 HB1 SER 51 13.125 1.179 7.961
906 HG SER 51 HG1 SER 51 11.202 3.039 8.405
907 H CYS 52 HN CYS 52 12.601 2.105 4.323
908 HA CYS 52 HA CYS 52 14.708 0.146 3.916
909 1HB CYS 52 HB2 CYS 52 13.088 1.377 1.683
910 2HB CYS 52 HB1 CYS 52 13.928 -0.136 1.705
911 HG CYS 52 HG1 CYS 52 12.019 -1.299 2.723
912 H LEU 53 HN LEU 53 14.223 3.526 3.038
913 HA LEU 53 HA LEU 53 16.331 3.622 1.126
914 1HB LEU 53 HB2 LEU 53 14.875 5.596 1.426
915 2HB LEU 53 HB1 LEU 53 15.374 5.756 3.096
916 HG LEU 53 HG LEU 53 17.658 6.351 2.424
917 1HD1 LEU 53 HD11 LEU 53 16.670 6.055 -0.447
918 2HD1 LEU 53 HD13 LEU 53 18.242 6.656 0.042
919 3HD1 LEU 53 HD12 LEU 53 17.825 4.981 0.324
920 1HD2 LEU 53 HD22 LEU 53 15.543 7.895 0.878
921 2HD2 LEU 53 HD21 LEU 53 15.960 8.139 2.566
922 3HD2 LEU 53 HD23 LEU 53 17.135 8.500 1.311
923 H ALA 54 HN ALA 54 16.216 3.669 4.622
924 HA ALA 54 HA ALA 54 19.021 4.287 4.945
925 1HB ALA 54 HB2 ALA 54 17.421 4.391 6.862
926 2HB ALA 54 HB1 ALA 54 17.245 2.636 6.782
927 3HB ALA 54 HB3 ALA 54 18.797 3.343 7.201
928 NH1 ARG 55 NH2 ARG 55 20.559 -4.463 6.120
929 NH2 ARG 55 NH1 ARG 55 18.648 -5.739 6.265
930 H ARG 55 HN ARG 55 17.164 1.312 4.722
931 HA ARG 55 HA ARG 55 19.467 -0.410 4.973
932 1HB ARG 55 HB2 ARG 55 16.690 -0.834 3.855
933 2HB ARG 55 HB1 ARG 55 17.892 -2.090 3.797
934 1HG ARG 55 HG2 ARG 55 17.099 -0.658 6.368
935 2HG ARG 55 HG1 ARG 55 16.298 -2.122 5.830
936 1HD ARG 55 HD2 ARG 55 19.284 -1.892 6.481
937 2HD ARG 55 HD1 ARG 55 18.063 -2.785 7.383
938 HE ARG 55 HE ARG 55 18.164 -3.645 4.627
939 1HH1 ARG 55 HH22 ARG 55 21.024 -3.601 5.908
940 2HH1 ARG 55 HH21 ARG 55 21.140 -5.214 6.451
941 1HH2 ARG 55 HH12 ARG 55 17.653 -5.815 6.174
942 2HH2 ARG 55 HH11 ARG 55 19.166 -6.540 6.574
943 H PHE 56 HN PHE 56 18.485 1.630 2.517
944 HA PHE 56 HA PHE 56 19.776 -0.117 0.482
945 1HB PHE 56 HB2 PHE 56 18.134 2.400 0.149
946 2HB PHE 56 HB1 PHE 56 18.883 1.508 -1.163
947 HD1 PHE 56 HD2 PHE 56 18.079 -1.237 0.695
948 HD2 PHE 56 HD1 PHE 56 16.064 2.009 -1.219
949 HE1 PHE 56 HE2 PHE 56 16.078 -2.588 0.501
950 HE2 PHE 56 HE1 PHE 56 14.050 0.626 -1.410
951 HZ PHE 56 HZ PHE 56 14.050 -1.676 -0.551
952 H GLY 57 HN GLY 57 19.791 3.386 1.258
953 1HA GLY 57 HA2 GLY 57 21.637 4.866 1.033
954 2HA GLY 57 HA1 GLY 57 22.682 3.410 1.241
955 H ASP 58 HN ASP 58 23.870 3.193 -0.658
956 HA ASP 58 HA ASP 58 22.256 3.012 -3.159
957 1HB ASP 58 HB2 ASP 58 23.836 5.211 -3.050
958 2HB ASP 58 HB1 ASP 58 25.115 4.024 -3.342
959 H ASP 59 HN ASP 59 22.665 1.284 -1.404
960 HA ASP 59 HA ASP 59 24.938 -0.437 -2.290
961 1HB ASP 59 HB2 ASP 59 23.395 -0.581 0.349
962 2HB ASP 59 HB1 ASP 59 24.752 -1.588 -0.124
963 H GLY 60 HN GLY 60 21.820 -0.399 -0.766
964 1HA GLY 60 HA2 GLY 60 19.769 -1.381 -1.435
965 2HA GLY 60 HA1 GLY 60 20.602 -2.061 -2.857
966 H GLU 61 HN GLU 61 22.143 -3.683 -2.508
967 HA GLU 61 HA GLU 61 21.248 -5.681 -0.566
968 1HB GLU 61 HB2 GLU 61 23.516 -5.728 -2.634
969 2HB GLU 61 HB1 GLU 61 22.764 -7.127 -1.879
970 1HG GLU 61 HG2 GLU 61 20.660 -6.708 -2.975
971 2HG GLU 61 HG1 GLU 61 21.152 -5.110 -3.525
972 H ASN 62 HN ASN 62 21.778 -4.206 1.131
973 HA ASN 62 HA ASN 62 24.652 -3.735 1.671
974 1HB ASN 62 HB2 ASN 62 23.902 -2.254 3.469
975 2HB ASN 62 HB1 ASN 62 22.936 -1.882 2.059
976 1HD2 ASN 62 HD21 ASN 62 20.215 -4.001 3.792
977 2HD2 ASN 62 HD22 ASN 62 21.214 -4.415 2.507
978 H LEU 63 HN LEU 63 23.624 -3.827 4.645
979 HA LEU 63 HA LEU 63 23.125 -6.632 5.081
980 1HB LEU 63 HB2 LEU 63 25.258 -7.022 6.341
981 2HB LEU 63 HB1 LEU 63 25.556 -6.765 4.637
982 HG LEU 63 HG LEU 63 25.798 -4.196 5.503
983 1HD1 LEU 63 HD11 LEU 63 26.708 -5.875 7.874
984 2HD1 LEU 63 HD13 LEU 63 26.983 -4.149 7.677
985 3HD1 LEU 63 HD12 LEU 63 25.357 -4.760 7.887
986 1HD2 LEU 63 HD22 LEU 63 27.976 -6.318 5.688
987 2HD2 LEU 63 HD21 LEU 63 27.493 -5.472 4.225
988 3HD2 LEU 63 HD23 LEU 63 28.253 -4.589 5.540
Start of MODEL 3
Raw file had 988 H/Q atoms
Start of MODEL 3
1 1H MET 1 HT1 MET 1 -22.912 -1.711 -3.592
2 2H MET 1 HT3 MET 1 -23.219 -2.971 -2.518
3 3H MET 1 HT2 MET 1 -21.908 -1.921 -2.246
4 HA MET 1 HA MET 1 -20.585 -3.236 -3.374
5 1HB MET 1 HB2 MET 1 -23.083 -4.720 -4.313
6 2HB MET 1 HB1 MET 1 -21.439 -5.290 -4.483
7 1HG MET 1 HG2 MET 1 -22.781 -4.699 -1.831
8 2HG MET 1 HG1 MET 1 -22.684 -6.278 -2.544
9 1HE MET 1 HE1 MET 1 -20.395 -7.358 -3.250
10 2HE MET 1 HE3 MET 1 -19.362 -7.644 -1.868
11 3HE MET 1 HE2 MET 1 -21.079 -7.976 -1.729
12 H THR 2 HN THR 2 -21.496 -0.823 -4.460
13 HA THR 2 HA THR 2 -22.505 -0.945 -7.061
14 HB THR 2 HB THR 2 -20.263 1.002 -6.302
15 HG1 THR 2 HG1 THR 2 -21.493 1.206 -4.506
16 1HG2 THR 2 HG22 THR 2 -21.650 1.227 -8.502
17 2HG2 THR 2 HG21 THR 2 -23.071 1.368 -7.487
18 3HG2 THR 2 HG23 THR 2 -21.811 2.589 -7.407
19 H LYS 3 HN LYS 3 -21.411 -0.909 -9.104
20 HA LYS 3 HA LYS 3 -19.461 -2.973 -9.385
21 1HB LYS 3 HB2 LYS 3 -19.708 -0.644 -11.319
22 2HB LYS 3 HB1 LYS 3 -19.253 -2.294 -11.693
23 1HG LYS 3 HG2 LYS 3 -21.567 -3.037 -11.045
24 2HG LYS 3 HG1 LYS 3 -22.026 -1.354 -10.822
25 1HD LYS 3 HD2 LYS 3 -21.263 -0.894 -13.194
26 2HD LYS 3 HD1 LYS 3 -21.108 -2.624 -13.427
27 1HE LYS 3 HE2 LYS 3 -23.646 -1.076 -12.719
28 2HE LYS 3 HE1 LYS 3 -23.330 -1.968 -14.196
29 1HZ LYS 3 HZ1 LYS 3 -22.995 -3.732 -12.051
30 2HZ LYS 3 HZ3 LYS 3 -24.456 -2.901 -11.823
31 3HZ LYS 3 HZ2 LYS 3 -24.176 -3.746 -13.266
32 H GLN 4 HN GLN 4 -19.387 0.440 -9.029
33 HA GLN 4 HA GLN 4 -16.620 0.913 -9.472
34 1HB GLN 4 HB2 GLN 4 -18.730 2.343 -7.817
35 2HB GLN 4 HB1 GLN 4 -17.076 2.918 -7.876
36 1HG GLN 4 HG2 GLN 4 -18.607 4.033 -9.546
37 2HG GLN 4 HG1 GLN 4 -17.213 3.264 -10.286
38 1HE2 GLN 4 HE21 GLN 4 -19.284 1.385 -12.398
39 2HE2 GLN 4 HE22 GLN 4 -17.825 2.210 -12.168
40 H GLU 5 HN GLU 5 -18.449 0.301 -6.506
41 HA GLU 5 HA GLU 5 -16.260 0.354 -4.738
42 1HB GLU 5 HB2 GLU 5 -18.749 -1.342 -4.670
43 2HB GLU 5 HB1 GLU 5 -17.638 -1.161 -3.332
44 1HG GLU 5 HG2 GLU 5 -17.984 1.286 -3.348
45 2HG GLU 5 HG1 GLU 5 -19.182 1.127 -4.623
46 H LYS 6 HN LYS 6 -17.562 -2.255 -6.678
47 HA LYS 6 HA LYS 6 -15.938 -4.323 -5.617
48 1HB LYS 6 HB2 LYS 6 -17.762 -4.776 -7.231
49 2HB LYS 6 HB1 LYS 6 -16.891 -3.907 -8.472
50 1HG LYS 6 HG2 LYS 6 -14.955 -5.749 -7.778
51 2HG LYS 6 HG1 LYS 6 -16.374 -6.601 -7.254
52 1HD LYS 6 HD2 LYS 6 -15.770 -7.232 -9.563
53 2HD LYS 6 HD1 LYS 6 -17.366 -6.523 -9.466
54 1HE LYS 6 HE2 LYS 6 -15.831 -5.668 -11.374
55 2HE LYS 6 HE1 LYS 6 -16.623 -4.426 -10.434
56 1HZ LYS 6 HZ1 LYS 6 -14.154 -5.076 -9.219
57 2HZ LYS 6 HZ3 LYS 6 -13.903 -4.780 -10.858
58 3HZ LYS 6 HZ2 LYS 6 -14.667 -3.618 -9.901
59 H THR 7 HN THR 7 -15.398 -1.966 -8.181
60 HA THR 7 HA THR 7 -12.805 -2.984 -8.849
61 HB THR 7 HB THR 7 -13.810 -0.117 -9.246
62 HG1 THR 7 HG1 THR 7 -15.436 -1.147 -10.110
63 1HG2 THR 7 HG22 THR 7 -11.506 -0.899 -10.208
64 2HG2 THR 7 HG21 THR 7 -12.380 -2.140 -11.090
65 3HG2 THR 7 HG23 THR 7 -12.671 -0.441 -11.438
66 H ALA 8 HN ALA 8 -13.883 -0.473 -6.578
67 HA ALA 8 HA ALA 8 -11.227 0.390 -5.920
68 1HB ALA 8 HB3 ALA 8 -13.722 0.405 -4.176
69 2HB ALA 8 HB2 ALA 8 -12.260 1.327 -3.861
70 3HB ALA 8 HB1 ALA 8 -13.252 1.706 -5.265
71 H LEU 9 HN LEU 9 -13.283 -2.149 -4.927
72 HA LEU 9 HA LEU 9 -11.837 -2.949 -2.589
73 1HB LEU 9 HB2 LEU 9 -14.235 -3.665 -3.309
74 2HB LEU 9 HB1 LEU 9 -13.459 -4.713 -4.480
75 HG LEU 9 HG LEU 9 -12.249 -5.845 -2.657
76 1HD1 LEU 9 HD11 LEU 9 -14.106 -4.248 -0.847
77 2HD1 LEU 9 HD13 LEU 9 -13.066 -5.566 -0.347
78 3HD1 LEU 9 HD12 LEU 9 -12.362 -4.068 -0.914
79 1HD2 LEU 9 HD22 LEU 9 -15.282 -5.837 -2.460
80 2HD2 LEU 9 HD21 LEU 9 -14.332 -6.788 -3.593
81 3HD2 LEU 9 HD23 LEU 9 -14.241 -7.123 -1.871
82 H ASN 10 HN ASN 10 -11.774 -3.663 -5.993
83 HA ASN 10 HA ASN 10 -9.720 -5.674 -5.825
84 1HB ASN 10 HB2 ASN 10 -10.355 -3.839 -8.187
85 2HB ASN 10 HB1 ASN 10 -9.408 -5.311 -8.253
86 1HD2 ASN 10 HD21 ASN 10 -12.608 -7.128 -7.220
87 2HD2 ASN 10 HD22 ASN 10 -11.199 -6.785 -6.347
88 H MET 11 HN MET 11 -9.741 -2.179 -6.120
89 HA MET 11 HA MET 11 -6.949 -1.946 -6.711
90 1HB MET 11 HB2 MET 11 -8.778 0.006 -5.252
91 2HB MET 11 HB1 MET 11 -7.143 0.373 -5.759
92 1HG MET 11 HG2 MET 11 -9.443 -0.399 -7.564
93 2HG MET 11 HG1 MET 11 -8.758 1.188 -7.408
94 1HE MET 11 HE3 MET 11 -6.743 1.967 -8.067
95 2HE MET 11 HE2 MET 11 -5.435 0.789 -7.858
96 3HE MET 11 HE1 MET 11 -5.836 1.429 -9.459
97 H ALA 12 HN ALA 12 -8.774 -2.124 -3.705
98 HA ALA 12 HA ALA 12 -6.563 -1.554 -1.990
99 1HB ALA 12 HB1 ALA 12 -8.885 -3.466 -1.467
100 2HB ALA 12 HB3 ALA 12 -7.808 -2.805 -0.250
101 3HB ALA 12 HB2 ALA 12 -8.902 -1.741 -1.125
102 NH1 ARG 13 NH1 ARG 13 -8.808 -10.023 -2.202
103 NH2 ARG 13 NH2 ARG 13 -8.677 -9.621 0.078
104 H ARG 13 HN ARG 13 -7.848 -4.524 -3.316
105 HA ARG 13 HA ARG 13 -5.846 -6.196 -2.127
106 1HB ARG 13 HB2 ARG 13 -8.048 -6.989 -3.139
107 2HB ARG 13 HB1 ARG 13 -7.411 -6.677 -4.721
108 1HG ARG 13 HG2 ARG 13 -7.181 -9.057 -4.220
109 2HG ARG 13 HG1 ARG 13 -5.594 -8.334 -4.288
110 1HD ARG 13 HD2 ARG 13 -6.043 -9.876 -2.246
111 2HD ARG 13 HD1 ARG 13 -5.346 -8.302 -1.903
112 HE ARG 13 HE ARG 13 -7.424 -7.601 -0.971
113 1HH1 ARG 13 HH12 ARG 13 -8.488 -9.817 -3.128
114 2HH1 ARG 13 HH11 ARG 13 -9.524 -10.719 -2.099
115 1HH2 ARG 13 HH22 ARG 13 -8.263 -9.110 0.841
116 2HH2 ARG 13 HH21 ARG 13 -9.379 -10.299 0.302
117 H PHE 14 HN PHE 14 -5.926 -4.108 -4.892
118 HA PHE 14 HA PHE 14 -3.665 -5.335 -6.209
119 1HB PHE 14 HB2 PHE 14 -5.143 -3.676 -7.415
120 2HB PHE 14 HB1 PHE 14 -4.525 -2.405 -6.363
121 HD1 PHE 14 HD2 PHE 14 -3.497 -4.928 -8.877
122 HD2 PHE 14 HD1 PHE 14 -2.384 -1.430 -6.717
123 HE1 PHE 14 HE2 PHE 14 -1.517 -4.682 -10.300
124 HE2 PHE 14 HE1 PHE 14 -0.396 -1.186 -8.150
125 HZ PHE 14 HZ PHE 14 0.038 -2.811 -9.941
126 H ILE 15 HN ILE 15 -4.124 -2.818 -3.781
127 HA ILE 15 HA ILE 15 -1.373 -2.030 -3.708
128 HB ILE 15 HB ILE 15 -3.311 -2.114 -1.350
129 1HG1 ILE 15 HG12 ILE 15 -4.443 -0.884 -3.105
130 2HG1 ILE 15 HG11 ILE 15 -3.855 0.251 -1.922
131 1HG2 ILE 15 HG21 ILE 15 -0.883 -0.371 -1.922
132 2HG2 ILE 15 HG23 ILE 15 -1.944 -0.186 -0.535
133 3HG2 ILE 15 HG22 ILE 15 -0.977 -1.637 -0.718
134 1HD1 ILE 15 HD1 ILE 15 -2.465 -0.380 -4.547
135 2HD1 ILE 15 HD3 ILE 15 -3.407 1.051 -4.206
136 3HD1 ILE 15 HD2 ILE 15 -1.903 0.781 -3.351
137 NH1 ARG 16 NH1 ARG 16 -2.598 -9.409 2.578
138 NH2 ARG 16 NH2 ARG 16 -4.866 -9.843 2.711
139 H ARG 16 HN ARG 16 -3.221 -4.543 -2.053
140 HA ARG 16 HA ARG 16 -1.146 -5.470 -0.369
141 1HB ARG 16 HB2 ARG 16 -3.358 -6.470 -0.121
142 2HB ARG 16 HB1 ARG 16 -3.371 -7.010 -1.795
143 1HG ARG 16 HG2 ARG 16 -1.482 -8.525 -1.338
144 2HG ARG 16 HG1 ARG 16 -1.441 -7.989 0.331
145 1HD ARG 16 HD2 ARG 16 -3.738 -9.439 -1.073
146 2HD ARG 16 HD1 ARG 16 -2.631 -10.158 0.079
147 HE ARG 16 HE ARG 16 -4.666 -8.092 0.771
148 1HH1 ARG 16 HH12 ARG 16 -1.819 -9.035 2.066
149 2HH1 ARG 16 HH11 ARG 16 -2.430 -9.817 3.482
150 1HH2 ARG 16 HH22 ARG 16 -5.782 -9.787 2.307
151 2HH2 ARG 16 HH21 ARG 16 -4.770 -10.274 3.614
152 H SER 17 HN SER 17 -2.001 -6.412 -3.647
153 HA SER 17 HA SER 17 0.193 -8.185 -4.005
154 1HB SER 17 HB2 SER 17 -1.370 -6.687 -6.140
155 2HB SER 17 HB1 SER 17 -0.593 -8.282 -6.278
156 HG SER 17 HG1 SER 17 -2.955 -7.619 -5.137
157 H GLN 18 HN GLN 18 -0.028 -4.714 -4.377
158 HA GLN 18 HA GLN 18 2.303 -4.518 -6.084
159 1HB GLN 18 HB2 GLN 18 0.439 -2.679 -5.399
160 2HB GLN 18 HB1 GLN 18 1.556 -2.364 -4.082
161 1HG GLN 18 HG2 GLN 18 2.433 -2.340 -6.984
162 2HG GLN 18 HG1 GLN 18 1.893 -0.902 -6.130
163 1HE2 GLN 18 HE21 GLN 18 4.825 -0.593 -4.166
164 2HE2 GLN 18 HE22 GLN 18 3.211 -0.116 -4.344
165 H THR 19 HN THR 19 1.568 -4.195 -2.683
166 HA THR 19 HA THR 19 4.167 -3.906 -1.705
167 HB THR 19 HB THR 19 1.790 -5.333 -0.391
168 HG1 THR 19 HG1 THR 19 0.960 -3.425 -0.747
169 1HG2 THR 19 HG21 THR 19 4.036 -3.577 0.724
170 2HG2 THR 19 HG23 THR 19 2.745 -4.332 1.649
171 3HG2 THR 19 HG22 THR 19 3.984 -5.322 0.908
172 H LEU 20 HN LEU 20 2.537 -6.738 -2.948
173 HA LEU 20 HA LEU 20 4.411 -8.563 -1.696
174 1HB LEU 20 HB2 LEU 20 2.164 -9.311 -2.592
175 2HB LEU 20 HB1 LEU 20 2.742 -8.974 -4.214
176 HG LEU 20 HG LEU 20 4.547 -10.649 -3.963
177 1HD1 LEU 20 HD11 LEU 20 3.274 -11.229 -1.243
178 2HD1 LEU 20 HD13 LEU 20 4.545 -12.173 -2.001
179 3HD1 LEU 20 HD12 LEU 20 4.869 -10.541 -1.481
180 1HD2 LEU 20 HD22 LEU 20 1.780 -11.707 -3.273
181 2HD2 LEU 20 HD21 LEU 20 2.366 -11.333 -4.887
182 3HD2 LEU 20 HD23 LEU 20 3.090 -12.646 -3.975
183 H THR 21 HN THR 21 4.023 -7.131 -4.899
184 HA THR 21 HA THR 21 6.302 -8.269 -6.090
185 HB THR 21 HB THR 21 5.302 -5.412 -6.602
186 HG1 THR 21 HG1 THR 21 3.438 -6.431 -6.670
187 1HG2 THR 21 HG21 THR 21 6.000 -7.779 -8.452
188 2HG2 THR 21 HG23 THR 21 5.653 -6.136 -8.971
189 3HG2 THR 21 HG22 THR 21 7.140 -6.489 -8.107
190 H LEU 22 HN LEU 22 5.891 -5.477 -4.019
191 HA LEU 22 HA LEU 22 8.594 -4.570 -4.245
192 1HB LEU 22 HB2 LEU 22 6.826 -3.108 -3.335
193 2HB LEU 22 HB1 LEU 22 6.537 -4.238 -2.024
194 HG LEU 22 HG LEU 22 8.673 -3.777 -1.007
195 1HD1 LEU 22 HD11 LEU 22 9.280 -2.042 -3.448
196 2HD1 LEU 22 HD13 LEU 22 10.290 -2.161 -2.019
197 3HD1 LEU 22 HD12 LEU 22 10.086 -3.548 -3.061
198 1HD2 LEU 22 HD21 LEU 22 6.878 -2.127 -0.579
199 2HD2 LEU 22 HD23 LEU 22 8.450 -1.344 -0.563
200 3HD2 LEU 22 HD22 LEU 22 7.398 -1.178 -1.961
201 H LEU 23 HN LEU 23 6.894 -6.581 -1.934
202 HA LEU 23 HA LEU 23 8.857 -7.196 -0.090
203 1HB LEU 23 HB2 LEU 23 6.454 -8.150 -0.198
204 2HB LEU 23 HB1 LEU 23 7.078 -9.319 -1.347
205 HG LEU 23 HG LEU 23 8.815 -9.962 0.425
206 1HD1 LEU 23 HD11 LEU 23 6.809 -8.479 2.172
207 2HD1 LEU 23 HD13 LEU 23 8.121 -9.478 2.757
208 3HD1 LEU 23 HD12 LEU 23 8.475 -7.982 1.906
209 1HD2 LEU 23 HD21 LEU 23 6.859 -11.365 -0.190
210 2HD2 LEU 23 HD23 LEU 23 7.190 -11.459 1.530
211 3HD2 LEU 23 HD22 LEU 23 5.862 -10.474 0.951
212 H GLU 24 HN GLU 24 8.256 -8.739 -3.158
213 HA GLU 24 HA GLU 24 10.331 -10.626 -3.159
214 1HB GLU 24 HB2 GLU 24 8.425 -10.317 -4.846
215 2HB GLU 24 HB1 GLU 24 9.356 -9.036 -5.583
216 1HG GLU 24 HG2 GLU 24 11.213 -10.717 -5.990
217 2HG GLU 24 HG1 GLU 24 10.101 -11.954 -5.404
218 H LYS 25 HN LYS 25 10.304 -7.435 -4.645
219 HA LYS 25 HA LYS 25 13.065 -7.330 -5.281
220 1HB LYS 25 HB2 LYS 25 11.218 -5.028 -4.563
221 2HB LYS 25 HB1 LYS 25 12.715 -4.895 -5.470
222 1HG LYS 25 HG2 LYS 25 10.397 -6.663 -6.411
223 2HG LYS 25 HG1 LYS 25 10.546 -4.985 -6.875
224 1HD LYS 25 HD2 LYS 25 12.028 -5.508 -8.469
225 2HD LYS 25 HD1 LYS 25 13.081 -6.307 -7.327
226 1HE LYS 25 HE2 LYS 25 10.601 -7.555 -8.654
227 2HE LYS 25 HE1 LYS 25 12.267 -7.889 -9.105
228 1HZ LYS 25 HZ1 LYS 25 12.094 -8.366 -6.387
229 2HZ LYS 25 HZ3 LYS 25 10.737 -9.098 -7.108
230 3HZ LYS 25 HZ2 LYS 25 12.276 -9.458 -7.651
231 H LEU 26 HN LEU 26 11.506 -6.808 -2.203
232 HA LEU 26 HA LEU 26 13.798 -5.372 -1.141
233 1HB LEU 26 HB2 LEU 26 11.552 -6.891 0.265
234 2HB LEU 26 HB1 LEU 26 12.761 -5.958 1.111
235 HG LEU 26 HG LEU 26 10.850 -4.798 -0.971
236 1HD1 LEU 26 HD11 LEU 26 10.844 -4.605 2.061
237 2HD1 LEU 26 HD13 LEU 26 9.741 -3.751 0.996
238 3HD1 LEU 26 HD12 LEU 26 9.680 -5.499 1.102
239 1HD2 LEU 26 HD22 LEU 26 12.767 -3.425 0.956
240 2HD2 LEU 26 HD21 LEU 26 12.984 -3.515 -0.783
241 3HD2 LEU 26 HD23 LEU 26 11.642 -2.615 -0.118
242 H ASN 27 HN ASN 27 12.747 -8.674 -1.421
243 HA ASN 27 HA ASN 27 14.775 -9.723 0.353
244 1HB ASN 27 HB2 ASN 27 13.288 -11.035 -1.968
245 2HB ASN 27 HB1 ASN 27 14.447 -11.884 -0.966
246 1HD2 ASN 27 HD21 ASN 27 11.227 -10.504 1.180
247 2HD2 ASN 27 HD22 ASN 27 12.051 -9.428 0.166
248 H GLU 28 HN GLU 28 14.536 -9.154 -3.094
249 HA GLU 28 HA GLU 28 17.059 -10.224 -3.821
250 1HB GLU 28 HB2 GLU 28 15.595 -7.900 -5.069
251 2HB GLU 28 HB1 GLU 28 16.840 -8.855 -5.851
252 1HG GLU 28 HG2 GLU 28 15.458 -10.878 -5.695
253 2HG GLU 28 HG1 GLU 28 14.179 -9.983 -4.882
254 H LEU 29 HN LEU 29 16.146 -6.950 -2.905
255 HA LEU 29 HA LEU 29 18.955 -6.119 -3.194
256 1HB LEU 29 HB2 LEU 29 16.585 -4.492 -2.271
257 2HB LEU 29 HB1 LEU 29 18.135 -3.877 -2.822
258 HG LEU 29 HG LEU 29 16.209 -5.498 -4.558
259 1HD1 LEU 29 HD12 LEU 29 15.400 -3.208 -4.049
260 2HD1 LEU 29 HD11 LEU 29 16.937 -2.566 -4.618
261 3HD1 LEU 29 HD13 LEU 29 15.846 -3.369 -5.739
262 1HD2 LEU 29 HD22 LEU 29 18.803 -4.087 -5.255
263 2HD2 LEU 29 HD21 LEU 29 18.594 -5.833 -5.192
264 3HD2 LEU 29 HD23 LEU 29 17.730 -4.901 -6.387
265 H ASP 30 HN ASP 30 18.228 -7.964 -1.007
266 HA ASP 30 HA ASP 30 18.644 -8.196 1.278
267 1HB ASP 30 HB2 ASP 30 20.991 -7.738 0.591
268 2HB ASP 30 HB1 ASP 30 20.682 -6.002 0.688
269 H ALA 31 HN ALA 31 16.528 -7.217 1.383
270 HA ALA 31 HA ALA 31 16.691 -4.914 3.243
271 1HB ALA 31 HB2 ALA 31 16.108 -3.982 0.973
272 2HB ALA 31 HB1 ALA 31 14.726 -5.065 0.911
273 3HB ALA 31 HB3 ALA 31 14.784 -3.783 2.110
274 H ASP 32 HN ASP 32 16.611 -7.328 3.982
275 HA ASP 32 HA ASP 32 14.114 -8.679 4.078
276 1HB ASP 32 HB2 ASP 32 15.117 -9.766 6.173
277 2HB ASP 32 HB1 ASP 32 16.057 -9.942 4.694
278 H GLU 33 HN GLU 33 15.570 -6.529 6.553
279 HA GLU 33 HA GLU 33 13.434 -6.678 8.386
280 1HB GLU 33 HB2 GLU 33 14.876 -4.124 7.620
281 2HB GLU 33 HB1 GLU 33 14.022 -4.400 9.116
282 1HG GLU 33 HG2 GLU 33 15.623 -5.887 9.938
283 2HG GLU 33 HG1 GLU 33 16.365 -6.152 8.372
284 H GLN 34 HN GLN 34 13.919 -4.724 5.624
285 HA GLN 34 HA GLN 34 11.556 -3.134 5.801
286 1HB GLN 34 HB2 GLN 34 13.114 -3.984 3.321
287 2HB GLN 34 HB1 GLN 34 11.896 -2.739 3.340
288 1HG GLN 34 HG2 GLN 34 14.145 -1.746 3.409
289 2HG GLN 34 HG1 GLN 34 13.264 -1.375 4.874
290 1HE2 GLN 34 HE21 GLN 34 16.057 -2.536 6.721
291 2HE2 GLN 34 HE22 GLN 34 14.969 -1.269 6.445
292 H ALA 35 HN ALA 35 12.261 -6.289 4.506
293 HA ALA 35 HA ALA 35 9.785 -6.598 3.097
294 1HB ALA 35 HB2 ALA 35 11.708 -8.186 2.767
295 2HB ALA 35 HB1 ALA 35 11.461 -8.794 4.401
296 3HB ALA 35 HB3 ALA 35 10.227 -9.032 3.192
297 H ASP 36 HN ASP 36 10.797 -7.572 6.381
298 HA ASP 36 HA ASP 36 8.387 -8.750 7.181
299 1HB ASP 36 HB2 ASP 36 10.249 -7.001 8.826
300 2HB ASP 36 HB1 ASP 36 8.907 -7.916 9.504
301 H ILE 37 HN ILE 37 9.315 -5.365 7.388
302 HA ILE 37 HA ILE 37 6.788 -4.514 8.464
303 HB ILE 37 HB ILE 37 8.643 -2.882 6.683
304 1HG1 ILE 37 HG12 ILE 37 9.969 -3.926 8.531
305 2HG1 ILE 37 HG11 ILE 37 9.834 -2.200 8.758
306 1HG2 ILE 37 HG21 ILE 37 6.706 -2.069 8.891
307 2HG2 ILE 37 HG23 ILE 37 7.753 -0.976 8.004
308 3HG2 ILE 37 HG22 ILE 37 6.472 -1.840 7.180
309 1HD1 ILE 37 HD2 ILE 37 7.997 -2.577 10.413
310 2HD1 ILE 37 HD1 ILE 37 8.148 -4.313 10.163
311 3HD1 ILE 37 HD3 ILE 37 9.470 -3.405 10.864
312 H CYS 38 HN CYS 38 8.031 -5.043 5.266
313 HA CYS 38 HA CYS 38 5.841 -3.835 3.878
314 1HB CYS 38 HB2 CYS 38 8.092 -4.531 2.863
315 2HB CYS 38 HB1 CYS 38 7.507 -6.172 2.919
316 HG CYS 38 HG1 CYS 38 6.151 -5.844 0.898
317 H GLU 39 HN GLU 39 6.247 -6.962 5.402
318 HA GLU 39 HA GLU 39 3.965 -8.096 4.027
319 1HB GLU 39 HB2 GLU 39 5.139 -8.829 6.760
320 2HB GLU 39 HB1 GLU 39 4.020 -9.810 5.833
321 1HG GLU 39 HG2 GLU 39 6.634 -9.015 4.577
322 2HG GLU 39 HG1 GLU 39 6.569 -10.368 5.691
323 H SER 40 HN SER 40 4.570 -6.386 7.008
324 HA SER 40 HA SER 40 1.915 -6.566 8.015
325 1HB SER 40 HB2 SER 40 3.852 -4.206 8.321
326 2HB SER 40 HB1 SER 40 2.667 -4.778 9.515
327 HG SER 40 HG1 SER 40 5.137 -5.764 8.925
328 H LEU 41 HN LEU 41 3.452 -4.538 5.657
329 HA LEU 41 HA LEU 41 1.181 -2.758 5.381
330 1HB LEU 41 HB2 LEU 41 3.608 -2.293 4.742
331 2HB LEU 41 HB1 LEU 41 3.371 -3.340 3.368
332 HG LEU 41 HG LEU 41 1.423 -1.861 2.654
333 1HD1 LEU 41 HD11 LEU 41 2.630 -0.039 4.768
334 2HD1 LEU 41 HD13 LEU 41 1.374 0.423 3.628
335 3HD1 LEU 41 HD12 LEU 41 1.046 -0.774 4.867
336 1HD2 LEU 41 HD22 LEU 41 4.180 -0.627 2.870
337 2HD2 LEU 41 HD21 LEU 41 3.640 -1.709 1.604
338 3HD2 LEU 41 HD23 LEU 41 2.934 -0.109 1.750
339 H HIS 42 HN HIS 42 2.377 -5.607 3.946
340 HA HIS 42 HA HIS 42 0.810 -5.854 1.628
341 1HB HIS 42 HB2 HIS 42 2.676 -7.418 2.345
342 2HB HIS 42 HB1 HIS 42 1.584 -8.115 3.505
343 HD1 HIS 42 HD1 HIS 42 1.597 -7.788 -0.271
344 HD2 HIS 42 HD2 HIS 42 0.155 -10.187 2.719
345 HE1 HIS 42 HE1 HIS 42 0.518 -9.705 -1.367
346 H ASP 43 HN ASP 43 0.123 -6.984 4.897
347 HA ASP 43 HA ASP 43 -2.620 -7.666 4.007
348 1HB ASP 43 HB2 ASP 43 -1.329 -9.056 5.755
349 2HB ASP 43 HB1 ASP 43 -1.677 -7.728 6.871
350 H HIS 44 HN HIS 44 -1.075 -5.093 5.788
351 HA HIS 44 HA HIS 44 -3.601 -4.135 6.851
352 1HB HIS 44 HB2 HIS 44 -1.333 -3.373 7.728
353 2HB HIS 44 HB1 HIS 44 -1.125 -2.493 6.211
354 HD1 HIS 44 HD1 HIS 44 -4.439 -2.562 7.983
355 HD2 HIS 44 HD2 HIS 44 -1.335 0.050 7.375
356 HE1 HIS 44 HE1 HIS 44 -5.203 -0.371 8.764
357 H ALA 45 HN ALA 45 -2.063 -4.149 3.804
358 HA ALA 45 HA ALA 45 -3.462 -1.817 2.757
359 1HB ALA 45 HB1 ALA 45 -2.366 -4.249 1.274
360 2HB ALA 45 HB3 ALA 45 -2.841 -2.727 0.539
361 3HB ALA 45 HB2 ALA 45 -1.433 -2.786 1.589
362 H ASP 46 HN ASP 46 -3.945 -5.135 3.300
363 HA ASP 46 HA ASP 46 -6.355 -5.402 1.708
364 1HB ASP 46 HB2 ASP 46 -4.741 -7.217 2.586
365 2HB ASP 46 HB1 ASP 46 -5.690 -7.123 4.062
366 H GLU 47 HN GLU 47 -5.613 -3.851 4.537
367 HA GLU 47 HA GLU 47 -7.981 -4.408 6.071
368 1HB GLU 47 HB2 GLU 47 -5.727 -2.934 6.524
369 2HB GLU 47 HB1 GLU 47 -6.793 -1.649 6.039
370 1HG GLU 47 HG2 GLU 47 -6.985 -1.805 8.442
371 2HG GLU 47 HG1 GLU 47 -8.431 -2.602 7.820
372 H LEU 48 HN LEU 48 -6.961 -2.236 3.530
373 HA LEU 48 HA LEU 48 -9.508 -0.864 3.335
374 1HB LEU 48 HB2 LEU 48 -7.333 -1.162 1.234
375 2HB LEU 48 HB1 LEU 48 -8.633 0.012 1.197
376 HG LEU 48 HG LEU 48 -6.498 -0.137 3.381
377 1HD1 LEU 48 HD12 LEU 48 -5.603 0.578 1.173
378 2HD1 LEU 48 HD11 LEU 48 -6.841 1.818 1.068
379 3HD1 LEU 48 HD13 LEU 48 -5.604 1.907 2.312
380 1HD2 LEU 48 HD22 LEU 48 -8.660 1.948 2.806
381 2HD2 LEU 48 HD21 LEU 48 -8.682 0.827 4.157
382 3HD2 LEU 48 HD23 LEU 48 -7.442 2.046 4.061
383 OH TYR 49 OH TYR 49 -11.902 -9.103 -2.887
384 H TYR 49 HN TYR 49 -8.909 -3.957 2.845
385 HA TYR 49 HA TYR 49 -10.621 -4.159 0.417
386 1HB TYR 49 HB2 TYR 49 -8.408 -5.488 0.562
387 2HB TYR 49 HB1 TYR 49 -9.162 -6.416 1.850
388 HD1 TYR 49 HD1 TYR 49 -11.160 -7.830 1.392
389 HD2 TYR 49 HD2 TYR 49 -9.100 -5.768 -1.699
390 HE1 TYR 49 HE1 TYR 49 -12.253 -9.239 -0.278
391 HE2 TYR 49 HE2 TYR 49 -10.184 -7.171 -3.376
392 HH TYR 49 HH TYR 49 -12.851 -8.953 -2.843
393 NH1 ARG 50 NH1 ARG 50 -6.445 -6.724 7.167
394 NH2 ARG 50 NH2 ARG 50 -6.557 -8.554 5.760
395 H ARG 50 HN ARG 50 -10.062 -5.676 3.546
396 HA ARG 50 HA ARG 50 -12.677 -6.803 3.708
397 1HB ARG 50 HB2 ARG 50 -12.038 -7.286 6.053
398 2HB ARG 50 HB1 ARG 50 -10.713 -7.662 4.964
399 1HG ARG 50 HG2 ARG 50 -9.948 -5.183 5.530
400 2HG ARG 50 HG1 ARG 50 -10.973 -5.401 6.937
401 1HD ARG 50 HD2 ARG 50 -8.831 -6.137 7.642
402 2HD ARG 50 HD1 ARG 50 -9.684 -7.628 7.311
403 HE ARG 50 HE ARG 50 -8.471 -7.056 4.894
404 1HH1 ARG 50 HH12 ARG 50 -6.853 -5.892 7.557
405 2HH1 ARG 50 HH11 ARG 50 -5.527 -6.977 7.491
406 1HH2 ARG 50 HH22 ARG 50 -7.053 -9.078 5.064
407 2HH2 ARG 50 HH21 ARG 50 -5.656 -8.887 6.055
408 H SER 51 HN SER 51 -11.312 -3.936 5.372
409 HA SER 51 HA SER 51 -13.741 -3.228 6.624
410 1HB SER 51 HB2 SER 51 -11.531 -1.336 5.709
411 2HB SER 51 HB1 SER 51 -12.552 -1.216 7.157
412 HG SER 51 HG1 SER 51 -11.127 -2.435 8.045
413 H CYS 52 HN CYS 52 -12.456 -2.391 3.406
414 HA CYS 52 HA CYS 52 -14.663 -0.564 2.902
415 1HB CYS 52 HB2 CYS 52 -12.929 -2.103 0.939
416 2HB CYS 52 HB1 CYS 52 -14.073 -0.865 0.516
417 HG CYS 52 HG1 CYS 52 -12.477 0.928 1.148
418 H LEU 53 HN LEU 53 -14.156 -3.996 2.483
419 HA LEU 53 HA LEU 53 -16.511 -4.407 0.893
420 1HB LEU 53 HB2 LEU 53 -14.716 -6.191 1.294
421 2HB LEU 53 HB1 LEU 53 -15.235 -6.264 2.965
422 HG LEU 53 HG LEU 53 -17.501 -7.017 2.246
423 1HD1 LEU 53 HD11 LEU 53 -16.251 -7.117 -0.533
424 2HD1 LEU 53 HD13 LEU 53 -17.834 -7.739 -0.096
425 3HD1 LEU 53 HD12 LEU 53 -17.533 -6.017 -0.046
426 1HD2 LEU 53 HD22 LEU 53 -15.199 -8.689 1.181
427 2HD2 LEU 53 HD21 LEU 53 -15.768 -8.664 2.842
428 3HD2 LEU 53 HD23 LEU 53 -16.802 -9.287 1.573
429 H ALA 54 HN ALA 54 -15.923 -3.804 4.238
430 HA ALA 54 HA ALA 54 -18.482 -4.724 5.144
431 1HB ALA 54 HB2 ALA 54 -16.679 -4.041 6.758
432 2HB ALA 54 HB1 ALA 54 -16.898 -2.368 6.264
433 3HB ALA 54 HB3 ALA 54 -18.201 -3.214 7.062
434 NH1 ARG 55 NH2 ARG 55 -20.814 4.241 1.613
435 NH2 ARG 55 NH1 ARG 55 -21.214 2.727 -0.067
436 H ARG 55 HN ARG 55 -17.434 -1.378 4.359
437 HA ARG 55 HA ARG 55 -20.178 -0.497 4.504
438 1HB ARG 55 HB2 ARG 55 -19.360 1.659 3.960
439 2HB ARG 55 HB1 ARG 55 -17.952 0.905 4.658
440 1HG ARG 55 HG2 ARG 55 -16.821 1.481 2.854
441 2HG ARG 55 HG1 ARG 55 -17.683 0.282 1.931
442 1HD ARG 55 HD2 ARG 55 -18.266 3.274 2.227
443 2HD ARG 55 HD1 ARG 55 -18.121 2.358 0.745
444 HE ARG 55 HE ARG 55 -20.394 1.379 2.143
445 1HH1 ARG 55 HH22 ARG 55 -20.408 4.510 2.494
446 2HH1 ARG 55 HH21 ARG 55 -21.354 4.940 1.129
447 1HH2 ARG 55 HH12 ARG 55 -21.100 1.822 -0.479
448 2HH2 ARG 55 HH11 ARG 55 -21.774 3.382 -0.584
449 H PHE 56 HN PHE 56 -18.248 -1.831 1.936
450 HA PHE 56 HA PHE 56 -20.024 -0.976 -0.195
451 1HB PHE 56 HB2 PHE 56 -18.118 -3.362 -0.048
452 2HB PHE 56 HB1 PHE 56 -18.943 -2.840 -1.505
453 HD1 PHE 56 HD2 PHE 56 -18.397 0.253 -0.213
454 HD2 PHE 56 HD1 PHE 56 -16.071 -3.050 -1.609
455 HE1 PHE 56 HE2 PHE 56 -16.568 1.760 -0.726
456 HE2 PHE 56 HE1 PHE 56 -14.229 -1.511 -2.125
457 HZ PHE 56 HZ PHE 56 -14.482 0.913 -1.671
458 H GLY 57 HN GLY 57 -19.803 -3.455 2.147
459 1HA GLY 57 HA2 GLY 57 -21.830 -5.181 1.063
460 2HA GLY 57 HA1 GLY 57 -21.364 -5.092 2.780
461 H ASP 58 HN ASP 58 -21.885 -2.669 3.582
462 HA ASP 58 HA ASP 58 -24.812 -2.477 3.415
463 1HB ASP 58 HB2 ASP 58 -22.876 -0.769 5.016
464 2HB ASP 58 HB1 ASP 58 -24.622 -0.864 5.230
465 H ASP 59 HN ASP 59 -23.759 -1.896 1.022
466 HA ASP 59 HA ASP 59 -23.756 1.087 0.821
467 1HB ASP 59 HB2 ASP 59 -21.806 0.145 -0.229
468 2HB ASP 59 HB1 ASP 59 -22.799 -1.095 -0.976
469 H GLY 60 HN GLY 60 -25.069 2.007 -0.821
470 1HA GLY 60 HA2 GLY 60 -27.524 0.404 -1.305
471 2HA GLY 60 HA1 GLY 60 -27.393 2.167 -1.433
472 H GLU 61 HN GLU 61 -25.171 -0.235 -2.679
473 HA GLU 61 HA GLU 61 -24.253 -0.480 -4.804
474 1HB GLU 61 HB2 GLU 61 -27.172 -0.228 -5.627
475 2HB GLU 61 HB1 GLU 61 -25.904 -1.080 -6.493
476 1HG GLU 61 HG2 GLU 61 -26.979 -1.817 -3.730
477 2HG GLU 61 HG1 GLU 61 -27.211 -2.725 -5.221
478 H ASN 62 HN ASN 62 -23.986 2.063 -3.939
479 HA ASN 62 HA ASN 62 -24.054 3.415 -6.539
480 1HB ASN 62 HB2 ASN 62 -26.288 3.974 -5.390
481 2HB ASN 62 HB1 ASN 62 -25.335 4.813 -4.158
482 1HD2 ASN 62 HD21 ASN 62 -24.956 6.280 -7.989
483 2HD2 ASN 62 HD22 ASN 62 -24.989 4.604 -7.748
484 H LEU 63 HN LEU 63 -23.652 4.152 -3.094
485 HA LEU 63 HA LEU 63 -20.866 4.432 -3.132
486 1HB LEU 63 HB2 LEU 63 -20.738 6.974 -2.995
487 2HB LEU 63 HB1 LEU 63 -21.036 6.366 -4.599
488 HG LEU 63 HG LEU 63 -23.596 6.729 -3.931
489 1HD1 LEU 63 HD11 LEU 63 -22.213 8.691 -2.068
490 2HD1 LEU 63 HD13 LEU 63 -23.928 8.674 -2.448
491 3HD1 LEU 63 HD12 LEU 63 -23.218 7.355 -1.554
492 1HD2 LEU 63 HD22 LEU 63 -21.712 9.030 -4.567
493 2HD2 LEU 63 HD21 LEU 63 -22.406 7.917 -5.739
494 3HD2 LEU 63 HD23 LEU 63 -23.449 9.023 -4.859
495 1H MET 1 HT1 MET 1 21.212 -3.121 -6.877
496 2H MET 1 HT3 MET 1 21.759 -4.529 -6.101
497 3H MET 1 HT2 MET 1 21.104 -3.242 -5.200
498 HA MET 1 HA MET 1 23.037 -2.287 -4.987
499 1HB MET 1 HB2 MET 1 23.990 -4.626 -6.685
500 2HB MET 1 HB1 MET 1 25.071 -3.478 -5.902
501 1HG MET 1 HG2 MET 1 24.710 -5.464 -4.485
502 2HG MET 1 HG1 MET 1 24.176 -3.997 -3.715
503 1HE MET 1 HE2 MET 1 23.767 -7.052 -2.987
504 2HE MET 1 HE1 MET 1 22.164 -7.686 -3.262
505 3HE MET 1 HE3 MET 1 23.303 -7.644 -4.602
506 H THR 2 HN THR 2 21.416 -1.174 -6.856
507 HA THR 2 HA THR 2 23.115 0.485 -8.338
508 HB THR 2 HB THR 2 23.413 -1.634 -9.809
509 HG1 THR 2 HG1 THR 2 23.463 -0.338 -11.367
510 1HG2 THR 2 HG22 THR 2 21.127 -2.602 -9.426
511 2HG2 THR 2 HG21 THR 2 20.421 -1.314 -10.386
512 3HG2 THR 2 HG23 THR 2 21.527 -2.451 -11.123
513 H LYS 3 HN LYS 3 20.903 0.639 -10.399
514 HA LYS 3 HA LYS 3 19.245 2.452 -8.890
515 1HB LYS 3 HB2 LYS 3 18.465 1.334 -11.585
516 2HB LYS 3 HB1 LYS 3 18.171 2.941 -10.955
517 1HG LYS 3 HG2 LYS 3 20.864 1.797 -11.827
518 2HG LYS 3 HG1 LYS 3 19.956 3.061 -12.600
519 1HD LYS 3 HD2 LYS 3 20.288 4.620 -10.821
520 2HD LYS 3 HD1 LYS 3 20.985 3.416 -9.754
521 1HE LYS 3 HE2 LYS 3 22.174 4.330 -12.407
522 2HE LYS 3 HE1 LYS 3 22.774 4.753 -10.808
523 1HZ LYS 3 HZ1 LYS 3 22.579 1.954 -10.958
524 2HZ LYS 3 HZ3 LYS 3 23.379 2.510 -12.346
525 3HZ LYS 3 HZ2 LYS 3 23.960 2.922 -10.807
526 H GLN 4 HN GLN 4 19.150 -0.842 -8.867
527 HA GLN 4 HA GLN 4 16.329 -1.327 -9.135
528 1HB GLN 4 HB2 GLN 4 18.218 -2.787 -7.231
529 2HB GLN 4 HB1 GLN 4 16.702 -3.368 -7.846
530 1HG GLN 4 HG2 GLN 4 17.555 -3.812 -9.968
531 2HG GLN 4 HG1 GLN 4 18.924 -2.725 -9.774
532 1HE2 GLN 4 HE21 GLN 4 19.140 -6.543 -8.371
533 2HE2 GLN 4 HE22 GLN 4 17.750 -5.969 -9.147
534 H GLU 5 HN GLU 5 18.467 -0.507 -6.518
535 HA GLU 5 HA GLU 5 16.619 -0.543 -4.386
536 1HB GLU 5 HB2 GLU 5 19.067 1.191 -4.838
537 2HB GLU 5 HB1 GLU 5 18.172 1.130 -3.338
538 1HG GLU 5 HG2 GLU 5 19.852 -0.440 -2.923
539 2HG GLU 5 HG1 GLU 5 18.610 -1.496 -3.579
540 H LYS 6 HN LYS 6 17.508 1.980 -6.620
541 HA LYS 6 HA LYS 6 15.892 3.993 -5.416
542 1HB LYS 6 HB2 LYS 6 17.414 4.716 -7.109
543 2HB LYS 6 HB1 LYS 6 16.900 3.526 -8.263
544 1HG LYS 6 HG2 LYS 6 14.554 4.957 -8.082
545 2HG LYS 6 HG1 LYS 6 15.638 6.167 -7.444
546 1HD LYS 6 HD2 LYS 6 15.814 6.697 -9.652
547 2HD LYS 6 HD1 LYS 6 17.045 5.449 -9.647
548 1HE LYS 6 HE2 LYS 6 14.119 5.210 -10.505
549 2HE LYS 6 HE1 LYS 6 15.542 4.911 -11.481
550 1HZ LYS 6 HZ1 LYS 6 15.595 3.143 -9.286
551 2HZ LYS 6 HZ3 LYS 6 14.078 3.071 -9.986
552 3HZ LYS 6 HZ2 LYS 6 15.437 2.793 -10.922
553 H THR 7 HN THR 7 15.194 1.438 -7.699
554 HA THR 7 HA THR 7 12.534 2.364 -8.213
555 HB THR 7 HB THR 7 13.524 -0.541 -8.403
556 HG1 THR 7 HG1 THR 7 15.048 0.364 -9.521
557 1HG2 THR 7 HG21 THR 7 11.917 1.287 -10.296
558 2HG2 THR 7 HG23 THR 7 12.178 -0.439 -10.492
559 3HG2 THR 7 HG22 THR 7 11.139 0.153 -9.208
560 H ALA 8 HN ALA 8 13.736 -0.225 -6.055
561 HA ALA 8 HA ALA 8 11.250 -0.862 -4.908
562 1HB ALA 8 HB1 ALA 8 13.974 -0.872 -3.569
563 2HB ALA 8 HB3 ALA 8 12.553 -1.715 -2.970
564 3HB ALA 8 HB2 ALA 8 13.284 -2.203 -4.491
565 H LEU 9 HN LEU 9 13.562 1.597 -4.006
566 HA LEU 9 HA LEU 9 12.274 2.404 -1.603
567 1HB LEU 9 HB2 LEU 9 14.618 3.075 -2.345
568 2HB LEU 9 HB1 LEU 9 13.899 4.067 -3.591
569 HG LEU 9 HG LEU 9 12.802 5.468 -1.886
570 1HD1 LEU 9 HD11 LEU 9 14.335 3.737 0.110
571 2HD1 LEU 9 HD13 LEU 9 13.435 5.184 0.516
572 3HD1 LEU 9 HD12 LEU 9 12.585 3.771 -0.061
573 1HD2 LEU 9 HD22 LEU 9 15.793 5.102 -1.440
574 2HD2 LEU 9 HD21 LEU 9 15.063 6.081 -2.701
575 3HD2 LEU 9 HD23 LEU 9 14.876 6.537 -1.016
576 H ASN 10 HN ASN 10 12.105 3.370 -4.925
577 HA ASN 10 HA ASN 10 10.102 5.388 -4.582
578 1HB ASN 10 HB2 ASN 10 11.494 5.298 -6.615
579 2HB ASN 10 HB1 ASN 10 10.766 3.750 -7.049
580 1HD2 ASN 10 HD21 ASN 10 8.149 5.382 -8.706
581 2HD2 ASN 10 HD22 ASN 10 9.248 4.093 -8.660
582 H MET 11 HN MET 11 9.934 1.916 -4.859
583 HA MET 11 HA MET 11 7.155 1.903 -5.664
584 1HB MET 11 HB2 MET 11 8.799 -0.227 -4.278
585 2HB MET 11 HB1 MET 11 7.148 -0.475 -4.810
586 1HG MET 11 HG2 MET 11 9.594 0.039 -6.498
587 2HG MET 11 HG1 MET 11 8.539 -1.333 -6.523
588 1HE MET 11 HE3 MET 11 6.509 -1.626 -7.437
589 2HE MET 11 HE2 MET 11 5.477 -0.242 -7.035
590 3HE MET 11 HE1 MET 11 5.770 -0.701 -8.717
591 H ALA 12 HN ALA 12 8.859 1.792 -2.572
592 HA ALA 12 HA ALA 12 6.464 1.325 -1.032
593 1HB ALA 12 HB1 ALA 12 8.942 2.924 -0.213
594 2HB ALA 12 HB3 ALA 12 7.721 2.299 0.884
595 3HB ALA 12 HB2 ALA 12 8.767 1.187 0.004
596 NH1 ARG 13 NH1 ARG 13 5.895 8.957 -5.244
597 NH2 ARG 13 NH2 ARG 13 6.537 6.771 -5.654
598 H ARG 13 HN ARG 13 8.209 4.157 -2.092
599 HA ARG 13 HA ARG 13 6.358 6.056 -0.992
600 1HB ARG 13 HB2 ARG 13 8.647 6.592 -1.788
601 2HB ARG 13 HB1 ARG 13 8.179 6.332 -3.444
602 1HG ARG 13 HG2 ARG 13 6.303 8.196 -2.720
603 2HG ARG 13 HG1 ARG 13 7.521 8.531 -1.510
604 1HD ARG 13 HD2 ARG 13 7.938 9.920 -3.539
605 2HD ARG 13 HD1 ARG 13 9.264 8.800 -3.250
606 HE ARG 13 HE ARG 13 8.799 8.102 -5.436
607 1HH1 ARG 13 HH12 ARG 13 6.133 9.884 -4.945
608 2HH1 ARG 13 HH11 ARG 13 4.946 8.781 -5.528
609 1HH2 ARG 13 HH22 ARG 13 7.253 6.063 -5.651
610 2HH2 ARG 13 HH21 ARG 13 5.623 6.511 -5.965
611 H PHE 14 HN PHE 14 6.388 4.013 -3.800
612 HA PHE 14 HA PHE 14 4.339 5.528 -5.189
613 1HB PHE 14 HB2 PHE 14 5.796 3.812 -6.412
614 2HB PHE 14 HB1 PHE 14 4.937 2.553 -5.519
615 HD1 PHE 14 HD2 PHE 14 4.078 5.658 -7.450
616 HD2 PHE 14 HD1 PHE 14 3.104 1.599 -6.571
617 HE1 PHE 14 HE2 PHE 14 2.213 5.763 -9.033
618 HE2 PHE 14 HE1 PHE 14 1.242 1.711 -8.162
619 HZ PHE 14 HZ PHE 14 0.789 3.792 -9.395
620 H ILE 15 HN ILE 15 4.388 2.927 -2.806
621 HA ILE 15 HA ILE 15 1.591 2.372 -3.094
622 HB ILE 15 HB ILE 15 3.360 2.226 -0.589
623 1HG1 ILE 15 HG12 ILE 15 2.472 0.129 -2.618
624 2HG1 ILE 15 HG11 ILE 15 4.082 0.820 -2.550
625 1HG2 ILE 15 HG21 ILE 15 0.652 0.949 -1.176
626 2HG2 ILE 15 HG23 ILE 15 1.577 0.702 0.293
627 3HG2 ILE 15 HG22 ILE 15 0.906 2.273 -0.056
628 1HD1 ILE 15 HD3 ILE 15 4.369 -0.119 -0.266
629 2HD1 ILE 15 HD2 ILE 15 2.776 -0.862 -0.392
630 3HD1 ILE 15 HD1 ILE 15 4.060 -1.364 -1.465
631 NH1 ARG 16 NH2 ARG 16 2.280 8.526 3.827
632 NH2 ARG 16 NH1 ARG 16 4.476 8.922 4.433
633 H ARG 16 HN ARG 16 3.523 4.728 -1.301
634 HA ARG 16 HA ARG 16 1.248 5.874 -0.003
635 1HB ARG 16 HB2 ARG 16 3.929 7.082 -0.829
636 2HB ARG 16 HB1 ARG 16 2.747 8.009 0.064
637 1HG ARG 16 HG2 ARG 16 2.644 6.148 1.729
638 2HG ARG 16 HG1 ARG 16 3.948 5.343 0.878
639 1HD ARG 16 HD2 ARG 16 4.801 6.622 2.839
640 2HD ARG 16 HD1 ARG 16 5.444 7.315 1.358
641 HE ARG 16 HE ARG 16 3.812 9.143 1.603
642 1HH1 ARG 16 HH22 ARG 16 1.602 8.297 3.127
643 2HH1 ARG 16 HH21 ARG 16 1.950 8.672 4.766
644 1HH2 ARG 16 HH12 ARG 16 5.450 8.987 4.201
645 2HH2 ARG 16 HH11 ARG 16 4.222 9.082 5.395
646 H SER 17 HN SER 17 2.651 6.310 -3.196
647 HA SER 17 HA SER 17 1.003 8.557 -3.891
648 1HB SER 17 HB2 SER 17 2.084 6.447 -5.825
649 2HB SER 17 HB1 SER 17 1.767 8.153 -6.157
650 HG SER 17 HG1 SER 17 3.324 7.850 -3.964
651 H GLN 18 HN GLN 18 0.521 5.073 -4.022
652 HA GLN 18 HA GLN 18 -1.900 5.237 -5.576
653 1HB GLN 18 HB2 GLN 18 -0.919 3.061 -3.662
654 2HB GLN 18 HB1 GLN 18 -2.279 2.896 -4.757
655 1HG GLN 18 HG2 GLN 18 -0.825 3.177 -6.692
656 2HG GLN 18 HG1 GLN 18 0.555 3.526 -5.668
657 1HE2 GLN 18 HE21 GLN 18 -0.689 -0.328 -6.145
658 2HE2 GLN 18 HE22 GLN 18 -1.609 0.955 -6.766
659 H THR 19 HN THR 19 -1.310 4.504 -2.198
660 HA THR 19 HA THR 19 -3.871 4.577 -1.218
661 HB THR 19 HB THR 19 -1.389 5.684 0.194
662 HG1 THR 19 HG1 THR 19 -0.680 3.753 -0.336
663 1HG2 THR 19 HG21 THR 19 -3.729 3.900 1.107
664 2HG2 THR 19 HG23 THR 19 -2.442 4.513 2.127
665 3HG2 THR 19 HG22 THR 19 -3.640 5.616 1.473
666 H LEU 20 HN LEU 20 -1.827 7.353 -2.018
667 HA LEU 20 HA LEU 20 -3.470 9.284 -0.735
668 1HB LEU 20 HB2 LEU 20 -1.274 9.903 -1.718
669 2HB LEU 20 HB1 LEU 20 -1.869 9.513 -3.322
670 HG LEU 20 HG LEU 20 -3.555 11.329 -3.175
671 1HD1 LEU 20 HD11 LEU 20 -2.271 11.931 -0.470
672 2HD1 LEU 20 HD13 LEU 20 -3.472 12.928 -1.272
673 3HD1 LEU 20 HD12 LEU 20 -3.907 11.335 -0.698
674 1HD2 LEU 20 HD21 LEU 20 -1.327 11.821 -4.101
675 2HD2 LEU 20 HD23 LEU 20 -1.974 13.221 -3.267
676 3HD2 LEU 20 HD22 LEU 20 -0.736 12.239 -2.500
677 H THR 21 HN THR 21 -3.349 8.094 -4.013
678 HA THR 21 HA THR 21 -5.667 9.340 -5.002
679 HB THR 21 HB THR 21 -4.384 6.700 -5.910
680 HG1 THR 21 HG1 THR 21 -2.695 7.980 -5.971
681 1HG2 THR 21 HG21 THR 21 -5.562 9.095 -7.436
682 2HG2 THR 21 HG23 THR 21 -4.944 7.609 -8.155
683 3HG2 THR 21 HG22 THR 21 -6.409 7.572 -7.185
684 H LEU 22 HN LEU 22 -5.362 6.691 -2.839
685 HA LEU 22 HA LEU 22 -8.056 5.673 -3.520
686 1HB LEU 22 HB2 LEU 22 -6.170 4.868 -1.272
687 2HB LEU 22 HB1 LEU 22 -7.675 4.068 -1.661
688 HG LEU 22 HG LEU 22 -5.280 4.278 -3.549
689 1HD1 LEU 22 HD11 LEU 22 -6.401 1.914 -1.988
690 2HD1 LEU 22 HD13 LEU 22 -5.083 1.844 -3.142
691 3HD1 LEU 22 HD12 LEU 22 -4.886 2.728 -1.642
692 1HD2 LEU 22 HD22 LEU 22 -7.892 2.731 -3.843
693 2HD2 LEU 22 HD21 LEU 22 -7.455 4.147 -4.785
694 3HD2 LEU 22 HD23 LEU 22 -6.534 2.673 -4.953
695 H LEU 23 HN LEU 23 -6.455 7.598 -1.070
696 HA LEU 23 HA LEU 23 -8.595 7.617 0.809
697 1HB LEU 23 HB2 LEU 23 -6.444 8.678 1.415
698 2HB LEU 23 HB1 LEU 23 -6.594 9.811 0.084
699 HG LEU 23 HG LEU 23 -8.637 10.829 1.188
700 1HD1 LEU 23 HD11 LEU 23 -7.997 8.878 3.435
701 2HD1 LEU 23 HD13 LEU 23 -9.189 10.161 3.476
702 3HD1 LEU 23 HD12 LEU 23 -9.416 8.798 2.398
703 1HD2 LEU 23 HD21 LEU 23 -6.369 11.736 1.689
704 2HD2 LEU 23 HD23 LEU 23 -7.439 11.862 3.075
705 3HD2 LEU 23 HD22 LEU 23 -6.220 10.607 3.025
706 H GLU 24 HN GLU 24 -7.722 9.499 -1.907
707 HA GLU 24 HA GLU 24 -9.608 11.475 -2.096
708 1HB GLU 24 HB2 GLU 24 -7.764 11.113 -3.704
709 2HB GLU 24 HB1 GLU 24 -8.518 9.640 -4.249
710 1HG GLU 24 HG2 GLU 24 -10.538 11.386 -4.786
711 2HG GLU 24 HG1 GLU 24 -9.134 12.443 -4.952
712 H LYS 25 HN LYS 25 -9.875 8.453 -3.735
713 HA LYS 25 HA LYS 25 -12.632 8.709 -4.356
714 1HB LYS 25 HB2 LYS 25 -10.872 6.250 -4.243
715 2HB LYS 25 HB1 LYS 25 -12.419 6.351 -5.085
716 1HG LYS 25 HG2 LYS 25 -11.538 8.289 -6.425
717 2HG LYS 25 HG1 LYS 25 -10.007 8.171 -5.593
718 1HD LYS 25 HD2 LYS 25 -9.619 5.935 -6.494
719 2HD LYS 25 HD1 LYS 25 -11.199 5.961 -7.270
720 1HE LYS 25 HE2 LYS 25 -9.399 6.637 -8.879
721 2HE LYS 25 HE1 LYS 25 -10.556 7.935 -8.617
722 1HZ LYS 25 HZ1 LYS 25 -8.511 8.230 -6.711
723 2HZ LYS 25 HZ3 LYS 25 -7.802 8.019 -8.238
724 3HZ LYS 25 HZ2 LYS 25 -8.935 9.230 -7.973
725 H LEU 26 HN LEU 26 -11.189 6.461 -2.006
726 HA LEU 26 HA LEU 26 -13.551 5.352 -1.036
727 1HB LEU 26 HB2 LEU 26 -11.123 6.194 0.581
728 2HB LEU 26 HB1 LEU 26 -12.386 5.156 1.200
729 HG LEU 26 HG LEU 26 -10.671 4.498 -1.247
730 1HD1 LEU 26 HD11 LEU 26 -10.544 3.446 1.617
731 2HD1 LEU 26 HD13 LEU 26 -9.567 2.866 0.279
732 3HD1 LEU 26 HD12 LEU 26 -9.358 4.504 0.869
733 1HD2 LEU 26 HD22 LEU 26 -12.635 2.805 0.368
734 2HD2 LEU 26 HD21 LEU 26 -12.923 3.387 -1.261
735 3HD2 LEU 26 HD23 LEU 26 -11.652 2.224 -0.965
736 H ASN 27 HN ASN 27 -12.142 8.431 -0.233
737 HA ASN 27 HA ASN 27 -13.840 9.072 1.938
738 1HB ASN 27 HB2 ASN 27 -11.850 10.432 1.212
739 2HB ASN 27 HB1 ASN 27 -12.800 10.994 -0.164
740 1HD2 ASN 27 HD21 ASN 27 -13.924 13.631 1.835
741 2HD2 ASN 27 HD22 ASN 27 -13.161 13.124 0.405
742 H GLU 28 HN GLU 28 -14.196 9.963 -1.493
743 HA GLU 28 HA GLU 28 -16.814 11.046 -1.124
744 1HB GLU 28 HB2 GLU 28 -15.938 9.748 -3.711
745 2HB GLU 28 HB1 GLU 28 -16.972 11.147 -3.480
746 1HG GLU 28 HG2 GLU 28 -13.970 11.034 -3.020
747 2HG GLU 28 HG1 GLU 28 -14.833 11.981 -4.214
748 H LEU 29 HN LEU 29 -15.680 7.808 -1.410
749 HA LEU 29 HA LEU 29 -18.368 6.791 -2.102
750 1HB LEU 29 HB2 LEU 29 -15.888 5.241 -1.267
751 2HB LEU 29 HB1 LEU 29 -17.349 4.563 -1.960
752 HG LEU 29 HG LEU 29 -15.598 6.586 -3.426
753 1HD1 LEU 29 HD11 LEU 29 -15.802 3.566 -3.759
754 2HD1 LEU 29 HD13 LEU 29 -14.852 4.643 -4.773
755 3HD1 LEU 29 HD12 LEU 29 -14.420 4.417 -3.089
756 1HD2 LEU 29 HD22 LEU 29 -17.903 4.852 -4.382
757 2HD2 LEU 29 HD21 LEU 29 -17.966 6.591 -4.151
758 3HD2 LEU 29 HD23 LEU 29 -16.932 5.918 -5.388
759 H ASP 30 HN ASP 30 -17.915 8.315 0.318
760 HA ASP 30 HA ASP 30 -18.248 8.207 2.642
761 1HB ASP 30 HB2 ASP 30 -20.508 8.211 1.727
762 2HB ASP 30 HB1 ASP 30 -20.461 6.488 1.470
763 H ALA 31 HN ALA 31 -16.240 6.698 2.030
764 HA ALA 31 HA ALA 31 -16.575 4.235 3.704
765 1HB ALA 31 HB2 ALA 31 -15.969 3.733 1.244
766 2HB ALA 31 HB1 ALA 31 -14.540 4.729 1.438
767 3HB ALA 31 HB3 ALA 31 -14.692 3.240 2.336
768 H ASP 32 HN ASP 32 -16.476 6.520 4.809
769 HA ASP 32 HA ASP 32 -13.978 7.846 5.116
770 1HB ASP 32 HB2 ASP 32 -14.918 8.909 7.064
771 2HB ASP 32 HB1 ASP 32 -16.242 8.739 5.913
772 H GLU 33 HN GLU 33 -15.408 5.105 6.762
773 HA GLU 33 HA GLU 33 -13.503 5.015 8.893
774 1HB GLU 33 HB2 GLU 33 -15.575 3.587 8.873
775 2HB GLU 33 HB1 GLU 33 -14.978 2.733 7.465
776 1HG GLU 33 HG2 GLU 33 -13.097 2.666 9.729
777 2HG GLU 33 HG1 GLU 33 -14.637 1.867 10.044
778 H GLN 34 HN GLN 34 -13.712 3.482 5.764
779 HA GLN 34 HA GLN 34 -11.078 2.372 5.881
780 1HB GLN 34 HB2 GLN 34 -12.791 3.048 3.470
781 2HB GLN 34 HB1 GLN 34 -11.329 2.081 3.417
782 1HG GLN 34 HG2 GLN 34 -13.048 0.470 3.601
783 2HG GLN 34 HG1 GLN 34 -12.432 0.615 5.233
784 1HE2 GLN 34 HE21 GLN 34 -15.809 1.021 6.222
785 2HE2 GLN 34 HE22 GLN 34 -14.441 0.034 6.293
786 H ALA 35 HN ALA 35 -12.203 5.539 5.345
787 HA ALA 35 HA ALA 35 -9.984 6.402 3.689
788 1HB ALA 35 HB2 ALA 35 -12.040 7.849 3.980
789 2HB ALA 35 HB1 ALA 35 -11.602 8.083 5.672
790 3HB ALA 35 HB3 ALA 35 -10.565 8.697 4.418
791 H ASP 36 HN ASP 36 -10.725 6.357 7.145
792 HA ASP 36 HA ASP 36 -8.273 7.502 8.046
793 1HB ASP 36 HB2 ASP 36 -9.948 7.012 9.768
794 2HB ASP 36 HB1 ASP 36 -9.928 5.293 9.365
795 H ILE 37 HN ILE 37 -9.253 4.199 7.709
796 HA ILE 37 HA ILE 37 -6.791 2.965 8.185
797 HB ILE 37 HB ILE 37 -8.912 2.127 6.167
798 1HG1 ILE 37 HG12 ILE 37 -9.952 2.523 8.386
799 2HG1 ILE 37 HG11 ILE 37 -9.928 0.819 8.017
800 1HG2 ILE 37 HG21 ILE 37 -6.865 0.475 7.666
801 2HG2 ILE 37 HG23 ILE 37 -8.163 -0.164 6.669
802 3HG2 ILE 37 HG22 ILE 37 -6.880 0.793 5.946
803 1HD1 ILE 37 HD2 ILE 37 -7.928 0.531 9.473
804 2HD1 ILE 37 HD1 ILE 37 -7.944 2.259 9.820
805 3HD1 ILE 37 HD3 ILE 37 -9.273 1.248 10.335
806 H CYS 38 HN CYS 38 -7.955 4.598 5.342
807 HA CYS 38 HA CYS 38 -5.904 3.588 3.591
808 1HB CYS 38 HB2 CYS 38 -8.024 4.804 2.837
809 2HB CYS 38 HB1 CYS 38 -7.278 6.281 3.390
810 HG CYS 38 HG1 CYS 38 -5.855 6.405 1.385
811 H GLU 39 HN GLU 39 -6.190 6.510 5.602
812 HA GLU 39 HA GLU 39 -3.595 7.460 4.771
813 1HB GLU 39 HB2 GLU 39 -5.277 8.134 7.217
814 2HB GLU 39 HB1 GLU 39 -3.893 9.057 6.651
815 1HG GLU 39 HG2 GLU 39 -5.004 9.366 4.447
816 2HG GLU 39 HG1 GLU 39 -6.406 8.463 5.020
817 H SER 40 HN SER 40 -4.761 5.338 7.304
818 HA SER 40 HA SER 40 -2.286 5.339 8.761
819 1HB SER 40 HB2 SER 40 -4.508 3.221 8.585
820 2HB SER 40 HB1 SER 40 -3.314 3.363 9.895
821 HG SER 40 HG1 SER 40 -5.573 4.799 9.578
822 H LEU 41 HN LEU 41 -3.564 3.623 6.026
823 HA LEU 41 HA LEU 41 -1.421 1.684 5.913
824 1HB LEU 41 HB2 LEU 41 -3.743 1.454 4.848
825 2HB LEU 41 HB1 LEU 41 -3.288 2.683 3.699
826 HG LEU 41 HG LEU 41 -3.189 0.310 2.851
827 1HD1 LEU 41 HD12 LEU 41 -1.904 2.067 1.665
828 2HD1 LEU 41 HD11 LEU 41 -0.507 1.764 2.682
829 3HD1 LEU 41 HD13 LEU 41 -1.090 0.519 1.613
830 1HD2 LEU 41 HD21 LEU 41 -2.303 -0.725 4.884
831 2HD2 LEU 41 HD23 LEU 41 -1.239 -1.074 3.530
832 3HD2 LEU 41 HD22 LEU 41 -0.793 0.145 4.707
833 H HIS 42 HN HIS 42 -2.234 4.716 4.591
834 HA HIS 42 HA HIS 42 -0.310 5.169 2.652
835 1HB HIS 42 HB2 HIS 42 -2.230 6.708 3.387
836 2HB HIS 42 HB1 HIS 42 -1.174 7.255 4.684
837 HD1 HIS 42 HD1 HIS 42 0.075 6.744 1.208
838 HD2 HIS 42 HD2 HIS 42 -0.793 9.791 3.797
839 HE1 HIS 42 HE1 HIS 42 0.927 8.803 0.174
840 H ASP 43 HN ASP 43 0.010 6.140 6.090
841 HA ASP 43 HA ASP 43 2.857 6.578 5.594
842 1HB ASP 43 HB2 ASP 43 1.158 6.737 8.077
843 2HB ASP 43 HB1 ASP 43 2.915 6.980 8.088
844 H HIS 44 HN HIS 44 0.957 3.881 6.561
845 HA HIS 44 HA HIS 44 3.033 2.579 8.074
846 1HB HIS 44 HB2 HIS 44 0.699 1.667 8.020
847 2HB HIS 44 HB1 HIS 44 0.874 1.338 6.297
848 HD1 HIS 44 HD1 HIS 44 3.922 0.491 8.122
849 HD2 HIS 44 HD2 HIS 44 0.415 -1.411 7.215
850 HE1 HIS 44 HE1 HIS 44 4.321 -1.889 8.472
851 H ALA 45 HN ALA 45 2.275 3.122 4.751
852 HA ALA 45 HA ALA 45 4.218 1.274 3.677
853 1HB ALA 45 HB2 ALA 45 2.361 2.179 2.264
854 2HB ALA 45 HB1 ALA 45 3.075 3.782 2.398
855 3HB ALA 45 HB3 ALA 45 3.940 2.507 1.557
856 H ASP 46 HN ASP 46 4.218 4.486 4.867
857 HA ASP 46 HA ASP 46 6.688 5.371 3.715
858 1HB ASP 46 HB2 ASP 46 5.013 6.821 5.018
859 2HB ASP 46 HB1 ASP 46 5.745 6.152 6.471
860 H GLU 47 HN GLU 47 5.841 3.508 6.519
861 HA GLU 47 HA GLU 47 8.302 3.562 7.884
862 1HB GLU 47 HB2 GLU 47 6.535 1.119 7.503
863 2HB GLU 47 HB1 GLU 47 7.707 1.366 8.782
864 1HG GLU 47 HG2 GLU 47 6.418 3.215 9.705
865 2HG GLU 47 HG1 GLU 47 5.283 3.161 8.357
866 H LEU 48 HN LEU 48 7.197 1.479 5.271
867 HA LEU 48 HA LEU 48 9.549 -0.099 5.079
868 1HB LEU 48 HB2 LEU 48 7.733 0.835 2.827
869 2HB LEU 48 HB1 LEU 48 9.054 -0.282 2.611
870 HG LEU 48 HG LEU 48 7.980 -1.941 4.059
871 1HD1 LEU 48 HD11 LEU 48 5.722 0.083 4.336
872 2HD1 LEU 48 HD13 LEU 48 5.681 -1.566 4.919
873 3HD1 LEU 48 HD12 LEU 48 6.782 -0.417 5.635
874 1HD2 LEU 48 HD22 LEU 48 6.164 -0.720 1.941
875 2HD2 LEU 48 HD21 LEU 48 7.457 -1.871 1.657
876 3HD2 LEU 48 HD23 LEU 48 6.019 -2.362 2.528
877 OH TYR 49 OH TYR 49 12.577 8.250 -1.086
878 H TYR 49 HN TYR 49 8.636 2.934 3.618
879 HA TYR 49 HA TYR 49 10.903 3.298 1.981
880 1HB TYR 49 HB2 TYR 49 8.745 4.716 2.108
881 2HB TYR 49 HB1 TYR 49 9.515 5.553 3.446
882 HD1 TYR 49 HD1 TYR 49 11.680 6.764 3.074
883 HD2 TYR 49 HD2 TYR 49 9.451 5.123 -0.148
884 HE1 TYR 49 HE1 TYR 49 12.902 8.184 1.505
885 HE2 TYR 49 HE2 TYR 49 10.684 6.525 -1.720
886 HH TYR 49 HH TYR 49 13.128 7.685 -1.636
887 NH1 ARG 50 NH1 ARG 50 9.923 7.701 4.721
888 NH2 ARG 50 NH2 ARG 50 11.580 9.245 4.247
889 H ARG 50 HN ARG 50 10.410 4.408 5.345
890 HA ARG 50 HA ARG 50 12.996 5.608 5.565
891 1HB ARG 50 HB2 ARG 50 11.594 4.128 7.832
892 2HB ARG 50 HB1 ARG 50 12.736 5.435 7.990
893 1HG ARG 50 HG2 ARG 50 9.993 5.794 6.718
894 2HG ARG 50 HG1 ARG 50 10.291 5.996 8.415
895 1HD ARG 50 HD2 ARG 50 10.330 8.176 7.277
896 2HD ARG 50 HD1 ARG 50 11.899 7.827 7.992
897 HE ARG 50 HE ARG 50 12.772 7.431 5.766
898 1HH1 ARG 50 HH12 ARG 50 9.587 6.932 5.276
899 2HH1 ARG 50 HH11 ARG 50 9.296 8.033 4.009
900 1HH2 ARG 50 HH22 ARG 50 12.486 9.625 4.442
901 2HH2 ARG 50 HH21 ARG 50 11.039 9.660 3.510
902 H SER 51 HN SER 51 11.854 2.423 6.453
903 HA SER 51 HA SER 51 14.358 1.410 7.265
904 1HB SER 51 HB2 SER 51 12.003 -0.076 6.002
905 2HB SER 51 HB1 SER 51 13.189 -0.749 7.148
906 HG SER 51 HG1 SER 51 11.039 0.810 7.630
907 H CYS 52 HN CYS 52 13.037 1.952 4.083
908 HA CYS 52 HA CYS 52 14.978 0.193 2.795
909 1HB CYS 52 HB2 CYS 52 13.240 2.424 1.707
910 2HB CYS 52 HB1 CYS 52 14.264 1.429 0.715
911 HG CYS 52 HG1 CYS 52 11.539 0.599 1.864
912 H LEU 53 HN LEU 53 14.810 3.509 3.864
913 HA LEU 53 HA LEU 53 17.112 4.350 2.315
914 1HB LEU 53 HB2 LEU 53 16.277 5.362 5.076
915 2HB LEU 53 HB1 LEU 53 17.355 6.177 3.966
916 HG LEU 53 HG LEU 53 14.423 5.592 3.367
917 1HD1 LEU 53 HD12 LEU 53 14.723 7.281 5.180
918 2HD1 LEU 53 HD11 LEU 53 15.788 8.203 4.135
919 3HD1 LEU 53 HD13 LEU 53 14.091 8.021 3.713
920 1HD2 LEU 53 HD22 LEU 53 16.498 7.280 1.906
921 2HD2 LEU 53 HD21 LEU 53 15.857 5.747 1.338
922 3HD2 LEU 53 HD23 LEU 53 14.811 7.140 1.452
923 H ALA 54 HN ALA 54 16.524 2.805 5.368
924 HA ALA 54 HA ALA 54 19.252 2.878 6.267
925 1HB ALA 54 HB2 ALA 54 17.401 2.391 7.826
926 2HB ALA 54 HB1 ALA 54 17.086 0.873 6.983
927 3HB ALA 54 HB3 ALA 54 18.594 1.100 7.852
928 NH1 ARG 55 NH2 ARG 55 19.112 -5.797 4.691
929 NH2 ARG 55 NH1 ARG 55 18.120 -5.802 6.756
930 H ARG 55 HN ARG 55 18.277 1.425 3.562
931 HA ARG 55 HA ARG 55 20.376 -0.689 3.821
932 1HB ARG 55 HB2 ARG 55 17.733 -0.860 2.293
933 2HB ARG 55 HB1 ARG 55 19.028 -2.020 2.133
934 1HG ARG 55 HG2 ARG 55 17.603 -1.424 4.751
935 2HG ARG 55 HG1 ARG 55 17.192 -2.741 3.660
936 1HD ARG 55 HD2 ARG 55 19.549 -3.622 3.879
937 2HD ARG 55 HD1 ARG 55 19.876 -2.383 5.072
938 HE ARG 55 HE ARG 55 18.067 -3.378 6.474
939 1HH1 ARG 55 HH22 ARG 55 19.488 -5.338 3.882
940 2HH1 ARG 55 HH21 ARG 55 19.159 -6.803 4.677
941 1HH2 ARG 55 HH12 ARG 55 17.726 -5.311 7.536
942 2HH2 ARG 55 HH11 ARG 55 18.141 -6.807 6.801
943 H PHE 56 HN PHE 56 18.340 1.038 1.611
944 HA PHE 56 HA PHE 56 20.303 1.035 -0.527
945 1HB PHE 56 HB2 PHE 56 17.780 2.687 -0.292
946 2HB PHE 56 HB1 PHE 56 18.634 2.255 -1.760
947 HD1 PHE 56 HD2 PHE 56 19.158 -0.752 -0.668
948 HD2 PHE 56 HD1 PHE 56 15.690 1.704 -1.075
949 HE1 PHE 56 HE2 PHE 56 17.768 -2.739 -0.805
950 HE2 PHE 56 HE1 PHE 56 14.297 -0.312 -1.217
951 HZ PHE 56 HZ PHE 56 15.333 -2.542 -1.085
952 H GLY 57 HN GLY 57 20.302 2.681 2.279
953 1HA GLY 57 HA2 GLY 57 21.497 5.086 0.966
954 2HA GLY 57 HA1 GLY 57 20.576 5.165 2.479
955 H ASP 58 HN ASP 58 23.225 6.005 2.308
956 HA ASP 58 HA ASP 58 24.984 3.884 3.261
957 1HB ASP 58 HB2 ASP 58 26.564 5.740 3.762
958 2HB ASP 58 HB1 ASP 58 25.904 5.998 2.149
959 H ASP 59 HN ASP 59 22.906 6.365 4.428
960 HA ASP 59 HA ASP 59 23.586 6.175 7.211
961 1HB ASP 59 HB2 ASP 59 22.168 8.054 6.561
962 2HB ASP 59 HB1 ASP 59 20.953 6.952 5.890
963 H GLY 60 HN GLY 60 22.604 4.957 8.830
964 1HA GLY 60 HA2 GLY 60 20.647 2.903 8.018
965 2HA GLY 60 HA1 GLY 60 22.217 2.315 8.591
966 H GLU 61 HN GLU 61 21.126 5.318 9.796
967 HA GLU 61 HA GLU 61 20.235 4.017 12.336
968 1HB GLU 61 HB2 GLU 61 21.843 6.591 12.098
969 2HB GLU 61 HB1 GLU 61 21.387 5.772 13.580
970 1HG GLU 61 HG2 GLU 61 22.765 3.811 12.918
971 2HG GLU 61 HG1 GLU 61 23.252 4.666 11.450
972 H ASN 62 HN ASN 62 20.210 6.705 10.205
973 HA ASN 62 HA ASN 62 18.624 8.282 9.603
974 1HB ASN 62 HB2 ASN 62 16.931 6.333 9.809
975 2HB ASN 62 HB1 ASN 62 16.634 6.885 11.456
976 1HD2 ASN 62 HD21 ASN 62 15.607 10.218 9.801
977 2HD2 ASN 62 HD22 ASN 62 17.021 9.866 10.635
978 H LEU 63 HN LEU 63 19.566 9.889 10.532
979 HA LEU 63 HA LEU 63 18.900 10.529 13.363
980 1HB LEU 63 HB2 LEU 63 21.398 10.181 12.707
981 2HB LEU 63 HB1 LEU 63 21.193 11.535 11.613
982 HG LEU 63 HG LEU 63 20.726 13.056 13.490
983 1HD1 LEU 63 HD11 LEU 63 21.198 10.607 15.254
984 2HD1 LEU 63 HD13 LEU 63 20.988 12.254 15.831
985 3HD1 LEU 63 HD12 LEU 63 19.660 11.431 15.054
986 1HD2 LEU 63 HD22 LEU 63 23.216 11.350 13.916
987 2HD2 LEU 63 HD21 LEU 63 23.073 12.689 12.787
988 3HD2 LEU 63 HD23 LEU 63 22.993 12.990 14.515
Start of MODEL 4
Raw file had 988 H/Q atoms
Start of MODEL 4
1 1H MET 1 HT1 MET 1 -21.461 -0.614 -5.868
2 2H MET 1 HT3 MET 1 -22.267 -0.506 -4.376
3 3H MET 1 HT2 MET 1 -22.382 -1.918 -5.312
4 HA MET 1 HA MET 1 -24.122 -1.220 -6.341
5 1HB MET 1 HB2 MET 1 -24.992 1.158 -5.857
6 2HB MET 1 HB1 MET 1 -24.878 0.094 -4.474
7 1HG MET 1 HG2 MET 1 -22.700 1.208 -3.862
8 2HG MET 1 HG1 MET 1 -22.936 2.279 -5.223
9 1HE MET 1 HE1 MET 1 -24.610 3.826 -5.628
10 2HE MET 1 HE3 MET 1 -25.120 4.932 -4.377
11 3HE MET 1 HE2 MET 1 -23.396 4.717 -4.687
12 H THR 2 HN THR 2 -21.761 1.503 -6.266
13 HA THR 2 HA THR 2 -22.227 1.823 -9.146
14 HB THR 2 HB THR 2 -20.076 3.191 -7.400
15 HG1 THR 2 HG1 THR 2 -21.740 3.788 -6.267
16 1HG2 THR 2 HG22 THR 2 -20.371 3.702 -9.940
17 2HG2 THR 2 HG21 THR 2 -22.003 4.224 -9.560
18 3HG2 THR 2 HG23 THR 2 -20.629 5.091 -8.891
19 H LYS 3 HN LYS 3 -20.314 1.239 -10.578
20 HA LYS 3 HA LYS 3 -19.072 -1.165 -9.423
21 1HB LYS 3 HB2 LYS 3 -19.206 -0.089 -12.244
22 2HB LYS 3 HB1 LYS 3 -18.291 -1.518 -11.797
23 1HG LYS 3 HG2 LYS 3 -20.405 -2.401 -12.430
24 2HG LYS 3 HG1 LYS 3 -20.473 -2.389 -10.686
25 1HD LYS 3 HD2 LYS 3 -21.741 -0.045 -11.003
26 2HD LYS 3 HD1 LYS 3 -21.849 -0.549 -12.670
27 1HE LYS 3 HE2 LYS 3 -23.850 -1.228 -11.370
28 2HE LYS 3 HE1 LYS 3 -22.990 -2.642 -11.965
29 1HZ LYS 3 HZ1 LYS 3 -21.947 -1.933 -9.436
30 2HZ LYS 3 HZ3 LYS 3 -23.614 -1.995 -9.321
31 3HZ LYS 3 HZ2 LYS 3 -22.777 -3.338 -9.873
32 H GLN 4 HN GLN 4 -18.251 2.061 -10.069
33 HA GLN 4 HA GLN 4 -15.443 1.641 -10.549
34 1HB GLN 4 HB2 GLN 4 -16.850 4.014 -9.235
35 2HB GLN 4 HB1 GLN 4 -15.180 4.013 -9.775
36 1HG GLN 4 HG2 GLN 4 -16.262 4.979 -11.630
37 2HG GLN 4 HG1 GLN 4 -16.214 3.287 -12.099
38 1HE2 GLN 4 HE21 GLN 4 -19.781 5.091 -11.373
39 2HE2 GLN 4 HE22 GLN 4 -18.321 5.910 -11.105
40 H GLU 5 HN GLU 5 -17.549 1.633 -7.850
41 HA GLU 5 HA GLU 5 -15.687 1.881 -5.710
42 1HB GLU 5 HB2 GLU 5 -18.137 0.129 -5.866
43 2HB GLU 5 HB1 GLU 5 -17.390 0.682 -4.379
44 1HG GLU 5 HG2 GLU 5 -18.040 2.923 -4.752
45 2HG GLU 5 HG1 GLU 5 -18.442 2.637 -6.437
46 H LYS 6 HN LYS 6 -16.919 -0.746 -7.609
47 HA LYS 6 HA LYS 6 -15.500 -2.755 -6.128
48 1HB LYS 6 HB2 LYS 6 -16.567 -2.916 -8.963
49 2HB LYS 6 HB1 LYS 6 -16.308 -4.253 -7.852
50 1HG LYS 6 HG2 LYS 6 -18.425 -2.059 -7.676
51 2HG LYS 6 HG1 LYS 6 -18.646 -3.789 -7.546
52 1HD LYS 6 HD2 LYS 6 -17.338 -3.697 -5.373
53 2HD LYS 6 HD1 LYS 6 -17.395 -1.958 -5.423
54 1HE LYS 6 HE2 LYS 6 -19.242 -2.466 -4.106
55 2HE LYS 6 HE1 LYS 6 -19.864 -2.038 -5.665
56 1HZ LYS 6 HZ1 LYS 6 -19.340 -4.804 -5.630
57 2HZ LYS 6 HZ3 LYS 6 -20.165 -4.379 -4.236
58 3HZ LYS 6 HZ2 LYS 6 -20.843 -3.982 -5.737
59 H THR 7 HN THR 7 -14.778 -0.741 -8.870
60 HA THR 7 HA THR 7 -12.372 -2.243 -9.454
61 HB THR 7 HB THR 7 -12.937 0.696 -10.143
62 HG1 THR 7 HG1 THR 7 -14.763 -0.192 -10.856
63 1HG2 THR 7 HG22 THR 7 -10.791 -0.525 -11.009
64 2HG2 THR 7 HG21 THR 7 -11.856 -1.688 -11.782
65 3HG2 THR 7 HG23 THR 7 -11.863 -0.008 -12.299
66 H ALA 8 HN ALA 8 -13.394 0.169 -7.218
67 HA ALA 8 HA ALA 8 -10.773 1.183 -6.597
68 1HB ALA 8 HB2 ALA 8 -12.806 2.451 -5.962
69 2HB ALA 8 HB1 ALA 8 -13.247 1.190 -4.817
70 3HB ALA 8 HB3 ALA 8 -11.791 2.125 -4.565
71 H LEU 9 HN LEU 9 -12.833 -1.102 -4.653
72 HA LEU 9 HA LEU 9 -10.533 -1.556 -2.946
73 1HB LEU 9 HB2 LEU 9 -11.651 -3.376 -1.931
74 2HB LEU 9 HB1 LEU 9 -12.917 -2.209 -2.246
75 HG LEU 9 HG LEU 9 -12.344 -4.652 -4.015
76 1HD1 LEU 9 HD12 LEU 9 -13.036 -5.287 -1.717
77 2HD1 LEU 9 HD11 LEU 9 -14.436 -4.236 -1.866
78 3HD1 LEU 9 HD13 LEU 9 -14.274 -5.641 -2.906
79 1HD2 LEU 9 HD22 LEU 9 -14.744 -2.810 -3.781
80 2HD2 LEU 9 HD21 LEU 9 -13.577 -2.761 -5.091
81 3HD2 LEU 9 HD23 LEU 9 -14.577 -4.186 -4.861
82 H ASN 10 HN ASN 10 -11.656 -2.925 -5.973
83 HA ASN 10 HA ASN 10 -9.976 -5.256 -5.751
84 1HB ASN 10 HB2 ASN 10 -11.207 -3.808 -8.105
85 2HB ASN 10 HB1 ASN 10 -9.995 -5.048 -8.379
86 1HD2 ASN 10 HD21 ASN 10 -13.458 -6.247 -6.462
87 2HD2 ASN 10 HD22 ASN 10 -12.863 -4.691 -6.173
88 H MET 11 HN MET 11 -9.584 -1.974 -6.857
89 HA MET 11 HA MET 11 -6.963 -2.316 -7.927
90 1HB MET 11 HB2 MET 11 -8.264 -0.248 -8.358
91 2HB MET 11 HB1 MET 11 -8.230 0.148 -6.649
92 1HG MET 11 HG2 MET 11 -6.541 1.370 -7.993
93 2HG MET 11 HG1 MET 11 -5.867 0.467 -6.667
94 1HE MET 11 HE1 MET 11 -6.951 0.058 -10.281
95 2HE MET 11 HE3 MET 11 -5.614 1.207 -10.512
96 3HE MET 11 HE2 MET 11 -5.508 -0.445 -11.122
97 H ALA 12 HN ALA 12 -8.198 -1.424 -4.769
98 HA ALA 12 HA ALA 12 -5.688 -1.057 -3.499
99 1HB ALA 12 HB2 ALA 12 -7.842 -0.458 -2.397
100 2HB ALA 12 HB1 ALA 12 -8.234 -2.169 -2.263
101 3HB ALA 12 HB3 ALA 12 -6.867 -1.510 -1.378
102 NH1 ARG 13 NH1 ARG 13 -9.261 -7.471 -6.781
103 NH2 ARG 13 NH2 ARG 13 -11.142 -8.455 -5.854
104 H ARG 13 HN ARG 13 -7.522 -3.884 -4.283
105 HA ARG 13 HA ARG 13 -6.006 -5.690 -2.636
106 1HB ARG 13 HB2 ARG 13 -8.237 -6.190 -3.824
107 2HB ARG 13 HB1 ARG 13 -7.329 -6.345 -5.307
108 1HG ARG 13 HG2 ARG 13 -5.883 -8.090 -4.129
109 2HG ARG 13 HG1 ARG 13 -7.088 -8.078 -2.848
110 1HD ARG 13 HD2 ARG 13 -7.497 -8.836 -5.778
111 2HD ARG 13 HD1 ARG 13 -7.802 -9.815 -4.351
112 HE ARG 13 HE ARG 13 -9.635 -8.155 -3.793
113 1HH1 ARG 13 HH12 ARG 13 -8.302 -7.179 -6.708
114 2HH1 ARG 13 HH11 ARG 13 -9.733 -7.286 -7.648
115 1HH2 ARG 13 HH22 ARG 13 -11.590 -8.900 -5.071
116 2HH2 ARG 13 HH21 ARG 13 -11.690 -8.312 -6.683
117 H PHE 14 HN PHE 14 -5.753 -4.406 -5.894
118 HA PHE 14 HA PHE 14 -3.421 -5.982 -6.551
119 1HB PHE 14 HB2 PHE 14 -4.227 -3.336 -7.798
120 2HB PHE 14 HB1 PHE 14 -3.251 -4.603 -8.526
121 HD1 PHE 14 HD2 PHE 14 -4.999 -6.993 -7.505
122 HD2 PHE 14 HD1 PHE 14 -5.938 -3.308 -9.416
123 HE1 PHE 14 HE2 PHE 14 -7.052 -7.981 -8.407
124 HE2 PHE 14 HE1 PHE 14 -8.005 -4.296 -10.315
125 HZ PHE 14 HZ PHE 14 -8.566 -6.639 -9.814
126 H ILE 15 HN ILE 15 -3.949 -2.993 -4.850
127 HA ILE 15 HA ILE 15 -1.255 -2.026 -5.216
128 HB ILE 15 HB ILE 15 -3.186 -1.616 -2.860
129 1HG1 ILE 15 HG12 ILE 15 -2.542 0.105 -5.293
130 2HG1 ILE 15 HG11 ILE 15 -4.041 -0.760 -5.072
131 1HG2 ILE 15 HG22 ILE 15 -0.801 -1.138 -2.292
132 2HG2 ILE 15 HG21 ILE 15 -0.717 -0.033 -3.656
133 3HG2 ILE 15 HG23 ILE 15 -1.769 0.315 -2.289
134 1HD1 ILE 15 HD2 ILE 15 -4.483 0.616 -3.006
135 2HD1 ILE 15 HD1 ILE 15 -3.030 1.539 -3.348
136 3HD1 ILE 15 HD3 ILE 15 -4.372 1.576 -4.469
137 NH1 ARG 16 NH2 ARG 16 -5.595 -7.708 -0.541
138 NH2 ARG 16 NH1 ARG 16 -5.102 -9.851 0.206
139 H ARG 16 HN ARG 16 -2.928 -4.226 -3.076
140 HA ARG 16 HA ARG 16 -0.697 -4.698 -1.340
141 1HB ARG 16 HB2 ARG 16 -3.093 -5.452 -0.912
142 2HB ARG 16 HB1 ARG 16 -2.818 -6.707 -2.120
143 1HG ARG 16 HG2 ARG 16 -0.941 -7.591 -0.837
144 2HG ARG 16 HG1 ARG 16 -1.104 -6.313 0.353
145 1HD ARG 16 HD2 ARG 16 -2.257 -8.430 1.076
146 2HD ARG 16 HD1 ARG 16 -3.364 -7.080 0.917
147 HE ARG 16 HE ARG 16 -3.080 -8.834 -1.448
148 1HH1 ARG 16 HH22 ARG 16 -5.285 -6.848 -0.951
149 2HH1 ARG 16 HH21 ARG 16 -6.568 -7.801 -0.299
150 1HH2 ARG 16 HH12 ARG 16 -4.434 -10.582 0.361
151 2HH2 ARG 16 HH11 ARG 16 -6.057 -10.025 0.472
152 H SER 17 HN SER 17 -1.783 -6.063 -4.417
153 HA SER 17 HA SER 17 0.144 -8.148 -4.530
154 1HB SER 17 HB2 SER 17 -0.929 -6.544 -6.907
155 2HB SER 17 HB1 SER 17 -0.449 -8.250 -6.880
156 HG SER 17 HG1 SER 17 -2.375 -8.647 -6.165
157 H GLN 18 HN GLN 18 0.284 -4.720 -5.390
158 HA GLN 18 HA GLN 18 2.895 -4.838 -6.563
159 1HB GLN 18 HB2 GLN 18 1.478 -2.743 -6.667
160 2HB GLN 18 HB1 GLN 18 1.691 -2.545 -4.929
161 1HG GLN 18 HG2 GLN 18 4.062 -2.200 -5.168
162 2HG GLN 18 HG1 GLN 18 4.017 -2.653 -6.871
163 1HE2 GLN 18 HE21 GLN 18 1.867 0.758 -6.262
164 2HE2 GLN 18 HE22 GLN 18 1.426 -0.671 -5.475
165 H THR 19 HN THR 19 1.736 -4.493 -3.269
166 HA THR 19 HA THR 19 4.249 -4.097 -2.031
167 HB THR 19 HB THR 19 1.882 -5.618 -0.802
168 HG1 THR 19 HG1 THR 19 0.923 -3.866 -1.619
169 1HG2 THR 19 HG21 THR 19 3.759 -3.420 0.213
170 2HG2 THR 19 HG23 THR 19 2.581 -4.303 1.179
171 3HG2 THR 19 HG22 THR 19 4.018 -5.118 0.584
172 H LEU 20 HN LEU 20 2.659 -6.947 -3.257
173 HA LEU 20 HA LEU 20 4.387 -8.849 -1.955
174 1HB LEU 20 HB2 LEU 20 2.156 -9.265 -3.368
175 2HB LEU 20 HB1 LEU 20 3.216 -9.211 -4.752
176 HG LEU 20 HG LEU 20 2.814 -11.527 -4.131
177 1HD1 LEU 20 HD12 LEU 20 5.061 -10.988 -5.062
178 2HD1 LEU 20 HD11 LEU 20 5.672 -10.764 -3.434
179 3HD1 LEU 20 HD13 LEU 20 5.124 -12.336 -3.945
180 1HD2 LEU 20 HD21 LEU 20 2.366 -11.232 -1.719
181 2HD2 LEU 20 HD23 LEU 20 3.605 -12.443 -1.983
182 3HD2 LEU 20 HD22 LEU 20 4.058 -10.844 -1.433
183 H THR 21 HN THR 21 4.317 -7.510 -5.221
184 HA THR 21 HA THR 21 6.822 -8.431 -6.076
185 HB THR 21 HB THR 21 5.550 -5.744 -6.844
186 HG1 THR 21 HG1 THR 21 4.643 -8.329 -6.766
187 1HG2 THR 21 HG22 THR 21 7.682 -6.591 -8.078
188 2HG2 THR 21 HG21 THR 21 6.770 -8.034 -8.496
189 3HG2 THR 21 HG23 THR 21 6.267 -6.467 -9.117
190 H LEU 22 HN LEU 22 6.112 -6.010 -3.756
191 HA LEU 22 HA LEU 22 8.738 -4.752 -4.030
192 1HB LEU 22 HB2 LEU 22 6.394 -4.401 -2.179
193 2HB LEU 22 HB1 LEU 22 7.955 -3.771 -1.700
194 HG LEU 22 HG LEU 22 6.826 -3.183 -4.467
195 1HD1 LEU 22 HD11 LEU 22 6.447 -1.517 -1.933
196 2HD1 LEU 22 HD13 LEU 22 5.976 -1.051 -3.562
197 3HD1 LEU 22 HD12 LEU 22 5.169 -2.385 -2.769
198 1HD2 LEU 22 HD22 LEU 22 8.765 -1.754 -2.583
199 2HD2 LEU 22 HD21 LEU 22 9.260 -2.732 -3.947
200 3HD2 LEU 22 HD23 LEU 22 8.366 -1.251 -4.208
201 H LEU 23 HN LEU 23 7.159 -7.094 -1.974
202 HA LEU 23 HA LEU 23 8.998 -7.260 0.104
203 1HB LEU 23 HB2 LEU 23 6.983 -8.611 0.154
204 2HB LEU 23 HB1 LEU 23 7.472 -9.472 -1.293
205 HG LEU 23 HG LEU 23 9.280 -10.577 -0.146
206 1HD1 LEU 23 HD11 LEU 23 8.565 -8.841 2.275
207 2HD1 LEU 23 HD13 LEU 23 9.726 -10.149 2.297
208 3HD1 LEU 23 HD12 LEU 23 10.048 -8.706 1.366
209 1HD2 LEU 23 HD22 LEU 23 6.778 -10.563 1.563
210 2HD2 LEU 23 HD21 LEU 23 7.054 -11.545 0.133
211 3HD2 LEU 23 HD23 LEU 23 8.013 -11.811 1.582
212 H GLU 24 HN GLU 24 9.034 -9.270 -2.803
213 HA GLU 24 HA GLU 24 11.432 -10.594 -2.428
214 1HB GLU 24 HB2 GLU 24 10.361 -9.364 -4.995
215 2HB GLU 24 HB1 GLU 24 11.765 -10.417 -4.962
216 1HG GLU 24 HG2 GLU 24 9.874 -11.805 -5.497
217 2HG GLU 24 HG1 GLU 24 10.237 -12.140 -3.807
218 H LYS 25 HN LYS 25 11.041 -7.512 -4.042
219 HA LYS 25 HA LYS 25 13.762 -6.911 -4.398
220 1HB LYS 25 HB2 LYS 25 11.659 -4.871 -3.604
221 2HB LYS 25 HB1 LYS 25 13.166 -4.560 -4.441
222 1HG LYS 25 HG2 LYS 25 12.428 -5.904 -6.355
223 2HG LYS 25 HG1 LYS 25 10.912 -6.281 -5.552
224 1HD LYS 25 HD2 LYS 25 10.436 -3.808 -5.389
225 2HD LYS 25 HD1 LYS 25 11.861 -3.496 -6.364
226 1HE LYS 25 HE2 LYS 25 9.374 -5.063 -7.188
227 2HE LYS 25 HE1 LYS 25 9.937 -3.536 -7.843
228 1HZ LYS 25 HZ1 LYS 25 12.030 -5.343 -8.084
229 2HZ LYS 25 HZ3 LYS 25 10.625 -6.117 -8.651
230 3HZ LYS 25 HZ2 LYS 25 11.121 -4.625 -9.299
231 H LEU 26 HN LEU 26 11.771 -6.152 -1.549
232 HA LEU 26 HA LEU 26 13.815 -4.767 -0.170
233 1HB LEU 26 HB2 LEU 26 11.592 -6.513 0.946
234 2HB LEU 26 HB1 LEU 26 12.549 -5.417 1.912
235 HG LEU 26 HG LEU 26 10.924 -4.521 -0.522
236 1HD1 LEU 26 HD11 LEU 26 10.207 -4.387 2.426
237 2HD1 LEU 26 HD13 LEU 26 9.276 -3.668 1.124
238 3HD1 LEU 26 HD12 LEU 26 9.437 -5.411 1.234
239 1HD2 LEU 26 HD22 LEU 26 12.202 -2.914 1.723
240 2HD2 LEU 26 HD21 LEU 26 12.775 -2.977 0.069
241 3HD2 LEU 26 HD23 LEU 26 11.219 -2.263 0.427
242 H ASN 27 HN ASN 27 13.221 -8.195 -0.497
243 HA ASN 27 HA ASN 27 15.088 -8.917 1.580
244 1HB ASN 27 HB2 ASN 27 14.139 -10.503 -0.824
245 2HB ASN 27 HB1 ASN 27 15.088 -11.169 0.496
246 1HD2 ASN 27 HD21 ASN 27 11.104 -10.600 0.936
247 2HD2 ASN 27 HD22 ASN 27 11.901 -10.251 -0.517
248 H GLU 28 HN GLU 28 15.356 -8.929 -1.967
249 HA GLU 28 HA GLU 28 18.133 -9.595 -1.946
250 1HB GLU 28 HB2 GLU 28 17.014 -7.852 -4.126
251 2HB GLU 28 HB1 GLU 28 18.115 -9.213 -4.247
252 1HG GLU 28 HG2 GLU 28 15.121 -9.346 -3.796
253 2HG GLU 28 HG1 GLU 28 16.038 -9.987 -5.141
254 H LEU 29 HN LEU 29 16.459 -6.626 -1.502
255 HA LEU 29 HA LEU 29 18.912 -5.034 -1.898
256 1HB LEU 29 HB2 LEU 29 16.143 -4.178 -1.006
257 2HB LEU 29 HB1 LEU 29 17.471 -3.102 -1.399
258 HG LEU 29 HG LEU 29 16.401 -5.089 -3.445
259 1HD1 LEU 29 HD11 LEU 29 15.634 -2.183 -2.969
260 2HD1 LEU 29 HD13 LEU 29 15.109 -3.145 -4.348
261 3HD1 LEU 29 HD12 LEU 29 14.574 -3.554 -2.725
262 1HD2 LEU 29 HD22 LEU 29 18.003 -2.526 -3.692
263 2HD2 LEU 29 HD21 LEU 29 18.659 -4.147 -3.866
264 3HD2 LEU 29 HD23 LEU 29 17.488 -3.549 -5.025
265 H ASP 30 HN ASP 30 18.186 -7.005 0.371
266 HA ASP 30 HA ASP 30 18.525 -7.195 2.647
267 1HB ASP 30 HB2 ASP 30 20.889 -6.682 2.033
268 2HB ASP 30 HB1 ASP 30 20.536 -4.955 2.141
269 H ALA 31 HN ALA 31 16.413 -6.293 2.720
270 HA ALA 31 HA ALA 31 16.407 -3.916 4.519
271 1HB ALA 31 HB2 ALA 31 15.659 -3.152 2.227
272 2HB ALA 31 HB1 ALA 31 14.407 -4.387 2.253
273 3HB ALA 31 HB3 ALA 31 14.359 -3.058 3.403
274 H ASP 32 HN ASP 32 16.598 -6.265 5.422
275 HA ASP 32 HA ASP 32 14.402 -8.004 5.629
276 1HB ASP 32 HB2 ASP 32 15.345 -8.707 7.817
277 2HB ASP 32 HB1 ASP 32 16.645 -8.521 6.640
278 H GLU 33 HN GLU 33 15.161 -5.090 7.409
279 HA GLU 33 HA GLU 33 13.023 -5.335 9.270
280 1HB GLU 33 HB2 GLU 33 13.245 -2.759 9.385
281 2HB GLU 33 HB1 GLU 33 14.763 -3.611 9.619
282 1HG GLU 33 HG2 GLU 33 15.309 -3.248 7.189
283 2HG GLU 33 HG1 GLU 33 13.769 -2.449 6.997
284 H GLN 34 HN GLN 34 13.222 -3.986 6.058
285 HA GLN 34 HA GLN 34 10.449 -3.135 6.120
286 1HB GLN 34 HB2 GLN 34 12.251 -3.621 3.716
287 2HB GLN 34 HB1 GLN 34 10.748 -2.708 3.709
288 1HG GLN 34 HG2 GLN 34 13.290 -1.922 5.189
289 2HG GLN 34 HG1 GLN 34 12.530 -1.085 3.857
290 1HE2 GLN 34 HE21 GLN 34 11.219 -0.262 7.527
291 2HE2 GLN 34 HE22 GLN 34 12.693 -1.032 7.216
292 H ALA 35 HN ALA 35 12.042 -6.098 5.713
293 HA ALA 35 HA ALA 35 10.061 -7.289 3.966
294 1HB ALA 35 HB2 ALA 35 12.261 -8.467 4.487
295 2HB ALA 35 HB1 ALA 35 11.695 -8.700 6.141
296 3HB ALA 35 HB3 ALA 35 10.847 -9.461 4.814
297 H ASP 36 HN ASP 36 10.622 -7.398 7.498
298 HA ASP 36 HA ASP 36 8.179 -8.627 8.182
299 1HB ASP 36 HB2 ASP 36 9.538 -8.190 10.086
300 2HB ASP 36 HB1 ASP 36 9.726 -6.478 9.668
301 H ILE 37 HN ILE 37 8.868 -5.228 8.038
302 HA ILE 37 HA ILE 37 6.239 -4.321 8.459
303 HB ILE 37 HB ILE 37 8.457 -3.110 6.754
304 1HG1 ILE 37 HG12 ILE 37 9.107 -3.654 9.154
305 2HG1 ILE 37 HG11 ILE 37 9.191 -1.945 8.788
306 1HG2 ILE 37 HG21 ILE 37 6.108 -1.734 8.065
307 2HG2 ILE 37 HG23 ILE 37 7.439 -0.939 7.251
308 3HG2 ILE 37 HG22 ILE 37 6.334 -1.960 6.349
309 1HD1 ILE 37 HD2 ILE 37 6.909 -3.374 10.226
310 2HD1 ILE 37 HD1 ILE 37 8.143 -2.388 10.973
311 3HD1 ILE 37 HD3 ILE 37 6.969 -1.642 9.914
312 H CYS 38 HN CYS 38 7.758 -5.576 5.569
313 HA CYS 38 HA CYS 38 5.666 -4.635 3.810
314 1HB CYS 38 HB2 CYS 38 7.885 -5.364 2.941
315 2HB CYS 38 HB1 CYS 38 7.520 -7.001 3.421
316 HG CYS 38 HG1 CYS 38 6.489 -5.616 0.902
317 H GLU 39 HN GLU 39 6.245 -7.749 5.489
318 HA GLU 39 HA GLU 39 3.939 -8.983 4.339
319 1HB GLU 39 HB2 GLU 39 5.467 -9.480 6.916
320 2HB GLU 39 HB1 GLU 39 4.003 -10.376 6.563
321 1HG GLU 39 HG2 GLU 39 5.899 -11.702 5.814
322 2HG GLU 39 HG1 GLU 39 5.084 -11.099 4.377
323 H SER 40 HN SER 40 4.492 -7.283 7.364
324 HA SER 40 HA SER 40 1.828 -7.433 8.297
325 1HB SER 40 HB2 SER 40 3.962 -5.277 8.771
326 2HB SER 40 HB1 SER 40 2.615 -5.670 9.867
327 HG SER 40 HG1 SER 40 4.963 -6.971 9.567
328 H LEU 41 HN LEU 41 3.376 -5.325 6.014
329 HA LEU 41 HA LEU 41 1.189 -3.418 5.930
330 1HB LEU 41 HB2 LEU 41 3.532 -2.925 5.155
331 2HB LEU 41 HB1 LEU 41 3.285 -4.033 3.830
332 HG LEU 41 HG LEU 41 1.370 -2.610 3.017
333 1HD1 LEU 41 HD11 LEU 41 2.409 -0.681 5.129
334 2HD1 LEU 41 HD13 LEU 41 1.175 -0.318 3.933
335 3HD1 LEU 41 HD12 LEU 41 0.847 -1.483 5.198
336 1HD2 LEU 41 HD22 LEU 41 4.055 -1.248 3.346
337 2HD2 LEU 41 HD21 LEU 41 3.652 -2.404 2.097
338 3HD2 LEU 41 HD23 LEU 41 2.853 -0.844 2.123
339 H HIS 42 HN HIS 42 2.200 -6.218 4.355
340 HA HIS 42 HA HIS 42 0.493 -6.265 2.095
341 1HB HIS 42 HB2 HIS 42 2.440 -7.912 2.699
342 2HB HIS 42 HB1 HIS 42 1.233 -8.773 3.644
343 HD1 HIS 42 HD1 HIS 42 2.085 -8.037 0.112
344 HD2 HIS 42 HD2 HIS 42 -0.744 -10.142 2.193
345 HE1 HIS 42 HE1 HIS 42 0.903 -9.432 -1.533
346 H ASP 43 HN ASP 43 0.039 -7.961 5.206
347 HA ASP 43 HA ASP 43 -2.691 -8.608 4.592
348 1HB ASP 43 HB2 ASP 43 -1.672 -9.813 6.461
349 2HB ASP 43 HB1 ASP 43 -1.414 -8.291 7.327
350 H HIS 44 HN HIS 44 -1.222 -5.917 6.329
351 HA HIS 44 HA HIS 44 -3.704 -4.842 7.207
352 1HB HIS 44 HB2 HIS 44 -1.426 -3.998 7.970
353 2HB HIS 44 HB1 HIS 44 -1.273 -3.199 6.399
354 HD1 HIS 44 HD1 HIS 44 -4.573 -3.321 8.103
355 HD2 HIS 44 HD2 HIS 44 -1.568 -0.595 7.547
356 HE1 HIS 44 HE1 HIS 44 -5.460 -1.157 8.820
357 H ALA 45 HN ALA 45 -2.076 -4.771 4.147
358 HA ALA 45 HA ALA 45 -3.734 -2.619 3.078
359 1HB ALA 45 HB2 ALA 45 -1.539 -3.264 1.978
360 2HB ALA 45 HB1 ALA 45 -2.242 -4.825 1.578
361 3HB ALA 45 HB3 ALA 45 -2.893 -3.361 0.859
362 H ASP 46 HN ASP 46 -3.709 -6.081 3.334
363 HA ASP 46 HA ASP 46 -6.096 -6.415 1.719
364 1HB ASP 46 HB2 ASP 46 -4.485 -8.364 2.259
365 2HB ASP 46 HB1 ASP 46 -5.092 -8.298 3.895
366 H GLU 47 HN GLU 47 -5.399 -5.329 4.872
367 HA GLU 47 HA GLU 47 -7.994 -6.085 5.951
368 1HB GLU 47 HB2 GLU 47 -6.017 -5.609 7.475
369 2HB GLU 47 HB1 GLU 47 -6.017 -3.945 6.900
370 1HG GLU 47 HG2 GLU 47 -7.149 -4.171 9.094
371 2HG GLU 47 HG1 GLU 47 -8.229 -3.554 7.849
372 H LEU 48 HN LEU 48 -6.442 -3.398 4.373
373 HA LEU 48 HA LEU 48 -8.699 -1.646 4.638
374 1HB LEU 48 HB2 LEU 48 -6.353 -0.939 3.824
375 2HB LEU 48 HB1 LEU 48 -6.708 -1.763 2.317
376 HG LEU 48 HG LEU 48 -8.642 -0.251 1.911
377 1HD1 LEU 48 HD12 LEU 48 -7.689 1.176 4.432
378 2HD1 LEU 48 HD11 LEU 48 -8.943 1.748 3.346
379 3HD1 LEU 48 HD13 LEU 48 -9.209 0.303 4.295
380 1HD2 LEU 48 HD22 LEU 48 -6.051 1.220 2.536
381 2HD2 LEU 48 HD21 LEU 48 -6.406 0.379 1.034
382 3HD2 LEU 48 HD23 LEU 48 -7.326 1.806 1.479
383 OH TYR 49 OH TYR 49 -11.980 -8.185 -3.281
384 H TYR 49 HN TYR 49 -7.759 -4.266 2.578
385 HA TYR 49 HA TYR 49 -9.821 -3.919 0.598
386 1HB TYR 49 HB2 TYR 49 -7.807 -5.361 0.207
387 2HB TYR 49 HB1 TYR 49 -8.438 -6.485 1.404
388 HD1 TYR 49 HD1 TYR 49 -9.246 -4.885 -1.838
389 HD2 TYR 49 HD2 TYR 49 -10.119 -8.068 0.842
390 HE1 TYR 49 HE1 TYR 49 -10.652 -5.927 -3.539
391 HE2 TYR 49 HE2 TYR 49 -11.529 -9.115 -0.855
392 HH TYR 49 HH TYR 49 -12.805 -8.480 -2.868
393 NH1 ARG 50 NH2 ARG 50 -6.885 -8.746 5.512
394 NH2 ARG 50 NH1 ARG 50 -6.697 -8.356 7.769
395 H ARG 50 HN ARG 50 -9.558 -5.840 3.546
396 HA ARG 50 HA ARG 50 -12.077 -7.152 3.279
397 1HB ARG 50 HB2 ARG 50 -10.343 -6.492 5.682
398 2HB ARG 50 HB1 ARG 50 -11.820 -7.420 5.848
399 1HG ARG 50 HG2 ARG 50 -10.941 -9.122 4.285
400 2HG ARG 50 HG1 ARG 50 -9.482 -8.204 4.030
401 1HD ARG 50 HD2 ARG 50 -10.406 -9.420 6.685
402 2HD ARG 50 HD1 ARG 50 -9.065 -9.998 5.702
403 HE ARG 50 HE ARG 50 -9.071 -7.418 7.201
404 1HH1 ARG 50 HH22 ARG 50 -7.438 -8.793 4.676
405 2HH1 ARG 50 HH21 ARG 50 -5.905 -8.950 5.430
406 1HH2 ARG 50 HH12 ARG 50 -7.118 -8.102 8.644
407 2HH2 ARG 50 HH11 ARG 50 -5.709 -8.548 7.755
408 H SER 51 HN SER 51 -11.140 -4.561 5.476
409 HA SER 51 HA SER 51 -13.658 -3.793 6.319
410 1HB SER 51 HB2 SER 51 -11.203 -2.058 5.801
411 2HB SER 51 HB1 SER 51 -12.528 -1.678 6.929
412 HG SER 51 HG1 SER 51 -10.527 -3.586 7.144
413 H CYS 52 HN CYS 52 -11.996 -2.659 3.343
414 HA CYS 52 HA CYS 52 -14.224 -0.868 2.784
415 1HB CYS 52 HB2 CYS 52 -13.266 -0.556 0.610
416 2HB CYS 52 HB1 CYS 52 -11.960 -0.541 1.766
417 HG CYS 52 HG1 CYS 52 -11.024 -2.635 0.778
418 H LEU 53 HN LEU 53 -13.462 -4.208 2.079
419 HA LEU 53 HA LEU 53 -15.499 -4.477 0.063
420 1HB LEU 53 HB2 LEU 53 -13.791 -6.262 0.322
421 2HB LEU 53 HB1 LEU 53 -14.306 -6.545 1.973
422 HG LEU 53 HG LEU 53 -16.514 -7.360 1.195
423 1HD1 LEU 53 HD11 LEU 53 -15.435 -6.922 -1.625
424 2HD1 LEU 53 HD13 LEU 53 -16.958 -7.678 -1.212
425 3HD1 LEU 53 HD12 LEU 53 -16.725 -5.976 -0.902
426 1HD2 LEU 53 HD21 LEU 53 -14.636 -8.956 1.393
427 2HD2 LEU 53 HD23 LEU 53 -15.735 -9.417 0.107
428 3HD2 LEU 53 HD22 LEU 53 -14.198 -8.657 -0.283
429 H ALA 54 HN ALA 54 -15.438 -4.299 3.528
430 HA ALA 54 HA ALA 54 -18.070 -5.454 3.881
431 1HB ALA 54 HB2 ALA 54 -16.516 -5.083 5.834
432 2HB ALA 54 HB1 ALA 54 -16.699 -3.345 5.610
433 3HB ALA 54 HB3 ALA 54 -18.081 -4.315 6.075
434 NH1 ARG 55 NH2 ARG 55 -18.887 4.448 3.316
435 NH2 ARG 55 NH1 ARG 55 -18.867 4.280 5.621
436 H ARG 55 HN ARG 55 -16.757 -2.399 2.989
437 HA ARG 55 HA ARG 55 -19.343 -1.051 3.212
438 1HB ARG 55 HB2 ARG 55 -17.219 0.211 3.670
439 2HB ARG 55 HB1 ARG 55 -16.687 -0.104 2.028
440 1HG ARG 55 HG2 ARG 55 -17.525 2.136 2.077
441 2HG ARG 55 HG1 ARG 55 -18.682 1.198 1.172
442 1HD ARG 55 HD2 ARG 55 -20.056 2.451 2.689
443 2HD ARG 55 HD1 ARG 55 -19.904 0.915 3.513
444 HE ARG 55 HE ARG 55 -18.199 1.904 4.980
445 1HH1 ARG 55 HH22 ARG 55 -18.838 4.029 2.407
446 2HH1 ARG 55 HH21 ARG 55 -18.988 5.448 3.350
447 1HH2 ARG 55 HH12 ARG 55 -18.813 3.710 6.447
448 2HH2 ARG 55 HH11 ARG 55 -18.950 5.274 5.741
449 H PHE 56 HN PHE 56 -17.588 -2.792 0.817
450 HA PHE 56 HA PHE 56 -19.421 -1.690 -1.261
451 1HB PHE 56 HB2 PHE 56 -16.711 -2.989 -1.580
452 2HB PHE 56 HB1 PHE 56 -17.691 -2.408 -2.902
453 HD1 PHE 56 HD2 PHE 56 -18.754 0.151 -2.023
454 HD2 PHE 56 HD1 PHE 56 -14.907 -1.537 -1.284
455 HE1 PHE 56 HE2 PHE 56 -17.834 2.384 -1.722
456 HE2 PHE 56 HE1 PHE 56 -13.986 0.720 -0.988
457 HZ PHE 56 HZ PHE 56 -15.446 2.689 -1.203
458 H GLY 57 HN GLY 57 -19.073 -4.539 0.493
459 1HA GLY 57 HA2 GLY 57 -19.444 -6.389 -1.655
460 2HA GLY 57 HA1 GLY 57 -19.867 -6.699 0.027
461 H ASP 58 HN ASP 58 -21.054 -5.732 -3.095
462 HA ASP 58 HA ASP 58 -23.771 -6.329 -2.215
463 1HB ASP 58 HB2 ASP 58 -24.800 -4.213 -2.629
464 2HB ASP 58 HB1 ASP 58 -23.415 -3.838 -1.614
465 H ASP 59 HN ASP 59 -21.780 -4.888 -4.753
466 HA ASP 59 HA ASP 59 -23.660 -5.753 -6.826
467 1HB ASP 59 HB2 ASP 59 -20.699 -5.041 -7.239
468 2HB ASP 59 HB1 ASP 59 -21.879 -5.313 -8.489
469 H GLY 60 HN GLY 60 -21.442 -7.208 -4.816
470 1HA GLY 60 HA2 GLY 60 -21.798 -9.759 -6.081
471 2HA GLY 60 HA1 GLY 60 -20.140 -9.163 -6.270
472 H GLU 61 HN GLU 61 -19.859 -11.128 -4.763
473 HA GLU 61 HA GLU 61 -20.521 -10.463 -1.956
474 1HB GLU 61 HB2 GLU 61 -19.314 -12.890 -1.826
475 2HB GLU 61 HB1 GLU 61 -21.037 -12.694 -2.082
476 1HG GLU 61 HG2 GLU 61 -20.090 -14.277 -3.716
477 2HG GLU 61 HG1 GLU 61 -20.627 -12.854 -4.587
478 H ASN 62 HN ASN 62 -17.824 -10.886 -4.098
479 HA ASN 62 HA ASN 62 -15.964 -10.231 -1.852
480 1HB ASN 62 HB2 ASN 62 -15.506 -12.363 -3.120
481 2HB ASN 62 HB1 ASN 62 -15.305 -11.397 -4.580
482 1HD2 ASN 62 HD21 ASN 62 -11.865 -11.570 -3.551
483 2HD2 ASN 62 HD22 ASN 62 -13.030 -12.326 -4.526
484 H LEU 63 HN LEU 63 -17.801 -8.638 -3.720
485 HA LEU 63 HA LEU 63 -15.862 -6.502 -4.122
486 1HB LEU 63 HB2 LEU 63 -16.703 -6.125 -6.505
487 2HB LEU 63 HB1 LEU 63 -15.587 -7.451 -6.313
488 HG LEU 63 HG LEU 63 -18.608 -7.869 -6.435
489 1HD1 LEU 63 HD11 LEU 63 -16.570 -7.945 -8.692
490 2HD1 LEU 63 HD13 LEU 63 -18.258 -8.410 -8.824
491 3HD1 LEU 63 HD12 LEU 63 -17.833 -6.739 -8.496
492 1HD2 LEU 63 HD22 LEU 63 -16.253 -9.738 -7.027
493 2HD2 LEU 63 HD21 LEU 63 -17.241 -9.838 -5.586
494 3HD2 LEU 63 HD23 LEU 63 -17.948 -10.170 -7.138
495 1H MET 1 HT1 MET 1 20.706 2.607 -5.150
496 2H MET 1 HT3 MET 1 21.853 1.461 -4.713
497 3H MET 1 HT2 MET 1 21.895 3.019 -4.034
498 HA MET 1 HA MET 1 23.174 3.758 -5.641
499 1HB MET 1 HB2 MET 1 22.911 0.962 -6.835
500 2HB MET 1 HB1 MET 1 24.084 2.162 -7.332
501 1HG MET 1 HG2 MET 1 25.044 0.534 -5.758
502 2HG MET 1 HG1 MET 1 25.131 2.172 -5.182
503 1HE MET 1 HE3 MET 1 22.796 -0.731 -5.355
504 2HE MET 1 HE2 MET 1 23.856 -1.535 -4.186
505 3HE MET 1 HE1 MET 1 22.229 -1.010 -3.732
506 H THR 2 HN THR 2 20.124 3.524 -6.057
507 HA THR 2 HA THR 2 18.643 4.397 -7.500
508 HB THR 2 HB THR 2 21.031 5.204 -9.286
509 HG1 THR 2 HG1 THR 2 20.287 5.773 -6.655
510 1HG2 THR 2 HG22 THR 2 18.634 5.897 -9.978
511 2HG2 THR 2 HG21 THR 2 18.524 6.754 -8.447
512 3HG2 THR 2 HG23 THR 2 19.715 7.237 -9.634
513 H LYS 3 HN LYS 3 20.108 1.762 -7.777
514 HA LYS 3 HA LYS 3 19.445 1.077 -10.576
515 1HB LYS 3 HB2 LYS 3 20.517 -0.788 -8.368
516 2HB LYS 3 HB1 LYS 3 20.561 -1.070 -10.095
517 1HG LYS 3 HG2 LYS 3 22.014 1.275 -8.887
518 2HG LYS 3 HG1 LYS 3 22.691 -0.321 -8.852
519 1HD LYS 3 HD2 LYS 3 23.627 0.797 -10.762
520 2HD LYS 3 HD1 LYS 3 22.574 -0.475 -11.315
521 1HE LYS 3 HE2 LYS 3 22.394 1.716 -12.581
522 2HE LYS 3 HE1 LYS 3 20.864 1.089 -12.014
523 1HZ LYS 3 HZ1 LYS 3 21.979 2.745 -10.024
524 2HZ LYS 3 HZ3 LYS 3 22.031 3.565 -11.505
525 3HZ LYS 3 HZ2 LYS 3 20.560 2.970 -10.924
526 H GLN 4 HN GLN 4 18.846 -1.541 -8.473
527 HA GLN 4 HA GLN 4 16.032 -1.350 -9.117
528 1HB GLN 4 HB2 GLN 4 17.259 -3.524 -9.249
529 2HB GLN 4 HB1 GLN 4 17.650 -3.400 -7.547
530 1HG GLN 4 HG2 GLN 4 15.831 -4.987 -7.878
531 2HG GLN 4 HG1 GLN 4 15.259 -3.619 -6.947
532 1HE2 GLN 4 HE21 GLN 4 14.112 -3.013 -10.783
533 2HE2 GLN 4 HE22 GLN 4 15.738 -2.926 -10.333
534 H GLU 5 HN GLU 5 18.019 -0.446 -6.484
535 HA GLU 5 HA GLU 5 16.056 -0.849 -4.419
536 1HB GLU 5 HB2 GLU 5 17.622 1.626 -4.035
537 2HB GLU 5 HB1 GLU 5 17.543 0.201 -3.043
538 1HG GLU 5 HG2 GLU 5 19.795 0.280 -3.700
539 2HG GLU 5 HG1 GLU 5 19.093 -0.973 -4.714
540 H LYS 6 HN LYS 6 16.721 1.524 -6.825
541 HA LYS 6 HA LYS 6 14.784 3.421 -5.849
542 1HB LYS 6 HB2 LYS 6 16.740 3.587 -7.749
543 2HB LYS 6 HB1 LYS 6 15.368 3.259 -8.784
544 1HG LYS 6 HG2 LYS 6 15.201 5.571 -8.702
545 2HG LYS 6 HG1 LYS 6 14.199 5.152 -7.332
546 1HD LYS 6 HD2 LYS 6 17.137 5.936 -7.186
547 2HD LYS 6 HD1 LYS 6 15.775 6.944 -6.774
548 1HE LYS 6 HE2 LYS 6 15.164 5.279 -4.971
549 2HE LYS 6 HE1 LYS 6 16.628 4.374 -5.343
550 1HZ LYS 6 HZ1 LYS 6 17.316 7.050 -4.887
551 2HZ LYS 6 HZ3 LYS 6 16.318 6.491 -3.640
552 3HZ LYS 6 HZ2 LYS 6 17.724 5.655 -4.003
553 H THR 7 HN THR 7 14.627 0.584 -7.818
554 HA THR 7 HA THR 7 12.042 1.234 -8.914
555 HB THR 7 HB THR 7 13.155 -1.564 -8.359
556 HG1 THR 7 HG1 THR 7 14.180 0.534 -9.735
557 1HG2 THR 7 HG22 THR 7 10.850 -1.335 -9.488
558 2HG2 THR 7 HG21 THR 7 11.623 -0.391 -10.750
559 3HG2 THR 7 HG23 THR 7 12.052 -2.081 -10.531
560 H ALA 8 HN ALA 8 13.163 -0.673 -6.164
561 HA ALA 8 HA ALA 8 10.563 -1.367 -5.229
562 1HB ALA 8 HB2 ALA 8 12.640 -2.420 -4.312
563 2HB ALA 8 HB1 ALA 8 13.075 -0.884 -3.575
564 3HB ALA 8 HB3 ALA 8 11.645 -1.745 -3.028
565 H LEU 9 HN LEU 9 12.718 1.225 -4.381
566 HA LEU 9 HA LEU 9 11.116 2.483 -2.458
567 1HB LEU 9 HB2 LEU 9 13.456 3.100 -2.819
568 2HB LEU 9 HB1 LEU 9 13.109 3.601 -4.460
569 HG LEU 9 HG LEU 9 11.642 5.011 -2.237
570 1HD1 LEU 9 HD11 LEU 9 14.508 5.540 -3.066
571 2HD1 LEU 9 HD13 LEU 9 13.562 6.545 -1.995
572 3HD1 LEU 9 HD12 LEU 9 14.020 4.920 -1.506
573 1HD2 LEU 9 HD22 LEU 9 12.948 5.948 -4.856
574 2HD2 LEU 9 HD21 LEU 9 11.232 5.646 -4.679
575 3HD2 LEU 9 HD23 LEU 9 11.989 6.943 -3.791
576 H ASN 10 HN ASN 10 11.234 3.090 -5.924
577 HA ASN 10 HA ASN 10 9.241 5.157 -5.772
578 1HB ASN 10 HB2 ASN 10 10.789 4.981 -7.680
579 2HB ASN 10 HB1 ASN 10 10.039 3.453 -8.146
580 1HD2 ASN 10 HD21 ASN 10 7.946 5.439 -10.206
581 2HD2 ASN 10 HD22 ASN 10 9.209 4.311 -10.156
582 H MET 11 HN MET 11 9.070 1.689 -6.294
583 HA MET 11 HA MET 11 6.286 1.752 -7.071
584 1HB MET 11 HB2 MET 11 8.073 -0.433 -6.000
585 2HB MET 11 HB1 MET 11 6.378 -0.712 -6.375
586 1HG MET 11 HG2 MET 11 6.774 0.067 -8.677
587 2HG MET 11 HG1 MET 11 8.431 0.426 -8.298
588 1HE MET 11 HE3 MET 11 5.716 -1.863 -8.544
589 2HE MET 11 HE2 MET 11 6.280 -3.043 -9.706
590 3HE MET 11 HE1 MET 11 6.349 -3.394 -7.964
591 H ALA 12 HN ALA 12 8.010 1.457 -4.008
592 HA ALA 12 HA ALA 12 5.599 0.898 -2.489
593 1HB ALA 12 HB1 ALA 12 8.209 2.180 -1.567
594 2HB ALA 12 HB3 ALA 12 6.968 1.519 -0.513
595 3HB ALA 12 HB2 ALA 12 7.898 0.448 -1.557
596 NH1 ARG 13 NH1 ARG 13 5.352 9.000 -5.631
597 NH2 ARG 13 NH2 ARG 13 5.587 6.932 -6.646
598 H ARG 13 HN ARG 13 7.401 3.618 -3.566
599 HA ARG 13 HA ARG 13 5.887 5.588 -2.091
600 1HB ARG 13 HB2 ARG 13 8.185 5.862 -3.174
601 2HB ARG 13 HB1 ARG 13 7.371 5.950 -4.712
602 1HG ARG 13 HG2 ARG 13 5.967 7.872 -3.468
603 2HG ARG 13 HG1 ARG 13 7.358 7.874 -2.413
604 1HD ARG 13 HD2 ARG 13 7.728 9.457 -4.302
605 2HD ARG 13 HD1 ARG 13 8.895 8.158 -4.345
606 HE ARG 13 HE ARG 13 8.044 7.811 -6.497
607 1HH1 ARG 13 HH12 ARG 13 5.768 9.783 -5.155
608 2HH1 ARG 13 HH11 ARG 13 4.361 9.021 -5.785
609 1HH2 ARG 13 HH22 ARG 13 6.183 6.172 -6.928
610 2HH2 ARG 13 HH21 ARG 13 4.605 6.865 -6.845
611 H PHE 14 HN PHE 14 5.537 3.741 -4.977
612 HA PHE 14 HA PHE 14 3.501 5.467 -6.135
613 1HB PHE 14 HB2 PHE 14 4.991 3.355 -7.154
614 2HB PHE 14 HB1 PHE 14 3.404 2.623 -6.911
615 HD1 PHE 14 HD2 PHE 14 1.385 3.724 -7.940
616 HD2 PHE 14 HD1 PHE 14 5.343 5.055 -8.780
617 HE1 PHE 14 HE2 PHE 14 0.557 4.967 -9.890
618 HE2 PHE 14 HE1 PHE 14 4.512 6.295 -10.728
619 HZ PHE 14 HZ PHE 14 2.119 6.254 -11.287
620 H ILE 15 HN ILE 15 3.678 2.708 -3.988
621 HA ILE 15 HA ILE 15 0.890 2.119 -3.999
622 HB ILE 15 HB ILE 15 3.039 1.897 -1.834
623 1HG1 ILE 15 HG12 ILE 15 1.536 -0.156 -3.490
624 2HG1 ILE 15 HG11 ILE 15 3.189 0.365 -3.758
625 1HG2 ILE 15 HG21 ILE 15 0.158 0.994 -1.571
626 2HG2 ILE 15 HG23 ILE 15 1.437 0.635 -0.428
627 3HG2 ILE 15 HG22 ILE 15 0.914 2.280 -0.656
628 1HD1 ILE 15 HD2 ILE 15 3.826 -0.521 -1.530
629 2HD1 ILE 15 HD1 ILE 15 2.174 -1.069 -1.273
630 3HD1 ILE 15 HD3 ILE 15 3.128 -1.766 -2.557
631 NH1 ARG 16 NH1 ARG 16 4.612 9.245 -0.923
632 NH2 ARG 16 NH2 ARG 16 6.470 8.696 0.341
633 H ARG 16 HN ARG 16 2.930 4.294 -2.122
634 HA ARG 16 HA ARG 16 0.873 5.498 -0.622
635 1HB ARG 16 HB2 ARG 16 3.497 6.582 -1.676
636 2HB ARG 16 HB1 ARG 16 2.433 7.543 -0.673
637 1HG ARG 16 HG2 ARG 16 2.509 5.897 1.099
638 2HG ARG 16 HG1 ARG 16 3.344 4.750 0.066
639 1HD ARG 16 HD2 ARG 16 4.808 6.001 1.685
640 2HD ARG 16 HD1 ARG 16 5.354 6.165 0.023
641 HE ARG 16 HE ARG 16 3.816 8.244 1.514
642 1HH1 ARG 16 HH12 ARG 16 3.631 9.163 -1.102
643 2HH1 ARG 16 HH11 ARG 16 5.161 9.827 -1.529
644 1HH2 ARG 16 HH22 ARG 16 6.861 8.194 1.118
645 2HH2 ARG 16 HH21 ARG 16 7.088 9.253 -0.222
646 H SER 17 HN SER 17 1.929 6.124 -3.922
647 HA SER 17 HA SER 17 0.371 8.511 -4.220
648 1HB SER 17 HB2 SER 17 1.090 6.494 -6.417
649 2HB SER 17 HB1 SER 17 0.794 8.228 -6.604
650 HG SER 17 HG1 SER 17 2.603 7.740 -4.644
651 H GLN 18 HN GLN 18 -0.301 5.189 -5.268
652 HA GLN 18 HA GLN 18 -2.938 5.607 -6.144
653 1HB GLN 18 HB2 GLN 18 -1.856 3.107 -4.765
654 2HB GLN 18 HB1 GLN 18 -3.283 3.191 -5.777
655 1HG GLN 18 HG2 GLN 18 -1.944 3.740 -7.727
656 2HG GLN 18 HG1 GLN 18 -0.485 3.870 -6.743
657 1HE2 GLN 18 HE21 GLN 18 -2.034 0.169 -7.564
658 2HE2 GLN 18 HE22 GLN 18 -2.975 1.550 -7.851
659 H THR 19 HN THR 19 -1.904 4.258 -3.117
660 HA THR 19 HA THR 19 -4.323 4.145 -1.780
661 HB THR 19 HB THR 19 -1.547 4.700 -0.593
662 HG1 THR 19 HG1 THR 19 -1.187 2.868 -1.561
663 1HG2 THR 19 HG21 THR 19 -3.924 3.027 0.425
664 2HG2 THR 19 HG23 THR 19 -2.402 3.280 1.270
665 3HG2 THR 19 HG22 THR 19 -3.523 4.614 1.066
666 H LEU 20 HN LEU 20 -2.255 6.951 -2.315
667 HA LEU 20 HA LEU 20 -3.597 8.510 -0.293
668 1HB LEU 20 HB2 LEU 20 -1.393 9.232 -1.185
669 2HB LEU 20 HB1 LEU 20 -2.087 9.405 -2.788
670 HG LEU 20 HG LEU 20 -3.563 11.226 -1.987
671 1HD1 LEU 20 HD11 LEU 20 -2.181 10.814 0.709
672 2HD1 LEU 20 HD13 LEU 20 -3.290 12.115 0.317
673 3HD1 LEU 20 HD12 LEU 20 -3.872 10.470 0.385
674 1HD2 LEU 20 HD21 LEU 20 -1.297 11.792 -2.796
675 2HD2 LEU 20 HD23 LEU 20 -1.803 12.896 -1.529
676 3HD2 LEU 20 HD22 LEU 20 -0.659 11.613 -1.169
677 H THR 21 HN THR 21 -3.910 8.249 -3.823
678 HA THR 21 HA THR 21 -6.161 10.070 -3.857
679 HB THR 21 HB THR 21 -5.561 7.957 -5.986
680 HG1 THR 21 HG1 THR 21 -3.991 9.893 -4.831
681 1HG2 THR 21 HG22 THR 21 -7.440 9.723 -6.303
682 2HG2 THR 21 HG21 THR 21 -6.220 10.965 -6.098
683 3HG2 THR 21 HG23 THR 21 -6.143 9.878 -7.477
684 H LEU 22 HN LEU 22 -5.706 6.773 -3.088
685 HA LEU 22 HA LEU 22 -8.420 5.960 -3.674
686 1HB LEU 22 HB2 LEU 22 -6.522 4.296 -3.376
687 2HB LEU 22 HB1 LEU 22 -6.429 4.780 -1.690
688 HG LEU 22 HG LEU 22 -8.779 4.019 -1.326
689 1HD1 LEU 22 HD11 LEU 22 -8.566 2.953 -4.178
690 2HD1 LEU 22 HD13 LEU 22 -9.874 2.621 -3.055
691 3HD1 LEU 22 HD12 LEU 22 -9.638 4.244 -3.660
692 1HD2 LEU 22 HD21 LEU 22 -6.874 2.518 -0.854
693 2HD2 LEU 22 HD23 LEU 22 -8.266 1.607 -1.411
694 3HD2 LEU 22 HD22 LEU 22 -6.922 1.915 -2.504
695 H LEU 23 HN LEU 23 -6.585 7.049 -0.921
696 HA LEU 23 HA LEU 23 -8.543 6.876 1.092
697 1HB LEU 23 HB2 LEU 23 -6.029 7.618 1.221
698 2HB LEU 23 HB1 LEU 23 -6.625 9.212 0.819
699 HG LEU 23 HG LEU 23 -7.679 7.652 3.203
700 1HD1 LEU 23 HD12 LEU 23 -5.474 9.750 3.106
701 2HD1 LEU 23 HD11 LEU 23 -6.183 9.052 4.543
702 3HD1 LEU 23 HD13 LEU 23 -5.240 8.045 3.467
703 1HD2 LEU 23 HD22 LEU 23 -7.754 10.614 2.492
704 2HD2 LEU 23 HD21 LEU 23 -9.134 9.527 2.481
705 3HD2 LEU 23 HD23 LEU 23 -8.341 9.911 3.984
706 H GLU 24 HN GLU 24 -7.715 9.478 -1.063
707 HA GLU 24 HA GLU 24 -9.659 11.365 -0.423
708 1HB GLU 24 HB2 GLU 24 -7.767 11.546 -2.133
709 2HB GLU 24 HB1 GLU 24 -8.728 10.550 -3.198
710 1HG GLU 24 HG2 GLU 24 -10.516 12.375 -3.115
711 2HG GLU 24 HG1 GLU 24 -9.348 13.334 -2.217
712 H LYS 25 HN LYS 25 -9.916 8.913 -2.940
713 HA LYS 25 HA LYS 25 -12.681 9.331 -3.445
714 1HB LYS 25 HB2 LYS 25 -11.016 6.807 -3.758
715 2HB LYS 25 HB1 LYS 25 -12.581 7.075 -4.504
716 1HG LYS 25 HG2 LYS 25 -10.264 9.026 -4.923
717 2HG LYS 25 HG1 LYS 25 -10.482 7.628 -5.950
718 1HD LYS 25 HD2 LYS 25 -12.142 8.619 -7.091
719 2HD LYS 25 HD1 LYS 25 -12.993 9.094 -5.641
720 1HE LYS 25 HE2 LYS 25 -10.536 10.520 -6.819
721 2HE LYS 25 HE1 LYS 25 -12.195 11.085 -6.980
722 1HZ LYS 25 HZ1 LYS 25 -11.731 10.699 -4.270
723 2HZ LYS 25 HZ3 LYS 25 -10.407 11.553 -4.895
724 3HZ LYS 25 HZ2 LYS 25 -11.975 12.127 -5.112
725 H LEU 26 HN LEU 26 -11.122 7.471 -0.915
726 HA LEU 26 HA LEU 26 -13.512 5.970 -0.325
727 1HB LEU 26 HB2 LEU 26 -11.136 6.756 1.445
728 2HB LEU 26 HB1 LEU 26 -12.451 5.770 2.024
729 HG LEU 26 HG LEU 26 -10.813 5.018 -0.441
730 1HD1 LEU 26 HD11 LEU 26 -10.495 4.093 2.448
731 2HD1 LEU 26 HD13 LEU 26 -9.627 3.427 1.073
732 3HD1 LEU 26 HD12 LEU 26 -9.346 5.078 1.578
733 1HD2 LEU 26 HD22 LEU 26 -12.654 3.389 1.356
734 2HD2 LEU 26 HD21 LEU 26 -13.051 3.935 -0.265
735 3HD2 LEU 26 HD23 LEU 26 -11.761 2.777 -0.025
736 H ASN 27 HN ASN 27 -12.136 9.021 0.764
737 HA ASN 27 HA ASN 27 -14.121 9.606 2.693
738 1HB ASN 27 HB2 ASN 27 -12.659 11.548 0.854
739 2HB ASN 27 HB1 ASN 27 -13.606 12.023 2.254
740 1HD2 ASN 27 HD21 ASN 27 -11.199 10.250 4.475
741 2HD2 ASN 27 HD22 ASN 27 -12.865 10.136 4.183
742 H GLU 28 HN GLU 28 -14.025 10.178 -0.762
743 HA GLU 28 HA GLU 28 -16.486 11.615 -0.865
744 1HB GLU 28 HB2 GLU 28 -15.200 9.836 -2.968
745 2HB GLU 28 HB1 GLU 28 -16.425 11.056 -3.283
746 1HG GLU 28 HG2 GLU 28 -14.955 12.824 -2.372
747 2HG GLU 28 HG1 GLU 28 -13.694 11.648 -2.042
748 H LEU 29 HN LEU 29 -15.732 8.212 -0.873
749 HA LEU 29 HA LEU 29 -18.577 7.522 -1.280
750 1HB LEU 29 HB2 LEU 29 -15.987 5.969 -1.096
751 2HB LEU 29 HB1 LEU 29 -17.504 5.126 -0.895
752 HG LEU 29 HG LEU 29 -18.286 5.769 -3.103
753 1HD1 LEU 29 HD11 LEU 29 -15.745 7.421 -3.433
754 2HD1 LEU 29 HD13 LEU 29 -16.951 7.131 -4.668
755 3HD1 LEU 29 HD12 LEU 29 -17.362 8.085 -3.264
756 1HD2 LEU 29 HD22 LEU 29 -15.376 4.905 -3.241
757 2HD2 LEU 29 HD21 LEU 29 -16.759 3.839 -3.037
758 3HD2 LEU 29 HD23 LEU 29 -16.552 4.722 -4.534
759 H ASP 30 HN ASP 30 -17.649 8.995 1.067
760 HA ASP 30 HA ASP 30 -17.930 9.077 3.358
761 1HB ASP 30 HB2 ASP 30 -20.035 6.943 2.796
762 2HB ASP 30 HB1 ASP 30 -19.920 7.914 4.263
763 H ALA 31 HN ALA 31 -16.254 6.900 2.123
764 HA ALA 31 HA ALA 31 -16.385 4.820 4.187
765 1HB ALA 31 HB2 ALA 31 -15.953 4.144 1.858
766 2HB ALA 31 HB1 ALA 31 -14.488 5.113 1.844
767 3HB ALA 31 HB3 ALA 31 -14.604 3.710 2.893
768 H ASP 32 HN ASP 32 -15.868 7.143 5.377
769 HA ASP 32 HA ASP 32 -13.126 7.900 5.540
770 1HB ASP 32 HB2 ASP 32 -15.312 8.151 7.636
771 2HB ASP 32 HB1 ASP 32 -13.724 8.890 7.758
772 H GLU 33 HN GLU 33 -14.974 5.437 7.161
773 HA GLU 33 HA GLU 33 -13.102 4.870 9.233
774 1HB GLU 33 HB2 GLU 33 -14.361 2.525 7.807
775 2HB GLU 33 HB1 GLU 33 -14.192 2.799 9.523
776 1HG GLU 33 HG2 GLU 33 -16.441 3.214 9.416
777 2HG GLU 33 HG1 GLU 33 -15.963 4.809 8.836
778 H GLN 34 HN GLN 34 -13.504 3.638 5.984
779 HA GLN 34 HA GLN 34 -11.074 2.111 5.978
780 1HB GLN 34 HB2 GLN 34 -12.751 3.262 3.732
781 2HB GLN 34 HB1 GLN 34 -11.255 2.411 3.415
782 1HG GLN 34 HG2 GLN 34 -13.308 0.975 3.272
783 2HG GLN 34 HG1 GLN 34 -12.058 0.365 4.347
784 1HE2 GLN 34 HE21 GLN 34 -15.470 1.922 6.038
785 2HE2 GLN 34 HE22 GLN 34 -14.960 2.541 4.549
786 H ALA 35 HN ALA 35 -11.744 5.481 5.599
787 HA ALA 35 HA ALA 35 -9.268 6.058 4.209
788 1HB ALA 35 HB2 ALA 35 -11.131 7.741 4.258
789 2HB ALA 35 HB1 ALA 35 -10.880 7.928 5.994
790 3HB ALA 35 HB3 ALA 35 -9.619 8.392 4.880
791 H ASP 36 HN ASP 36 -10.283 5.919 7.601
792 HA ASP 36 HA ASP 36 -7.871 6.957 8.716
793 1HB ASP 36 HB2 ASP 36 -9.557 4.703 9.907
794 2HB ASP 36 HB1 ASP 36 -8.468 5.775 10.778
795 H ILE 37 HN ILE 37 -9.020 3.786 8.007
796 HA ILE 37 HA ILE 37 -6.684 2.333 8.669
797 HB ILE 37 HB ILE 37 -8.803 1.761 6.529
798 1HG1 ILE 37 HG12 ILE 37 -8.624 0.920 9.462
799 2HG1 ILE 37 HG11 ILE 37 -9.690 2.171 8.876
800 1HG2 ILE 37 HG22 ILE 37 -6.774 0.299 6.336
801 2HG2 ILE 37 HG21 ILE 37 -6.983 -0.147 8.020
802 3HG2 ILE 37 HG23 ILE 37 -8.176 -0.623 6.827
803 1HD1 ILE 37 HD2 ILE 37 -10.842 0.501 7.419
804 2HD1 ILE 37 HD1 ILE 37 -9.814 -0.767 8.072
805 3HD1 ILE 37 HD3 ILE 37 -10.926 0.085 9.118
806 H CYS 38 HN CYS 38 -7.631 4.128 5.840
807 HA CYS 38 HA CYS 38 -5.442 3.163 4.211
808 1HB CYS 38 HB2 CYS 38 -7.588 4.221 3.352
809 2HB CYS 38 HB1 CYS 38 -6.966 5.750 3.923
810 HG CYS 38 HG1 CYS 38 -6.082 4.327 1.364
811 H GLU 39 HN GLU 39 -5.859 5.780 6.521
812 HA GLU 39 HA GLU 39 -3.497 7.201 5.693
813 1HB GLU 39 HB2 GLU 39 -4.876 7.056 8.426
814 2HB GLU 39 HB1 GLU 39 -3.532 8.116 8.086
815 1HG GLU 39 HG2 GLU 39 -6.065 8.227 6.442
816 2HG GLU 39 HG1 GLU 39 -5.912 9.113 7.944
817 H SER 40 HN SER 40 -4.207 4.918 8.269
818 HA SER 40 HA SER 40 -1.529 4.663 9.173
819 1HB SER 40 HB2 SER 40 -3.697 2.513 9.190
820 2HB SER 40 HB1 SER 40 -2.366 2.697 10.350
821 HG SER 40 HG1 SER 40 -3.601 5.052 10.059
822 H LEU 41 HN LEU 41 -3.290 3.139 6.564
823 HA LEU 41 HA LEU 41 -1.271 1.162 6.057
824 1HB LEU 41 HB2 LEU 41 -3.679 1.177 5.140
825 2HB LEU 41 HB1 LEU 41 -3.146 2.407 4.019
826 HG LEU 41 HG LEU 41 -1.390 0.851 3.126
827 1HD1 LEU 41 HD11 LEU 41 -2.816 -1.210 4.863
828 2HD1 LEU 41 HD13 LEU 41 -1.562 -1.558 3.683
829 3HD1 LEU 41 HD12 LEU 41 -1.176 -0.643 5.120
830 1HD2 LEU 41 HD21 LEU 41 -3.591 1.070 2.009
831 2HD2 LEU 41 HD23 LEU 41 -2.970 -0.564 1.860
832 3HD2 LEU 41 HD22 LEU 41 -4.238 -0.210 3.025
833 H HIS 42 HN HIS 42 -1.923 4.349 4.953
834 HA HIS 42 HA HIS 42 0.052 4.489 2.895
835 1HB HIS 42 HB2 HIS 42 -1.781 6.223 3.300
836 2HB HIS 42 HB1 HIS 42 -0.834 6.813 4.658
837 HD1 HIS 42 HD1 HIS 42 -1.110 7.256 1.108
838 HD2 HIS 42 HD2 HIS 42 1.940 7.614 3.819
839 HE1 HIS 42 HE1 HIS 42 0.645 8.587 0.019
840 H ASP 43 HN ASP 43 0.160 5.631 6.225
841 HA ASP 43 HA ASP 43 2.879 6.415 6.283
842 1HB ASP 43 HB2 ASP 43 1.365 6.961 8.156
843 2HB ASP 43 HB1 ASP 43 1.195 5.248 8.529
844 H HIS 44 HN HIS 44 1.358 3.402 7.105
845 HA HIS 44 HA HIS 44 3.735 2.038 7.869
846 1HB HIS 44 HB2 HIS 44 1.314 1.331 8.290
847 2HB HIS 44 HB1 HIS 44 1.252 0.809 6.609
848 HD1 HIS 44 HD1 HIS 44 1.050 -1.678 7.357
849 HD2 HIS 44 HD2 HIS 44 4.503 0.061 8.698
850 HE1 HIS 44 HE1 HIS 44 2.477 -3.498 8.189
851 H ALA 45 HN ALA 45 2.206 2.664 4.812
852 HA ALA 45 HA ALA 45 3.952 0.821 3.358
853 1HB ALA 45 HB2 ALA 45 1.695 1.438 2.413
854 2HB ALA 45 HB1 ALA 45 2.240 3.106 2.285
855 3HB ALA 45 HB3 ALA 45 3.001 1.858 1.313
856 H ASP 46 HN ASP 46 3.988 3.987 4.546
857 HA ASP 46 HA ASP 46 6.041 4.907 2.701
858 1HB ASP 46 HB2 ASP 46 4.317 6.389 4.044
859 2HB ASP 46 HB1 ASP 46 5.381 6.104 5.407
860 H GLU 47 HN GLU 47 5.967 2.832 5.338
861 HA GLU 47 HA GLU 47 8.596 3.568 6.324
862 1HB GLU 47 HB2 GLU 47 6.932 1.023 6.464
863 2HB GLU 47 HB1 GLU 47 8.567 1.088 7.105
864 1HG GLU 47 HG2 GLU 47 6.482 3.140 7.907
865 2HG GLU 47 HG1 GLU 47 6.712 1.627 8.797
866 H LEU 48 HN LEU 48 7.249 1.477 3.918
867 HA LEU 48 HA LEU 48 9.714 0.251 3.102
868 1HB LEU 48 HB2 LEU 48 7.109 0.735 1.621
869 2HB LEU 48 HB1 LEU 48 8.469 -0.082 0.885
870 HG LEU 48 HG LEU 48 8.401 -1.850 2.596
871 1HD1 LEU 48 HD11 LEU 48 6.017 -0.354 3.764
872 2HD1 LEU 48 HD13 LEU 48 6.533 -1.971 4.218
873 3HD1 LEU 48 HD12 LEU 48 7.568 -0.607 4.552
874 1HD2 LEU 48 HD22 LEU 48 5.681 -1.286 1.360
875 2HD2 LEU 48 HD21 LEU 48 7.014 -2.112 0.572
876 3HD2 LEU 48 HD23 LEU 48 6.216 -2.853 1.949
877 OH TYR 49 OH TYR 49 10.425 9.550 -2.176
878 H TYR 49 HN TYR 49 8.733 3.380 3.019
879 HA TYR 49 HA TYR 49 10.422 4.023 0.651
880 1HB TYR 49 HB2 TYR 49 7.967 4.856 0.830
881 2HB TYR 49 HB1 TYR 49 8.485 5.774 2.217
882 HD1 TYR 49 HD2 TYR 49 9.414 5.232 -1.342
883 HD2 TYR 49 HD1 TYR 49 9.193 7.988 1.890
884 HE1 TYR 49 HE2 TYR 49 10.098 7.030 -2.833
885 HE2 TYR 49 HE1 TYR 49 9.880 9.796 0.395
886 HH TYR 49 HH TYR 49 11.368 9.689 -2.045
887 NH1 ARG 50 NH1 ARG 50 5.772 7.418 7.234
888 NH2 ARG 50 NH2 ARG 50 6.280 5.753 8.740
889 H ARG 50 HN ARG 50 9.540 5.841 3.539
890 HA ARG 50 HA ARG 50 11.799 7.048 4.296
891 1HB ARG 50 HB2 ARG 50 9.997 5.528 6.215
892 2HB ARG 50 HB1 ARG 50 11.100 6.807 6.666
893 1HG ARG 50 HG2 ARG 50 9.853 8.405 5.252
894 2HG ARG 50 HG1 ARG 50 8.751 7.144 4.747
895 1HD ARG 50 HD2 ARG 50 9.176 8.017 7.649
896 2HD ARG 50 HD1 ARG 50 7.819 8.502 6.651
897 HE ARG 50 HE ARG 50 8.260 5.588 7.116
898 1HH1 ARG 50 HH12 ARG 50 6.034 8.011 6.471
899 2HH1 ARG 50 HH11 ARG 50 4.844 7.511 7.598
900 1HH2 ARG 50 HH22 ARG 50 6.933 5.091 9.117
901 2HH2 ARG 50 HH21 ARG 50 5.361 5.789 9.150
902 H SER 51 HN SER 51 11.118 3.990 5.919
903 HA SER 51 HA SER 51 13.715 3.780 6.975
904 1HB SER 51 HB2 SER 51 11.775 1.549 6.290
905 2HB SER 51 HB1 SER 51 12.922 1.593 7.655
906 HG SER 51 HG1 SER 51 10.603 2.470 7.926
907 H CYS 52 HN CYS 52 12.404 2.720 3.852
908 HA CYS 52 HA CYS 52 14.804 1.220 3.239
909 1HB CYS 52 HB2 CYS 52 12.748 2.459 1.391
910 2HB CYS 52 HB1 CYS 52 14.098 1.514 0.849
911 HG CYS 52 HG1 CYS 52 12.952 -0.596 1.497
912 H LEU 53 HN LEU 53 13.906 4.586 3.062
913 HA LEU 53 HA LEU 53 15.922 5.414 1.216
914 1HB LEU 53 HB2 LEU 53 15.202 7.013 3.715
915 2HB LEU 53 HB1 LEU 53 15.851 7.632 2.218
916 HG LEU 53 HG LEU 53 13.057 6.480 2.554
917 1HD1 LEU 53 HD11 LEU 53 14.000 9.343 2.149
918 2HD1 LEU 53 HD13 LEU 53 12.323 8.827 2.213
919 3HD1 LEU 53 HD12 LEU 53 13.339 8.692 3.640
920 1HD2 LEU 53 HD21 LEU 53 13.998 6.132 0.281
921 2HD2 LEU 53 HD23 LEU 53 12.675 7.285 0.258
922 3HD2 LEU 53 HD22 LEU 53 14.333 7.854 0.171
923 H ALA 54 HN ALA 54 15.712 4.792 4.614
924 HA ALA 54 HA ALA 54 18.481 5.495 5.130
925 1HB ALA 54 HB2 ALA 54 16.840 5.427 6.964
926 2HB ALA 54 HB1 ALA 54 16.667 3.685 6.741
927 3HB ALA 54 HB3 ALA 54 18.201 4.351 7.278
928 NH1 ARG 55 NH2 ARG 55 17.594 -3.469 7.599
929 NH2 ARG 55 NH1 ARG 55 18.970 -4.514 6.078
930 H ARG 55 HN ARG 55 16.879 2.483 4.273
931 HA ARG 55 HA ARG 55 19.292 0.943 4.809
932 1HB ARG 55 HB2 ARG 55 16.772 0.224 3.260
933 2HB ARG 55 HB1 ARG 55 18.066 -0.905 3.583
934 1HG ARG 55 HG2 ARG 55 16.675 0.610 5.829
935 2HG ARG 55 HG1 ARG 55 16.070 -0.925 5.255
936 1HD ARG 55 HD2 ARG 55 18.937 -0.501 6.254
937 2HD ARG 55 HD1 ARG 55 17.655 -1.115 7.257
938 HE ARG 55 HE ARG 55 18.437 -2.508 4.721
939 1HH1 ARG 55 HH22 ARG 55 17.064 -2.676 7.910
940 2HH1 ARG 55 HH21 ARG 55 17.586 -4.283 8.191
941 1HH2 ARG 55 HH12 ARG 55 19.495 -4.497 5.221
942 2HH2 ARG 55 HH11 ARG 55 19.008 -5.367 6.610
943 H PHE 56 HN PHE 56 18.214 2.814 2.139
944 HA PHE 56 HA PHE 56 20.187 1.393 0.395
945 1HB PHE 56 HB2 PHE 56 18.039 3.404 -0.357
946 2HB PHE 56 HB1 PHE 56 19.061 2.524 -1.473
947 HD1 PHE 56 HD1 PHE 56 18.762 -0.130 0.463
948 HD2 PHE 56 HD2 PHE 56 16.093 2.534 -1.540
949 HE1 PHE 56 HE1 PHE 56 17.079 -1.878 0.383
950 HE2 PHE 56 HE2 PHE 56 14.401 0.761 -1.626
951 HZ PHE 56 HZ PHE 56 14.889 -1.458 -0.663
952 H GLY 57 HN GLY 57 19.123 4.666 1.275
953 1HA GLY 57 HA2 GLY 57 20.513 6.464 1.837
954 2HA GLY 57 HA1 GLY 57 21.919 5.478 1.474
955 H ASP 58 HN ASP 58 20.448 5.017 -1.313
956 HA ASP 58 HA ASP 58 21.721 7.443 -2.504
957 1HB ASP 58 HB2 ASP 58 21.463 6.314 -4.680
958 2HB ASP 58 HB1 ASP 58 22.228 5.187 -3.557
959 H ASP 59 HN ASP 59 19.222 7.364 -0.993
960 HA ASP 59 HA ASP 59 17.243 7.954 -3.098
961 1HB ASP 59 HB2 ASP 59 16.669 7.874 -0.157
962 2HB ASP 59 HB1 ASP 59 15.606 7.475 -1.514
963 H GLY 60 HN GLY 60 16.774 9.787 -3.677
964 1HA GLY 60 HA2 GLY 60 16.968 12.076 -1.790
965 2HA GLY 60 HA1 GLY 60 17.658 12.191 -3.429
966 H GLU 61 HN GLU 61 15.094 10.042 -3.297
967 HA GLU 61 HA GLU 61 13.408 11.883 -4.824
968 1HB GLU 61 HB2 GLU 61 12.705 9.087 -3.823
969 2HB GLU 61 HB1 GLU 61 11.923 9.951 -5.124
970 1HG GLU 61 HG2 GLU 61 13.371 8.352 -6.202
971 2HG GLU 61 HG1 GLU 61 14.178 9.909 -6.366
972 H ASN 62 HN ASN 62 11.487 12.747 -3.997
973 HA ASN 62 HA ASN 62 10.734 12.052 -1.220
974 1HB ASN 62 HB2 ASN 62 11.429 14.882 -2.119
975 2HB ASN 62 HB1 ASN 62 10.555 14.494 -0.645
976 1HD2 ASN 62 HD21 ASN 62 14.557 13.573 -0.829
977 2HD2 ASN 62 HD22 ASN 62 13.706 13.770 -2.279
978 H LEU 63 HN LEU 63 8.960 11.149 -2.434
979 HA LEU 63 HA LEU 63 6.810 13.080 -2.728
980 1HB LEU 63 HB2 LEU 63 8.112 12.985 -5.030
981 2HB LEU 63 HB1 LEU 63 7.514 11.346 -5.151
982 HG LEU 63 HG LEU 63 5.140 12.257 -4.977
983 1HD1 LEU 63 HD11 LEU 63 6.552 14.935 -5.262
984 2HD1 LEU 63 HD13 LEU 63 4.816 14.675 -5.339
985 3HD1 LEU 63 HD12 LEU 63 5.675 14.403 -3.840
986 1HD2 LEU 63 HD22 LEU 63 6.837 13.356 -7.245
987 2HD2 LEU 63 HD21 LEU 63 6.170 11.732 -7.168
988 3HD2 LEU 63 HD23 LEU 63 5.097 13.115 -7.284
Start of MODEL 5
Raw file had 988 H/Q atoms
Start of MODEL 5
1 1H MET 1 HT1 MET 1 -20.585 3.453 -0.736
2 2H MET 1 HT3 MET 1 -21.348 2.745 0.585
3 3H MET 1 HT2 MET 1 -20.457 1.779 -0.502
4 HA MET 1 HA MET 1 -22.222 1.494 -1.805
5 1HB MET 1 HB2 MET 1 -23.645 3.433 0.061
6 2HB MET 1 HB1 MET 1 -24.430 2.388 -1.108
7 1HG MET 1 HG2 MET 1 -24.603 1.343 1.059
8 2HG MET 1 HG1 MET 1 -23.532 0.406 0.056
9 1HE MET 1 HE1 MET 1 -23.228 3.547 2.347
10 2HE MET 1 HE3 MET 1 -24.075 2.320 3.319
11 3HE MET 1 HE2 MET 1 -22.458 2.850 3.751
12 H THR 2 HN THR 2 -20.431 3.170 -2.802
13 HA THR 2 HA THR 2 -22.094 5.378 -3.893
14 HB THR 2 HB THR 2 -19.151 5.820 -3.477
15 HG1 THR 2 HG1 THR 2 -20.398 5.995 -1.140
16 1HG2 THR 2 HG22 THR 2 -20.967 7.650 -4.018
17 2HG2 THR 2 HG21 THR 2 -21.682 7.253 -2.464
18 3HG2 THR 2 HG23 THR 2 -20.066 7.936 -2.538
19 H LYS 3 HN LYS 3 -19.598 6.125 -5.400
20 HA LYS 3 HA LYS 3 -20.359 4.699 -7.786
21 1HB LYS 3 HB2 LYS 3 -17.822 6.309 -7.683
22 2HB LYS 3 HB1 LYS 3 -18.988 6.145 -8.970
23 1HG LYS 3 HG2 LYS 3 -20.655 7.427 -7.587
24 2HG LYS 3 HG1 LYS 3 -19.410 7.711 -6.385
25 1HD LYS 3 HD2 LYS 3 -19.321 8.609 -9.289
26 2HD LYS 3 HD1 LYS 3 -19.597 9.649 -7.911
27 1HE LYS 3 HE2 LYS 3 -17.011 8.116 -8.530
28 2HE LYS 3 HE1 LYS 3 -17.253 9.847 -8.600
29 1HZ LYS 3 HZ1 LYS 3 -17.949 9.053 -6.013
30 2HZ LYS 3 HZ3 LYS 3 -16.468 8.328 -6.397
31 3HZ LYS 3 HZ2 LYS 3 -16.651 9.976 -6.511
32 H GLN 4 HN GLN 4 -17.069 5.021 -6.518
33 HA GLN 4 HA GLN 4 -16.362 2.619 -8.015
34 1HB GLN 4 HB2 GLN 4 -14.034 3.144 -7.362
35 2HB GLN 4 HB1 GLN 4 -14.833 4.519 -8.081
36 1HG GLN 4 HG2 GLN 4 -14.450 4.125 -5.097
37 2HG GLN 4 HG1 GLN 4 -13.372 5.025 -6.133
38 1HE2 GLN 4 HE21 GLN 4 -16.021 7.194 -4.437
39 2HE2 GLN 4 HE22 GLN 4 -15.127 5.902 -3.817
40 H GLU 5 HN GLU 5 -18.038 1.632 -6.182
41 HA GLU 5 HA GLU 5 -16.812 0.869 -3.707
42 1HB GLU 5 HB2 GLU 5 -18.926 -0.644 -5.347
43 2HB GLU 5 HB1 GLU 5 -18.556 -0.881 -3.649
44 1HG GLU 5 HG2 GLU 5 -19.281 1.896 -4.458
45 2HG GLU 5 HG1 GLU 5 -20.565 0.692 -4.448
46 H LYS 6 HN LYS 6 -17.523 -1.333 -6.355
47 HA LYS 6 HA LYS 6 -15.508 -3.168 -5.503
48 1HB LYS 6 HB2 LYS 6 -15.787 -4.338 -7.594
49 2HB LYS 6 HB1 LYS 6 -17.372 -3.854 -7.013
50 1HG LYS 6 HG2 LYS 6 -17.634 -2.211 -8.648
51 2HG LYS 6 HG1 LYS 6 -15.939 -1.947 -8.904
52 1HD LYS 6 HD2 LYS 6 -16.273 -4.623 -9.662
53 2HD LYS 6 HD1 LYS 6 -17.744 -3.831 -10.206
54 1HE LYS 6 HE2 LYS 6 -15.884 -3.639 -11.900
55 2HE LYS 6 HE1 LYS 6 -16.448 -2.068 -11.346
56 1HZ LYS 6 HZ1 LYS 6 -14.380 -2.966 -9.637
57 2HZ LYS 6 HZ3 LYS 6 -13.862 -3.091 -11.233
58 3HZ LYS 6 HZ2 LYS 6 -14.426 -1.603 -10.643
59 H THR 7 HN THR 7 -15.247 -0.322 -7.478
60 HA THR 7 HA THR 7 -12.825 -1.316 -8.746
61 HB THR 7 HB THR 7 -13.790 1.583 -8.618
62 HG1 THR 7 HG1 THR 7 -15.483 0.801 -9.606
63 1HG2 THR 7 HG21 THR 7 -12.576 -0.166 -10.851
64 2HG2 THR 7 HG23 THR 7 -12.875 1.564 -10.935
65 3HG2 THR 7 HG22 THR 7 -11.611 0.942 -9.891
66 H ALA 8 HN ALA 8 -13.605 0.754 -5.967
67 HA ALA 8 HA ALA 8 -10.818 1.415 -5.520
68 1HB ALA 8 HB1 ALA 8 -13.093 1.222 -3.505
69 2HB ALA 8 HB3 ALA 8 -11.551 2.020 -3.225
70 3HB ALA 8 HB2 ALA 8 -12.673 2.676 -4.411
71 H LEU 9 HN LEU 9 -13.051 -1.060 -4.723
72 HA LEU 9 HA LEU 9 -11.567 -2.485 -2.799
73 1HB LEU 9 HB2 LEU 9 -14.006 -2.860 -3.623
74 2HB LEU 9 HB1 LEU 9 -13.304 -3.784 -4.934
75 HG LEU 9 HG LEU 9 -12.112 -5.185 -3.189
76 1HD1 LEU 9 HD11 LEU 9 -14.142 -3.824 -1.374
77 2HD1 LEU 9 HD13 LEU 9 -13.129 -5.184 -0.942
78 3HD1 LEU 9 HD12 LEU 9 -12.402 -3.627 -1.267
79 1HD2 LEU 9 HD21 LEU 9 -14.099 -5.979 -4.437
80 2HD2 LEU 9 HD23 LEU 9 -14.117 -6.566 -2.784
81 3HD2 LEU 9 HD22 LEU 9 -15.154 -5.226 -3.250
82 H ASN 10 HN ASN 10 -11.873 -3.345 -6.251
83 HA ASN 10 HA ASN 10 -9.697 -5.163 -6.125
84 1HB ASN 10 HB2 ASN 10 -9.649 -4.977 -8.652
85 2HB ASN 10 HB1 ASN 10 -11.210 -5.397 -7.984
86 1HD2 ASN 10 HD21 ASN 10 -10.918 -1.553 -9.427
87 2HD2 ASN 10 HD22 ASN 10 -9.613 -2.162 -8.543
88 H MET 11 HN MET 11 -9.667 -1.696 -6.374
89 HA MET 11 HA MET 11 -6.915 -1.758 -7.429
90 1HB MET 11 HB2 MET 11 -8.678 0.501 -6.438
91 2HB MET 11 HB1 MET 11 -6.989 0.747 -6.845
92 1HG MET 11 HG2 MET 11 -9.229 -0.175 -8.666
93 2HG MET 11 HG1 MET 11 -8.251 1.249 -8.816
94 1HE MET 11 HE3 MET 11 -5.436 0.631 -8.605
95 2HE MET 11 HE2 MET 11 -4.906 -0.007 -10.144
96 3HE MET 11 HE1 MET 11 -5.976 1.389 -10.124
97 H ALA 12 HN ALA 12 -8.539 -1.788 -4.387
98 HA ALA 12 HA ALA 12 -6.301 -0.784 -2.844
99 1HB ALA 12 HB1 ALA 12 -8.414 -2.847 -2.021
100 2HB ALA 12 HB3 ALA 12 -7.342 -1.983 -0.942
101 3HB ALA 12 HB2 ALA 12 -8.603 -1.111 -1.809
102 NH1 ARG 13 NH1 ARG 13 -4.247 -7.057 -7.387
103 NH2 ARG 13 NH2 ARG 13 -5.666 -7.546 -9.161
104 H ARG 13 HN ARG 13 -7.586 -3.779 -3.900
105 HA ARG 13 HA ARG 13 -5.597 -5.550 -2.945
106 1HB ARG 13 HB2 ARG 13 -7.775 -6.248 -3.805
107 2HB ARG 13 HB1 ARG 13 -7.382 -5.683 -5.404
108 1HG ARG 13 HG2 ARG 13 -5.298 -7.499 -4.747
109 2HG ARG 13 HG1 ARG 13 -6.740 -8.190 -4.033
110 1HD ARG 13 HD2 ARG 13 -6.434 -8.892 -6.435
111 2HD ARG 13 HD1 ARG 13 -7.959 -8.052 -6.162
112 HE ARG 13 HE ARG 13 -6.982 -6.068 -7.224
113 1HH1 ARG 13 HH12 ARG 13 -4.129 -6.771 -6.431
114 2HH1 ARG 13 HH11 ARG 13 -3.404 -7.242 -7.899
115 1HH2 ARG 13 HH22 ARG 13 -6.602 -7.625 -9.513
116 2HH2 ARG 13 HH21 ARG 13 -4.910 -7.759 -9.787
117 H PHE 14 HN PHE 14 -5.661 -3.333 -5.652
118 HA PHE 14 HA PHE 14 -3.483 -4.558 -7.086
119 1HB PHE 14 HB2 PHE 14 -4.774 -2.760 -8.218
120 2HB PHE 14 HB1 PHE 14 -4.296 -1.612 -6.972
121 HD1 PHE 14 HD1 PHE 14 -2.607 -4.052 -9.279
122 HD2 PHE 14 HD2 PHE 14 -2.544 -0.220 -7.417
123 HE1 PHE 14 HE1 PHE 14 -0.540 -3.497 -10.478
124 HE2 PHE 14 HE2 PHE 14 -0.478 0.330 -8.622
125 HZ PHE 14 HZ PHE 14 0.528 -1.306 -10.153
126 H ILE 15 HN ILE 15 -3.663 -1.945 -4.721
127 HA ILE 15 HA ILE 15 -0.873 -1.493 -4.557
128 HB ILE 15 HB ILE 15 -2.919 -1.276 -2.292
129 1HG1 ILE 15 HG12 ILE 15 -2.041 0.729 -4.438
130 2HG1 ILE 15 HG11 ILE 15 -3.614 -0.042 -4.382
131 1HG2 ILE 15 HG21 ILE 15 -0.270 0.110 -2.816
132 2HG2 ILE 15 HG23 ILE 15 -1.299 0.439 -1.427
133 3HG2 ILE 15 HG22 ILE 15 -0.526 -1.117 -1.594
134 1HD1 ILE 15 HD2 ILE 15 -4.075 1.024 -2.190
135 2HD1 ILE 15 HD1 ILE 15 -2.527 1.856 -2.265
136 3HD1 ILE 15 HD3 ILE 15 -3.767 2.208 -3.449
137 NH1 ARG 16 NH1 ARG 16 -2.917 -9.205 2.240
138 NH2 ARG 16 NH2 ARG 16 -4.806 -10.134 1.283
139 H ARG 16 HN ARG 16 -2.976 -3.799 -2.976
140 HA ARG 16 HA ARG 16 -1.099 -4.857 -1.141
141 1HB ARG 16 HB2 ARG 16 -3.499 -5.540 -1.143
142 2HB ARG 16 HB1 ARG 16 -3.288 -6.330 -2.696
143 1HG ARG 16 HG2 ARG 16 -1.703 -7.876 -1.768
144 2HG ARG 16 HG1 ARG 16 -1.795 -7.103 -0.188
145 1HD ARG 16 HD2 ARG 16 -4.281 -7.681 -0.178
146 2HD ARG 16 HD1 ARG 16 -4.040 -8.563 -1.676
147 HE ARG 16 HE ARG 16 -2.436 -10.024 -0.388
148 1HH1 ARG 16 HH12 ARG 16 -2.014 -8.784 2.137
149 2HH1 ARG 16 HH11 ARG 16 -3.277 -9.319 3.173
150 1HH2 ARG 16 HH22 ARG 16 -5.314 -10.416 0.468
151 2HH2 ARG 16 HH21 ARG 16 -5.247 -10.273 2.177
152 H SER 17 HN SER 17 -1.725 -5.588 -4.533
153 HA SER 17 HA SER 17 0.207 -7.682 -4.736
154 1HB SER 17 HB2 SER 17 -0.664 -5.787 -6.966
155 2HB SER 17 HB1 SER 17 -0.114 -7.464 -7.126
156 HG SER 17 HG1 SER 17 -2.004 -7.363 -5.261
157 H GLN 18 HN GLN 18 0.454 -4.189 -5.327
158 HA GLN 18 HA GLN 18 3.089 -4.227 -6.350
159 1HB GLN 18 HB2 GLN 18 1.890 -2.119 -4.510
160 2HB GLN 18 HB1 GLN 18 3.271 -1.902 -5.566
161 1HG GLN 18 HG2 GLN 18 1.824 -2.368 -7.543
162 2HG GLN 18 HG1 GLN 18 0.434 -2.513 -6.467
163 1HE2 GLN 18 HE21 GLN 18 2.101 1.152 -7.117
164 2HE2 GLN 18 HE22 GLN 18 2.920 -0.245 -7.611
165 H THR 19 HN THR 19 1.947 -3.924 -3.040
166 HA THR 19 HA THR 19 4.451 -3.744 -1.802
167 HB THR 19 HB THR 19 1.943 -5.095 -0.686
168 HG1 THR 19 HG1 THR 19 1.153 -3.199 -1.262
169 1HG2 THR 19 HG21 THR 19 4.081 -3.227 0.484
170 2HG2 THR 19 HG23 THR 19 2.758 -3.953 1.386
171 3HG2 THR 19 HG22 THR 19 4.065 -4.956 0.780
172 H LEU 20 HN LEU 20 2.688 -6.582 -2.915
173 HA LEU 20 HA LEU 20 4.316 -8.491 -1.565
174 1HB LEU 20 HB2 LEU 20 2.184 -9.050 -2.825
175 2HB LEU 20 HB1 LEU 20 3.035 -8.727 -4.325
176 HG LEU 20 HG LEU 20 4.639 -10.554 -3.843
177 1HD1 LEU 20 HD11 LEU 20 2.842 -11.097 -1.431
178 2HD1 LEU 20 HD13 LEU 20 4.147 -12.131 -1.985
179 3HD1 LEU 20 HD12 LEU 20 4.506 -10.547 -1.341
180 1HD2 LEU 20 HD21 LEU 20 2.597 -10.983 -5.172
181 2HD2 LEU 20 HD23 LEU 20 3.026 -12.398 -4.228
182 3HD2 LEU 20 HD22 LEU 20 1.707 -11.361 -3.705
183 H THR 21 HN THR 21 4.512 -6.941 -4.697
184 HA THR 21 HA THR 21 6.888 -8.190 -5.582
185 HB THR 21 HB THR 21 6.251 -5.283 -6.246
186 HG1 THR 21 HG1 THR 21 4.246 -6.023 -6.330
187 1HG2 THR 21 HG22 THR 21 7.976 -6.737 -7.560
188 2HG2 THR 21 HG21 THR 21 6.658 -7.829 -7.940
189 3HG2 THR 21 HG23 THR 21 6.636 -6.182 -8.552
190 H LEU 22 HN LEU 22 6.327 -5.404 -3.476
191 HA LEU 22 HA LEU 22 9.062 -4.570 -3.408
192 1HB LEU 22 HB2 LEU 22 7.057 -4.436 -1.115
193 2HB LEU 22 HB1 LEU 22 8.570 -3.572 -1.194
194 HG LEU 22 HG LEU 22 6.230 -3.177 -3.107
195 1HD1 LEU 22 HD11 LEU 22 7.395 -1.418 -0.909
196 2HD1 LEU 22 HD13 LEU 22 6.086 -0.964 -1.982
197 3HD1 LEU 22 HD12 LEU 22 5.858 -2.260 -0.825
198 1HD2 LEU 22 HD22 LEU 22 8.898 -1.703 -2.925
199 2HD2 LEU 22 HD21 LEU 22 8.417 -2.760 -4.244
200 3HD2 LEU 22 HD23 LEU 22 7.554 -1.266 -3.963
201 H LEU 23 HN LEU 23 7.253 -6.864 -1.423
202 HA LEU 23 HA LEU 23 9.250 -7.495 0.423
203 1HB LEU 23 HB2 LEU 23 6.919 -8.553 0.357
204 2HB LEU 23 HB1 LEU 23 7.488 -9.563 -0.961
205 HG LEU 23 HG LEU 23 9.382 -10.335 0.617
206 1HD1 LEU 23 HD11 LEU 23 7.556 -9.025 2.665
207 2HD1 LEU 23 HD13 LEU 23 8.912 -10.071 3.035
208 3HD1 LEU 23 HD12 LEU 23 9.189 -8.510 2.286
209 1HD2 LEU 23 HD22 LEU 23 6.510 -11.018 1.328
210 2HD2 LEU 23 HD21 LEU 23 7.459 -11.762 0.060
211 3HD2 LEU 23 HD23 LEU 23 7.918 -11.975 1.742
212 H GLU 24 HN GLU 24 8.745 -8.738 -2.814
213 HA GLU 24 HA GLU 24 10.894 -10.584 -2.836
214 1HB GLU 24 HB2 GLU 24 9.133 -10.338 -4.654
215 2HB GLU 24 HB1 GLU 24 9.947 -8.873 -5.148
216 1HG GLU 24 HG2 GLU 24 12.068 -10.634 -5.169
217 2HG GLU 24 HG1 GLU 24 10.732 -11.718 -5.511
218 H LYS 25 HN LYS 25 10.808 -7.115 -3.624
219 HA LYS 25 HA LYS 25 13.583 -7.070 -4.399
220 1HB LYS 25 HB2 LYS 25 12.032 -4.782 -3.178
221 2HB LYS 25 HB1 LYS 25 13.455 -4.668 -4.188
222 1HG LYS 25 HG2 LYS 25 10.731 -5.708 -5.080
223 2HG LYS 25 HG1 LYS 25 11.383 -4.148 -5.473
224 1HD LYS 25 HD2 LYS 25 11.962 -5.198 -7.413
225 2HD LYS 25 HD1 LYS 25 13.375 -5.647 -6.481
226 1HE LYS 25 HE2 LYS 25 11.058 -7.500 -6.206
227 2HE LYS 25 HE1 LYS 25 11.756 -7.446 -7.801
228 1HZ LYS 25 HZ1 LYS 25 13.889 -7.662 -6.023
229 2HZ LYS 25 HZ3 LYS 25 12.687 -8.786 -5.558
230 3HZ LYS 25 HZ2 LYS 25 13.269 -8.798 -7.121
231 H LEU 26 HN LEU 26 11.969 -6.683 -1.322
232 HA LEU 26 HA LEU 26 14.410 -5.913 0.023
233 1HB LEU 26 HB2 LEU 26 11.777 -7.040 0.972
234 2HB LEU 26 HB1 LEU 26 13.127 -6.879 2.069
235 HG LEU 26 HG LEU 26 13.250 -4.437 1.582
236 1HD1 LEU 26 HD12 LEU 26 12.211 -4.447 -0.738
237 2HD1 LEU 26 HD11 LEU 26 10.676 -4.853 0.026
238 3HD1 LEU 26 HD13 LEU 26 11.447 -3.319 0.359
239 1HD2 LEU 26 HD22 LEU 26 10.562 -5.552 2.381
240 2HD2 LEU 26 HD21 LEU 26 11.951 -5.322 3.423
241 3HD2 LEU 26 HD23 LEU 26 11.117 -3.923 2.742
242 H ASN 27 HN ASN 27 13.016 -8.824 -1.107
243 HA ASN 27 HA ASN 27 14.393 -10.616 0.664
244 1HB ASN 27 HB2 ASN 27 12.556 -11.340 -1.000
245 2HB ASN 27 HB1 ASN 27 13.778 -11.172 -2.265
246 1HD2 ASN 27 HD21 ASN 27 14.387 -14.083 0.559
247 2HD2 ASN 27 HD22 ASN 27 13.536 -12.683 0.996
248 H GLU 28 HN GLU 28 15.175 -8.923 -2.275
249 HA GLU 28 HA GLU 28 17.645 -10.235 -2.808
250 1HB GLU 28 HB2 GLU 28 17.033 -7.276 -3.267
251 2HB GLU 28 HB1 GLU 28 18.254 -8.231 -4.085
252 1HG GLU 28 HG2 GLU 28 16.511 -9.623 -5.127
253 2HG GLU 28 HG1 GLU 28 15.258 -8.713 -4.281
254 H LEU 29 HN LEU 29 16.944 -7.251 -1.051
255 HA LEU 29 HA LEU 29 19.673 -7.281 0.068
256 1HB LEU 29 HB2 LEU 29 17.401 -5.293 0.161
257 2HB LEU 29 HB1 LEU 29 18.779 -5.125 1.226
258 HG LEU 29 HG LEU 29 20.318 -5.150 -0.721
259 1HD1 LEU 29 HD11 LEU 29 17.776 -5.035 -2.396
260 2HD1 LEU 29 HD13 LEU 29 19.417 -4.775 -2.980
261 3HD1 LEU 29 HD12 LEU 29 18.949 -6.350 -2.391
262 1HD2 LEU 29 HD21 LEU 29 19.527 -3.039 0.255
263 2HD2 LEU 29 HD23 LEU 29 19.761 -2.862 -1.472
264 3HD2 LEU 29 HD22 LEU 29 18.139 -3.049 -0.823
265 H ASP 30 HN ASP 30 17.633 -9.260 0.826
266 HA ASP 30 HA ASP 30 16.598 -10.196 2.704
267 1HB ASP 30 HB2 ASP 30 18.231 -10.879 4.377
268 2HB ASP 30 HB1 ASP 30 19.011 -10.933 2.807
269 H ALA 31 HN ALA 31 16.122 -7.358 2.616
270 HA ALA 31 HA ALA 31 16.541 -6.247 5.246
271 1HB ALA 31 HB2 ALA 31 16.032 -4.794 3.306
272 2HB ALA 31 HB1 ALA 31 14.422 -5.502 3.202
273 3HB ALA 31 HB3 ALA 31 14.873 -4.548 4.607
274 H ASP 32 HN ASP 32 15.921 -7.882 6.606
275 HA ASP 32 HA ASP 32 13.393 -9.177 6.658
276 1HB ASP 32 HB2 ASP 32 15.167 -10.109 8.008
277 2HB ASP 32 HB1 ASP 32 15.336 -8.596 8.908
278 H GLU 33 HN GLU 33 14.621 -6.514 8.533
279 HA GLU 33 HA GLU 33 12.324 -5.939 10.016
280 1HB GLU 33 HB2 GLU 33 13.442 -3.415 9.056
281 2HB GLU 33 HB1 GLU 33 13.543 -4.089 10.664
282 1HG GLU 33 HG2 GLU 33 15.801 -3.757 9.866
283 2HG GLU 33 HG1 GLU 33 15.515 -5.487 9.898
284 H GLN 34 HN GLN 34 13.215 -4.481 6.949
285 HA GLN 34 HA GLN 34 10.603 -3.259 6.720
286 1HB GLN 34 HB2 GLN 34 12.779 -3.727 4.659
287 2HB GLN 34 HB1 GLN 34 11.358 -2.715 4.410
288 1HG GLN 34 HG2 GLN 34 11.977 -1.232 6.142
289 2HG GLN 34 HG1 GLN 34 13.262 -2.287 6.725
290 1HE2 GLN 34 HE21 GLN 34 15.579 -1.163 4.356
291 2HE2 GLN 34 HE22 GLN 34 15.272 -2.105 5.738
292 H ALA 35 HN ALA 35 11.783 -6.403 6.138
293 HA ALA 35 HA ALA 35 9.925 -7.052 4.010
294 1HB ALA 35 HB2 ALA 35 11.827 -8.648 4.635
295 2HB ALA 35 HB1 ALA 35 11.006 -8.956 6.160
296 3HB ALA 35 HB3 ALA 35 10.252 -9.419 4.656
297 H ASP 36 HN ASP 36 9.978 -7.173 7.546
298 HA ASP 36 HA ASP 36 7.360 -8.256 7.854
299 1HB ASP 36 HB2 ASP 36 8.548 -7.965 9.937
300 2HB ASP 36 HB1 ASP 36 8.827 -6.248 9.613
301 H ILE 37 HN ILE 37 8.502 -4.954 7.837
302 HA ILE 37 HA ILE 37 5.978 -3.732 7.940
303 HB ILE 37 HB ILE 37 8.392 -2.771 6.322
304 1HG1 ILE 37 HG12 ILE 37 7.595 -2.337 9.245
305 2HG1 ILE 37 HG11 ILE 37 8.939 -3.316 8.719
306 1HG2 ILE 37 HG22 ILE 37 6.270 -1.512 5.869
307 2HG2 ILE 37 HG21 ILE 37 6.087 -1.218 7.588
308 3HG2 ILE 37 HG23 ILE 37 7.421 -0.495 6.698
309 1HD1 ILE 37 HD2 ILE 37 10.008 -1.298 7.704
310 2HD1 ILE 37 HD1 ILE 37 8.690 -0.307 8.318
311 3HD1 ILE 37 HD3 ILE 37 9.754 -1.133 9.433
312 H CYS 38 HN CYS 38 7.619 -5.189 5.182
313 HA CYS 38 HA CYS 38 5.726 -4.124 3.282
314 1HB CYS 38 HB2 CYS 38 7.579 -6.499 3.145
315 2HB CYS 38 HB1 CYS 38 6.478 -6.110 1.859
316 HG CYS 38 HG1 CYS 38 9.025 -4.514 2.559
317 H GLU 39 HN GLU 39 5.842 -7.126 5.167
318 HA GLU 39 HA GLU 39 3.518 -8.182 3.792
319 1HB GLU 39 HB2 GLU 39 4.681 -8.871 6.532
320 2HB GLU 39 HB1 GLU 39 3.521 -9.850 5.642
321 1HG GLU 39 HG2 GLU 39 6.298 -9.134 4.607
322 2HG GLU 39 HG1 GLU 39 5.836 -10.690 5.288
323 H SER 40 HN SER 40 4.051 -6.595 6.883
324 HA SER 40 HA SER 40 1.340 -6.577 7.649
325 1HB SER 40 HB2 SER 40 3.564 -4.546 8.257
326 2HB SER 40 HB1 SER 40 2.140 -4.872 9.273
327 HG SER 40 HG1 SER 40 4.419 -6.279 9.170
328 H LEU 41 HN LEU 41 3.206 -4.519 5.529
329 HA LEU 41 HA LEU 41 1.142 -2.509 5.262
330 1HB LEU 41 HB2 LEU 41 3.577 -2.134 4.726
331 2HB LEU 41 HB1 LEU 41 3.420 -3.206 3.355
332 HG LEU 41 HG LEU 41 1.637 -1.591 2.452
333 1HD1 LEU 41 HD12 LEU 41 1.163 -0.501 4.682
334 2HD1 LEU 41 HD11 LEU 41 2.788 0.151 4.673
335 3HD1 LEU 41 HD13 LEU 41 1.628 0.673 3.464
336 1HD2 LEU 41 HD21 LEU 41 4.019 -1.563 1.675
337 2HD2 LEU 41 HD23 LEU 41 3.323 0.042 1.686
338 3HD2 LEU 41 HD22 LEU 41 4.421 -0.453 2.969
339 H HIS 42 HN HIS 42 2.199 -5.253 3.523
340 HA HIS 42 HA HIS 42 0.620 -5.206 1.207
341 1HB HIS 42 HB2 HIS 42 2.430 -6.866 1.642
342 2HB HIS 42 HB1 HIS 42 1.480 -7.590 2.900
343 HD1 HIS 42 HD1 HIS 42 1.313 -7.320 -0.863
344 HD2 HIS 42 HD2 HIS 42 -0.165 -9.585 2.208
345 HE1 HIS 42 HE1 HIS 42 0.146 -9.211 -1.896
346 H ASP 43 HN ASP 43 -0.024 -6.659 4.308
347 HA ASP 43 HA ASP 43 -2.786 -7.254 3.540
348 1HB ASP 43 HB2 ASP 43 -1.478 -8.702 5.155
349 2HB ASP 43 HB1 ASP 43 -1.603 -7.377 6.319
350 H HIS 44 HN HIS 44 -1.175 -4.664 5.157
351 HA HIS 44 HA HIS 44 -3.497 -3.672 6.553
352 1HB HIS 44 HB2 HIS 44 -1.043 -2.816 6.837
353 2HB HIS 44 HB1 HIS 44 -1.301 -1.925 5.346
354 HD1 HIS 44 HD1 HIS 44 -3.231 -2.277 8.584
355 HD2 HIS 44 HD2 HIS 44 -2.084 0.635 5.954
356 HE1 HIS 44 HE1 HIS 44 -4.071 -0.147 9.488
357 H ALA 45 HN ALA 45 -2.163 -3.410 3.359
358 HA ALA 45 HA ALA 45 -4.108 -1.473 2.426
359 1HB ALA 45 HB2 ALA 45 -1.946 -1.905 1.163
360 2HB ALA 45 HB1 ALA 45 -2.526 -3.527 0.806
361 3HB ALA 45 HB3 ALA 45 -3.365 -2.134 0.146
362 H ASP 46 HN ASP 46 -3.805 -4.904 2.710
363 HA ASP 46 HA ASP 46 -6.104 -5.541 1.102
364 1HB ASP 46 HB2 ASP 46 -4.343 -7.189 1.810
365 2HB ASP 46 HB1 ASP 46 -5.038 -7.166 3.418
366 H GLU 47 HN GLU 47 -5.801 -4.208 4.280
367 HA GLU 47 HA GLU 47 -8.298 -5.274 5.228
368 1HB GLU 47 HB2 GLU 47 -6.691 -2.809 5.899
369 2HB GLU 47 HB1 GLU 47 -8.353 -2.863 6.436
370 1HG GLU 47 HG2 GLU 47 -6.333 -5.043 7.047
371 2HG GLU 47 HG1 GLU 47 -6.638 -3.685 8.122
372 H LEU 48 HN LEU 48 -7.286 -2.719 3.198
373 HA LEU 48 HA LEU 48 -9.869 -1.444 2.903
374 1HB LEU 48 HB2 LEU 48 -7.580 -1.364 0.940
375 2HB LEU 48 HB1 LEU 48 -8.837 -0.166 1.147
376 HG LEU 48 HG LEU 48 -6.704 -0.857 3.241
377 1HD1 LEU 48 HD12 LEU 48 -5.793 0.303 1.253
378 2HD1 LEU 48 HD11 LEU 48 -6.995 1.570 1.433
379 3HD1 LEU 48 HD13 LEU 48 -5.764 1.342 2.668
380 1HD2 LEU 48 HD22 LEU 48 -8.790 1.356 3.170
381 2HD2 LEU 48 HD21 LEU 48 -8.843 -0.036 4.244
382 3HD2 LEU 48 HD23 LEU 48 -7.563 1.151 4.404
383 OH TYR 49 OH TYR 49 -10.837 -9.185 -4.317
384 H TYR 49 HN TYR 49 -9.149 -4.427 2.265
385 HA TYR 49 HA TYR 49 -10.677 -4.561 -0.284
386 1HB TYR 49 HB2 TYR 49 -8.203 -5.426 -0.286
387 2HB TYR 49 HB1 TYR 49 -8.775 -6.655 0.831
388 HD1 TYR 49 HD1 TYR 49 -9.812 -5.208 -2.443
389 HD2 TYR 49 HD2 TYR 49 -9.379 -8.691 -0.052
390 HE1 TYR 49 HE1 TYR 49 -10.574 -6.580 -4.320
391 HE2 TYR 49 HE2 TYR 49 -10.138 -10.073 -1.912
392 HH TYR 49 HH TYR 49 -11.164 -10.022 -3.978
393 NH1 ARG 50 NH1 ARG 50 -6.435 -7.438 5.274
394 NH2 ARG 50 NH2 ARG 50 -6.630 -7.475 7.573
395 H ARG 50 HN ARG 50 -9.929 -5.700 2.920
396 HA ARG 50 HA ARG 50 -12.065 -7.641 2.982
397 1HB ARG 50 HB2 ARG 50 -10.399 -6.398 5.204
398 2HB ARG 50 HB1 ARG 50 -11.524 -7.723 5.454
399 1HG ARG 50 HG2 ARG 50 -10.255 -9.082 3.784
400 2HG ARG 50 HG1 ARG 50 -9.121 -7.771 3.567
401 1HD ARG 50 HD2 ARG 50 -9.631 -9.300 6.164
402 2HD ARG 50 HD1 ARG 50 -8.173 -9.342 5.178
403 HE ARG 50 HE ARG 50 -9.050 -6.869 6.621
404 1HH1 ARG 50 HH12 ARG 50 -6.865 -7.459 4.367
405 2HH1 ARG 50 HH11 ARG 50 -5.433 -7.378 5.315
406 1HH2 ARG 50 HH22 ARG 50 -7.216 -7.489 8.388
407 2HH2 ARG 50 HH21 ARG 50 -5.637 -7.445 7.703
408 H SER 51 HN SER 51 -11.707 -5.032 5.339
409 HA SER 51 HA SER 51 -14.437 -4.977 5.963
410 1HB SER 51 HB2 SER 51 -12.355 -2.768 6.181
411 2HB SER 51 HB1 SER 51 -13.795 -2.947 7.204
412 HG SER 51 HG1 SER 51 -11.450 -4.214 7.401
413 H CYS 52 HN CYS 52 -12.789 -3.631 3.244
414 HA CYS 52 HA CYS 52 -14.889 -1.702 2.630
415 1HB CYS 52 HB2 CYS 52 -12.734 -3.013 0.952
416 2HB CYS 52 HB1 CYS 52 -13.899 -1.929 0.259
417 HG CYS 52 HG1 CYS 52 -12.672 0.042 1.188
418 H LEU 53 HN LEU 53 -14.040 -4.982 1.526
419 HA LEU 53 HA LEU 53 -16.314 -5.176 -0.194
420 1HB LEU 53 HB2 LEU 53 -14.447 -6.821 -0.318
421 2HB LEU 53 HB1 LEU 53 -14.797 -7.346 1.317
422 HG LEU 53 HG LEU 53 -16.998 -8.231 0.609
423 1HD1 LEU 53 HD11 LEU 53 -16.219 -7.305 -2.194
424 2HD1 LEU 53 HD13 LEU 53 -17.633 -8.256 -1.776
425 3HD1 LEU 53 HD12 LEU 53 -17.507 -6.602 -1.226
426 1HD2 LEU 53 HD22 LEU 53 -14.730 -9.122 -1.209
427 2HD2 LEU 53 HD21 LEU 53 -15.018 -9.688 0.430
428 3HD2 LEU 53 HD23 LEU 53 -16.175 -10.053 -0.838
429 H ALA 54 HN ALA 54 -15.839 -5.632 3.213
430 HA ALA 54 HA ALA 54 -18.192 -7.051 3.826
431 1HB ALA 54 HB2 ALA 54 -16.499 -6.477 5.560
432 2HB ALA 54 HB1 ALA 54 -16.975 -4.784 5.457
433 3HB ALA 54 HB3 ALA 54 -18.112 -5.979 6.052
434 NH1 ARG 55 NH2 ARG 55 -16.347 -0.260 5.701
435 NH2 ARG 55 NH1 ARG 55 -17.334 1.702 6.489
436 H ARG 55 HN ARG 55 -17.831 -3.792 2.737
437 HA ARG 55 HA ARG 55 -20.754 -3.401 3.257
438 1HB ARG 55 HB2 ARG 55 -18.597 -1.317 2.831
439 2HB ARG 55 HB1 ARG 55 -20.308 -0.981 3.074
440 1HG ARG 55 HG2 ARG 55 -20.090 -2.469 5.193
441 2HG ARG 55 HG1 ARG 55 -18.357 -2.260 5.000
442 1HD ARG 55 HD2 ARG 55 -20.373 0.029 5.241
443 2HD ARG 55 HD1 ARG 55 -19.299 -0.517 6.525
444 HE ARG 55 HE ARG 55 -18.406 0.844 4.035
445 1HH1 ARG 55 HH22 ARG 55 -16.383 -1.067 5.106
446 2HH1 ARG 55 HH21 ARG 55 -15.538 -0.152 6.288
447 1HH2 ARG 55 HH12 ARG 55 -18.093 2.358 6.459
448 2HH2 ARG 55 HH11 ARG 55 -16.592 1.916 7.137
449 H PHE 56 HN PHE 56 -18.417 -3.843 0.833
450 HA PHE 56 HA PHE 56 -20.154 -2.519 -1.180
451 1HB PHE 56 HB2 PHE 56 -17.560 -4.045 -1.590
452 2HB PHE 56 HB1 PHE 56 -18.395 -3.064 -2.778
453 HD1 PHE 56 HD1 PHE 56 -18.925 -1.046 -0.030
454 HD2 PHE 56 HD2 PHE 56 -15.685 -2.506 -2.386
455 HE1 PHE 56 HE1 PHE 56 -17.585 0.867 0.624
456 HE2 PHE 56 HE2 PHE 56 -14.339 -0.567 -1.724
457 HZ PHE 56 HZ PHE 56 -15.287 1.125 -0.209
458 H GLY 57 HN GLY 57 -19.868 -5.431 0.418
459 1HA GLY 57 HA2 GLY 57 -21.829 -6.671 -1.247
460 2HA GLY 57 HA1 GLY 57 -20.234 -7.355 -1.590
461 H ASP 58 HN ASP 58 -22.926 -7.483 0.431
462 HA ASP 58 HA ASP 58 -21.770 -8.319 2.896
463 1HB ASP 58 HB2 ASP 58 -24.370 -9.355 1.696
464 2HB ASP 58 HB1 ASP 58 -23.925 -9.352 3.399
465 H ASP 59 HN ASP 59 -21.350 -10.434 3.639
466 HA ASP 59 HA ASP 59 -20.429 -12.227 1.507
467 1HB ASP 59 HB2 ASP 59 -19.580 -13.649 3.290
468 2HB ASP 59 HB1 ASP 59 -19.248 -11.998 3.813
469 H GLY 60 HN GLY 60 -22.992 -11.845 3.781
470 1HA GLY 60 HA2 GLY 60 -25.142 -12.875 2.693
471 2HA GLY 60 HA1 GLY 60 -24.254 -14.395 2.935
472 H GLU 61 HN GLU 61 -23.075 -14.249 5.245
473 HA GLU 61 HA GLU 61 -24.640 -13.018 7.329
474 1HB GLU 61 HB2 GLU 61 -25.298 -15.341 8.311
475 2HB GLU 61 HB1 GLU 61 -26.272 -14.766 6.976
476 1HG GLU 61 HG2 GLU 61 -24.872 -16.180 5.411
477 2HG GLU 61 HG1 GLU 61 -24.050 -16.845 6.829
478 H ASN 62 HN ASN 62 -22.669 -15.771 6.525
479 HA ASN 62 HA ASN 62 -20.246 -14.990 7.659
480 1HB ASN 62 HB2 ASN 62 -21.483 -15.252 9.914
481 2HB ASN 62 HB1 ASN 62 -21.747 -16.934 9.493
482 1HD2 ASN 62 HD21 ASN 62 -17.872 -17.129 9.498
483 2HD2 ASN 62 HD22 ASN 62 -18.899 -17.118 8.166
484 H LEU 63 HN LEU 63 -20.027 -15.945 5.573
485 HA LEU 63 HA LEU 63 -20.460 -18.879 5.443
486 1HB LEU 63 HB2 LEU 63 -19.579 -16.789 3.413
487 2HB LEU 63 HB1 LEU 63 -19.452 -18.503 3.080
488 HG LEU 63 HG LEU 63 -21.913 -18.759 3.453
489 1HD1 LEU 63 HD11 LEU 63 -21.938 -15.724 3.613
490 2HD1 LEU 63 HD13 LEU 63 -23.360 -16.747 3.517
491 3HD1 LEU 63 HD12 LEU 63 -22.340 -16.814 4.932
492 1HD2 LEU 63 HD21 LEU 63 -21.026 -18.401 1.174
493 2HD2 LEU 63 HD23 LEU 63 -22.599 -17.634 1.337
494 3HD2 LEU 63 HD22 LEU 63 -21.136 -16.660 1.391
495 1H MET 1 HT1 MET 1 21.906 -2.710 -6.746
496 2H MET 1 HT3 MET 1 23.374 -3.181 -6.015
497 3H MET 1 HT2 MET 1 22.149 -2.427 -5.098
498 HA MET 1 HA MET 1 22.890 -0.452 -5.573
499 1HB MET 1 HB2 MET 1 25.159 -1.687 -5.793
500 2HB MET 1 HB1 MET 1 24.857 -1.737 -7.525
501 1HG MET 1 HG2 MET 1 24.628 0.755 -7.500
502 2HG MET 1 HG1 MET 1 25.091 0.752 -5.823
503 1HE MET 1 HE1 MET 1 27.242 0.164 -4.886
504 2HE MET 1 HE3 MET 1 27.679 -1.337 -5.737
505 3HE MET 1 HE2 MET 1 28.757 0.056 -5.744
506 H THR 2 HN THR 2 21.517 0.727 -6.739
507 HA THR 2 HA THR 2 20.174 1.408 -8.434
508 HB THR 2 HB THR 2 22.475 0.723 -10.326
509 HG1 THR 2 HG1 THR 2 22.401 2.428 -8.032
510 1HG2 THR 2 HG22 THR 2 20.596 2.372 -10.996
511 2HG2 THR 2 HG21 THR 2 21.090 3.386 -9.649
512 3HG2 THR 2 HG23 THR 2 22.195 3.101 -10.982
513 H LYS 3 HN LYS 3 20.349 -1.637 -8.111
514 HA LYS 3 HA LYS 3 19.265 -2.308 -10.796
515 1HB LYS 3 HB2 LYS 3 18.959 -4.643 -9.856
516 2HB LYS 3 HB1 LYS 3 20.620 -4.118 -9.804
517 1HG LYS 3 HG2 LYS 3 20.682 -3.969 -7.502
518 2HG LYS 3 HG1 LYS 3 18.961 -3.756 -7.292
519 1HD LYS 3 HD2 LYS 3 18.709 -6.177 -8.168
520 2HD LYS 3 HD1 LYS 3 20.458 -6.287 -8.093
521 1HE LYS 3 HE2 LYS 3 19.370 -7.187 -6.028
522 2HE LYS 3 HE1 LYS 3 20.428 -5.846 -5.661
523 1HZ LYS 3 HZ1 LYS 3 17.820 -4.882 -6.205
524 2HZ LYS 3 HZ3 LYS 3 17.739 -6.118 -5.074
525 3HZ LYS 3 HZ2 LYS 3 18.732 -4.774 -4.779
526 H GLN 4 HN GLN 4 17.642 -4.029 -8.485
527 HA GLN 4 HA GLN 4 15.303 -2.342 -8.880
528 1HB GLN 4 HB2 GLN 4 15.554 -4.810 -7.168
529 2HB GLN 4 HB1 GLN 4 14.075 -4.076 -7.761
530 1HG GLN 4 HG2 GLN 4 14.851 -4.479 -10.113
531 2HG GLN 4 HG1 GLN 4 16.236 -5.363 -9.473
532 1HE2 GLN 4 HE21 GLN 4 14.298 -8.186 -8.486
533 2HE2 GLN 4 HE22 GLN 4 15.777 -7.396 -8.263
534 H GLU 5 HN GLU 5 17.819 -1.854 -6.780
535 HA GLU 5 HA GLU 5 16.281 -1.661 -4.329
536 1HB GLU 5 HB2 GLU 5 18.765 -0.057 -5.093
537 2HB GLU 5 HB1 GLU 5 18.035 -0.077 -3.526
538 1HG GLU 5 HG2 GLU 5 19.718 -1.601 -3.212
539 2HG GLU 5 HG1 GLU 5 18.382 -2.668 -3.620
540 H LYS 6 HN LYS 6 17.619 0.816 -6.431
541 HA LYS 6 HA LYS 6 16.089 2.954 -5.410
542 1HB LYS 6 HB2 LYS 6 18.072 2.727 -7.301
543 2HB LYS 6 HB1 LYS 6 16.676 3.002 -8.325
544 1HG LYS 6 HG2 LYS 6 16.143 5.075 -7.181
545 2HG LYS 6 HG1 LYS 6 17.366 4.778 -5.958
546 1HD LYS 6 HD2 LYS 6 19.016 4.665 -8.058
547 2HD LYS 6 HD1 LYS 6 17.709 5.461 -8.897
548 1HE LYS 6 HE2 LYS 6 19.432 7.001 -7.921
549 2HE LYS 6 HE1 LYS 6 17.791 7.393 -7.423
550 1HZ LYS 6 HZ1 LYS 6 18.986 5.559 -5.599
551 2HZ LYS 6 HZ3 LYS 6 20.010 6.843 -5.840
552 3HZ LYS 6 HZ2 LYS 6 18.456 7.122 -5.302
553 H THR 7 HN THR 7 15.284 0.410 -7.621
554 HA THR 7 HA THR 7 12.947 1.782 -8.648
555 HB THR 7 HB THR 7 13.522 -1.214 -8.783
556 HG1 THR 7 HG1 THR 7 15.365 -0.519 -9.686
557 1HG2 THR 7 HG22 THR 7 11.448 -0.156 -9.962
558 2HG2 THR 7 HG21 THR 7 12.572 0.871 -10.841
559 3HG2 THR 7 HG23 THR 7 12.603 -0.870 -11.076
560 H ALA 8 HN ALA 8 13.597 -0.516 -6.057
561 HA ALA 8 HA ALA 8 10.784 -1.044 -5.542
562 1HB ALA 8 HB2 ALA 8 12.624 -2.552 -4.696
563 2HB ALA 8 HB1 ALA 8 13.158 -1.255 -3.640
564 3HB ALA 8 HB3 ALA 8 11.583 -1.991 -3.390
565 H LEU 9 HN LEU 9 13.263 0.998 -4.470
566 HA LEU 9 HA LEU 9 12.055 2.403 -2.341
567 1HB LEU 9 HB2 LEU 9 14.493 2.364 -3.148
568 2HB LEU 9 HB1 LEU 9 14.007 3.397 -4.467
569 HG LEU 9 HG LEU 9 13.846 4.200 -1.547
570 1HD1 LEU 9 HD11 LEU 9 15.861 4.805 -3.765
571 2HD1 LEU 9 HD13 LEU 9 15.897 5.530 -2.179
572 3HD1 LEU 9 HD12 LEU 9 16.174 3.809 -2.358
573 1HD2 LEU 9 HD22 LEU 9 13.637 5.824 -4.128
574 2HD2 LEU 9 HD21 LEU 9 12.291 5.455 -3.065
575 3HD2 LEU 9 HD23 LEU 9 13.594 6.470 -2.496
576 H ASN 10 HN ASN 10 12.308 3.072 -5.759
577 HA ASN 10 HA ASN 10 10.683 5.377 -5.861
578 1HB ASN 10 HB2 ASN 10 12.043 4.424 -7.803
579 2HB ASN 10 HB1 ASN 10 10.742 3.251 -8.023
580 1HD2 ASN 10 HD21 ASN 10 10.232 7.081 -9.210
581 2HD2 ASN 10 HD22 ASN 10 11.682 6.547 -8.510
582 H MET 11 HN MET 11 9.818 1.998 -6.335
583 HA MET 11 HA MET 11 7.076 2.391 -6.812
584 1HB MET 11 HB2 MET 11 8.585 0.108 -5.533
585 2HB MET 11 HB1 MET 11 6.839 0.067 -5.698
586 1HG MET 11 HG2 MET 11 8.772 0.555 -7.973
587 2HG MET 11 HG1 MET 11 8.094 -1.007 -7.607
588 1HE MET 11 HE3 MET 11 5.865 -1.688 -7.718
589 2HE MET 11 HE2 MET 11 4.860 -0.367 -7.091
590 3HE MET 11 HE1 MET 11 4.601 -1.017 -8.717
591 H ALA 12 HN ALA 12 8.782 2.147 -3.723
592 HA ALA 12 HA ALA 12 6.375 2.049 -2.165
593 1HB ALA 12 HB2 ALA 12 8.627 1.590 -1.164
594 2HB ALA 12 HB1 ALA 12 9.060 3.279 -1.400
595 3HB ALA 12 HB3 ALA 12 7.775 2.848 -0.280
596 NH1 ARG 13 NH1 ARG 13 7.101 7.432 0.076
597 NH2 ARG 13 NH2 ARG 13 7.671 9.659 0.281
598 H ARG 13 HN ARG 13 8.308 4.622 -3.525
599 HA ARG 13 HA ARG 13 6.837 6.694 -2.207
600 1HB ARG 13 HB2 ARG 13 9.064 7.085 -3.275
601 2HB ARG 13 HB1 ARG 13 8.379 6.818 -4.839
602 1HG ARG 13 HG2 ARG 13 8.542 9.155 -4.625
603 2HG ARG 13 HG1 ARG 13 6.844 8.827 -4.411
604 1HD ARG 13 HD2 ARG 13 8.857 9.265 -2.142
605 2HD ARG 13 HD1 ARG 13 7.711 10.462 -2.722
606 HE ARG 13 HE ARG 13 5.942 8.689 -1.997
607 1HH1 ARG 13 HH12 ARG 13 6.737 6.665 -0.456
608 2HH1 ARG 13 HH11 ARG 13 7.390 7.252 1.020
609 1HH2 ARG 13 HH22 ARG 13 7.759 10.573 -0.118
610 2HH2 ARG 13 HH21 ARG 13 7.944 9.533 1.243
611 H PHE 14 HN PHE 14 6.484 5.071 -5.270
612 HA PHE 14 HA PHE 14 4.409 6.776 -6.237
613 1HB PHE 14 HB2 PHE 14 5.717 5.173 -7.678
614 2HB PHE 14 HB1 PHE 14 4.886 3.838 -6.884
615 HD1 PHE 14 HD2 PHE 14 3.719 7.160 -8.230
616 HD2 PHE 14 HD1 PHE 14 3.291 2.918 -8.290
617 HE1 PHE 14 HE2 PHE 14 1.840 7.370 -9.781
618 HE2 PHE 14 HE1 PHE 14 1.414 3.136 -9.845
619 HZ PHE 14 HZ PHE 14 0.680 5.359 -10.599
620 H ILE 15 HN ILE 15 4.368 3.716 -4.515
621 HA ILE 15 HA ILE 15 1.604 3.288 -4.466
622 HB ILE 15 HB ILE 15 3.767 2.665 -2.425
623 1HG1 ILE 15 HG12 ILE 15 2.218 0.891 -4.354
624 2HG1 ILE 15 HG11 ILE 15 3.789 1.563 -4.732
625 1HG2 ILE 15 HG21 ILE 15 0.875 1.738 -2.443
626 2HG2 ILE 15 HG23 ILE 15 2.106 1.116 -1.354
627 3HG2 ILE 15 HG22 ILE 15 1.590 2.776 -1.233
628 1HD1 ILE 15 HD2 ILE 15 4.719 0.437 -2.716
629 2HD1 ILE 15 HD1 ILE 15 3.159 -0.313 -2.408
630 3HD1 ILE 15 HD3 ILE 15 4.054 -0.717 -3.858
631 NH1 ARG 16 NH2 ARG 16 1.759 9.272 3.053
632 NH2 ARG 16 NH1 ARG 16 3.845 9.818 3.878
633 H ARG 16 HN ARG 16 3.628 5.190 -2.282
634 HA ARG 16 HA ARG 16 1.659 5.924 -0.427
635 1HB ARG 16 HB2 ARG 16 4.045 6.695 -0.236
636 2HB ARG 16 HB1 ARG 16 3.797 7.767 -1.614
637 1HG ARG 16 HG2 ARG 16 2.072 8.989 -0.410
638 2HG ARG 16 HG1 ARG 16 2.211 7.903 0.964
639 1HD ARG 16 HD2 ARG 16 4.648 8.698 1.149
640 2HD ARG 16 HD1 ARG 16 4.290 9.868 -0.105
641 HE ARG 16 HE ARG 16 3.196 11.170 1.476
642 1HH1 ARG 16 HH22 ARG 16 1.116 9.249 2.282
643 2HH1 ARG 16 HH21 ARG 16 1.451 8.908 3.935
644 1HH2 ARG 16 HH12 ARG 16 4.762 10.199 3.729
645 2HH2 ARG 16 HH11 ARG 16 3.637 9.481 4.801
646 H SER 17 HN SER 17 2.528 7.514 -3.434
647 HA SER 17 HA SER 17 0.570 9.512 -3.444
648 1HB SER 17 HB2 SER 17 1.496 8.038 -5.939
649 2HB SER 17 HB1 SER 17 1.198 9.775 -5.727
650 HG SER 17 HG1 SER 17 3.398 8.332 -5.102
651 H GLN 18 HN GLN 18 0.378 6.243 -4.811
652 HA GLN 18 HA GLN 18 -2.256 6.498 -5.818
653 1HB GLN 18 HB2 GLN 18 -1.001 3.999 -4.621
654 2HB GLN 18 HB1 GLN 18 -2.424 4.057 -5.640
655 1HG GLN 18 HG2 GLN 18 -1.100 4.855 -7.531
656 2HG GLN 18 HG1 GLN 18 0.335 5.000 -6.512
657 1HE2 GLN 18 HE21 GLN 18 -1.060 1.158 -6.854
658 2HE2 GLN 18 HE22 GLN 18 -2.165 2.397 -6.521
659 H THR 19 HN THR 19 -1.094 5.627 -2.613
660 HA THR 19 HA THR 19 -3.607 4.784 -1.626
661 HB THR 19 HB THR 19 -1.437 6.202 -0.014
662 HG1 THR 19 HG1 THR 19 -1.163 4.163 -1.646
663 1HG2 THR 19 HG21 THR 19 -3.363 3.883 0.528
664 2HG2 THR 19 HG23 THR 19 -2.205 4.517 1.682
665 3HG2 THR 19 HG22 THR 19 -3.564 5.501 1.172
666 H LEU 20 HN LEU 20 -2.177 7.974 -1.998
667 HA LEU 20 HA LEU 20 -4.154 9.326 -0.440
668 1HB LEU 20 HB2 LEU 20 -2.070 10.470 -1.295
669 2HB LEU 20 HB1 LEU 20 -2.681 10.310 -2.929
670 HG LEU 20 HG LEU 20 -4.622 11.748 -2.388
671 1HD1 LEU 20 HD11 LEU 20 -3.288 12.049 0.341
672 2HD1 LEU 20 HD13 LEU 20 -4.678 12.959 -0.227
673 3HD1 LEU 20 HD12 LEU 20 -4.821 11.239 0.051
674 1HD2 LEU 20 HD22 LEU 20 -1.940 12.963 -1.622
675 2HD2 LEU 20 HD21 LEU 20 -2.547 12.770 -3.259
676 3HD2 LEU 20 HD23 LEU 20 -3.359 13.859 -2.148
677 H THR 21 HN THR 21 -3.902 8.418 -3.822
678 HA THR 21 HA THR 21 -6.365 9.581 -4.615
679 HB THR 21 HB THR 21 -5.117 7.056 -5.842
680 HG1 THR 21 HG1 THR 21 -4.097 9.548 -5.275
681 1HG2 THR 21 HG21 THR 21 -6.203 9.663 -7.062
682 2HG2 THR 21 HG23 THR 21 -5.702 8.233 -7.956
683 3HG2 THR 21 HG22 THR 21 -7.150 8.186 -6.961
684 H LEU 22 HN LEU 22 -5.625 6.443 -3.214
685 HA LEU 22 HA LEU 22 -8.308 5.452 -3.628
686 1HB LEU 22 HB2 LEU 22 -5.985 4.571 -1.906
687 2HB LEU 22 HB1 LEU 22 -7.570 3.929 -1.569
688 HG LEU 22 HG LEU 22 -6.240 2.426 -3.046
689 1HD1 LEU 22 HD12 LEU 22 -8.696 2.355 -3.182
690 2HD1 LEU 22 HD11 LEU 22 -8.696 3.590 -4.429
691 3HD1 LEU 22 HD13 LEU 22 -7.974 2.026 -4.743
692 1HD2 LEU 22 HD22 LEU 22 -6.389 4.689 -5.079
693 2HD2 LEU 22 HD21 LEU 22 -4.942 4.078 -4.289
694 3HD2 LEU 22 HD23 LEU 22 -5.828 3.057 -5.398
695 H LEU 23 HN LEU 23 -6.687 7.269 -1.164
696 HA LEU 23 HA LEU 23 -8.502 6.910 0.940
697 1HB LEU 23 HB2 LEU 23 -6.368 8.206 1.161
698 2HB LEU 23 HB1 LEU 23 -7.061 9.480 0.173
699 HG LEU 23 HG LEU 23 -8.805 9.923 1.845
700 1HD1 LEU 23 HD11 LEU 23 -7.453 7.709 3.439
701 2HD1 LEU 23 HD13 LEU 23 -8.698 8.778 4.058
702 3HD1 LEU 23 HD12 LEU 23 -9.081 7.638 2.786
703 1HD2 LEU 23 HD22 LEU 23 -6.014 9.802 3.037
704 2HD2 LEU 23 HD21 LEU 23 -6.652 11.104 2.045
705 3HD2 LEU 23 HD23 LEU 23 -7.336 10.794 3.633
706 H GLU 24 HN GLU 24 -8.465 9.389 -1.541
707 HA GLU 24 HA GLU 24 -10.741 10.840 -0.927
708 1HB GLU 24 HB2 GLU 24 -10.451 9.834 -3.767
709 2HB GLU 24 HB1 GLU 24 -11.026 11.375 -3.201
710 1HG GLU 24 HG2 GLU 24 -8.801 12.155 -2.799
711 2HG GLU 24 HG1 GLU 24 -8.118 10.534 -3.029
712 H LYS 25 HN LYS 25 -10.571 8.022 -2.920
713 HA LYS 25 HA LYS 25 -13.349 7.698 -3.309
714 1HB LYS 25 HB2 LYS 25 -11.316 5.449 -3.187
715 2HB LYS 25 HB1 LYS 25 -12.794 5.490 -4.119
716 1HG LYS 25 HG2 LYS 25 -10.265 7.138 -4.541
717 2HG LYS 25 HG1 LYS 25 -10.994 6.031 -5.671
718 1HD LYS 25 HD2 LYS 25 -12.925 7.524 -6.000
719 2HD LYS 25 HD1 LYS 25 -12.315 8.668 -4.828
720 1HE LYS 25 HE2 LYS 25 -10.991 7.949 -7.467
721 2HE LYS 25 HE1 LYS 25 -11.736 9.474 -7.016
722 1HZ LYS 25 HZ1 LYS 25 -9.750 8.920 -5.111
723 2HZ LYS 25 HZ3 LYS 25 -9.079 8.720 -6.641
724 3HZ LYS 25 HZ2 LYS 25 -9.849 10.155 -6.244
725 H LEU 26 HN LEU 26 -11.302 6.072 -0.873
726 HA LEU 26 HA LEU 26 -13.436 4.567 0.209
727 1HB LEU 26 HB2 LEU 26 -11.071 5.813 1.653
728 2HB LEU 26 HB1 LEU 26 -12.082 4.541 2.314
729 HG LEU 26 HG LEU 26 -10.566 4.252 -0.334
730 1HD1 LEU 26 HD11 LEU 26 -9.813 3.274 2.434
731 2HD1 LEU 26 HD13 LEU 26 -8.944 2.909 0.950
732 3HD1 LEU 26 HD12 LEU 26 -9.005 4.559 1.550
733 1HD2 LEU 26 HD22 LEU 26 -11.855 2.182 1.491
734 2HD2 LEU 26 HD21 LEU 26 -12.512 2.702 -0.047
735 3HD2 LEU 26 HD23 LEU 26 -10.990 1.844 0.004
736 H ASN 27 HN ASN 27 -12.624 7.921 0.569
737 HA ASN 27 HA ASN 27 -14.306 8.339 2.880
738 1HB ASN 27 HB2 ASN 27 -13.650 10.365 0.677
739 2HB ASN 27 HB1 ASN 27 -14.212 10.734 2.291
740 1HD2 ASN 27 HD21 ASN 27 -10.758 9.076 3.187
741 2HD2 ASN 27 HD22 ASN 27 -12.231 8.253 3.033
742 H GLU 28 HN GLU 28 -14.773 8.441 -0.595
743 HA GLU 28 HA GLU 28 -17.532 9.285 -0.386
744 1HB GLU 28 HB2 GLU 28 -16.321 7.737 -2.669
745 2HB GLU 28 HB1 GLU 28 -17.718 8.789 -2.732
746 1HG GLU 28 HG2 GLU 28 -16.234 10.737 -2.217
747 2HG GLU 28 HG1 GLU 28 -14.842 9.652 -2.313
748 H LEU 29 HN LEU 29 -15.908 6.223 -0.460
749 HA LEU 29 HA LEU 29 -18.299 4.692 -1.026
750 1HB LEU 29 HB2 LEU 29 -15.668 3.727 0.049
751 2HB LEU 29 HB1 LEU 29 -16.930 2.757 -0.694
752 HG LEU 29 HG LEU 29 -15.611 5.062 -2.184
753 1HD1 LEU 29 HD12 LEU 29 -13.947 3.304 -1.584
754 2HD1 LEU 29 HD11 LEU 29 -15.009 2.088 -2.281
755 3HD1 LEU 29 HD13 LEU 29 -14.289 3.317 -3.298
756 1HD2 LEU 29 HD21 LEU 29 -17.829 4.341 -3.018
757 2HD2 LEU 29 HD23 LEU 29 -16.540 4.015 -4.154
758 3HD2 LEU 29 HD22 LEU 29 -17.195 2.725 -3.180
759 H ASP 30 HN ASP 30 -18.136 6.374 1.526
760 HA ASP 30 HA ASP 30 -18.889 6.128 3.736
761 1HB ASP 30 HB2 ASP 30 -20.131 3.500 2.811
762 2HB ASP 30 HB1 ASP 30 -20.674 4.555 4.107
763 H ALA 31 HN ALA 31 -16.387 5.088 2.880
764 HA ALA 31 HA ALA 31 -16.085 2.682 4.628
765 1HB ALA 31 HB2 ALA 31 -15.464 2.376 2.233
766 2HB ALA 31 HB1 ALA 31 -14.295 3.683 2.382
767 3HB ALA 31 HB3 ALA 31 -14.090 2.206 3.298
768 H ASP 32 HN ASP 32 -16.290 4.414 6.211
769 HA ASP 32 HA ASP 32 -14.363 6.436 6.626
770 1HB ASP 32 HB2 ASP 32 -15.138 6.409 8.996
771 2HB ASP 32 HB1 ASP 32 -16.494 6.407 7.876
772 H GLU 33 HN GLU 33 -14.517 3.274 8.299
773 HA GLU 33 HA GLU 33 -11.960 3.682 9.505
774 1HB GLU 33 HB2 GLU 33 -12.139 0.946 9.378
775 2HB GLU 33 HB1 GLU 33 -12.890 1.915 10.630
776 1HG GLU 33 HG2 GLU 33 -14.484 0.300 9.703
777 2HG GLU 33 HG1 GLU 33 -15.029 1.917 9.323
778 H GLN 34 HN GLN 34 -12.900 2.607 6.334
779 HA GLN 34 HA GLN 34 -10.273 1.419 5.810
780 1HB GLN 34 HB2 GLN 34 -12.159 2.592 3.750
781 2HB GLN 34 HB1 GLN 34 -10.909 1.402 3.470
782 1HG GLN 34 HG2 GLN 34 -13.362 0.858 5.151
783 2HG GLN 34 HG1 GLN 34 -13.140 0.321 3.513
784 1HE2 GLN 34 HE21 GLN 34 -10.822 -1.428 6.417
785 2HE2 GLN 34 HE22 GLN 34 -11.447 0.124 6.699
786 H ALA 35 HN ALA 35 -11.770 4.541 5.749
787 HA ALA 35 HA ALA 35 -9.764 5.826 4.140
788 1HB ALA 35 HB2 ALA 35 -11.892 7.031 4.869
789 2HB ALA 35 HB1 ALA 35 -11.259 7.065 6.512
790 3HB ALA 35 HB3 ALA 35 -10.427 7.933 5.249
791 H ASP 36 HN ASP 36 -10.230 5.637 7.637
792 HA ASP 36 HA ASP 36 -7.792 6.636 8.522
793 1HB ASP 36 HB2 ASP 36 -9.201 5.997 10.293
794 2HB ASP 36 HB1 ASP 36 -9.491 4.390 9.618
795 H ILE 37 HN ILE 37 -8.462 3.255 7.985
796 HA ILE 37 HA ILE 37 -5.840 2.317 8.310
797 HB ILE 37 HB ILE 37 -8.167 1.318 6.625
798 1HG1 ILE 37 HG12 ILE 37 -7.069 0.530 9.362
799 2HG1 ILE 37 HG11 ILE 37 -8.473 1.535 9.121
800 1HG2 ILE 37 HG22 ILE 37 -6.020 0.281 5.811
801 2HG2 ILE 37 HG21 ILE 37 -5.692 -0.242 7.451
802 3HG2 ILE 37 HG23 ILE 37 -7.071 -0.878 6.583
803 1HD1 ILE 37 HD2 ILE 37 -9.596 -0.341 7.921
804 2HD1 ILE 37 HD1 ILE 37 -8.208 -1.373 8.241
805 3HD1 ILE 37 HD3 ILE 37 -9.170 -0.764 9.569
806 H CYS 38 HN CYS 38 -7.346 3.863 5.570
807 HA CYS 38 HA CYS 38 -5.145 3.160 3.781
808 1HB CYS 38 HB2 CYS 38 -7.417 3.548 2.935
809 2HB CYS 38 HB1 CYS 38 -7.346 5.210 3.462
810 HG CYS 38 HG1 CYS 38 -5.996 5.834 1.466
811 H GLU 39 HN GLU 39 -5.934 5.796 5.936
812 HA GLU 39 HA GLU 39 -4.009 7.614 4.751
813 1HB GLU 39 HB2 GLU 39 -5.331 7.505 7.515
814 2HB GLU 39 HB1 GLU 39 -4.358 8.853 6.946
815 1HG GLU 39 HG2 GLU 39 -5.883 9.339 5.181
816 2HG GLU 39 HG1 GLU 39 -6.713 7.803 5.355
817 H SER 40 HN SER 40 -4.188 5.309 7.353
818 HA SER 40 HA SER 40 -1.517 5.629 8.281
819 1HB SER 40 HB2 SER 40 -3.361 3.172 8.311
820 2HB SER 40 HB1 SER 40 -1.992 3.458 9.412
821 HG SER 40 HG1 SER 40 -4.493 4.561 9.465
822 H LEU 41 HN LEU 41 -3.046 3.613 5.826
823 HA LEU 41 HA LEU 41 -0.723 2.151 5.077
824 1HB LEU 41 HB2 LEU 41 -3.153 1.750 4.266
825 2HB LEU 41 HB1 LEU 41 -2.900 3.082 3.165
826 HG LEU 41 HG LEU 41 -0.843 1.812 2.273
827 1HD1 LEU 41 HD12 LEU 41 -0.674 0.233 4.203
828 2HD1 LEU 41 HD11 LEU 41 -2.219 -0.458 3.757
829 3HD1 LEU 41 HD13 LEU 41 -0.837 -0.625 2.684
830 1HD2 LEU 41 HD22 LEU 41 -3.588 0.558 1.926
831 2HD2 LEU 41 HD21 LEU 41 -2.983 1.936 1.030
832 3HD2 LEU 41 HD23 LEU 41 -2.231 0.370 0.825
833 H HIS 42 HN HIS 42 -2.014 5.176 4.136
834 HA HIS 42 HA HIS 42 -0.419 5.852 1.932
835 1HB HIS 42 HB2 HIS 42 -2.410 7.154 2.961
836 2HB HIS 42 HB1 HIS 42 -1.250 7.810 4.098
837 HD1 HIS 42 HD1 HIS 42 -0.114 7.571 0.558
838 HD2 HIS 42 HD2 HIS 42 -1.704 10.356 3.113
839 HE1 HIS 42 HE1 HIS 42 0.167 9.763 -0.515
840 H ASP 43 HN ASP 43 0.209 6.611 5.350
841 HA ASP 43 HA ASP 43 2.893 7.529 4.589
842 1HB ASP 43 HB2 ASP 43 1.802 8.611 6.527
843 2HB ASP 43 HB1 ASP 43 1.757 7.047 7.353
844 H HIS 44 HN HIS 44 1.534 4.580 5.895
845 HA HIS 44 HA HIS 44 4.072 3.554 6.778
846 1HB HIS 44 HB2 HIS 44 1.604 2.045 5.827
847 2HB HIS 44 HB1 HIS 44 2.978 1.315 6.660
848 HD1 HIS 44 HD1 HIS 44 2.797 4.371 8.277
849 HD2 HIS 44 HD2 HIS 44 0.346 1.088 8.414
850 HE1 HIS 44 HE1 HIS 44 1.529 4.538 10.367
851 H ALA 45 HN ALA 45 2.495 3.837 3.725
852 HA ALA 45 HA ALA 45 4.192 1.924 2.355
853 1HB ALA 45 HB1 ALA 45 2.834 4.429 1.229
854 2HB ALA 45 HB3 ALA 45 3.479 3.101 0.275
855 3HB ALA 45 HB2 ALA 45 2.068 2.847 1.296
856 H ASP 46 HN ASP 46 4.192 5.222 3.314
857 HA ASP 46 HA ASP 46 6.680 5.859 1.963
858 1HB ASP 46 HB2 ASP 46 4.788 7.499 2.699
859 2HB ASP 46 HB1 ASP 46 5.461 7.369 4.293
860 H GLU 47 HN GLU 47 5.733 4.350 4.949
861 HA GLU 47 HA GLU 47 8.227 4.965 6.273
862 1HB GLU 47 HB2 GLU 47 6.203 2.711 6.699
863 2HB GLU 47 HB1 GLU 47 7.687 2.793 7.610
864 1HG GLU 47 HG2 GLU 47 5.807 5.161 7.526
865 2HG GLU 47 HG1 GLU 47 5.583 3.855 8.684
866 H LEU 48 HN LEU 48 7.029 2.497 4.141
867 HA LEU 48 HA LEU 48 9.379 0.841 4.335
868 1HB LEU 48 HB2 LEU 48 6.989 0.485 3.081
869 2HB LEU 48 HB1 LEU 48 7.878 1.140 1.723
870 HG LEU 48 HG LEU 48 7.991 -1.282 1.613
871 1HD1 LEU 48 HD12 LEU 48 10.085 -0.116 0.960
872 2HD1 LEU 48 HD11 LEU 48 10.688 -0.273 2.605
873 3HD1 LEU 48 HD13 LEU 48 10.405 -1.699 1.639
874 1HD2 LEU 48 HD22 LEU 48 9.100 -1.214 4.454
875 2HD2 LEU 48 HD21 LEU 48 7.519 -1.801 3.963
876 3HD2 LEU 48 HD23 LEU 48 8.970 -2.636 3.447
877 OH TYR 49 OH TYR 49 12.048 9.475 -1.804
878 H TYR 49 HN TYR 49 8.318 3.488 2.331
879 HA TYR 49 HA TYR 49 10.531 3.716 0.607
880 1HB TYR 49 HB2 TYR 49 8.462 5.017 0.325
881 2HB TYR 49 HB1 TYR 49 8.788 5.867 1.821
882 HD1 TYR 49 HD1 TYR 49 9.966 5.468 -1.660
883 HD2 TYR 49 HD2 TYR 49 10.226 7.728 1.937
884 HE1 TYR 49 HE1 TYR 49 11.163 7.232 -2.848
885 HE2 TYR 49 HE2 TYR 49 11.419 9.488 0.748
886 HH TYR 49 HH TYR 49 12.989 9.286 -1.758
887 NH1 ARG 50 NH2 ARG 50 7.257 7.874 5.732
888 NH2 ARG 50 NH1 ARG 50 6.930 7.535 7.981
889 H ARG 50 HN ARG 50 10.075 5.149 3.810
890 HA ARG 50 HA ARG 50 12.585 6.529 3.799
891 1HB ARG 50 HB2 ARG 50 10.775 5.621 6.068
892 2HB ARG 50 HB1 ARG 50 12.213 6.595 6.319
893 1HG ARG 50 HG2 ARG 50 11.322 8.345 4.824
894 2HG ARG 50 HG1 ARG 50 9.902 7.381 4.488
895 1HD ARG 50 HD2 ARG 50 10.700 8.384 7.270
896 2HD ARG 50 HD1 ARG 50 9.458 9.112 6.260
897 HE ARG 50 HE ARG 50 9.251 6.377 7.447
898 1HH1 ARG 50 HH22 ARG 50 7.852 7.863 4.924
899 2HH1 ARG 50 HH21 ARG 50 6.298 8.141 5.616
900 1HH2 ARG 50 HH12 ARG 50 7.286 7.272 8.883
901 2HH2 ARG 50 HH11 ARG 50 5.959 7.781 7.925
902 H SER 51 HN SER 51 11.549 3.607 5.456
903 HA SER 51 HA SER 51 14.042 2.878 6.503
904 1HB SER 51 HB2 SER 51 11.777 1.072 5.555
905 2HB SER 51 HB1 SER 51 12.993 0.683 6.796
906 HG SER 51 HG1 SER 51 10.787 2.262 6.985
907 H CYS 52 HN CYS 52 12.823 2.651 3.266
908 HA CYS 52 HA CYS 52 14.691 0.635 2.392
909 1HB CYS 52 HB2 CYS 52 12.699 1.370 1.033
910 2HB CYS 52 HB1 CYS 52 13.448 2.932 0.826
911 HG CYS 52 HG1 CYS 52 14.180 0.396 -0.734
912 H LEU 53 HN LEU 53 14.631 4.161 2.420
913 HA LEU 53 HA LEU 53 17.228 4.522 1.326
914 1HB LEU 53 HB2 LEU 53 16.141 6.219 3.592
915 2HB LEU 53 HB1 LEU 53 17.275 6.704 2.351
916 HG LEU 53 HG LEU 53 14.334 6.057 1.947
917 1HD1 LEU 53 HD11 LEU 53 15.897 8.640 1.656
918 2HD1 LEU 53 HD13 LEU 53 14.186 8.436 1.303
919 3HD1 LEU 53 HD12 LEU 53 14.769 8.258 2.950
920 1HD2 LEU 53 HD22 LEU 53 16.446 6.849 -0.100
921 2HD2 LEU 53 HD21 LEU 53 15.663 5.280 0.006
922 3HD2 LEU 53 HD23 LEU 53 14.724 6.694 -0.416
923 H ALA 54 HN ALA 54 16.090 3.839 4.532
924 HA ALA 54 HA ALA 54 18.575 4.228 5.862
925 1HB ALA 54 HB2 ALA 54 16.470 4.079 7.117
926 2HB ALA 54 HB1 ALA 54 16.295 2.388 6.663
927 3HB ALA 54 HB3 ALA 54 17.623 2.883 7.692
928 NH1 ARG 55 NH1 ARG 55 19.918 -6.302 4.800
929 NH2 ARG 55 NH2 ARG 55 18.496 -6.934 6.512
930 H ARG 55 HN ARG 55 17.118 1.036 5.033
931 HA ARG 55 HA ARG 55 19.759 -0.092 5.674
932 1HB ARG 55 HB2 ARG 55 17.518 -1.259 6.215
933 2HB ARG 55 HB1 ARG 55 17.446 -1.639 4.494
934 1HG ARG 55 HG2 ARG 55 19.561 -2.806 4.571
935 2HG ARG 55 HG1 ARG 55 19.841 -2.292 6.227
936 1HD ARG 55 HD2 ARG 55 17.729 -3.569 6.874
937 2HD ARG 55 HD1 ARG 55 17.697 -4.237 5.244
938 HE ARG 55 HE ARG 55 20.030 -4.609 7.062
939 1HH1 ARG 55 HH12 ARG 55 20.483 -5.613 4.347
940 2HH1 ARG 55 HH11 ARG 55 19.876 -7.214 4.376
941 1HH2 ARG 55 HH22 ARG 55 17.973 -6.701 7.336
942 2HH2 ARG 55 HH21 ARG 55 18.430 -7.874 6.159
943 H PHE 56 HN PHE 56 17.843 0.515 2.770
944 HA PHE 56 HA PHE 56 19.714 -1.026 1.148
945 1HB PHE 56 HB2 PHE 56 17.804 1.172 0.210
946 2HB PHE 56 HB1 PHE 56 18.743 0.117 -0.802
947 HD1 PHE 56 HD2 PHE 56 17.249 -1.565 2.137
948 HD2 PHE 56 HD1 PHE 56 16.647 -0.385 -1.919
949 HE1 PHE 56 HE2 PHE 56 15.422 -3.159 1.937
950 HE2 PHE 56 HE1 PHE 56 14.818 -1.999 -2.109
951 HZ PHE 56 HZ PHE 56 14.199 -3.391 -0.184
952 H GLY 57 HN GLY 57 19.536 2.156 2.482
953 1HA GLY 57 HA2 GLY 57 21.148 3.896 2.349
954 2HA GLY 57 HA1 GLY 57 22.248 2.693 1.604
955 H ASP 58 HN ASP 58 19.090 4.092 0.958
956 HA ASP 58 HA ASP 58 18.066 4.788 -1.048
957 1HB ASP 58 HB2 ASP 58 19.787 6.593 -0.966
958 2HB ASP 58 HB1 ASP 58 20.989 5.541 -1.679
959 H ASP 59 HN ASP 59 20.765 4.244 -3.052
960 HA ASP 59 HA ASP 59 20.204 1.361 -3.383
961 1HB ASP 59 HB2 ASP 59 19.831 1.544 -5.776
962 2HB ASP 59 HB1 ASP 59 18.754 2.748 -5.058
963 H GLY 60 HN GLY 60 22.161 3.540 -2.561
964 1HA GLY 60 HA2 GLY 60 24.562 2.951 -2.478
965 2HA GLY 60 HA1 GLY 60 24.469 2.669 -4.240
966 H GLU 61 HN GLU 61 22.849 5.041 -2.283
967 HA GLU 61 HA GLU 61 22.579 7.323 -2.567
968 1HB GLU 61 HB2 GLU 61 25.611 7.104 -2.699
969 2HB GLU 61 HB1 GLU 61 24.722 8.565 -2.323
970 1HG GLU 61 HG2 GLU 61 25.426 7.611 -0.206
971 2HG GLU 61 HG1 GLU 61 23.696 7.322 -0.339
972 H ASN 62 HN ASN 62 22.326 5.933 -5.026
973 HA ASN 62 HA ASN 62 23.884 7.535 -6.965
974 1HB ASN 62 HB2 ASN 62 21.631 5.556 -7.495
975 2HB ASN 62 HB1 ASN 62 22.624 6.317 -8.716
976 1HD2 ASN 62 HD21 ASN 62 24.224 3.276 -6.510
977 2HD2 ASN 62 HD22 ASN 62 22.746 3.962 -6.043
978 H LEU 63 HN LEU 63 22.399 8.385 -8.830
979 HA LEU 63 HA LEU 63 20.280 10.034 -7.523
980 1HB LEU 63 HB2 LEU 63 21.717 10.474 -10.183
981 2HB LEU 63 HB1 LEU 63 20.570 11.563 -9.450
982 HG LEU 63 HG LEU 63 22.696 12.534 -9.017
983 1HD1 LEU 63 HD12 LEU 63 21.248 12.552 -7.039
984 2HD1 LEU 63 HD11 LEU 63 21.935 11.033 -6.486
985 3HD1 LEU 63 HD13 LEU 63 22.936 12.468 -6.563
986 1HD2 LEU 63 HD21 LEU 63 24.146 10.616 -9.550
987 2HD2 LEU 63 HD23 LEU 63 24.626 11.372 -8.041
988 3HD2 LEU 63 HD22 LEU 63 23.756 9.858 -8.016
Start of MODEL 6
Raw file had 988 H/Q atoms
Start of MODEL 6
1 1H MET 1 HT1 MET 1 -21.057 3.504 -2.646
2 2H MET 1 HT3 MET 1 -21.643 3.446 -1.061
3 3H MET 1 HT2 MET 1 -20.180 2.713 -1.449
4 HA MET 1 HA MET 1 -21.200 0.839 -1.946
5 1HB MET 1 HB2 MET 1 -23.756 2.460 -1.536
6 2HB MET 1 HB1 MET 1 -23.788 0.753 -1.864
7 1HG MET 1 HG2 MET 1 -24.046 1.105 0.506
8 2HG MET 1 HG1 MET 1 -22.540 0.299 0.192
9 1HE MET 1 HE1 MET 1 -23.974 3.741 0.213
10 2HE MET 1 HE3 MET 1 -24.053 3.720 1.980
11 3HE MET 1 HE2 MET 1 -22.864 4.722 1.128
12 H THR 2 HN THR 2 -20.308 1.240 -4.144
13 HA THR 2 HA THR 2 -22.497 1.169 -6.074
14 HB THR 2 HB THR 2 -20.326 3.104 -6.816
15 HG1 THR 2 HG1 THR 2 -20.564 3.964 -4.872
16 1HG2 THR 2 HG21 THR 2 -23.389 3.326 -6.767
17 2HG2 THR 2 HG23 THR 2 -22.309 4.411 -7.625
18 3HG2 THR 2 HG22 THR 2 -22.493 2.749 -8.163
19 H LYS 3 HN LYS 3 -21.230 1.076 -8.368
20 HA LYS 3 HA LYS 3 -19.660 -1.318 -8.134
21 1HB LYS 3 HB2 LYS 3 -19.198 -0.977 -10.578
22 2HB LYS 3 HB1 LYS 3 -20.912 -0.899 -10.198
23 1HG LYS 3 HG2 LYS 3 -20.739 1.613 -10.111
24 2HG LYS 3 HG1 LYS 3 -19.036 1.476 -10.509
25 1HD LYS 3 HD2 LYS 3 -19.646 0.423 -12.685
26 2HD LYS 3 HD1 LYS 3 -21.344 0.539 -12.251
27 1HE LYS 3 HE2 LYS 3 -20.623 2.493 -13.660
28 2HE LYS 3 HE1 LYS 3 -21.191 2.996 -12.078
29 1HZ LYS 3 HZ1 LYS 3 -18.433 2.465 -11.926
30 2HZ LYS 3 HZ3 LYS 3 -18.726 3.496 -13.238
31 3HZ LYS 3 HZ2 LYS 3 -19.268 3.921 -11.685
32 H GLN 4 HN GLN 4 -18.879 2.064 -8.096
33 HA GLN 4 HA GLN 4 -16.109 1.752 -8.850
34 1HB GLN 4 HB2 GLN 4 -17.306 3.821 -6.991
35 2HB GLN 4 HB1 GLN 4 -15.714 3.917 -7.711
36 1HG GLN 4 HG2 GLN 4 -16.950 5.290 -9.143
37 2HG GLN 4 HG1 GLN 4 -17.081 3.744 -9.980
38 1HE2 GLN 4 HE21 GLN 4 -20.310 4.992 -7.724
39 2HE2 GLN 4 HE22 GLN 4 -18.741 5.362 -7.212
40 H GLU 5 HN GLU 5 -17.938 1.279 -6.002
41 HA GLU 5 HA GLU 5 -15.747 1.256 -4.138
42 1HB GLU 5 HB2 GLU 5 -18.586 0.125 -4.101
43 2HB GLU 5 HB1 GLU 5 -17.461 -0.258 -2.860
44 1HG GLU 5 HG2 GLU 5 -18.815 1.564 -2.078
45 2HG GLU 5 HG1 GLU 5 -17.222 2.204 -2.372
46 H LYS 6 HN LYS 6 -17.583 -1.050 -6.004
47 HA LYS 6 HA LYS 6 -16.086 -3.344 -5.200
48 1HB LYS 6 HB2 LYS 6 -17.394 -2.813 -7.920
49 2HB LYS 6 HB1 LYS 6 -16.883 -4.380 -7.347
50 1HG LYS 6 HG2 LYS 6 -19.085 -2.659 -6.121
51 2HG LYS 6 HG1 LYS 6 -19.302 -4.180 -6.974
52 1HD LYS 6 HD2 LYS 6 -17.555 -5.051 -5.151
53 2HD LYS 6 HD1 LYS 6 -18.150 -3.654 -4.269
54 1HE LYS 6 HE2 LYS 6 -19.798 -5.931 -5.400
55 2HE LYS 6 HE1 LYS 6 -19.468 -5.669 -3.708
56 1HZ LYS 6 HZ1 LYS 6 -20.671 -3.340 -4.750
57 2HZ LYS 6 HZ3 LYS 6 -21.583 -4.723 -5.179
58 3HZ LYS 6 HZ2 LYS 6 -21.218 -4.418 -3.568
59 H THR 7 HN THR 7 -15.507 -0.822 -7.553
60 HA THR 7 HA THR 7 -13.308 -2.209 -8.798
61 HB THR 7 HB THR 7 -13.644 0.841 -8.635
62 HG1 THR 7 HG1 THR 7 -15.420 -0.996 -9.396
63 1HG2 THR 7 HG21 THR 7 -12.813 -1.066 -10.896
64 2HG2 THR 7 HG23 THR 7 -12.765 0.691 -10.955
65 3HG2 THR 7 HG22 THR 7 -11.656 -0.183 -9.911
66 H ALA 8 HN ALA 8 -13.714 -0.025 -6.088
67 HA ALA 8 HA ALA 8 -10.922 0.358 -5.595
68 1HB ALA 8 HB1 ALA 8 -13.267 0.498 -3.664
69 2HB ALA 8 HB3 ALA 8 -11.654 1.119 -3.338
70 3HB ALA 8 HB2 ALA 8 -12.641 1.843 -4.604
71 H LEU 9 HN LEU 9 -13.187 -2.152 -4.835
72 HA LEU 9 HA LEU 9 -11.624 -3.341 -2.738
73 1HB LEU 9 HB2 LEU 9 -14.026 -4.062 -3.315
74 2HB LEU 9 HB1 LEU 9 -13.415 -4.715 -4.820
75 HG LEU 9 HG LEU 9 -11.959 -6.290 -3.539
76 1HD1 LEU 9 HD11 LEU 9 -13.504 -5.255 -1.124
77 2HD1 LEU 9 HD13 LEU 9 -12.413 -6.628 -1.127
78 3HD1 LEU 9 HD12 LEU 9 -11.785 -5.020 -1.406
79 1HD2 LEU 9 HD22 LEU 9 -14.928 -6.441 -2.918
80 2HD2 LEU 9 HD21 LEU 9 -14.155 -7.017 -4.383
81 3HD2 LEU 9 HD23 LEU 9 -13.802 -7.790 -2.848
82 H ASN 10 HN ASN 10 -11.749 -3.564 -6.203
83 HA ASN 10 HA ASN 10 -9.679 -5.563 -6.370
84 1HB ASN 10 HB2 ASN 10 -10.675 -3.612 -8.468
85 2HB ASN 10 HB1 ASN 10 -9.572 -4.946 -8.779
86 1HD2 ASN 10 HD21 ASN 10 -13.515 -5.703 -8.494
87 2HD2 ASN 10 HD22 ASN 10 -12.897 -4.130 -8.530
88 H MET 11 HN MET 11 -9.580 -2.001 -6.433
89 HA MET 11 HA MET 11 -6.797 -2.082 -7.276
90 1HB MET 11 HB2 MET 11 -6.758 0.258 -7.006
91 2HB MET 11 HB1 MET 11 -8.429 -0.042 -7.419
92 1HG MET 11 HG2 MET 11 -8.477 1.490 -5.660
93 2HG MET 11 HG1 MET 11 -8.928 -0.028 -4.954
94 1HE MET 11 HE3 MET 11 -8.766 0.030 -2.801
95 2HE MET 11 HE2 MET 11 -7.384 0.332 -1.784
96 3HE MET 11 HE1 MET 11 -8.321 1.696 -2.403
97 H ALA 12 HN ALA 12 -8.525 -2.211 -4.232
98 HA ALA 12 HA ALA 12 -6.236 -1.675 -2.580
99 1HB ALA 12 HB2 ALA 12 -8.564 -3.558 -2.020
100 2HB ALA 12 HB1 ALA 12 -7.440 -2.946 -0.819
101 3HB ALA 12 HB3 ALA 12 -8.562 -1.853 -1.618
102 NH1 ARG 13 NH1 ARG 13 -9.365 -8.574 -7.532
103 NH2 ARG 13 NH2 ARG 13 -10.677 -8.056 -5.702
104 H ARG 13 HN ARG 13 -7.646 -4.509 -4.025
105 HA ARG 13 HA ARG 13 -5.741 -6.380 -3.013
106 1HB ARG 13 HB2 ARG 13 -7.910 -6.976 -4.125
107 2HB ARG 13 HB1 ARG 13 -7.247 -6.482 -5.656
108 1HG ARG 13 HG2 ARG 13 -5.368 -8.210 -5.226
109 2HG ARG 13 HG1 ARG 13 -6.359 -8.793 -3.900
110 1HD ARG 13 HD2 ARG 13 -7.122 -8.618 -6.833
111 2HD ARG 13 HD1 ARG 13 -6.891 -10.095 -5.904
112 HE ARG 13 HE ARG 13 -8.895 -9.414 -4.545
113 1HH1 ARG 13 HH12 ARG 13 -8.530 -8.966 -7.922
114 2HH1 ARG 13 HH11 ARG 13 -10.043 -8.192 -8.169
115 1HH2 ARG 13 HH22 ARG 13 -10.823 -8.067 -4.708
116 2HH2 ARG 13 HH21 ARG 13 -11.395 -7.656 -6.279
117 H PHE 14 HN PHE 14 -5.708 -4.106 -5.697
118 HA PHE 14 HA PHE 14 -3.462 -5.253 -7.050
119 1HB PHE 14 HB2 PHE 14 -4.630 -3.339 -8.138
120 2HB PHE 14 HB1 PHE 14 -4.165 -2.283 -6.804
121 HD1 PHE 14 HD1 PHE 14 -2.706 -4.460 -9.463
122 HD2 PHE 14 HD2 PHE 14 -2.078 -1.229 -6.751
123 HE1 PHE 14 HE1 PHE 14 -0.532 -4.002 -10.500
124 HE2 PHE 14 HE2 PHE 14 0.093 -0.778 -7.795
125 HZ PHE 14 HZ PHE 14 0.875 -2.161 -9.669
126 H ILE 15 HN ILE 15 -3.724 -2.818 -4.529
127 HA ILE 15 HA ILE 15 -0.939 -2.383 -4.230
128 HB ILE 15 HB ILE 15 -3.132 -2.247 -2.092
129 1HG1 ILE 15 HG12 ILE 15 -2.041 -0.151 -4.037
130 2HG1 ILE 15 HG11 ILE 15 -3.603 -0.916 -4.205
131 1HG2 ILE 15 HG22 ILE 15 -0.792 -2.149 -1.198
132 2HG2 ILE 15 HG21 ILE 15 -0.438 -0.842 -2.315
133 3HG2 ILE 15 HG23 ILE 15 -1.592 -0.608 -1.009
134 1HD1 ILE 15 HD2 ILE 15 -4.310 0.030 -2.021
135 2HD1 ILE 15 HD1 ILE 15 -2.768 0.865 -1.885
136 3HD1 ILE 15 HD3 ILE 15 -3.872 1.272 -3.180
137 NH1 ARG 16 NH1 ARG 16 -3.799 -9.511 2.179
138 NH2 ARG 16 NH2 ARG 16 -5.811 -10.074 1.180
139 H ARG 16 HN ARG 16 -3.103 -4.842 -2.901
140 HA ARG 16 HA ARG 16 -1.180 -5.917 -1.084
141 1HB ARG 16 HB2 ARG 16 -3.553 -7.103 -2.512
142 2HB ARG 16 HB1 ARG 16 -2.505 -8.132 -1.575
143 1HG ARG 16 HG2 ARG 16 -2.821 -6.672 0.386
144 2HG ARG 16 HG1 ARG 16 -3.839 -5.597 -0.568
145 1HD ARG 16 HD2 ARG 16 -5.200 -7.210 0.782
146 2HD ARG 16 HD1 ARG 16 -5.452 -7.492 -0.934
147 HE ARG 16 HE ARG 16 -3.687 -9.353 -0.631
148 1HH1 ARG 16 HH12 ARG 16 -2.895 -9.077 2.127
149 2HH1 ARG 16 HH11 ARG 16 -4.061 -9.943 3.049
150 1HH2 ARG 16 HH22 ARG 16 -6.413 -10.070 0.380
151 2HH2 ARG 16 HH21 ARG 16 -6.143 -10.518 2.020
152 H SER 17 HN SER 17 -1.999 -6.893 -4.363
153 HA SER 17 HA SER 17 -0.021 -8.901 -4.604
154 1HB SER 17 HB2 SER 17 -1.182 -7.176 -6.823
155 2HB SER 17 HB1 SER 17 -0.672 -8.878 -6.931
156 HG SER 17 HG1 SER 17 -2.965 -7.810 -5.924
157 H GLN 18 HN GLN 18 0.078 -5.457 -5.121
158 HA GLN 18 HA GLN 18 2.581 -5.394 -6.503
159 1HB GLN 18 HB2 GLN 18 1.054 -3.437 -6.434
160 2HB GLN 18 HB1 GLN 18 1.223 -3.337 -4.694
161 1HG GLN 18 HG2 GLN 18 3.610 -2.792 -4.933
162 2HG GLN 18 HG1 GLN 18 3.477 -2.926 -6.690
163 1HE2 GLN 18 HE21 GLN 18 2.849 0.630 -6.150
164 2HE2 GLN 18 HE22 GLN 18 4.150 -0.447 -6.282
165 H THR 19 HN THR 19 1.638 -4.852 -3.203
166 HA THR 19 HA THR 19 4.214 -4.699 -2.077
167 HB THR 19 HB THR 19 1.518 -5.517 -0.844
168 HG1 THR 19 HG1 THR 19 1.191 -3.513 -1.432
169 1HG2 THR 19 HG22 THR 19 3.580 -5.830 0.694
170 2HG2 THR 19 HG21 THR 19 3.959 -4.136 0.406
171 3HG2 THR 19 HG23 THR 19 2.475 -4.583 1.233
172 H LEU 20 HN LEU 20 2.270 -7.415 -3.065
173 HA LEU 20 HA LEU 20 3.633 -9.351 -1.450
174 1HB LEU 20 HB2 LEU 20 1.506 -9.947 -2.580
175 2HB LEU 20 HB1 LEU 20 2.249 -9.685 -4.148
176 HG LEU 20 HG LEU 20 3.849 -11.535 -3.747
177 1HD1 LEU 20 HD11 LEU 20 2.281 -11.960 -1.164
178 2HD1 LEU 20 HD13 LEU 20 3.519 -13.032 -1.798
179 3HD1 LEU 20 HD12 LEU 20 3.952 -11.430 -1.253
180 1HD2 LEU 20 HD22 LEU 20 0.944 -12.315 -3.331
181 2HD2 LEU 20 HD21 LEU 20 1.721 -12.006 -4.878
182 3HD2 LEU 20 HD23 LEU 20 2.220 -13.377 -3.905
183 H THR 21 HN THR 21 3.884 -8.421 -4.834
184 HA THR 21 HA THR 21 6.285 -9.915 -5.299
185 HB THR 21 HB THR 21 5.404 -7.475 -6.909
186 HG1 THR 21 HG1 THR 21 3.499 -8.429 -6.820
187 1HG2 THR 21 HG21 THR 21 6.154 -10.372 -7.645
188 2HG2 THR 21 HG23 THR 21 5.946 -9.049 -8.781
189 3HG2 THR 21 HG22 THR 21 7.319 -9.064 -7.685
190 H LEU 22 HN LEU 22 5.605 -6.931 -3.793
191 HA LEU 22 HA LEU 22 8.241 -5.793 -4.271
192 1HB LEU 22 HB2 LEU 22 6.037 -4.517 -3.625
193 2HB LEU 22 HB1 LEU 22 6.358 -5.097 -2.001
194 HG LEU 22 HG LEU 22 8.561 -3.938 -2.015
195 1HD1 LEU 22 HD11 LEU 22 7.580 -2.795 -4.676
196 2HD1 LEU 22 HD13 LEU 22 9.021 -2.284 -3.819
197 3HD1 LEU 22 HD12 LEU 22 8.944 -3.886 -4.516
198 1HD2 LEU 22 HD22 LEU 22 6.164 -2.209 -2.719
199 2HD2 LEU 22 HD21 LEU 22 6.533 -2.825 -1.119
200 3HD2 LEU 22 HD23 LEU 22 7.596 -1.649 -1.878
201 H LEU 23 HN LEU 23 6.583 -7.699 -1.904
202 HA LEU 23 HA LEU 23 8.519 -7.639 0.164
203 1HB LEU 23 HB2 LEU 23 6.159 -8.695 0.267
204 2HB LEU 23 HB1 LEU 23 6.801 -10.027 -0.671
205 HG LEU 23 HG LEU 23 8.475 -10.474 1.126
206 1HD1 LEU 23 HD11 LEU 23 6.794 -8.445 2.658
207 2HD1 LEU 23 HD13 LEU 23 8.060 -9.441 3.349
208 3HD1 LEU 23 HD12 LEU 23 8.468 -8.205 2.178
209 1HD2 LEU 23 HD22 LEU 23 5.541 -10.492 1.918
210 2HD2 LEU 23 HD21 LEU 23 6.340 -11.730 0.965
211 3HD2 LEU 23 HD23 LEU 23 6.780 -11.497 2.648
212 H GLU 24 HN GLU 24 7.898 -9.829 -2.414
213 HA GLU 24 HA GLU 24 10.040 -11.590 -2.260
214 1HB GLU 24 HB2 GLU 24 8.121 -11.808 -3.817
215 2HB GLU 24 HB1 GLU 24 8.650 -10.383 -4.672
216 1HG GLU 24 HG2 GLU 24 10.787 -11.707 -5.254
217 2HG GLU 24 HG1 GLU 24 9.978 -13.105 -4.559
218 H LYS 25 HN LYS 25 9.875 -8.890 -4.476
219 HA LYS 25 HA LYS 25 12.571 -8.869 -5.209
220 1HB LYS 25 HB2 LYS 25 10.572 -6.584 -5.028
221 2HB LYS 25 HB1 LYS 25 12.112 -6.461 -5.864
222 1HG LYS 25 HG2 LYS 25 10.158 -8.722 -6.490
223 2HG LYS 25 HG1 LYS 25 10.040 -7.172 -7.293
224 1HD LYS 25 HD2 LYS 25 11.965 -7.463 -8.486
225 2HD LYS 25 HD1 LYS 25 12.784 -8.346 -7.229
226 1HE LYS 25 HE2 LYS 25 10.555 -9.419 -9.045
227 2HE LYS 25 HE1 LYS 25 12.261 -9.829 -9.162
228 1HZ LYS 25 HZ1 LYS 25 11.434 -10.363 -6.547
229 2HZ LYS 25 HZ3 LYS 25 10.316 -11.063 -7.607
230 3HZ LYS 25 HZ2 LYS 25 11.960 -11.424 -7.726
231 H LEU 26 HN LEU 26 11.175 -7.501 -2.297
232 HA LEU 26 HA LEU 26 13.532 -5.891 -1.745
233 1HB LEU 26 HB2 LEU 26 11.060 -6.707 -0.306
234 2HB LEU 26 HB1 LEU 26 12.452 -6.472 0.719
235 HG LEU 26 HG LEU 26 12.686 -4.172 0.095
236 1HD1 LEU 26 HD11 LEU 26 10.676 -4.627 -2.169
237 2HD1 LEU 26 HD13 LEU 26 11.410 -3.099 -1.733
238 3HD1 LEU 26 HD12 LEU 26 12.394 -4.370 -2.405
239 1HD2 LEU 26 HD21 LEU 26 10.740 -4.631 1.552
240 2HD2 LEU 26 HD23 LEU 26 10.418 -3.258 0.500
241 3HD2 LEU 26 HD22 LEU 26 9.714 -4.826 0.139
242 H ASN 27 HN ASN 27 12.472 -9.132 -1.091
243 HA ASN 27 HA ASN 27 14.629 -9.769 0.701
244 1HB ASN 27 HB2 ASN 27 13.183 -11.646 -1.239
245 2HB ASN 27 HB1 ASN 27 14.110 -12.135 0.169
246 1HD2 ASN 27 HD21 ASN 27 11.348 -10.097 2.029
247 2HD2 ASN 27 HD22 ASN 27 12.863 -9.529 1.532
248 H GLU 28 HN GLU 28 14.182 -9.756 -2.765
249 HA GLU 28 HA GLU 28 16.740 -10.958 -3.347
250 1HB GLU 28 HB2 GLU 28 14.994 -9.176 -5.082
251 2HB GLU 28 HB1 GLU 28 16.287 -10.214 -5.658
252 1HG GLU 28 HG2 GLU 28 15.123 -12.210 -4.790
253 2HG GLU 28 HG1 GLU 28 13.802 -11.215 -4.191
254 H LEU 29 HN LEU 29 15.610 -7.695 -2.839
255 HA LEU 29 HA LEU 29 18.217 -6.597 -3.664
256 1HB LEU 29 HB2 LEU 29 15.549 -5.438 -2.936
257 2HB LEU 29 HB1 LEU 29 16.955 -4.426 -2.671
258 HG LEU 29 HG LEU 29 17.658 -4.714 -5.020
259 1HD1 LEU 29 HD12 LEU 29 16.645 -6.959 -5.478
260 2HD1 LEU 29 HD11 LEU 29 15.048 -6.245 -5.388
261 3HD1 LEU 29 HD13 LEU 29 16.147 -5.775 -6.665
262 1HD2 LEU 29 HD21 LEU 29 16.198 -2.824 -4.394
263 2HD2 LEU 29 HD23 LEU 29 15.825 -3.362 -6.025
264 3HD2 LEU 29 HD22 LEU 29 14.775 -3.810 -4.688
265 H ASP 30 HN ASP 30 17.715 -8.344 -1.229
266 HA ASP 30 HA ASP 30 18.508 -8.485 0.943
267 1HB ASP 30 HB2 ASP 30 20.712 -7.885 -0.123
268 2HB ASP 30 HB1 ASP 30 20.332 -6.177 0.098
269 H ALA 31 HN ALA 31 16.352 -7.609 1.371
270 HA ALA 31 HA ALA 31 16.668 -5.170 3.044
271 1HB ALA 31 HB3 ALA 31 15.620 -4.429 0.895
272 2HB ALA 31 HB2 ALA 31 14.354 -5.628 1.132
273 3HB ALA 31 HB1 ALA 31 14.521 -4.290 2.256
274 H ASP 32 HN ASP 32 16.049 -5.685 4.984
275 HA ASP 32 HA ASP 32 14.218 -8.016 5.334
276 1HB ASP 32 HB2 ASP 32 16.019 -6.729 7.442
277 2HB ASP 32 HB1 ASP 32 15.115 -8.227 7.579
278 H GLU 33 HN GLU 33 15.076 -5.165 7.165
279 HA GLU 33 HA GLU 33 12.762 -4.781 8.601
280 1HB GLU 33 HB2 GLU 33 13.379 -2.353 8.681
281 2HB GLU 33 HB1 GLU 33 14.796 -3.372 8.891
282 1HG GLU 33 HG2 GLU 33 14.028 -1.934 6.344
283 2HG GLU 33 HG1 GLU 33 15.291 -1.468 7.459
284 H GLN 34 HN GLN 34 13.398 -3.758 5.325
285 HA GLN 34 HA GLN 34 10.882 -2.390 5.027
286 1HB GLN 34 HB2 GLN 34 12.756 -3.599 2.982
287 2HB GLN 34 HB1 GLN 34 11.388 -2.598 2.556
288 1HG GLN 34 HG2 GLN 34 12.377 -0.683 3.270
289 2HG GLN 34 HG1 GLN 34 13.215 -1.466 4.607
290 1HE2 GLN 34 HE21 GLN 34 16.143 -1.836 2.759
291 2HE2 GLN 34 HE22 GLN 34 15.381 -1.687 4.268
292 H ALA 35 HN ALA 35 12.013 -5.651 4.333
293 HA ALA 35 HA ALA 35 9.651 -6.492 2.988
294 1HB ALA 35 HB2 ALA 35 11.729 -7.885 3.037
295 2HB ALA 35 HB1 ALA 35 11.484 -8.164 4.758
296 3HB ALA 35 HB3 ALA 35 10.334 -8.800 3.598
297 H ASP 36 HN ASP 36 10.548 -6.455 6.392
298 HA ASP 36 HA ASP 36 8.284 -7.824 7.389
299 1HB ASP 36 HB2 ASP 36 9.741 -5.505 8.734
300 2HB ASP 36 HB1 ASP 36 8.745 -6.721 9.529
301 H ILE 37 HN ILE 37 8.840 -4.345 7.389
302 HA ILE 37 HA ILE 37 6.157 -3.679 8.006
303 HB ILE 37 HB ILE 37 8.423 -2.172 6.665
304 1HG1 ILE 37 HG12 ILE 37 8.235 -0.734 8.733
305 2HG1 ILE 37 HG11 ILE 37 6.943 -1.762 9.311
306 1HG2 ILE 37 HG21 ILE 37 5.668 -1.020 7.237
307 2HG2 ILE 37 HG23 ILE 37 7.090 -0.113 6.752
308 3HG2 ILE 37 HG22 ILE 37 6.366 -1.243 5.638
309 1HD1 ILE 37 HD1 ILE 37 9.805 -2.633 8.822
310 2HD1 ILE 37 HD3 ILE 37 9.071 -2.325 10.377
311 3HD1 ILE 37 HD2 ILE 37 8.526 -3.684 9.419
312 H CYS 38 HN CYS 38 7.661 -4.569 5.017
313 HA CYS 38 HA CYS 38 5.637 -3.471 3.287
314 1HB CYS 38 HB2 CYS 38 7.838 -4.363 2.429
315 2HB CYS 38 HB1 CYS 38 7.315 -5.971 2.849
316 HG CYS 38 HG1 CYS 38 6.458 -4.407 0.364
317 H GLU 39 HN GLU 39 6.087 -6.563 4.922
318 HA GLU 39 HA GLU 39 3.677 -7.701 3.861
319 1HB GLU 39 HB2 GLU 39 5.481 -9.084 4.942
320 2HB GLU 39 HB1 GLU 39 5.140 -8.313 6.481
321 1HG GLU 39 HG2 GLU 39 4.051 -10.553 6.267
322 2HG GLU 39 HG1 GLU 39 2.870 -9.270 6.498
323 H SER 40 HN SER 40 4.510 -5.716 6.642
324 HA SER 40 HA SER 40 1.927 -5.937 7.877
325 1HB SER 40 HB2 SER 40 3.737 -3.479 7.963
326 2HB SER 40 HB1 SER 40 2.652 -4.073 9.233
327 HG SER 40 HG1 SER 40 4.260 -6.072 8.437
328 H LEU 41 HN LEU 41 3.215 -4.060 5.255
329 HA LEU 41 HA LEU 41 0.961 -2.249 5.124
330 1HB LEU 41 HB2 LEU 41 3.404 -2.046 4.092
331 2HB LEU 41 HB1 LEU 41 2.771 -3.026 2.797
332 HG LEU 41 HG LEU 41 2.790 -0.601 2.241
333 1HD1 LEU 41 HD12 LEU 41 1.105 -2.058 1.131
334 2HD1 LEU 41 HD11 LEU 41 -0.051 -1.677 2.399
335 3HD1 LEU 41 HD13 LEU 41 0.527 -0.417 1.347
336 1HD2 LEU 41 HD21 LEU 41 2.354 0.260 4.495
337 2HD2 LEU 41 HD23 LEU 41 1.205 0.921 3.345
338 3HD2 LEU 41 HD22 LEU 41 0.711 -0.345 4.448
339 H HIS 42 HN HIS 42 1.928 -5.328 3.874
340 HA HIS 42 HA HIS 42 -0.119 -5.646 1.927
341 1HB HIS 42 HB2 HIS 42 1.921 -7.158 2.262
342 2HB HIS 42 HB1 HIS 42 1.051 -7.869 3.607
343 HD1 HIS 42 HD1 HIS 42 0.541 -7.443 -0.096
344 HD2 HIS 42 HD2 HIS 42 -0.800 -9.749 3.008
345 HE1 HIS 42 HE1 HIS 42 -0.863 -9.163 -1.089
346 H ASP 43 HN ASP 43 -0.017 -6.835 5.299
347 HA ASP 43 HA ASP 43 -2.754 -7.756 5.167
348 1HB ASP 43 HB2 ASP 43 -1.273 -8.590 6.990
349 2HB ASP 43 HB1 ASP 43 -1.274 -6.964 7.692
350 H HIS 44 HN HIS 44 -1.278 -4.731 6.289
351 HA HIS 44 HA HIS 44 -3.785 -3.746 7.299
352 1HB HIS 44 HB2 HIS 44 -1.316 -2.277 6.293
353 2HB HIS 44 HB1 HIS 44 -2.737 -1.436 6.918
354 HD1 HIS 44 HD1 HIS 44 -3.411 -3.061 9.350
355 HD2 HIS 44 HD2 HIS 44 0.477 -2.194 8.396
356 HE1 HIS 44 HE1 HIS 44 -2.120 -3.269 11.426
357 H ALA 45 HN ALA 45 -2.324 -3.993 4.169
358 HA ALA 45 HA ALA 45 -4.262 -2.217 2.888
359 1HB ALA 45 HB1 ALA 45 -2.625 -4.461 1.603
360 2HB ALA 45 HB3 ALA 45 -3.494 -3.201 0.748
361 3HB ALA 45 HB2 ALA 45 -2.081 -2.792 1.708
362 H ASP 46 HN ASP 46 -3.931 -5.459 3.931
363 HA ASP 46 HA ASP 46 -6.161 -6.495 2.415
364 1HB ASP 46 HB2 ASP 46 -4.309 -7.864 3.692
365 2HB ASP 46 HB1 ASP 46 -5.272 -7.571 5.115
366 H GLU 47 HN GLU 47 -5.677 -4.750 5.435
367 HA GLU 47 HA GLU 47 -8.380 -5.197 6.382
368 1HB GLU 47 HB2 GLU 47 -6.673 -2.680 6.718
369 2HB GLU 47 HB1 GLU 47 -8.090 -3.071 7.656
370 1HG GLU 47 HG2 GLU 47 -7.008 -4.991 8.665
371 2HG GLU 47 HG1 GLU 47 -5.568 -4.767 7.669
372 H LEU 48 HN LEU 48 -6.699 -3.011 4.258
373 HA LEU 48 HA LEU 48 -9.095 -1.514 3.593
374 1HB LEU 48 HB2 LEU 48 -6.494 -0.877 3.377
375 2HB LEU 48 HB1 LEU 48 -6.675 -1.623 1.800
376 HG LEU 48 HG LEU 48 -8.585 -0.059 1.301
377 1HD1 LEU 48 HD11 LEU 48 -7.679 1.271 3.902
378 2HD1 LEU 48 HD13 LEU 48 -8.846 1.935 2.776
379 3HD1 LEU 48 HD12 LEU 48 -9.229 0.485 3.673
380 1HD2 LEU 48 HD21 LEU 48 -6.261 0.443 0.554
381 2HD2 LEU 48 HD23 LEU 48 -7.134 1.919 0.933
382 3HD2 LEU 48 HD22 LEU 48 -5.958 1.277 2.069
383 OH TYR 49 OH TYR 49 -10.446 -9.491 -3.275
384 H TYR 49 HN TYR 49 -8.763 -4.541 3.165
385 HA TYR 49 HA TYR 49 -9.918 -4.623 0.423
386 1HB TYR 49 HB2 TYR 49 -7.586 -5.618 0.516
387 2HB TYR 49 HB1 TYR 49 -8.202 -6.754 1.712
388 HD1 TYR 49 HD1 TYR 49 -9.051 -5.508 -1.720
389 HD2 TYR 49 HD2 TYR 49 -9.050 -8.796 0.981
390 HE1 TYR 49 HE1 TYR 49 -9.903 -6.942 -3.469
391 HE2 TYR 49 HE2 TYR 49 -9.906 -10.246 -0.781
392 HH TYR 49 HH TYR 49 -10.902 -10.240 -2.879
393 NH1 ARG 50 NH1 ARG 50 -6.498 -9.477 6.784
394 NH2 ARG 50 NH2 ARG 50 -6.352 -7.262 7.382
395 H ARG 50 HN ARG 50 -9.867 -5.505 3.713
396 HA ARG 50 HA ARG 50 -12.220 -7.306 3.497
397 1HB ARG 50 HB2 ARG 50 -10.292 -6.767 5.822
398 2HB ARG 50 HB1 ARG 50 -11.629 -7.895 5.877
399 1HG ARG 50 HG2 ARG 50 -10.635 -9.353 4.278
400 2HG ARG 50 HG1 ARG 50 -9.497 -8.145 3.744
401 1HD ARG 50 HD2 ARG 50 -9.467 -9.443 6.543
402 2HD ARG 50 HD1 ARG 50 -8.419 -9.878 5.192
403 HE ARG 50 HE ARG 50 -8.223 -7.079 5.717
404 1HH1 ARG 50 HH12 ARG 50 -6.938 -10.223 6.283
405 2HH1 ARG 50 HH11 ARG 50 -5.680 -9.691 7.328
406 1HH2 ARG 50 HH22 ARG 50 -6.693 -6.321 7.355
407 2HH2 ARG 50 HH21 ARG 50 -5.516 -7.427 7.923
408 H SER 51 HN SER 51 -10.926 -4.875 5.699
409 HA SER 51 HA SER 51 -13.446 -4.141 6.765
410 1HB SER 51 HB2 SER 51 -11.071 -2.244 6.427
411 2HB SER 51 HB1 SER 51 -12.176 -2.379 7.808
412 HG SER 51 HG1 SER 51 -10.740 -3.753 8.512
413 H CYS 52 HN CYS 52 -11.663 -3.322 3.867
414 HA CYS 52 HA CYS 52 -13.410 -1.098 3.221
415 1HB CYS 52 HB2 CYS 52 -12.406 -1.017 1.128
416 2HB CYS 52 HB1 CYS 52 -11.122 -1.597 2.144
417 HG CYS 52 HG1 CYS 52 -12.500 -3.186 -0.102
418 H LEU 53 HN LEU 53 -13.452 -4.553 2.682
419 HA LEU 53 HA LEU 53 -15.570 -4.487 0.742
420 1HB LEU 53 HB2 LEU 53 -14.156 -6.549 1.204
421 2HB LEU 53 HB1 LEU 53 -14.909 -6.662 2.784
422 HG LEU 53 HG LEU 53 -17.110 -7.073 1.798
423 1HD1 LEU 53 HD11 LEU 53 -15.689 -6.882 -0.894
424 2HD1 LEU 53 HD13 LEU 53 -17.361 -7.366 -0.654
425 3HD1 LEU 53 HD12 LEU 53 -16.876 -5.726 -0.305
426 1HD2 LEU 53 HD22 LEU 53 -14.936 -8.802 0.564
427 2HD2 LEU 53 HD21 LEU 53 -15.609 -8.997 2.174
428 3HD2 LEU 53 HD23 LEU 53 -16.617 -9.271 0.764
429 H ALA 54 HN ALA 54 -15.391 -4.159 4.158
430 HA ALA 54 HA ALA 54 -18.125 -4.737 4.771
431 1HB ALA 54 HB2 ALA 54 -16.426 -4.261 6.559
432 2HB ALA 54 HB1 ALA 54 -16.407 -2.574 6.058
433 3HB ALA 54 HB3 ALA 54 -17.866 -3.264 6.733
434 NH1 ARG 55 NH1 ARG 55 -19.271 0.318 5.470
435 NH2 ARG 55 NH2 ARG 55 -19.348 2.468 6.352
436 H ARG 55 HN ARG 55 -16.767 -2.347 2.875
437 HA ARG 55 HA ARG 55 -19.276 -0.731 2.959
438 1HB ARG 55 HB2 ARG 55 -17.008 0.488 3.444
439 2HB ARG 55 HB1 ARG 55 -16.595 0.119 1.782
440 1HG ARG 55 HG2 ARG 55 -17.534 2.357 1.787
441 2HG ARG 55 HG1 ARG 55 -18.687 1.302 1.012
442 1HD ARG 55 HD2 ARG 55 -19.711 2.847 2.714
443 2HD ARG 55 HD1 ARG 55 -20.030 1.172 3.106
444 HE ARG 55 HE ARG 55 -17.704 2.610 4.307
445 1HH1 ARG 55 HH12 ARG 55 -19.031 -0.284 4.704
446 2HH1 ARG 55 HH11 ARG 55 -19.666 -0.108 6.285
447 1HH2 ARG 55 HH22 ARG 55 -19.142 3.444 6.210
448 2HH2 ARG 55 HH21 ARG 55 -19.755 2.189 7.223
449 H PHE 56 HN PHE 56 -16.752 -2.033 0.917
450 HA PHE 56 HA PHE 56 -18.192 -1.584 -1.518
451 1HB PHE 56 HB2 PHE 56 -15.900 -3.532 -1.051
452 2HB PHE 56 HB1 PHE 56 -16.411 -2.849 -2.575
453 HD1 PHE 56 HD2 PHE 56 -16.839 0.042 -0.925
454 HD2 PHE 56 HD1 PHE 56 -13.637 -2.683 -1.676
455 HE1 PHE 56 HE2 PHE 56 -15.246 1.844 -0.677
456 HE2 PHE 56 HE1 PHE 56 -12.037 -0.851 -1.416
457 HZ PHE 56 HZ PHE 56 -12.840 1.427 -0.914
458 H GLY 57 HN GLY 57 -19.067 -3.548 0.864
459 1HA GLY 57 HA2 GLY 57 -19.745 -5.860 -0.878
460 2HA GLY 57 HA1 GLY 57 -20.092 -5.715 0.864
461 H ASP 58 HN ASP 58 -20.559 -3.420 -1.742
462 HA ASP 58 HA ASP 58 -23.271 -2.829 -0.855
463 1HB ASP 58 HB2 ASP 58 -23.154 -1.045 -2.576
464 2HB ASP 58 HB1 ASP 58 -21.796 -1.006 -1.442
465 H ASP 59 HN ASP 59 -22.910 -5.428 -2.043
466 HA ASP 59 HA ASP 59 -23.993 -5.184 -4.746
467 1HB ASP 59 HB2 ASP 59 -23.816 -7.593 -2.897
468 2HB ASP 59 HB1 ASP 59 -24.234 -7.649 -4.615
469 H GLY 60 HN GLY 60 -26.147 -6.097 -5.273
470 1HA GLY 60 HA2 GLY 60 -28.125 -6.600 -3.330
471 2HA GLY 60 HA1 GLY 60 -28.135 -4.855 -3.662
472 H GLU 61 HN GLU 61 -30.356 -5.948 -4.404
473 HA GLU 61 HA GLU 61 -30.097 -6.544 -7.312
474 1HB GLU 61 HB2 GLU 61 -32.628 -7.329 -6.677
475 2HB GLU 61 HB1 GLU 61 -31.255 -8.414 -6.655
476 1HG GLU 61 HG2 GLU 61 -32.527 -8.629 -4.564
477 2HG GLU 61 HG1 GLU 61 -30.968 -7.932 -4.181
478 H ASN 62 HN ASN 62 -31.707 -4.671 -4.856
479 HA ASN 62 HA ASN 62 -32.436 -2.648 -6.856
480 1HB ASN 62 HB2 ASN 62 -34.499 -3.952 -5.021
481 2HB ASN 62 HB1 ASN 62 -34.743 -2.436 -5.862
482 1HD2 ASN 62 HD21 ASN 62 -34.803 -5.940 -8.001
483 2HD2 ASN 62 HD22 ASN 62 -34.109 -5.911 -6.453
484 H LEU 63 HN LEU 63 -32.855 -3.807 -3.608
485 HA LEU 63 HA LEU 63 -32.385 -2.929 -1.518
486 1HB LEU 63 HB2 LEU 63 -31.027 -0.584 -2.950
487 2HB LEU 63 HB1 LEU 63 -30.843 -1.046 -1.282
488 HG LEU 63 HG LEU 63 -29.976 -2.817 -3.602
489 1HD1 LEU 63 HD11 LEU 63 -28.336 -1.072 -1.712
490 2HD1 LEU 63 HD13 LEU 63 -27.667 -2.166 -2.914
491 3HD1 LEU 63 HD12 LEU 63 -28.596 -0.763 -3.420
492 1HD2 LEU 63 HD22 LEU 63 -29.528 -3.018 -0.588
493 2HD2 LEU 63 HD21 LEU 63 -30.565 -4.075 -1.533
494 3HD2 LEU 63 HD23 LEU 63 -28.831 -4.102 -1.776
495 1H MET 1 HT1 MET 1 22.185 2.593 -2.820
496 2H MET 1 HT3 MET 1 22.260 1.976 -1.245
497 3H MET 1 HT2 MET 1 23.059 3.421 -1.654
498 HA MET 1 HA MET 1 24.881 2.367 -2.221
499 1HB MET 1 HB2 MET 1 23.371 -0.243 -1.842
500 2HB MET 1 HB1 MET 1 25.097 -0.058 -1.931
501 1HG MET 1 HG2 MET 1 25.078 1.264 0.136
502 2HG MET 1 HG1 MET 1 23.340 1.157 0.221
503 1HE MET 1 HE3 MET 1 22.166 -1.118 0.010
504 2HE MET 1 HE2 MET 1 22.546 -2.377 1.154
505 3HE MET 1 HE1 MET 1 22.138 -0.772 1.755
506 H THR 2 HN THR 2 21.943 1.187 -3.742
507 HA THR 2 HA THR 2 23.469 1.148 -6.277
508 HB THR 2 HB THR 2 21.444 -1.025 -5.455
509 HG1 THR 2 HG1 THR 2 23.115 -1.568 -4.291
510 1HG2 THR 2 HG22 THR 2 21.973 -0.613 -7.968
511 2HG2 THR 2 HG21 THR 2 23.651 -0.936 -7.589
512 3HG2 THR 2 HG23 THR 2 22.447 -2.205 -7.394
513 H LYS 3 HN LYS 3 22.224 1.777 -8.036
514 HA LYS 3 HA LYS 3 20.099 3.584 -7.443
515 1HB LYS 3 HB2 LYS 3 21.440 3.600 -9.601
516 2HB LYS 3 HB1 LYS 3 20.576 2.152 -10.090
517 1HG LYS 3 HG2 LYS 3 18.417 3.723 -9.530
518 2HG LYS 3 HG1 LYS 3 19.591 4.984 -9.732
519 1HD LYS 3 HD2 LYS 3 18.453 4.639 -11.851
520 2HD LYS 3 HD1 LYS 3 20.136 4.191 -11.996
521 1HE LYS 3 HE2 LYS 3 18.475 2.536 -13.027
522 2HE LYS 3 HE1 LYS 3 19.626 1.812 -11.931
523 1HZ LYS 3 HZ1 LYS 3 17.335 2.611 -10.457
524 2HZ LYS 3 HZ3 LYS 3 16.856 1.731 -11.809
525 3HZ LYS 3 HZ2 LYS 3 17.967 1.067 -10.732
526 H GLN 4 HN GLN 4 20.271 0.186 -8.086
527 HA GLN 4 HA GLN 4 17.548 -0.294 -8.784
528 1HB GLN 4 HB2 GLN 4 19.292 -2.074 -7.019
529 2HB GLN 4 HB1 GLN 4 17.907 -2.580 -7.965
530 1HG GLN 4 HG2 GLN 4 20.554 -1.556 -9.089
531 2HG GLN 4 HG1 GLN 4 19.907 -3.180 -9.214
532 1HE2 GLN 4 HE21 GLN 4 17.647 -2.375 -11.833
533 2HE2 GLN 4 HE22 GLN 4 18.089 -3.532 -10.678
534 H GLU 5 HN GLU 5 19.170 0.088 -5.717
535 HA GLU 5 HA GLU 5 16.920 -0.482 -4.071
536 1HB GLU 5 HB2 GLU 5 19.277 1.393 -3.585
537 2HB GLU 5 HB1 GLU 5 18.244 0.697 -2.367
538 1HG GLU 5 HG2 GLU 5 18.946 -1.511 -2.759
539 2HG GLU 5 HG1 GLU 5 19.632 -1.161 -4.331
540 H LYS 6 HN LYS 6 18.197 2.492 -5.497
541 HA LYS 6 HA LYS 6 16.181 4.186 -4.409
542 1HB LYS 6 HB2 LYS 6 17.773 4.451 -6.992
543 2HB LYS 6 HB1 LYS 6 16.729 5.710 -6.351
544 1HG LYS 6 HG2 LYS 6 17.985 5.640 -4.203
545 2HG LYS 6 HG1 LYS 6 19.044 4.415 -4.865
546 1HD LYS 6 HD2 LYS 6 19.953 5.993 -6.486
547 2HD LYS 6 HD1 LYS 6 18.700 7.175 -6.119
548 1HE LYS 6 HE2 LYS 6 20.847 7.663 -4.890
549 2HE LYS 6 HE1 LYS 6 19.519 7.344 -3.786
550 1HZ LYS 6 HZ1 LYS 6 20.825 4.908 -4.433
551 2HZ LYS 6 HZ3 LYS 6 21.940 6.052 -3.942
552 3HZ LYS 6 HZ2 LYS 6 20.646 5.663 -2.942
553 H THR 7 HN THR 7 16.105 1.906 -7.005
554 HA THR 7 HA THR 7 13.760 3.077 -8.257
555 HB THR 7 HB THR 7 14.590 0.121 -8.444
556 HG1 THR 7 HG1 THR 7 16.422 1.230 -8.626
557 1HG2 THR 7 HG22 THR 7 12.593 1.095 -9.803
558 2HG2 THR 7 HG21 THR 7 13.724 2.224 -10.526
559 3HG2 THR 7 HG23 THR 7 13.900 0.498 -10.811
560 H ALA 8 HN ALA 8 14.408 0.386 -6.059
561 HA ALA 8 HA ALA 8 11.692 -0.346 -5.614
562 1HB ALA 8 HB1 ALA 8 14.019 -0.496 -3.649
563 2HB ALA 8 HB3 ALA 8 12.508 -1.374 -3.500
564 3HB ALA 8 HB2 ALA 8 13.612 -1.747 -4.815
565 H LEU 9 HN LEU 9 13.754 2.081 -4.322
566 HA LEU 9 HA LEU 9 12.174 2.881 -2.105
567 1HB LEU 9 HB2 LEU 9 14.515 3.658 -2.468
568 2HB LEU 9 HB1 LEU 9 14.005 4.502 -3.915
569 HG LEU 9 HG LEU 9 12.493 5.921 -2.559
570 1HD1 LEU 9 HD11 LEU 9 13.936 4.568 -0.242
571 2HD1 LEU 9 HD13 LEU 9 12.848 5.934 -0.084
572 3HD1 LEU 9 HD12 LEU 9 12.225 4.380 -0.595
573 1HD2 LEU 9 HD21 LEU 9 14.737 6.672 -3.221
574 2HD2 LEU 9 HD23 LEU 9 14.285 7.313 -1.654
575 3HD2 LEU 9 HD22 LEU 9 15.414 5.964 -1.763
576 H ASN 10 HN ASN 10 12.245 3.786 -5.489
577 HA ASN 10 HA ASN 10 10.188 5.778 -5.282
578 1HB ASN 10 HB2 ASN 10 11.008 4.090 -7.678
579 2HB ASN 10 HB1 ASN 10 9.915 5.465 -7.744
580 1HD2 ASN 10 HD21 ASN 10 13.703 6.342 -8.122
581 2HD2 ASN 10 HD22 ASN 10 12.907 4.947 -8.660
582 H MET 11 HN MET 11 10.166 2.318 -5.821
583 HA MET 11 HA MET 11 7.372 2.181 -6.447
584 1HB MET 11 HB2 MET 11 9.142 0.083 -5.126
585 2HB MET 11 HB1 MET 11 7.547 -0.214 -5.784
586 1HG MET 11 HG2 MET 11 9.941 0.803 -7.339
587 2HG MET 11 HG1 MET 11 9.316 -0.819 -7.401
588 1HE MET 11 HE1 MET 11 6.848 -1.233 -7.801
589 2HE MET 11 HE3 MET 11 6.076 -0.628 -9.246
590 3HE MET 11 HE2 MET 11 7.560 -1.577 -9.392
591 H ALA 12 HN ALA 12 9.157 2.046 -3.416
592 HA ALA 12 HA ALA 12 6.894 1.378 -1.793
593 1HB ALA 12 HB1 ALA 12 9.342 3.035 -1.036
594 2HB ALA 12 HB3 ALA 12 8.217 2.308 0.100
595 3HB ALA 12 HB2 ALA 12 9.231 1.285 -0.908
596 NH1 ARG 13 NH1 ARG 13 10.647 7.773 -4.152
597 NH2 ARG 13 NH2 ARG 13 11.073 10.050 -4.186
598 H ARG 13 HN ARG 13 8.341 4.409 -2.775
599 HA ARG 13 HA ARG 13 6.499 6.064 -1.329
600 1HB ARG 13 HB2 ARG 13 8.689 6.811 -2.375
601 2HB ARG 13 HB1 ARG 13 7.911 6.770 -3.941
602 1HG ARG 13 HG2 ARG 13 6.176 8.389 -3.030
603 2HG ARG 13 HG1 ARG 13 7.124 8.495 -1.561
604 1HD ARG 13 HD2 ARG 13 8.047 9.261 -4.376
605 2HD ARG 13 HD1 ARG 13 7.749 10.355 -3.030
606 HE ARG 13 HE ARG 13 9.691 9.209 -1.873
607 1HH1 ARG 13 HH12 ARG 13 10.120 7.002 -3.786
608 2HH1 ARG 13 HH11 ARG 13 11.352 7.576 -4.841
609 1HH2 ARG 13 HH22 ARG 13 10.864 10.968 -3.841
610 2HH2 ARG 13 HH21 ARG 13 11.793 9.956 -4.878
611 H PHE 14 HN PHE 14 6.419 4.466 -4.450
612 HA PHE 14 HA PHE 14 4.197 5.924 -5.467
613 1HB PHE 14 HB2 PHE 14 5.487 4.407 -6.948
614 2HB PHE 14 HB1 PHE 14 4.998 3.022 -5.986
615 HD1 PHE 14 HD1 PHE 14 2.704 5.840 -6.934
616 HD2 PHE 14 HD2 PHE 14 3.871 1.796 -7.643
617 HE1 PHE 14 HE1 PHE 14 0.711 5.500 -8.297
618 HE2 PHE 14 HE2 PHE 14 1.868 1.468 -9.010
619 HZ PHE 14 HZ PHE 14 0.281 3.316 -9.344
620 H ILE 15 HN ILE 15 4.380 2.875 -3.656
621 HA ILE 15 HA ILE 15 1.611 2.402 -3.498
622 HB ILE 15 HB ILE 15 3.772 1.869 -1.412
623 1HG1 ILE 15 HG12 ILE 15 2.541 0.228 -3.663
624 2HG1 ILE 15 HG11 ILE 15 4.183 0.840 -3.640
625 1HG2 ILE 15 HG22 ILE 15 1.470 1.747 -0.429
626 2HG2 ILE 15 HG21 ILE 15 0.998 0.642 -1.705
627 3HG2 ILE 15 HG23 ILE 15 2.189 0.160 -0.507
628 1HD1 ILE 15 HD2 ILE 15 4.666 -0.575 -1.643
629 2HD1 ILE 15 HD1 ILE 15 3.041 -1.243 -1.737
630 3HD1 ILE 15 HD3 ILE 15 4.169 -1.521 -3.039
631 NH1 ARG 16 NH2 ARG 16 2.502 8.939 4.574
632 NH2 ARG 16 NH1 ARG 16 4.748 9.450 4.432
633 H ARG 16 HN ARG 16 3.678 4.418 -1.471
634 HA ARG 16 HA ARG 16 1.650 5.134 0.378
635 1HB ARG 16 HB2 ARG 16 4.040 5.739 0.744
636 2HB ARG 16 HB1 ARG 16 3.994 6.798 -0.658
637 1HG ARG 16 HG2 ARG 16 2.417 8.240 0.360
638 2HG ARG 16 HG1 ARG 16 2.159 7.142 1.714
639 1HD ARG 16 HD2 ARG 16 4.531 7.508 2.401
640 2HD ARG 16 HD1 ARG 16 4.757 8.616 1.057
641 HE ARG 16 HE ARG 16 3.048 10.088 2.128
642 1HH1 ARG 16 HH22 ARG 16 1.622 8.774 4.123
643 2HH1 ARG 16 HH21 ARG 16 2.548 8.866 5.577
644 1HH2 ARG 16 HH12 ARG 16 5.558 9.657 3.875
645 2HH2 ARG 16 HH11 ARG 16 4.865 9.403 5.428
646 H SER 17 HN SER 17 2.518 6.464 -2.750
647 HA SER 17 HA SER 17 0.611 8.602 -2.645
648 1HB SER 17 HB2 SER 17 1.790 7.274 -5.121
649 2HB SER 17 HB1 SER 17 1.268 8.963 -4.939
650 HG SER 17 HG1 SER 17 3.559 7.752 -4.098
651 H GLN 18 HN GLN 18 0.430 5.258 -3.739
652 HA GLN 18 HA GLN 18 -2.043 5.552 -5.162
653 1HB GLN 18 HB2 GLN 18 -0.925 3.126 -3.661
654 2HB GLN 18 HB1 GLN 18 -2.287 3.074 -4.761
655 1HG GLN 18 HG2 GLN 18 -0.905 3.696 -6.638
656 2HG GLN 18 HG1 GLN 18 0.449 4.097 -5.592
657 1HE2 GLN 18 HE21 GLN 18 -0.473 0.107 -5.964
658 2HE2 GLN 18 HE22 GLN 18 -1.745 1.230 -5.997
659 H THR 19 HN THR 19 -1.158 4.757 -1.904
660 HA THR 19 HA THR 19 -3.788 4.382 -0.915
661 HB THR 19 HB THR 19 -1.246 5.255 0.563
662 HG1 THR 19 HG1 THR 19 -0.606 3.430 -0.308
663 1HG2 THR 19 HG21 THR 19 -3.589 3.430 1.338
664 2HG2 THR 19 HG23 THR 19 -2.211 3.839 2.349
665 3HG2 THR 19 HG22 THR 19 -3.397 5.068 1.947
666 H LEU 20 HN LEU 20 -1.709 7.213 -1.170
667 HA LEU 20 HA LEU 20 -3.370 8.939 0.354
668 1HB LEU 20 HB2 LEU 20 -1.071 9.567 -0.353
669 2HB LEU 20 HB1 LEU 20 -1.598 9.620 -2.020
670 HG LEU 20 HG LEU 20 -3.186 11.464 -1.482
671 1HD1 LEU 20 HD11 LEU 20 -1.928 11.360 1.296
672 2HD1 LEU 20 HD13 LEU 20 -3.036 12.591 0.717
673 3HD1 LEU 20 HD12 LEU 20 -3.597 10.950 0.925
674 1HD2 LEU 20 HD22 LEU 20 -0.321 11.976 -0.620
675 2HD2 LEU 20 HD21 LEU 20 -0.924 11.985 -2.272
676 3HD2 LEU 20 HD23 LEU 20 -1.473 13.200 -1.135
677 H THR 21 HN THR 21 -3.099 8.654 -3.140
678 HA THR 21 HA THR 21 -5.282 10.371 -3.678
679 HB THR 21 HB THR 21 -4.383 8.034 -5.451
680 HG1 THR 21 HG1 THR 21 -2.470 8.862 -5.053
681 1HG2 THR 21 HG22 THR 21 -6.109 9.777 -6.305
682 2HG2 THR 21 HG21 THR 21 -4.896 11.011 -6.011
683 3HG2 THR 21 HG23 THR 21 -4.614 9.774 -7.227
684 H LEU 22 HN LEU 22 -5.164 6.904 -3.130
685 HA LEU 22 HA LEU 22 -7.935 6.573 -3.831
686 1HB LEU 22 HB2 LEU 22 -5.884 4.873 -2.438
687 2HB LEU 22 HB1 LEU 22 -7.561 4.512 -2.122
688 HG LEU 22 HG LEU 22 -6.556 3.233 -4.076
689 1HD1 LEU 22 HD11 LEU 22 -8.983 5.008 -4.640
690 2HD1 LEU 22 HD13 LEU 22 -8.585 3.542 -5.500
691 3HD1 LEU 22 HD12 LEU 22 -9.002 3.472 -3.799
692 1HD2 LEU 22 HD21 LEU 22 -5.230 5.046 -5.107
693 2HD2 LEU 22 HD23 LEU 22 -6.378 4.376 -6.242
694 3HD2 LEU 22 HD22 LEU 22 -6.696 5.928 -5.498
695 H LEU 23 HN LEU 23 -6.262 7.577 -0.960
696 HA LEU 23 HA LEU 23 -8.297 7.030 0.918
697 1HB LEU 23 HB2 LEU 23 -6.039 8.012 1.525
698 2HB LEU 23 HB1 LEU 23 -6.563 9.531 0.816
699 HG LEU 23 HG LEU 23 -8.409 8.351 2.851
700 1HD1 LEU 23 HD11 LEU 23 -5.787 9.738 3.556
701 2HD1 LEU 23 HD13 LEU 23 -7.084 9.325 4.668
702 3HD1 LEU 23 HD12 LEU 23 -6.159 8.052 3.892
703 1HD2 LEU 23 HD22 LEU 23 -7.326 11.170 2.358
704 2HD2 LEU 23 HD21 LEU 23 -8.853 10.589 1.729
705 3HD2 LEU 23 HD23 LEU 23 -8.628 10.748 3.455
706 H GLU 24 HN GLU 24 -7.793 9.768 -1.215
707 HA GLU 24 HA GLU 24 -10.044 11.318 -0.474
708 1HB GLU 24 HB2 GLU 24 -9.414 10.848 -3.409
709 2HB GLU 24 HB1 GLU 24 -10.009 12.294 -2.639
710 1HG GLU 24 HG2 GLU 24 -7.850 12.897 -1.897
711 2HG GLU 24 HG1 GLU 24 -7.186 11.281 -2.217
712 H LYS 25 HN LYS 25 -9.692 8.923 -2.966
713 HA LYS 25 HA LYS 25 -12.447 8.789 -3.628
714 1HB LYS 25 HB2 LYS 25 -10.467 6.503 -3.862
715 2HB LYS 25 HB1 LYS 25 -11.867 6.787 -4.876
716 1HG LYS 25 HG2 LYS 25 -9.299 8.428 -4.769
717 2HG LYS 25 HG1 LYS 25 -9.954 7.583 -6.144
718 1HD LYS 25 HD2 LYS 25 -11.871 9.129 -6.265
719 2HD LYS 25 HD1 LYS 25 -11.303 10.016 -4.868
720 1HE LYS 25 HE2 LYS 25 -9.878 9.814 -7.541
721 2HE LYS 25 HE1 LYS 25 -10.619 11.230 -6.821
722 1HZ LYS 25 HZ1 LYS 25 -8.708 10.243 -4.991
723 2HZ LYS 25 HZ3 LYS 25 -7.988 10.366 -6.508
724 3HZ LYS 25 HZ2 LYS 25 -8.735 11.693 -5.820
725 H LEU 26 HN LEU 26 -10.797 7.345 -0.897
726 HA LEU 26 HA LEU 26 -12.916 5.366 -0.589
727 1HB LEU 26 HB2 LEU 26 -10.960 6.538 1.441
728 2HB LEU 26 HB1 LEU 26 -12.074 5.238 1.799
729 HG LEU 26 HG LEU 26 -9.974 5.074 -0.414
730 1HD1 LEU 26 HD12 LEU 26 -8.949 5.228 1.832
731 2HD1 LEU 26 HD11 LEU 26 -9.958 3.901 2.376
732 3HD1 LEU 26 HD13 LEU 26 -8.736 3.630 1.142
733 1HD2 LEU 26 HD22 LEU 26 -11.699 2.927 0.878
734 2HD2 LEU 26 HD21 LEU 26 -11.923 3.561 -0.745
735 3HD2 LEU 26 HD23 LEU 26 -10.473 2.667 -0.352
736 H ASN 27 HN ASN 27 -12.254 8.658 0.339
737 HA ASN 27 HA ASN 27 -14.474 8.870 2.154
738 1HB ASN 27 HB2 ASN 27 -13.193 11.048 0.429
739 2HB ASN 27 HB1 ASN 27 -14.294 11.342 1.758
740 1HD2 ASN 27 HD21 ASN 27 -11.841 10.137 4.215
741 2HD2 ASN 27 HD22 ASN 27 -13.477 9.917 3.870
742 H GLU 28 HN GLU 28 -14.053 9.707 -1.251
743 HA GLU 28 HA GLU 28 -16.739 10.494 -1.719
744 1HB GLU 28 HB2 GLU 28 -15.076 9.076 -3.816
745 2HB GLU 28 HB1 GLU 28 -16.260 10.355 -4.032
746 1HG GLU 28 HG2 GLU 28 -13.499 10.677 -2.806
747 2HG GLU 28 HG1 GLU 28 -14.100 11.375 -4.297
748 H LEU 29 HN LEU 29 -15.215 7.381 -1.699
749 HA LEU 29 HA LEU 29 -17.650 6.045 -2.697
750 1HB LEU 29 HB2 LEU 29 -15.004 4.875 -1.744
751 2HB LEU 29 HB1 LEU 29 -16.298 3.977 -2.490
752 HG LEU 29 HG LEU 29 -14.978 6.312 -3.941
753 1HD1 LEU 29 HD11 LEU 29 -14.370 3.314 -4.114
754 2HD1 LEU 29 HD13 LEU 29 -13.650 4.554 -5.129
755 3HD1 LEU 29 HD12 LEU 29 -13.290 4.503 -3.409
756 1HD2 LEU 29 HD21 LEU 29 -17.221 5.549 -4.726
757 2HD2 LEU 29 HD23 LEU 29 -15.944 5.231 -5.890
758 3HD2 LEU 29 HD22 LEU 29 -16.569 3.927 -4.892
759 H ASP 30 HN ASP 30 -17.916 7.445 -0.374
760 HA ASP 30 HA ASP 30 -18.442 7.329 1.906
761 1HB ASP 30 HB2 ASP 30 -20.343 5.599 2.243
762 2HB ASP 30 HB1 ASP 30 -20.578 6.856 1.050
763 H ALA 31 HN ALA 31 -16.157 5.742 1.275
764 HA ALA 31 HA ALA 31 -16.269 3.615 3.360
765 1HB ALA 31 HB2 ALA 31 -15.512 2.925 1.076
766 2HB ALA 31 HB1 ALA 31 -14.232 4.125 1.147
767 3HB ALA 31 HB3 ALA 31 -14.214 2.754 2.240
768 H ASP 32 HN ASP 32 -16.382 6.160 4.120
769 HA ASP 32 HA ASP 32 -13.912 7.547 4.415
770 1HB ASP 32 HB2 ASP 32 -16.074 8.634 4.959
771 2HB ASP 32 HB1 ASP 32 -16.274 7.531 6.327
772 H GLU 33 HN GLU 33 -15.432 5.058 6.261
773 HA GLU 33 HA GLU 33 -13.641 5.094 8.502
774 1HB GLU 33 HB2 GLU 33 -14.341 2.364 7.570
775 2HB GLU 33 HB1 GLU 33 -14.606 3.081 9.137
776 1HG GLU 33 HG2 GLU 33 -16.801 2.676 8.300
777 2HG GLU 33 HG1 GLU 33 -16.549 4.403 8.068
778 H GLN 34 HN GLN 34 -13.593 3.562 5.371
779 HA GLN 34 HA GLN 34 -11.055 2.261 5.821
780 1HB GLN 34 HB2 GLN 34 -12.104 3.139 3.111
781 2HB GLN 34 HB1 GLN 34 -11.056 1.781 3.472
782 1HG GLN 34 HG2 GLN 34 -13.968 2.029 4.287
783 2HG GLN 34 HG1 GLN 34 -13.293 0.934 3.095
784 1HE2 GLN 34 HE21 GLN 34 -13.443 -0.335 6.815
785 2HE2 GLN 34 HE22 GLN 34 -14.444 0.844 6.122
786 H ALA 35 HN ALA 35 -12.003 5.483 5.004
787 HA ALA 35 HA ALA 35 -9.519 6.265 3.777
788 1HB ALA 35 HB2 ALA 35 -11.544 7.798 3.800
789 2HB ALA 35 HB1 ALA 35 -11.310 8.026 5.532
790 3HB ALA 35 HB3 ALA 35 -10.094 8.581 4.410
791 H ASP 36 HN ASP 36 -10.722 6.208 7.096
792 HA ASP 36 HA ASP 36 -8.404 7.254 8.369
793 1HB ASP 36 HB2 ASP 36 -10.148 6.889 9.905
794 2HB ASP 36 HB1 ASP 36 -10.502 5.273 9.288
795 H ILE 37 HN ILE 37 -9.341 3.951 7.778
796 HA ILE 37 HA ILE 37 -6.933 2.753 8.661
797 HB ILE 37 HB ILE 37 -8.749 1.829 6.385
798 1HG1 ILE 37 HG12 ILE 37 -8.829 1.307 9.398
799 2HG1 ILE 37 HG11 ILE 37 -9.975 2.292 8.525
800 1HG2 ILE 37 HG22 ILE 37 -6.568 0.616 6.503
801 2HG2 ILE 37 HG21 ILE 37 -6.865 0.255 8.194
802 3HG2 ILE 37 HG23 ILE 37 -7.885 -0.439 6.940
803 1HD1 ILE 37 HD2 ILE 37 -10.660 0.314 7.180
804 2HD1 ILE 37 HD1 ILE 37 -9.564 -0.695 8.116
805 3HD1 ILE 37 HD3 ILE 37 -10.925 0.081 8.900
806 H CYS 38 HN CYS 38 -7.779 4.364 5.736
807 HA CYS 38 HA CYS 38 -5.442 3.480 4.264
808 1HB CYS 38 HB2 CYS 38 -7.584 4.250 3.246
809 2HB CYS 38 HB1 CYS 38 -7.191 5.885 3.715
810 HG CYS 38 HG1 CYS 38 -5.591 6.104 1.832
811 H GLU 39 HN GLU 39 -6.122 6.174 6.470
812 HA GLU 39 HA GLU 39 -3.813 7.687 5.593
813 1HB GLU 39 HB2 GLU 39 -5.172 7.617 8.337
814 2HB GLU 39 HB1 GLU 39 -3.904 8.732 7.879
815 1HG GLU 39 HG2 GLU 39 -5.352 9.546 6.015
816 2HG GLU 39 HG1 GLU 39 -6.635 8.464 6.581
817 H SER 40 HN SER 40 -4.505 5.290 8.054
818 HA SER 40 HA SER 40 -1.879 5.172 9.117
819 1HB SER 40 HB2 SER 40 -3.910 2.882 8.805
820 2HB SER 40 HB1 SER 40 -2.654 3.011 10.055
821 HG SER 40 HG1 SER 40 -5.073 4.273 9.917
822 H LEU 41 HN LEU 41 -3.428 3.283 6.587
823 HA LEU 41 HA LEU 41 -1.169 1.757 5.856
824 1HB LEU 41 HB2 LEU 41 -3.664 1.614 5.076
825 2HB LEU 41 HB1 LEU 41 -3.199 2.771 3.859
826 HG LEU 41 HG LEU 41 -1.332 1.165 3.146
827 1HD1 LEU 41 HD11 LEU 41 -2.952 -0.698 4.907
828 2HD1 LEU 41 HD13 LEU 41 -1.628 -1.202 3.872
829 3HD1 LEU 41 HD12 LEU 41 -1.311 -0.187 5.263
830 1HD2 LEU 41 HD22 LEU 41 -4.192 0.132 2.956
831 2HD2 LEU 41 HD21 LEU 41 -3.474 1.324 1.882
832 3HD2 LEU 41 HD23 LEU 41 -2.868 -0.318 1.894
833 H HIS 42 HN HIS 42 -2.176 4.918 5.046
834 HA HIS 42 HA HIS 42 -0.501 5.444 2.813
835 1HB HIS 42 HB2 HIS 42 -2.334 6.996 3.598
836 2HB HIS 42 HB1 HIS 42 -1.341 7.425 4.965
837 HD1 HIS 42 HD1 HIS 42 -0.159 7.347 1.357
838 HD2 HIS 42 HD2 HIS 42 -0.632 9.932 4.503
839 HE1 HIS 42 HE1 HIS 42 0.822 9.486 0.669
840 H ASP 43 HN ASP 43 0.034 6.234 6.237
841 HA ASP 43 HA ASP 43 2.825 6.883 5.538
842 1HB ASP 43 HB2 ASP 43 1.513 7.920 7.567
843 2HB ASP 43 HB1 ASP 43 1.921 6.402 8.376
844 H HIS 44 HN HIS 44 1.123 4.050 6.408
845 HA HIS 44 HA HIS 44 3.450 2.713 7.521
846 1HB HIS 44 HB2 HIS 44 0.988 1.555 6.145
847 2HB HIS 44 HB1 HIS 44 2.232 0.578 6.914
848 HD1 HIS 44 HD1 HIS 44 2.108 3.296 9.053
849 HD2 HIS 44 HD2 HIS 44 -0.522 0.223 8.408
850 HE1 HIS 44 HE1 HIS 44 0.688 3.161 11.056
851 H ALA 45 HN ALA 45 2.143 3.442 4.415
852 HA ALA 45 HA ALA 45 3.869 1.623 2.959
853 1HB ALA 45 HB2 ALA 45 1.845 2.726 1.895
854 2HB ALA 45 HB1 ALA 45 2.673 4.272 2.052
855 3HB ALA 45 HB3 ALA 45 3.323 3.032 0.988
856 H ASP 46 HN ASP 46 4.038 4.714 4.480
857 HA ASP 46 HA ASP 46 6.570 5.411 3.191
858 1HB ASP 46 HB2 ASP 46 4.870 7.055 4.354
859 2HB ASP 46 HB1 ASP 46 5.757 6.590 5.799
860 H GLU 47 HN GLU 47 5.445 3.705 6.028
861 HA GLU 47 HA GLU 47 7.878 3.813 7.504
862 1HB GLU 47 HB2 GLU 47 5.835 1.548 7.247
863 2HB GLU 47 HB1 GLU 47 7.163 1.491 8.370
864 1HG GLU 47 HG2 GLU 47 5.161 3.771 8.389
865 2HG GLU 47 HG1 GLU 47 4.878 2.279 9.286
866 H LEU 48 HN LEU 48 6.697 2.014 4.800
867 HA LEU 48 HA LEU 48 8.964 0.260 4.622
868 1HB LEU 48 HB2 LEU 48 6.749 -0.099 3.420
869 2HB LEU 48 HB1 LEU 48 7.148 1.259 2.384
870 HG LEU 48 HG LEU 48 9.207 0.063 1.627
871 1HD1 LEU 48 HD11 LEU 48 7.972 -2.217 3.209
872 2HD1 LEU 48 HD13 LEU 48 9.328 -2.365 2.109
873 3HD1 LEU 48 HD12 LEU 48 9.496 -1.430 3.576
874 1HD2 LEU 48 HD22 LEU 48 6.590 -1.436 1.245
875 2HD2 LEU 48 HD21 LEU 48 7.103 -0.031 0.321
876 3HD2 LEU 48 HD23 LEU 48 8.008 -1.532 0.210
877 OH TYR 49 OH TYR 49 11.721 9.169 -1.070
878 H TYR 49 HN TYR 49 8.016 3.211 3.041
879 HA TYR 49 HA TYR 49 10.169 3.685 1.354
880 1HB TYR 49 HB2 TYR 49 8.058 5.053 1.537
881 2HB TYR 49 HB1 TYR 49 8.706 5.788 2.993
882 HD1 TYR 49 HD1 TYR 49 9.633 5.204 -0.564
883 HD2 TYR 49 HD2 TYR 49 9.943 7.736 2.840
884 HE1 TYR 49 HE1 TYR 49 10.810 6.852 -1.900
885 HE2 TYR 49 HE2 TYR 49 11.126 9.394 1.502
886 HH TYR 49 HH TYR 49 12.424 9.545 -0.532
887 NH1 ARG 50 NH1 ARG 50 6.965 6.049 9.139
888 NH2 ARG 50 NH2 ARG 50 6.768 7.735 7.594
889 H ARG 50 HN ARG 50 9.888 5.135 4.574
890 HA ARG 50 HA ARG 50 12.516 6.137 4.648
891 1HB ARG 50 HB2 ARG 50 12.120 6.429 7.050
892 2HB ARG 50 HB1 ARG 50 10.648 6.819 6.180
893 1HG ARG 50 HG2 ARG 50 10.013 4.317 6.619
894 2HG ARG 50 HG1 ARG 50 11.275 4.362 7.834
895 1HD ARG 50 HD2 ARG 50 9.203 4.934 8.952
896 2HD ARG 50 HD1 ARG 50 10.105 6.438 8.819
897 HE ARG 50 HE ARG 50 8.579 6.344 6.496
898 1HH1 ARG 50 HH12 ARG 50 7.458 5.264 9.519
899 2HH1 ARG 50 HH11 ARG 50 6.117 6.321 9.606
900 1HH2 ARG 50 HH22 ARG 50 7.110 8.212 6.784
901 2HH2 ARG 50 HH21 ARG 50 5.925 8.073 8.025
902 H SER 51 HN SER 51 11.254 2.944 5.604
903 HA SER 51 HA SER 51 13.737 2.149 6.803
904 1HB SER 51 HB2 SER 51 11.446 0.519 5.605
905 2HB SER 51 HB1 SER 51 12.773 -0.175 6.560
906 HG SER 51 HG1 SER 51 10.638 1.177 7.429
907 H CYS 52 HN CYS 52 12.625 2.341 3.506
908 HA CYS 52 HA CYS 52 14.705 0.604 2.457
909 1HB CYS 52 HB2 CYS 52 13.291 2.940 1.123
910 2HB CYS 52 HB1 CYS 52 14.229 1.742 0.296
911 HG CYS 52 HG1 CYS 52 12.323 0.110 0.407
912 H LEU 53 HN LEU 53 14.239 4.043 2.875
913 HA LEU 53 HA LEU 53 16.850 4.803 2.032
914 1HB LEU 53 HB2 LEU 53 14.982 6.085 4.064
915 2HB LEU 53 HB1 LEU 53 16.448 6.846 3.481
916 HG LEU 53 HG LEU 53 14.276 5.884 1.588
917 1HD1 LEU 53 HD11 LEU 53 14.646 8.681 2.755
918 2HD1 LEU 53 HD13 LEU 53 13.505 8.241 1.493
919 3HD1 LEU 53 HD12 LEU 53 13.303 7.603 3.113
920 1HD2 LEU 53 HD22 LEU 53 16.561 7.897 1.339
921 2HD2 LEU 53 HD21 LEU 53 16.544 6.301 0.609
922 3HD2 LEU 53 HD23 LEU 53 15.417 7.522 0.070
923 H ALA 54 HN ALA 54 15.714 3.311 4.905
924 HA ALA 54 HA ALA 54 17.996 4.137 6.496
925 1HB ALA 54 HB2 ALA 54 15.895 3.394 7.587
926 2HB ALA 54 HB1 ALA 54 16.117 1.778 6.923
927 3HB ALA 54 HB3 ALA 54 17.260 2.406 8.095
928 NH1 ARG 55 NH1 ARG 55 18.301 -5.569 6.032
929 NH2 ARG 55 NH2 ARG 55 18.767 -7.064 4.338
930 H ARG 55 HN ARG 55 17.083 0.973 5.137
931 HA ARG 55 HA ARG 55 19.680 -0.117 5.722
932 1HB ARG 55 HB2 ARG 55 17.524 -1.437 5.270
933 2HB ARG 55 HB1 ARG 55 17.802 -1.111 3.563
934 1HG ARG 55 HG2 ARG 55 20.062 -2.187 3.755
935 2HG ARG 55 HG1 ARG 55 19.691 -2.582 5.434
936 1HD ARG 55 HD2 ARG 55 17.583 -3.744 4.563
937 2HD ARG 55 HD1 ARG 55 18.207 -3.508 2.948
938 HE ARG 55 HE ARG 55 20.150 -4.958 3.668
939 1HH1 ARG 55 HH12 ARG 55 18.307 -4.630 6.388
940 2HH1 ARG 55 HH11 ARG 55 17.919 -6.289 6.619
941 1HH2 ARG 55 HH22 ARG 55 19.141 -7.238 3.424
942 2HH2 ARG 55 HH21 ARG 55 18.394 -7.850 4.841
943 H PHE 56 HN PHE 56 18.206 0.931 2.660
944 HA PHE 56 HA PHE 56 20.601 0.531 1.141
945 1HB PHE 56 HB2 PHE 56 18.393 2.541 0.586
946 2HB PHE 56 HB1 PHE 56 19.524 1.871 -0.572
947 HD1 PHE 56 HD2 PHE 56 19.451 -1.071 0.506
948 HD2 PHE 56 HD1 PHE 56 16.395 1.759 -0.424
949 HE1 PHE 56 HE2 PHE 56 17.894 -2.899 0.074
950 HE2 PHE 56 HE1 PHE 56 14.835 -0.094 -0.857
951 HZ PHE 56 HZ PHE 56 15.585 -2.421 -0.611
952 H GLY 57 HN GLY 57 19.636 2.940 3.365
953 1HA GLY 57 HA2 GLY 57 21.328 5.031 2.330
954 2HA GLY 57 HA1 GLY 57 20.591 4.993 3.925
955 H ASP 58 HN ASP 58 22.507 2.238 3.102
956 HA ASP 58 HA ASP 58 24.289 2.615 5.285
957 1HB ASP 58 HB2 ASP 58 24.151 0.406 4.253
958 2HB ASP 58 HB1 ASP 58 24.686 1.055 2.700
959 H ASP 59 HN ASP 59 24.786 2.981 1.849
960 HA ASP 59 HA ASP 59 27.191 4.628 2.254
961 1HB ASP 59 HB2 ASP 59 27.389 4.680 -0.167
962 2HB ASP 59 HB1 ASP 59 26.926 3.029 0.249
963 H GLY 60 HN GLY 60 24.285 5.274 2.947
964 1HA GLY 60 HA2 GLY 60 23.073 7.257 3.121
965 2HA GLY 60 HA1 GLY 60 24.459 8.086 2.389
966 H GLU 61 HN GLU 61 23.141 5.331 0.802
967 HA GLU 61 HA GLU 61 22.237 5.128 -1.313
968 1HB GLU 61 HB2 GLU 61 20.560 7.285 0.034
969 2HB GLU 61 HB1 GLU 61 20.224 6.895 -1.633
970 1HG GLU 61 HG2 GLU 61 20.474 4.669 0.349
971 2HG GLU 61 HG1 GLU 61 18.966 5.569 0.253
972 H ASN 62 HN ASN 62 24.587 6.536 -1.136
973 HA ASN 62 HA ASN 62 24.474 9.007 -2.610
974 1HB ASN 62 HB2 ASN 62 26.569 8.307 -1.425
975 2HB ASN 62 HB1 ASN 62 26.710 6.933 -2.525
976 1HD2 ASN 62 HD21 ASN 62 28.161 8.891 -5.077
977 2HD2 ASN 62 HD22 ASN 62 27.816 7.342 -4.477
978 H LEU 63 HN LEU 63 24.689 5.633 -3.306
979 HA LEU 63 HA LEU 63 24.086 6.143 -6.190
980 1HB LEU 63 HB2 LEU 63 25.483 3.705 -5.036
981 2HB LEU 63 HB1 LEU 63 25.339 4.128 -6.729
982 HG LEU 63 HG LEU 63 26.894 5.729 -4.648
983 1HD1 LEU 63 HD11 LEU 63 27.886 3.874 -6.843
984 2HD1 LEU 63 HD13 LEU 63 28.911 4.854 -5.805
985 3HD1 LEU 63 HD12 LEU 63 27.945 3.556 -5.119
986 1HD2 LEU 63 HD22 LEU 63 26.765 5.981 -7.697
987 2HD2 LEU 63 HD21 LEU 63 26.051 7.118 -6.570
988 3HD2 LEU 63 HD23 LEU 63 27.794 6.945 -6.653
Start of MODEL 7
Raw file had 988 H/Q atoms
Start of MODEL 7
1 1H MET 1 HT1 MET 1 -20.397 4.376 0.222
2 2H MET 1 HT3 MET 1 -21.074 4.499 1.766
3 3H MET 1 HT2 MET 1 -20.157 3.140 1.346
4 HA MET 1 HA MET 1 -21.943 2.097 0.583
5 1HB MET 1 HB2 MET 1 -23.379 4.714 1.153
6 2HB MET 1 HB1 MET 1 -24.180 3.225 0.697
7 1HG MET 1 HG2 MET 1 -22.369 3.541 3.110
8 2HG MET 1 HG1 MET 1 -24.103 3.619 3.180
9 1HE MET 1 HE1 MET 1 -25.549 1.534 2.070
10 2HE MET 1 HE3 MET 1 -25.350 0.140 3.110
11 3HE MET 1 HE2 MET 1 -25.528 1.726 3.839
12 H THR 2 HN THR 2 -20.878 2.111 -1.523
13 HA THR 2 HA THR 2 -22.438 3.717 -3.491
14 HB THR 2 HB THR 2 -19.411 3.227 -3.752
15 HG1 THR 2 HG1 THR 2 -19.343 4.550 -2.086
16 1HG2 THR 2 HG21 THR 2 -21.263 5.502 -4.684
17 2HG2 THR 2 HG23 THR 2 -19.584 5.288 -5.146
18 3HG2 THR 2 HG22 THR 2 -20.805 4.185 -5.753
19 H LYS 3 HN LYS 3 -22.177 2.609 -5.756
20 HA LYS 3 HA LYS 3 -22.386 -0.302 -5.233
21 1HB LYS 3 HB2 LYS 3 -23.160 -0.504 -7.516
22 2HB LYS 3 HB1 LYS 3 -24.074 0.771 -6.735
23 1HG LYS 3 HG2 LYS 3 -22.666 2.491 -7.792
24 2HG LYS 3 HG1 LYS 3 -21.665 1.275 -8.548
25 1HD LYS 3 HD2 LYS 3 -24.611 1.809 -9.077
26 2HD LYS 3 HD1 LYS 3 -23.288 2.139 -10.172
27 1HE LYS 3 HE2 LYS 3 -24.402 -0.578 -9.338
28 2HE LYS 3 HE1 LYS 3 -24.221 0.078 -10.952
29 1HZ LYS 3 HZ1 LYS 3 -21.684 -0.004 -9.785
30 2HZ LYS 3 HZ3 LYS 3 -22.419 -1.503 -9.534
31 3HZ LYS 3 HZ2 LYS 3 -22.265 -0.878 -11.100
32 H GLN 4 HN GLN 4 -20.289 2.083 -6.570
33 HA GLN 4 HA GLN 4 -18.507 0.049 -7.773
34 1HB GLN 4 HB2 GLN 4 -18.058 3.053 -7.421
35 2HB GLN 4 HB1 GLN 4 -17.084 1.977 -8.394
36 1HG GLN 4 HG2 GLN 4 -20.017 2.599 -8.917
37 2HG GLN 4 HG1 GLN 4 -18.653 3.242 -9.821
38 1HE2 GLN 4 HE21 GLN 4 -17.782 -0.101 -11.096
39 2HE2 GLN 4 HE22 GLN 4 -16.998 1.180 -10.314
40 H GLU 5 HN GLU 5 -19.327 0.632 -4.889
41 HA GLU 5 HA GLU 5 -17.073 1.495 -3.440
42 1HB GLU 5 HB2 GLU 5 -19.340 1.416 -2.548
43 2HB GLU 5 HB1 GLU 5 -19.406 -0.326 -2.741
44 1HG GLU 5 HG2 GLU 5 -17.711 -0.584 -1.062
45 2HG GLU 5 HG1 GLU 5 -17.531 1.176 -0.969
46 H LYS 6 HN LYS 6 -18.366 -1.725 -3.708
47 HA LYS 6 HA LYS 6 -16.137 -3.101 -2.662
48 1HB LYS 6 HB2 LYS 6 -17.807 -4.226 -4.926
49 2HB LYS 6 HB1 LYS 6 -17.108 -5.100 -3.580
50 1HG LYS 6 HG2 LYS 6 -19.486 -3.177 -3.489
51 2HG LYS 6 HG1 LYS 6 -19.497 -4.892 -3.175
52 1HD LYS 6 HD2 LYS 6 -18.087 -4.566 -1.172
53 2HD LYS 6 HD1 LYS 6 -18.079 -2.826 -1.450
54 1HE LYS 6 HE2 LYS 6 -20.581 -2.808 -1.330
55 2HE LYS 6 HE1 LYS 6 -20.564 -4.523 -0.946
56 1HZ LYS 6 HZ1 LYS 6 -18.830 -3.156 0.808
57 2HZ LYS 6 HZ3 LYS 6 -20.312 -2.370 0.761
58 3HZ LYS 6 HZ2 LYS 6 -20.239 -4.007 1.179
59 H THR 7 HN THR 7 -16.893 -1.981 -5.867
60 HA THR 7 HA THR 7 -14.804 -3.262 -7.262
61 HB THR 7 HB THR 7 -15.766 -0.463 -7.972
62 HG1 THR 7 HG1 THR 7 -17.505 -2.421 -8.608
63 1HG2 THR 7 HG21 THR 7 -15.668 -3.137 -9.503
64 2HG2 THR 7 HG23 THR 7 -15.988 -1.556 -10.205
65 3HG2 THR 7 HG22 THR 7 -14.391 -1.938 -9.591
66 H ALA 8 HN ALA 8 -14.898 -0.113 -5.631
67 HA ALA 8 HA ALA 8 -12.250 0.657 -6.329
68 1HB ALA 8 HB2 ALA 8 -13.863 2.235 -5.270
69 2HB ALA 8 HB1 ALA 8 -13.767 1.314 -3.771
70 3HB ALA 8 HB3 ALA 8 -12.353 2.168 -4.370
71 H LEU 9 HN LEU 9 -13.534 -1.277 -3.691
72 HA LEU 9 HA LEU 9 -10.914 -1.479 -2.456
73 1HB LEU 9 HB2 LEU 9 -13.561 -2.243 -1.783
74 2HB LEU 9 HB1 LEU 9 -12.645 -3.730 -1.889
75 HG LEU 9 HG LEU 9 -10.942 -2.888 -0.333
76 1HD1 LEU 9 HD11 LEU 9 -12.633 -0.356 -0.069
77 2HD1 LEU 9 HD13 LEU 9 -11.243 -0.771 0.903
78 3HD1 LEU 9 HD12 LEU 9 -11.040 -0.409 -0.791
79 1HD2 LEU 9 HD22 LEU 9 -13.792 -2.509 0.673
80 2HD2 LEU 9 HD21 LEU 9 -12.917 -4.023 0.542
81 3HD2 LEU 9 HD23 LEU 9 -12.408 -2.807 1.696
82 H ASN 10 HN ASN 10 -12.557 -3.116 -5.029
83 HA ASN 10 HA ASN 10 -10.853 -5.457 -4.912
84 1HB ASN 10 HB2 ASN 10 -12.522 -4.228 -7.133
85 2HB ASN 10 HB1 ASN 10 -11.316 -5.439 -7.525
86 1HD2 ASN 10 HD21 ASN 10 -14.741 -6.568 -5.635
87 2HD2 ASN 10 HD22 ASN 10 -14.431 -4.930 -5.937
88 H MET 11 HN MET 11 -10.648 -2.197 -6.039
89 HA MET 11 HA MET 11 -8.152 -2.689 -7.496
90 1HB MET 11 HB2 MET 11 -9.393 -0.053 -6.574
91 2HB MET 11 HB1 MET 11 -8.060 -0.222 -7.699
92 1HG MET 11 HG2 MET 11 -9.507 -1.566 -9.200
93 2HG MET 11 HG1 MET 11 -10.836 -1.361 -8.104
94 1HE MET 11 HE1 MET 11 -8.879 -0.340 -10.909
95 2HE MET 11 HE3 MET 11 -9.480 1.198 -11.467
96 3HE MET 11 HE2 MET 11 -8.285 1.160 -10.167
97 H ALA 12 HN ALA 12 -9.242 -1.945 -4.298
98 HA ALA 12 HA ALA 12 -6.730 -0.908 -3.321
99 1HB ALA 12 HB2 ALA 12 -8.842 -0.742 -1.961
100 2HB ALA 12 HB1 ALA 12 -8.814 -2.493 -1.753
101 3HB ALA 12 HB3 ALA 12 -7.530 -1.511 -1.082
102 NH1 ARG 13 NH1 ARG 13 -10.183 -7.984 -4.997
103 NH2 ARG 13 NH2 ARG 13 -10.126 -8.493 -7.247
104 H ARG 13 HN ARG 13 -8.083 -4.016 -3.949
105 HA ARG 13 HA ARG 13 -6.173 -5.608 -2.553
106 1HB ARG 13 HB2 ARG 13 -8.249 -6.537 -3.620
107 2HB ARG 13 HB1 ARG 13 -7.565 -6.158 -5.196
108 1HG ARG 13 HG2 ARG 13 -5.703 -7.740 -4.814
109 2HG ARG 13 HG1 ARG 13 -6.340 -8.101 -3.219
110 1HD ARG 13 HD2 ARG 13 -6.986 -9.716 -5.156
111 2HD ARG 13 HD1 ARG 13 -8.302 -9.173 -4.132
112 HE ARG 13 HE ARG 13 -7.649 -7.882 -6.759
113 1HH1 ARG 13 HH12 ARG 13 -9.698 -7.798 -4.138
114 2HH1 ARG 13 HH11 ARG 13 -11.186 -7.965 -4.976
115 1HH2 ARG 13 HH22 ARG 13 -9.607 -8.699 -8.078
116 2HH2 ARG 13 HH21 ARG 13 -11.130 -8.479 -7.305
117 H PHE 14 HN PHE 14 -6.148 -3.872 -5.595
118 HA PHE 14 HA PHE 14 -3.744 -5.061 -6.604
119 1HB PHE 14 HB2 PHE 14 -5.150 -3.607 -8.080
120 2HB PHE 14 HB1 PHE 14 -4.730 -2.218 -7.073
121 HD1 PHE 14 HD1 PHE 14 -2.948 -5.030 -8.810
122 HD2 PHE 14 HD2 PHE 14 -2.975 -0.903 -7.751
123 HE1 PHE 14 HE1 PHE 14 -0.853 -4.701 -10.036
124 HE2 PHE 14 HE2 PHE 14 -0.872 -0.577 -8.988
125 HZ PHE 14 HZ PHE 14 0.190 -2.474 -10.128
126 H ILE 15 HN ILE 15 -4.400 -2.384 -4.432
127 HA ILE 15 HA ILE 15 -1.723 -1.394 -4.330
128 HB ILE 15 HB ILE 15 -3.671 -1.514 -1.976
129 1HG1 ILE 15 HG12 ILE 15 -4.849 -0.619 -3.996
130 2HG1 ILE 15 HG11 ILE 15 -4.609 0.620 -2.784
131 1HG2 ILE 15 HG21 ILE 15 -1.483 0.481 -2.689
132 2HG2 ILE 15 HG23 ILE 15 -2.577 0.614 -1.321
133 3HG2 ILE 15 HG22 ILE 15 -1.427 -0.708 -1.410
134 1HD1 ILE 15 HD1 ILE 15 -2.878 0.195 -5.246
135 2HD1 ILE 15 HD3 ILE 15 -4.103 1.434 -5.052
136 3HD1 ILE 15 HD2 ILE 15 -2.659 1.476 -4.061
137 NH1 ARG 16 NH1 ARG 16 -3.240 -10.051 1.877
138 NH2 ARG 16 NH2 ARG 16 -1.066 -9.611 2.521
139 H ARG 16 HN ARG 16 -3.452 -3.940 -2.647
140 HA ARG 16 HA ARG 16 -1.330 -4.673 -0.881
141 1HB ARG 16 HB2 ARG 16 -3.752 -5.747 -0.992
142 2HB ARG 16 HB1 ARG 16 -3.075 -6.775 -2.250
143 1HG ARG 16 HG2 ARG 16 -1.134 -6.931 -0.311
144 2HG ARG 16 HG1 ARG 16 -2.577 -6.743 0.645
145 1HD ARG 16 HD2 ARG 16 -3.609 -8.708 -0.209
146 2HD ARG 16 HD1 ARG 16 -2.469 -8.853 -1.528
147 HE ARG 16 HE ARG 16 -0.894 -9.811 -0.066
148 1HH1 ARG 16 HH12 ARG 16 -3.951 -10.114 1.169
149 2HH1 ARG 16 HH11 ARG 16 -3.517 -10.263 2.821
150 1HH2 ARG 16 HH22 ARG 16 -0.117 -9.350 2.317
151 2HH2 ARG 16 HH21 ARG 16 -1.281 -9.803 3.486
152 H SER 17 HN SER 17 -2.190 -5.756 -4.109
153 HA SER 17 HA SER 17 -0.080 -7.526 -4.571
154 1HB SER 17 HB2 SER 17 -1.394 -5.736 -6.648
155 2HB SER 17 HB1 SER 17 -0.723 -7.362 -6.874
156 HG SER 17 HG1 SER 17 -3.085 -6.600 -5.722
157 H GLN 18 HN GLN 18 -0.032 -3.980 -4.874
158 HA GLN 18 HA GLN 18 2.452 -3.930 -6.326
159 1HB GLN 18 HB2 GLN 18 1.553 -1.905 -4.232
160 2HB GLN 18 HB1 GLN 18 2.772 -1.669 -5.464
161 1HG GLN 18 HG2 GLN 18 1.080 -1.807 -7.225
162 2HG GLN 18 HG1 GLN 18 -0.174 -2.110 -6.015
163 1HE2 GLN 18 HE21 GLN 18 1.520 1.613 -6.285
164 2HE2 GLN 18 HE22 GLN 18 2.266 0.297 -7.046
165 H THR 19 HN THR 19 1.552 -3.793 -2.982
166 HA THR 19 HA THR 19 4.178 -3.689 -1.921
167 HB THR 19 HB THR 19 1.775 -4.916 -0.519
168 HG1 THR 19 HG1 THR 19 0.790 -3.150 -1.224
169 1HG2 THR 19 HG21 THR 19 3.824 -2.732 0.204
170 2HG2 THR 19 HG23 THR 19 2.666 -3.449 1.312
171 3HG2 THR 19 HG22 THR 19 4.014 -4.403 0.709
172 H LEU 20 HN LEU 20 2.321 -6.248 -3.287
173 HA LEU 20 HA LEU 20 3.726 -8.403 -1.949
174 1HB LEU 20 HB2 LEU 20 1.532 -8.474 -3.521
175 2HB LEU 20 HB1 LEU 20 2.704 -8.636 -4.795
176 HG LEU 20 HG LEU 20 2.652 -10.514 -2.413
177 1HD1 LEU 20 HD11 LEU 20 1.517 -10.864 -5.219
178 2HD1 LEU 20 HD13 LEU 20 1.585 -12.115 -3.989
179 3HD1 LEU 20 HD12 LEU 20 0.565 -10.707 -3.751
180 1HD2 LEU 20 HD22 LEU 20 4.042 -10.689 -5.129
181 2HD2 LEU 20 HD21 LEU 20 4.850 -10.422 -3.597
182 3HD2 LEU 20 HD23 LEU 20 4.049 -11.939 -3.900
183 H THR 21 HN THR 21 3.840 -7.015 -5.165
184 HA THR 21 HA THR 21 6.249 -8.206 -5.985
185 HB THR 21 HB THR 21 5.421 -5.429 -6.921
186 HG1 THR 21 HG1 THR 21 3.461 -6.287 -6.920
187 1HG2 THR 21 HG22 THR 21 7.199 -6.902 -8.129
188 2HG2 THR 21 HG21 THR 21 5.947 -8.112 -8.341
189 3HG2 THR 21 HG23 THR 21 5.800 -6.549 -9.134
190 H LEU 22 HN LEU 22 5.703 -5.609 -3.794
191 HA LEU 22 HA LEU 22 8.431 -4.594 -4.101
192 1HB LEU 22 HB2 LEU 22 6.584 -3.087 -3.357
193 2HB LEU 22 HB1 LEU 22 6.343 -4.109 -1.951
194 HG LEU 22 HG LEU 22 8.537 -3.553 -1.058
195 1HD1 LEU 22 HD11 LEU 22 8.890 -1.838 -3.558
196 2HD1 LEU 22 HD13 LEU 22 9.993 -1.884 -2.193
197 3HD1 LEU 22 HD12 LEU 22 9.805 -3.295 -3.209
198 1HD2 LEU 22 HD21 LEU 22 6.643 -2.021 -0.609
199 2HD2 LEU 22 HD23 LEU 22 8.165 -1.145 -0.676
200 3HD2 LEU 22 HD22 LEU 22 7.057 -1.093 -2.041
201 H LEU 23 HN LEU 23 6.564 -6.593 -1.975
202 HA LEU 23 HA LEU 23 8.388 -7.039 0.089
203 1HB LEU 23 HB2 LEU 23 6.042 -7.860 0.120
204 2HB LEU 23 HB1 LEU 23 6.413 -9.008 -1.148
205 HG LEU 23 HG LEU 23 8.050 -10.153 0.366
206 1HD1 LEU 23 HD11 LEU 23 6.878 -8.259 2.431
207 2HD1 LEU 23 HD13 LEU 23 7.974 -9.587 2.766
208 3HD1 LEU 23 HD12 LEU 23 8.532 -8.208 1.844
209 1HD2 LEU 23 HD22 LEU 23 5.219 -9.824 1.430
210 2HD2 LEU 23 HD21 LEU 23 5.695 -10.920 0.145
211 3HD2 LEU 23 HD23 LEU 23 6.281 -11.177 1.779
212 H GLU 24 HN GLU 24 7.853 -9.113 -2.717
213 HA GLU 24 HA GLU 24 10.025 -10.839 -2.219
214 1HB GLU 24 HB2 GLU 24 9.942 -11.054 -4.877
215 2HB GLU 24 HB1 GLU 24 8.568 -11.598 -3.936
216 1HG GLU 24 HG2 GLU 24 7.319 -9.645 -4.413
217 2HG GLU 24 HG1 GLU 24 8.714 -8.767 -5.026
218 H LYS 25 HN LYS 25 9.999 -7.910 -4.232
219 HA LYS 25 HA LYS 25 12.708 -8.165 -5.025
220 1HB LYS 25 HB2 LYS 25 11.027 -5.662 -4.600
221 2HB LYS 25 HB1 LYS 25 12.543 -5.695 -5.490
222 1HG LYS 25 HG2 LYS 25 10.164 -7.490 -6.197
223 2HG LYS 25 HG1 LYS 25 10.413 -5.923 -6.925
224 1HD LYS 25 HD2 LYS 25 12.044 -6.691 -8.285
225 2HD LYS 25 HD1 LYS 25 12.840 -7.621 -7.035
226 1HE LYS 25 HE2 LYS 25 10.269 -8.424 -8.499
227 2HE LYS 25 HE1 LYS 25 11.865 -9.112 -8.782
228 1HZ LYS 25 HZ1 LYS 25 11.342 -9.311 -6.051
229 2HZ LYS 25 HZ3 LYS 25 9.983 -9.882 -6.883
230 3HZ LYS 25 HZ2 LYS 25 11.512 -10.525 -7.180
231 H LEU 26 HN LEU 26 11.348 -6.567 -2.169
232 HA LEU 26 HA LEU 26 13.880 -5.511 -1.335
233 1HB LEU 26 HB2 LEU 26 11.487 -6.416 0.314
234 2HB LEU 26 HB1 LEU 26 12.862 -5.573 0.994
235 HG LEU 26 HG LEU 26 11.184 -4.429 -1.288
236 1HD1 LEU 26 HD11 LEU 26 11.016 -3.907 1.708
237 2HD1 LEU 26 HD13 LEU 26 10.112 -3.040 0.478
238 3HD1 LEU 26 HD12 LEU 26 9.813 -4.750 0.747
239 1HD2 LEU 26 HD22 LEU 26 13.155 -3.131 0.650
240 2HD2 LEU 26 HD21 LEU 26 13.487 -3.465 -1.040
241 3HD2 LEU 26 HD23 LEU 26 12.255 -2.301 -0.603
242 H ASN 27 HN ASN 27 12.212 -8.512 -0.829
243 HA ASN 27 HA ASN 27 13.993 -9.698 1.026
244 1HB ASN 27 HB2 ASN 27 11.735 -10.627 0.128
245 2HB ASN 27 HB1 ASN 27 12.688 -11.246 -1.221
246 1HD2 ASN 27 HD21 ASN 27 13.164 -12.846 2.501
247 2HD2 ASN 27 HD22 ASN 27 12.397 -11.354 2.316
248 H GLU 28 HN GLU 28 13.949 -9.702 -2.462
249 HA GLU 28 HA GLU 28 16.293 -11.273 -2.851
250 1HB GLU 28 HB2 GLU 28 14.906 -9.229 -4.609
251 2HB GLU 28 HB1 GLU 28 16.117 -10.366 -5.183
252 1HG GLU 28 HG2 GLU 28 14.762 -12.246 -4.774
253 2HG GLU 28 HG1 GLU 28 13.707 -11.409 -3.656
254 H LEU 29 HN LEU 29 15.774 -7.934 -2.170
255 HA LEU 29 HA LEU 29 18.566 -7.268 -2.886
256 1HB LEU 29 HB2 LEU 29 16.351 -5.597 -1.636
257 2HB LEU 29 HB1 LEU 29 17.933 -4.971 -2.049
258 HG LEU 29 HG LEU 29 16.084 -6.267 -4.108
259 1HD1 LEU 29 HD11 LEU 29 16.557 -3.314 -3.499
260 2HD1 LEU 29 HD13 LEU 29 15.587 -3.941 -4.825
261 3HD1 LEU 29 HD12 LEU 29 15.068 -4.187 -3.167
262 1HD2 LEU 29 HD22 LEU 29 18.560 -4.517 -4.410
263 2HD2 LEU 29 HD21 LEU 29 18.497 -6.247 -4.711
264 3HD2 LEU 29 HD23 LEU 29 17.583 -5.154 -5.724
265 H ASP 30 HN ASP 30 17.777 -9.184 -0.773
266 HA ASP 30 HA ASP 30 18.326 -9.767 1.386
267 1HB ASP 30 HB2 ASP 30 20.587 -7.816 0.778
268 2HB ASP 30 HB1 ASP 30 20.533 -8.808 2.224
269 H ALA 31 HN ALA 31 16.735 -7.298 0.806
270 HA ALA 31 HA ALA 31 17.132 -5.758 3.309
271 1HB ALA 31 HB1 ALA 31 15.205 -5.343 0.986
272 2HB ALA 31 HB3 ALA 31 15.379 -4.291 2.365
273 3HB ALA 31 HB2 ALA 31 16.712 -4.469 1.227
274 H ASP 32 HN ASP 32 16.560 -8.094 4.076
275 HA ASP 32 HA ASP 32 13.781 -8.839 3.815
276 1HB ASP 32 HB2 ASP 32 15.639 -10.461 4.482
277 2HB ASP 32 HB1 ASP 32 15.582 -9.704 6.081
278 H GLU 33 HN GLU 33 15.549 -6.777 5.932
279 HA GLU 33 HA GLU 33 13.705 -6.706 8.122
280 1HB GLU 33 HB2 GLU 33 14.858 -4.089 7.150
281 2HB GLU 33 HB1 GLU 33 14.706 -4.650 8.788
282 1HG GLU 33 HG2 GLU 33 17.014 -4.825 8.503
283 2HG GLU 33 HG1 GLU 33 16.531 -6.441 7.997
284 H GLN 34 HN GLN 34 14.096 -4.884 5.254
285 HA GLN 34 HA GLN 34 11.679 -3.353 5.477
286 1HB GLN 34 HB2 GLN 34 13.180 -4.040 2.923
287 2HB GLN 34 HB1 GLN 34 12.190 -2.620 3.227
288 1HG GLN 34 HG2 GLN 34 13.728 -1.853 4.968
289 2HG GLN 34 HG1 GLN 34 14.722 -3.285 4.786
290 1HE2 GLN 34 HE21 GLN 34 16.649 -1.865 2.339
291 2HE2 GLN 34 HE22 GLN 34 16.517 -2.828 3.725
292 H ALA 35 HN ALA 35 12.465 -6.520 4.301
293 HA ALA 35 HA ALA 35 10.101 -6.799 2.683
294 1HB ALA 35 HB2 ALA 35 11.982 -8.473 2.564
295 2HB ALA 35 HB1 ALA 35 11.581 -9.002 4.196
296 3HB ALA 35 HB3 ALA 35 10.438 -9.244 2.896
297 H ASP 36 HN ASP 36 10.877 -7.557 6.067
298 HA ASP 36 HA ASP 36 8.358 -8.640 6.769
299 1HB ASP 36 HB2 ASP 36 10.059 -8.697 8.483
300 2HB ASP 36 HB1 ASP 36 10.213 -6.935 8.470
301 H ILE 37 HN ILE 37 9.517 -5.365 7.186
302 HA ILE 37 HA ILE 37 7.056 -4.258 7.994
303 HB ILE 37 HB ILE 37 9.262 -2.943 6.338
304 1HG1 ILE 37 HG12 ILE 37 8.858 -3.183 9.361
305 2HG1 ILE 37 HG11 ILE 37 10.065 -4.054 8.450
306 1HG2 ILE 37 HG22 ILE 37 7.140 -1.603 6.465
307 2HG2 ILE 37 HG21 ILE 37 7.189 -1.730 8.214
308 3HG2 ILE 37 HG23 ILE 37 8.425 -0.822 7.354
309 1HD1 ILE 37 HD2 ILE 37 11.119 -1.931 7.764
310 2HD1 ILE 37 HD1 ILE 37 9.956 -1.025 8.725
311 3HD1 ILE 37 HD3 ILE 37 11.078 -2.118 9.502
312 H CYS 38 HN CYS 38 8.294 -5.060 4.839
313 HA CYS 38 HA CYS 38 6.184 -3.641 3.448
314 1HB CYS 38 HB2 CYS 38 8.335 -4.187 2.350
315 2HB CYS 38 HB1 CYS 38 7.948 -5.885 2.453
316 HG CYS 38 HG1 CYS 38 6.413 -5.696 0.495
317 H GLU 39 HN GLU 39 6.491 -6.871 4.811
318 HA GLU 39 HA GLU 39 4.207 -7.819 3.257
319 1HB GLU 39 HB2 GLU 39 6.019 -9.269 4.650
320 2HB GLU 39 HB1 GLU 39 4.885 -8.980 5.960
321 1HG GLU 39 HG2 GLU 39 4.143 -10.246 3.287
322 2HG GLU 39 HG1 GLU 39 4.348 -11.107 4.804
323 H SER 40 HN SER 40 4.912 -6.668 6.540
324 HA SER 40 HA SER 40 2.289 -6.661 7.474
325 1HB SER 40 HB2 SER 40 4.475 -4.553 7.998
326 2HB SER 40 HB1 SER 40 3.156 -4.977 9.108
327 HG SER 40 HG1 SER 40 5.490 -6.316 8.640
328 H LEU 41 HN LEU 41 3.888 -4.449 5.309
329 HA LEU 41 HA LEU 41 1.681 -2.551 5.329
330 1HB LEU 41 HB2 LEU 41 4.133 -2.094 4.642
331 2HB LEU 41 HB1 LEU 41 3.781 -2.958 3.166
332 HG LEU 41 HG LEU 41 1.916 -1.316 2.680
333 1HD1 LEU 41 HD11 LEU 41 3.156 0.208 5.018
334 2HD1 LEU 41 HD13 LEU 41 1.908 0.818 3.947
335 3HD1 LEU 41 HD12 LEU 41 1.555 -0.505 5.034
336 1HD2 LEU 41 HD21 LEU 41 4.172 -1.062 1.670
337 2HD2 LEU 41 HD23 LEU 41 3.448 0.504 1.987
338 3HD2 LEU 41 HD22 LEU 41 4.691 -0.124 3.061
339 H HIS 42 HN HIS 42 2.769 -5.259 3.542
340 HA HIS 42 HA HIS 42 0.994 -5.211 1.334
341 1HB HIS 42 HB2 HIS 42 3.060 -6.715 1.628
342 2HB HIS 42 HB1 HIS 42 2.130 -7.667 2.752
343 HD1 HIS 42 HD1 HIS 42 0.801 -6.641 -0.605
344 HD2 HIS 42 HD2 HIS 42 2.041 -9.988 1.389
345 HE1 HIS 42 HE1 HIS 42 0.224 -8.548 -2.023
346 H ASP 43 HN ASP 43 0.677 -7.278 4.279
347 HA ASP 43 HA ASP 43 -2.074 -7.785 3.597
348 1HB ASP 43 HB2 ASP 43 -0.575 -9.206 5.208
349 2HB ASP 43 HB1 ASP 43 -0.990 -7.985 6.407
350 H HIS 44 HN HIS 44 -0.553 -5.131 5.175
351 HA HIS 44 HA HIS 44 -2.859 -4.345 6.730
352 1HB HIS 44 HB2 HIS 44 -0.693 -3.190 7.080
353 2HB HIS 44 HB1 HIS 44 -0.672 -2.637 5.418
354 HD1 HIS 44 HD1 HIS 44 -3.888 -1.702 5.876
355 HD2 HIS 44 HD2 HIS 44 -0.545 -0.489 7.898
356 HE1 HIS 44 HE1 HIS 44 -4.428 0.468 6.862
357 H ALA 45 HN ALA 45 -1.691 -3.728 3.479
358 HA ALA 45 HA ALA 45 -3.918 -2.109 2.671
359 1HB ALA 45 HB2 ALA 45 -1.800 -2.274 1.315
360 2HB ALA 45 HB1 ALA 45 -2.210 -3.944 0.955
361 3HB ALA 45 HB3 ALA 45 -3.227 -2.645 0.350
362 H ASP 46 HN ASP 46 -3.399 -5.493 3.042
363 HA ASP 46 HA ASP 46 -5.743 -6.216 1.438
364 1HB ASP 46 HB2 ASP 46 -3.772 -7.767 2.006
365 2HB ASP 46 HB1 ASP 46 -4.521 -7.922 3.590
366 H GLU 47 HN GLU 47 -5.019 -5.484 4.785
367 HA GLU 47 HA GLU 47 -7.413 -6.592 5.800
368 1HB GLU 47 HB2 GLU 47 -5.364 -4.727 6.816
369 2HB GLU 47 HB1 GLU 47 -6.956 -4.426 7.487
370 1HG GLU 47 HG2 GLU 47 -5.547 -7.117 7.467
371 2HG GLU 47 HG1 GLU 47 -5.620 -6.044 8.851
372 H LEU 48 HN LEU 48 -6.693 -3.349 4.612
373 HA LEU 48 HA LEU 48 -9.331 -2.397 5.307
374 1HB LEU 48 HB2 LEU 48 -8.809 -0.509 3.739
375 2HB LEU 48 HB1 LEU 48 -7.620 -0.788 4.985
376 HG LEU 48 HG LEU 48 -6.230 -2.068 3.279
377 1HD1 LEU 48 HD11 LEU 48 -8.140 -0.709 1.324
378 2HD1 LEU 48 HD13 LEU 48 -6.633 -1.507 0.905
379 3HD1 LEU 48 HD12 LEU 48 -7.967 -2.444 1.516
380 1HD2 LEU 48 HD22 LEU 48 -6.817 0.861 2.818
381 2HD2 LEU 48 HD21 LEU 48 -5.705 0.222 4.021
382 3HD2 LEU 48 HD23 LEU 48 -5.346 0.042 2.311
383 OH TYR 49 OH TYR 49 -10.348 -9.373 -2.736
384 H TYR 49 HN TYR 49 -8.351 -4.617 3.147
385 HA TYR 49 HA TYR 49 -10.644 -4.165 1.325
386 1HB TYR 49 HB2 TYR 49 -8.739 -4.126 -0.065
387 2HB TYR 49 HB1 TYR 49 -7.851 -5.238 0.965
388 HD1 TYR 49 HD2 TYR 49 -10.823 -5.121 -1.295
389 HD2 TYR 49 HD1 TYR 49 -7.739 -7.485 0.431
390 HE1 TYR 49 HE2 TYR 49 -11.482 -6.999 -2.708
391 HE2 TYR 49 HE1 TYR 49 -8.374 -9.363 -0.968
392 HH TYR 49 HH TYR 49 -10.357 -10.160 -2.182
393 NH1 ARG 50 NH1 ARG 50 -5.895 -8.913 5.482
394 NH2 ARG 50 NH2 ARG 50 -5.856 -9.537 7.701
395 H ARG 50 HN ARG 50 -9.523 -5.882 3.878
396 HA ARG 50 HA ARG 50 -11.050 -8.314 3.144
397 1HB ARG 50 HB2 ARG 50 -8.632 -8.550 3.652
398 2HB ARG 50 HB1 ARG 50 -8.902 -7.856 5.235
399 1HG ARG 50 HG2 ARG 50 -10.465 -9.805 5.699
400 2HG ARG 50 HG1 ARG 50 -9.987 -10.435 4.125
401 1HD ARG 50 HD2 ARG 50 -8.578 -11.350 6.082
402 2HD ARG 50 HD1 ARG 50 -7.645 -10.594 4.795
403 HE ARG 50 HE ARG 50 -8.386 -8.946 7.171
404 1HH1 ARG 50 HH12 ARG 50 -6.411 -8.731 4.642
405 2HH1 ARG 50 HH11 ARG 50 -4.898 -8.786 5.453
406 1HH2 ARG 50 HH22 ARG 50 -6.352 -9.806 8.529
407 2HH2 ARG 50 HH21 ARG 50 -4.858 -9.445 7.747
408 H SER 51 HN SER 51 -10.235 -7.501 6.453
409 HA SER 51 HA SER 51 -12.787 -8.211 7.358
410 1HB SER 51 HB2 SER 51 -10.865 -6.200 8.624
411 2HB SER 51 HB1 SER 51 -12.047 -7.214 9.474
412 HG SER 51 HG1 SER 51 -9.628 -7.880 8.758
413 H CYS 52 HN CYS 52 -11.517 -5.068 6.355
414 HA CYS 52 HA CYS 52 -14.000 -3.679 7.013
415 1HB CYS 52 HB2 CYS 52 -11.952 -3.056 4.825
416 2HB CYS 52 HB1 CYS 52 -13.194 -1.979 5.321
417 HG CYS 52 HG1 CYS 52 -11.833 -1.254 7.305
418 H LEU 53 HN LEU 53 -12.808 -5.283 4.042
419 HA LEU 53 HA LEU 53 -15.013 -4.426 2.543
420 1HB LEU 53 HB2 LEU 53 -13.091 -5.666 1.596
421 2HB LEU 53 HB1 LEU 53 -13.631 -7.122 2.398
422 HG LEU 53 HG LEU 53 -15.621 -7.265 1.035
423 1HD1 LEU 53 HD11 LEU 53 -14.805 -4.575 -0.196
424 2HD1 LEU 53 HD13 LEU 53 -16.163 -5.565 -0.689
425 3HD1 LEU 53 HD12 LEU 53 -16.175 -4.793 0.877
426 1HD2 LEU 53 HD21 LEU 53 -13.507 -8.052 0.050
427 2HD2 LEU 53 HD23 LEU 53 -14.576 -7.432 -1.202
428 3HD2 LEU 53 HD22 LEU 53 -13.220 -6.462 -0.635
429 H ALA 54 HN ALA 54 -14.856 -6.764 5.034
430 HA ALA 54 HA ALA 54 -17.026 -8.439 4.601
431 1HB ALA 54 HB2 ALA 54 -15.763 -8.384 6.786
432 2HB ALA 54 HB1 ALA 54 -16.583 -6.873 7.174
433 3HB ALA 54 HB3 ALA 54 -17.510 -8.354 7.028
434 NH1 ARG 55 NH1 ARG 55 -20.131 0.590 7.659
435 NH2 ARG 55 NH2 ARG 55 -19.303 0.136 9.780
436 H ARG 55 HN ARG 55 -17.021 -5.116 5.662
437 HA ARG 55 HA ARG 55 -19.923 -4.929 4.978
438 1HB ARG 55 HB2 ARG 55 -19.045 -4.353 7.383
439 2HB ARG 55 HB1 ARG 55 -18.301 -2.966 6.655
440 1HG ARG 55 HG2 ARG 55 -20.439 -2.140 5.781
441 2HG ARG 55 HG1 ARG 55 -21.263 -3.600 6.315
442 1HD ARG 55 HD2 ARG 55 -21.547 -1.662 7.932
443 2HD ARG 55 HD1 ARG 55 -20.767 -3.064 8.668
444 HE ARG 55 HE ARG 55 -18.583 -1.886 8.197
445 1HH1 ARG 55 HH12 ARG 55 -20.369 0.268 6.743
446 2HH1 ARG 55 HH11 ARG 55 -20.272 1.562 7.871
447 1HH2 ARG 55 HH22 ARG 55 -18.940 -0.546 10.423
448 2HH2 ARG 55 HH21 ARG 55 -19.398 1.089 10.084
449 H PHE 56 HN PHE 56 -17.238 -2.792 5.359
450 HA PHE 56 HA PHE 56 -16.091 -2.211 3.056
451 1HB PHE 56 HB2 PHE 56 -18.487 -1.592 2.051
452 2HB PHE 56 HB1 PHE 56 -18.447 -0.237 3.179
453 HD1 PHE 56 HD2 PHE 56 -16.151 -2.046 0.852
454 HD2 PHE 56 HD1 PHE 56 -17.436 1.726 2.343
455 HE1 PHE 56 HE2 PHE 56 -14.595 -0.928 -0.652
456 HE2 PHE 56 HE1 PHE 56 -15.855 2.847 0.816
457 HZ PHE 56 HZ PHE 56 -14.441 1.526 -0.684
458 H GLY 57 HN GLY 57 -15.322 -2.218 5.388
459 1HA GLY 57 HA2 GLY 57 -13.953 -0.724 6.729
460 2HA GLY 57 HA1 GLY 57 -14.967 0.626 6.191
461 H ASP 58 HN ASP 58 -14.246 -0.511 8.941
462 HA ASP 58 HA ASP 58 -16.994 -0.375 9.971
463 1HB ASP 58 HB2 ASP 58 -15.207 -2.757 10.370
464 2HB ASP 58 HB1 ASP 58 -16.395 -2.306 11.588
465 H ASP 59 HN ASP 59 -13.585 -0.024 10.551
466 HA ASP 59 HA ASP 59 -13.918 0.267 13.404
467 1HB ASP 59 HB2 ASP 59 -11.643 -0.097 12.521
468 2HB ASP 59 HB1 ASP 59 -11.727 1.469 11.694
469 H GLY 60 HN GLY 60 -14.875 1.803 14.429
470 1HA GLY 60 HA2 GLY 60 -15.602 3.944 15.022
471 2HA GLY 60 HA1 GLY 60 -14.344 4.566 13.956
472 H GLU 61 HN GLU 61 -14.795 4.851 11.790
473 HA GLU 61 HA GLU 61 -15.990 5.467 9.927
474 1HB GLU 61 HB2 GLU 61 -17.357 3.251 10.481
475 2HB GLU 61 HB1 GLU 61 -18.537 4.351 11.184
476 1HG GLU 61 HG2 GLU 61 -18.931 5.456 9.115
477 2HG GLU 61 HG1 GLU 61 -17.515 4.723 8.370
478 H ASN 62 HN ASN 62 -17.823 7.000 9.427
479 HA ASN 62 HA ASN 62 -18.443 8.752 11.762
480 1HB ASN 62 HB2 ASN 62 -16.588 9.781 10.417
481 2HB ASN 62 HB1 ASN 62 -17.610 9.668 8.984
482 1HD2 ASN 62 HD21 ASN 62 -19.880 12.260 10.148
483 2HD2 ASN 62 HD22 ASN 62 -19.868 10.828 9.254
484 H LEU 63 HN LEU 63 -20.484 9.456 11.775
485 HA LEU 63 HA LEU 63 -22.180 8.787 9.408
486 1HB LEU 63 HB2 LEU 63 -22.944 8.969 12.361
487 2HB LEU 63 HB1 LEU 63 -24.070 8.718 11.051
488 HG LEU 63 HG LEU 63 -22.765 6.577 10.483
489 1HD1 LEU 63 HD11 LEU 63 -21.595 7.003 13.264
490 2HD1 LEU 63 HD13 LEU 63 -21.471 5.526 12.322
491 3HD1 LEU 63 HD12 LEU 63 -20.677 6.972 11.771
492 1HD2 LEU 63 HD22 LEU 63 -24.173 6.751 13.177
493 2HD2 LEU 63 HD21 LEU 63 -24.954 6.537 11.617
494 3HD2 LEU 63 HD23 LEU 63 -23.922 5.270 12.262
495 1H MET 1 HT1 MET 1 20.548 3.383 -1.110
496 2H MET 1 HT3 MET 1 20.493 2.742 0.446
497 3H MET 1 HT2 MET 1 20.139 4.389 0.192
498 HA MET 1 HA MET 1 22.264 4.943 0.349
499 1HB MET 1 HB2 MET 1 22.841 1.944 0.576
500 2HB MET 1 HB1 MET 1 23.909 3.241 1.074
501 1HG MET 1 HG2 MET 1 22.028 4.013 2.638
502 2HG MET 1 HG1 MET 1 21.217 2.516 2.262
503 1HE MET 1 HE2 MET 1 24.472 4.075 3.566
504 2HE MET 1 HE1 MET 1 23.209 4.295 4.802
505 3HE MET 1 HE3 MET 1 24.606 3.277 5.117
506 H THR 2 HN THR 2 22.071 1.886 -1.466
507 HA THR 2 HA THR 2 23.983 2.868 -3.420
508 HB THR 2 HB THR 2 22.350 0.341 -3.819
509 HG1 THR 2 HG1 THR 2 22.558 0.049 -1.697
510 1HG2 THR 2 HG22 THR 2 24.617 0.882 -5.004
511 2HG2 THR 2 HG21 THR 2 25.357 0.842 -3.410
512 3HG2 THR 2 HG23 THR 2 24.626 -0.609 -4.079
513 H LYS 3 HN LYS 3 22.821 2.146 -5.806
514 HA LYS 3 HA LYS 3 20.691 4.193 -5.956
515 1HB LYS 3 HB2 LYS 3 21.865 2.638 -8.277
516 2HB LYS 3 HB1 LYS 3 21.093 4.204 -8.324
517 1HG LYS 3 HG2 LYS 3 23.790 3.510 -7.040
518 2HG LYS 3 HG1 LYS 3 23.558 4.458 -8.478
519 1HD LYS 3 HD2 LYS 3 22.594 5.276 -5.688
520 2HD LYS 3 HD1 LYS 3 24.065 5.840 -6.430
521 1HE LYS 3 HE2 LYS 3 21.239 6.304 -7.499
522 2HE LYS 3 HE1 LYS 3 22.280 7.501 -6.750
523 1HZ LYS 3 HZ1 LYS 3 23.714 6.330 -8.843
524 2HZ LYS 3 HZ3 LYS 3 22.175 6.744 -9.432
525 3HZ LYS 3 HZ2 LYS 3 23.150 7.922 -8.703
526 H GLN 4 HN GLN 4 21.147 0.980 -7.331
527 HA GLN 4 HA GLN 4 18.553 0.480 -8.164
528 1HB GLN 4 HB2 GLN 4 19.011 -1.975 -7.654
529 2HB GLN 4 HB1 GLN 4 20.201 -1.197 -8.669
530 1HG GLN 4 HG2 GLN 4 20.626 -1.489 -5.660
531 2HG GLN 4 HG1 GLN 4 21.089 -2.730 -6.805
532 1HE2 GLN 4 HE21 GLN 4 23.757 -0.821 -8.226
533 2HE2 GLN 4 HE22 GLN 4 22.649 -2.057 -8.559
534 H GLU 5 HN GLU 5 19.768 -0.019 -4.864
535 HA GLU 5 HA GLU 5 17.243 -1.085 -3.992
536 1HB GLU 5 HB2 GLU 5 18.251 -0.394 -1.713
537 2HB GLU 5 HB1 GLU 5 19.065 -1.652 -2.614
538 1HG GLU 5 HG2 GLU 5 20.908 -0.392 -2.498
539 2HG GLU 5 HG1 GLU 5 20.158 0.901 -3.447
540 H LYS 6 HN LYS 6 18.577 2.143 -4.213
541 HA LYS 6 HA LYS 6 16.541 3.341 -2.593
542 1HB LYS 6 HB2 LYS 6 18.657 4.576 -3.315
543 2HB LYS 6 HB1 LYS 6 18.061 4.560 -4.963
544 1HG LYS 6 HG2 LYS 6 17.597 6.739 -3.948
545 2HG LYS 6 HG1 LYS 6 16.091 5.916 -4.302
546 1HD LYS 6 HD2 LYS 6 16.880 5.133 -1.649
547 2HD LYS 6 HD1 LYS 6 17.090 6.864 -1.769
548 1HE LYS 6 HE2 LYS 6 14.546 5.396 -2.598
549 2HE LYS 6 HE1 LYS 6 14.739 6.240 -1.080
550 1HZ LYS 6 HZ1 LYS 6 15.454 7.978 -3.159
551 2HZ LYS 6 HZ3 LYS 6 13.969 7.245 -3.532
552 3HZ LYS 6 HZ2 LYS 6 14.139 8.069 -2.074
553 H THR 7 HN THR 7 16.825 2.308 -5.889
554 HA THR 7 HA THR 7 14.445 3.559 -6.856
555 HB THR 7 HB THR 7 15.596 0.893 -7.864
556 HG1 THR 7 HG1 THR 7 17.382 2.071 -7.679
557 1HG2 THR 7 HG22 THR 7 13.656 2.096 -9.115
558 2HG2 THR 7 HG21 THR 7 14.730 3.478 -9.287
559 3HG2 THR 7 HG23 THR 7 15.130 1.951 -10.057
560 H ALA 8 HN ALA 8 15.176 0.559 -5.175
561 HA ALA 8 HA ALA 8 12.547 -0.573 -5.406
562 1HB ALA 8 HB2 ALA 8 14.497 -1.884 -4.507
563 2HB ALA 8 HB1 ALA 8 14.481 -0.881 -3.061
564 3HB ALA 8 HB3 ALA 8 13.117 -1.923 -3.416
565 H LEU 9 HN LEU 9 14.071 1.565 -3.087
566 HA LEU 9 HA LEU 9 11.844 1.764 -1.337
567 1HB LEU 9 HB2 LEU 9 14.310 3.339 -1.878
568 2HB LEU 9 HB1 LEU 9 13.010 4.264 -1.147
569 HG LEU 9 HG LEU 9 14.696 3.169 0.453
570 1HD1 LEU 9 HD11 LEU 9 11.759 2.405 0.748
571 2HD1 LEU 9 HD13 LEU 9 12.938 2.480 2.042
572 3HD1 LEU 9 HD12 LEU 9 12.473 3.947 1.205
573 1HD2 LEU 9 HD21 LEU 9 14.832 1.059 -0.786
574 2HD2 LEU 9 HD23 LEU 9 14.386 0.804 0.901
575 3HD2 LEU 9 HD22 LEU 9 13.183 0.641 -0.352
576 H ASN 10 HN ASN 10 12.660 3.352 -4.337
577 HA ASN 10 HA ASN 10 10.653 5.388 -4.176
578 1HB ASN 10 HB2 ASN 10 11.747 4.034 -6.680
579 2HB ASN 10 HB1 ASN 10 10.798 5.508 -6.652
580 1HD2 ASN 10 HD21 ASN 10 14.445 6.420 -6.668
581 2HD2 ASN 10 HD22 ASN 10 13.465 5.498 -7.692
582 H MET 11 HN MET 11 10.575 2.015 -5.099
583 HA MET 11 HA MET 11 7.973 2.149 -6.318
584 1HB MET 11 HB2 MET 11 9.396 0.134 -6.616
585 2HB MET 11 HB1 MET 11 9.329 -0.179 -4.891
586 1HG MET 11 HG2 MET 11 7.727 -1.558 -6.210
587 2HG MET 11 HG1 MET 11 6.988 -0.626 -4.947
588 1HE MET 11 HE2 MET 11 8.003 -0.931 -8.375
589 2HE MET 11 HE1 MET 11 6.439 -1.131 -9.149
590 3HE MET 11 HE3 MET 11 7.297 0.425 -9.230
591 H ALA 12 HN ALA 12 9.136 1.581 -3.044
592 HA ALA 12 HA ALA 12 6.613 1.014 -1.854
593 1HB ALA 12 HB2 ALA 12 8.797 0.888 -0.563
594 2HB ALA 12 HB1 ALA 12 8.877 2.640 -0.608
595 3HB ALA 12 HB3 ALA 12 7.583 1.849 0.270
596 NH1 ARG 13 NH2 ARG 13 5.714 7.928 -5.447
597 NH2 ARG 13 NH1 ARG 13 6.798 9.716 -6.444
598 H ARG 13 HN ARG 13 8.286 3.976 -2.541
599 HA ARG 13 HA ARG 13 6.338 5.735 -1.409
600 1HB ARG 13 HB2 ARG 13 8.686 6.381 -2.167
601 2HB ARG 13 HB1 ARG 13 8.114 6.299 -3.818
602 1HG ARG 13 HG2 ARG 13 6.213 7.965 -2.874
603 2HG ARG 13 HG1 ARG 13 7.420 8.248 -1.641
604 1HD ARG 13 HD2 ARG 13 7.670 9.854 -3.538
605 2HD ARG 13 HD1 ARG 13 9.103 8.846 -3.355
606 HE ARG 13 HE ARG 13 8.591 7.809 -5.410
607 1HH1 ARG 13 HH22 ARG 13 5.745 7.142 -4.827
608 2HH1 ARG 13 HH21 ARG 13 4.835 8.111 -5.901
609 1HH2 ARG 13 HH12 ARG 13 7.633 10.261 -6.563
610 2HH2 ARG 13 HH11 ARG 13 5.979 9.994 -6.956
611 H PHE 14 HN PHE 14 6.620 4.086 -4.479
612 HA PHE 14 HA PHE 14 4.576 5.611 -5.815
613 1HB PHE 14 HB2 PHE 14 6.304 3.904 -6.833
614 2HB PHE 14 HB1 PHE 14 5.079 2.701 -6.428
615 HD1 PHE 14 HD1 PHE 14 2.793 2.851 -7.442
616 HD2 PHE 14 HD2 PHE 14 5.913 5.534 -8.552
617 HE1 PHE 14 HE1 PHE 14 1.513 3.534 -9.419
618 HE2 PHE 14 HE2 PHE 14 4.625 6.211 -10.525
619 HZ PHE 14 HZ PHE 14 2.421 5.212 -10.961
620 H ILE 15 HN ILE 15 4.530 2.676 -3.855
621 HA ILE 15 HA ILE 15 1.781 2.059 -4.309
622 HB ILE 15 HB ILE 15 3.297 1.672 -1.675
623 1HG1 ILE 15 HG12 ILE 15 3.203 -0.071 -4.177
624 2HG1 ILE 15 HG11 ILE 15 4.611 0.793 -3.618
625 1HG2 ILE 15 HG22 ILE 15 0.832 1.234 -1.637
626 2HG2 ILE 15 HG21 ILE 15 1.012 0.114 -2.972
627 3HG2 ILE 15 HG23 ILE 15 1.722 -0.251 -1.410
628 1HD1 ILE 15 HD2 ILE 15 4.631 -0.511 -1.527
629 2HD1 ILE 15 HD1 ILE 15 3.255 -1.441 -2.096
630 3HD1 ILE 15 HD3 ILE 15 4.780 -1.536 -2.946
631 NH1 ARG 16 NH1 ARG 16 3.827 7.661 3.597
632 NH2 ARG 16 NH2 ARG 16 5.943 8.418 3.008
633 H ARG 16 HN ARG 16 3.440 3.957 -1.887
634 HA ARG 16 HA ARG 16 1.265 4.894 -0.409
635 1HB ARG 16 HB2 ARG 16 3.565 5.426 0.207
636 2HB ARG 16 HB1 ARG 16 3.779 6.399 -1.235
637 1HG ARG 16 HG2 ARG 16 1.871 7.885 -0.403
638 2HG ARG 16 HG1 ARG 16 1.960 6.988 1.101
639 1HD ARG 16 HD2 ARG 16 4.262 8.507 -0.221
640 2HD ARG 16 HD1 ARG 16 3.373 9.040 1.198
641 HE ARG 16 HE ARG 16 5.036 6.558 1.182
642 1HH1 ARG 16 HH12 ARG 16 2.980 7.206 3.317
643 2HH1 ARG 16 HH11 ARG 16 3.890 7.971 4.551
644 1HH2 ARG 16 HH22 ARG 16 6.662 8.529 2.319
645 2HH2 ARG 16 HH21 ARG 16 6.141 8.778 3.925
646 H SER 17 HN SER 17 2.556 6.116 -3.467
647 HA SER 17 HA SER 17 0.884 8.392 -3.648
648 1HB SER 17 HB2 SER 17 1.750 6.656 -6.015
649 2HB SER 17 HB1 SER 17 1.462 8.401 -5.998
650 HG SER 17 HG1 SER 17 3.115 7.753 -3.998
651 H GLN 18 HN GLN 18 0.358 5.103 -4.903
652 HA GLN 18 HA GLN 18 -2.235 5.706 -5.916
653 1HB GLN 18 HB2 GLN 18 -1.112 3.056 -4.926
654 2HB GLN 18 HB1 GLN 18 -2.621 3.253 -5.808
655 1HG GLN 18 HG2 GLN 18 -1.343 4.344 -7.680
656 2HG GLN 18 HG1 GLN 18 0.154 4.052 -6.803
657 1HE2 GLN 18 HE21 GLN 18 -1.630 0.488 -7.568
658 2HE2 GLN 18 HE22 GLN 18 -2.387 1.620 -6.567
659 H THR 19 HN THR 19 -1.147 4.720 -2.711
660 HA THR 19 HA THR 19 -3.667 4.083 -1.637
661 HB THR 19 HB THR 19 -1.445 5.590 -0.133
662 HG1 THR 19 HG1 THR 19 -0.335 3.985 -1.039
663 1HG2 THR 19 HG21 THR 19 -3.243 3.203 0.579
664 2HG2 THR 19 HG23 THR 19 -2.141 4.034 1.668
665 3HG2 THR 19 HG22 THR 19 -3.587 4.843 1.097
666 H LEU 20 HN LEU 20 -2.004 7.197 -1.895
667 HA LEU 20 HA LEU 20 -4.109 8.700 -0.709
668 1HB LEU 20 HB2 LEU 20 -1.778 9.573 -1.167
669 2HB LEU 20 HB1 LEU 20 -2.165 9.600 -2.880
670 HG LEU 20 HG LEU 20 -4.053 11.207 -2.386
671 1HD1 LEU 20 HD11 LEU 20 -2.822 11.224 0.406
672 2HD1 LEU 20 HD13 LEU 20 -4.085 12.303 -0.156
673 3HD1 LEU 20 HD12 LEU 20 -4.408 10.595 0.019
674 1HD2 LEU 20 HD22 LEU 20 -1.297 12.077 -1.432
675 2HD2 LEU 20 HD21 LEU 20 -1.823 12.029 -3.108
676 3HD2 LEU 20 HD23 LEU 20 -2.573 13.150 -1.985
677 H THR 21 HN THR 21 -3.488 7.574 -3.973
678 HA THR 21 HA THR 21 -5.543 9.102 -5.229
679 HB THR 21 HB THR 21 -4.597 6.296 -6.063
680 HG1 THR 21 HG1 THR 21 -3.196 8.509 -5.528
681 1HG2 THR 21 HG21 THR 21 -5.304 8.824 -7.648
682 2HG2 THR 21 HG23 THR 21 -4.864 7.263 -8.332
683 3HG2 THR 21 HG22 THR 21 -6.378 7.440 -7.461
684 H LEU 22 HN LEU 22 -5.572 6.236 -3.263
685 HA LEU 22 HA LEU 22 -8.394 5.715 -3.949
686 1HB LEU 22 HB2 LEU 22 -6.359 4.304 -2.237
687 2HB LEU 22 HB1 LEU 22 -8.067 4.005 -1.983
688 HG LEU 22 HG LEU 22 -8.284 3.508 -4.471
689 1HD1 LEU 22 HD12 LEU 22 -6.210 4.649 -5.262
690 2HD1 LEU 22 HD11 LEU 22 -5.251 3.467 -4.381
691 3HD1 LEU 22 HD13 LEU 22 -6.241 2.964 -5.736
692 1HD2 LEU 22 HD22 LEU 22 -6.389 1.757 -2.881
693 2HD2 LEU 22 HD21 LEU 22 -8.144 1.696 -2.822
694 3HD2 LEU 22 HD23 LEU 22 -7.302 1.243 -4.296
695 H LEU 23 HN LEU 23 -6.528 7.392 -1.548
696 HA LEU 23 HA LEU 23 -8.391 7.365 0.589
697 1HB LEU 23 HB2 LEU 23 -6.332 8.569 0.987
698 2HB LEU 23 HB1 LEU 23 -6.551 9.574 -0.428
699 HG LEU 23 HG LEU 23 -8.610 10.621 0.699
700 1HD1 LEU 23 HD12 LEU 23 -9.095 8.750 2.245
701 2HD1 LEU 23 HD11 LEU 23 -7.620 9.091 3.126
702 3HD1 LEU 23 HD13 LEU 23 -8.908 10.277 3.090
703 1HD2 LEU 23 HD22 LEU 23 -5.972 10.888 2.157
704 2HD2 LEU 23 HD21 LEU 23 -6.452 11.747 0.709
705 3HD2 LEU 23 HD23 LEU 23 -7.309 12.027 2.214
706 H GLU 24 HN GLU 24 -7.963 9.330 -2.169
707 HA GLU 24 HA GLU 24 -10.010 11.164 -2.057
708 1HB GLU 24 HB2 GLU 24 -8.293 11.145 -3.795
709 2HB GLU 24 HB1 GLU 24 -8.845 9.605 -4.391
710 1HG GLU 24 HG2 GLU 24 -11.113 10.968 -4.827
711 2HG GLU 24 HG1 GLU 24 -9.987 12.326 -4.813
712 H LYS 25 HN LYS 25 -10.149 8.404 -4.051
713 HA LYS 25 HA LYS 25 -12.923 8.400 -4.485
714 1HB LYS 25 HB2 LYS 25 -10.992 6.053 -4.614
715 2HB LYS 25 HB1 LYS 25 -12.545 6.166 -5.438
716 1HG LYS 25 HG2 LYS 25 -11.805 8.140 -6.707
717 2HG LYS 25 HG1 LYS 25 -10.306 8.232 -5.826
718 1HD LYS 25 HD2 LYS 25 -9.626 6.024 -6.755
719 2HD LYS 25 HD1 LYS 25 -11.122 5.986 -7.681
720 1HE LYS 25 HE2 LYS 25 -9.257 6.916 -9.068
721 2HE LYS 25 HE1 LYS 25 -10.509 8.119 -8.808
722 1HZ LYS 25 HZ1 LYS 25 -8.655 8.371 -6.718
723 2HZ LYS 25 HZ3 LYS 25 -7.804 8.325 -8.181
724 3HZ LYS 25 HZ2 LYS 25 -9.031 9.444 -7.942
725 H LEU 26 HN LEU 26 -11.179 6.116 -2.387
726 HA LEU 26 HA LEU 26 -13.450 4.835 -1.352
727 1HB LEU 26 HB2 LEU 26 -10.934 5.554 0.196
728 2HB LEU 26 HB1 LEU 26 -12.134 4.398 0.720
729 HG LEU 26 HG LEU 26 -10.543 4.117 -1.880
730 1HD1 LEU 26 HD11 LEU 26 -10.196 2.739 0.824
731 2HD1 LEU 26 HD13 LEU 26 -9.287 2.364 -0.631
732 3HD1 LEU 26 HD12 LEU 26 -9.104 3.932 0.137
733 1HD2 LEU 26 HD22 LEU 26 -12.306 2.146 -0.358
734 2HD2 LEU 26 HD21 LEU 26 -12.758 2.922 -1.867
735 3HD2 LEU 26 HD23 LEU 26 -11.420 1.795 -1.832
736 H ASN 27 HN ASN 27 -12.177 7.983 -0.522
737 HA ASN 27 HA ASN 27 -13.822 8.186 1.862
738 1HB ASN 27 HB2 ASN 27 -11.782 9.615 1.509
739 2HB ASN 27 HB1 ASN 27 -12.644 10.452 0.214
740 1HD2 ASN 27 HD21 ASN 27 -14.043 12.629 2.568
741 2HD2 ASN 27 HD22 ASN 27 -13.287 12.419 1.067
742 H GLU 28 HN GLU 28 -13.995 9.751 -1.320
743 HA GLU 28 HA GLU 28 -16.577 10.865 -0.873
744 1HB GLU 28 HB2 GLU 28 -15.432 10.029 -3.564
745 2HB GLU 28 HB1 GLU 28 -16.632 11.275 -3.262
746 1HG GLU 28 HG2 GLU 28 -13.711 11.375 -2.392
747 2HG GLU 28 HG1 GLU 28 -14.490 12.378 -3.601
748 H LEU 29 HN LEU 29 -15.621 7.674 -1.381
749 HA LEU 29 HA LEU 29 -18.159 6.827 -2.591
750 1HB LEU 29 HB2 LEU 29 -15.569 5.574 -1.865
751 2HB LEU 29 HB1 LEU 29 -16.941 4.528 -1.608
752 HG LEU 29 HG LEU 29 -17.650 4.719 -3.922
753 1HD1 LEU 29 HD12 LEU 29 -17.037 7.129 -4.349
754 2HD1 LEU 29 HD11 LEU 29 -15.345 6.678 -4.352
755 3HD1 LEU 29 HD13 LEU 29 -16.417 6.062 -5.586
756 1HD2 LEU 29 HD21 LEU 29 -15.814 3.119 -3.405
757 2HD2 LEU 29 HD23 LEU 29 -15.660 3.740 -5.040
758 3HD2 LEU 29 HD22 LEU 29 -14.632 4.362 -3.757
759 H ASP 30 HN ASP 30 -17.866 8.234 0.056
760 HA ASP 30 HA ASP 30 -18.869 8.231 2.119
761 1HB ASP 30 HB2 ASP 30 -20.954 7.942 0.878
762 2HB ASP 30 HB1 ASP 30 -20.702 6.212 0.741
763 H ALA 31 HN ALA 31 -16.897 7.311 2.757
764 HA ALA 31 HA ALA 31 -17.283 5.108 4.551
765 1HB ALA 31 HB2 ALA 31 -16.967 3.794 2.457
766 2HB ALA 31 HB1 ALA 31 -15.431 4.609 2.187
767 3HB ALA 31 HB3 ALA 31 -15.636 3.552 3.579
768 H ASP 32 HN ASP 32 -16.621 7.180 5.535
769 HA ASP 32 HA ASP 32 -14.031 8.304 5.191
770 1HB ASP 32 HB2 ASP 32 -14.283 9.248 7.442
771 2HB ASP 32 HB1 ASP 32 -15.862 9.332 6.655
772 H GLU 33 HN GLU 33 -15.224 5.522 6.873
773 HA GLU 33 HA GLU 33 -12.957 4.991 8.505
774 1HB GLU 33 HB2 GLU 33 -15.227 3.733 8.481
775 2HB GLU 33 HB1 GLU 33 -14.663 2.876 7.068
776 1HG GLU 33 HG2 GLU 33 -12.975 2.873 9.554
777 2HG GLU 33 HG1 GLU 33 -14.396 1.856 9.488
778 H GLN 34 HN GLN 34 -13.834 3.615 5.389
779 HA GLN 34 HA GLN 34 -11.324 2.465 4.826
780 1HB GLN 34 HB2 GLN 34 -13.318 3.625 2.827
781 2HB GLN 34 HB1 GLN 34 -12.065 2.454 2.459
782 1HG GLN 34 HG2 GLN 34 -14.101 1.797 4.596
783 2HG GLN 34 HG1 GLN 34 -14.487 1.560 2.905
784 1HE2 GLN 34 HE21 GLN 34 -11.470 -0.748 4.479
785 2HE2 GLN 34 HE22 GLN 34 -11.768 0.764 5.184
786 H ALA 35 HN ALA 35 -12.320 5.758 4.693
787 HA ALA 35 HA ALA 35 -10.166 6.539 2.916
788 1HB ALA 35 HB2 ALA 35 -12.177 8.030 3.317
789 2HB ALA 35 HB1 ALA 35 -11.660 8.239 4.982
790 3HB ALA 35 HB3 ALA 35 -10.680 8.869 3.687
791 H ASP 36 HN ASP 36 -10.630 6.537 6.424
792 HA ASP 36 HA ASP 36 -8.009 7.605 6.961
793 1HB ASP 36 HB2 ASP 36 -9.620 7.526 8.833
794 2HB ASP 36 HB1 ASP 36 -9.699 5.764 8.725
795 H ILE 37 HN ILE 37 -9.235 4.362 7.399
796 HA ILE 37 HA ILE 37 -6.877 3.008 7.837
797 HB ILE 37 HB ILE 37 -9.026 1.923 5.993
798 1HG1 ILE 37 HG12 ILE 37 -10.162 2.801 8.039
799 2HG1 ILE 37 HG11 ILE 37 -10.120 1.061 8.067
800 1HG2 ILE 37 HG21 ILE 37 -7.101 0.641 7.981
801 2HG2 ILE 37 HG23 ILE 37 -8.300 -0.222 7.026
802 3HG2 ILE 37 HG22 ILE 37 -6.952 0.602 6.246
803 1HD1 ILE 37 HD1 ILE 37 -8.204 2.875 9.570
804 2HD1 ILE 37 HD3 ILE 37 -9.569 2.018 10.249
805 3HD1 ILE 37 HD2 ILE 37 -8.201 1.115 9.640
806 H CYS 38 HN CYS 38 -8.154 4.121 4.725
807 HA CYS 38 HA CYS 38 -6.167 2.790 3.145
808 1HB CYS 38 HB2 CYS 38 -8.106 3.929 2.103
809 2HB CYS 38 HB1 CYS 38 -7.537 5.470 2.691
810 HG CYS 38 HG1 CYS 38 -5.918 5.633 0.806
811 H GLU 39 HN GLU 39 -6.251 6.084 4.493
812 HA GLU 39 HA GLU 39 -3.493 6.359 3.698
813 1HB GLU 39 HB2 GLU 39 -5.252 8.033 5.505
814 2HB GLU 39 HB1 GLU 39 -3.649 8.521 4.960
815 1HG GLU 39 HG2 GLU 39 -5.955 7.780 3.105
816 2HG GLU 39 HG1 GLU 39 -5.424 9.418 3.468
817 H SER 40 HN SER 40 -4.832 4.640 6.257
818 HA SER 40 HA SER 40 -2.702 5.315 8.141
819 1HB SER 40 HB2 SER 40 -4.210 2.658 8.035
820 2HB SER 40 HB1 SER 40 -3.692 3.568 9.478
821 HG SER 40 HG1 SER 40 -5.527 4.690 9.288
822 H LEU 41 HN LEU 41 -3.458 3.220 5.483
823 HA LEU 41 HA LEU 41 -1.085 1.588 5.618
824 1HB LEU 41 HB2 LEU 41 -3.123 1.048 4.160
825 2HB LEU 41 HB1 LEU 41 -2.680 2.401 3.139
826 HG LEU 41 HG LEU 41 -0.404 1.300 2.807
827 1HD1 LEU 41 HD11 LEU 41 -1.941 -1.068 3.912
828 2HD1 LEU 41 HD13 LEU 41 -0.355 -1.132 3.160
829 3HD1 LEU 41 HD12 LEU 41 -0.568 -0.298 4.688
830 1HD2 LEU 41 HD22 LEU 41 -2.899 -0.082 1.751
831 2HD2 LEU 41 HD21 LEU 41 -2.159 1.361 1.078
832 3HD2 LEU 41 HD23 LEU 41 -1.294 -0.159 1.033
833 H HIS 42 HN HIS 42 -2.063 4.483 3.953
834 HA HIS 42 HA HIS 42 0.229 5.088 2.469
835 1HB HIS 42 HB2 HIS 42 -1.872 6.413 2.417
836 2HB HIS 42 HB1 HIS 42 -1.526 7.039 4.018
837 HD1 HIS 42 HD1 HIS 42 -1.478 8.236 0.884
838 HD2 HIS 42 HD2 HIS 42 1.397 8.299 3.788
839 HE1 HIS 42 HE1 HIS 42 0.066 10.065 0.291
840 H ASP 43 HN ASP 43 -0.518 6.177 5.723
841 HA ASP 43 HA ASP 43 1.911 7.437 6.330
842 1HB ASP 43 HB2 ASP 43 0.069 7.656 7.877
843 2HB ASP 43 HB1 ASP 43 0.066 5.914 8.185
844 H HIS 44 HN HIS 44 0.952 4.153 7.116
845 HA HIS 44 HA HIS 44 3.419 3.397 8.267
846 1HB HIS 44 HB2 HIS 44 1.336 2.016 8.438
847 2HB HIS 44 HB1 HIS 44 1.489 1.611 6.728
848 HD1 HIS 44 HD1 HIS 44 4.568 1.745 8.779
849 HD2 HIS 44 HD2 HIS 44 2.019 -1.134 7.372
850 HE1 HIS 44 HE1 HIS 44 5.691 -0.411 9.128
851 H ALA 45 HN ALA 45 2.461 3.688 4.939
852 HA ALA 45 HA ALA 45 4.553 2.026 3.874
853 1HB ALA 45 HB2 ALA 45 2.670 2.867 2.429
854 2HB ALA 45 HB1 ALA 45 3.324 4.495 2.565
855 3HB ALA 45 HB3 ALA 45 4.247 3.248 1.750
856 H ASP 46 HN ASP 46 4.468 5.181 5.249
857 HA ASP 46 HA ASP 46 6.953 6.004 4.030
858 1HB ASP 46 HB2 ASP 46 5.366 7.661 5.412
859 2HB ASP 46 HB1 ASP 46 6.144 6.935 6.796
860 H GLU 47 HN GLU 47 6.010 4.125 6.802
861 HA GLU 47 HA GLU 47 8.615 4.230 8.028
862 1HB GLU 47 HB2 GLU 47 6.633 1.896 8.053
863 2HB GLU 47 HB1 GLU 47 7.919 2.148 9.209
864 1HG GLU 47 HG2 GLU 47 5.561 4.052 8.801
865 2HG GLU 47 HG1 GLU 47 5.737 2.921 10.141
866 H LEU 48 HN LEU 48 7.026 2.184 5.705
867 HA LEU 48 HA LEU 48 9.282 0.459 5.310
868 1HB LEU 48 HB2 LEU 48 6.915 -0.073 4.533
869 2HB LEU 48 HB1 LEU 48 7.086 1.181 3.318
870 HG LEU 48 HG LEU 48 8.966 -0.047 2.259
871 1HD1 LEU 48 HD11 LEU 48 8.407 -2.199 4.346
872 2HD1 LEU 48 HD13 LEU 48 9.512 -2.345 2.990
873 3HD1 LEU 48 HD12 LEU 48 9.864 -1.219 4.276
874 1HD2 LEU 48 HD22 LEU 48 6.486 -1.728 2.715
875 2HD2 LEU 48 HD21 LEU 48 6.685 -0.495 1.483
876 3HD2 LEU 48 HD23 LEU 48 7.648 -1.966 1.421
877 OH TYR 49 OH TYR 49 12.336 8.336 -1.283
878 H TYR 49 HN TYR 49 8.517 3.652 4.357
879 HA TYR 49 HA TYR 49 10.592 3.575 2.251
880 1HB TYR 49 HB2 TYR 49 8.440 4.708 1.733
881 2HB TYR 49 HB1 TYR 49 8.722 5.862 3.021
882 HD1 TYR 49 HD2 TYR 49 10.186 4.532 -0.116
883 HD2 TYR 49 HD1 TYR 49 10.087 7.796 2.610
884 HE1 TYR 49 HE2 TYR 49 11.524 5.857 -1.671
885 HE2 TYR 49 HE1 TYR 49 11.423 9.125 1.072
886 HH TYR 49 HH TYR 49 12.114 9.262 -1.131
887 NH1 ARG 50 NH2 ARG 50 8.304 6.991 8.475
888 NH2 ARG 50 NH1 ARG 50 9.273 6.717 10.558
889 H ARG 50 HN ARG 50 9.875 6.324 4.234
890 HA ARG 50 HA ARG 50 12.324 7.393 4.581
891 1HB ARG 50 HB2 ARG 50 10.330 8.467 5.313
892 2HB ARG 50 HB1 ARG 50 10.020 7.237 6.513
893 1HG ARG 50 HG2 ARG 50 12.560 8.258 7.220
894 2HG ARG 50 HG1 ARG 50 11.691 9.642 6.584
895 1HD ARG 50 HD2 ARG 50 11.233 9.316 9.045
896 2HD ARG 50 HD1 ARG 50 9.765 9.190 8.077
897 HE ARG 50 HE ARG 50 11.243 6.690 8.749
898 1HH1 ARG 50 HH22 ARG 50 8.391 7.227 7.504
899 2HH1 ARG 50 HH21 ARG 50 7.392 6.732 8.811
900 1HH2 ARG 50 HH12 ARG 50 10.079 6.749 11.150
901 2HH2 ARG 50 HH11 ARG 50 8.394 6.442 10.962
902 H SER 51 HN SER 51 10.950 5.248 7.113
903 HA SER 51 HA SER 51 13.361 5.250 8.621
904 1HB SER 51 HB2 SER 51 11.497 2.843 8.526
905 2HB SER 51 HB1 SER 51 12.308 3.591 9.913
906 HG SER 51 HG1 SER 51 10.195 4.319 9.824
907 H CYS 52 HN CYS 52 12.123 2.817 6.304
908 HA CYS 52 HA CYS 52 14.672 1.478 6.421
909 1HB CYS 52 HB2 CYS 52 12.663 1.293 4.169
910 2HB CYS 52 HB1 CYS 52 13.927 0.170 4.523
911 HG CYS 52 HG1 CYS 52 12.552 -0.901 6.343
912 H LEU 53 HN LEU 53 14.106 4.446 5.176
913 HA LEU 53 HA LEU 53 15.689 3.833 2.764
914 1HB LEU 53 HB2 LEU 53 13.788 5.736 3.121
915 2HB LEU 53 HB1 LEU 53 15.160 6.642 3.711
916 HG LEU 53 HG LEU 53 14.696 5.493 0.969
917 1HD1 LEU 53 HD11 LEU 53 15.312 8.254 2.042
918 2HD1 LEU 53 HD13 LEU 53 15.070 7.884 0.340
919 3HD1 LEU 53 HD12 LEU 53 13.751 7.670 1.487
920 1HD2 LEU 53 HD22 LEU 53 17.334 6.569 2.046
921 2HD2 LEU 53 HD21 LEU 53 17.036 4.934 1.470
922 3HD2 LEU 53 HD23 LEU 53 17.008 6.268 0.352
923 H ALA 54 HN ALA 54 15.845 5.515 5.791
924 HA ALA 54 HA ALA 54 18.274 6.771 5.771
925 1HB ALA 54 HB2 ALA 54 16.861 6.618 7.817
926 2HB ALA 54 HB1 ALA 54 17.330 4.933 7.995
927 3HB ALA 54 HB3 ALA 54 18.530 6.196 8.165
928 NH1 ARG 55 NH2 ARG 55 18.969 -2.766 7.700
929 NH2 ARG 55 NH1 ARG 55 18.036 -2.173 9.736
930 H ARG 55 HN ARG 55 17.779 3.318 6.149
931 HA ARG 55 HA ARG 55 20.727 2.954 5.738
932 1HB ARG 55 HB2 ARG 55 19.641 2.152 7.980
933 2HB ARG 55 HB1 ARG 55 18.786 1.064 6.926
934 1HG ARG 55 HG2 ARG 55 20.712 -0.147 6.214
935 2HG ARG 55 HG1 ARG 55 21.775 0.947 7.083
936 1HD ARG 55 HD2 ARG 55 21.107 -1.293 8.276
937 2HD ARG 55 HD1 ARG 55 20.902 0.167 9.230
938 HE ARG 55 HE ARG 55 18.474 0.097 8.447
939 1HH1 ARG 55 HH22 ARG 55 19.485 -2.509 6.881
940 2HH1 ARG 55 HH21 ARG 55 18.661 -3.719 7.779
941 1HH2 ARG 55 HH12 ARG 55 17.851 -1.462 10.421
942 2HH2 ARG 55 HH11 ARG 55 17.698 -3.097 9.932
943 H PHE 56 HN PHE 56 17.698 2.619 4.282
944 HA PHE 56 HA PHE 56 16.919 1.290 2.508
945 1HB PHE 56 HB2 PHE 56 19.077 1.608 1.177
946 2HB PHE 56 HB1 PHE 56 19.862 0.337 2.139
947 HD1 PHE 56 HD1 PHE 56 16.498 0.863 0.567
948 HD2 PHE 56 HD2 PHE 56 19.756 -1.785 1.198
949 HE1 PHE 56 HE1 PHE 56 15.300 -0.899 -0.666
950 HE2 PHE 56 HE2 PHE 56 18.562 -3.535 -0.043
951 HZ PHE 56 HZ PHE 56 16.341 -3.097 -0.982
952 H GLY 57 HN GLY 57 16.694 1.012 4.878
953 1HA GLY 57 HA2 GLY 57 16.155 -1.588 5.584
954 2HA GLY 57 HA1 GLY 57 17.844 -1.357 6.106
955 H ASP 58 HN ASP 58 15.631 -1.639 7.870
956 HA ASP 58 HA ASP 58 14.261 0.474 8.864
957 1HB ASP 58 HB2 ASP 58 15.866 -1.487 10.501
958 2HB ASP 58 HB1 ASP 58 14.584 -0.460 11.109
959 H ASP 59 HN ASP 59 14.549 2.238 10.110
960 HA ASP 59 HA ASP 59 17.305 3.295 10.198
961 1HB ASP 59 HB2 ASP 59 15.582 4.795 9.293
962 2HB ASP 59 HB1 ASP 59 14.641 4.667 10.768
963 H GLY 60 HN GLY 60 15.220 4.668 12.493
964 1HA GLY 60 HA2 GLY 60 17.045 4.044 14.609
965 2HA GLY 60 HA1 GLY 60 15.501 4.878 14.784
966 H GLU 61 HN GLU 61 14.471 2.310 13.260
967 HA GLU 61 HA GLU 61 13.496 1.068 15.661
968 1HB GLU 61 HB2 GLU 61 13.705 -0.191 12.884
969 2HB GLU 61 HB1 GLU 61 12.652 -0.725 14.169
970 1HG GLU 61 HG2 GLU 61 11.227 0.555 12.759
971 2HG GLU 61 HG1 GLU 61 11.625 1.680 14.052
972 H ASN 62 HN ASN 62 16.043 0.419 13.355
973 HA ASN 62 HA ASN 62 17.970 -0.509 15.143
974 1HB ASN 62 HB2 ASN 62 18.030 -2.931 14.746
975 2HB ASN 62 HB1 ASN 62 16.467 -2.592 15.457
976 1HD2 ASN 62 HD21 ASN 62 15.021 -2.857 11.969
977 2HD2 ASN 62 HD22 ASN 62 15.158 -1.563 13.043
978 H LEU 63 HN LEU 63 19.796 -1.335 13.889
979 HA LEU 63 HA LEU 63 19.609 -0.408 11.074
980 1HB LEU 63 HB2 LEU 63 21.973 -0.910 12.930
981 2HB LEU 63 HB1 LEU 63 22.171 -0.605 11.223
982 HG LEU 63 HG LEU 63 21.068 1.604 11.448
983 1HD1 LEU 63 HD11 LEU 63 21.038 1.033 14.439
984 2HD1 LEU 63 HD13 LEU 63 20.694 2.587 13.692
985 3HD1 LEU 63 HD12 LEU 63 19.625 1.241 13.410
986 1HD2 LEU 63 HD22 LEU 63 23.400 1.156 13.354
987 2HD2 LEU 63 HD21 LEU 63 23.519 1.430 11.623
988 3HD2 LEU 63 HD23 LEU 63 22.934 2.709 12.674
Start of MODEL 8
Raw file had 988 H/Q atoms
Start of MODEL 8
1 1H MET 1 HT1 MET 1 -22.857 -0.818 -2.004
2 2H MET 1 HT3 MET 1 -23.571 -2.107 -1.165
3 3H MET 1 HT2 MET 1 -21.890 -1.935 -1.187
4 HA MET 1 HA MET 1 -21.730 -3.126 -3.015
5 1HB MET 1 HB2 MET 1 -24.760 -3.198 -2.852
6 2HB MET 1 HB1 MET 1 -23.849 -4.086 -4.059
7 1HG MET 1 HG2 MET 1 -22.552 -5.140 -2.159
8 2HG MET 1 HG1 MET 1 -23.672 -4.402 -1.050
9 1HE MET 1 HE1 MET 1 -26.201 -4.576 -1.456
10 2HE MET 1 HE3 MET 1 -26.934 -6.158 -1.509
11 3HE MET 1 HE2 MET 1 -25.862 -5.749 -0.169
12 H THR 2 HN THR 2 -20.894 -1.278 -4.175
13 HA THR 2 HA THR 2 -22.767 -0.388 -6.305
14 HB THR 2 HB THR 2 -20.750 1.450 -4.864
15 HG1 THR 2 HG1 THR 2 -22.253 1.352 -3.390
16 1HG2 THR 2 HG21 THR 2 -23.263 2.043 -6.532
17 2HG2 THR 2 HG23 THR 2 -22.135 3.229 -5.897
18 3HG2 THR 2 HG22 THR 2 -21.644 2.169 -7.206
19 H LYS 3 HN LYS 3 -21.569 0.275 -8.230
20 HA LYS 3 HA LYS 3 -19.593 -1.626 -8.967
21 1HB LYS 3 HB2 LYS 3 -21.109 -0.179 -10.481
22 2HB LYS 3 HB1 LYS 3 -20.001 1.141 -10.226
23 1HG LYS 3 HG2 LYS 3 -19.310 -1.559 -11.475
24 2HG LYS 3 HG1 LYS 3 -19.641 -0.108 -12.387
25 1HD LYS 3 HD2 LYS 3 -17.259 -0.580 -10.559
26 2HD LYS 3 HD1 LYS 3 -17.269 -0.508 -12.296
27 1HE LYS 3 HE2 LYS 3 -17.948 1.851 -12.307
28 2HE LYS 3 HE1 LYS 3 -18.075 1.868 -10.558
29 1HZ LYS 3 HZ1 LYS 3 -15.524 0.964 -11.194
30 2HZ LYS 3 HZ3 LYS 3 -15.840 2.370 -12.108
31 3HZ LYS 3 HZ2 LYS 3 -15.996 2.391 -10.425
32 H GLN 4 HN GLN 4 -19.390 1.750 -7.966
33 HA GLN 4 HA GLN 4 -16.615 2.109 -8.136
34 1HB GLN 4 HB2 GLN 4 -18.460 3.137 -5.928
35 2HB GLN 4 HB1 GLN 4 -16.843 3.725 -6.266
36 1HG GLN 4 HG2 GLN 4 -19.049 3.804 -8.346
37 2HG GLN 4 HG1 GLN 4 -18.629 5.157 -7.294
38 1HE2 GLN 4 HE21 GLN 4 -15.509 5.805 -8.878
39 2HE2 GLN 4 HE22 GLN 4 -16.407 6.045 -7.468
40 H GLU 5 HN GLU 5 -18.475 0.772 -5.474
41 HA GLU 5 HA GLU 5 -16.321 0.334 -3.706
42 1HB GLU 5 HB2 GLU 5 -18.758 -1.365 -4.159
43 2HB GLU 5 HB1 GLU 5 -17.733 -1.412 -2.753
44 1HG GLU 5 HG2 GLU 5 -18.349 0.837 -2.104
45 2HG GLU 5 HG1 GLU 5 -19.174 1.135 -3.630
46 H LYS 6 HN LYS 6 -17.670 -1.673 -6.228
47 HA LYS 6 HA LYS 6 -15.995 -3.922 -5.730
48 1HB LYS 6 HB2 LYS 6 -18.090 -3.638 -7.370
49 2HB LYS 6 HB1 LYS 6 -16.870 -3.131 -8.521
50 1HG LYS 6 HG2 LYS 6 -17.205 -5.478 -8.883
51 2HG LYS 6 HG1 LYS 6 -15.640 -5.292 -8.120
52 1HD LYS 6 HD2 LYS 6 -16.528 -5.906 -5.925
53 2HD LYS 6 HD1 LYS 6 -18.170 -5.917 -6.531
54 1HE LYS 6 HE2 LYS 6 -15.891 -7.764 -7.407
55 2HE LYS 6 HE1 LYS 6 -17.247 -8.221 -6.390
56 1HZ LYS 6 HZ1 LYS 6 -18.279 -7.080 -8.723
57 2HZ LYS 6 HZ3 LYS 6 -17.101 -8.216 -9.173
58 3HZ LYS 6 HZ2 LYS 6 -18.396 -8.682 -8.187
59 H THR 7 HN THR 7 -15.590 -0.954 -7.484
60 HA THR 7 HA THR 7 -13.114 -1.795 -8.738
61 HB THR 7 HB THR 7 -13.975 1.109 -8.238
62 HG1 THR 7 HG1 THR 7 -15.416 -0.851 -9.280
63 1HG2 THR 7 HG22 THR 7 -11.821 0.577 -9.535
64 2HG2 THR 7 HG21 THR 7 -12.787 -0.338 -10.678
65 3HG2 THR 7 HG23 THR 7 -13.016 1.399 -10.520
66 H ALA 8 HN ALA 8 -14.107 -0.257 -5.776
67 HA ALA 8 HA ALA 8 -11.481 0.623 -4.997
68 1HB ALA 8 HB1 ALA 8 -13.906 0.012 -3.273
69 2HB ALA 8 HB3 ALA 8 -12.473 0.873 -2.735
70 3HB ALA 8 HB2 ALA 8 -13.521 1.583 -3.959
71 H LEU 9 HN LEU 9 -13.306 -2.331 -4.615
72 HA LEU 9 HA LEU 9 -11.425 -3.416 -2.692
73 1HB LEU 9 HB2 LEU 9 -13.550 -4.682 -4.452
74 2HB LEU 9 HB1 LEU 9 -12.508 -5.654 -3.432
75 HG LEU 9 HG LEU 9 -14.046 -3.302 -2.343
76 1HD1 LEU 9 HD11 LEU 9 -14.858 -6.253 -2.426
77 2HD1 LEU 9 HD13 LEU 9 -15.743 -4.999 -1.569
78 3HD1 LEU 9 HD12 LEU 9 -15.657 -4.967 -3.321
79 1HD2 LEU 9 HD21 LEU 9 -12.162 -4.186 -0.952
80 2HD2 LEU 9 HD23 LEU 9 -13.702 -4.498 -0.193
81 3HD2 LEU 9 HD22 LEU 9 -12.865 -5.788 -1.035
82 H ASN 10 HN ASN 10 -12.065 -3.920 -6.105
83 HA ASN 10 HA ASN 10 -9.918 -5.709 -6.574
84 1HB ASN 10 HB2 ASN 10 -11.753 -5.005 -8.236
85 2HB ASN 10 HB1 ASN 10 -10.804 -3.546 -8.510
86 1HD2 ASN 10 HD21 ASN 10 -9.680 -5.913 -11.086
87 2HD2 ASN 10 HD22 ASN 10 -11.066 -5.008 -10.729
88 H MET 11 HN MET 11 -10.127 -2.263 -6.298
89 HA MET 11 HA MET 11 -7.443 -1.720 -7.163
90 1HB MET 11 HB2 MET 11 -9.047 0.082 -7.178
91 2HB MET 11 HB1 MET 11 -9.432 -0.172 -5.487
92 1HG MET 11 HG2 MET 11 -6.686 0.588 -6.420
93 2HG MET 11 HG1 MET 11 -7.901 1.775 -6.054
94 1HE MET 11 HE3 MET 11 -9.072 2.008 -4.110
95 2HE MET 11 HE2 MET 11 -9.119 0.740 -2.884
96 3HE MET 11 HE1 MET 11 -8.204 2.236 -2.611
97 H ALA 12 HN ALA 12 -8.919 -2.114 -3.957
98 HA ALA 12 HA ALA 12 -6.495 -1.643 -2.519
99 1HB ALA 12 HB1 ALA 12 -8.847 -3.418 -1.735
100 2HB ALA 12 HB3 ALA 12 -7.596 -2.848 -0.639
101 3HB ALA 12 HB2 ALA 12 -8.707 -1.703 -1.377
102 NH1 ARG 13 NH1 ARG 13 -4.962 -7.956 -7.534
103 NH2 ARG 13 NH2 ARG 13 -6.100 -5.996 -8.030
104 H ARG 13 HN ARG 13 -7.846 -4.361 -4.139
105 HA ARG 13 HA ARG 13 -6.013 -6.300 -3.026
106 1HB ARG 13 HB2 ARG 13 -8.123 -7.010 -4.067
107 2HB ARG 13 HB1 ARG 13 -7.689 -6.332 -5.602
108 1HG ARG 13 HG2 ARG 13 -5.561 -8.037 -5.202
109 2HG ARG 13 HG1 ARG 13 -6.750 -8.799 -4.178
110 1HD ARG 13 HD2 ARG 13 -6.878 -9.727 -6.498
111 2HD ARG 13 HD1 ARG 13 -8.375 -8.937 -6.030
112 HE ARG 13 HE ARG 13 -8.009 -7.714 -7.987
113 1HH1 ARG 13 HH12 ARG 13 -4.996 -8.922 -7.266
114 2HH1 ARG 13 HH11 ARG 13 -4.056 -7.551 -7.693
115 1HH2 ARG 13 HH22 ARG 13 -6.975 -5.508 -8.110
116 2HH2 ARG 13 HH21 ARG 13 -5.262 -5.487 -8.235
117 H PHE 14 HN PHE 14 -6.101 -4.032 -5.682
118 HA PHE 14 HA PHE 14 -3.740 -5.047 -6.990
119 1HB PHE 14 HB2 PHE 14 -5.288 -3.361 -8.131
120 2HB PHE 14 HB1 PHE 14 -4.717 -2.153 -6.982
121 HD1 PHE 14 HD2 PHE 14 -3.380 -4.640 -9.447
122 HD2 PHE 14 HD1 PHE 14 -2.795 -0.924 -7.434
123 HE1 PHE 14 HE2 PHE 14 -1.385 -4.212 -10.800
124 HE2 PHE 14 HE1 PHE 14 -0.805 -0.502 -8.796
125 HZ PHE 14 HZ PHE 14 -0.091 -2.147 -10.481
126 H ILE 15 HN ILE 15 -4.301 -2.535 -4.555
127 HA ILE 15 HA ILE 15 -1.578 -1.733 -4.387
128 HB ILE 15 HB ILE 15 -3.655 -1.870 -2.141
129 1HG1 ILE 15 HG12 ILE 15 -2.916 0.319 -4.137
130 2HG1 ILE 15 HG11 ILE 15 -4.447 -0.529 -4.064
131 1HG2 ILE 15 HG22 ILE 15 -1.294 -1.582 -1.343
132 2HG2 ILE 15 HG21 ILE 15 -1.122 -0.194 -2.400
133 3HG2 ILE 15 HG23 ILE 15 -2.234 -0.145 -1.039
134 1HD1 ILE 15 HD2 ILE 15 -4.870 0.412 -1.799
135 2HD1 ILE 15 HD1 ILE 15 -3.367 1.323 -1.902
136 3HD1 ILE 15 HD3 ILE 15 -4.670 1.664 -3.009
137 NH1 ARG 16 NH1 ARG 16 -6.725 -7.925 -0.452
138 NH2 ARG 16 NH2 ARG 16 -6.037 -10.047 0.177
139 H ARG 16 HN ARG 16 -3.452 -4.294 -2.895
140 HA ARG 16 HA ARG 16 -1.325 -5.214 -1.221
141 1HB ARG 16 HB2 ARG 16 -3.744 -5.904 -0.997
142 2HB ARG 16 HB1 ARG 16 -3.564 -6.855 -2.466
143 1HG ARG 16 HG2 ARG 16 -1.971 -8.308 -1.470
144 2HG ARG 16 HG1 ARG 16 -1.700 -7.216 -0.119
145 1HD ARG 16 HD2 ARG 16 -3.197 -9.168 0.483
146 2HD ARG 16 HD1 ARG 16 -3.963 -7.606 0.716
147 HE ARG 16 HE ARG 16 -4.485 -8.773 -1.915
148 1HH1 ARG 16 HH12 ARG 16 -6.543 -7.051 -0.906
149 2HH1 ARG 16 HH11 ARG 16 -7.627 -8.055 -0.022
150 1HH2 ARG 16 HH22 ARG 16 -5.341 -10.766 0.194
151 2HH2 ARG 16 HH21 ARG 16 -6.917 -10.236 0.630
152 H SER 17 HN SER 17 -2.165 -5.745 -4.595
153 HA SER 17 HA SER 17 -0.307 -7.909 -4.985
154 1HB SER 17 HB2 SER 17 -1.130 -5.836 -7.095
155 2HB SER 17 HB1 SER 17 -0.621 -7.503 -7.371
156 HG SER 17 HG1 SER 17 -2.609 -7.373 -5.544
157 H GLN 18 HN GLN 18 -0.098 -4.395 -5.024
158 HA GLN 18 HA GLN 18 2.597 -4.373 -6.048
159 1HB GLN 18 HB2 GLN 18 1.113 -2.297 -4.383
160 2HB GLN 18 HB1 GLN 18 2.642 -2.037 -5.201
161 1HG GLN 18 HG2 GLN 18 1.597 -2.540 -7.380
162 2HG GLN 18 HG1 GLN 18 0.057 -2.840 -6.582
163 1HE2 GLN 18 HE21 GLN 18 1.271 0.978 -7.197
164 2HE2 GLN 18 HE22 GLN 18 2.252 -0.322 -7.663
165 H THR 19 HN THR 19 1.115 -4.585 -2.866
166 HA THR 19 HA THR 19 3.548 -4.201 -1.431
167 HB THR 19 HB THR 19 1.132 -5.894 -0.550
168 HG1 THR 19 HG1 THR 19 0.171 -4.046 -1.051
169 1HG2 THR 19 HG21 THR 19 2.965 -3.868 0.875
170 2HG2 THR 19 HG23 THR 19 1.732 -4.842 1.649
171 3HG2 THR 19 HG22 THR 19 3.185 -5.603 1.028
172 H LEU 20 HN LEU 20 2.179 -6.816 -3.232
173 HA LEU 20 HA LEU 20 3.867 -8.867 -2.059
174 1HB LEU 20 HB2 LEU 20 1.725 -9.090 -3.655
175 2HB LEU 20 HB1 LEU 20 2.883 -8.860 -4.944
176 HG LEU 20 HG LEU 20 2.490 -11.229 -4.664
177 1HD1 LEU 20 HD12 LEU 20 4.826 -10.591 -5.222
178 2HD1 LEU 20 HD11 LEU 20 5.232 -10.580 -3.510
179 3HD1 LEU 20 HD13 LEU 20 4.756 -12.073 -4.286
180 1HD2 LEU 20 HD21 LEU 20 1.715 -11.204 -2.329
181 2HD2 LEU 20 HD23 LEU 20 2.982 -12.396 -2.541
182 3HD2 LEU 20 HD22 LEU 20 3.340 -10.870 -1.759
183 H THR 21 HN THR 21 3.872 -6.797 -4.886
184 HA THR 21 HA THR 21 6.418 -7.452 -5.887
185 HB THR 21 HB THR 21 5.082 -4.684 -6.010
186 HG1 THR 21 HG1 THR 21 3.461 -5.972 -6.616
187 1HG2 THR 21 HG21 THR 21 6.517 -6.428 -8.078
188 2HG2 THR 21 HG23 THR 21 5.950 -4.776 -8.330
189 3HG2 THR 21 HG22 THR 21 7.291 -5.087 -7.234
190 H LEU 22 HN LEU 22 5.505 -5.619 -3.098
191 HA LEU 22 HA LEU 22 8.168 -4.376 -2.874
192 1HB LEU 22 HB2 LEU 22 5.887 -4.544 -0.877
193 2HB LEU 22 HB1 LEU 22 7.386 -3.697 -0.586
194 HG LEU 22 HG LEU 22 5.373 -2.994 -2.767
195 1HD1 LEU 22 HD11 LEU 22 6.098 -1.675 -0.118
196 2HD1 LEU 22 HD13 LEU 22 4.944 -1.032 -1.267
197 3HD1 LEU 22 HD12 LEU 22 4.605 -2.536 -0.439
198 1HD2 LEU 22 HD22 LEU 22 7.916 -1.566 -1.854
199 2HD2 LEU 22 HD21 LEU 22 7.729 -2.390 -3.394
200 3HD2 LEU 22 HD23 LEU 22 6.782 -0.960 -3.049
201 H LEU 23 HN LEU 23 6.318 -7.029 -1.482
202 HA LEU 23 HA LEU 23 8.236 -7.677 0.517
203 1HB LEU 23 HB2 LEU 23 5.979 -8.781 0.439
204 2HB LEU 23 HB1 LEU 23 6.424 -9.554 -1.072
205 HG LEU 23 HG LEU 23 8.253 -10.824 0.081
206 1HD1 LEU 23 HD11 LEU 23 7.222 -9.435 2.588
207 2HD1 LEU 23 HD13 LEU 23 8.411 -10.720 2.557
208 3HD1 LEU 23 HD12 LEU 23 8.795 -9.165 1.859
209 1HD2 LEU 23 HD22 LEU 23 5.568 -11.020 1.507
210 2HD2 LEU 23 HD21 LEU 23 5.969 -11.807 -0.013
211 3HD2 LEU 23 HD23 LEU 23 6.801 -12.266 1.464
212 H GLU 24 HN GLU 24 7.866 -8.295 -2.823
213 HA GLU 24 HA GLU 24 9.891 -10.232 -3.199
214 1HB GLU 24 HB2 GLU 24 8.198 -9.765 -4.909
215 2HB GLU 24 HB1 GLU 24 8.669 -8.091 -4.988
216 1HG GLU 24 HG2 GLU 24 11.042 -9.359 -5.666
217 2HG GLU 24 HG1 GLU 24 9.841 -10.480 -6.285
218 H LYS 25 HN LYS 25 10.061 -7.059 -4.500
219 HA LYS 25 HA LYS 25 12.798 -6.858 -4.724
220 1HB LYS 25 HB2 LYS 25 10.805 -4.641 -4.153
221 2HB LYS 25 HB1 LYS 25 12.442 -4.375 -4.753
222 1HG LYS 25 HG2 LYS 25 11.986 -5.826 -6.705
223 2HG LYS 25 HG1 LYS 25 10.394 -6.192 -6.084
224 1HD LYS 25 HD2 LYS 25 9.697 -3.857 -6.363
225 2HD LYS 25 HD1 LYS 25 11.319 -3.422 -6.891
226 1HE LYS 25 HE2 LYS 25 9.772 -3.860 -8.849
227 2HE LYS 25 HE1 LYS 25 11.162 -4.933 -8.827
228 1HZ LYS 25 HZ1 LYS 25 9.113 -6.168 -7.355
229 2HZ LYS 25 HZ3 LYS 25 8.465 -5.649 -8.823
230 3HZ LYS 25 HZ2 LYS 25 9.816 -6.652 -8.777
231 H LEU 26 HN LEU 26 10.976 -5.958 -1.842
232 HA LEU 26 HA LEU 26 13.326 -4.852 -0.566
233 1HB LEU 26 HB2 LEU 26 10.708 -5.946 0.517
234 2HB LEU 26 HB1 LEU 26 12.004 -5.503 1.591
235 HG LEU 26 HG LEU 26 11.930 -3.200 1.014
236 1HD1 LEU 26 HD11 LEU 26 10.169 -3.859 -1.400
237 2HD1 LEU 26 HD13 LEU 26 10.675 -2.263 -0.896
238 3HD1 LEU 26 HD12 LEU 26 11.862 -3.402 -1.486
239 1HD2 LEU 26 HD21 LEU 26 9.950 -3.922 2.324
240 2HD2 LEU 26 HD23 LEU 26 9.533 -2.583 1.268
241 3HD2 LEU 26 HD22 LEU 26 9.067 -4.224 0.841
242 H ASN 27 HN ASN 27 11.813 -8.036 -0.607
243 HA ASN 27 HA ASN 27 13.692 -9.187 1.217
244 1HB ASN 27 HB2 ASN 27 11.600 -10.324 0.747
245 2HB ASN 27 HB1 ASN 27 12.043 -10.505 -0.950
246 1HD2 ASN 27 HD21 ASN 27 13.707 -13.495 -0.289
247 2HD2 ASN 27 HD22 ASN 27 12.773 -12.552 -1.341
248 H GLU 28 HN GLU 28 13.580 -9.481 -2.368
249 HA GLU 28 HA GLU 28 16.030 -10.917 -2.447
250 1HB GLU 28 HB2 GLU 28 15.420 -9.072 -4.725
251 2HB GLU 28 HB1 GLU 28 15.932 -10.745 -4.749
252 1HG GLU 28 HG2 GLU 28 13.137 -9.694 -4.274
253 2HG GLU 28 HG1 GLU 28 13.699 -10.754 -5.541
254 H LEU 29 HN LEU 29 15.406 -7.448 -2.360
255 HA LEU 29 HA LEU 29 18.252 -6.921 -2.912
256 1HB LEU 29 HB2 LEU 29 15.935 -5.066 -2.274
257 2HB LEU 29 HB1 LEU 29 17.579 -4.512 -2.360
258 HG LEU 29 HG LEU 29 17.869 -5.139 -4.639
259 1HD1 LEU 29 HD11 LEU 29 15.058 -6.323 -4.637
260 2HD1 LEU 29 HD13 LEU 29 16.078 -6.102 -6.042
261 3HD1 LEU 29 HD12 LEU 29 16.559 -7.221 -4.790
262 1HD2 LEU 29 HD22 LEU 29 15.214 -3.732 -4.224
263 2HD2 LEU 29 HD21 LEU 29 16.814 -3.006 -4.235
264 3HD2 LEU 29 HD23 LEU 29 16.152 -3.682 -5.712
265 H ASP 30 HN ASP 30 17.238 -8.361 -0.424
266 HA ASP 30 HA ASP 30 17.820 -8.483 1.800
267 1HB ASP 30 HB2 ASP 30 20.160 -8.417 0.980
268 2HB ASP 30 HB1 ASP 30 20.106 -6.653 0.930
269 H ALA 31 HN ALA 31 15.901 -7.281 2.081
270 HA ALA 31 HA ALA 31 16.460 -4.890 3.750
271 1HB ALA 31 HB2 ALA 31 15.735 -4.032 1.475
272 2HB ALA 31 HB1 ALA 31 14.238 -4.937 1.644
273 3HB ALA 31 HB3 ALA 31 14.595 -3.627 2.742
274 H ASP 32 HN ASP 32 16.280 -7.197 4.636
275 HA ASP 32 HA ASP 32 13.877 -8.569 4.946
276 1HB ASP 32 HB2 ASP 32 14.824 -9.248 7.233
277 2HB ASP 32 HB1 ASP 32 15.816 -9.638 5.829
278 H GLU 33 HN GLU 33 15.071 -5.973 7.097
279 HA GLU 33 HA GLU 33 12.788 -6.209 8.792
280 1HB GLU 33 HB2 GLU 33 13.494 -4.169 9.807
281 2HB GLU 33 HB1 GLU 33 14.980 -4.889 9.231
282 1HG GLU 33 HG2 GLU 33 13.507 -2.748 7.684
283 2HG GLU 33 HG1 GLU 33 14.732 -2.393 8.875
284 H GLN 34 HN GLN 34 13.369 -4.542 5.785
285 HA GLN 34 HA GLN 34 10.892 -3.022 5.931
286 1HB GLN 34 HB2 GLN 34 12.204 -3.910 3.339
287 2HB GLN 34 HB1 GLN 34 11.198 -2.502 3.606
288 1HG GLN 34 HG2 GLN 34 14.002 -2.892 4.664
289 2HG GLN 34 HG1 GLN 34 13.496 -1.783 3.409
290 1HE2 GLN 34 HE21 GLN 34 13.619 -0.252 6.935
291 2HE2 GLN 34 HE22 GLN 34 14.654 -1.384 6.226
292 H ALA 35 HN ALA 35 11.865 -6.223 5.083
293 HA ALA 35 HA ALA 35 9.499 -6.878 3.569
294 1HB ALA 35 HB2 ALA 35 11.521 -8.419 3.586
295 2HB ALA 35 HB1 ALA 35 11.170 -8.807 5.268
296 3HB ALA 35 HB3 ALA 35 10.032 -9.244 4.023
297 H ASP 36 HN ASP 36 10.444 -7.449 6.975
298 HA ASP 36 HA ASP 36 8.102 -8.539 7.953
299 1HB ASP 36 HB2 ASP 36 9.730 -6.346 9.303
300 2HB ASP 36 HB1 ASP 36 8.454 -7.262 10.090
301 H ILE 37 HN ILE 37 8.835 -5.120 7.780
302 HA ILE 37 HA ILE 37 6.249 -4.241 8.575
303 HB ILE 37 HB ILE 37 8.268 -2.892 6.735
304 1HG1 ILE 37 HG12 ILE 37 9.263 -3.499 8.916
305 2HG1 ILE 37 HG11 ILE 37 9.129 -1.765 8.733
306 1HG2 ILE 37 HG21 ILE 37 5.983 -1.664 8.342
307 2HG2 ILE 37 HG23 ILE 37 7.212 -0.755 7.474
308 3HG2 ILE 37 HG22 ILE 37 6.083 -1.766 6.597
309 1HD1 ILE 37 HD2 ILE 37 7.070 -1.774 10.142
310 2HD1 ILE 37 HD1 ILE 37 7.204 -3.522 10.315
311 3HD1 ILE 37 HD3 ILE 37 8.437 -2.473 10.980
312 H CYS 38 HN CYS 38 7.567 -5.047 5.433
313 HA CYS 38 HA CYS 38 5.289 -4.127 3.952
314 1HB CYS 38 HB2 CYS 38 7.449 -4.498 2.880
315 2HB CYS 38 HB1 CYS 38 7.367 -6.200 3.254
316 HG CYS 38 HG1 CYS 38 5.873 -6.613 1.317
317 H GLU 39 HN GLU 39 5.978 -7.188 5.560
318 HA GLU 39 HA GLU 39 3.860 -8.579 4.170
319 1HB GLU 39 HB2 GLU 39 5.294 -9.160 6.800
320 2HB GLU 39 HB1 GLU 39 4.175 -10.263 6.007
321 1HG GLU 39 HG2 GLU 39 5.578 -10.311 4.004
322 2HG GLU 39 HG1 GLU 39 6.653 -9.094 4.674
323 H SER 40 HN SER 40 4.305 -6.924 7.214
324 HA SER 40 HA SER 40 1.648 -7.332 8.185
325 1HB SER 40 HB2 SER 40 3.499 -4.947 8.700
326 2HB SER 40 HB1 SER 40 2.269 -5.607 9.803
327 HG SER 40 HG1 SER 40 4.787 -6.540 9.245
328 H LEU 41 HN LEU 41 3.132 -5.145 5.947
329 HA LEU 41 HA LEU 41 0.864 -3.353 5.778
330 1HB LEU 41 HB2 LEU 41 3.333 -2.939 5.043
331 2HB LEU 41 HB1 LEU 41 2.905 -3.832 3.609
332 HG LEU 41 HG LEU 41 1.035 -2.240 3.130
333 1HD1 LEU 41 HD11 LEU 41 2.305 -0.629 5.383
334 2HD1 LEU 41 HD13 LEU 41 1.045 -0.048 4.308
335 3HD1 LEU 41 HD12 LEU 41 0.696 -1.331 5.444
336 1HD2 LEU 41 HD21 LEU 41 3.261 -1.988 2.057
337 2HD2 LEU 41 HD23 LEU 41 2.508 -0.429 2.331
338 3HD2 LEU 41 HD22 LEU 41 3.788 -0.984 3.401
339 H HIS 42 HN HIS 42 1.952 -6.237 4.371
340 HA HIS 42 HA HIS 42 0.247 -6.310 2.059
341 1HB HIS 42 HB2 HIS 42 2.236 -7.947 3.028
342 2HB HIS 42 HB1 HIS 42 0.807 -8.915 3.370
343 HD1 HIS 42 HD1 HIS 42 -0.770 -9.178 1.090
344 HD2 HIS 42 HD2 HIS 42 3.115 -8.052 0.478
345 HE1 HIS 42 HE1 HIS 42 -0.271 -9.613 -1.295
346 H ASP 43 HN ASP 43 -0.083 -7.674 5.310
347 HA ASP 43 HA ASP 43 -2.756 -8.654 4.860
348 1HB ASP 43 HB2 ASP 43 -1.669 -9.451 6.896
349 2HB ASP 43 HB1 ASP 43 -1.436 -7.789 7.462
350 H HIS 44 HN HIS 44 -1.389 -5.746 6.142
351 HA HIS 44 HA HIS 44 -3.787 -4.435 6.867
352 1HB HIS 44 HB2 HIS 44 -1.484 -3.613 7.442
353 2HB HIS 44 HB1 HIS 44 -1.259 -3.190 5.746
354 HD1 HIS 44 HD1 HIS 44 -3.542 -2.213 8.573
355 HD2 HIS 44 HD2 HIS 44 -2.201 -0.754 4.998
356 HE1 HIS 44 HE1 HIS 44 -4.378 0.093 8.407
357 H ALA 45 HN ALA 45 -2.216 -4.872 3.790
358 HA ALA 45 HA ALA 45 -3.861 -2.905 2.419
359 1HB ALA 45 HB2 ALA 45 -1.695 -3.754 1.418
360 2HB ALA 45 HB1 ALA 45 -2.434 -5.341 1.250
361 3HB ALA 45 HB3 ALA 45 -3.062 -3.980 0.335
362 H ASP 46 HN ASP 46 -3.947 -6.291 3.210
363 HA ASP 46 HA ASP 46 -6.366 -6.741 1.649
364 1HB ASP 46 HB2 ASP 46 -4.830 -8.673 2.336
365 2HB ASP 46 HB1 ASP 46 -5.303 -8.380 3.990
366 H GLU 47 HN GLU 47 -5.559 -5.423 4.743
367 HA GLU 47 HA GLU 47 -8.189 -5.926 5.860
368 1HB GLU 47 HB2 GLU 47 -6.264 -5.327 7.371
369 2HB GLU 47 HB1 GLU 47 -6.123 -3.772 6.563
370 1HG GLU 47 HG2 GLU 47 -7.369 -3.668 8.744
371 2HG GLU 47 HG1 GLU 47 -8.295 -3.059 7.378
372 H LEU 48 HN LEU 48 -6.548 -3.455 4.055
373 HA LEU 48 HA LEU 48 -8.730 -1.606 4.050
374 1HB LEU 48 HB2 LEU 48 -6.296 -1.152 3.300
375 2HB LEU 48 HB1 LEU 48 -6.684 -2.026 1.830
376 HG LEU 48 HG LEU 48 -8.470 -0.375 1.288
377 1HD1 LEU 48 HD11 LEU 48 -7.445 1.098 3.760
378 2HD1 LEU 48 HD13 LEU 48 -8.620 1.721 2.615
379 3HD1 LEU 48 HD12 LEU 48 -9.029 0.356 3.622
380 1HD2 LEU 48 HD21 LEU 48 -6.174 -0.033 0.428
381 2HD2 LEU 48 HD23 LEU 48 -6.955 1.505 0.749
382 3HD2 LEU 48 HD22 LEU 48 -5.761 0.876 1.874
383 OH TYR 49 OH TYR 49 -12.000 -8.608 -3.512
384 H TYR 49 HN TYR 49 -8.316 -4.654 2.720
385 HA TYR 49 HA TYR 49 -10.315 -4.198 0.577
386 1HB TYR 49 HB2 TYR 49 -8.188 -5.569 0.188
387 2HB TYR 49 HB1 TYR 49 -8.828 -6.727 1.342
388 HD1 TYR 49 HD2 TYR 49 -10.976 -7.944 0.845
389 HD2 TYR 49 HD1 TYR 49 -8.974 -5.588 -2.085
390 HE1 TYR 49 HE2 TYR 49 -12.214 -9.076 -0.918
391 HE2 TYR 49 HE1 TYR 49 -10.219 -6.729 -3.847
392 HH TYR 49 HH TYR 49 -12.599 -9.246 -3.114
393 NH1 ARG 50 NH1 ARG 50 -6.788 -8.721 5.787
394 NH2 ARG 50 NH2 ARG 50 -6.696 -7.851 7.918
395 H ARG 50 HN ARG 50 -9.785 -5.657 3.692
396 HA ARG 50 HA ARG 50 -12.263 -7.154 3.707
397 1HB ARG 50 HB2 ARG 50 -10.284 -6.448 5.865
398 2HB ARG 50 HB1 ARG 50 -11.721 -7.391 6.194
399 1HG ARG 50 HG2 ARG 50 -10.998 -9.099 4.569
400 2HG ARG 50 HG1 ARG 50 -9.580 -8.176 4.146
401 1HD ARG 50 HD2 ARG 50 -10.231 -9.425 6.863
402 2HD ARG 50 HD1 ARG 50 -8.903 -9.858 5.796
403 HE ARG 50 HE ARG 50 -9.083 -7.223 7.210
404 1HH1 ARG 50 HH12 ARG 50 -7.314 -8.972 4.973
405 2HH1 ARG 50 HH11 ARG 50 -5.796 -8.882 5.772
406 1HH2 ARG 50 HH22 ARG 50 -7.162 -7.436 8.704
407 2HH2 ARG 50 HH21 ARG 50 -5.700 -7.990 7.972
408 H SER 51 HN SER 51 -11.201 -4.459 5.819
409 HA SER 51 HA SER 51 -13.754 -4.025 6.900
410 1HB SER 51 HB2 SER 51 -12.777 -1.598 7.199
411 2HB SER 51 HB1 SER 51 -11.847 -2.930 7.916
412 HG SER 51 HG1 SER 51 -10.404 -2.760 6.417
413 H CYS 52 HN CYS 52 -12.279 -2.734 3.986
414 HA CYS 52 HA CYS 52 -14.466 -1.010 3.315
415 1HB CYS 52 HB2 CYS 52 -12.523 -2.488 1.520
416 2HB CYS 52 HB1 CYS 52 -13.658 -1.299 0.959
417 HG CYS 52 HG1 CYS 52 -12.227 0.558 1.802
418 H LEU 53 HN LEU 53 -13.730 -4.374 2.482
419 HA LEU 53 HA LEU 53 -16.068 -4.762 0.905
420 1HB LEU 53 HB2 LEU 53 -14.245 -6.429 0.879
421 2HB LEU 53 HB1 LEU 53 -14.479 -6.747 2.585
422 HG LEU 53 HG LEU 53 -16.708 -7.726 2.130
423 1HD1 LEU 53 HD11 LEU 53 -16.077 -7.181 -0.805
424 2HD1 LEU 53 HD13 LEU 53 -17.475 -8.048 -0.196
425 3HD1 LEU 53 HD12 LEU 53 -17.315 -6.335 0.114
426 1HD2 LEU 53 HD22 LEU 53 -14.525 -8.803 0.316
427 2HD2 LEU 53 HD21 LEU 53 -14.718 -9.171 2.023
428 3HD2 LEU 53 HD23 LEU 53 -15.929 -9.704 0.870
429 H ALA 54 HN ALA 54 -15.587 -4.571 4.330
430 HA ALA 54 HA ALA 54 -18.040 -5.964 4.983
431 1HB ALA 54 HB2 ALA 54 -16.292 -5.490 6.736
432 2HB ALA 54 HB1 ALA 54 -16.649 -3.771 6.590
433 3HB ALA 54 HB3 ALA 54 -17.875 -4.870 7.189
434 NH1 ARG 55 NH1 ARG 55 -19.088 3.547 3.517
435 NH2 ARG 55 NH2 ARG 55 -18.951 4.347 5.689
436 H ARG 55 HN ARG 55 -17.126 -2.615 4.354
437 HA ARG 55 HA ARG 55 -19.873 -1.722 4.798
438 1HB ARG 55 HB2 ARG 55 -17.565 -0.312 3.447
439 2HB ARG 55 HB1 ARG 55 -19.120 0.411 3.792
440 1HG ARG 55 HG2 ARG 55 -18.603 -0.350 6.289
441 2HG ARG 55 HG1 ARG 55 -16.951 -0.509 5.708
442 1HD ARG 55 HD2 ARG 55 -17.420 1.806 6.631
443 2HD ARG 55 HD1 ARG 55 -16.950 1.856 4.938
444 HE ARG 55 HE ARG 55 -19.837 1.637 5.417
445 1HH1 ARG 55 HH12 ARG 55 -19.124 2.780 2.875
446 2HH1 ARG 55 HH11 ARG 55 -19.111 4.474 3.123
447 1HH2 ARG 55 HH22 ARG 55 -18.861 4.175 6.672
448 2HH2 ARG 55 HH21 ARG 55 -18.987 5.305 5.387
449 H PHE 56 HN PHE 56 -18.099 -2.999 2.188
450 HA PHE 56 HA PHE 56 -19.964 -1.857 0.213
451 1HB PHE 56 HB2 PHE 56 -17.670 -3.814 -0.082
452 2HB PHE 56 HB1 PHE 56 -18.542 -3.107 -1.421
453 HD1 PHE 56 HD1 PHE 56 -18.589 -0.336 0.614
454 HD2 PHE 56 HD2 PHE 56 -15.742 -2.817 -1.346
455 HE1 PHE 56 HE1 PHE 56 -16.995 1.506 0.594
456 HE2 PHE 56 HE2 PHE 56 -14.141 -0.966 -1.367
457 HZ PHE 56 HZ PHE 56 -14.765 1.210 -0.396
458 H GLY 57 HN GLY 57 -19.484 -4.646 2.076
459 1HA GLY 57 HA2 GLY 57 -21.348 -6.261 0.431
460 2HA GLY 57 HA1 GLY 57 -20.436 -6.826 1.848
461 H ASP 58 HN ASP 58 -22.907 -4.498 0.891
462 HA ASP 58 HA ASP 58 -23.911 -3.943 3.495
463 1HB ASP 58 HB2 ASP 58 -25.962 -4.203 1.335
464 2HB ASP 58 HB1 ASP 58 -25.736 -2.925 2.504
465 H ASP 59 HN ASP 59 -25.247 -5.113 4.799
466 HA ASP 59 HA ASP 59 -25.728 -7.915 4.040
467 1HB ASP 59 HB2 ASP 59 -25.404 -7.444 6.451
468 2HB ASP 59 HB1 ASP 59 -26.718 -6.267 6.388
469 H GLY 60 HN GLY 60 -27.411 -4.929 4.571
470 1HA GLY 60 HA2 GLY 60 -29.231 -4.079 3.355
471 2HA GLY 60 HA1 GLY 60 -29.408 -5.644 2.561
472 H GLU 61 HN GLU 61 -29.739 -7.368 4.634
473 HA GLU 61 HA GLU 61 -32.443 -6.625 5.452
474 1HB GLU 61 HB2 GLU 61 -30.889 -9.128 6.178
475 2HB GLU 61 HB1 GLU 61 -32.636 -8.923 6.151
476 1HG GLU 61 HG2 GLU 61 -30.803 -8.830 3.708
477 2HG GLU 61 HG1 GLU 61 -31.963 -10.089 4.101
478 H ASN 62 HN ASN 62 -29.633 -5.699 6.674
479 HA ASN 62 HA ASN 62 -30.784 -5.183 9.288
480 1HB ASN 62 HB2 ASN 62 -29.944 -7.547 9.621
481 2HB ASN 62 HB1 ASN 62 -28.334 -6.998 9.163
482 1HD2 ASN 62 HD21 ASN 62 -27.901 -5.082 12.211
483 2HD2 ASN 62 HD22 ASN 62 -27.482 -5.066 10.568
484 H LEU 63 HN LEU 63 -28.000 -5.488 7.265
485 HA LEU 63 HA LEU 63 -27.082 -2.764 8.119
486 1HB LEU 63 HB2 LEU 63 -25.272 -4.980 7.003
487 2HB LEU 63 HB1 LEU 63 -24.779 -3.444 7.660
488 HG LEU 63 HG LEU 63 -26.152 -5.623 9.285
489 1HD1 LEU 63 HD12 LEU 63 -23.899 -6.302 8.518
490 2HD1 LEU 63 HD11 LEU 63 -23.219 -4.810 9.146
491 3HD1 LEU 63 HD13 LEU 63 -23.892 -6.005 10.248
492 1HD2 LEU 63 HD22 LEU 63 -24.730 -3.037 10.094
493 2HD2 LEU 63 HD21 LEU 63 -26.465 -3.281 10.159
494 3HD2 LEU 63 HD23 LEU 63 -25.413 -4.201 11.218
495 1H MET 1 HT1 MET 1 22.732 0.143 -2.013
496 2H MET 1 HT3 MET 1 22.652 -1.245 -1.061
497 3H MET 1 HT2 MET 1 23.445 0.141 -0.490
498 HA MET 1 HA MET 1 25.341 -0.523 -1.367
499 1HB MET 1 HB2 MET 1 23.868 -2.809 -2.750
500 2HB MET 1 HB1 MET 1 25.563 -2.741 -2.330
501 1HG MET 1 HG2 MET 1 23.245 -2.832 -0.376
502 2HG MET 1 HG1 MET 1 24.327 -4.135 -0.741
503 1HE MET 1 HE3 MET 1 26.214 -4.747 0.280
504 2HE MET 1 HE2 MET 1 27.295 -3.468 -0.321
505 3HE MET 1 HE1 MET 1 27.220 -3.862 1.397
506 H THR 2 HN THR 2 22.592 -0.405 -3.524
507 HA THR 2 HA THR 2 24.238 1.006 -5.477
508 HB THR 2 HB THR 2 23.383 -0.528 -7.350
509 HG1 THR 2 HG1 THR 2 22.128 -1.494 -5.074
510 1HG2 THR 2 HG22 THR 2 25.654 -1.098 -6.306
511 2HG2 THR 2 HG21 THR 2 24.821 -2.172 -5.191
512 3HG2 THR 2 HG23 THR 2 24.790 -2.499 -6.912
513 H LYS 3 HN LYS 3 22.529 1.358 -7.430
514 HA LYS 3 HA LYS 3 20.421 2.861 -6.152
515 1HB LYS 3 HB2 LYS 3 19.720 3.375 -8.540
516 2HB LYS 3 HB1 LYS 3 21.322 3.875 -8.072
517 1HG LYS 3 HG2 LYS 3 22.400 2.157 -9.261
518 2HG LYS 3 HG1 LYS 3 20.980 1.137 -9.308
519 1HD LYS 3 HD2 LYS 3 20.679 3.779 -10.647
520 2HD LYS 3 HD1 LYS 3 21.887 2.727 -11.354
521 1HE LYS 3 HE2 LYS 3 19.491 2.409 -12.259
522 2HE LYS 3 HE1 LYS 3 20.317 0.951 -11.740
523 1HZ LYS 3 HZ1 LYS 3 18.953 2.026 -9.533
524 2HZ LYS 3 HZ3 LYS 3 17.877 1.953 -10.837
525 3HZ LYS 3 HZ2 LYS 3 18.713 0.560 -10.350
526 H GLN 4 HN GLN 4 20.519 -0.377 -7.135
527 HA GLN 4 HA GLN 4 17.875 -0.600 -8.250
528 1HB GLN 4 HB2 GLN 4 19.591 -2.523 -6.621
529 2HB GLN 4 HB1 GLN 4 17.968 -2.955 -7.116
530 1HG GLN 4 HG2 GLN 4 19.792 -3.726 -8.706
531 2HG GLN 4 HG1 GLN 4 18.541 -2.748 -9.465
532 1HE2 GLN 4 HE21 GLN 4 22.286 -1.142 -8.930
533 2HE2 GLN 4 HE22 GLN 4 21.803 -2.442 -7.960
534 H GLU 5 HN GLU 5 19.176 -0.714 -5.077
535 HA GLU 5 HA GLU 5 16.832 -1.106 -3.563
536 1HB GLU 5 HB2 GLU 5 19.368 0.446 -2.988
537 2HB GLU 5 HB1 GLU 5 18.247 -0.153 -1.788
538 1HG GLU 5 HG2 GLU 5 18.728 -2.395 -2.242
539 2HG GLU 5 HG1 GLU 5 19.429 -2.080 -3.825
540 H LYS 6 HN LYS 6 18.439 1.817 -4.620
541 HA LYS 6 HA LYS 6 16.591 3.631 -3.457
542 1HB LYS 6 HB2 LYS 6 18.149 3.995 -6.051
543 2HB LYS 6 HB1 LYS 6 17.460 5.272 -5.068
544 1HG LYS 6 HG2 LYS 6 18.920 4.685 -3.171
545 2HG LYS 6 HG1 LYS 6 19.553 3.304 -4.038
546 1HD LYS 6 HD2 LYS 6 20.511 4.882 -5.779
547 2HD LYS 6 HD1 LYS 6 19.836 6.220 -4.878
548 1HE LYS 6 HE2 LYS 6 22.278 5.765 -4.387
549 2HE LYS 6 HE1 LYS 6 21.232 5.809 -2.983
550 1HZ LYS 6 HZ1 LYS 6 21.351 3.135 -3.906
551 2HZ LYS 6 HZ3 LYS 6 22.906 3.757 -3.833
552 3HZ LYS 6 HZ2 LYS 6 21.931 3.803 -2.465
553 H THR 7 HN THR 7 16.539 1.843 -6.482
554 HA THR 7 HA THR 7 14.333 3.248 -7.622
555 HB THR 7 HB THR 7 14.987 0.261 -8.081
556 HG1 THR 7 HG1 THR 7 16.867 1.135 -8.314
557 1HG2 THR 7 HG22 THR 7 13.052 1.414 -9.376
558 2HG2 THR 7 HG21 THR 7 14.231 2.566 -9.975
559 3HG2 THR 7 HG23 THR 7 14.359 0.869 -10.410
560 H ALA 8 HN ALA 8 14.609 0.397 -5.547
561 HA ALA 8 HA ALA 8 11.823 -0.190 -5.447
562 1HB ALA 8 HB2 ALA 8 13.559 -1.755 -4.547
563 2HB ALA 8 HB1 ALA 8 13.898 -0.611 -3.257
564 3HB ALA 8 HB3 ALA 8 12.330 -1.393 -3.342
565 H LEU 9 HN LEU 9 13.841 2.067 -3.762
566 HA LEU 9 HA LEU 9 12.033 2.783 -1.682
567 1HB LEU 9 HB2 LEU 9 14.542 3.616 -2.302
568 2HB LEU 9 HB1 LEU 9 13.647 4.919 -3.065
569 HG LEU 9 HG LEU 9 12.380 5.120 -0.819
570 1HD1 LEU 9 HD11 LEU 9 14.824 3.555 0.082
571 2HD1 LEU 9 HD13 LEU 9 13.668 4.325 1.147
572 3HD1 LEU 9 HD12 LEU 9 13.165 2.981 0.139
573 1HD2 LEU 9 HD22 LEU 9 15.332 5.832 -0.980
574 2HD2 LEU 9 HD21 LEU 9 14.013 6.796 -1.625
575 3HD2 LEU 9 HD23 LEU 9 14.171 6.576 0.110
576 H ASN 10 HN ASN 10 12.490 3.915 -4.962
577 HA ASN 10 HA ASN 10 10.383 5.859 -4.876
578 1HB ASN 10 HB2 ASN 10 11.572 4.401 -7.261
579 2HB ASN 10 HB1 ASN 10 10.382 5.688 -7.377
580 1HD2 ASN 10 HD21 ASN 10 14.235 6.613 -6.409
581 2HD2 ASN 10 HD22 ASN 10 13.744 4.992 -6.477
582 H MET 11 HN MET 11 10.452 2.422 -5.524
583 HA MET 11 HA MET 11 7.851 2.306 -6.734
584 1HB MET 11 HB2 MET 11 9.240 0.205 -5.013
585 2HB MET 11 HB1 MET 11 7.823 -0.075 -6.002
586 1HG MET 11 HG2 MET 11 10.530 0.822 -7.016
587 2HG MET 11 HG1 MET 11 9.883 -0.783 -7.150
588 1HE MET 11 HE3 MET 11 10.738 2.257 -8.778
589 2HE MET 11 HE2 MET 11 9.554 2.599 -10.015
590 3HE MET 11 HE1 MET 11 9.193 3.029 -8.351
591 H ALA 12 HN ALA 12 8.976 2.149 -3.402
592 HA ALA 12 HA ALA 12 6.412 1.633 -2.254
593 1HB ALA 12 HB2 ALA 12 8.530 1.579 -0.898
594 2HB ALA 12 HB1 ALA 12 8.664 3.321 -1.065
595 3HB ALA 12 HB3 ALA 12 7.331 2.622 -0.160
596 NH1 ARG 13 NH1 ARG 13 6.399 9.890 0.294
597 NH2 ARG 13 NH2 ARG 13 8.376 8.792 0.773
598 H ARG 13 HN ARG 13 8.134 4.586 -3.029
599 HA ARG 13 HA ARG 13 6.088 6.356 -2.122
600 1HB ARG 13 HB2 ARG 13 8.413 7.092 -2.624
601 2HB ARG 13 HB1 ARG 13 8.173 6.745 -4.322
602 1HG ARG 13 HG2 ARG 13 7.927 9.113 -4.049
603 2HG ARG 13 HG1 ARG 13 6.331 8.475 -4.354
604 1HD ARG 13 HD2 ARG 13 6.220 10.084 -2.512
605 2HD ARG 13 HD1 ARG 13 5.881 8.487 -1.861
606 HE ARG 13 HE ARG 13 8.704 9.322 -1.724
607 1HH1 ARG 13 HH12 ARG 13 5.764 10.295 -0.370
608 2HH1 ARG 13 HH11 ARG 13 6.153 9.938 1.270
609 1HH2 ARG 13 HH22 ARG 13 9.232 8.369 0.468
610 2HH2 ARG 13 HH21 ARG 13 8.194 8.802 1.766
611 H PHE 14 HN PHE 14 6.480 4.543 -5.084
612 HA PHE 14 HA PHE 14 4.619 6.030 -6.657
613 1HB PHE 14 HB2 PHE 14 6.084 4.172 -7.600
614 2HB PHE 14 HB1 PHE 14 5.037 3.013 -6.781
615 HD1 PHE 14 HD1 PHE 14 5.156 5.586 -9.411
616 HD2 PHE 14 HD2 PHE 14 2.789 2.572 -7.545
617 HE1 PHE 14 HE1 PHE 14 3.539 5.714 -11.249
618 HE2 PHE 14 HE2 PHE 14 1.176 2.703 -9.384
619 HZ PHE 14 HZ PHE 14 1.546 4.272 -11.241
620 H ILE 15 HN ILE 15 4.258 3.092 -4.836
621 HA ILE 15 HA ILE 15 1.478 2.760 -5.107
622 HB ILE 15 HB ILE 15 3.190 2.052 -2.676
623 1HG1 ILE 15 HG12 ILE 15 2.595 0.360 -5.134
624 2HG1 ILE 15 HG11 ILE 15 4.068 1.291 -5.034
625 1HG2 ILE 15 HG22 ILE 15 0.716 1.743 -2.384
626 2HG2 ILE 15 HG21 ILE 15 0.674 0.780 -3.848
627 3HG2 ILE 15 HG23 ILE 15 1.529 0.195 -2.431
628 1HD1 ILE 15 HD1 ILE 15 3.224 -0.883 -3.087
629 2HD1 ILE 15 HD3 ILE 15 4.483 -0.987 -4.305
630 3HD1 ILE 15 HD2 ILE 15 4.665 0.121 -2.959
631 NH1 ARG 16 NH2 ARG 16 5.086 4.406 0.311
632 NH2 ARG 16 NH1 ARG 16 6.466 6.252 0.506
633 H ARG 16 HN ARG 16 3.393 4.782 -3.048
634 HA ARG 16 HA ARG 16 1.308 5.481 -1.222
635 1HB ARG 16 HB2 ARG 16 3.826 5.835 -1.112
636 2HB ARG 16 HB1 ARG 16 3.565 7.264 -2.080
637 1HG ARG 16 HG2 ARG 16 2.362 8.406 -0.514
638 2HG ARG 16 HG1 ARG 16 1.895 6.968 0.378
639 1HD ARG 16 HD2 ARG 16 4.745 8.050 0.182
640 2HD ARG 16 HD1 ARG 16 3.697 8.271 1.576
641 HE ARG 16 HE ARG 16 3.866 5.944 2.059
642 1HH1 ARG 16 HH22 ARG 16 4.189 3.985 0.459
643 2HH1 ARG 16 HH21 ARG 16 5.793 3.849 -0.129
644 1HH2 ARG 16 HH12 ARG 16 6.583 7.196 0.825
645 2HH2 ARG 16 HH11 ARG 16 7.244 5.801 0.062
646 H SER 17 HN SER 17 2.526 7.032 -4.142
647 HA SER 17 HA SER 17 0.850 9.276 -4.134
648 1HB SER 17 HB2 SER 17 1.761 7.712 -6.585
649 2HB SER 17 HB1 SER 17 1.484 9.464 -6.454
650 HG SER 17 HG1 SER 17 3.607 7.980 -5.620
651 H GLN 18 HN GLN 18 0.210 6.059 -5.581
652 HA GLN 18 HA GLN 18 -2.374 6.940 -6.503
653 1HB GLN 18 HB2 GLN 18 -2.926 4.463 -6.610
654 2HB GLN 18 HB1 GLN 18 -1.482 4.901 -7.497
655 1HG GLN 18 HG2 GLN 18 -0.102 4.153 -5.596
656 2HG GLN 18 HG1 GLN 18 -1.561 3.639 -4.736
657 1HE2 GLN 18 HE21 GLN 18 -2.073 0.792 -6.758
658 2HE2 GLN 18 HE22 GLN 18 -2.774 1.823 -5.610
659 H THR 19 HN THR 19 -1.323 5.264 -3.538
660 HA THR 19 HA THR 19 -3.865 4.864 -2.434
661 HB THR 19 HB THR 19 -1.219 5.534 -1.020
662 HG1 THR 19 HG1 THR 19 -0.820 3.646 -1.876
663 1HG2 THR 19 HG22 THR 19 -3.326 5.520 0.506
664 2HG2 THR 19 HG21 THR 19 -3.648 3.896 -0.080
665 3HG2 THR 19 HG23 THR 19 -2.198 4.226 0.855
666 H LEU 20 HN LEU 20 -1.918 7.757 -2.627
667 HA LEU 20 HA LEU 20 -3.394 9.348 -0.777
668 1HB LEU 20 HB2 LEU 20 -1.140 9.833 -2.039
669 2HB LEU 20 HB1 LEU 20 -2.150 10.376 -3.359
670 HG LEU 20 HG LEU 20 -2.237 11.560 -0.561
671 1HD1 LEU 20 HD11 LEU 20 -0.954 12.585 -3.132
672 2HD1 LEU 20 HD13 LEU 20 -1.046 13.479 -1.622
673 3HD1 LEU 20 HD12 LEU 20 -0.088 12.010 -1.715
674 1HD2 LEU 20 HD22 LEU 20 -3.495 12.507 -3.177
675 2HD2 LEU 20 HD21 LEU 20 -4.376 11.893 -1.786
676 3HD2 LEU 20 HD23 LEU 20 -3.502 13.396 -1.663
677 H THR 21 HN THR 21 -3.576 9.092 -4.303
678 HA THR 21 HA THR 21 -5.959 10.614 -4.554
679 HB THR 21 HB THR 21 -5.078 8.382 -6.440
680 HG1 THR 21 HG1 THR 21 -3.204 9.377 -6.205
681 1HG2 THR 21 HG21 THR 21 -5.943 11.313 -6.847
682 2HG2 THR 21 HG23 THR 21 -5.693 10.129 -8.124
683 3HG2 THR 21 HG22 THR 21 -7.056 9.969 -7.028
684 H LEU 22 HN LEU 22 -5.417 7.319 -3.688
685 HA LEU 22 HA LEU 22 -8.184 6.554 -4.221
686 1HB LEU 22 HB2 LEU 22 -5.906 5.146 -2.812
687 2HB LEU 22 HB1 LEU 22 -7.457 4.405 -3.145
688 HG LEU 22 HG LEU 22 -5.794 5.680 -5.377
689 1HD1 LEU 22 HD11 LEU 22 -5.810 2.761 -4.535
690 2HD1 LEU 22 HD13 LEU 22 -5.018 3.401 -5.961
691 3HD1 LEU 22 HD12 LEU 22 -4.446 3.846 -4.365
692 1HD2 LEU 22 HD22 LEU 22 -8.061 3.682 -5.389
693 2HD2 LEU 22 HD21 LEU 22 -8.156 5.355 -5.894
694 3HD2 LEU 22 HD23 LEU 22 -7.184 4.231 -6.811
695 H LEU 23 HN LEU 23 -6.388 7.952 -1.693
696 HA LEU 23 HA LEU 23 -7.848 7.093 0.558
697 1HB LEU 23 HB2 LEU 23 -5.819 8.625 0.638
698 2HB LEU 23 HB1 LEU 23 -6.786 9.903 -0.056
699 HG LEU 23 HG LEU 23 -6.383 9.971 2.485
700 1HD1 LEU 23 HD12 LEU 23 -8.105 11.398 1.377
701 2HD1 LEU 23 HD11 LEU 23 -9.297 10.120 1.562
702 3HD1 LEU 23 HD13 LEU 23 -8.600 10.871 2.975
703 1HD2 LEU 23 HD21 LEU 23 -6.888 7.592 2.869
704 2HD2 LEU 23 HD23 LEU 23 -7.914 8.635 3.832
705 3HD2 LEU 23 HD22 LEU 23 -8.557 7.845 2.400
706 H GLU 24 HN GLU 24 -8.256 9.647 -1.740
707 HA GLU 24 HA GLU 24 -10.721 10.659 -0.803
708 1HB GLU 24 HB2 GLU 24 -9.257 11.694 -2.644
709 2HB GLU 24 HB1 GLU 24 -9.790 10.412 -3.707
710 1HG GLU 24 HG2 GLU 24 -12.193 11.262 -3.311
711 2HG GLU 24 HG1 GLU 24 -11.460 12.600 -2.443
712 H LYS 25 HN LYS 25 -10.016 7.993 -3.025
713 HA LYS 25 HA LYS 25 -12.779 7.505 -3.622
714 1HB LYS 25 HB2 LYS 25 -10.485 5.522 -3.527
715 2HB LYS 25 HB1 LYS 25 -12.015 5.304 -4.354
716 1HG LYS 25 HG2 LYS 25 -10.137 7.654 -4.953
717 2HG LYS 25 HG1 LYS 25 -10.128 6.156 -5.853
718 1HD LYS 25 HD2 LYS 25 -11.801 6.850 -7.138
719 2HD LYS 25 HD1 LYS 25 -12.852 7.069 -5.763
720 1HE LYS 25 HE2 LYS 25 -10.743 9.142 -6.558
721 2HE LYS 25 HE1 LYS 25 -12.369 9.172 -7.210
722 1HZ LYS 25 HZ1 LYS 25 -12.594 8.984 -4.435
723 2HZ LYS 25 HZ3 LYS 25 -11.468 10.206 -4.799
724 3HZ LYS 25 HZ2 LYS 25 -13.014 10.232 -5.469
725 H LEU 26 HN LEU 26 -10.822 6.580 -0.821
726 HA LEU 26 HA LEU 26 -12.869 4.705 0.043
727 1HB LEU 26 HB2 LEU 26 -10.692 6.185 1.581
728 2HB LEU 26 HB1 LEU 26 -11.885 5.217 2.403
729 HG LEU 26 HG LEU 26 -9.859 3.908 2.120
730 1HD1 LEU 26 HD12 LEU 26 -11.980 2.678 1.963
731 2HD1 LEU 26 HD11 LEU 26 -12.007 2.883 0.219
732 3HD1 LEU 26 HD13 LEU 26 -10.741 1.934 0.966
733 1HD2 LEU 26 HD22 LEU 26 -10.133 4.362 -0.869
734 2HD2 LEU 26 HD21 LEU 26 -8.885 5.025 0.182
735 3HD2 LEU 26 HD23 LEU 26 -8.976 3.297 -0.094
736 H ASN 27 HN ASN 27 -12.109 8.081 0.670
737 HA ASN 27 HA ASN 27 -14.421 8.374 2.415
738 1HB ASN 27 HB2 ASN 27 -13.759 10.653 2.653
739 2HB ASN 27 HB1 ASN 27 -12.253 9.796 2.403
740 1HD2 ASN 27 HD21 ASN 27 -11.430 12.324 0.177
741 2HD2 ASN 27 HD22 ASN 27 -11.130 11.598 1.682
742 H GLU 28 HN GLU 28 -13.987 8.174 -0.885
743 HA GLU 28 HA GLU 28 -16.088 9.971 -1.744
744 1HB GLU 28 HB2 GLU 28 -14.245 9.085 -3.281
745 2HB GLU 28 HB1 GLU 28 -14.959 7.484 -3.144
746 1HG GLU 28 HG2 GLU 28 -17.021 8.326 -4.206
747 2HG GLU 28 HG1 GLU 28 -16.252 9.908 -4.390
748 H LEU 29 HN LEU 29 -15.628 6.576 -1.138
749 HA LEU 29 HA LEU 29 -18.540 6.070 -1.256
750 1HB LEU 29 HB2 LEU 29 -16.307 4.147 -0.504
751 2HB LEU 29 HB1 LEU 29 -17.922 3.725 -1.046
752 HG LEU 29 HG LEU 29 -15.791 5.153 -2.729
753 1HD1 LEU 29 HD12 LEU 29 -15.365 2.741 -2.420
754 2HD1 LEU 29 HD11 LEU 29 -16.987 2.375 -2.988
755 3HD1 LEU 29 HD13 LEU 29 -15.813 3.096 -4.080
756 1HD2 LEU 29 HD22 LEU 29 -18.608 4.290 -3.504
757 2HD2 LEU 29 HD21 LEU 29 -18.070 5.952 -3.312
758 3HD2 LEU 29 HD23 LEU 29 -17.398 4.975 -4.584
759 H ASP 30 HN ASP 30 -17.656 7.857 0.547
760 HA ASP 30 HA ASP 30 -17.464 8.504 2.740
761 1HB ASP 30 HB2 ASP 30 -19.533 8.265 3.915
762 2HB ASP 30 HB1 ASP 30 -19.938 8.330 2.208
763 H ALA 31 HN ALA 31 -16.195 5.829 2.242
764 HA ALA 31 HA ALA 31 -16.504 4.578 4.916
765 1HB ALA 31 HB1 ALA 31 -14.662 3.826 2.592
766 2HB ALA 31 HB3 ALA 31 -14.931 2.875 4.046
767 3HB ALA 31 HB2 ALA 31 -16.235 3.088 2.885
768 H ASP 32 HN ASP 32 -15.850 6.845 5.488
769 HA ASP 32 HA ASP 32 -13.165 7.714 5.048
770 1HB ASP 32 HB2 ASP 32 -14.996 9.235 5.894
771 2HB ASP 32 HB1 ASP 32 -14.882 8.393 7.447
772 H GLU 33 HN GLU 33 -14.667 5.546 7.283
773 HA GLU 33 HA GLU 33 -12.513 5.557 9.190
774 1HB GLU 33 HB2 GLU 33 -13.793 2.904 8.665
775 2HB GLU 33 HB1 GLU 33 -13.545 3.735 10.170
776 1HG GLU 33 HG2 GLU 33 -15.865 3.807 10.007
777 2HG GLU 33 HG1 GLU 33 -15.423 5.372 9.344
778 H GLN 34 HN GLN 34 -13.267 3.524 6.344
779 HA GLN 34 HA GLN 34 -10.679 2.235 6.504
780 1HB GLN 34 HB2 GLN 34 -12.658 2.480 4.220
781 2HB GLN 34 HB1 GLN 34 -11.086 1.741 3.981
782 1HG GLN 34 HG2 GLN 34 -12.454 -0.114 4.492
783 2HG GLN 34 HG1 GLN 34 -11.743 0.264 6.049
784 1HE2 GLN 34 HE21 GLN 34 -14.793 1.412 7.458
785 2HE2 GLN 34 HE22 GLN 34 -13.105 1.387 7.632
786 H ALA 35 HN ALA 35 -11.680 5.327 5.501
787 HA ALA 35 HA ALA 35 -9.585 5.734 3.539
788 1HB ALA 35 HB2 ALA 35 -11.544 7.335 3.773
789 2HB ALA 35 HB1 ALA 35 -10.904 7.841 5.334
790 3HB ALA 35 HB3 ALA 35 -10.011 8.168 3.883
791 H ASP 36 HN ASP 36 -9.961 6.349 7.013
792 HA ASP 36 HA ASP 36 -7.338 7.385 7.418
793 1HB ASP 36 HB2 ASP 36 -8.853 7.444 9.320
794 2HB ASP 36 HB1 ASP 36 -9.025 5.683 9.284
795 H ILE 37 HN ILE 37 -8.605 4.142 7.583
796 HA ILE 37 HA ILE 37 -6.183 2.819 8.193
797 HB ILE 37 HB ILE 37 -8.505 1.824 6.465
798 1HG1 ILE 37 HG12 ILE 37 -7.927 1.674 9.466
799 2HG1 ILE 37 HG11 ILE 37 -9.174 2.653 8.746
800 1HG2 ILE 37 HG22 ILE 37 -6.447 0.391 6.309
801 2HG2 ILE 37 HG21 ILE 37 -6.452 0.247 8.060
802 3HG2 ILE 37 HG23 ILE 37 -7.752 -0.450 7.108
803 1HD1 ILE 37 HD2 ILE 37 -10.297 0.580 7.898
804 2HD1 ILE 37 HD1 ILE 37 -9.073 -0.394 8.702
805 3HD1 ILE 37 HD3 ILE 37 -10.154 0.605 9.647
806 H CYS 38 HN CYS 38 -7.485 4.058 5.192
807 HA CYS 38 HA CYS 38 -5.548 2.761 3.494
808 1HB CYS 38 HB2 CYS 38 -7.672 3.951 2.677
809 2HB CYS 38 HB1 CYS 38 -6.858 5.453 3.025
810 HG CYS 38 HG1 CYS 38 -5.507 5.304 0.979
811 H GLU 39 HN GLU 39 -5.675 5.813 5.299
812 HA GLU 39 HA GLU 39 -3.090 6.597 4.268
813 1HB GLU 39 HB2 GLU 39 -4.584 7.582 6.739
814 2HB GLU 39 HB1 GLU 39 -3.175 8.355 6.020
815 1HG GLU 39 HG2 GLU 39 -5.821 7.908 4.617
816 2HG GLU 39 HG1 GLU 39 -5.211 9.459 5.184
817 H SER 40 HN SER 40 -4.172 4.471 6.738
818 HA SER 40 HA SER 40 -1.719 4.690 8.277
819 1HB SER 40 HB2 SER 40 -3.432 2.177 7.917
820 2HB SER 40 HB1 SER 40 -2.460 2.605 9.329
821 HG SER 40 HG1 SER 40 -4.178 4.620 8.720
822 H LEU 41 HN LEU 41 -2.976 2.982 5.514
823 HA LEU 41 HA LEU 41 -0.641 1.368 5.069
824 1HB LEU 41 HB2 LEU 41 -3.077 1.178 4.027
825 2HB LEU 41 HB1 LEU 41 -2.523 2.391 2.902
826 HG LEU 41 HG LEU 41 -0.933 -0.163 3.171
827 1HD1 LEU 41 HD11 LEU 41 -3.348 0.369 1.379
828 2HD1 LEU 41 HD13 LEU 41 -2.321 -1.054 1.308
829 3HD1 LEU 41 HD12 LEU 41 -3.316 -0.758 2.723
830 1HD2 LEU 41 HD22 LEU 41 -1.419 1.789 0.860
831 2HD2 LEU 41 HD21 LEU 41 0.038 1.761 1.832
832 3HD2 LEU 41 HD23 LEU 41 -0.357 0.395 0.820
833 H HIS 42 HN HIS 42 -1.725 4.521 4.050
834 HA HIS 42 HA HIS 42 0.242 5.142 2.149
835 1HB HIS 42 HB2 HIS 42 -1.767 6.543 2.757
836 2HB HIS 42 HB1 HIS 42 -0.923 7.062 4.211
837 HD1 HIS 42 HD1 HIS 42 -1.611 8.335 1.120
838 HD2 HIS 42 HD2 HIS 42 1.888 8.141 3.236
839 HE1 HIS 42 HE1 HIS 42 -0.128 10.057 0.173
840 H ASP 43 HN ASP 43 0.284 5.999 5.580
841 HA ASP 43 HA ASP 43 3.006 6.867 5.568
842 1HB ASP 43 HB2 ASP 43 1.593 7.602 7.389
843 2HB ASP 43 HB1 ASP 43 1.318 5.930 7.899
844 H HIS 44 HN HIS 44 1.590 3.779 6.590
845 HA HIS 44 HA HIS 44 4.128 2.779 7.506
846 1HB HIS 44 HB2 HIS 44 1.704 1.220 6.530
847 2HB HIS 44 HB1 HIS 44 3.021 0.581 7.519
848 HD1 HIS 44 HD1 HIS 44 2.655 3.791 8.845
849 HD2 HIS 44 HD2 HIS 44 0.293 0.447 9.112
850 HE1 HIS 44 HE1 HIS 44 1.237 4.099 10.809
851 H ALA 45 HN ALA 45 2.639 3.108 4.418
852 HA ALA 45 HA ALA 45 4.455 1.171 3.155
853 1HB ALA 45 HB1 ALA 45 2.846 3.436 1.870
854 2HB ALA 45 HB3 ALA 45 3.640 2.119 1.007
855 3HB ALA 45 HB2 ALA 45 2.265 1.786 2.041
856 H ASP 46 HN ASP 46 4.301 4.432 4.181
857 HA ASP 46 HA ASP 46 6.656 5.236 2.616
858 1HB ASP 46 HB2 ASP 46 4.734 6.815 3.567
859 2HB ASP 46 HB1 ASP 46 5.617 6.685 5.059
860 H GLU 47 HN GLU 47 5.954 3.583 5.569
861 HA GLU 47 HA GLU 47 8.497 4.227 6.750
862 1HB GLU 47 HB2 GLU 47 6.713 1.747 7.018
863 2HB GLU 47 HB1 GLU 47 8.253 1.843 7.826
864 1HG GLU 47 HG2 GLU 47 6.169 4.007 8.183
865 2HG GLU 47 HG1 GLU 47 6.184 2.561 9.190
866 H LEU 48 HN LEU 48 7.335 2.230 4.228
867 HA LEU 48 HA LEU 48 9.875 0.790 3.930
868 1HB LEU 48 HB2 LEU 48 7.583 0.996 1.925
869 2HB LEU 48 HB1 LEU 48 8.861 -0.194 1.932
870 HG LEU 48 HG LEU 48 6.792 0.084 4.158
871 1HD1 LEU 48 HD12 LEU 48 5.801 -0.743 2.034
872 2HD1 LEU 48 HD11 LEU 48 7.040 -1.989 1.942
873 3HD1 LEU 48 HD13 LEU 48 5.861 -2.013 3.244
874 1HD2 LEU 48 HD22 LEU 48 8.916 -2.037 3.616
875 2HD2 LEU 48 HD21 LEU 48 8.959 -0.876 4.933
876 3HD2 LEU 48 HD23 LEU 48 7.710 -2.102 4.883
877 OH TYR 49 OH TYR 49 12.084 9.137 -1.859
878 H TYR 49 HN TYR 49 10.017 3.567 4.029
879 HA TYR 49 HA TYR 49 11.350 4.134 1.481
880 1HB TYR 49 HB2 TYR 49 8.901 5.099 1.455
881 2HB TYR 49 HB1 TYR 49 9.458 6.160 2.748
882 HD1 TYR 49 HD2 TYR 49 11.387 7.701 2.371
883 HD2 TYR 49 HD1 TYR 49 9.542 5.559 -0.816
884 HE1 TYR 49 HE2 TYR 49 12.385 9.236 0.763
885 HE2 TYR 49 HE1 TYR 49 10.546 7.096 -2.431
886 HH TYR 49 HH TYR 49 13.032 9.191 -1.706
887 NH1 ARG 50 NH1 ARG 50 6.727 7.209 6.887
888 NH2 ARG 50 NH2 ARG 50 6.471 6.373 9.020
889 H ARG 50 HN ARG 50 10.263 5.018 4.707
890 HA ARG 50 HA ARG 50 12.629 6.608 5.277
891 1HB ARG 50 HB2 ARG 50 10.576 5.334 7.169
892 2HB ARG 50 HB1 ARG 50 11.797 6.498 7.649
893 1HG ARG 50 HG2 ARG 50 10.815 8.165 6.094
894 2HG ARG 50 HG1 ARG 50 9.592 7.006 5.609
895 1HD ARG 50 HD2 ARG 50 9.996 8.031 8.464
896 2HD ARG 50 HD1 ARG 50 8.719 8.556 7.377
897 HE ARG 50 HE ARG 50 8.940 5.755 8.415
898 1HH1 ARG 50 HH12 ARG 50 7.313 7.461 6.109
899 2HH1 ARG 50 HH11 ARG 50 5.736 7.338 6.794
900 1HH2 ARG 50 HH22 ARG 50 6.876 6.000 9.860
901 2HH2 ARG 50 HH21 ARG 50 5.471 6.467 8.991
902 H SER 51 HN SER 51 11.396 3.672 6.813
903 HA SER 51 HA SER 51 13.896 2.857 7.805
904 1HB SER 51 HB2 SER 51 11.493 1.116 7.016
905 2HB SER 51 HB1 SER 51 12.697 0.761 8.274
906 HG SER 51 HG1 SER 51 10.563 2.372 8.466
907 H CYS 52 HN CYS 52 12.304 2.232 4.684
908 HA CYS 52 HA CYS 52 14.306 0.356 3.838
909 1HB CYS 52 HB2 CYS 52 12.585 2.244 2.228
910 2HB CYS 52 HB1 CYS 52 13.686 1.110 1.499
911 HG CYS 52 HG1 CYS 52 12.113 -0.770 1.929
912 H LEU 53 HN LEU 53 14.205 3.895 3.738
913 HA LEU 53 HA LEU 53 16.623 4.040 2.139
914 1HB LEU 53 HB2 LEU 53 15.018 5.973 2.342
915 2HB LEU 53 HB1 LEU 53 15.409 6.090 4.049
916 HG LEU 53 HG LEU 53 17.787 6.627 3.435
917 1HD1 LEU 53 HD11 LEU 53 16.700 6.635 0.587
918 2HD1 LEU 53 HD13 LEU 53 18.307 7.147 1.070
919 3HD1 LEU 53 HD12 LEU 53 17.852 5.466 1.214
920 1HD2 LEU 53 HD21 LEU 53 16.144 8.438 3.802
921 2HD2 LEU 53 HD23 LEU 53 17.316 8.891 2.578
922 3HD2 LEU 53 HD22 LEU 53 15.700 8.389 2.103
923 H ALA 54 HN ALA 54 15.894 3.503 5.459
924 HA ALA 54 HA ALA 54 18.370 4.387 6.559
925 1HB ALA 54 HB2 ALA 54 16.484 3.536 8.003
926 2HB ALA 54 HB1 ALA 54 16.814 1.906 7.418
927 3HB ALA 54 HB3 ALA 54 18.016 2.750 8.366
928 NH1 ARG 55 NH2 ARG 55 18.813 -5.867 4.944
929 NH2 ARG 55 NH1 ARG 55 17.809 -5.177 6.900
930 H ARG 55 HN ARG 55 17.481 1.523 4.765
931 HA ARG 55 HA ARG 55 20.269 0.511 5.101
932 1HB ARG 55 HB2 ARG 55 18.166 -1.012 5.399
933 2HB ARG 55 HB1 ARG 55 18.038 -0.934 3.645
934 1HG ARG 55 HG2 ARG 55 20.445 -1.688 3.492
935 2HG ARG 55 HG1 ARG 55 20.441 -1.918 5.230
936 1HD ARG 55 HD2 ARG 55 18.639 -3.327 3.222
937 2HD ARG 55 HD1 ARG 55 20.009 -4.038 4.061
938 HE ARG 55 HE ARG 55 17.725 -3.002 5.680
939 1HH1 ARG 55 HH22 ARG 55 19.199 -5.675 4.037
940 2HH1 ARG 55 HH21 ARG 55 18.832 -6.831 5.229
941 1HH2 ARG 55 HH12 ARG 55 17.426 -4.445 7.468
942 2HH2 ARG 55 HH11 ARG 55 17.790 -6.113 7.266
943 H PHE 56 HN PHE 56 18.017 1.796 2.821
944 HA PHE 56 HA PHE 56 19.798 1.268 0.520
945 1HB PHE 56 HB2 PHE 56 17.137 2.737 0.604
946 2HB PHE 56 HB1 PHE 56 18.028 2.296 -0.832
947 HD1 PHE 56 HD2 PHE 56 18.654 -0.555 0.956
948 HD2 PHE 56 HD1 PHE 56 15.323 1.530 -0.719
949 HE1 PHE 56 HE2 PHE 56 17.424 -2.645 0.789
950 HE2 PHE 56 HE1 PHE 56 14.094 -0.579 -0.880
951 HZ PHE 56 HZ PHE 56 15.137 -2.677 -0.133
952 H GLY 57 HN GLY 57 20.088 3.280 2.874
953 1HA GLY 57 HA2 GLY 57 20.256 5.824 1.431
954 2HA GLY 57 HA1 GLY 57 20.716 5.543 3.115
955 H ASP 58 HN ASP 58 21.743 3.737 0.288
956 HA ASP 58 HA ASP 58 24.578 4.436 0.885
957 1HB ASP 58 HB2 ASP 58 25.166 2.431 -0.380
958 2HB ASP 58 HB1 ASP 58 23.835 1.933 0.676
959 H ASP 59 HN ASP 59 25.705 4.094 -1.432
960 HA ASP 59 HA ASP 59 24.234 5.155 -3.690
961 1HB ASP 59 HB2 ASP 59 24.854 7.362 -2.651
962 2HB ASP 59 HB1 ASP 59 26.533 6.795 -2.531
963 H GLY 60 HN GLY 60 25.346 4.627 -5.506
964 1HA GLY 60 HA2 GLY 60 28.159 3.902 -5.400
965 2HA GLY 60 HA1 GLY 60 27.070 2.502 -5.571
966 H GLU 61 HN GLU 61 25.977 5.554 -6.651
967 HA GLU 61 HA GLU 61 26.717 4.938 -9.444
968 1HB GLU 61 HB2 GLU 61 24.226 5.653 -9.920
969 2HB GLU 61 HB1 GLU 61 24.598 3.987 -9.549
970 1HG GLU 61 HG2 GLU 61 23.977 5.958 -7.324
971 2HG GLU 61 HG1 GLU 61 22.656 5.300 -8.247
972 H ASN 62 HN ASN 62 26.321 7.206 -6.970
973 HA ASN 62 HA ASN 62 25.662 9.459 -8.681
974 1HB ASN 62 HB2 ASN 62 25.459 9.529 -6.140
975 2HB ASN 62 HB1 ASN 62 27.223 9.536 -6.070
976 1HD2 ASN 62 HD21 ASN 62 27.534 12.898 -7.256
977 2HD2 ASN 62 HD22 ASN 62 28.360 11.446 -7.051
978 H LEU 63 HN LEU 63 27.190 11.099 -9.332
979 HA LEU 63 HA LEU 63 29.936 10.020 -9.735
980 1HB LEU 63 HB2 LEU 63 28.643 10.317 -11.886
981 2HB LEU 63 HB1 LEU 63 28.323 11.984 -11.443
982 HG LEU 63 HG LEU 63 30.784 12.434 -11.423
983 1HD1 LEU 63 HD11 LEU 63 30.990 9.597 -12.517
984 2HD1 LEU 63 HD13 LEU 63 32.310 10.757 -12.459
985 3HD1 LEU 63 HD12 LEU 63 31.613 10.157 -10.972
986 1HD2 LEU 63 HD22 LEU 63 29.704 11.290 -14.033
987 2HD2 LEU 63 HD21 LEU 63 29.464 12.928 -13.442
988 3HD2 LEU 63 HD23 LEU 63 31.071 12.388 -13.894
Start of MODEL 9
Raw file had 988 H/Q atoms
Start of MODEL 9
1 1H MET 1 HT1 MET 1 -20.802 -4.788 0.047
2 2H MET 1 HT3 MET 1 -20.324 -5.999 1.138
3 3H MET 1 HT2 MET 1 -19.377 -5.652 -0.237
4 HA MET 1 HA MET 1 -20.509 -7.079 -1.468
5 1HB MET 1 HB2 MET 1 -22.282 -7.392 0.998
6 2HB MET 1 HB1 MET 1 -22.341 -8.436 -0.414
7 1HG MET 1 HG2 MET 1 -19.867 -8.874 -0.077
8 2HG MET 1 HG1 MET 1 -19.966 -7.988 1.417
9 1HE MET 1 HE1 MET 1 -21.297 -10.805 -0.638
10 2HE MET 1 HE3 MET 1 -19.833 -11.569 0.013
11 3HE MET 1 HE2 MET 1 -21.438 -12.153 0.459
12 H THR 2 HN THR 2 -20.988 -5.248 -2.649
13 HA THR 2 HA THR 2 -23.837 -4.630 -2.898
14 HB THR 2 HB THR 2 -22.242 -2.155 -3.024
15 HG1 THR 2 HG1 THR 2 -20.761 -2.829 -1.701
16 1HG2 THR 2 HG21 THR 2 -23.975 -3.259 -0.728
17 2HG2 THR 2 HG23 THR 2 -23.635 -1.565 -1.047
18 3HG2 THR 2 HG22 THR 2 -24.686 -2.467 -2.123
19 H LYS 3 HN LYS 3 -22.932 -2.515 -4.853
20 HA LYS 3 HA LYS 3 -22.241 -4.413 -7.002
21 1HB LYS 3 HB2 LYS 3 -22.986 -1.457 -7.108
22 2HB LYS 3 HB1 LYS 3 -22.736 -2.479 -8.507
23 1HG LYS 3 HG2 LYS 3 -24.839 -2.951 -6.350
24 2HG LYS 3 HG1 LYS 3 -25.145 -2.182 -7.891
25 1HD LYS 3 HD2 LYS 3 -24.302 -4.334 -9.016
26 2HD LYS 3 HD1 LYS 3 -24.219 -5.055 -7.419
27 1HE LYS 3 HE2 LYS 3 -26.378 -5.603 -8.522
28 2HE LYS 3 HE1 LYS 3 -26.618 -4.687 -7.043
29 1HZ LYS 3 HZ1 LYS 3 -26.341 -2.885 -9.181
30 2HZ LYS 3 HZ3 LYS 3 -27.476 -4.066 -9.609
31 3HZ LYS 3 HZ2 LYS 3 -27.691 -3.167 -8.191
32 H GLN 4 HN GLN 4 -21.202 -1.073 -7.118
33 HA GLN 4 HA GLN 4 -18.527 -1.950 -7.857
34 1HB GLN 4 HB2 GLN 4 -19.800 0.785 -7.601
35 2HB GLN 4 HB1 GLN 4 -18.118 0.576 -8.028
36 1HG GLN 4 HG2 GLN 4 -19.399 0.829 -10.063
37 2HG GLN 4 HG1 GLN 4 -18.824 -0.832 -9.979
38 1HE2 GLN 4 HE21 GLN 4 -22.141 -1.849 -10.576
39 2HE2 GLN 4 HE22 GLN 4 -20.523 -1.893 -11.075
40 H GLU 5 HN GLU 5 -19.549 -2.110 -4.882
41 HA GLU 5 HA GLU 5 -17.722 -0.221 -3.632
42 1HB GLU 5 HB2 GLU 5 -18.612 -1.005 -1.650
43 2HB GLU 5 HB1 GLU 5 -19.825 -1.652 -2.700
44 1HG GLU 5 HG2 GLU 5 -17.429 -3.312 -1.829
45 2HG GLU 5 HG1 GLU 5 -18.908 -3.232 -0.907
46 H LYS 6 HN LYS 6 -17.758 -3.494 -4.776
47 HA LYS 6 HA LYS 6 -15.174 -4.280 -3.834
48 1HB LYS 6 HB2 LYS 6 -16.705 -5.084 -6.322
49 2HB LYS 6 HB1 LYS 6 -15.149 -5.779 -5.913
50 1HG LYS 6 HG2 LYS 6 -15.936 -6.681 -3.860
51 2HG LYS 6 HG1 LYS 6 -17.411 -5.761 -3.943
52 1HD LYS 6 HD2 LYS 6 -16.619 -7.930 -5.932
53 2HD LYS 6 HD1 LYS 6 -17.644 -8.244 -4.546
54 1HE LYS 6 HE2 LYS 6 -18.259 -6.349 -6.880
55 2HE LYS 6 HE1 LYS 6 -19.094 -7.833 -6.469
56 1HZ LYS 6 HZ1 LYS 6 -19.134 -6.187 -4.203
57 2HZ LYS 6 HZ3 LYS 6 -19.582 -5.254 -5.516
58 3HZ LYS 6 HZ2 LYS 6 -20.429 -6.664 -5.187
59 H THR 7 HN THR 7 -16.319 -2.539 -6.654
60 HA THR 7 HA THR 7 -13.890 -2.471 -8.060
61 HB THR 7 HB THR 7 -16.024 -0.263 -7.922
62 HG1 THR 7 HG1 THR 7 -16.335 -2.247 -9.721
63 1HG2 THR 7 HG21 THR 7 -14.410 -1.468 -10.250
64 2HG2 THR 7 HG23 THR 7 -15.505 -0.092 -10.346
65 3HG2 THR 7 HG22 THR 7 -13.985 0.052 -9.482
66 H ALA 8 HN ALA 8 -15.112 -0.341 -5.482
67 HA ALA 8 HA ALA 8 -12.883 1.454 -5.575
68 1HB ALA 8 HB1 ALA 8 -14.560 0.676 -3.152
69 2HB ALA 8 HB3 ALA 8 -13.505 2.076 -3.256
70 3HB ALA 8 HB2 ALA 8 -14.939 1.979 -4.271
71 H LEU 9 HN LEU 9 -13.546 -1.195 -3.347
72 HA LEU 9 HA LEU 9 -10.904 -1.153 -2.225
73 1HB LEU 9 HB2 LEU 9 -13.333 -2.841 -2.071
74 2HB LEU 9 HB1 LEU 9 -11.844 -3.697 -1.759
75 HG LEU 9 HG LEU 9 -11.280 -2.301 0.102
76 1HD1 LEU 9 HD11 LEU 9 -13.543 -0.411 -0.718
77 2HD1 LEU 9 HD13 LEU 9 -12.563 -0.263 0.725
78 3HD1 LEU 9 HD12 LEU 9 -11.842 -0.032 -0.847
79 1HD2 LEU 9 HD21 LEU 9 -13.102 -3.896 0.562
80 2HD2 LEU 9 HD23 LEU 9 -13.291 -2.454 1.541
81 3HD2 LEU 9 HD22 LEU 9 -14.299 -2.692 0.121
82 H ASN 10 HN ASN 10 -11.972 -2.296 -5.222
83 HA ASN 10 HA ASN 10 -10.102 -4.504 -5.407
84 1HB ASN 10 HB2 ASN 10 -11.860 -3.058 -7.307
85 2HB ASN 10 HB1 ASN 10 -10.343 -3.587 -8.010
86 1HD2 ASN 10 HD21 ASN 10 -12.626 -6.562 -6.284
87 2HD2 ASN 10 HD22 ASN 10 -12.475 -5.072 -5.492
88 H MET 11 HN MET 11 -10.065 -1.082 -5.831
89 HA MET 11 HA MET 11 -7.524 -0.995 -7.178
90 1HB MET 11 HB2 MET 11 -8.645 1.140 -5.329
91 2HB MET 11 HB1 MET 11 -7.543 1.368 -6.680
92 1HG MET 11 HG2 MET 11 -10.461 0.586 -6.777
93 2HG MET 11 HG1 MET 11 -9.713 1.998 -7.448
94 1HE MET 11 HE1 MET 11 -9.735 2.330 -9.814
95 2HE MET 11 HE3 MET 11 -8.018 1.938 -9.537
96 3HE MET 11 HE2 MET 11 -8.883 1.256 -10.903
97 H ALA 12 HN ALA 12 -8.645 -0.893 -3.870
98 HA ALA 12 HA ALA 12 -6.064 -0.528 -2.665
99 1HB ALA 12 HB2 ALA 12 -8.189 -0.262 -1.357
100 2HB ALA 12 HB1 ALA 12 -8.479 -1.992 -1.516
101 3HB ALA 12 HB3 ALA 12 -7.100 -1.416 -0.601
102 NH1 ARG 13 NH1 ARG 13 -8.604 -5.736 -7.701
103 NH2 ARG 13 NH2 ARG 13 -9.476 -7.883 -7.787
104 H ARG 13 HN ARG 13 -7.826 -3.259 -3.849
105 HA ARG 13 HA ARG 13 -6.224 -5.301 -2.658
106 1HB ARG 13 HB2 ARG 13 -8.414 -5.617 -4.010
107 2HB ARG 13 HB1 ARG 13 -7.410 -5.425 -5.436
108 1HG ARG 13 HG2 ARG 13 -5.946 -7.321 -4.542
109 2HG ARG 13 HG1 ARG 13 -7.185 -7.583 -3.325
110 1HD ARG 13 HD2 ARG 13 -7.566 -9.050 -5.307
111 2HD ARG 13 HD1 ARG 13 -8.888 -7.894 -5.127
112 HE ARG 13 HE ARG 13 -6.624 -7.452 -7.030
113 1HH1 ARG 13 HH12 ARG 13 -7.890 -5.097 -7.393
114 2HH1 ARG 13 HH11 ARG 13 -9.356 -5.357 -8.244
115 1HH2 ARG 13 HH22 ARG 13 -9.405 -8.853 -7.544
116 2HH2 ARG 13 HH21 ARG 13 -10.269 -7.589 -8.330
117 H PHE 14 HN PHE 14 -6.050 -3.471 -5.663
118 HA PHE 14 HA PHE 14 -3.713 -4.799 -6.629
119 1HB PHE 14 HB2 PHE 14 -4.539 -1.897 -7.098
120 2HB PHE 14 HB1 PHE 14 -3.351 -2.784 -8.035
121 HD1 PHE 14 HD2 PHE 14 -4.747 -5.467 -8.302
122 HD2 PHE 14 HD1 PHE 14 -6.237 -1.489 -8.665
123 HE1 PHE 14 HE2 PHE 14 -6.531 -6.261 -9.767
124 HE2 PHE 14 HE1 PHE 14 -8.025 -2.291 -10.127
125 HZ PHE 14 HZ PHE 14 -8.181 -4.681 -10.689
126 H ILE 15 HN ILE 15 -4.143 -2.047 -4.431
127 HA ILE 15 HA ILE 15 -1.370 -1.382 -4.384
128 HB ILE 15 HB ILE 15 -3.441 -1.202 -2.133
129 1HG1 ILE 15 HG12 ILE 15 -2.493 0.680 -4.334
130 2HG1 ILE 15 HG11 ILE 15 -4.121 0.098 -4.069
131 1HG2 ILE 15 HG22 ILE 15 -1.090 -1.093 -1.276
132 2HG2 ILE 15 HG21 ILE 15 -0.766 0.213 -2.405
133 3HG2 ILE 15 HG23 ILE 15 -1.906 0.436 -1.084
134 1HD1 ILE 15 HD3 ILE 15 -4.214 1.346 -1.917
135 2HD1 ILE 15 HD2 ILE 15 -2.616 2.003 -2.234
136 3HD1 ILE 15 HD1 ILE 15 -3.943 2.402 -3.296
137 NH1 ARG 16 NH2 ARG 16 -1.276 -9.985 1.885
138 NH2 ARG 16 NH1 ARG 16 -3.560 -10.245 2.149
139 H ARG 16 HN ARG 16 -3.279 -3.763 -2.584
140 HA ARG 16 HA ARG 16 -1.112 -4.636 -0.939
141 1HB ARG 16 HB2 ARG 16 -3.393 -5.418 -0.429
142 2HB ARG 16 HB1 ARG 16 -3.531 -6.185 -2.002
143 1HG ARG 16 HG2 ARG 16 -1.736 -7.753 -1.444
144 2HG ARG 16 HG1 ARG 16 -1.483 -6.929 0.092
145 1HD ARG 16 HD2 ARG 16 -3.570 -7.705 0.955
146 2HD ARG 16 HD1 ARG 16 -4.158 -8.199 -0.626
147 HE ARG 16 HE ARG 16 -2.465 -10.017 -0.568
148 1HH1 ARG 16 HH22 ARG 16 -0.495 -9.712 1.320
149 2HH1 ARG 16 HH21 ARG 16 -1.082 -10.324 2.811
150 1HH2 ARG 16 HH12 ARG 16 -4.490 -10.163 1.775
151 2HH2 ARG 16 HH11 ARG 16 -3.466 -10.594 3.087
152 H SER 17 HN SER 17 -2.125 -5.412 -4.211
153 HA SER 17 HA SER 17 -0.313 -7.600 -4.564
154 1HB SER 17 HB2 SER 17 -1.237 -5.686 -6.757
155 2HB SER 17 HB1 SER 17 -0.857 -7.405 -6.904
156 HG SER 17 HG1 SER 17 -2.648 -7.021 -4.922
157 H GLN 18 HN GLN 18 0.002 -4.111 -5.065
158 HA GLN 18 HA GLN 18 2.615 -4.315 -6.248
159 1HB GLN 18 HB2 GLN 18 1.398 -1.994 -4.688
160 2HB GLN 18 HB1 GLN 18 2.783 -1.917 -5.770
161 1HG GLN 18 HG2 GLN 18 1.420 -2.537 -7.682
162 2HG GLN 18 HG1 GLN 18 0.004 -2.734 -6.660
163 1HE2 GLN 18 HE21 GLN 18 1.284 1.012 -7.638
164 2HE2 GLN 18 HE22 GLN 18 2.235 -0.341 -8.012
165 H THR 19 HN THR 19 1.385 -4.144 -2.985
166 HA THR 19 HA THR 19 3.913 -3.655 -1.748
167 HB THR 19 HB THR 19 1.454 -5.143 -0.626
168 HG1 THR 19 HG1 THR 19 0.664 -3.239 -1.140
169 1HG2 THR 19 HG21 THR 19 3.543 -3.329 0.723
170 2HG2 THR 19 HG23 THR 19 2.229 -4.169 1.532
171 3HG2 THR 19 HG22 THR 19 3.572 -5.078 0.863
172 H LEU 20 HN LEU 20 2.337 -6.440 -3.096
173 HA LEU 20 HA LEU 20 4.013 -8.429 -1.870
174 1HB LEU 20 HB2 LEU 20 1.854 -8.723 -3.403
175 2HB LEU 20 HB1 LEU 20 2.996 -8.608 -4.729
176 HG LEU 20 HG LEU 20 3.231 -10.685 -2.522
177 1HD1 LEU 20 HD11 LEU 20 2.143 -10.925 -5.359
178 2HD1 LEU 20 HD13 LEU 20 2.373 -12.262 -4.243
179 3HD1 LEU 20 HD12 LEU 20 1.182 -11.022 -3.889
180 1HD2 LEU 20 HD22 LEU 20 4.617 -10.447 -5.237
181 2HD2 LEU 20 HD21 LEU 20 5.397 -10.232 -3.680
182 3HD2 LEU 20 HD23 LEU 20 4.779 -11.795 -4.129
183 H THR 21 HN THR 21 4.105 -6.639 -4.943
184 HA THR 21 HA THR 21 6.580 -7.586 -5.828
185 HB THR 21 HB THR 21 5.644 -4.693 -6.174
186 HG1 THR 21 HG1 THR 21 4.563 -7.176 -6.765
187 1HG2 THR 21 HG21 THR 21 6.901 -6.778 -8.068
188 2HG2 THR 21 HG23 THR 21 6.598 -5.091 -8.462
189 3HG2 THR 21 HG22 THR 21 7.835 -5.514 -7.290
190 H LEU 22 HN LEU 22 5.883 -5.099 -3.413
191 HA LEU 22 HA LEU 22 8.611 -4.195 -3.268
192 1HB LEU 22 HB2 LEU 22 6.533 -4.302 -1.035
193 2HB LEU 22 HB1 LEU 22 8.054 -3.450 -0.942
194 HG LEU 22 HG LEU 22 5.841 -2.831 -2.955
195 1HD1 LEU 22 HD12 LEU 22 5.266 -2.231 -0.602
196 2HD1 LEU 22 HD11 LEU 22 6.778 -1.351 -0.455
197 3HD1 LEU 22 HD13 LEU 22 5.532 -0.782 -1.555
198 1HD2 LEU 22 HD22 LEU 22 8.461 -1.381 -2.338
199 2HD2 LEU 22 HD21 LEU 22 8.127 -2.266 -3.815
200 3HD2 LEU 22 HD23 LEU 22 7.235 -0.813 -3.456
201 H LEU 23 HN LEU 23 6.793 -6.667 -1.552
202 HA LEU 23 HA LEU 23 8.745 -7.512 0.249
203 1HB LEU 23 HB2 LEU 23 6.415 -8.538 0.022
204 2HB LEU 23 HB1 LEU 23 6.998 -9.391 -1.396
205 HG LEU 23 HG LEU 23 8.820 -10.415 0.047
206 1HD1 LEU 23 HD11 LEU 23 7.078 -9.273 2.255
207 2HD1 LEU 23 HD13 LEU 23 8.400 -10.402 2.490
208 3HD1 LEU 23 HD12 LEU 23 8.730 -8.775 1.926
209 1HD2 LEU 23 HD22 LEU 23 5.930 -10.997 0.755
210 2HD2 LEU 23 HD21 LEU 23 6.798 -11.651 -0.621
211 3HD2 LEU 23 HD23 LEU 23 7.282 -12.084 1.010
212 H GLU 24 HN GLU 24 8.241 -8.483 -3.065
213 HA GLU 24 HA GLU 24 10.317 -10.324 -3.367
214 1HB GLU 24 HB2 GLU 24 9.500 -8.235 -5.365
215 2HB GLU 24 HB1 GLU 24 10.295 -9.760 -5.740
216 1HG GLU 24 HG2 GLU 24 8.325 -10.994 -5.146
217 2HG GLU 24 HG1 GLU 24 7.535 -9.555 -4.505
218 H LYS 25 HN LYS 25 10.466 -7.010 -4.450
219 HA LYS 25 HA LYS 25 13.213 -6.870 -4.975
220 1HB LYS 25 HB2 LYS 25 11.704 -4.552 -3.737
221 2HB LYS 25 HB1 LYS 25 13.031 -4.466 -4.865
222 1HG LYS 25 HG2 LYS 25 10.311 -5.600 -5.630
223 2HG LYS 25 HG1 LYS 25 10.687 -3.914 -5.777
224 1HD LYS 25 HD2 LYS 25 10.984 -4.785 -7.952
225 2HD LYS 25 HD1 LYS 25 12.602 -4.594 -7.325
226 1HE LYS 25 HE2 LYS 25 12.202 -6.779 -8.535
227 2HE LYS 25 HE1 LYS 25 12.839 -6.944 -6.920
228 1HZ LYS 25 HZ1 LYS 25 10.009 -7.018 -6.780
229 2HZ LYS 25 HZ3 LYS 25 10.530 -8.087 -7.967
230 3HZ LYS 25 HZ2 LYS 25 11.160 -8.207 -6.432
231 H LEU 26 HN LEU 26 11.589 -6.323 -1.911
232 HA LEU 26 HA LEU 26 13.958 -5.442 -0.562
233 1HB LEU 26 HB2 LEU 26 11.275 -6.491 0.281
234 2HB LEU 26 HB1 LEU 26 12.562 -6.502 1.469
235 HG LEU 26 HG LEU 26 12.878 -4.097 1.304
236 1HD1 LEU 26 HD12 LEU 26 12.533 -3.810 -1.175
237 2HD1 LEU 26 HD11 LEU 26 10.811 -4.065 -0.942
238 3HD1 LEU 26 HD13 LEU 26 11.594 -2.671 -0.237
239 1HD2 LEU 26 HD21 LEU 26 10.979 -4.868 2.678
240 2HD2 LEU 26 HD23 LEU 26 10.622 -3.303 1.969
241 3HD2 LEU 26 HD22 LEU 26 9.907 -4.761 1.293
242 H ASN 27 HN ASN 27 12.537 -8.624 -1.076
243 HA ASN 27 HA ASN 27 14.393 -9.965 0.671
244 1HB ASN 27 HB2 ASN 27 12.940 -11.032 -1.786
245 2HB ASN 27 HB1 ASN 27 13.838 -12.024 -0.652
246 1HD2 ASN 27 HD21 ASN 27 10.929 -10.331 1.543
247 2HD2 ASN 27 HD22 ASN 27 12.286 -9.454 1.033
248 H GLU 28 HN GLU 28 14.316 -9.285 -2.749
249 HA GLU 28 HA GLU 28 16.685 -10.602 -3.505
250 1HB GLU 28 HB2 GLU 28 15.426 -8.076 -4.628
251 2HB GLU 28 HB1 GLU 28 16.619 -9.061 -5.455
252 1HG GLU 28 HG2 GLU 28 15.138 -10.890 -5.672
253 2HG GLU 28 HG1 GLU 28 14.034 -10.299 -4.437
254 H LEU 29 HN LEU 29 16.208 -7.267 -2.441
255 HA LEU 29 HA LEU 29 19.119 -6.840 -2.577
256 1HB LEU 29 HB2 LEU 29 16.771 -5.042 -1.990
257 2HB LEU 29 HB1 LEU 29 18.417 -4.510 -1.705
258 HG LEU 29 HG LEU 29 19.013 -4.960 -4.070
259 1HD1 LEU 29 HD11 LEU 29 16.050 -5.540 -4.483
260 2HD1 LEU 29 HD13 LEU 29 17.239 -5.348 -5.755
261 3HD1 LEU 29 HD12 LEU 29 17.352 -6.705 -4.667
262 1HD2 LEU 29 HD21 LEU 29 18.268 -2.721 -3.387
263 2HD2 LEU 29 HD23 LEU 29 17.764 -3.061 -5.036
264 3HD2 LEU 29 HD22 LEU 29 16.598 -3.151 -3.724
265 H ASP 30 HN ASP 30 17.813 -8.641 -0.585
266 HA ASP 30 HA ASP 30 17.991 -9.214 1.628
267 1HB ASP 30 HB2 ASP 30 20.425 -9.229 0.991
268 2HB ASP 30 HB1 ASP 30 20.533 -7.548 1.515
269 H ALA 31 HN ALA 31 16.218 -7.786 1.848
270 HA ALA 31 HA ALA 31 16.770 -5.791 4.007
271 1HB ALA 31 HB1 ALA 31 14.633 -5.513 1.833
272 2HB ALA 31 HB3 ALA 31 14.899 -4.395 3.164
273 3HB ALA 31 HB2 ALA 31 16.105 -4.550 1.897
274 H ASP 32 HN ASP 32 16.495 -8.126 4.723
275 HA ASP 32 HA ASP 32 13.951 -9.394 4.673
276 1HB ASP 32 HB2 ASP 32 15.875 -10.682 5.413
277 2HB ASP 32 HB1 ASP 32 16.100 -9.597 6.793
278 H GLU 33 HN GLU 33 15.348 -7.292 7.170
279 HA GLU 33 HA GLU 33 13.102 -7.557 8.901
280 1HB GLU 33 HB2 GLU 33 13.963 -4.890 9.220
281 2HB GLU 33 HB1 GLU 33 14.480 -6.259 10.180
282 1HG GLU 33 HG2 GLU 33 16.462 -5.165 9.405
283 2HG GLU 33 HG1 GLU 33 16.356 -6.604 8.421
284 H GLN 34 HN GLN 34 13.739 -5.362 6.217
285 HA GLN 34 HA GLN 34 11.210 -3.977 6.636
286 1HB GLN 34 HB2 GLN 34 12.822 -4.181 4.053
287 2HB GLN 34 HB1 GLN 34 11.598 -2.976 4.425
288 1HG GLN 34 HG2 GLN 34 14.274 -3.297 5.819
289 2HG GLN 34 HG1 GLN 34 13.751 -1.948 4.822
290 1HE2 GLN 34 HE21 GLN 34 12.885 -1.770 8.680
291 2HE2 GLN 34 HE22 GLN 34 14.128 -2.702 8.006
292 H ALA 35 HN ALA 35 12.246 -6.898 5.170
293 HA ALA 35 HA ALA 35 9.979 -7.170 3.402
294 1HB ALA 35 HB2 ALA 35 11.992 -8.715 3.237
295 2HB ALA 35 HB1 ALA 35 11.523 -9.436 4.774
296 3HB ALA 35 HB3 ALA 35 10.472 -9.590 3.392
297 H ASP 36 HN ASP 36 10.706 -8.158 6.734
298 HA ASP 36 HA ASP 36 8.249 -9.464 7.253
299 1HB ASP 36 HB2 ASP 36 9.852 -9.587 9.034
300 2HB ASP 36 HB1 ASP 36 9.973 -7.825 9.140
301 H ILE 37 HN ILE 37 9.143 -6.119 7.890
302 HA ILE 37 HA ILE 37 6.549 -5.323 8.739
303 HB ILE 37 HB ILE 37 8.638 -3.704 7.222
304 1HG1 ILE 37 HG12 ILE 37 9.589 -4.719 9.254
305 2HG1 ILE 37 HG11 ILE 37 9.478 -2.983 9.424
306 1HG2 ILE 37 HG21 ILE 37 6.336 -2.718 9.000
307 2HG2 ILE 37 HG23 ILE 37 7.579 -1.690 8.310
308 3HG2 ILE 37 HG22 ILE 37 6.446 -2.520 7.271
309 1HD1 ILE 37 HD2 ILE 37 7.380 -3.267 10.758
310 2HD1 ILE 37 HD1 ILE 37 7.515 -5.011 10.572
311 3HD1 ILE 37 HD3 ILE 37 8.729 -4.130 11.469
312 H CYS 38 HN CYS 38 7.952 -5.803 5.587
313 HA CYS 38 HA CYS 38 5.754 -4.549 4.182
314 1HB CYS 38 HB2 CYS 38 8.006 -4.996 3.129
315 2HB CYS 38 HB1 CYS 38 7.625 -6.699 3.145
316 HG CYS 38 HG1 CYS 38 6.177 -6.470 1.160
317 H GLU 39 HN GLU 39 6.349 -7.754 5.471
318 HA GLU 39 HA GLU 39 4.163 -8.971 4.017
319 1HB GLU 39 HB2 GLU 39 5.531 -9.878 6.601
320 2HB GLU 39 HB1 GLU 39 4.413 -10.838 5.654
321 1HG GLU 39 HG2 GLU 39 6.861 -9.761 4.311
322 2HG GLU 39 HG1 GLU 39 6.984 -11.193 5.320
323 H SER 40 HN SER 40 4.624 -7.979 7.367
324 HA SER 40 HA SER 40 1.972 -8.501 8.177
325 1HB SER 40 HB2 SER 40 2.656 -6.516 9.862
326 2HB SER 40 HB1 SER 40 3.607 -8.021 9.905
327 HG SER 40 HG1 SER 40 5.212 -6.967 9.071
328 H LEU 41 HN LEU 41 3.451 -5.855 6.494
329 HA LEU 41 HA LEU 41 1.087 -4.178 6.587
330 1HB LEU 41 HB2 LEU 41 3.476 -3.409 6.130
331 2HB LEU 41 HB1 LEU 41 3.299 -4.094 4.530
332 HG LEU 41 HG LEU 41 1.211 -2.622 4.260
333 1HD1 LEU 41 HD11 LEU 41 2.432 -1.285 6.714
334 2HD1 LEU 41 HD13 LEU 41 1.106 -0.640 5.770
335 3HD1 LEU 41 HD12 LEU 41 0.882 -2.106 6.693
336 1HD2 LEU 41 HD21 LEU 41 3.396 -2.130 3.212
337 2HD2 LEU 41 HD23 LEU 41 2.567 -0.666 3.701
338 3HD2 LEU 41 HD22 LEU 41 3.899 -1.281 4.669
339 H HIS 42 HN HIS 42 2.483 -6.505 4.512
340 HA HIS 42 HA HIS 42 1.017 -6.216 2.133
341 1HB HIS 42 HB2 HIS 42 2.876 -7.989 2.647
342 2HB HIS 42 HB1 HIS 42 1.593 -8.946 3.357
343 HD1 HIS 42 HD1 HIS 42 0.283 -7.305 0.446
344 HD2 HIS 42 HD2 HIS 42 2.493 -10.668 1.166
345 HE1 HIS 42 HE1 HIS 42 0.103 -8.713 -1.577
346 H ASP 43 HN ASP 43 0.225 -7.985 5.069
347 HA ASP 43 HA ASP 43 -2.484 -8.505 4.034
348 1HB ASP 43 HB2 ASP 43 -1.103 -9.331 6.588
349 2HB ASP 43 HB1 ASP 43 -2.791 -9.704 6.220
350 H HIS 44 HN HIS 44 -0.924 -6.254 6.141
351 HA HIS 44 HA HIS 44 -3.248 -5.595 7.706
352 1HB HIS 44 HB2 HIS 44 -0.981 -4.702 8.298
353 2HB HIS 44 HB1 HIS 44 -0.976 -3.771 6.798
354 HD1 HIS 44 HD1 HIS 44 -4.160 -3.883 8.674
355 HD2 HIS 44 HD2 HIS 44 -0.951 -1.359 8.344
356 HE1 HIS 44 HE1 HIS 44 -4.840 -1.768 9.691
357 H ALA 45 HN ALA 45 -1.930 -4.610 4.665
358 HA ALA 45 HA ALA 45 -3.929 -2.622 4.064
359 1HB ALA 45 HB2 ALA 45 -1.729 -2.697 2.853
360 2HB ALA 45 HB1 ALA 45 -2.197 -4.240 2.148
361 3HB ALA 45 HB3 ALA 45 -3.085 -2.780 1.734
362 H ASP 46 HN ASP 46 -3.870 -5.993 4.156
363 HA ASP 46 HA ASP 46 -5.989 -6.315 2.148
364 1HB ASP 46 HB2 ASP 46 -4.277 -8.149 2.810
365 2HB ASP 46 HB1 ASP 46 -5.331 -8.396 4.203
366 H GLU 47 HN GLU 47 -5.582 -5.935 5.606
367 HA GLU 47 HA GLU 47 -8.177 -6.894 6.282
368 1HB GLU 47 HB2 GLU 47 -6.654 -4.592 7.585
369 2HB GLU 47 HB1 GLU 47 -7.948 -5.497 8.347
370 1HG GLU 47 HG2 GLU 47 -6.597 -7.582 8.171
371 2HG GLU 47 HG1 GLU 47 -5.272 -6.643 7.491
372 H LEU 48 HN LEU 48 -7.016 -3.649 5.481
373 HA LEU 48 HA LEU 48 -9.644 -2.502 5.636
374 1HB LEU 48 HB2 LEU 48 -8.668 -0.600 4.351
375 2HB LEU 48 HB1 LEU 48 -7.735 -1.043 5.761
376 HG LEU 48 HG LEU 48 -6.299 -2.457 4.106
377 1HD1 LEU 48 HD11 LEU 48 -7.558 -0.468 2.166
378 2HD1 LEU 48 HD13 LEU 48 -6.179 -1.496 1.816
379 3HD1 LEU 48 HD12 LEU 48 -7.750 -2.208 2.074
380 1HD2 LEU 48 HD22 LEU 48 -6.225 0.574 4.114
381 2HD2 LEU 48 HD21 LEU 48 -5.474 -0.487 5.298
382 3HD2 LEU 48 HD23 LEU 48 -4.889 -0.466 3.644
383 OH TYR 49 OH TYR 49 -10.701 -7.959 -3.502
384 H TYR 49 HN TYR 49 -8.282 -4.643 3.502
385 HA TYR 49 HA TYR 49 -9.955 -3.790 1.229
386 1HB TYR 49 HB2 TYR 49 -7.721 -4.528 0.596
387 2HB TYR 49 HB1 TYR 49 -7.888 -6.001 1.536
388 HD1 TYR 49 HD1 TYR 49 -9.879 -4.230 -1.086
389 HD2 TYR 49 HD2 TYR 49 -8.305 -7.912 0.338
390 HE1 TYR 49 HE1 TYR 49 -10.868 -5.390 -3.000
391 HE2 TYR 49 HE2 TYR 49 -9.279 -9.077 -1.558
392 HH TYR 49 HH TYR 49 -10.903 -8.861 -3.235
393 NH1 ARG 50 NH1 ARG 50 -15.007 -9.569 2.646
394 NH2 ARG 50 NH2 ARG 50 -15.667 -10.857 0.836
395 H ARG 50 HN ARG 50 -9.277 -7.042 2.464
396 HA ARG 50 HA ARG 50 -11.883 -7.886 1.758
397 1HB ARG 50 HB2 ARG 50 -9.882 -9.416 1.877
398 2HB ARG 50 HB1 ARG 50 -9.907 -9.244 3.617
399 1HG ARG 50 HG2 ARG 50 -11.025 -11.312 3.005
400 2HG ARG 50 HG1 ARG 50 -12.193 -10.232 3.728
401 1HD ARG 50 HD2 ARG 50 -12.684 -9.547 1.149
402 2HD ARG 50 HD1 ARG 50 -11.881 -11.071 0.826
403 HE ARG 50 HE ARG 50 -13.659 -12.173 2.144
404 1HH1 ARG 50 HH12 ARG 50 -14.323 -9.360 3.351
405 2HH1 ARG 50 HH11 ARG 50 -15.837 -9.006 2.628
406 1HH2 ARG 50 HH22 ARG 50 -15.477 -11.605 0.195
407 2HH2 ARG 50 HH21 ARG 50 -16.532 -10.357 0.732
408 H SER 51 HN SER 51 -10.509 -7.546 5.061
409 HA SER 51 HA SER 51 -12.808 -8.373 6.423
410 1HB SER 51 HB2 SER 51 -11.071 -6.021 7.327
411 2HB SER 51 HB1 SER 51 -11.906 -7.212 8.334
412 HG SER 51 HG1 SER 51 -9.513 -7.462 7.402
413 H CYS 52 HN CYS 52 -11.982 -5.175 5.209
414 HA CYS 52 HA CYS 52 -14.472 -3.976 6.055
415 1HB CYS 52 HB2 CYS 52 -12.571 -3.302 3.779
416 2HB CYS 52 HB1 CYS 52 -13.848 -2.253 4.285
417 HG CYS 52 HG1 CYS 52 -12.516 -1.547 6.297
418 H LEU 53 HN LEU 53 -13.397 -5.372 2.989
419 HA LEU 53 HA LEU 53 -15.688 -4.898 1.511
420 1HB LEU 53 HB2 LEU 53 -13.650 -6.009 0.591
421 2HB LEU 53 HB1 LEU 53 -14.045 -7.459 1.488
422 HG LEU 53 HG LEU 53 -16.071 -7.804 0.159
423 1HD1 LEU 53 HD11 LEU 53 -15.340 -5.176 -1.226
424 2HD1 LEU 53 HD13 LEU 53 -16.649 -6.247 -1.691
425 3HD1 LEU 53 HD12 LEU 53 -16.729 -5.391 -0.176
426 1HD2 LEU 53 HD21 LEU 53 -13.915 -8.591 -0.769
427 2HD2 LEU 53 HD23 LEU 53 -15.015 -8.112 -2.052
428 3HD2 LEU 53 HD22 LEU 53 -13.700 -7.046 -1.578
429 H ALA 54 HN ALA 54 -15.363 -7.014 4.199
430 HA ALA 54 HA ALA 54 -17.486 -8.842 3.761
431 1HB ALA 54 HB2 ALA 54 -16.100 -8.809 5.890
432 2HB ALA 54 HB1 ALA 54 -16.925 -7.328 6.355
433 3HB ALA 54 HB3 ALA 54 -17.830 -8.824 6.218
434 NH1 ARG 55 NH1 ARG 55 -19.720 0.273 5.510
435 NH2 ARG 55 NH2 ARG 55 -21.376 1.547 6.493
436 H ARG 55 HN ARG 55 -17.561 -5.645 5.252
437 HA ARG 55 HA ARG 55 -20.465 -5.446 4.683
438 1HB ARG 55 HB2 ARG 55 -19.693 -4.543 6.891
439 2HB ARG 55 HB1 ARG 55 -18.503 -3.531 6.125
440 1HG ARG 55 HG2 ARG 55 -20.336 -2.293 4.911
441 2HG ARG 55 HG1 ARG 55 -21.519 -3.330 5.682
442 1HD ARG 55 HD2 ARG 55 -21.086 -2.392 7.853
443 2HD ARG 55 HD1 ARG 55 -19.627 -1.583 7.349
444 HE ARG 55 HE ARG 55 -22.389 -0.735 6.798
445 1HH1 ARG 55 HH12 ARG 55 -19.316 -0.625 5.326
446 2HH1 ARG 55 HH11 ARG 55 -19.231 1.067 5.130
447 1HH2 ARG 55 HH22 ARG 55 -22.223 1.593 7.034
448 2HH2 ARG 55 HH21 ARG 55 -20.979 2.415 6.189
449 H PHE 56 HN PHE 56 -17.856 -3.287 4.569
450 HA PHE 56 HA PHE 56 -16.899 -2.816 2.176
451 1HB PHE 56 HB2 PHE 56 -19.262 -2.328 1.185
452 2HB PHE 56 HB1 PHE 56 -19.448 -1.076 2.422
453 HD1 PHE 56 HD2 PHE 56 -16.803 -2.281 0.065
454 HD2 PHE 56 HD1 PHE 56 -18.796 1.102 1.729
455 HE1 PHE 56 HE2 PHE 56 -15.418 -0.811 -1.278
456 HE2 PHE 56 HE1 PHE 56 -17.398 2.579 0.377
457 HZ PHE 56 HZ PHE 56 -15.694 1.631 -1.135
458 H GLY 57 HN GLY 57 -15.890 -2.701 4.319
459 1HA GLY 57 HA2 GLY 57 -14.971 -1.503 6.128
460 2HA GLY 57 HA1 GLY 57 -15.048 -0.147 4.985
461 H ASP 58 HN ASP 58 -15.548 1.278 6.360
462 HA ASP 58 HA ASP 58 -16.633 2.447 8.056
463 1HB ASP 58 HB2 ASP 58 -18.905 2.585 6.128
464 2HB ASP 58 HB1 ASP 58 -17.987 3.862 6.906
465 H ASP 59 HN ASP 59 -19.242 3.108 8.202
466 HA ASP 59 HA ASP 59 -20.924 0.905 9.063
467 1HB ASP 59 HB2 ASP 59 -19.375 1.101 11.053
468 2HB ASP 59 HB1 ASP 59 -19.735 2.823 11.137
469 H GLY 60 HN GLY 60 -22.705 2.527 10.562
470 1HA GLY 60 HA2 GLY 60 -23.288 5.047 10.237
471 2HA GLY 60 HA1 GLY 60 -23.399 4.550 8.526
472 H GLU 61 HN GLU 61 -24.002 1.805 9.713
473 HA GLU 61 HA GLU 61 -26.919 2.212 9.772
474 1HB GLU 61 HB2 GLU 61 -25.292 -0.362 9.721
475 2HB GLU 61 HB1 GLU 61 -27.016 -0.225 9.444
476 1HG GLU 61 HG2 GLU 61 -25.984 -0.393 7.248
477 2HG GLU 61 HG1 GLU 61 -26.487 1.282 7.441
478 H ASN 62 HN ASN 62 -24.190 1.186 11.693
479 HA ASN 62 HA ASN 62 -25.924 0.276 13.888
480 1HB ASN 62 HB2 ASN 62 -23.544 -0.642 13.479
481 2HB ASN 62 HB1 ASN 62 -22.962 0.927 14.028
482 1HD2 ASN 62 HD21 ASN 62 -23.896 0.427 17.438
483 2HD2 ASN 62 HD22 ASN 62 -23.601 1.613 16.272
484 H LEU 63 HN LEU 63 -26.006 1.440 15.937
485 HA LEU 63 HA LEU 63 -25.001 4.170 15.997
486 1HB LEU 63 HB2 LEU 63 -27.425 4.998 16.496
487 2HB LEU 63 HB1 LEU 63 -26.974 4.744 14.829
488 HG LEU 63 HG LEU 63 -28.104 2.513 14.856
489 1HD1 LEU 63 HD11 LEU 63 -29.008 3.305 17.659
490 2HD1 LEU 63 HD13 LEU 63 -29.624 1.938 16.741
491 3HD1 LEU 63 HD12 LEU 63 -27.963 1.953 17.273
492 1HD2 LEU 63 HD22 LEU 63 -29.834 4.838 15.775
493 2HD2 LEU 63 HD21 LEU 63 -29.326 4.522 14.122
494 3HD2 LEU 63 HD23 LEU 63 -30.418 3.410 14.931
495 1H MET 1 HT1 MET 1 24.007 -0.239 -3.541
496 2H MET 1 HT3 MET 1 24.901 -0.766 -2.198
497 3H MET 1 HT2 MET 1 23.408 0.032 -1.990
498 HA MET 1 HA MET 1 24.392 1.996 -1.971
499 1HB MET 1 HB2 MET 1 26.939 0.451 -2.684
500 2HB MET 1 HB1 MET 1 26.899 2.127 -2.182
501 1HG MET 1 HG2 MET 1 27.496 0.625 -0.322
502 2HG MET 1 HG1 MET 1 26.056 1.544 0.006
503 1HE MET 1 HE2 MET 1 23.620 0.583 -0.074
504 2HE MET 1 HE1 MET 1 23.454 -0.857 0.907
505 3HE MET 1 HE3 MET 1 24.392 0.487 1.526
506 H THR 2 HN THR 2 22.989 1.499 -4.008
507 HA THR 2 HA THR 2 24.442 2.636 -6.303
508 HB THR 2 HB THR 2 22.465 0.615 -7.127
509 HG1 THR 2 HG1 THR 2 22.749 -0.577 -5.393
510 1HG2 THR 2 HG21 THR 2 25.543 0.443 -7.020
511 2HG2 THR 2 HG23 THR 2 24.498 -0.475 -8.093
512 3HG2 THR 2 HG22 THR 2 24.709 1.251 -8.335
513 H LYS 3 HN LYS 3 22.428 3.201 -7.937
514 HA LYS 3 HA LYS 3 20.594 4.735 -6.185
515 1HB LYS 3 HB2 LYS 3 21.675 5.646 -8.424
516 2HB LYS 3 HB1 LYS 3 20.420 4.686 -9.206
517 1HG LYS 3 HG2 LYS 3 18.755 5.863 -7.595
518 2HG LYS 3 HG1 LYS 3 20.068 6.945 -7.196
519 1HD LYS 3 HD2 LYS 3 18.989 8.144 -8.896
520 2HD LYS 3 HD1 LYS 3 20.273 7.333 -9.766
521 1HE LYS 3 HE2 LYS 3 18.095 7.067 -10.957
522 2HE LYS 3 HE1 LYS 3 18.714 5.509 -10.444
523 1HZ LYS 3 HZ1 LYS 3 17.126 6.555 -8.371
524 2HZ LYS 3 HZ3 LYS 3 16.263 6.673 -9.821
525 3HZ LYS 3 HZ2 LYS 3 16.866 5.182 -9.317
526 H GLN 4 HN GLN 4 20.784 2.027 -8.294
527 HA GLN 4 HA GLN 4 18.189 1.492 -9.066
528 1HB GLN 4 HB2 GLN 4 20.092 -0.576 -7.898
529 2HB GLN 4 HB1 GLN 4 18.717 -0.893 -8.930
530 1HG GLN 4 HG2 GLN 4 19.754 0.371 -10.771
531 2HG GLN 4 HG1 GLN 4 21.147 0.755 -9.749
532 1HE2 GLN 4 HE21 GLN 4 22.499 -2.267 -11.089
533 2HE2 GLN 4 HE22 GLN 4 22.588 -0.576 -11.155
534 H GLU 5 HN GLU 5 19.625 0.450 -6.036
535 HA GLU 5 HA GLU 5 17.359 -0.704 -4.881
536 1HB GLU 5 HB2 GLU 5 18.668 -0.332 -2.757
537 2HB GLU 5 HB1 GLU 5 19.643 -0.932 -4.064
538 1HG GLU 5 HG2 GLU 5 20.111 1.622 -4.554
539 2HG GLU 5 HG1 GLU 5 19.468 1.850 -2.930
540 H LYS 6 HN LYS 6 18.406 2.648 -4.884
541 HA LYS 6 HA LYS 6 16.356 3.600 -3.117
542 1HB LYS 6 HB2 LYS 6 17.594 5.145 -5.445
543 2HB LYS 6 HB1 LYS 6 16.846 5.829 -4.027
544 1HG LYS 6 HG2 LYS 6 19.370 4.121 -3.957
545 2HG LYS 6 HG1 LYS 6 19.358 5.871 -3.911
546 1HD LYS 6 HD2 LYS 6 17.977 5.828 -1.853
547 2HD LYS 6 HD1 LYS 6 18.043 4.071 -1.827
548 1HE LYS 6 HE2 LYS 6 20.395 5.992 -1.632
549 2HE LYS 6 HE1 LYS 6 19.763 4.987 -0.345
550 1HZ LYS 6 HZ1 LYS 6 20.377 3.333 -2.547
551 2HZ LYS 6 HZ3 LYS 6 21.699 4.330 -2.240
552 3HZ LYS 6 HZ2 LYS 6 21.059 3.349 -1.018
553 H THR 7 HN THR 7 16.566 3.058 -6.552
554 HA THR 7 HA THR 7 14.074 4.237 -7.247
555 HB THR 7 HB THR 7 15.224 1.846 -8.753
556 HG1 THR 7 HG1 THR 7 17.024 2.881 -8.280
557 1HG2 THR 7 HG21 THR 7 14.409 4.705 -9.574
558 2HG2 THR 7 HG23 THR 7 14.757 3.374 -10.671
559 3HG2 THR 7 HG22 THR 7 13.315 3.338 -9.673
560 H ALA 8 HN ALA 8 14.994 1.089 -5.991
561 HA ALA 8 HA ALA 8 12.478 -0.188 -6.498
562 1HB ALA 8 HB2 ALA 8 14.495 -1.460 -5.632
563 2HB ALA 8 HB1 ALA 8 14.315 -0.618 -4.097
564 3HB ALA 8 HB3 ALA 8 13.066 -1.722 -4.636
565 H LEU 9 HN LEU 9 13.767 1.700 -3.795
566 HA LEU 9 HA LEU 9 11.266 1.594 -2.373
567 1HB LEU 9 HB2 LEU 9 13.699 3.342 -2.248
568 2HB LEU 9 HB1 LEU 9 12.287 3.925 -1.397
569 HG LEU 9 HG LEU 9 13.566 2.816 0.212
570 1HD1 LEU 9 HD12 LEU 9 11.219 1.978 0.297
571 2HD1 LEU 9 HD11 LEU 9 11.668 0.608 -0.703
572 3HD1 LEU 9 HD13 LEU 9 12.375 0.801 0.880
573 1HD2 LEU 9 HD21 LEU 9 15.143 1.825 -1.348
574 2HD2 LEU 9 HD23 LEU 9 14.615 0.627 -0.170
575 3HD2 LEU 9 HD22 LEU 9 13.963 0.602 -1.804
576 H ASN 10 HN ASN 10 12.426 3.598 -4.987
577 HA ASN 10 HA ASN 10 10.472 5.678 -4.665
578 1HB ASN 10 HB2 ASN 10 11.596 4.584 -7.292
579 2HB ASN 10 HB1 ASN 10 10.698 6.075 -7.109
580 1HD2 ASN 10 HD21 ASN 10 13.810 6.814 -4.784
581 2HD2 ASN 10 HD22 ASN 10 12.409 5.999 -4.292
582 H MET 11 HN MET 11 10.394 2.447 -5.965
583 HA MET 11 HA MET 11 7.844 2.683 -7.239
584 1HB MET 11 HB2 MET 11 9.382 0.653 -7.453
585 2HB MET 11 HB1 MET 11 8.941 0.222 -5.808
586 1HG MET 11 HG2 MET 11 7.587 -0.995 -7.463
587 2HG MET 11 HG1 MET 11 6.636 -0.029 -6.375
588 1HE MET 11 HE3 MET 11 8.377 -0.371 -9.504
589 2HE MET 11 HE2 MET 11 7.172 -0.077 -10.737
590 3HE MET 11 HE1 MET 11 8.221 1.247 -10.183
591 H ALA 12 HN ALA 12 8.881 1.856 -3.982
592 HA ALA 12 HA ALA 12 6.290 1.360 -2.918
593 1HB ALA 12 HB2 ALA 12 8.367 0.893 -1.599
594 2HB ALA 12 HB1 ALA 12 8.649 2.622 -1.453
595 3HB ALA 12 HB3 ALA 12 7.247 1.901 -0.695
596 NH1 ARG 13 NH2 ARG 13 7.070 7.767 -0.028
597 NH2 ARG 13 NH1 ARG 13 4.948 8.534 0.504
598 H ARG 13 HN ARG 13 8.039 4.333 -3.505
599 HA ARG 13 HA ARG 13 6.241 5.998 -2.035
600 1HB ARG 13 HB2 ARG 13 8.353 7.005 -2.767
601 2HB ARG 13 HB1 ARG 13 8.040 6.584 -4.431
602 1HG ARG 13 HG2 ARG 13 7.677 8.903 -4.284
603 2HG ARG 13 HG1 ARG 13 6.091 8.213 -4.440
604 1HD ARG 13 HD2 ARG 13 7.393 9.314 -1.905
605 2HD ARG 13 HD1 ARG 13 6.003 9.956 -2.756
606 HE ARG 13 HE ARG 13 4.853 7.746 -2.072
607 1HH1 ARG 13 HH22 ARG 13 7.750 7.498 -0.715
608 2HH1 ARG 13 HH21 ARG 13 7.341 7.712 0.937
609 1HH2 ARG 13 HH12 ARG 13 4.039 8.843 0.215
610 2HH2 ARG 13 HH11 ARG 13 5.134 8.508 1.494
611 H PHE 14 HN PHE 14 6.304 4.790 -5.349
612 HA PHE 14 HA PHE 14 4.013 6.304 -6.202
613 1HB PHE 14 HB2 PHE 14 4.854 3.573 -7.215
614 2HB PHE 14 HB1 PHE 14 3.873 4.759 -8.064
615 HD1 PHE 14 HD2 PHE 14 5.627 7.224 -7.066
616 HD2 PHE 14 HD1 PHE 14 6.511 3.476 -8.889
617 HE1 PHE 14 HE2 PHE 14 7.680 8.168 -7.998
618 HE2 PHE 14 HE1 PHE 14 8.581 4.429 -9.827
619 HZ PHE 14 HZ PHE 14 9.165 6.778 -9.383
620 H ILE 15 HN ILE 15 4.377 3.095 -4.805
621 HA ILE 15 HA ILE 15 1.604 2.426 -5.009
622 HB ILE 15 HB ILE 15 3.658 1.564 -2.913
623 1HG1 ILE 15 HG12 ILE 15 2.878 0.240 -5.537
624 2HG1 ILE 15 HG11 ILE 15 4.314 1.210 -5.367
625 1HG2 ILE 15 HG22 ILE 15 1.271 0.968 -2.365
626 2HG2 ILE 15 HG21 ILE 15 1.118 0.196 -3.925
627 3HG2 ILE 15 HG23 ILE 15 2.194 -0.475 -2.711
628 1HD1 ILE 15 HD2 ILE 15 5.136 -0.300 -3.590
629 2HD1 ILE 15 HD1 ILE 15 3.731 -1.329 -3.789
630 3HD1 ILE 15 HD3 ILE 15 4.881 -1.150 -5.098
631 NH1 ARG 16 NH2 ARG 16 1.553 2.361 -0.299
632 NH2 ARG 16 NH1 ARG 16 3.627 1.347 -0.501
633 H ARG 16 HN ARG 16 3.458 4.481 -2.982
634 HA ARG 16 HA ARG 16 1.471 4.700 -0.868
635 1HB ARG 16 HB2 ARG 16 4.137 5.595 -1.283
636 2HB ARG 16 HB1 ARG 16 3.143 7.040 -1.245
637 1HG ARG 16 HG2 ARG 16 3.918 6.385 1.050
638 2HG ARG 16 HG1 ARG 16 2.176 6.440 0.839
639 1HD ARG 16 HD2 ARG 16 3.527 4.343 1.900
640 2HD ARG 16 HD1 ARG 16 1.914 4.231 1.220
641 HE ARG 16 HE ARG 16 4.286 3.822 -0.548
642 1HH1 ARG 16 HH22 ARG 16 0.986 3.175 -0.137
643 2HH1 ARG 16 HH21 ARG 16 1.061 1.505 -0.472
644 1HH2 ARG 16 HH12 ARG 16 4.627 1.418 -0.474
645 2HH2 ARG 16 HH11 ARG 16 3.226 0.446 -0.695
646 H SER 17 HN SER 17 2.371 6.451 -3.765
647 HA SER 17 HA SER 17 0.491 8.555 -3.459
648 1HB SER 17 HB2 SER 17 1.428 7.267 -6.080
649 2HB SER 17 HB1 SER 17 0.961 8.960 -5.821
650 HG SER 17 HG1 SER 17 3.312 7.746 -5.267
651 H GLN 18 HN GLN 18 0.336 5.308 -4.822
652 HA GLN 18 HA GLN 18 -2.307 5.416 -5.827
653 1HB GLN 18 HB2 GLN 18 -1.043 3.034 -4.371
654 2HB GLN 18 HB1 GLN 18 -2.459 2.987 -5.389
655 1HG GLN 18 HG2 GLN 18 0.169 3.987 -6.486
656 2HG GLN 18 HG1 GLN 18 -0.281 2.283 -6.520
657 1HE2 GLN 18 HE21 GLN 18 -2.842 2.728 -8.931
658 2HE2 GLN 18 HE22 GLN 18 -2.207 1.690 -7.748
659 H THR 19 HN THR 19 -1.113 4.730 -2.593
660 HA THR 19 HA THR 19 -3.595 4.152 -1.381
661 HB THR 19 HB THR 19 -1.368 5.718 0.050
662 HG1 THR 19 HG1 THR 19 -1.171 3.495 -1.485
663 1HG2 THR 19 HG21 THR 19 -2.995 3.220 0.788
664 2HG2 THR 19 HG23 THR 19 -1.890 4.082 1.844
665 3HG2 THR 19 HG22 THR 19 -3.383 4.839 1.339
666 H LEU 20 HN LEU 20 -1.903 7.248 -1.674
667 HA LEU 20 HA LEU 20 -3.892 8.827 -0.470
668 1HB LEU 20 HB2 LEU 20 -1.553 9.566 -1.122
669 2HB LEU 20 HB1 LEU 20 -2.114 9.659 -2.785
670 HG LEU 20 HG LEU 20 -3.886 11.310 -2.038
671 1HD1 LEU 20 HD11 LEU 20 -2.299 11.243 0.568
672 2HD1 LEU 20 HD13 LEU 20 -3.575 12.385 0.186
673 3HD1 LEU 20 HD12 LEU 20 -3.949 10.689 0.386
674 1HD2 LEU 20 HD22 LEU 20 -0.995 12.073 -1.473
675 2HD2 LEU 20 HD21 LEU 20 -1.759 12.062 -3.054
676 3HD2 LEU 20 HD23 LEU 20 -2.297 13.199 -1.829
677 H THR 21 HN THR 21 -3.553 7.789 -3.838
678 HA THR 21 HA THR 21 -5.674 9.411 -4.823
679 HB THR 21 HB THR 21 -4.832 6.672 -5.926
680 HG1 THR 21 HG1 THR 21 -2.926 7.607 -5.856
681 1HG2 THR 21 HG21 THR 21 -5.445 9.397 -7.227
682 2HG2 THR 21 HG23 THR 21 -5.179 7.884 -8.085
683 3HG2 THR 21 HG22 THR 21 -6.638 8.115 -7.131
684 H LEU 22 HN LEU 22 -5.602 6.302 -3.159
685 HA LEU 22 HA LEU 22 -8.416 5.827 -3.789
686 1HB LEU 22 HB2 LEU 22 -6.798 4.716 -1.469
687 2HB LEU 22 HB1 LEU 22 -8.350 4.118 -2.011
688 HG LEU 22 HG LEU 22 -5.671 3.937 -3.420
689 1HD1 LEU 22 HD12 LEU 22 -6.274 2.149 -1.845
690 2HD1 LEU 22 HD11 LEU 22 -7.782 1.880 -2.703
691 3HD1 LEU 22 HD13 LEU 22 -6.252 1.540 -3.495
692 1HD2 LEU 22 HD22 LEU 22 -8.394 3.399 -4.686
693 2HD2 LEU 22 HD21 LEU 22 -7.287 4.679 -5.165
694 3HD2 LEU 22 HD23 LEU 22 -6.836 3.010 -5.399
695 H LEU 23 HN LEU 23 -6.566 7.304 -1.186
696 HA LEU 23 HA LEU 23 -8.583 7.687 0.698
697 1HB LEU 23 HB2 LEU 23 -6.286 8.584 1.084
698 2HB LEU 23 HB1 LEU 23 -6.509 9.749 -0.202
699 HG LEU 23 HG LEU 23 -8.470 10.730 1.087
700 1HD1 LEU 23 HD12 LEU 23 -8.871 8.772 2.545
701 2HD1 LEU 23 HD11 LEU 23 -7.324 9.026 3.324
702 3HD1 LEU 23 HD13 LEU 23 -8.588 10.230 3.486
703 1HD2 LEU 23 HD22 LEU 23 -5.714 10.845 2.336
704 2HD2 LEU 23 HD21 LEU 23 -6.293 11.813 0.998
705 3HD2 LEU 23 HD23 LEU 23 -7.005 12.009 2.589
706 H GLU 24 HN GLU 24 -7.759 9.632 -2.055
707 HA GLU 24 HA GLU 24 -9.675 11.636 -1.917
708 1HB GLU 24 HB2 GLU 24 -7.801 11.532 -3.562
709 2HB GLU 24 HB1 GLU 24 -8.590 10.184 -4.341
710 1HG GLU 24 HG2 GLU 24 -10.556 11.780 -4.816
711 2HG GLU 24 HG1 GLU 24 -9.513 13.071 -4.238
712 H LYS 25 HN LYS 25 -9.933 8.833 -4.006
713 HA LYS 25 HA LYS 25 -12.714 9.283 -4.492
714 1HB LYS 25 HB2 LYS 25 -10.903 6.910 -4.958
715 2HB LYS 25 HB1 LYS 25 -12.632 6.777 -5.239
716 1HG LYS 25 HG2 LYS 25 -11.705 7.458 -7.343
717 2HG LYS 25 HG1 LYS 25 -12.485 8.867 -6.689
718 1HD LYS 25 HD2 LYS 25 -9.982 9.397 -5.784
719 2HD LYS 25 HD1 LYS 25 -9.559 8.312 -7.085
720 1HE LYS 25 HE2 LYS 25 -9.634 10.585 -7.983
721 2HE LYS 25 HE1 LYS 25 -11.017 9.716 -8.622
722 1HZ LYS 25 HZ1 LYS 25 -11.755 10.870 -6.171
723 2HZ LYS 25 HZ3 LYS 25 -11.011 12.050 -7.098
724 3HZ LYS 25 HZ2 LYS 25 -12.364 11.225 -7.679
725 H LEU 26 HN LEU 26 -11.221 7.759 -1.797
726 HA LEU 26 HA LEU 26 -13.632 6.205 -1.193
727 1HB LEU 26 HB2 LEU 26 -11.181 6.941 0.466
728 2HB LEU 26 HB1 LEU 26 -12.496 5.974 1.102
729 HG LEU 26 HG LEU 26 -10.989 5.208 -1.453
730 1HD1 LEU 26 HD11 LEU 26 -10.536 4.221 1.392
731 2HD1 LEU 26 HD13 LEU 26 -9.736 3.595 -0.038
732 3HD1 LEU 26 HD12 LEU 26 -9.424 5.238 0.494
733 1HD2 LEU 26 HD22 LEU 26 -12.786 3.590 0.388
734 2HD2 LEU 26 HD21 LEU 26 -13.220 4.166 -1.209
735 3HD2 LEU 26 HD23 LEU 26 -11.946 2.982 -1.025
736 H ASN 27 HN ASN 27 -12.239 9.318 -0.626
737 HA ASN 27 HA ASN 27 -14.090 10.080 1.466
738 1HB ASN 27 HB2 ASN 27 -12.648 11.861 -0.568
739 2HB ASN 27 HB1 ASN 27 -13.497 12.436 0.849
740 1HD2 ASN 27 HD21 ASN 27 -10.663 10.196 2.474
741 2HD2 ASN 27 HD22 ASN 27 -12.135 9.585 1.899
742 H GLU 28 HN GLU 28 -13.950 10.269 -2.023
743 HA GLU 28 HA GLU 28 -16.435 11.672 -2.332
744 1HB GLU 28 HB2 GLU 28 -15.084 9.737 -4.243
745 2HB GLU 28 HB1 GLU 28 -16.297 10.921 -4.686
746 1HG GLU 28 HG2 GLU 28 -14.833 12.771 -4.017
747 2HG GLU 28 HG1 GLU 28 -13.585 11.650 -3.498
748 H LEU 29 HN LEU 29 -15.552 8.382 -1.835
749 HA LEU 29 HA LEU 29 -18.269 7.450 -2.469
750 1HB LEU 29 HB2 LEU 29 -16.159 6.166 -3.092
751 2HB LEU 29 HB1 LEU 29 -15.864 5.943 -1.382
752 HG LEU 29 HG LEU 29 -17.770 4.486 -1.117
753 1HD1 LEU 29 HD11 LEU 29 -18.481 5.173 -4.015
754 2HD1 LEU 29 HD13 LEU 29 -19.317 4.007 -3.000
755 3HD1 LEU 29 HD12 LEU 29 -19.389 5.707 -2.607
756 1HD2 LEU 29 HD21 LEU 29 -15.744 3.510 -2.150
757 2HD2 LEU 29 HD23 LEU 29 -17.198 2.712 -2.735
758 3HD2 LEU 29 HD22 LEU 29 -16.369 3.886 -3.748
759 H ASP 30 HN ASP 30 -17.311 9.194 -0.119
760 HA ASP 30 HA ASP 30 -17.778 9.485 2.120
761 1HB ASP 30 HB2 ASP 30 -20.154 7.736 1.353
762 2HB ASP 30 HB1 ASP 30 -20.014 8.585 2.884
763 H ALA 31 HN ALA 31 -16.321 7.004 1.236
764 HA ALA 31 HA ALA 31 -16.913 5.150 3.458
765 1HB ALA 31 HB2 ALA 31 -16.210 4.256 1.216
766 2HB ALA 31 HB1 ALA 31 -14.666 5.087 1.384
767 3HB ALA 31 HB3 ALA 31 -15.103 3.790 2.494
768 H ASP 32 HN ASP 32 -16.503 6.617 5.118
769 HA ASP 32 HA ASP 32 -14.056 8.115 5.299
770 1HB ASP 32 HB2 ASP 32 -14.703 8.631 7.584
771 2HB ASP 32 HB1 ASP 32 -16.163 8.684 6.597
772 H GLU 33 HN GLU 33 -15.108 5.055 6.755
773 HA GLU 33 HA GLU 33 -12.750 4.742 8.330
774 1HB GLU 33 HB2 GLU 33 -14.744 3.281 8.628
775 2HB GLU 33 HB1 GLU 33 -14.508 2.613 7.026
776 1HG GLU 33 HG2 GLU 33 -12.230 1.808 7.809
777 2HG GLU 33 HG1 GLU 33 -12.768 2.216 9.442
778 H GLN 34 HN GLN 34 -13.648 3.566 5.155
779 HA GLN 34 HA GLN 34 -11.144 2.322 4.595
780 1HB GLN 34 HB2 GLN 34 -12.875 3.763 2.553
781 2HB GLN 34 HB1 GLN 34 -11.775 2.426 2.248
782 1HG GLN 34 HG2 GLN 34 -14.350 2.264 3.870
783 2HG GLN 34 HG1 GLN 34 -14.020 1.500 2.323
784 1HE2 GLN 34 HE21 GLN 34 -12.480 -0.054 5.768
785 2HE2 GLN 34 HE22 GLN 34 -13.233 1.452 5.762
786 H ALA 35 HN ALA 35 -12.195 5.631 4.389
787 HA ALA 35 HA ALA 35 -9.907 6.504 2.907
788 1HB ALA 35 HB1 ALA 35 -11.641 8.058 4.886
789 2HB ALA 35 HB3 ALA 35 -10.524 8.792 3.769
790 3HB ALA 35 HB2 ALA 35 -11.936 7.936 3.160
791 H ASP 36 HN ASP 36 -10.529 6.833 6.400
792 HA ASP 36 HA ASP 36 -7.911 7.831 6.934
793 1HB ASP 36 HB2 ASP 36 -9.488 7.990 8.750
794 2HB ASP 36 HB1 ASP 36 -9.786 6.247 8.721
795 H ILE 37 HN ILE 37 -9.150 4.583 7.462
796 HA ILE 37 HA ILE 37 -6.699 3.443 8.167
797 HB ILE 37 HB ILE 37 -8.934 2.119 6.572
798 1HG1 ILE 37 HG12 ILE 37 -8.456 2.597 9.553
799 2HG1 ILE 37 HG11 ILE 37 -9.827 3.140 8.620
800 1HG2 ILE 37 HG22 ILE 37 -6.793 0.829 6.656
801 2HG2 ILE 37 HG21 ILE 37 -6.786 0.967 8.404
802 3HG2 ILE 37 HG23 ILE 37 -8.032 0.027 7.589
803 1HD1 ILE 37 HD3 ILE 37 -10.499 0.758 8.233
804 2HD1 ILE 37 HD2 ILE 37 -9.190 0.236 9.282
805 3HD1 ILE 37 HD1 ILE 37 -10.491 1.208 9.930
806 H CYS 38 HN CYS 38 -7.944 4.214 4.933
807 HA CYS 38 HA CYS 38 -5.978 2.692 3.522
808 1HB CYS 38 HB2 CYS 38 -7.806 3.825 2.304
809 2HB CYS 38 HB1 CYS 38 -7.182 5.386 2.782
810 HG CYS 38 HG1 CYS 38 -5.479 5.288 0.971
811 H GLU 39 HN GLU 39 -5.990 6.056 4.679
812 HA GLU 39 HA GLU 39 -3.230 6.311 3.920
813 1HB GLU 39 HB2 GLU 39 -5.041 8.018 5.632
814 2HB GLU 39 HB1 GLU 39 -3.403 8.492 5.185
815 1HG GLU 39 HG2 GLU 39 -5.604 7.756 3.198
816 2HG GLU 39 HG1 GLU 39 -5.071 9.391 3.577
817 H SER 40 HN SER 40 -4.726 4.897 6.640
818 HA SER 40 HA SER 40 -2.522 5.494 8.445
819 1HB SER 40 HB2 SER 40 -4.305 2.995 8.444
820 2HB SER 40 HB1 SER 40 -3.448 3.688 9.828
821 HG SER 40 HG1 SER 40 -5.025 5.563 8.597
822 H LEU 41 HN LEU 41 -3.398 3.308 5.936
823 HA LEU 41 HA LEU 41 -1.121 1.545 6.250
824 1HB LEU 41 HB2 LEU 41 -3.501 1.281 4.955
825 2HB LEU 41 HB1 LEU 41 -2.585 1.957 3.632
826 HG LEU 41 HG LEU 41 -2.636 -0.472 3.458
827 1HD1 LEU 41 HD12 LEU 41 -0.598 0.664 2.648
828 2HD1 LEU 41 HD11 LEU 41 0.143 0.449 4.228
829 3HD1 LEU 41 HD13 LEU 41 -0.247 -0.945 3.253
830 1HD2 LEU 41 HD21 LEU 41 -2.901 -1.030 5.843
831 2HD2 LEU 41 HD23 LEU 41 -1.547 -1.904 5.157
832 3HD2 LEU 41 HD22 LEU 41 -1.258 -0.509 6.173
833 H HIS 42 HN HIS 42 -1.956 4.456 4.510
834 HA HIS 42 HA HIS 42 0.202 4.595 2.715
835 1HB HIS 42 HB2 HIS 42 -1.610 6.259 2.779
836 2HB HIS 42 HB1 HIS 42 -1.009 6.919 4.289
837 HD1 HIS 42 HD1 HIS 42 -1.213 7.996 1.201
838 HD2 HIS 42 HD2 HIS 42 2.155 7.470 3.467
839 HE1 HIS 42 HE1 HIS 42 0.523 9.433 0.209
840 H ASP 43 HN ASP 43 0.056 5.981 5.975
841 HA ASP 43 HA ASP 43 2.749 6.811 6.049
842 1HB ASP 43 HB2 ASP 43 1.111 7.397 7.854
843 2HB ASP 43 HB1 ASP 43 1.305 5.753 8.489
844 H HIS 44 HN HIS 44 1.525 3.709 7.410
845 HA HIS 44 HA HIS 44 4.147 2.883 8.143
846 1HB HIS 44 HB2 HIS 44 1.734 1.206 7.417
847 2HB HIS 44 HB1 HIS 44 3.253 0.527 8.002
848 HD1 HIS 44 HD1 HIS 44 3.978 2.234 10.299
849 HD2 HIS 44 HD2 HIS 44 0.051 1.347 9.558
850 HE1 HIS 44 HE1 HIS 44 2.786 2.573 12.412
851 H ALA 45 HN ALA 45 2.352 2.608 5.214
852 HA ALA 45 HA ALA 45 4.253 0.847 3.924
853 1HB ALA 45 HB2 ALA 45 1.880 1.136 3.041
854 2HB ALA 45 HB1 ALA 45 2.272 2.790 2.668
855 3HB ALA 45 HB3 ALA 45 3.110 1.478 1.846
856 H ASP 46 HN ASP 46 4.070 4.108 4.691
857 HA ASP 46 HA ASP 46 6.069 4.920 2.687
858 1HB ASP 46 HB2 ASP 46 4.086 6.388 3.427
859 2HB ASP 46 HB1 ASP 46 4.887 6.557 4.972
860 H GLU 47 HN GLU 47 5.825 3.783 5.962
861 HA GLU 47 HA GLU 47 8.296 4.899 6.931
862 1HB GLU 47 HB2 GLU 47 7.025 2.199 7.534
863 2HB GLU 47 HB1 GLU 47 8.366 2.860 8.434
864 1HG GLU 47 HG2 GLU 47 7.049 4.713 9.244
865 2HG GLU 47 HG1 GLU 47 5.681 4.271 8.226
866 H LEU 48 HN LEU 48 7.378 1.916 5.365
867 HA LEU 48 HA LEU 48 9.906 0.752 4.989
868 1HB LEU 48 HB2 LEU 48 7.600 0.806 2.999
869 2HB LEU 48 HB1 LEU 48 8.961 -0.293 2.922
870 HG LEU 48 HG LEU 48 7.066 -0.165 5.313
871 1HD1 LEU 48 HD12 LEU 48 5.875 -0.930 3.247
872 2HD1 LEU 48 HD11 LEU 48 7.124 -2.140 2.984
873 3HD1 LEU 48 HD13 LEU 48 6.082 -2.242 4.395
874 1HD2 LEU 48 HD22 LEU 48 9.156 -2.206 4.417
875 2HD2 LEU 48 HD21 LEU 48 9.329 -1.112 5.781
876 3HD2 LEU 48 HD23 LEU 48 8.100 -2.357 5.803
877 OH TYR 49 OH TYR 49 11.610 8.474 -2.183
878 H TYR 49 HN TYR 49 8.454 3.484 3.476
879 HA TYR 49 HA TYR 49 10.488 3.538 1.365
880 1HB TYR 49 HB2 TYR 49 8.240 4.377 0.829
881 2HB TYR 49 HB1 TYR 49 8.358 5.563 2.115
882 HD1 TYR 49 HD1 TYR 49 10.032 4.420 -0.957
883 HD2 TYR 49 HD2 TYR 49 9.399 7.686 1.678
884 HE1 TYR 49 HE1 TYR 49 11.197 5.893 -2.522
885 HE2 TYR 49 HE2 TYR 49 10.561 9.170 0.127
886 HH TYR 49 HH TYR 49 12.453 8.082 -2.427
887 NH1 ARG 50 NH1 ARG 50 5.490 8.498 6.322
888 NH2 ARG 50 NH2 ARG 50 6.161 6.791 7.720
889 H ARG 50 HN ARG 50 9.497 6.143 3.473
890 HA ARG 50 HA ARG 50 11.585 7.780 3.452
891 1HB ARG 50 HB2 ARG 50 9.995 6.899 5.900
892 2HB ARG 50 HB1 ARG 50 11.031 8.318 5.899
893 1HG ARG 50 HG2 ARG 50 9.725 9.427 4.261
894 2HG ARG 50 HG1 ARG 50 8.892 7.964 3.797
895 1HD ARG 50 HD2 ARG 50 8.621 9.273 6.552
896 2HD ARG 50 HD1 ARG 50 7.483 9.484 5.226
897 HE ARG 50 HE ARG 50 7.922 6.684 5.812
898 1HH1 ARG 50 HH12 ARG 50 5.661 9.097 5.536
899 2HH1 ARG 50 HH11 ARG 50 4.612 8.599 6.800
900 1HH2 ARG 50 HH22 ARG 50 6.834 6.109 8.013
901 2HH2 ARG 50 HH21 ARG 50 5.296 6.821 8.234
902 H SER 51 HN SER 51 11.727 6.167 6.533
903 HA SER 51 HA SER 51 14.401 6.774 6.913
904 1HB SER 51 HB2 SER 51 13.026 4.285 7.989
905 2HB SER 51 HB1 SER 51 14.228 5.311 8.799
906 HG SER 51 HG1 SER 51 12.739 6.656 9.264
907 H CYS 52 HN CYS 52 13.008 3.885 5.443
908 HA CYS 52 HA CYS 52 15.611 2.636 5.187
909 1HB CYS 52 HB2 CYS 52 13.117 2.254 3.522
910 2HB CYS 52 HB1 CYS 52 14.416 1.121 3.578
911 HG CYS 52 HG1 CYS 52 13.564 0.199 5.763
912 H LEU 53 HN LEU 53 13.880 4.977 3.222
913 HA LEU 53 HA LEU 53 15.451 4.262 0.971
914 1HB LEU 53 HB2 LEU 53 13.311 5.678 0.837
915 2HB LEU 53 HB1 LEU 53 14.100 6.946 1.738
916 HG LEU 53 HG LEU 53 13.782 7.270 -0.792
917 1HD1 LEU 53 HD12 LEU 53 15.241 8.762 0.514
918 2HD1 LEU 53 HD11 LEU 53 16.602 7.681 0.318
919 3HD1 LEU 53 HD13 LEU 53 15.911 8.470 -1.076
920 1HD2 LEU 53 HD22 LEU 53 16.138 5.355 -0.879
921 2HD2 LEU 53 HD21 LEU 53 14.531 5.063 -1.512
922 3HD2 LEU 53 HD23 LEU 53 15.539 6.301 -2.233
923 H ALA 54 HN ALA 54 15.807 6.183 3.725
924 HA ALA 54 HA ALA 54 17.926 7.876 3.318
925 1HB ALA 54 HB2 ALA 54 17.008 7.332 5.598
926 2HB ALA 54 HB1 ALA 54 17.909 5.823 5.501
927 3HB ALA 54 HB3 ALA 54 18.776 7.335 5.553
928 NH1 ARG 55 NH1 ARG 55 22.885 5.234 6.942
929 NH2 ARG 55 NH2 ARG 55 24.326 6.026 5.308
930 H ARG 55 HN ARG 55 18.207 4.393 3.729
931 HA ARG 55 HA ARG 55 20.986 4.603 2.641
932 1HB ARG 55 HB2 ARG 55 20.496 3.718 5.123
933 2HB ARG 55 HB1 ARG 55 19.955 2.297 4.305
934 1HG ARG 55 HG2 ARG 55 22.344 2.020 4.896
935 2HG ARG 55 HG1 ARG 55 22.102 1.989 3.161
936 1HD ARG 55 HD2 ARG 55 23.978 3.550 4.261
937 2HD ARG 55 HD1 ARG 55 23.070 4.145 2.872
938 HE ARG 55 HE ARG 55 21.561 5.275 4.590
939 1HH1 ARG 55 HH12 ARG 55 22.041 4.745 7.199
940 2HH1 ARG 55 HH11 ARG 55 23.452 5.596 7.686
941 1HH2 ARG 55 HH22 ARG 55 24.567 6.130 4.344
942 2HH2 ARG 55 HH21 ARG 55 24.943 6.419 5.996
943 H PHE 56 HN PHE 56 18.446 2.483 3.203
944 HA PHE 56 HA PHE 56 17.116 1.665 1.156
945 1HB PHE 56 HB2 PHE 56 19.230 1.178 -0.294
946 2HB PHE 56 HB1 PHE 56 19.740 0.031 0.950
947 HD1 PHE 56 HD1 PHE 56 16.985 0.856 -1.428
948 HD2 PHE 56 HD2 PHE 56 18.676 -2.107 1.116
949 HE1 PHE 56 HE1 PHE 56 15.458 -0.828 -2.346
950 HE2 PHE 56 HE2 PHE 56 17.155 -3.778 0.200
951 HZ PHE 56 HZ PHE 56 15.529 -3.145 -1.541
952 H GLY 57 HN GLY 57 16.267 1.468 3.248
953 1HA GLY 57 HA2 GLY 57 15.448 -0.334 4.726
954 2HA GLY 57 HA1 GLY 57 16.982 -1.169 4.506
955 H ASP 58 HN ASP 58 18.932 0.239 5.234
956 HA ASP 58 HA ASP 58 18.528 0.807 8.037
957 1HB ASP 58 HB2 ASP 58 20.804 0.184 7.276
958 2HB ASP 58 HB1 ASP 58 20.851 1.592 6.224
959 H ASP 59 HN ASP 59 18.726 2.842 9.037
960 HA ASP 59 HA ASP 59 17.619 5.045 7.369
961 1HB ASP 59 HB2 ASP 59 16.230 4.371 9.318
962 2HB ASP 59 HB1 ASP 59 17.580 4.671 10.402
963 H GLY 60 HN GLY 60 18.816 6.028 10.361
964 1HA GLY 60 HA2 GLY 60 21.014 7.430 9.035
965 2HA GLY 60 HA1 GLY 60 20.550 7.572 10.747
966 H GLU 61 HN GLU 61 23.116 7.009 9.397
967 HA GLU 61 HA GLU 61 24.388 4.760 9.236
968 1HB GLU 61 HB2 GLU 61 25.372 6.505 11.505
969 2HB GLU 61 HB1 GLU 61 26.302 5.667 10.277
970 1HG GLU 61 HG2 GLU 61 24.581 8.150 9.913
971 2HG GLU 61 HG1 GLU 61 26.318 7.993 9.687
972 H ASN 62 HN ASN 62 23.083 2.998 10.088
973 HA ASN 62 HA ASN 62 23.726 2.516 12.988
974 1HB ASN 62 HB2 ASN 62 21.188 2.638 12.305
975 2HB ASN 62 HB1 ASN 62 21.528 1.127 11.457
976 1HD2 ASN 62 HD21 ASN 62 22.131 -0.748 14.479
977 2HD2 ASN 62 HD22 ASN 62 22.615 -0.658 12.865
978 H LEU 63 HN LEU 63 24.409 0.344 13.390
979 HA LEU 63 HA LEU 63 24.819 -1.447 11.128
980 1HB LEU 63 HB2 LEU 63 27.238 -1.582 11.353
981 2HB LEU 63 HB1 LEU 63 26.839 0.084 11.005
982 HG LEU 63 HG LEU 63 27.403 -1.001 13.813
983 1HD1 LEU 63 HD11 LEU 63 29.209 0.538 11.902
984 2HD1 LEU 63 HD13 LEU 63 29.612 0.106 13.558
985 3HD1 LEU 63 HD12 LEU 63 29.390 -1.151 12.354
986 1HD2 LEU 63 HD22 LEU 63 27.243 1.874 12.784
987 2HD2 LEU 63 HD21 LEU 63 26.072 1.113 13.851
988 3HD2 LEU 63 HD23 LEU 63 27.698 1.391 14.412
Start of MODEL 10
Raw file had 988 H/Q atoms
Start of MODEL 10
1 1H MET 1 HT1 MET 1 -20.649 -0.676 -1.444
2 2H MET 1 HT3 MET 1 -21.157 0.831 -0.840
3 3H MET 1 HT2 MET 1 -20.073 -0.101 0.054
4 HA MET 1 HA MET 1 -21.689 -1.161 1.065
5 1HB MET 1 HB2 MET 1 -22.914 1.119 0.523
6 2HB MET 1 HB1 MET 1 -23.726 0.235 -0.745
7 1HG MET 1 HG2 MET 1 -23.738 -0.447 2.188
8 2HG MET 1 HG1 MET 1 -25.042 0.300 1.317
9 1HE MET 1 HE3 MET 1 -26.632 -0.599 -0.017
10 2HE MET 1 HE2 MET 1 -25.727 -1.446 -1.286
11 3HE MET 1 HE1 MET 1 -26.968 -2.278 -0.349
12 H THR 2 HN THR 2 -22.854 -0.663 -2.166
13 HA THR 2 HA THR 2 -23.884 -3.303 -2.556
14 HB THR 2 HB THR 2 -23.294 -1.325 -4.793
15 HG1 THR 2 HG1 THR 2 -24.047 0.113 -3.447
16 1HG2 THR 2 HG22 THR 2 -24.854 -3.426 -5.053
17 2HG2 THR 2 HG21 THR 2 -25.853 -2.724 -3.792
18 3HG2 THR 2 HG23 THR 2 -25.677 -1.900 -5.332
19 H LYS 3 HN LYS 3 -22.910 -3.540 -5.324
20 HA LYS 3 HA LYS 3 -20.392 -4.926 -4.679
21 1HB LYS 3 HB2 LYS 3 -22.198 -6.078 -6.002
22 2HB LYS 3 HB1 LYS 3 -21.990 -4.884 -7.271
23 1HG LYS 3 HG2 LYS 3 -19.500 -6.235 -6.378
24 2HG LYS 3 HG1 LYS 3 -20.636 -7.258 -7.233
25 1HD LYS 3 HD2 LYS 3 -20.680 -5.779 -9.123
26 2HD LYS 3 HD1 LYS 3 -19.768 -4.534 -8.295
27 1HE LYS 3 HE2 LYS 3 -17.874 -6.266 -8.066
28 2HE LYS 3 HE1 LYS 3 -18.792 -7.276 -9.179
29 1HZ LYS 3 HZ1 LYS 3 -18.648 -4.693 -10.228
30 2HZ LYS 3 HZ3 LYS 3 -17.101 -5.140 -9.727
31 3HZ LYS 3 HZ2 LYS 3 -17.943 -6.117 -10.847
32 H GLN 4 HN GLN 4 -21.566 -2.224 -6.495
33 HA GLN 4 HA GLN 4 -19.362 -1.749 -8.203
34 1HB GLN 4 HB2 GLN 4 -21.139 0.301 -6.797
35 2HB GLN 4 HB1 GLN 4 -20.046 0.684 -8.110
36 1HG GLN 4 HG2 GLN 4 -22.251 0.413 -9.086
37 2HG GLN 4 HG1 GLN 4 -21.334 -1.018 -9.532
38 1HE2 GLN 4 HE21 GLN 4 -24.426 -1.351 -6.858
39 2HE2 GLN 4 HE22 GLN 4 -23.764 0.174 -7.190
40 H GLU 5 HN GLU 5 -19.965 -0.280 -5.096
41 HA GLU 5 HA GLU 5 -17.467 0.991 -4.819
42 1HB GLU 5 HB2 GLU 5 -18.837 -0.289 -2.421
43 2HB GLU 5 HB1 GLU 5 -17.928 1.193 -2.491
44 1HG GLU 5 HG2 GLU 5 -20.005 2.151 -2.460
45 2HG GLU 5 HG1 GLU 5 -19.830 1.954 -4.197
46 H LYS 6 HN LYS 6 -18.465 -2.328 -4.024
47 HA LYS 6 HA LYS 6 -15.972 -3.050 -2.821
48 1HB LYS 6 HB2 LYS 6 -17.920 -4.771 -4.414
49 2HB LYS 6 HB1 LYS 6 -16.515 -5.408 -3.601
50 1HG LYS 6 HG2 LYS 6 -17.362 -4.587 -1.424
51 2HG LYS 6 HG1 LYS 6 -18.768 -3.890 -2.208
52 1HD LYS 6 HD2 LYS 6 -19.430 -6.209 -2.946
53 2HD LYS 6 HD1 LYS 6 -17.965 -6.838 -2.218
54 1HE LYS 6 HE2 LYS 6 -19.913 -7.146 -0.691
55 2HE LYS 6 HE1 LYS 6 -18.701 -6.105 0.026
56 1HZ LYS 6 HZ1 LYS 6 -20.484 -4.493 -1.422
57 2HZ LYS 6 HZ3 LYS 6 -21.378 -5.539 -0.445
58 3HZ LYS 6 HZ2 LYS 6 -20.212 -4.553 0.242
59 H THR 7 HN THR 7 -17.015 -2.782 -6.142
60 HA THR 7 HA THR 7 -14.717 -4.057 -7.279
61 HB THR 7 HB THR 7 -16.376 -1.802 -8.590
62 HG1 THR 7 HG1 THR 7 -17.850 -3.158 -7.850
63 1HG2 THR 7 HG21 THR 7 -15.178 -4.425 -9.665
64 2HG2 THR 7 HG23 THR 7 -15.989 -3.177 -10.611
65 3HG2 THR 7 HG22 THR 7 -14.426 -2.857 -9.886
66 H ALA 8 HN ALA 8 -15.462 -0.791 -6.145
67 HA ALA 8 HA ALA 8 -13.033 0.389 -7.156
68 1HB ALA 8 HB2 ALA 8 -14.890 1.805 -6.206
69 2HB ALA 8 HB1 ALA 8 -14.537 1.160 -4.607
70 3HB ALA 8 HB3 ALA 8 -13.347 2.141 -5.435
71 H LEU 9 HN LEU 9 -13.869 -1.520 -4.374
72 HA LEU 9 HA LEU 9 -11.393 -1.103 -2.925
73 1HB LEU 9 HB2 LEU 9 -13.775 -2.466 -2.415
74 2HB LEU 9 HB1 LEU 9 -12.629 -3.764 -2.665
75 HG LEU 9 HG LEU 9 -11.075 -2.612 -0.981
76 1HD1 LEU 9 HD12 LEU 9 -12.053 -0.321 -1.107
77 2HD1 LEU 9 HD11 LEU 9 -13.531 -0.934 -0.386
78 3HD1 LEU 9 HD13 LEU 9 -12.037 -0.951 0.527
79 1HD2 LEU 9 HD22 LEU 9 -13.838 -3.414 0.011
80 2HD2 LEU 9 HD21 LEU 9 -12.515 -4.522 -0.321
81 3HD2 LEU 9 HD23 LEU 9 -12.388 -3.371 0.995
82 H ASN 10 HN ASN 10 -12.320 -2.970 -5.684
83 HA ASN 10 HA ASN 10 -10.174 -4.874 -5.547
84 1HB ASN 10 HB2 ASN 10 -11.529 -3.707 -8.024
85 2HB ASN 10 HB1 ASN 10 -10.290 -4.921 -8.086
86 1HD2 ASN 10 HD21 ASN 10 -13.629 -6.184 -6.052
87 2HD2 ASN 10 HD22 ASN 10 -12.925 -4.704 -5.637
88 H MET 11 HN MET 11 -10.409 -1.553 -6.524
89 HA MET 11 HA MET 11 -7.897 -1.443 -7.892
90 1HB MET 11 HB2 MET 11 -9.686 0.413 -7.860
91 2HB MET 11 HB1 MET 11 -9.127 0.797 -6.239
92 1HG MET 11 HG2 MET 11 -6.850 1.155 -7.089
93 2HG MET 11 HG1 MET 11 -7.379 0.764 -8.702
94 1HE MET 11 HE3 MET 11 -9.276 1.812 -9.755
95 2HE MET 11 HE2 MET 11 -9.614 3.522 -9.767
96 3HE MET 11 HE1 MET 11 -8.106 2.923 -10.484
97 H ALA 12 HN ALA 12 -8.933 -0.897 -4.593
98 HA ALA 12 HA ALA 12 -6.364 -0.292 -3.510
99 1HB ALA 12 HB2 ALA 12 -8.482 0.015 -2.175
100 2HB ALA 12 HB1 ALA 12 -8.665 -1.733 -2.109
101 3HB ALA 12 HB3 ALA 12 -7.309 -0.968 -1.311
102 NH1 ARG 13 NH1 ARG 13 -9.452 -7.061 -7.258
103 NH2 ARG 13 NH2 ARG 13 -11.049 -8.392 -6.232
104 H ARG 13 HN ARG 13 -8.005 -3.245 -4.255
105 HA ARG 13 HA ARG 13 -6.276 -5.026 -2.854
106 1HB ARG 13 HB2 ARG 13 -8.482 -5.590 -4.068
107 2HB ARG 13 HB1 ARG 13 -7.527 -5.635 -5.546
108 1HG ARG 13 HG2 ARG 13 -5.984 -7.304 -4.375
109 2HG ARG 13 HG1 ARG 13 -7.224 -7.436 -3.135
110 1HD ARG 13 HD2 ARG 13 -7.450 -8.118 -6.097
111 2HD ARG 13 HD1 ARG 13 -7.815 -9.143 -4.713
112 HE ARG 13 HE ARG 13 -9.646 -7.321 -4.264
113 1HH1 ARG 13 HH12 ARG 13 -8.594 -6.542 -7.206
114 2HH1 ARG 13 HH11 ARG 13 -9.944 -7.073 -8.134
115 1HH2 ARG 13 HH22 ARG 13 -11.370 -8.869 -5.407
116 2HH2 ARG 13 HH21 ARG 13 -11.609 -8.456 -7.063
117 H PHE 14 HN PHE 14 -6.118 -3.507 -6.029
118 HA PHE 14 HA PHE 14 -3.832 -4.996 -6.920
119 1HB PHE 14 HB2 PHE 14 -4.503 -2.134 -7.659
120 2HB PHE 14 HB1 PHE 14 -3.522 -3.257 -8.584
121 HD1 PHE 14 HD2 PHE 14 -5.439 -5.730 -8.055
122 HD2 PHE 14 HD1 PHE 14 -6.052 -1.733 -9.389
123 HE1 PHE 14 HE2 PHE 14 -7.458 -6.438 -9.254
124 HE2 PHE 14 HE1 PHE 14 -8.079 -2.444 -10.590
125 HZ PHE 14 HZ PHE 14 -8.785 -4.798 -10.524
126 H ILE 15 HN ILE 15 -4.211 -2.070 -5.054
127 HA ILE 15 HA ILE 15 -1.475 -1.286 -5.105
128 HB ILE 15 HB ILE 15 -3.440 -1.008 -2.774
129 1HG1 ILE 15 HG12 ILE 15 -3.014 0.719 -5.255
130 2HG1 ILE 15 HG11 ILE 15 -4.462 -0.174 -4.866
131 1HG2 ILE 15 HG22 ILE 15 -1.120 -0.473 -2.234
132 2HG2 ILE 15 HG21 ILE 15 -1.028 0.662 -3.573
133 3HG2 ILE 15 HG23 ILE 15 -2.077 0.984 -2.197
134 1HD1 ILE 15 HD2 ILE 15 -4.805 1.176 -2.827
135 2HD1 ILE 15 HD1 ILE 15 -3.395 2.145 -3.225
136 3HD1 ILE 15 HD3 ILE 15 -4.789 2.159 -4.280
137 NH1 ARG 16 NH2 ARG 16 -4.142 -8.605 -3.147
138 NH2 ARG 16 NH1 ARG 16 -5.339 -9.608 -1.419
139 H ARG 16 HN ARG 16 -3.325 -3.301 -2.924
140 HA ARG 16 HA ARG 16 -1.110 -4.004 -1.282
141 1HB ARG 16 HB2 ARG 16 -3.442 -4.386 -0.585
142 2HB ARG 16 HB1 ARG 16 -3.657 -5.541 -1.889
143 1HG ARG 16 HG2 ARG 16 -1.301 -6.053 -0.192
144 2HG ARG 16 HG1 ARG 16 -2.799 -6.147 0.676
145 1HD ARG 16 HD2 ARG 16 -2.166 -7.680 -1.893
146 2HD ARG 16 HD1 ARG 16 -2.249 -8.363 -0.274
147 HE ARG 16 HE ARG 16 -4.714 -7.201 -0.534
148 1HH1 ARG 16 HH22 ARG 16 -3.532 -7.868 -3.456
149 2HH1 ARG 16 HH21 ARG 16 -4.434 -9.277 -3.830
150 1HH2 ARG 16 HH12 ARG 16 -5.608 -9.596 -0.448
151 2HH2 ARG 16 HH11 ARG 16 -5.702 -10.344 -1.992
152 H SER 17 HN SER 17 -2.383 -5.416 -4.256
153 HA SER 17 HA SER 17 -0.706 -7.739 -4.127
154 1HB SER 17 HB2 SER 17 -1.769 -6.300 -6.609
155 2HB SER 17 HB1 SER 17 -1.331 -8.015 -6.488
156 HG SER 17 HG1 SER 17 -3.576 -6.764 -5.695
157 H GLN 18 HN GLN 18 -0.266 -4.438 -5.234
158 HA GLN 18 HA GLN 18 2.256 -4.919 -6.529
159 1HB GLN 18 HB2 GLN 18 0.949 -2.689 -6.643
160 2HB GLN 18 HB1 GLN 18 1.509 -2.372 -5.005
161 1HG GLN 18 HG2 GLN 18 3.896 -2.732 -5.868
162 2HG GLN 18 HG1 GLN 18 3.212 -2.702 -7.486
163 1HE2 GLN 18 HE21 GLN 18 1.948 0.787 -6.351
164 2HE2 GLN 18 HE22 GLN 18 1.090 -0.668 -6.355
165 H THR 19 HN THR 19 1.221 -4.367 -3.219
166 HA THR 19 HA THR 19 3.812 -3.968 -2.119
167 HB THR 19 HB THR 19 1.567 -5.465 -0.678
168 HG1 THR 19 HG1 THR 19 1.473 -3.131 -2.055
169 1HG2 THR 19 HG21 THR 19 3.450 -3.173 0.126
170 2HG2 THR 19 HG23 THR 19 2.340 -4.010 1.197
171 3HG2 THR 19 HG22 THR 19 3.736 -4.854 0.552
172 H LEU 20 HN LEU 20 2.203 -6.846 -3.266
173 HA LEU 20 HA LEU 20 3.900 -8.713 -1.919
174 1HB LEU 20 HB2 LEU 20 1.856 -9.435 -3.267
175 2HB LEU 20 HB1 LEU 20 2.707 -8.952 -4.721
176 HG LEU 20 HG LEU 20 4.469 -10.630 -4.329
177 1HD1 LEU 20 HD11 LEU 20 2.783 -11.470 -1.924
178 2HD1 LEU 20 HD13 LEU 20 4.189 -12.318 -2.538
179 3HD1 LEU 20 HD12 LEU 20 4.374 -10.734 -1.825
180 1HD2 LEU 20 HD21 LEU 20 2.473 -11.235 -5.646
181 2HD2 LEU 20 HD23 LEU 20 3.083 -12.622 -4.760
182 3HD2 LEU 20 HD22 LEU 20 1.654 -11.771 -4.187
183 H THR 21 HN THR 21 4.064 -7.004 -4.991
184 HA THR 21 HA THR 21 6.510 -8.092 -5.877
185 HB THR 21 HB THR 21 5.602 -5.226 -6.418
186 HG1 THR 21 HG1 THR 21 4.428 -7.743 -6.740
187 1HG2 THR 21 HG22 THR 21 7.613 -6.306 -7.672
188 2HG2 THR 21 HG21 THR 21 6.506 -7.552 -8.217
189 3HG2 THR 21 HG23 THR 21 6.272 -5.885 -8.728
190 H LEU 22 HN LEU 22 5.808 -5.591 -3.532
191 HA LEU 22 HA LEU 22 8.533 -4.615 -3.457
192 1HB LEU 22 HB2 LEU 22 6.182 -4.413 -1.551
193 2HB LEU 22 HB1 LEU 22 7.777 -3.982 -0.997
194 HG LEU 22 HG LEU 22 6.356 -2.051 -1.922
195 1HD1 LEU 22 HD12 LEU 22 8.814 -1.908 -1.613
196 2HD1 LEU 22 HD11 LEU 22 9.071 -2.582 -3.214
197 3HD1 LEU 22 HD13 LEU 22 8.303 -1.017 -3.029
198 1HD2 LEU 22 HD21 LEU 22 5.476 -3.253 -3.926
199 2HD2 LEU 22 HD23 LEU 22 6.310 -1.781 -4.374
200 3HD2 LEU 22 HD22 LEU 22 7.092 -3.333 -4.603
201 H LEU 23 HN LEU 23 6.744 -7.176 -1.898
202 HA LEU 23 HA LEU 23 8.734 -7.786 0.053
203 1HB LEU 23 HB2 LEU 23 6.453 -8.887 0.029
204 2HB LEU 23 HB1 LEU 23 6.926 -9.749 -1.426
205 HG LEU 23 HG LEU 23 8.851 -10.789 -0.133
206 1HD1 LEU 23 HD11 LEU 23 7.379 -9.524 2.218
207 2HD1 LEU 23 HD13 LEU 23 8.709 -10.657 2.341
208 3HD1 LEU 23 HD12 LEU 23 8.985 -9.058 1.685
209 1HD2 LEU 23 HD21 LEU 23 6.688 -11.953 -0.530
210 2HD2 LEU 23 HD23 LEU 23 7.384 -12.390 1.021
211 3HD2 LEU 23 HD22 LEU 23 6.047 -11.256 0.947
212 H GLU 24 HN GLU 24 8.171 -8.808 -3.234
213 HA GLU 24 HA GLU 24 10.229 -10.684 -3.532
214 1HB GLU 24 HB2 GLU 24 9.483 -8.591 -5.589
215 2HB GLU 24 HB1 GLU 24 10.235 -10.146 -5.896
216 1HG GLU 24 HG2 GLU 24 8.254 -11.333 -5.260
217 2HG GLU 24 HG1 GLU 24 7.470 -9.858 -4.702
218 H LYS 25 HN LYS 25 10.408 -7.369 -4.607
219 HA LYS 25 HA LYS 25 13.180 -7.330 -5.036
220 1HB LYS 25 HB2 LYS 25 11.377 -5.013 -4.231
221 2HB LYS 25 HB1 LYS 25 12.925 -4.860 -5.046
222 1HG LYS 25 HG2 LYS 25 10.558 -6.444 -6.209
223 2HG LYS 25 HG1 LYS 25 10.918 -4.786 -6.615
224 1HD LYS 25 HD2 LYS 25 12.631 -5.327 -7.968
225 2HD LYS 25 HD1 LYS 25 13.288 -6.545 -6.910
226 1HE LYS 25 HE2 LYS 25 10.844 -6.864 -8.739
227 2HE LYS 25 HE1 LYS 25 12.430 -7.577 -8.996
228 1HZ LYS 25 HZ1 LYS 25 11.605 -8.345 -6.455
229 2HZ LYS 25 HZ3 LYS 25 10.304 -8.630 -7.513
230 3HZ LYS 25 HZ2 LYS 25 11.834 -9.283 -7.802
231 H LEU 26 HN LEU 26 11.503 -6.227 -2.083
232 HA LEU 26 HA LEU 26 13.934 -5.432 -0.823
233 1HB LEU 26 HB2 LEU 26 11.377 -6.537 0.408
234 2HB LEU 26 HB1 LEU 26 12.653 -5.760 1.325
235 HG LEU 26 HG LEU 26 11.238 -4.389 -1.022
236 1HD1 LEU 26 HD11 LEU 26 10.662 -4.146 1.958
237 2HD1 LEU 26 HD13 LEU 26 9.937 -3.163 0.692
238 3HD1 LEU 26 HD12 LEU 26 9.615 -4.887 0.754
239 1HD2 LEU 26 HD22 LEU 26 12.941 -3.288 1.256
240 2HD2 LEU 26 HD21 LEU 26 13.470 -3.441 -0.411
241 3HD2 LEU 26 HD23 LEU 26 12.175 -2.337 -0.004
242 H ASN 27 HN ASN 27 12.354 -8.520 -1.148
243 HA ASN 27 HA ASN 27 14.099 -9.884 0.715
244 1HB ASN 27 HB2 ASN 27 11.961 -10.901 0.122
245 2HB ASN 27 HB1 ASN 27 12.400 -10.931 -1.584
246 1HD2 ASN 27 HD21 ASN 27 13.828 -14.077 -1.239
247 2HD2 ASN 27 HD22 ASN 27 12.938 -12.973 -2.179
248 H GLU 28 HN GLU 28 14.149 -9.195 -2.701
249 HA GLU 28 HA GLU 28 16.409 -10.880 -3.297
250 1HB GLU 28 HB2 GLU 28 15.178 -8.487 -4.709
251 2HB GLU 28 HB1 GLU 28 16.425 -9.497 -5.426
252 1HG GLU 28 HG2 GLU 28 15.051 -11.386 -5.528
253 2HG GLU 28 HG1 GLU 28 13.948 -10.818 -4.291
254 H LEU 29 HN LEU 29 15.922 -7.754 -2.005
255 HA LEU 29 HA LEU 29 18.747 -6.986 -2.393
256 1HB LEU 29 HB2 LEU 29 16.256 -5.631 -1.390
257 2HB LEU 29 HB1 LEU 29 17.804 -4.998 -0.874
258 HG LEU 29 HG LEU 29 18.497 -4.479 -3.101
259 1HD1 LEU 29 HD11 LEU 29 16.066 -5.998 -4.170
260 2HD1 LEU 29 HD13 LEU 29 17.235 -5.122 -5.129
261 3HD1 LEU 29 HD12 LEU 29 17.721 -6.567 -4.278
262 1HD2 LEU 29 HD21 LEU 29 16.806 -2.936 -2.177
263 2HD2 LEU 29 HD23 LEU 29 16.642 -3.044 -3.921
264 3HD2 LEU 29 HD22 LEU 29 15.516 -3.900 -2.877
265 H ASP 30 HN ASP 30 17.530 -9.182 -0.626
266 HA ASP 30 HA ASP 30 17.871 -10.119 1.465
267 1HB ASP 30 HB2 ASP 30 20.254 -10.070 0.504
268 2HB ASP 30 HB1 ASP 30 20.490 -8.559 1.380
269 H ALA 31 HN ALA 31 16.539 -7.642 1.317
270 HA ALA 31 HA ALA 31 17.425 -6.168 3.735
271 1HB ALA 31 HB2 ALA 31 16.590 -4.855 1.747
272 2HB ALA 31 HB1 ALA 31 15.036 -5.667 1.894
273 3HB ALA 31 HB3 ALA 31 15.595 -4.603 3.172
274 H ASP 32 HN ASP 32 17.029 -8.424 4.615
275 HA ASP 32 HA ASP 32 14.618 -9.704 4.972
276 1HB ASP 32 HB2 ASP 32 16.534 -10.657 6.054
277 2HB ASP 32 HB1 ASP 32 16.760 -9.217 7.056
278 H GLU 33 HN GLU 33 15.853 -7.255 7.135
279 HA GLU 33 HA GLU 33 13.574 -7.068 8.758
280 1HB GLU 33 HB2 GLU 33 14.363 -4.515 8.838
281 2HB GLU 33 HB1 GLU 33 15.262 -5.777 9.659
282 1HG GLU 33 HG2 GLU 33 16.848 -5.976 7.839
283 2HG GLU 33 HG1 GLU 33 15.916 -4.902 6.801
284 H GLN 34 HN GLN 34 14.284 -4.994 5.918
285 HA GLN 34 HA GLN 34 11.681 -3.769 6.110
286 1HB GLN 34 HB2 GLN 34 13.554 -4.025 3.734
287 2HB GLN 34 HB1 GLN 34 12.009 -3.219 3.614
288 1HG GLN 34 HG2 GLN 34 13.379 -1.403 4.094
289 2HG GLN 34 HG1 GLN 34 12.944 -1.866 5.733
290 1HE2 GLN 34 HE21 GLN 34 16.243 -2.754 6.594
291 2HE2 GLN 34 HE22 GLN 34 14.658 -2.550 7.124
292 H ALA 35 HN ALA 35 12.716 -6.825 4.945
293 HA ALA 35 HA ALA 35 10.514 -7.178 3.090
294 1HB ALA 35 HB2 ALA 35 12.539 -8.716 3.048
295 2HB ALA 35 HB1 ALA 35 12.041 -9.365 4.606
296 3HB ALA 35 HB3 ALA 35 11.025 -9.593 3.204
297 H ASP 36 HN ASP 36 11.168 -8.003 6.471
298 HA ASP 36 HA ASP 36 8.686 -9.260 7.032
299 1HB ASP 36 HB2 ASP 36 10.230 -9.327 8.850
300 2HB ASP 36 HB1 ASP 36 10.486 -7.579 8.800
301 H ILE 37 HN ILE 37 9.666 -5.930 7.418
302 HA ILE 37 HA ILE 37 7.129 -4.967 8.222
303 HB ILE 37 HB ILE 37 9.220 -3.534 6.514
304 1HG1 ILE 37 HG12 ILE 37 10.210 -4.449 8.624
305 2HG1 ILE 37 HG11 ILE 37 10.209 -2.702 8.615
306 1HG2 ILE 37 HG21 ILE 37 7.043 -2.398 8.314
307 2HG2 ILE 37 HG23 ILE 37 8.292 -1.444 7.524
308 3HG2 ILE 37 HG22 ILE 37 7.104 -2.307 6.566
309 1HD1 ILE 37 HD1 ILE 37 8.184 -4.488 10.031
310 2HD1 ILE 37 HD3 ILE 37 9.488 -3.605 10.788
311 3HD1 ILE 37 HD2 ILE 37 8.158 -2.729 10.062
312 H CYS 38 HN CYS 38 8.473 -5.740 5.085
313 HA CYS 38 HA CYS 38 6.292 -4.527 3.629
314 1HB CYS 38 HB2 CYS 38 8.512 -5.163 2.607
315 2HB CYS 38 HB1 CYS 38 8.029 -6.835 2.726
316 HG CYS 38 HG1 CYS 38 6.589 -6.648 0.742
317 H GLU 39 HN GLU 39 6.833 -7.683 5.103
318 HA GLU 39 HA GLU 39 4.613 -8.952 3.795
319 1HB GLU 39 HB2 GLU 39 5.773 -9.489 6.587
320 2HB GLU 39 HB1 GLU 39 4.675 -10.549 5.739
321 1HG GLU 39 HG2 GLU 39 7.302 -9.776 4.475
322 2HG GLU 39 HG1 GLU 39 7.232 -11.061 5.668
323 H SER 40 HN SER 40 5.033 -7.635 7.008
324 HA SER 40 HA SER 40 2.368 -7.663 7.827
325 1HB SER 40 HB2 SER 40 4.540 -5.619 8.491
326 2HB SER 40 HB1 SER 40 3.188 -6.103 9.545
327 HG SER 40 HG1 SER 40 5.520 -7.409 9.085
328 H LEU 41 HN LEU 41 4.033 -5.406 5.768
329 HA LEU 41 HA LEU 41 1.911 -3.434 5.822
330 1HB LEU 41 HB2 LEU 41 4.320 -2.985 5.194
331 2HB LEU 41 HB1 LEU 41 4.049 -3.883 3.725
332 HG LEU 41 HG LEU 41 2.280 -2.272 3.031
333 1HD1 LEU 41 HD11 LEU 41 3.178 -0.707 5.493
334 2HD1 LEU 41 HD13 LEU 41 2.065 -0.127 4.268
335 3HD1 LEU 41 HD12 LEU 41 1.602 -1.455 5.300
336 1HD2 LEU 41 HD21 LEU 41 4.629 -1.997 2.298
337 2HD2 LEU 41 HD23 LEU 41 3.858 -0.439 2.493
338 3HD2 LEU 41 HD22 LEU 41 4.971 -1.027 3.719
339 H HIS 42 HN HIS 42 2.881 -6.070 3.909
340 HA HIS 42 HA HIS 42 1.119 -5.757 1.686
341 1HB HIS 42 HB2 HIS 42 3.110 -7.397 1.907
342 2HB HIS 42 HB1 HIS 42 2.047 -8.412 2.860
343 HD1 HIS 42 HD1 HIS 42 0.265 -6.930 0.044
344 HD2 HIS 42 HD2 HIS 42 2.553 -10.254 0.713
345 HE1 HIS 42 HE1 HIS 42 -0.172 -8.474 -1.825
346 H ASP 43 HN ASP 43 0.853 -7.545 4.693
347 HA ASP 43 HA ASP 43 -1.778 -8.557 4.256
348 1HB ASP 43 HB2 ASP 43 -0.398 -9.446 6.107
349 2HB ASP 43 HB1 ASP 43 -0.448 -7.872 6.906
350 H HIS 44 HN HIS 44 -0.663 -5.860 6.178
351 HA HIS 44 HA HIS 44 -3.155 -4.840 6.943
352 1HB HIS 44 HB2 HIS 44 -1.111 -3.895 7.882
353 2HB HIS 44 HB1 HIS 44 -0.605 -3.318 6.292
354 HD1 HIS 44 HD1 HIS 44 -1.214 -0.882 6.052
355 HD2 HIS 44 HD2 HIS 44 -3.949 -2.785 8.429
356 HE1 HIS 44 HE1 HIS 44 -2.866 0.818 6.722
357 H ALA 45 HN ALA 45 -1.335 -4.242 4.022
358 HA ALA 45 HA ALA 45 -3.080 -2.218 3.008
359 1HB ALA 45 HB1 ALA 45 -1.419 -4.236 1.436
360 2HB ALA 45 HB3 ALA 45 -2.110 -2.762 0.776
361 3HB ALA 45 HB2 ALA 45 -0.829 -2.670 1.976
362 H ASP 46 HN ASP 46 -3.090 -5.682 2.971
363 HA ASP 46 HA ASP 46 -5.365 -5.796 1.137
364 1HB ASP 46 HB2 ASP 46 -3.718 -7.793 1.465
365 2HB ASP 46 HB1 ASP 46 -4.456 -7.957 3.041
366 H GLU 47 HN GLU 47 -4.802 -5.443 4.514
367 HA GLU 47 HA GLU 47 -7.348 -6.479 5.276
368 1HB GLU 47 HB2 GLU 47 -5.395 -6.114 6.880
369 2HB GLU 47 HB1 GLU 47 -5.675 -4.383 6.749
370 1HG GLU 47 HG2 GLU 47 -6.736 -5.394 8.780
371 2HG GLU 47 HG1 GLU 47 -7.917 -4.631 7.717
372 H LEU 48 HN LEU 48 -6.146 -3.444 4.152
373 HA LEU 48 HA LEU 48 -8.373 -1.800 4.822
374 1HB LEU 48 HB2 LEU 48 -6.274 -0.860 3.827
375 2HB LEU 48 HB1 LEU 48 -6.590 -1.742 2.343
376 HG LEU 48 HG LEU 48 -8.666 -0.415 1.965
377 1HD1 LEU 48 HD11 LEU 48 -7.788 1.119 4.438
378 2HD1 LEU 48 HD13 LEU 48 -9.124 1.556 3.385
379 3HD1 LEU 48 HD12 LEU 48 -9.215 0.093 4.340
380 1HD2 LEU 48 HD22 LEU 48 -6.188 1.272 2.480
381 2HD2 LEU 48 HD21 LEU 48 -6.521 0.367 1.012
382 3HD2 LEU 48 HD23 LEU 48 -7.536 1.730 1.448
383 OH TYR 49 OH TYR 49 -11.651 -8.138 -3.524
384 H TYR 49 HN TYR 49 -7.730 -4.152 2.425
385 HA TYR 49 HA TYR 49 -10.247 -3.697 0.994
386 1HB TYR 49 HB2 TYR 49 -8.212 -4.338 -0.239
387 2HB TYR 49 HB1 TYR 49 -7.976 -5.762 0.728
388 HD1 TYR 49 HD2 TYR 49 -10.203 -4.226 -1.800
389 HD2 TYR 49 HD1 TYR 49 -9.021 -7.814 0.137
390 HE1 TYR 49 HE2 TYR 49 -11.458 -5.519 -3.449
391 HE2 TYR 49 HE1 TYR 49 -10.264 -9.118 -1.497
392 HH TYR 49 HH TYR 49 -12.307 -8.661 -3.050
393 NH1 ARG 50 NH1 ARG 50 -5.475 -8.760 6.305
394 NH2 ARG 50 NH2 ARG 50 -4.613 -9.826 4.435
395 H ARG 50 HN ARG 50 -9.073 -6.782 1.749
396 HA ARG 50 HA ARG 50 -10.703 -8.516 2.341
397 1HB ARG 50 HB2 ARG 50 -8.370 -8.379 2.998
398 2HB ARG 50 HB1 ARG 50 -8.808 -7.598 4.502
399 1HG ARG 50 HG2 ARG 50 -10.117 -9.761 5.041
400 2HG ARG 50 HG1 ARG 50 -9.234 -10.466 3.686
401 1HD ARG 50 HD2 ARG 50 -8.082 -9.181 6.209
402 2HD ARG 50 HD1 ARG 50 -7.786 -10.812 5.624
403 HE ARG 50 HE ARG 50 -6.896 -8.989 3.620
404 1HH1 ARG 50 HH12 ARG 50 -6.253 -8.352 6.790
405 2HH1 ARG 50 HH11 ARG 50 -4.583 -8.741 6.769
406 1HH2 ARG 50 HH22 ARG 50 -4.766 -10.210 3.520
407 2HH2 ARG 50 HH21 ARG 50 -3.687 -9.856 4.821
408 H SER 51 HN SER 51 -10.349 -7.597 5.663
409 HA SER 51 HA SER 51 -12.920 -8.534 6.245
410 1HB SER 51 HB2 SER 51 -11.308 -6.435 7.766
411 2HB SER 51 HB1 SER 51 -12.611 -7.430 8.436
412 HG SER 51 HG1 SER 51 -10.064 -8.088 7.991
413 H CYS 52 HN CYS 52 -11.911 -5.321 5.232
414 HA CYS 52 HA CYS 52 -14.595 -4.276 5.818
415 1HB CYS 52 HB2 CYS 52 -12.443 -3.212 3.919
416 2HB CYS 52 HB1 CYS 52 -13.798 -2.313 4.492
417 HG CYS 52 HG1 CYS 52 -12.635 -1.854 6.663
418 H LEU 53 HN LEU 53 -12.995 -5.802 3.080
419 HA LEU 53 HA LEU 53 -14.877 -5.065 1.127
420 1HB LEU 53 HB2 LEU 53 -12.837 -6.480 0.622
421 2HB LEU 53 HB1 LEU 53 -13.602 -7.808 1.480
422 HG LEU 53 HG LEU 53 -15.538 -7.713 -0.118
423 1HD1 LEU 53 HD11 LEU 53 -13.751 -5.769 -1.634
424 2HD1 LEU 53 HD13 LEU 53 -15.255 -6.463 -2.219
425 3HD1 LEU 53 HD12 LEU 53 -15.277 -5.348 -0.872
426 1HD2 LEU 53 HD22 LEU 53 -12.818 -8.162 -1.257
427 2HD2 LEU 53 HD21 LEU 53 -13.773 -9.319 -0.353
428 3HD2 LEU 53 HD23 LEU 53 -14.322 -8.789 -1.939
429 H ALA 54 HN ALA 54 -14.860 -7.289 3.678
430 HA ALA 54 HA ALA 54 -16.971 -8.997 3.287
431 1HB ALA 54 HB2 ALA 54 -15.755 -8.776 5.450
432 2HB ALA 54 HB1 ALA 54 -16.651 -7.298 5.760
433 3HB ALA 54 HB3 ALA 54 -17.511 -8.818 5.673
434 NH1 ARG 55 NH1 ARG 55 -22.183 -0.844 5.407
435 NH2 ARG 55 NH2 ARG 55 -19.878 -0.719 5.315
436 H ARG 55 HN ARG 55 -17.580 -5.936 4.973
437 HA ARG 55 HA ARG 55 -20.379 -6.113 4.096
438 1HB ARG 55 HB2 ARG 55 -19.514 -5.119 6.371
439 2HB ARG 55 HB1 ARG 55 -19.060 -3.719 5.431
440 1HG ARG 55 HG2 ARG 55 -21.326 -3.463 4.502
441 2HG ARG 55 HG1 ARG 55 -21.848 -4.971 5.217
442 1HD ARG 55 HD2 ARG 55 -22.717 -3.143 6.571
443 2HD ARG 55 HD1 ARG 55 -21.476 -3.991 7.483
444 HE ARG 55 HE ARG 55 -20.334 -1.956 7.549
445 1HH1 ARG 55 HH12 ARG 55 -23.009 -1.227 5.828
446 2HH1 ARG 55 HH11 ARG 55 -22.287 -0.166 4.671
447 1HH2 ARG 55 HH22 ARG 55 -18.991 -1.010 5.684
448 2HH2 ARG 55 HH21 ARG 55 -19.885 -0.045 4.569
449 H PHE 56 HN PHE 56 -17.767 -4.048 4.014
450 HA PHE 56 HA PHE 56 -16.804 -3.305 1.798
451 1HB PHE 56 HB2 PHE 56 -19.015 -3.018 0.525
452 2HB PHE 56 HB1 PHE 56 -19.503 -1.805 1.728
453 HD1 PHE 56 HD2 PHE 56 -16.762 -2.717 -0.628
454 HD2 PHE 56 HD1 PHE 56 -18.617 0.406 1.570
455 HE1 PHE 56 HE2 PHE 56 -15.313 -1.071 -1.731
456 HE2 PHE 56 HE1 PHE 56 -17.188 2.053 0.469
457 HZ PHE 56 HZ PHE 56 -15.522 1.319 -1.194
458 H GLY 57 HN GLY 57 -15.604 -2.660 3.580
459 1HA GLY 57 HA2 GLY 57 -14.805 -0.515 4.503
460 2HA GLY 57 HA1 GLY 57 -16.468 0.036 4.624
461 H ASP 58 HN ASP 58 -16.352 -3.154 5.366
462 HA ASP 58 HA ASP 58 -16.609 -4.363 7.345
463 1HB ASP 58 HB2 ASP 58 -14.178 -3.258 7.720
464 2HB ASP 58 HB1 ASP 58 -15.053 -2.225 8.845
465 H ASP 59 HN ASP 59 -16.715 -2.850 9.939
466 HA ASP 59 HA ASP 59 -18.392 -1.931 11.251
467 1HB ASP 59 HB2 ASP 59 -18.276 0.325 10.867
468 2HB ASP 59 HB1 ASP 59 -17.511 -0.015 9.329
469 H GLY 60 HN GLY 60 -20.856 -0.720 10.611
470 1HA GLY 60 HA2 GLY 60 -22.239 -2.924 9.136
471 2HA GLY 60 HA1 GLY 60 -22.858 -2.239 10.621
472 H GLU 61 HN GLU 61 -22.594 0.437 10.272
473 HA GLU 61 HA GLU 61 -24.691 0.831 8.243
474 1HB GLU 61 HB2 GLU 61 -23.822 2.926 10.197
475 2HB GLU 61 HB1 GLU 61 -25.400 2.645 9.483
476 1HG GLU 61 HG2 GLU 61 -24.061 0.860 11.570
477 2HG GLU 61 HG1 GLU 61 -25.484 1.865 11.791
478 H ASN 62 HN ASN 62 -21.495 1.079 7.837
479 HA ASN 62 HA ASN 62 -21.430 3.817 6.778
480 1HB ASN 62 HB2 ASN 62 -19.330 2.571 7.550
481 2HB ASN 62 HB1 ASN 62 -19.521 1.533 6.140
482 1HD2 ASN 62 HD21 ASN 62 -17.441 3.779 4.450
483 2HD2 ASN 62 HD22 ASN 62 -17.612 2.222 5.090
484 H LEU 63 HN LEU 63 -20.520 3.675 4.216
485 HA LEU 63 HA LEU 63 -22.842 2.531 2.830
486 1HB LEU 63 HB2 LEU 63 -20.450 4.096 1.728
487 2HB LEU 63 HB1 LEU 63 -21.875 3.662 0.812
488 HG LEU 63 HG LEU 63 -22.073 5.961 1.397
489 1HD1 LEU 63 HD12 LEU 63 -24.167 4.677 1.543
490 2HD1 LEU 63 HD11 LEU 63 -23.874 4.351 3.247
491 3HD1 LEU 63 HD13 LEU 63 -24.163 5.994 2.707
492 1HD2 LEU 63 HD21 LEU 63 -20.494 6.057 3.292
493 2HD2 LEU 63 HD23 LEU 63 -22.010 6.850 3.662
494 3HD2 LEU 63 HD22 LEU 63 -21.668 5.278 4.339
495 1H MET 1 HT1 MET 1 21.003 1.366 -1.163
496 2H MET 1 HT3 MET 1 21.472 -0.087 -0.437
497 3H MET 1 HT2 MET 1 20.418 0.972 0.374
498 HA MET 1 HA MET 1 22.105 2.095 1.257
499 1HB MET 1 HB2 MET 1 23.945 0.390 -0.501
500 2HB MET 1 HB1 MET 1 24.416 1.278 0.933
501 1HG MET 1 HG2 MET 1 22.875 -0.141 2.283
502 2HG MET 1 HG1 MET 1 22.485 -1.066 0.857
503 1HE MET 1 HE3 MET 1 23.691 -2.654 -0.267
504 2HE MET 1 HE2 MET 1 25.225 -1.829 -0.618
505 3HE MET 1 HE1 MET 1 25.202 -3.393 0.196
506 H THR 2 HN THR 2 22.775 1.190 -2.018
507 HA THR 2 HA THR 2 23.860 3.749 -2.784
508 HB THR 2 HB THR 2 22.872 1.586 -4.697
509 HG1 THR 2 HG1 THR 2 23.781 0.231 -3.370
510 1HG2 THR 2 HG22 THR 2 24.462 3.545 -5.418
511 2HG2 THR 2 HG21 THR 2 25.628 2.903 -4.270
512 3HG2 THR 2 HG23 THR 2 25.142 1.948 -5.663
513 H LYS 3 HN LYS 3 22.422 4.060 -5.255
514 HA LYS 3 HA LYS 3 19.932 5.185 -4.132
515 1HB LYS 3 HB2 LYS 3 21.166 5.434 -6.897
516 2HB LYS 3 HB1 LYS 3 19.710 6.259 -6.367
517 1HG LYS 3 HG2 LYS 3 21.004 7.340 -4.511
518 2HG LYS 3 HG1 LYS 3 22.459 6.533 -5.077
519 1HD LYS 3 HD2 LYS 3 22.307 7.753 -7.242
520 2HD LYS 3 HD1 LYS 3 20.771 8.441 -6.754
521 1HE LYS 3 HE2 LYS 3 22.700 10.030 -6.395
522 2HE LYS 3 HE1 LYS 3 21.790 9.690 -4.931
523 1HZ LYS 3 HZ1 LYS 3 23.848 7.790 -5.168
524 2HZ LYS 3 HZ3 LYS 3 24.507 9.333 -5.397
525 3HZ LYS 3 HZ2 LYS 3 23.632 8.994 -3.988
526 H GLN 4 HN GLN 4 20.989 2.724 -6.362
527 HA GLN 4 HA GLN 4 18.573 2.213 -7.683
528 1HB GLN 4 HB2 GLN 4 19.395 -0.261 -7.670
529 2HB GLN 4 HB1 GLN 4 20.365 0.937 -8.505
530 1HG GLN 4 HG2 GLN 4 21.083 0.546 -5.642
531 2HG GLN 4 HG1 GLN 4 21.374 -0.830 -6.687
532 1HE2 GLN 4 HE21 GLN 4 24.172 0.648 -8.196
533 2HE2 GLN 4 HE22 GLN 4 23.252 -0.748 -7.918
534 H GLU 5 HN GLU 5 19.650 0.791 -4.628
535 HA GLU 5 HA GLU 5 17.286 -0.774 -4.271
536 1HB GLU 5 HB2 GLU 5 18.865 0.405 -1.954
537 2HB GLU 5 HB1 GLU 5 17.998 -1.108 -2.028
538 1HG GLU 5 HG2 GLU 5 19.997 -2.089 -2.411
539 2HG GLU 5 HG1 GLU 5 19.818 -1.487 -4.055
540 H LYS 6 HN LYS 6 18.149 2.556 -3.536
541 HA LYS 6 HA LYS 6 15.799 3.014 -1.933
542 1HB LYS 6 HB2 LYS 6 17.484 4.950 -3.579
543 2HB LYS 6 HB1 LYS 6 16.158 5.457 -2.564
544 1HG LYS 6 HG2 LYS 6 17.297 4.171 -0.651
545 2HG LYS 6 HG1 LYS 6 18.689 4.010 -1.706
546 1HD LYS 6 HD2 LYS 6 18.919 6.442 -1.834
547 2HD LYS 6 HD1 LYS 6 17.427 6.658 -0.916
548 1HE LYS 6 HE2 LYS 6 18.473 5.310 0.963
549 2HE LYS 6 HE1 LYS 6 19.986 5.311 0.069
550 1HZ LYS 6 HZ1 LYS 6 19.090 7.958 0.304
551 2HZ LYS 6 HZ3 LYS 6 18.996 7.216 1.816
552 3HZ LYS 6 HZ2 LYS 6 20.466 7.225 0.992
553 H THR 7 HN THR 7 16.458 2.927 -5.354
554 HA THR 7 HA THR 7 13.971 4.156 -6.114
555 HB THR 7 HB THR 7 15.608 2.140 -7.758
556 HG1 THR 7 HG1 THR 7 17.122 3.533 -7.128
557 1HG2 THR 7 HG22 THR 7 13.476 3.264 -8.745
558 2HG2 THR 7 HG21 THR 7 14.249 4.815 -8.445
559 3HG2 THR 7 HG23 THR 7 14.959 3.685 -9.589
560 H ALA 8 HN ALA 8 15.056 0.945 -5.186
561 HA ALA 8 HA ALA 8 12.654 -0.403 -6.072
562 1HB ALA 8 HB2 ALA 8 14.712 -1.684 -5.275
563 2HB ALA 8 HB1 ALA 8 14.387 -1.109 -3.645
564 3HB ALA 8 HB3 ALA 8 13.247 -2.175 -4.438
565 H LEU 9 HN LEU 9 13.712 1.423 -3.330
566 HA LEU 9 HA LEU 9 11.322 0.990 -1.746
567 1HB LEU 9 HB2 LEU 9 13.810 2.194 -1.319
568 2HB LEU 9 HB1 LEU 9 12.730 3.572 -1.401
569 HG LEU 9 HG LEU 9 11.243 2.363 0.309
570 1HD1 LEU 9 HD12 LEU 9 12.157 0.073 -0.026
571 2HD1 LEU 9 HD11 LEU 9 13.708 0.609 0.596
572 3HD1 LEU 9 HD13 LEU 9 12.297 0.591 1.640
573 1HD2 LEU 9 HD22 LEU 9 14.094 3.062 1.152
574 2HD2 LEU 9 HD21 LEU 9 12.780 4.215 0.963
575 3HD2 LEU 9 HD23 LEU 9 12.700 2.995 2.215
576 H ASN 10 HN ASN 10 12.256 3.119 -4.358
577 HA ASN 10 HA ASN 10 10.152 5.030 -3.985
578 1HB ASN 10 HB2 ASN 10 11.584 4.150 -6.526
579 2HB ASN 10 HB1 ASN 10 10.237 5.249 -6.567
580 1HD2 ASN 10 HD21 ASN 10 13.314 6.688 -4.274
581 2HD2 ASN 10 HD22 ASN 10 12.674 5.156 -3.940
582 H MET 11 HN MET 11 10.180 1.767 -5.077
583 HA MET 11 HA MET 11 7.677 1.902 -6.512
584 1HB MET 11 HB2 MET 11 8.854 -0.468 -4.991
585 2HB MET 11 HB1 MET 11 7.618 -0.547 -6.229
586 1HG MET 11 HG2 MET 11 10.457 0.450 -6.615
587 2HG MET 11 HG1 MET 11 9.858 -1.101 -7.120
588 1HE MET 11 HE2 MET 11 7.546 -1.146 -8.610
589 2HE MET 11 HE1 MET 11 7.916 -0.583 -10.225
590 3HE MET 11 HE3 MET 11 9.062 -1.634 -9.407
591 H ALA 12 HN ALA 12 8.703 1.354 -3.213
592 HA ALA 12 HA ALA 12 6.082 0.789 -2.174
593 1HB ALA 12 HB2 ALA 12 8.175 0.415 -0.795
594 2HB ALA 12 HB1 ALA 12 8.404 2.159 -0.727
595 3HB ALA 12 HB3 ALA 12 7.011 1.431 0.043
596 NH1 ARG 13 NH2 ARG 13 9.287 7.486 -5.836
597 NH2 ARG 13 NH1 ARG 13 10.801 9.036 -5.009
598 H ARG 13 HN ARG 13 7.887 3.660 -2.942
599 HA ARG 13 HA ARG 13 6.086 5.497 -1.644
600 1HB ARG 13 HB2 ARG 13 8.349 6.159 -2.720
601 2HB ARG 13 HB1 ARG 13 7.510 6.075 -4.268
602 1HG ARG 13 HG2 ARG 13 5.755 7.680 -3.220
603 2HG ARG 13 HG1 ARG 13 6.941 7.953 -1.962
604 1HD ARG 13 HD2 ARG 13 7.223 8.534 -4.944
605 2HD ARG 13 HD1 ARG 13 7.323 9.666 -3.604
606 HE ARG 13 HE ARG 13 9.408 8.346 -2.915
607 1HH1 ARG 13 HH22 ARG 13 8.446 6.953 -5.714
608 2HH1 ARG 13 HH21 ARG 13 9.804 7.372 -6.690
609 1HH2 ARG 13 HH12 ARG 13 11.079 9.657 -4.273
610 2HH2 ARG 13 HH11 ARG 13 11.383 8.980 -5.827
611 H PHE 14 HN PHE 14 6.197 3.980 -4.841
612 HA PHE 14 HA PHE 14 3.981 5.427 -5.888
613 1HB PHE 14 HB2 PHE 14 5.413 3.950 -7.349
614 2HB PHE 14 HB1 PHE 14 4.755 2.539 -6.520
615 HD1 PHE 14 HD1 PHE 14 3.184 5.698 -7.857
616 HD2 PHE 14 HD2 PHE 14 3.239 1.437 -7.872
617 HE1 PHE 14 HE1 PHE 14 1.239 5.676 -9.345
618 HE2 PHE 14 HE2 PHE 14 1.293 1.413 -9.357
619 HZ PHE 14 HZ PHE 14 0.285 3.538 -10.103
620 H ILE 15 HN ILE 15 4.201 2.511 -3.943
621 HA ILE 15 HA ILE 15 1.459 1.803 -4.074
622 HB ILE 15 HB ILE 15 3.476 1.557 -1.778
623 1HG1 ILE 15 HG12 ILE 15 2.413 -0.374 -3.866
624 2HG1 ILE 15 HG11 ILE 15 4.020 0.325 -3.861
625 1HG2 ILE 15 HG22 ILE 15 1.148 1.475 -0.887
626 2HG2 ILE 15 HG21 ILE 15 0.793 0.193 -2.032
627 3HG2 ILE 15 HG23 ILE 15 1.946 -0.067 -0.737
628 1HD1 ILE 15 HD2 ILE 15 4.484 -0.820 -1.696
629 2HD1 ILE 15 HD1 ILE 15 2.890 -1.560 -1.751
630 3HD1 ILE 15 HD3 ILE 15 4.069 -1.945 -2.983
631 NH1 ARG 16 NH1 ARG 16 1.753 9.013 4.029
632 NH2 ARG 16 NH2 ARG 16 3.910 9.560 3.445
633 H ARG 16 HN ARG 16 3.225 4.047 -1.984
634 HA ARG 16 HA ARG 16 0.984 4.862 -0.451
635 1HB ARG 16 HB2 ARG 16 3.358 5.518 0.101
636 2HB ARG 16 HB1 ARG 16 3.362 6.590 -1.293
637 1HG ARG 16 HG2 ARG 16 1.541 7.877 -0.408
638 2HG ARG 16 HG1 ARG 16 1.373 6.793 0.969
639 1HD ARG 16 HD2 ARG 16 3.702 7.457 1.685
640 2HD ARG 16 HD1 ARG 16 3.772 8.581 0.341
641 HE ARG 16 HE ARG 16 1.718 9.679 1.415
642 1HH1 ARG 16 HH12 ARG 16 0.814 8.755 3.794
643 2HH1 ARG 16 HH11 ARG 16 1.975 9.106 5.006
644 1HH2 ARG 16 HH22 ARG 16 4.626 9.723 2.765
645 2HH2 ARG 16 HH21 ARG 16 4.182 9.656 4.408
646 H SER 17 HN SER 17 2.203 5.965 -3.577
647 HA SER 17 HA SER 17 0.449 8.174 -3.854
648 1HB SER 17 HB2 SER 17 1.436 6.395 -6.125
649 2HB SER 17 HB1 SER 17 1.116 8.139 -6.165
650 HG SER 17 HG1 SER 17 3.041 8.401 -5.402
651 H GLN 18 HN GLN 18 0.055 4.775 -4.806
652 HA GLN 18 HA GLN 18 -2.495 5.211 -6.036
653 1HB GLN 18 HB2 GLN 18 -1.507 2.703 -4.621
654 2HB GLN 18 HB1 GLN 18 -2.826 2.793 -5.778
655 1HG GLN 18 HG2 GLN 18 -1.210 3.639 -7.504
656 2HG GLN 18 HG1 GLN 18 0.098 3.386 -6.350
657 1HE2 GLN 18 HE21 GLN 18 -1.083 0.262 -8.459
658 2HE2 GLN 18 HE22 GLN 18 -1.334 1.881 -8.901
659 H THR 19 HN THR 19 -1.461 4.357 -2.795
660 HA THR 19 HA THR 19 -3.996 4.020 -1.640
661 HB THR 19 HB THR 19 -1.445 5.169 -0.351
662 HG1 THR 19 HG1 THR 19 -0.776 3.262 -0.981
663 1HG2 THR 19 HG21 THR 19 -3.672 3.374 0.758
664 2HG2 THR 19 HG23 THR 19 -2.295 4.003 1.651
665 3HG2 THR 19 HG22 THR 19 -3.563 5.091 1.118
666 H LEU 20 HN LEU 20 -2.232 6.959 -2.476
667 HA LEU 20 HA LEU 20 -3.923 8.693 -0.942
668 1HB LEU 20 HB2 LEU 20 -1.747 9.449 -2.015
669 2HB LEU 20 HB1 LEU 20 -2.517 9.289 -3.579
670 HG LEU 20 HG LEU 20 -4.181 11.016 -3.006
671 1HD1 LEU 20 HD11 LEU 20 -2.636 11.282 -0.384
672 2HD1 LEU 20 HD13 LEU 20 -3.918 12.347 -0.932
673 3HD1 LEU 20 HD12 LEU 20 -4.283 10.687 -0.533
674 1HD2 LEU 20 HD21 LEU 20 -2.055 11.688 -4.069
675 2HD2 LEU 20 HD23 LEU 20 -2.629 12.939 -2.982
676 3HD2 LEU 20 HD22 LEU 20 -1.312 11.886 -2.487
677 H THR 21 HN THR 21 -3.946 7.552 -4.254
678 HA THR 21 HA THR 21 -6.218 8.916 -5.164
679 HB THR 21 HB THR 21 -5.573 6.025 -5.948
680 HG1 THR 21 HG1 THR 21 -3.592 6.828 -5.982
681 1HG2 THR 21 HG21 THR 21 -6.039 8.611 -7.556
682 2HG2 THR 21 HG23 THR 21 -5.937 6.985 -8.219
683 3HG2 THR 21 HG22 THR 21 -7.320 7.449 -7.241
684 H LEU 22 HN LEU 22 -5.944 5.866 -3.401
685 HA LEU 22 HA LEU 22 -8.810 5.446 -3.395
686 1HB LEU 22 HB2 LEU 22 -6.490 4.229 -1.885
687 2HB LEU 22 HB1 LEU 22 -8.127 3.886 -1.383
688 HG LEU 22 HG LEU 22 -7.089 2.186 -3.023
689 1HD1 LEU 22 HD12 LEU 22 -9.535 2.337 -2.614
690 2HD1 LEU 22 HD11 LEU 22 -9.688 3.572 -3.851
691 3HD1 LEU 22 HD13 LEU 22 -9.210 1.945 -4.291
692 1HD2 LEU 22 HD21 LEU 22 -6.038 3.855 -4.576
693 2HD2 LEU 22 HD23 LEU 22 -7.130 2.768 -5.408
694 3HD2 LEU 22 HD22 LEU 22 -7.633 4.406 -5.058
695 H LEU 23 HN LEU 23 -6.570 7.161 -1.373
696 HA LEU 23 HA LEU 23 -8.222 7.289 0.942
697 1HB LEU 23 HB2 LEU 23 -5.795 8.116 0.769
698 2HB LEU 23 HB1 LEU 23 -6.399 9.502 -0.120
699 HG LEU 23 HG LEU 23 -7.906 10.017 1.897
700 1HD1 LEU 23 HD11 LEU 23 -6.014 8.023 3.188
701 2HD1 LEU 23 HD13 LEU 23 -7.180 9.024 4.032
702 3HD1 LEU 23 HD12 LEU 23 -7.732 7.773 2.934
703 1HD2 LEU 23 HD22 LEU 23 -4.879 10.054 2.286
704 2HD2 LEU 23 HD21 LEU 23 -5.794 11.258 1.393
705 3HD2 LEU 23 HD23 LEU 23 -6.021 11.086 3.126
706 H GLU 24 HN GLU 24 -7.772 9.461 -1.733
707 HA GLU 24 HA GLU 24 -9.863 11.263 -1.063
708 1HB GLU 24 HB2 GLU 24 -7.993 11.769 -2.636
709 2HB GLU 24 HB1 GLU 24 -8.617 10.602 -3.778
710 1HG GLU 24 HG2 GLU 24 -10.682 11.975 -4.029
711 2HG GLU 24 HG1 GLU 24 -10.006 13.142 -2.891
712 H LYS 25 HN LYS 25 -9.860 8.732 -3.597
713 HA LYS 25 HA LYS 25 -12.600 9.148 -4.185
714 1HB LYS 25 HB2 LYS 25 -10.737 6.808 -4.606
715 2HB LYS 25 HB1 LYS 25 -12.453 6.628 -4.935
716 1HG LYS 25 HG2 LYS 25 -11.456 7.352 -7.003
717 2HG LYS 25 HG1 LYS 25 -12.350 8.710 -6.379
718 1HD LYS 25 HD2 LYS 25 -9.830 9.245 -5.345
719 2HD LYS 25 HD1 LYS 25 -9.435 8.369 -6.805
720 1HE LYS 25 HE2 LYS 25 -9.623 10.741 -7.349
721 2HE LYS 25 HE1 LYS 25 -10.991 9.912 -8.074
722 1HZ LYS 25 HZ1 LYS 25 -11.713 10.670 -5.473
723 2HZ LYS 25 HZ3 LYS 25 -11.039 12.005 -6.236
724 3HZ LYS 25 HZ2 LYS 25 -12.364 11.213 -6.909
725 H LEU 26 HN LEU 26 -11.183 7.057 -1.705
726 HA LEU 26 HA LEU 26 -13.717 5.807 -1.126
727 1HB LEU 26 HB2 LEU 26 -11.280 6.335 0.638
728 2HB LEU 26 HB1 LEU 26 -12.671 5.437 1.200
729 HG LEU 26 HG LEU 26 -11.153 4.647 -1.335
730 1HD1 LEU 26 HD11 LEU 26 -10.788 3.604 1.510
731 2HD1 LEU 26 HD13 LEU 26 -10.012 2.940 0.081
732 3HD1 LEU 26 HD12 LEU 26 -9.612 4.560 0.630
733 1HD2 LEU 26 HD22 LEU 26 -13.025 3.089 0.499
734 2HD2 LEU 26 HD21 LEU 26 -13.459 3.715 -1.083
735 3HD2 LEU 26 HD23 LEU 26 -12.243 2.464 -0.943
736 H ASN 27 HN ASN 27 -12.092 8.730 -0.230
737 HA ASN 27 HA ASN 27 -13.869 9.589 1.831
738 1HB ASN 27 HB2 ASN 27 -11.627 10.708 1.094
739 2HB ASN 27 HB1 ASN 27 -12.594 11.487 -0.162
740 1HD2 ASN 27 HD21 ASN 27 -13.253 12.442 3.750
741 2HD2 ASN 27 HD22 ASN 27 -12.517 10.977 3.341
742 H GLU 28 HN GLU 28 -13.924 9.903 -1.668
743 HA GLU 28 HA GLU 28 -16.243 11.584 -1.750
744 1HB GLU 28 HB2 GLU 28 -15.238 9.591 -3.818
745 2HB GLU 28 HB1 GLU 28 -16.382 10.878 -4.138
746 1HG GLU 28 HG2 GLU 28 -14.713 12.582 -3.539
747 2HG GLU 28 HG1 GLU 28 -13.532 11.337 -3.161
748 H LEU 29 HN LEU 29 -15.763 8.187 -1.356
749 HA LEU 29 HA LEU 29 -18.637 7.644 -1.819
750 1HB LEU 29 HB2 LEU 29 -16.434 5.784 -0.850
751 2HB LEU 29 HB1 LEU 29 -18.049 5.289 -1.318
752 HG LEU 29 HG LEU 29 -16.065 6.648 -3.205
753 1HD1 LEU 29 HD11 LEU 29 -16.936 3.732 -3.014
754 2HD1 LEU 29 HD13 LEU 29 -15.886 4.405 -4.254
755 3HD1 LEU 29 HD12 LEU 29 -15.349 4.352 -2.584
756 1HD2 LEU 29 HD22 LEU 29 -18.763 5.332 -3.748
757 2HD2 LEU 29 HD21 LEU 29 -18.448 7.062 -3.813
758 3HD2 LEU 29 HD23 LEU 29 -17.677 5.993 -4.963
759 H ASP 30 HN ASP 30 -17.505 9.344 0.384
760 HA ASP 30 HA ASP 30 -17.833 9.721 2.644
761 1HB ASP 30 HB2 ASP 30 -20.233 7.913 2.102
762 2HB ASP 30 HB1 ASP 30 -19.993 8.795 3.599
763 H ALA 31 HN ALA 31 -16.371 7.329 1.644
764 HA ALA 31 HA ALA 31 -16.717 5.482 3.935
765 1HB ALA 31 HB1 ALA 31 -14.929 5.214 1.471
766 2HB ALA 31 HB3 ALA 31 -15.164 3.984 2.705
767 3HB ALA 31 HB2 ALA 31 -16.500 4.441 1.657
768 H ASP 32 HN ASP 32 -15.955 7.693 4.858
769 HA ASP 32 HA ASP 32 -13.178 8.326 4.670
770 1HB ASP 32 HB2 ASP 32 -15.285 9.031 6.702
771 2HB ASP 32 HB1 ASP 32 -13.602 9.510 6.921
772 H GLU 33 HN GLU 33 -14.867 5.919 6.532
773 HA GLU 33 HA GLU 33 -12.687 5.731 8.468
774 1HB GLU 33 HB2 GLU 33 -13.877 3.232 8.507
775 2HB GLU 33 HB1 GLU 33 -14.387 4.573 9.505
776 1HG GLU 33 HG2 GLU 33 -16.333 3.628 8.449
777 2HG GLU 33 HG1 GLU 33 -16.067 5.167 7.657
778 H GLN 34 HN GLN 34 -13.478 4.405 5.333
779 HA GLN 34 HA GLN 34 -11.262 2.494 5.483
780 1HB GLN 34 HB2 GLN 34 -12.745 3.614 3.039
781 2HB GLN 34 HB1 GLN 34 -11.595 2.282 3.000
782 1HG GLN 34 HG2 GLN 34 -14.221 2.278 4.500
783 2HG GLN 34 HG1 GLN 34 -13.836 1.351 3.057
784 1HE2 GLN 34 HE21 GLN 34 -12.742 -0.130 6.604
785 2HE2 GLN 34 HE22 GLN 34 -13.859 1.127 6.422
786 H ALA 35 HN ALA 35 -11.913 5.774 4.640
787 HA ALA 35 HA ALA 35 -9.405 6.191 3.271
788 1HB ALA 35 HB2 ALA 35 -11.283 7.882 3.148
789 2HB ALA 35 HB1 ALA 35 -11.022 8.244 4.851
790 3HB ALA 35 HB3 ALA 35 -9.772 8.601 3.683
791 H ASP 36 HN ASP 36 -10.518 6.135 6.579
792 HA ASP 36 HA ASP 36 -8.215 7.324 7.793
793 1HB ASP 36 HB2 ASP 36 -10.072 6.950 9.276
794 2HB ASP 36 HB1 ASP 36 -10.128 5.228 8.891
795 H ILE 37 HN ILE 37 -9.110 3.955 7.487
796 HA ILE 37 HA ILE 37 -6.602 2.932 8.320
797 HB ILE 37 HB ILE 37 -8.602 1.711 6.357
798 1HG1 ILE 37 HG12 ILE 37 -8.419 1.473 9.395
799 2HG1 ILE 37 HG11 ILE 37 -9.597 2.458 8.562
800 1HG2 ILE 37 HG22 ILE 37 -6.392 0.528 6.436
801 2HG2 ILE 37 HG21 ILE 37 -6.536 0.389 8.180
802 3HG2 ILE 37 HG23 ILE 37 -7.648 -0.470 7.123
803 1HD1 ILE 37 HD2 ILE 37 -10.489 0.446 7.410
804 2HD1 ILE 37 HD1 ILE 37 -9.352 -0.568 8.292
805 3HD1 ILE 37 HD3 ILE 37 -10.597 0.311 9.157
806 H CYS 38 HN CYS 38 -7.796 4.084 5.271
807 HA CYS 38 HA CYS 38 -5.569 3.108 3.711
808 1HB CYS 38 HB2 CYS 38 -7.753 3.782 2.704
809 2HB CYS 38 HB1 CYS 38 -7.417 5.434 3.155
810 HG CYS 38 HG1 CYS 38 -6.250 3.981 0.726
811 H GLU 39 HN GLU 39 -6.108 5.913 5.710
812 HA GLU 39 HA GLU 39 -3.866 7.393 4.565
813 1HB GLU 39 HB2 GLU 39 -5.927 8.205 6.168
814 2HB GLU 39 HB1 GLU 39 -4.747 7.830 7.411
815 1HG GLU 39 HG2 GLU 39 -4.280 9.738 5.093
816 2HG GLU 39 HG1 GLU 39 -4.549 10.189 6.773
817 H SER 40 HN SER 40 -4.583 5.504 7.455
818 HA SER 40 HA SER 40 -2.022 5.436 8.554
819 1HB SER 40 HB2 SER 40 -4.096 3.166 8.467
820 2HB SER 40 HB1 SER 40 -2.859 3.401 9.720
821 HG SER 40 HG1 SER 40 -5.235 4.728 9.377
822 H LEU 41 HN LEU 41 -3.342 3.745 5.823
823 HA LEU 41 HA LEU 41 -1.066 1.933 5.559
824 1HB LEU 41 HB2 LEU 41 -3.528 1.763 4.568
825 2HB LEU 41 HB1 LEU 41 -2.897 2.773 3.292
826 HG LEU 41 HG LEU 41 -2.019 -0.032 4.041
827 1HD1 LEU 41 HD11 LEU 41 -3.172 1.176 1.505
828 2HD1 LEU 41 HD13 LEU 41 -2.701 -0.498 1.695
829 3HD1 LEU 41 HD12 LEU 41 -4.028 0.150 2.644
830 1HD2 LEU 41 HD22 LEU 41 -0.705 1.796 1.985
831 2HD2 LEU 41 HD21 LEU 41 0.047 1.204 3.464
832 3HD2 LEU 41 HD23 LEU 41 -0.373 0.085 2.194
833 H HIS 42 HN HIS 42 -2.226 4.905 4.202
834 HA HIS 42 HA HIS 42 -0.381 5.480 2.212
835 1HB HIS 42 HB2 HIS 42 -2.463 6.839 2.987
836 2HB HIS 42 HB1 HIS 42 -1.402 7.551 4.176
837 HD1 HIS 42 HD1 HIS 42 -0.916 7.192 0.420
838 HD2 HIS 42 HD2 HIS 42 -0.738 10.002 3.389
839 HE1 HIS 42 HE1 HIS 42 -0.209 9.286 -0.640
840 H ASP 43 HN ASP 43 -0.085 6.444 5.677
841 HA ASP 43 HA ASP 43 2.730 7.100 5.025
842 1HB ASP 43 HB2 ASP 43 1.246 8.533 6.639
843 2HB ASP 43 HB1 ASP 43 1.642 7.272 7.806
844 H HIS 44 HN HIS 44 1.033 4.457 6.511
845 HA HIS 44 HA HIS 44 3.270 3.594 8.117
846 1HB HIS 44 HB2 HIS 44 1.124 2.404 8.399
847 2HB HIS 44 HB1 HIS 44 1.125 1.927 6.702
848 HD1 HIS 44 HD1 HIS 44 4.440 1.533 8.153
849 HD2 HIS 44 HD2 HIS 44 1.053 -0.756 7.938
850 HE1 HIS 44 HE1 HIS 44 5.118 -0.768 8.678
851 H ALA 45 HN ALA 45 2.179 2.904 4.861
852 HA ALA 45 HA ALA 45 4.442 1.318 4.119
853 1HB ALA 45 HB1 ALA 45 2.758 3.137 2.334
854 2HB ALA 45 HB3 ALA 45 3.818 1.857 1.766
855 3HB ALA 45 HB2 ALA 45 2.366 1.456 2.672
856 H ASP 46 HN ASP 46 3.789 4.710 4.368
857 HA ASP 46 HA ASP 46 6.100 5.510 2.860
858 1HB ASP 46 HB2 ASP 46 4.179 7.061 3.534
859 2HB ASP 46 HB1 ASP 46 4.937 7.087 5.120
860 H GLU 47 HN GLU 47 5.572 4.576 6.174
861 HA GLU 47 HA GLU 47 8.013 5.721 7.175
862 1HB GLU 47 HB2 GLU 47 5.978 4.518 8.474
863 2HB GLU 47 HB1 GLU 47 6.912 3.070 8.165
864 1HG GLU 47 HG2 GLU 47 7.549 3.870 10.359
865 2HG GLU 47 HG1 GLU 47 8.904 4.164 9.268
866 H LEU 48 HN LEU 48 7.022 2.720 5.706
867 HA LEU 48 HA LEU 48 9.597 1.461 5.796
868 1HB LEU 48 HB2 LEU 48 7.485 0.180 5.341
869 2HB LEU 48 HB1 LEU 48 7.283 1.049 3.832
870 HG LEU 48 HG LEU 48 9.350 0.047 2.924
871 1HD1 LEU 48 HD11 LEU 48 9.462 -1.490 5.557
872 2HD1 LEU 48 HD13 LEU 48 10.493 -1.762 4.164
873 3HD1 LEU 48 HD12 LEU 48 10.616 -0.261 5.055
874 1HD2 LEU 48 HD22 LEU 48 7.444 -2.012 4.105
875 2HD2 LEU 48 HD21 LEU 48 7.204 -1.136 2.599
876 3HD2 LEU 48 HD23 LEU 48 8.526 -2.280 2.748
877 OH TYR 49 OH TYR 49 11.399 7.912 -2.511
878 H TYR 49 HN TYR 49 8.143 3.874 3.822
879 HA TYR 49 HA TYR 49 10.292 3.644 1.814
880 1HB TYR 49 HB2 TYR 49 8.019 4.196 0.966
881 2HB TYR 49 HB1 TYR 49 7.944 5.615 1.997
882 HD1 TYR 49 HD1 TYR 49 10.319 4.070 -0.422
883 HD2 TYR 49 HD2 TYR 49 8.520 7.657 0.962
884 HE1 TYR 49 HE1 TYR 49 11.525 5.322 -2.124
885 HE2 TYR 49 HE2 TYR 49 9.718 8.919 -0.735
886 HH TYR 49 HH TYR 49 12.337 7.793 -2.329
887 NH1 ARG 50 NH1 ARG 50 8.143 8.804 8.614
888 NH2 ARG 50 NH2 ARG 50 6.498 8.031 7.184
889 H ARG 50 HN ARG 50 9.041 6.661 2.893
890 HA ARG 50 HA ARG 50 11.048 8.340 2.924
891 1HB ARG 50 HB2 ARG 50 8.794 8.842 3.623
892 2HB ARG 50 HB1 ARG 50 9.021 7.970 5.119
893 1HG ARG 50 HG2 ARG 50 11.074 9.953 5.032
894 2HG ARG 50 HG1 ARG 50 9.595 10.731 4.499
895 1HD ARG 50 HD2 ARG 50 10.008 9.198 7.104
896 2HD ARG 50 HD1 ARG 50 9.562 10.887 6.889
897 HE ARG 50 HE ARG 50 7.433 9.892 5.775
898 1HH1 ARG 50 HH12 ARG 50 8.932 9.396 8.783
899 2HH1 ARG 50 HH11 ARG 50 7.817 8.225 9.369
900 1HH2 ARG 50 HH22 ARG 50 6.060 8.040 6.282
901 2HH2 ARG 50 HH21 ARG 50 6.101 7.425 7.883
902 H SER 51 HN SER 51 10.415 7.028 6.122
903 HA SER 51 HA SER 51 12.750 7.878 7.348
904 1HB SER 51 HB2 SER 51 11.426 5.203 7.938
905 2HB SER 51 HB1 SER 51 12.080 6.388 9.091
906 HG SER 51 HG1 SER 51 10.141 7.193 8.989
907 H CYS 52 HN CYS 52 12.205 4.689 5.945
908 HA CYS 52 HA CYS 52 14.972 3.881 6.207
909 1HB CYS 52 HB2 CYS 52 12.715 3.042 4.385
910 2HB CYS 52 HB1 CYS 52 14.183 2.154 4.449
911 HG CYS 52 HG1 CYS 52 13.443 1.122 6.656
912 H LEU 53 HN LEU 53 13.299 5.766 3.828
913 HA LEU 53 HA LEU 53 15.155 5.280 1.730
914 1HB LEU 53 HB2 LEU 53 12.901 6.610 1.615
915 2HB LEU 53 HB1 LEU 53 13.832 7.956 2.251
916 HG LEU 53 HG LEU 53 15.445 7.682 0.336
917 1HD1 LEU 53 HD11 LEU 53 13.271 5.808 -0.667
918 2HD1 LEU 53 HD13 LEU 53 14.608 6.403 -1.636
919 3HD1 LEU 53 HD12 LEU 53 14.909 5.335 -0.282
920 1HD2 LEU 53 HD22 LEU 53 12.554 8.302 -0.252
921 2HD2 LEU 53 HD21 LEU 53 13.753 9.401 0.401
922 3HD2 LEU 53 HD23 LEU 53 13.923 8.814 -1.248
923 H ALA 54 HN ALA 54 15.087 7.142 4.530
924 HA ALA 54 HA ALA 54 16.999 9.087 4.327
925 1HB ALA 54 HB1 ALA 54 16.922 6.975 6.496
926 2HB ALA 54 HB3 ALA 54 17.730 8.524 6.624
927 3HB ALA 54 HB2 ALA 54 15.969 8.446 6.483
928 NH1 ARG 55 NH2 ARG 55 19.249 6.204 8.673
929 NH2 ARG 55 NH1 ARG 55 20.298 4.577 9.958
930 H ARG 55 HN ARG 55 17.847 5.883 5.389
931 HA ARG 55 HA ARG 55 20.608 6.272 4.423
932 1HB ARG 55 HB2 ARG 55 19.628 5.324 6.665
933 2HB ARG 55 HB1 ARG 55 19.560 3.831 5.802
934 1HG ARG 55 HG2 ARG 55 21.782 3.577 5.519
935 2HG ARG 55 HG1 ARG 55 22.146 5.293 5.550
936 1HD ARG 55 HD2 ARG 55 21.399 3.513 7.937
937 2HD ARG 55 HD1 ARG 55 22.945 4.309 7.696
938 HE ARG 55 HE ARG 55 21.827 6.463 8.189
939 1HH1 ARG 55 HH22 ARG 55 19.320 6.868 7.923
940 2HH1 ARG 55 HH21 ARG 55 18.383 6.147 9.159
941 1HH2 ARG 55 HH12 ARG 55 21.120 4.033 10.147
942 2HH2 ARG 55 HH11 ARG 55 19.506 4.404 10.551
943 H PHE 56 HN PHE 56 18.138 3.981 4.530
944 HA PHE 56 HA PHE 56 17.226 3.207 2.261
945 1HB PHE 56 HB2 PHE 56 19.403 2.933 1.031
946 2HB PHE 56 HB1 PHE 56 20.024 1.942 2.373
947 HD1 PHE 56 HD2 PHE 56 16.936 2.223 0.288
948 HD2 PHE 56 HD1 PHE 56 19.768 -0.381 2.117
949 HE1 PHE 56 HE2 PHE 56 15.725 0.281 -0.609
950 HE2 PHE 56 HE1 PHE 56 18.558 -2.326 1.213
951 HZ PHE 56 HZ PHE 56 16.537 -1.994 -0.143
952 H GLY 57 HN GLY 57 15.928 2.545 3.963
953 1HA GLY 57 HA2 GLY 57 15.076 0.489 5.036
954 2HA GLY 57 HA1 GLY 57 16.694 -0.184 4.922
955 H ASP 58 HN ASP 58 18.333 0.698 6.273
956 HA ASP 58 HA ASP 58 17.558 0.892 8.996
957 1HB ASP 58 HB2 ASP 58 19.872 0.305 8.295
958 2HB ASP 58 HB1 ASP 58 20.086 1.918 7.633
959 H ASP 59 HN ASP 59 16.903 2.606 10.189
960 HA ASP 59 HA ASP 59 16.865 5.254 8.798
961 1HB ASP 59 HB2 ASP 59 14.557 4.315 9.262
962 2HB ASP 59 HB1 ASP 59 14.960 4.341 10.984
963 H GLY 60 HN GLY 60 17.181 7.067 10.264
964 1HA GLY 60 HA2 GLY 60 17.980 6.759 12.990
965 2HA GLY 60 HA1 GLY 60 19.418 6.861 11.922
966 H GLU 61 HN GLU 61 18.501 8.249 9.883
967 HA GLU 61 HA GLU 61 18.121 10.965 10.968
968 1HB GLU 61 HB2 GLU 61 18.349 10.050 8.051
969 2HB GLU 61 HB1 GLU 61 18.550 11.685 8.634
970 1HG GLU 61 HG2 GLU 61 20.783 10.956 8.330
971 2HG GLU 61 HG1 GLU 61 20.533 10.669 10.047
972 H ASN 62 HN ASN 62 16.137 9.804 11.766
973 HA ASN 62 HA ASN 62 14.034 8.981 10.071
974 1HB ASN 62 HB2 ASN 62 14.033 8.582 12.543
975 2HB ASN 62 HB1 ASN 62 13.815 10.319 12.786
976 1HD2 ASN 62 HD21 ASN 62 10.718 8.380 10.890
977 2HD2 ASN 62 HD22 ASN 62 12.317 7.928 10.534
978 H LEU 63 HN LEU 63 12.426 9.941 9.123
979 HA LEU 63 HA LEU 63 12.246 12.915 9.233
980 1HB LEU 63 HB2 LEU 63 11.766 11.149 6.792
981 2HB LEU 63 HB1 LEU 63 11.751 12.900 6.818
982 HG LEU 63 HG LEU 63 14.203 11.165 7.375
983 1HD1 LEU 63 HD11 LEU 63 13.449 12.762 4.892
984 2HD1 LEU 63 HD13 LEU 63 14.974 11.919 5.138
985 3HD1 LEU 63 HD12 LEU 63 13.480 11.008 5.012
986 1HD2 LEU 63 HD22 LEU 63 13.931 14.177 6.947
987 2HD2 LEU 63 HD21 LEU 63 14.273 13.397 8.484
988 3HD2 LEU 63 HD23 LEU 63 15.443 13.307 7.185
No H/Q in entry = 988
Contact the webmaster for help, if required. Sunday, July 7, 2024 8:29:28 PM GMT (wattos1)