NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
605982 |
5k57   |
30097 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 SER 1 1H SER 1 -5.059 31.214 -6.325
2 H2 SER 1 2H SER 1 -6.688 30.818 -6.459
3 H3 SER 1 3H SER 1 -6.208 32.430 -6.530
4 HA SER 1 HA SER 1 -6.788 31.472 -8.752
5 HB2 SER 1 1HB SER 1 -3.886 32.297 -8.359
6 HB3 SER 1 2HB SER 1 -4.759 32.397 -9.853
7 HG SER 1 HG SER 1 -5.752 34.135 -9.169
8 H GLN 2 H GLN 2 -6.656 29.926 -10.206
9 HA GLN 2 HA GLN 2 -5.044 27.544 -9.620
10 HB2 GLN 2 1HB GLN 2 -6.814 28.257 -11.998
11 HB3 GLN 2 2HB GLN 2 -6.053 26.683 -11.730
12 HG2 GLN 2 1HG GLN 2 -7.331 26.458 -9.603
13 HG3 GLN 2 2HG GLN 2 -8.143 27.992 -9.953
14 HE21 GLN 2 1HE2 GLN 2 -10.617 26.441 -11.816
15 HE22 GLN 2 2HE2 GLN 2 -10.110 27.748 -10.774
16 H GLN 3 H GLN 3 -3.125 27.021 -10.560
17 HA GLN 3 HA GLN 3 -2.074 28.696 -12.782
18 HB2 GLN 3 1HB GLN 3 -0.675 28.153 -10.127
19 HB3 GLN 3 2HB GLN 3 0.080 28.901 -11.539
20 HG2 GLN 3 1HG GLN 3 -1.481 30.806 -11.372
21 HG3 GLN 3 2HG GLN 3 -2.239 30.057 -9.960
22 HE21 GLN 3 1HE2 GLN 3 0.113 31.196 -7.688
23 HE22 GLN 3 2HE2 GLN 3 -1.376 30.326 -7.987
24 H SER 4 H SER 4 0.017 27.624 -13.587
25 HA SER 4 HA SER 4 0.288 24.769 -12.923
26 HB2 SER 4 1HB SER 4 0.093 24.097 -15.303
27 HB3 SER 4 2HB SER 4 -1.442 24.745 -14.687
28 HG SER 4 HG SER 4 -0.805 25.578 -16.770
29 H HIS 5 H HIS 5 2.247 23.923 -14.189
30 HA HIS 5 HA HIS 5 4.132 26.084 -14.963
31 HB2 HIS 5 1HB HIS 5 4.349 25.323 -12.480
32 HB3 HIS 5 2HB HIS 5 4.964 23.803 -13.143
33 HD1 HIS 5 HD1 HIS 5 7.421 23.826 -14.037
34 HD2 HIS 5 HD2 HIS 5 5.979 27.579 -12.910
35 HE1 HIS 5 HE1 HIS 5 9.396 25.402 -14.009
36 H SER 6 H SER 6 5.849 25.186 -16.330
37 HA SER 6 HA SER 6 4.875 22.808 -17.828
38 HB2 SER 6 1HB SER 6 7.046 24.852 -18.452
39 HB3 SER 6 2HB SER 6 6.540 23.525 -19.520
40 HG SER 6 HG SER 6 4.944 25.693 -18.607
41 H SER 7 H SER 7 6.547 21.216 -18.538
42 HA SER 7 HA SER 7 8.812 21.005 -16.606
43 HB2 SER 7 1HB SER 7 6.977 19.436 -15.986
44 HB3 SER 7 2HB SER 7 7.115 18.687 -17.590
45 HG SER 7 HG SER 7 8.736 18.448 -15.359
46 HA PRO 8 HA PRO 8 10.347 20.508 -20.936
47 HB2 PRO 8 1HB PRO 8 12.250 22.427 -20.930
48 HB3 PRO 8 2HB PRO 8 10.534 22.843 -21.230
49 HG2 PRO 8 1HG PRO 8 12.089 22.977 -18.654
50 HG3 PRO 8 2HG PRO 8 11.113 24.257 -19.445
51 HD2 PRO 8 1HD PRO 8 10.113 22.719 -17.474
52 HD3 PRO 8 2HD PRO 8 9.105 23.250 -18.854
53 H GLY 9 H GLY 9 12.859 20.159 -21.433
54 HA2 GLY 9 1HA GLY 9 13.776 18.325 -19.371
55 HA3 GLY 9 2HA GLY 9 14.506 18.585 -20.956
56 H GLU 10 H GLU 10 13.930 21.266 -18.790
57 HA GLU 10 HA GLU 10 16.833 21.773 -18.669
58 HB2 GLU 10 1HB GLU 10 14.367 23.377 -17.937
59 HB3 GLU 10 2HB GLU 10 16.005 23.945 -17.587
60 HG2 GLU 10 1HG GLU 10 16.338 24.643 -19.681
61 HG3 GLU 10 2HG GLU 10 15.798 23.103 -20.362
62 H ILE 11 H ILE 11 15.677 19.532 -17.125
63 HA ILE 11 HA ILE 11 15.510 20.241 -14.448
64 HB ILE 11 HB ILE 11 16.101 17.553 -15.769
65 HG12 ILE 11 1HG1 ILE 11 14.164 18.523 -16.922
66 HG13 ILE 11 2HG1 ILE 11 13.682 17.160 -15.934
67 HG21 ILE 11 1HG2 ILE 11 16.272 17.386 -13.482
68 HG22 ILE 11 2HG2 ILE 11 14.799 18.330 -13.222
69 HG23 ILE 11 3HG2 ILE 11 14.705 16.699 -13.928
70 HD11 ILE 11 1HD1 ILE 11 12.016 18.973 -15.807
71 HD12 ILE 11 2HD1 ILE 11 12.745 18.705 -14.212
72 HD13 ILE 11 3HD1 ILE 11 13.247 20.096 -15.200
73 H THR 12 H THR 12 17.997 20.197 -16.423
74 HA THR 12 HA THR 12 20.005 19.900 -14.239
75 HB THR 12 HB THR 12 21.585 18.939 -15.858
76 HG1 THR 12 HG1 THR 12 20.437 19.535 -17.765
77 HG21 THR 12 1HG2 THR 12 20.733 16.661 -15.723
78 HG22 THR 12 2HG2 THR 12 19.076 17.260 -15.492
79 HG23 THR 12 3HG2 THR 12 20.302 17.530 -14.232
80 H SER 13 H SER 13 19.791 22.168 -14.213
81 HA SER 13 HA SER 13 21.375 23.539 -16.350
82 HB2 SER 13 1HB SER 13 19.101 24.715 -14.729
83 HB3 SER 13 2HB SER 13 19.945 25.473 -16.096
84 HG SER 13 HG SER 13 17.811 23.947 -16.186
85 H SER 14 H SER 14 21.577 22.625 -13.200
86 HA SER 14 HA SER 14 22.517 23.434 -11.256
87 HB2 SER 14 1HB SER 14 24.422 24.701 -13.252
88 HB3 SER 14 2HB SER 14 24.760 24.382 -11.538
89 HG SER 14 HG SER 14 25.572 22.763 -12.955
90 HA PRO 15 HA PRO 15 21.070 27.816 -12.172
91 HB2 PRO 15 1HB PRO 15 18.687 27.989 -10.865
92 HB3 PRO 15 2HB PRO 15 18.844 27.255 -12.488
93 HG2 PRO 15 1HG PRO 15 18.843 25.859 -9.818
94 HG3 PRO 15 2HG PRO 15 17.789 25.555 -11.230
95 HD2 PRO 15 1HD PRO 15 19.969 24.079 -10.866
96 HD3 PRO 15 2HD PRO 15 19.547 24.676 -12.511
97 H GLN 16 H GLN 16 21.216 26.071 -9.179
98 HA GLN 16 HA GLN 16 21.009 28.433 -7.486
99 HB2 GLN 16 1HB GLN 16 21.911 25.609 -6.833
100 HB3 GLN 16 2HB GLN 16 21.551 26.876 -5.654
101 HG2 GLN 16 1HG GLN 16 19.212 26.951 -6.544
102 HG3 GLN 16 2HG GLN 16 19.598 25.550 -7.554
103 HE21 GLN 16 1HE2 GLN 16 17.983 24.454 -4.363
104 HE22 GLN 16 2HE2 GLN 16 17.558 25.592 -5.617
105 H GLY 17 H GLY 17 23.274 28.270 -9.568
106 HA2 GLY 17 1HA GLY 17 25.456 29.030 -9.614
107 HA3 GLY 17 2HA GLY 17 25.250 29.521 -7.922
108 H LEU 18 H LEU 18 24.807 26.215 -9.006
109 HA LEU 18 HA LEU 18 26.560 25.196 -6.982
110 HB2 LEU 18 1HB LEU 18 25.573 23.809 -9.498
111 HB3 LEU 18 2HB LEU 18 26.168 23.029 -8.041
112 HG LEU 18 HG LEU 18 23.632 24.665 -8.289
113 HD11 LEU 18 1HD1 LEU 18 24.055 21.671 -7.946
114 HD12 LEU 18 2HD1 LEU 18 23.557 22.484 -9.443
115 HD13 LEU 18 3HD1 LEU 18 22.485 22.508 -8.027
116 HD21 LEU 18 1HD2 LEU 18 24.789 23.113 -5.921
117 HD22 LEU 18 2HD2 LEU 18 23.121 23.730 -5.995
118 HD23 LEU 18 3HD2 LEU 18 24.483 24.865 -6.006
119 H ASP 19 H ASP 19 26.876 25.815 -10.414
120 HA ASP 19 HA ASP 19 29.552 24.640 -10.602
121 HB2 ASP 19 1HB ASP 19 27.484 25.848 -12.381
122 HB3 ASP 19 2HB ASP 19 29.176 25.931 -12.935
123 H ASN 20 H ASN 20 28.119 27.708 -9.855
124 HA ASN 20 HA ASN 20 30.787 29.009 -10.080
125 HB2 ASN 20 1HB ASN 20 27.996 30.168 -10.458
126 HB3 ASN 20 2HB ASN 20 29.485 31.096 -10.387
127 HD21 ASN 20 1HD2 ASN 20 30.464 30.447 -13.663
128 HD22 ASN 20 2HD2 ASN 20 30.987 31.026 -12.107
129 HA PRO 21 HA PRO 21 29.457 29.099 -5.629
130 HB2 PRO 21 1HB PRO 21 32.085 28.994 -4.712
131 HB3 PRO 21 2HB PRO 21 31.074 27.558 -4.972
132 HG2 PRO 21 1HG PRO 21 33.078 28.792 -6.755
133 HG3 PRO 21 2HG PRO 21 32.848 27.080 -6.355
134 HD2 PRO 21 1HD PRO 21 31.997 28.029 -8.646
135 HD3 PRO 21 2HD PRO 21 30.990 26.867 -7.709
136 H ALA 22 H ALA 22 31.898 30.821 -7.562
137 HA ALA 22 HA ALA 22 32.420 32.920 -5.715
138 HB1 ALA 22 1HB ALA 22 33.168 34.177 -7.728
139 HB2 ALA 22 2HB ALA 22 33.807 32.519 -7.709
140 HB3 ALA 22 3HB ALA 22 32.441 32.932 -8.772
141 H LEU 23 H LEU 23 29.993 32.579 -8.297
142 HA LEU 23 HA LEU 23 28.850 35.195 -7.871
143 HB2 LEU 23 1HB LEU 23 27.596 32.748 -9.156
144 HB3 LEU 23 2HB LEU 23 27.069 34.415 -9.344
145 HG LEU 23 HG LEU 23 29.671 33.236 -10.374
146 HD11 LEU 23 1HD1 LEU 23 28.625 33.443 -12.563
147 HD12 LEU 23 2HD1 LEU 23 27.155 34.119 -11.820
148 HD13 LEU 23 3HD1 LEU 23 27.616 32.441 -11.508
149 HD21 LEU 23 1HD2 LEU 23 29.921 35.311 -11.646
150 HD22 LEU 23 2HD2 LEU 23 29.983 35.604 -9.897
151 HD23 LEU 23 3HD2 LEU 23 28.506 36.001 -10.807
152 H LEU 24 H LEU 24 28.069 31.882 -6.764
153 HA LEU 24 HA LEU 24 25.572 32.606 -5.573
154 HB2 LEU 24 1HB LEU 24 26.210 30.283 -6.066
155 HB3 LEU 24 2HB LEU 24 27.515 30.375 -4.884
156 HG LEU 24 HG LEU 24 25.913 30.653 -3.073
157 HD11 LEU 24 1HD1 LEU 24 23.787 30.478 -5.222
158 HD12 LEU 24 2HD1 LEU 24 24.094 31.824 -4.085
159 HD13 LEU 24 3HD1 LEU 24 23.475 30.280 -3.481
160 HD21 LEU 24 1HD2 LEU 24 24.853 28.411 -3.209
161 HD22 LEU 24 2HD2 LEU 24 26.586 28.445 -3.592
162 HD23 LEU 24 3HD2 LEU 24 25.400 28.318 -4.900
163 H ARG 25 H ARG 25 28.914 32.452 -4.298
164 HA ARG 25 HA ARG 25 28.310 33.081 -1.586
165 HB2 ARG 25 1HB ARG 25 30.520 32.332 -2.324
166 HB3 ARG 25 2HB ARG 25 30.666 33.709 -3.390
167 HG2 ARG 25 1HG ARG 25 30.409 35.012 -1.017
168 HG3 ARG 25 2HG ARG 25 31.151 33.503 -0.460
169 HD2 ARG 25 1HD ARG 25 32.859 35.183 -0.988
170 HD3 ARG 25 2HD ARG 25 32.967 33.807 -2.107
171 HE ARG 25 HE ARG 25 31.329 35.522 -3.445
172 HH11 ARG 25 1HH1 ARG 25 34.523 35.989 -2.039
173 HH12 ARG 25 2HH1 ARG 25 34.945 37.226 -3.193
174 HH21 ARG 25 1HH2 ARG 25 31.901 37.152 -4.843
175 HH22 ARG 25 2HH2 ARG 25 33.489 37.858 -4.758
176 H ASP 26 H ASP 26 28.888 35.118 -4.461
177 HA ASP 26 HA ASP 26 28.811 37.613 -3.094
178 HB2 ASP 26 1HB ASP 26 29.397 36.776 -5.590
179 HB3 ASP 26 2HB ASP 26 27.797 37.442 -5.889
180 H MET 27 H MET 27 26.231 35.787 -4.814
181 HA MET 27 HA MET 27 24.128 37.669 -4.359
182 HB2 MET 27 1HB MET 27 24.059 35.685 -5.907
183 HB3 MET 27 2HB MET 27 23.934 34.644 -4.485
184 HG2 MET 27 1HG MET 27 21.826 35.832 -3.853
185 HG3 MET 27 2HG MET 27 21.942 36.750 -5.362
186 HE1 MET 27 1HE MET 27 22.301 32.980 -4.087
187 HE2 MET 27 2HE MET 27 20.660 33.487 -3.632
188 HE3 MET 27 3HE MET 27 20.893 32.244 -4.881
189 H LEU 28 H LEU 28 25.283 34.894 -2.434
190 HA LEU 28 HA LEU 28 23.217 34.982 -0.482
191 HB2 LEU 28 1HB LEU 28 25.989 33.908 -0.611
192 HB3 LEU 28 2HB LEU 28 25.142 33.946 0.934
193 HG LEU 28 HG LEU 28 23.861 32.711 -1.498
194 HD11 LEU 28 1HD1 LEU 28 24.756 30.587 -0.720
195 HD12 LEU 28 2HD1 LEU 28 25.693 31.441 0.530
196 HD13 LEU 28 3HD1 LEU 28 26.039 31.719 -1.187
197 HD21 LEU 28 1HD2 LEU 28 23.559 32.142 1.478
198 HD22 LEU 28 2HD2 LEU 28 22.541 31.531 0.149
199 HD23 LEU 28 3HD2 LEU 28 22.525 33.248 0.575
200 H LEU 29 H LEU 29 26.431 36.519 -0.624
201 HA LEU 29 HA LEU 29 26.316 37.671 2.010
202 HB2 LEU 29 1HB LEU 29 27.766 38.474 -0.527
203 HB3 LEU 29 2HB LEU 29 27.957 39.361 0.982
204 HG LEU 29 HG LEU 29 28.567 36.406 0.749
205 HD11 LEU 29 1HD1 LEU 29 30.444 38.766 0.385
206 HD12 LEU 29 2HD1 LEU 29 29.955 37.593 -0.863
207 HD13 LEU 29 3HD1 LEU 29 30.938 37.061 0.518
208 HD21 LEU 29 1HD2 LEU 29 29.438 38.516 2.758
209 HD22 LEU 29 2HD2 LEU 29 29.943 36.808 2.750
210 HD23 LEU 29 3HD2 LEU 29 28.246 37.225 3.042
211 H ALA 30 H ALA 30 25.106 38.722 -1.131
212 HA ALA 30 HA ALA 30 24.279 41.333 -0.121
213 HB1 ALA 30 1HB ALA 30 23.361 41.626 -2.383
214 HB2 ALA 30 2HB ALA 30 25.021 40.988 -2.461
215 HB3 ALA 30 3HB ALA 30 23.636 39.904 -2.736
216 H ASN 31 H ASN 31 22.912 38.190 0.141
217 HA ASN 31 HA ASN 31 20.153 39.365 0.204
218 HB2 ASN 31 1HB ASN 31 20.720 37.639 -1.554
219 HB3 ASN 31 2HB ASN 31 20.893 36.475 -0.252
220 HD21 ASN 31 1HD2 ASN 31 17.394 36.778 -1.816
221 HD22 ASN 31 2HD2 ASN 31 18.975 36.914 -2.558
222 HA PRO 32 HA PRO 32 20.898 38.305 4.496
223 HB2 PRO 32 1HB PRO 32 18.769 39.632 5.611
224 HB3 PRO 32 2HB PRO 32 20.281 40.445 5.094
225 HG2 PRO 32 1HG PRO 32 17.703 40.136 3.563
226 HG3 PRO 32 2HG PRO 32 18.645 41.625 3.891
227 HD2 PRO 32 1HD PRO 32 18.910 40.349 1.573
228 HD3 PRO 32 2HD PRO 32 20.356 41.018 2.413
229 H HIS 33 H HIS 33 17.884 37.722 2.702
230 HA HIS 33 HA HIS 33 16.759 36.006 4.784
231 HB2 HIS 33 1HB HIS 33 15.333 37.160 3.130
232 HB3 HIS 33 2HB HIS 33 16.121 36.273 1.820
233 HD1 HIS 33 HD1 HIS 33 13.718 35.727 4.716
234 HD2 HIS 33 HD2 HIS 33 15.235 33.696 1.409
235 HE1 HIS 33 HE1 HIS 33 12.350 33.614 4.459
236 H GLU 34 H GLU 34 18.564 35.592 1.760
237 HA GLU 34 HA GLU 34 18.316 32.713 1.699
238 HB2 GLU 34 1HB GLU 34 19.571 34.863 0.178
239 HB3 GLU 34 2HB GLU 34 20.558 33.436 0.196
240 HG2 GLU 34 1HG GLU 34 17.647 33.469 -0.612
241 HG3 GLU 34 2HG GLU 34 18.997 33.636 -1.747
242 H LEU 35 H LEU 35 20.818 35.034 2.789
243 HA LEU 35 HA LEU 35 22.702 33.034 3.530
244 HB2 LEU 35 1HB LEU 35 23.969 34.697 4.279
245 HB3 LEU 35 2HB LEU 35 22.923 35.483 3.149
246 HG LEU 35 HG LEU 35 21.656 36.496 4.983
247 HD11 LEU 35 1HD1 LEU 35 22.892 36.733 7.164
248 HD12 LEU 35 2HD1 LEU 35 23.836 35.293 6.695
249 HD13 LEU 35 3HD1 LEU 35 22.073 35.187 6.917
250 HD21 LEU 35 1HD2 LEU 35 23.403 37.540 3.669
251 HD22 LEU 35 2HD2 LEU 35 24.645 36.886 4.753
252 HD23 LEU 35 3HD2 LEU 35 23.497 38.117 5.347
253 H SER 36 H SER 36 19.865 34.292 5.121
254 HA SER 36 HA SER 36 20.504 33.304 7.754
255 HB2 SER 36 1HB SER 36 18.967 35.210 7.365
256 HB3 SER 36 2HB SER 36 17.804 34.094 6.617
257 HG SER 36 HG SER 36 17.710 32.979 8.605
258 H LEU 37 H LEU 37 18.500 32.117 5.010
259 HA LEU 37 HA LEU 37 17.578 29.823 6.513
260 HB2 LEU 37 1HB LEU 37 16.635 29.072 4.589
261 HB3 LEU 37 2HB LEU 37 16.608 30.784 4.510
262 HG LEU 37 HG LEU 37 18.333 30.743 2.756
263 HD11 LEU 37 1HD1 LEU 37 19.249 28.525 2.988
264 HD12 LEU 37 2HD1 LEU 37 18.426 28.636 1.430
265 HD13 LEU 37 3HD1 LEU 37 17.644 27.794 2.796
266 HD21 LEU 37 1HD2 LEU 37 15.645 29.398 2.324
267 HD22 LEU 37 2HD2 LEU 37 16.628 30.163 1.058
268 HD23 LEU 37 3HD2 LEU 37 15.958 31.150 2.369
269 H LEU 38 H LEU 38 20.321 30.619 4.529
270 HA LEU 38 HA LEU 38 21.285 27.983 4.272
271 HB2 LEU 38 1HB LEU 38 21.915 29.985 3.002
272 HB3 LEU 38 2HB LEU 38 22.832 30.572 4.404
273 HG LEU 38 HG LEU 38 24.208 28.481 4.361
274 HD11 LEU 38 1HD1 LEU 38 22.792 28.069 1.716
275 HD12 LEU 38 2HD1 LEU 38 22.729 27.017 3.149
276 HD13 LEU 38 3HD1 LEU 38 24.242 27.187 2.249
277 HD21 LEU 38 1HD2 LEU 38 24.987 30.607 3.363
278 HD22 LEU 38 2HD2 LEU 38 24.349 30.058 1.798
279 HD23 LEU 38 3HD2 LEU 38 25.668 29.164 2.583
280 H LYS 39 H LYS 39 22.025 30.463 6.769
281 HA LYS 39 HA LYS 39 23.727 28.606 8.209
282 HB2 LYS 39 1HB LYS 39 23.492 30.147 10.146
283 HB3 LYS 39 2HB LYS 39 24.132 30.870 8.670
284 HG2 LYS 39 1HG LYS 39 22.097 32.014 8.241
285 HG3 LYS 39 2HG LYS 39 21.220 31.129 9.460
286 HD2 LYS 39 1HD LYS 39 21.672 33.284 10.356
287 HD3 LYS 39 2HD LYS 39 22.779 32.164 11.177
288 HE2 LYS 39 1HE LYS 39 24.599 32.834 9.632
289 HE3 LYS 39 2HE LYS 39 23.480 33.922 8.783
290 HZ1 LYS 39 1HZ LYS 39 23.241 35.175 10.837
291 HZ2 LYS 39 2HZ LYS 39 24.828 35.109 10.394
292 HZ3 LYS 39 3HZ LYS 39 24.278 34.163 11.627
293 H GLU 40 H GLU 40 20.250 29.029 8.159
294 HA GLU 40 HA GLU 40 19.883 27.509 10.625
295 HB2 GLU 40 1HB GLU 40 18.220 29.146 9.588
296 HB3 GLU 40 2HB GLU 40 17.895 27.915 8.364
297 HG2 GLU 40 1HG GLU 40 17.577 26.453 10.654
298 HG3 GLU 40 2HG GLU 40 17.064 28.052 11.214
299 H ARG 41 H ARG 41 19.462 26.804 7.114
300 HA ARG 41 HA ARG 41 18.932 23.976 7.695
301 HB2 ARG 41 1HB ARG 41 19.453 25.386 5.056
302 HB3 ARG 41 2HB ARG 41 18.770 23.770 5.243
303 HG2 ARG 41 1HG ARG 41 17.462 26.291 6.318
304 HG3 ARG 41 2HG ARG 41 17.128 25.604 4.733
305 HD2 ARG 41 1HD ARG 41 15.941 23.821 5.603
306 HD3 ARG 41 2HD ARG 41 16.908 23.773 7.087
307 HE ARG 41 HE ARG 41 15.554 25.385 8.089
308 HH11 ARG 41 1HH1 ARG 41 14.524 24.999 4.716
309 HH12 ARG 41 2HH1 ARG 41 13.079 25.937 4.975
310 HH21 ARG 41 1HH2 ARG 41 13.777 26.573 8.315
311 HH22 ARG 41 2HH2 ARG 41 12.646 26.803 6.994
312 H ASN 42 H ASN 42 21.749 25.774 6.544
313 HA ASN 42 HA ASN 42 23.278 23.200 6.517
314 HB2 ASN 42 1HB ASN 42 22.566 24.081 4.211
315 HB3 ASN 42 2HB ASN 42 23.695 25.388 4.464
316 HD21 ASN 42 1HD2 ASN 42 25.450 22.768 2.606
317 HD22 ASN 42 2HD2 ASN 42 24.195 23.954 2.360
318 HA PRO 43 HA PRO 43 25.342 26.649 8.835
319 HB2 PRO 43 1HB PRO 43 26.396 25.046 10.866
320 HB3 PRO 43 2HB PRO 43 24.874 25.988 10.938
321 HG2 PRO 43 1HG PRO 43 25.271 23.088 10.289
322 HG3 PRO 43 2HG PRO 43 24.056 23.860 11.348
323 HD2 PRO 43 1HD PRO 43 23.434 23.084 8.858
324 HD3 PRO 43 2HD PRO 43 22.787 24.621 9.534
325 HA PRO 44 HA PRO 44 29.469 24.600 8.252
326 HB2 PRO 44 1HB PRO 44 29.854 22.553 6.490
327 HB3 PRO 44 2HB PRO 44 29.531 22.289 8.233
328 HG2 PRO 44 1HG PRO 44 27.606 22.250 5.944
329 HG3 PRO 44 2HG PRO 44 27.873 21.017 7.215
330 HD2 PRO 44 1HD PRO 44 25.883 22.802 7.436
331 HD3 PRO 44 2HD PRO 44 26.852 22.335 8.872
332 H LEU 45 H LEU 45 27.184 24.572 5.424
333 HA LEU 45 HA LEU 45 29.261 25.684 3.683
334 HB2 LEU 45 1HB LEU 45 27.322 24.443 2.788
335 HB3 LEU 45 2HB LEU 45 26.253 25.721 3.364
336 HG LEU 45 HG LEU 45 27.220 27.313 1.802
337 HD11 LEU 45 1HD1 LEU 45 28.873 26.600 0.071
338 HD12 LEU 45 2HD1 LEU 45 29.086 25.061 0.934
339 HD13 LEU 45 3HD1 LEU 45 29.560 26.595 1.699
340 HD21 LEU 45 1HD2 LEU 45 26.417 26.336 -0.262
341 HD22 LEU 45 2HD2 LEU 45 25.402 25.757 1.068
342 HD23 LEU 45 3HD2 LEU 45 26.644 24.689 0.373
343 H ALA 46 H ALA 46 26.684 26.829 5.804
344 HA ALA 46 HA ALA 46 26.805 29.556 5.023
345 HB1 ALA 46 1HB ALA 46 25.051 28.483 6.405
346 HB2 ALA 46 2HB ALA 46 26.190 28.475 7.770
347 HB3 ALA 46 3HB ALA 46 25.664 30.018 7.059
348 H GLU 47 H GLU 47 28.627 27.861 7.682
349 HA GLU 47 HA GLU 47 29.831 30.268 8.623
350 HB2 GLU 47 1HB GLU 47 31.381 28.908 9.827
351 HB3 GLU 47 2HB GLU 47 29.777 28.168 9.896
352 HG2 GLU 47 1HG GLU 47 30.459 26.587 8.128
353 HG3 GLU 47 2HG GLU 47 32.082 27.286 8.133
354 H ALA 48 H ALA 48 30.702 28.151 5.961
355 HA ALA 48 HA ALA 48 33.269 29.218 5.434
356 HB1 ALA 48 1HB ALA 48 32.288 27.085 4.507
357 HB2 ALA 48 2HB ALA 48 31.242 28.077 3.467
358 HB3 ALA 48 3HB ALA 48 32.995 28.141 3.274
359 H LEU 49 H LEU 49 29.985 30.205 4.494
360 HA LEU 49 HA LEU 49 30.796 32.330 2.701
361 HB2 LEU 49 1HB LEU 49 28.523 31.291 2.712
362 HB3 LEU 49 2HB LEU 49 28.253 31.940 4.319
363 HG LEU 49 HG LEU 49 28.655 34.267 3.227
364 HD11 LEU 49 1HD1 LEU 49 29.434 33.449 1.076
365 HD12 LEU 49 2HD1 LEU 49 27.915 34.337 0.879
366 HD13 LEU 49 3HD1 LEU 49 27.915 32.562 0.831
367 HD21 LEU 49 1HD2 LEU 49 26.551 33.454 4.213
368 HD22 LEU 49 2HD2 LEU 49 26.140 32.666 2.670
369 HD23 LEU 49 3HD2 LEU 49 26.277 34.440 2.763
370 H LEU 50 H LEU 50 29.951 32.135 6.176
371 HA LEU 50 HA LEU 50 29.891 34.959 6.633
372 HB2 LEU 50 1HB LEU 50 30.764 32.888 8.666
373 HB3 LEU 50 2HB LEU 50 30.050 34.456 8.978
374 HG LEU 50 HG LEU 50 28.726 31.934 8.078
375 HD11 LEU 50 1HD1 LEU 50 28.215 33.765 10.397
376 HD12 LEU 50 2HD1 LEU 50 29.098 32.216 10.430
377 HD13 LEU 50 3HD1 LEU 50 27.371 32.233 10.038
378 HD21 LEU 50 1HD2 LEU 50 27.703 33.519 6.638
379 HD22 LEU 50 2HD2 LEU 50 27.487 34.677 7.980
380 HD23 LEU 50 3HD2 LEU 50 26.574 33.143 7.945
381 H SER 51 H SER 51 32.463 32.651 6.388
382 HA SER 51 HA SER 51 34.494 34.285 7.658
383 HB2 SER 51 1HB SER 51 34.375 31.751 7.435
384 HB3 SER 51 2HB SER 51 34.829 31.973 5.741
385 HG SER 51 HG SER 51 36.724 33.129 6.579
386 H GLY 52 H GLY 52 33.061 34.219 4.479
387 HA2 GLY 52 1HA GLY 52 33.419 35.831 2.837
388 HA3 GLY 52 2HA GLY 52 34.898 36.347 3.653
389 H ASP 53 H ASP 53 36.021 33.643 3.738
390 HA ASP 53 HA ASP 53 37.574 33.629 1.418
391 HB2 ASP 53 1HB ASP 53 36.952 31.679 3.525
392 HB3 ASP 53 2HB ASP 53 38.042 31.279 2.214
393 H LEU 54 H LEU 54 36.824 33.435 -0.603
394 HA LEU 54 HA LEU 54 34.540 31.872 -1.326
395 HB2 LEU 54 1HB LEU 54 35.530 33.620 -2.760
396 HB3 LEU 54 2HB LEU 54 36.961 32.632 -3.000
397 HG LEU 54 HG LEU 54 35.134 32.776 -4.820
398 HD11 LEU 54 1HD1 LEU 54 35.716 30.637 -5.735
399 HD12 LEU 54 2HD1 LEU 54 36.215 30.042 -4.140
400 HD13 LEU 54 3HD1 LEU 54 37.133 31.339 -4.934
401 HD21 LEU 54 1HD2 LEU 54 33.176 32.165 -3.493
402 HD22 LEU 54 2HD2 LEU 54 33.869 30.558 -3.208
403 HD23 LEU 54 3HD2 LEU 54 33.440 31.053 -4.842
404 H GLU 55 H GLU 55 38.037 31.131 -0.992
405 HA GLU 55 HA GLU 55 37.959 28.620 -2.277
406 HB2 GLU 55 1HB GLU 55 39.953 28.052 -0.925
407 HB3 GLU 55 2HB GLU 55 40.064 29.590 -1.780
408 HG2 GLU 55 1HG GLU 55 39.666 30.819 0.291
409 HG3 GLU 55 2HG GLU 55 39.435 29.298 1.171
410 H LYS 56 H LYS 56 37.282 29.345 1.205
411 HA LYS 56 HA LYS 56 36.776 26.528 1.682
412 HB2 LYS 56 1HB LYS 56 36.090 27.120 3.898
413 HB3 LYS 56 2HB LYS 56 37.557 28.051 3.447
414 HG2 LYS 56 1HG LYS 56 35.998 29.914 2.981
415 HG3 LYS 56 2HG LYS 56 34.800 28.998 3.870
416 HD2 LYS 56 1HD LYS 56 37.584 29.594 4.931
417 HD3 LYS 56 2HD LYS 56 36.208 30.638 5.216
418 HE2 LYS 56 1HE LYS 56 35.019 28.761 6.344
419 HE3 LYS 56 2HE LYS 56 36.491 27.774 6.154
420 HZ1 LYS 56 1HZ LYS 56 37.704 29.407 7.433
421 HZ2 LYS 56 2HZ LYS 56 36.385 28.947 8.312
422 HZ3 LYS 56 3HZ LYS 56 36.397 30.406 7.533
423 H PHE 57 H PHE 57 34.797 29.354 0.819
424 HA PHE 57 HA PHE 57 32.282 28.067 1.226
425 HB2 PHE 57 1HB PHE 57 32.517 30.480 0.801
426 HB3 PHE 57 2HB PHE 57 33.054 30.139 -0.850
427 HD1 PHE 57 HD1 PHE 57 30.160 29.891 1.478
428 HD2 PHE 57 HD2 PHE 57 31.503 29.660 -2.602
429 HE1 PHE 57 HE1 PHE 57 27.794 29.867 0.701
430 HE2 PHE 57 HE2 PHE 57 29.145 29.630 -3.380
431 HZ PHE 57 HZ PHE 57 27.293 29.753 -1.739
432 H SER 58 H SER 58 34.337 28.258 -1.727
433 HA SER 58 HA SER 58 32.716 26.537 -3.304
434 HB2 SER 58 1HB SER 58 34.507 28.007 -4.186
435 HB3 SER 58 2HB SER 58 35.726 27.010 -3.368
436 HG SER 58 HG SER 58 35.479 26.418 -5.558
437 H ARG 59 H ARG 59 35.499 25.785 -1.157
438 HA ARG 59 HA ARG 59 35.702 23.039 -1.876
439 HB2 ARG 59 1HB ARG 59 37.392 24.215 -0.556
440 HB3 ARG 59 2HB ARG 59 36.243 24.464 0.757
441 HG2 ARG 59 1HG ARG 59 36.619 21.618 0.030
442 HG3 ARG 59 2HG ARG 59 38.089 22.426 0.608
443 HD2 ARG 59 1HD ARG 59 36.805 23.251 2.595
444 HD3 ARG 59 2HD ARG 59 35.412 22.298 2.045
445 HE ARG 59 HE ARG 59 37.626 20.558 2.197
446 HH11 ARG 59 1HH1 ARG 59 35.550 22.366 4.394
447 HH12 ARG 59 2HH1 ARG 59 35.807 21.253 5.706
448 HH21 ARG 59 1HH2 ARG 59 37.886 19.167 3.906
449 HH22 ARG 59 2HH2 ARG 59 37.110 19.477 5.432
450 H VAL 60 H VAL 60 33.764 24.621 0.703
451 HA VAL 60 HA VAL 60 32.647 22.096 1.551
452 HB VAL 60 HB VAL 60 31.668 24.937 2.088
453 HG11 VAL 60 1HG1 VAL 60 29.866 23.373 2.500
454 HG12 VAL 60 2HG1 VAL 60 30.961 22.250 3.342
455 HG13 VAL 60 3HG1 VAL 60 30.561 23.823 4.068
456 HG21 VAL 60 1HG2 VAL 60 33.393 23.039 3.756
457 HG22 VAL 60 2HG2 VAL 60 33.971 24.505 2.936
458 HG23 VAL 60 3HG2 VAL 60 32.814 24.644 4.270
459 H LEU 61 H LEU 61 31.738 24.570 -0.840
460 HA LEU 61 HA LEU 61 29.073 23.744 -1.285
461 HB2 LEU 61 1HB LEU 61 30.400 25.716 -2.309
462 HB3 LEU 61 2HB LEU 61 30.977 24.557 -3.496
463 HG LEU 61 HG LEU 61 28.313 24.117 -3.705
464 HD11 LEU 61 1HD1 LEU 61 28.635 27.054 -3.010
465 HD12 LEU 61 2HD1 LEU 61 27.847 25.830 -1.977
466 HD13 LEU 61 3HD1 LEU 61 27.143 26.245 -3.554
467 HD21 LEU 61 1HD2 LEU 61 30.083 24.960 -5.457
468 HD22 LEU 61 2HD2 LEU 61 29.386 26.558 -5.094
469 HD23 LEU 61 3HD2 LEU 61 28.357 25.271 -5.714
470 H VAL 62 H VAL 62 32.137 22.479 -2.695
471 HA VAL 62 HA VAL 62 30.794 20.551 -4.374
472 HB VAL 62 HB VAL 62 33.643 20.495 -3.257
473 HG11 VAL 62 1HG1 VAL 62 32.981 18.277 -4.064
474 HG12 VAL 62 2HG1 VAL 62 32.364 18.972 -5.580
475 HG13 VAL 62 3HG1 VAL 62 34.109 19.007 -5.220
476 HG21 VAL 62 1HG2 VAL 62 33.211 22.516 -4.567
477 HG22 VAL 62 2HG2 VAL 62 34.269 21.424 -5.467
478 HG23 VAL 62 3HG2 VAL 62 32.546 21.548 -5.897
479 H GLU 63 H GLU 63 32.240 20.362 -1.097
480 HA GLU 63 HA GLU 63 31.814 17.561 -0.715
481 HB2 GLU 63 1HB GLU 63 31.811 19.875 1.250
482 HB3 GLU 63 2HB GLU 63 31.756 18.179 1.740
483 HG2 GLU 63 1HG GLU 63 33.914 17.766 0.672
484 HG3 GLU 63 2HG GLU 63 33.976 19.434 0.100
485 H GLN 64 H GLN 64 29.691 20.373 -0.121
486 HA GLN 64 HA GLN 64 27.515 18.828 0.961
487 HB2 GLN 64 1HB GLN 64 27.695 21.555 -0.348
488 HB3 GLN 64 2HB GLN 64 26.170 20.888 0.241
489 HG2 GLN 64 1HG GLN 64 28.636 21.294 1.961
490 HG3 GLN 64 2HG GLN 64 27.280 22.421 1.855
491 HE21 GLN 64 1HE2 GLN 64 27.089 19.592 4.554
492 HE22 GLN 64 2HE2 GLN 64 28.539 20.259 3.845
493 H GLN 65 H GLN 65 28.387 19.805 -2.389
494 HA GLN 65 HA GLN 65 25.918 18.829 -3.513
495 HB2 GLN 65 1HB GLN 65 28.664 19.301 -4.692
496 HB3 GLN 65 2HB GLN 65 27.322 18.645 -5.636
497 HG2 GLN 65 1HG GLN 65 25.970 20.645 -5.070
498 HG3 GLN 65 2HG GLN 65 27.366 21.335 -4.250
499 HE21 GLN 65 1HE2 GLN 65 28.688 22.662 -7.173
500 HE22 GLN 65 2HE2 GLN 65 28.629 22.631 -5.424
501 H GLN 66 H GLN 66 29.055 17.242 -2.793
502 HA GLN 66 HA GLN 66 28.401 14.764 -4.089
503 HB2 GLN 66 1HB GLN 66 30.170 15.385 -1.698
504 HB3 GLN 66 2HB GLN 66 30.028 13.779 -2.419
505 HG2 GLN 66 1HG GLN 66 30.884 14.631 -4.550
506 HG3 GLN 66 2HG GLN 66 31.006 16.255 -3.870
507 HE21 GLN 66 1HE2 GLN 66 34.362 15.426 -3.263
508 HE22 GLN 66 2HE2 GLN 66 33.239 16.341 -4.241
509 H ASP 67 H ASP 67 27.864 15.983 -0.759
510 HA ASP 67 HA ASP 67 26.662 13.541 0.177
511 HB2 ASP 67 1HB ASP 67 27.637 15.431 1.559
512 HB3 ASP 67 2HB ASP 67 26.168 16.334 1.201
513 H ARG 68 H ARG 68 25.341 16.524 -1.274
514 HA ARG 68 HA ARG 68 22.555 15.853 -0.917
515 HB2 ARG 68 1HB ARG 68 24.015 17.400 -3.095
516 HB3 ARG 68 2HB ARG 68 22.284 17.093 -3.170
517 HG2 ARG 68 1HG ARG 68 22.001 18.318 -1.016
518 HG3 ARG 68 2HG ARG 68 23.726 18.745 -1.087
519 HD2 ARG 68 1HD ARG 68 23.326 19.688 -3.388
520 HD3 ARG 68 2HD ARG 68 21.596 19.379 -3.165
521 HE ARG 68 HE ARG 68 22.645 20.992 -1.023
522 HH11 ARG 68 1HH1 ARG 68 21.606 21.204 -4.393
523 HH12 ARG 68 2HH1 ARG 68 21.237 22.913 -4.275
524 HH21 ARG 68 1HH2 ARG 68 22.156 23.189 -0.965
525 HH22 ARG 68 2HH2 ARG 68 21.550 23.993 -2.391
526 H ALA 69 H ALA 69 24.851 15.245 -3.602
527 HA ALA 69 HA ALA 69 23.031 13.862 -5.226
528 HB1 ALA 69 1HB ALA 69 25.025 13.009 -6.398
529 HB2 ALA 69 2HB ALA 69 25.208 14.731 -5.991
530 HB3 ALA 69 3HB ALA 69 26.048 13.496 -5.024
531 H ARG 70 H ARG 70 24.865 12.595 -2.432
532 HA ARG 70 HA ARG 70 24.642 9.874 -3.220
533 HB2 ARG 70 1HB ARG 70 25.743 9.450 -1.297
534 HB3 ARG 70 2HB ARG 70 26.025 11.193 -1.331
535 HG2 ARG 70 1HG ARG 70 24.160 11.522 0.222
536 HG3 ARG 70 2HG ARG 70 23.874 9.802 0.242
537 HD2 ARG 70 1HD ARG 70 26.479 11.111 1.050
538 HD3 ARG 70 2HD ARG 70 25.190 10.687 2.190
539 HE ARG 70 HE ARG 70 25.760 8.352 0.751
540 HH11 ARG 70 1HH1 ARG 70 27.491 10.479 2.968
541 HH12 ARG 70 2HH1 ARG 70 28.521 9.194 3.549
542 HH21 ARG 70 1HH2 ARG 70 27.094 6.756 1.544
543 HH22 ARG 70 2HH2 ARG 70 28.299 7.122 2.749
544 H ARG 71 H ARG 71 22.502 11.976 -1.255
545 HA ARG 71 HA ARG 71 20.542 9.780 -1.000
546 HB2 ARG 71 1HB ARG 71 19.187 11.480 0.215
547 HB3 ARG 71 2HB ARG 71 20.773 11.151 0.919
548 HG2 ARG 71 1HG ARG 71 21.653 13.222 -0.060
549 HG3 ARG 71 2HG ARG 71 20.063 13.585 -0.753
550 HD2 ARG 71 1HD ARG 71 19.105 13.967 1.348
551 HD3 ARG 71 2HD ARG 71 20.378 13.072 2.200
552 HE ARG 71 HE ARG 71 20.497 15.850 1.243
553 HH11 ARG 71 1HH1 ARG 71 22.341 13.134 2.553
554 HH12 ARG 71 2HH1 ARG 71 23.672 14.161 3.044
555 HH21 ARG 71 1HH2 ARG 71 22.255 17.079 1.924
556 HH22 ARG 71 2HH2 ARG 71 23.619 16.299 2.706
557 H GLU 72 H GLU 72 20.955 12.727 -2.926
558 HA GLU 72 HA GLU 72 18.262 12.993 -3.760
559 HB2 GLU 72 1HB GLU 72 20.531 14.410 -4.205
560 HB3 GLU 72 2HB GLU 72 20.381 13.610 -5.761
561 HG2 GLU 72 1HG GLU 72 18.931 15.188 -6.360
562 HG3 GLU 72 2HG GLU 72 17.807 14.602 -5.120
563 H GLN 73 H GLN 73 20.929 11.001 -5.046
564 HA GLN 73 HA GLN 73 19.666 10.152 -7.430
565 HB2 GLN 73 1HB GLN 73 21.671 8.866 -5.584
566 HB3 GLN 73 2HB GLN 73 21.061 8.021 -7.015
567 HG2 GLN 73 1HG GLN 73 21.849 9.811 -8.464
568 HG3 GLN 73 2HG GLN 73 22.415 10.728 -7.063
569 HE21 GLN 73 1HE2 GLN 73 25.443 9.058 -6.814
570 HE22 GLN 73 2HE2 GLN 73 24.381 10.329 -6.243
571 H GLU 74 H GLU 74 19.242 8.995 -4.083
572 HA GLU 74 HA GLU 74 17.712 6.672 -4.853
573 HB2 GLU 74 1HB GLU 74 17.586 8.241 -2.252
574 HB3 GLU 74 2HB GLU 74 17.094 6.565 -2.502
575 HG2 GLU 74 1HG GLU 74 19.452 5.956 -2.963
576 HG3 GLU 74 2HG GLU 74 19.933 7.643 -2.697
577 H ARG 75 H ARG 75 16.930 10.040 -4.021
578 HA ARG 75 HA ARG 75 14.077 9.587 -3.989
579 HB2 ARG 75 1HB ARG 75 15.588 12.195 -4.387
580 HB3 ARG 75 2HB ARG 75 13.888 12.013 -3.943
581 HG2 ARG 75 1HG ARG 75 14.836 10.652 -1.904
582 HG3 ARG 75 2HG ARG 75 16.354 11.478 -2.297
583 HD2 ARG 75 1HD ARG 75 15.280 12.823 -0.671
584 HD3 ARG 75 2HD ARG 75 15.039 13.656 -2.223
585 HE ARG 75 HE ARG 75 12.851 11.893 -1.781
586 HH11 ARG 75 1HH1 ARG 75 14.113 14.914 -0.458
587 HH12 ARG 75 2HH1 ARG 75 12.541 15.441 0.080
588 HH21 ARG 75 1HH2 ARG 75 10.885 12.628 -1.069
589 HH22 ARG 75 2HH2 ARG 75 10.745 14.166 -0.263
590 H ILE 76 H ILE 76 16.303 10.885 -6.503
591 HA ILE 76 HA ILE 76 14.130 11.529 -8.268
592 HB ILE 76 HB ILE 76 15.800 11.857 -10.017
593 HG12 ILE 76 1HG1 ILE 76 17.798 10.668 -8.083
594 HG13 ILE 76 2HG1 ILE 76 17.193 9.870 -9.527
595 HG21 ILE 76 1HG2 ILE 76 15.437 13.562 -8.179
596 HG22 ILE 76 2HG2 ILE 76 16.882 12.922 -7.371
597 HG23 ILE 76 3HG2 ILE 76 17.019 13.671 -8.972
598 HD11 ILE 76 1HD1 ILE 76 18.180 11.740 -10.903
599 HD12 ILE 76 2HD1 ILE 76 18.931 12.364 -9.413
600 HD13 ILE 76 3HD1 ILE 76 19.372 10.756 -10.026
601 H ARG 77 H ARG 77 15.667 8.524 -7.521
602 HA ARG 77 HA ARG 77 15.012 7.151 -9.991
603 HB2 ARG 77 1HB ARG 77 15.600 6.296 -7.157
604 HB3 ARG 77 2HB ARG 77 14.998 5.123 -8.330
605 HG2 ARG 77 1HG ARG 77 16.892 5.390 -9.739
606 HG3 ARG 77 2HG ARG 77 17.449 6.814 -8.842
607 HD2 ARG 77 1HD ARG 77 17.767 5.413 -6.829
608 HD3 ARG 77 2HD ARG 77 17.237 3.988 -7.745
609 HE ARG 77 HE ARG 77 19.379 5.219 -9.143
610 HH11 ARG 77 1HH1 ARG 77 18.875 3.446 -6.135
611 HH12 ARG 77 2HH1 ARG 77 20.507 2.834 -6.110
612 HH21 ARG 77 1HH2 ARG 77 21.449 4.405 -9.046
613 HH22 ARG 77 2HH2 ARG 77 21.936 3.372 -7.731
614 H LEU 78 H LEU 78 13.092 8.312 -7.348
615 HA LEU 78 HA LEU 78 10.905 6.416 -7.943
616 HB2 LEU 78 1HB LEU 78 11.681 7.640 -5.650
617 HB3 LEU 78 2HB LEU 78 10.470 8.793 -6.191
618 HG LEU 78 HG LEU 78 10.000 5.821 -5.764
619 HD11 LEU 78 1HD1 LEU 78 10.512 7.011 -3.672
620 HD12 LEU 78 2HD1 LEU 78 8.809 6.517 -3.724
621 HD13 LEU 78 3HD1 LEU 78 9.250 8.212 -4.034
622 HD21 LEU 78 1HD2 LEU 78 8.000 8.063 -6.264
623 HD22 LEU 78 2HD2 LEU 78 7.597 6.381 -5.862
624 HD23 LEU 78 3HD2 LEU 78 8.408 6.753 -7.393
625 H PHE 79 H PHE 79 11.472 9.993 -8.034
626 HA PHE 79 HA PHE 79 10.155 10.156 -10.604
627 HB2 PHE 79 1HB PHE 79 8.492 11.759 -9.887
628 HB3 PHE 79 2HB PHE 79 8.229 10.239 -9.047
629 HD1 PHE 79 HD1 PHE 79 9.116 13.793 -8.703
630 HD2 PHE 79 HD2 PHE 79 8.705 10.055 -6.625
631 HE1 PHE 79 HE1 PHE 79 9.145 15.008 -6.532
632 HE2 PHE 79 HE2 PHE 79 8.732 11.251 -4.443
633 HZ PHE 79 HZ PHE 79 8.954 13.739 -4.392
634 H SER 80 H SER 80 10.677 12.145 -11.656
635 HA SER 80 HA SER 80 11.988 14.318 -10.251
636 HB2 SER 80 1HB SER 80 14.109 13.921 -11.816
637 HB3 SER 80 2HB SER 80 13.995 13.200 -10.201
638 HG SER 80 HG SER 80 13.612 11.249 -11.055
639 H ALA 81 H ALA 81 10.520 15.680 -11.365
640 HA ALA 81 HA ALA 81 11.319 16.314 -14.105
641 HB1 ALA 81 1HB ALA 81 8.461 15.349 -13.573
642 HB2 ALA 81 2HB ALA 81 9.100 15.961 -15.117
643 HB3 ALA 81 3HB ALA 81 9.704 14.429 -14.456
644 H ASP 82 H ASP 82 11.266 17.748 -11.515
645 HA ASP 82 HA ASP 82 9.145 19.774 -12.096
646 HB2 ASP 82 1HB ASP 82 8.911 18.366 -10.016
647 HB3 ASP 82 2HB ASP 82 10.370 19.147 -9.398
648 HA PRO 83 HA PRO 83 12.949 22.310 -12.248
649 HB2 PRO 83 1HB PRO 83 12.346 23.879 -14.358
650 HB3 PRO 83 2HB PRO 83 12.846 22.174 -14.594
651 HG2 PRO 83 1HG PRO 83 10.111 23.384 -14.620
652 HG3 PRO 83 2HG PRO 83 10.830 22.167 -15.709
653 HD2 PRO 83 1HD PRO 83 9.152 21.602 -13.552
654 HD3 PRO 83 2HD PRO 83 10.290 20.434 -14.311
655 H PHE 84 H PHE 84 13.247 24.708 -11.891
656 HA PHE 84 HA PHE 84 10.749 26.147 -11.189
657 HB2 PHE 84 1HB PHE 84 11.399 26.605 -8.938
658 HB3 PHE 84 2HB PHE 84 11.621 24.866 -9.156
659 HD1 PHE 84 HD1 PHE 84 13.173 27.976 -8.213
660 HD2 PHE 84 HD2 PHE 84 14.044 24.036 -9.712
661 HE1 PHE 84 HE1 PHE 84 15.550 28.246 -7.524
662 HE2 PHE 84 HE2 PHE 84 16.423 24.298 -9.031
663 HZ PHE 84 HZ PHE 84 17.184 26.413 -7.944
664 H ASP 85 H ASP 85 13.371 26.151 -12.851
665 HA ASP 85 HA ASP 85 14.319 28.887 -12.180
666 HB2 ASP 85 1HB ASP 85 16.553 27.985 -12.869
667 HB3 ASP 85 2HB ASP 85 15.876 27.233 -11.420
668 H LEU 86 H LEU 86 12.386 29.020 -13.913
669 HA LEU 86 HA LEU 86 12.936 28.455 -16.634
670 HB2 LEU 86 1HB LEU 86 11.354 30.772 -15.466
671 HB3 LEU 86 2HB LEU 86 11.235 30.170 -17.117
672 HG LEU 86 HG LEU 86 10.467 28.598 -14.629
673 HD11 LEU 86 1HD1 LEU 86 8.155 29.014 -15.342
674 HD12 LEU 86 2HD1 LEU 86 8.740 30.009 -16.700
675 HD13 LEU 86 3HD1 LEU 86 9.004 30.539 -15.021
676 HD21 LEU 86 1HD2 LEU 86 9.367 27.071 -16.255
677 HD22 LEU 86 2HD2 LEU 86 11.129 27.112 -16.455
678 HD23 LEU 86 3HD2 LEU 86 10.090 27.998 -17.592
679 H GLU 87 H GLU 87 14.120 31.060 -14.612
680 HA GLU 87 HA GLU 87 15.022 32.717 -16.849
681 HB2 GLU 87 1HB GLU 87 15.606 32.727 -13.868
682 HB3 GLU 87 2HB GLU 87 16.308 33.892 -14.994
683 HG2 GLU 87 1HG GLU 87 13.311 33.563 -14.862
684 HG3 GLU 87 2HG GLU 87 14.162 34.500 -13.625
685 H ALA 88 H ALA 88 16.258 30.071 -14.962
686 HA ALA 88 HA ALA 88 18.390 29.215 -14.636
687 HB1 ALA 88 1HB ALA 88 17.840 29.009 -17.606
688 HB2 ALA 88 2HB ALA 88 18.999 28.002 -16.703
689 HB3 ALA 88 3HB ALA 88 17.261 27.912 -16.320
690 H GLN 89 H GLN 89 19.096 31.638 -14.249
691 HA GLN 89 HA GLN 89 20.648 32.945 -16.189
692 HB2 GLN 89 1HB GLN 89 21.512 34.341 -14.464
693 HB3 GLN 89 2HB GLN 89 19.824 34.004 -14.090
694 HG2 GLN 89 1HG GLN 89 20.453 32.462 -12.321
695 HG3 GLN 89 2HG GLN 89 22.156 32.541 -12.790
696 HE21 GLN 89 1HE2 GLN 89 21.036 34.945 -9.956
697 HE22 GLN 89 2HE2 GLN 89 20.350 33.392 -10.368
698 H ALA 90 H ALA 90 22.747 33.091 -16.724
699 HA ALA 90 HA ALA 90 24.734 31.342 -15.395
700 HB1 ALA 90 1HB ALA 90 24.181 31.351 -18.408
701 HB2 ALA 90 2HB ALA 90 25.492 30.470 -17.586
702 HB3 ALA 90 3HB ALA 90 23.798 30.014 -17.296
703 H LYS 91 H LYS 91 26.964 31.977 -16.204
704 HA LYS 91 HA LYS 91 27.145 34.668 -17.430
705 HB2 LYS 91 1HB LYS 91 27.868 34.017 -14.580
706 HB3 LYS 91 2HB LYS 91 28.981 35.030 -15.497
707 HG2 LYS 91 1HG LYS 91 27.723 36.743 -14.762
708 HG3 LYS 91 2HG LYS 91 26.626 36.269 -16.067
709 HD2 LYS 91 1HD LYS 91 25.571 34.669 -14.286
710 HD3 LYS 91 2HD LYS 91 26.442 35.664 -13.110
711 HE2 LYS 91 1HE LYS 91 24.190 36.501 -13.306
712 HE3 LYS 91 2HE LYS 91 25.293 37.688 -14.040
713 HZ1 LYS 91 1HZ LYS 91 24.657 36.950 -16.191
714 HZ2 LYS 91 2HZ LYS 91 23.245 37.136 -15.356
715 HZ3 LYS 91 3HZ LYS 91 23.867 35.627 -15.620
716 H ILE 92 H ILE 92 29.488 35.133 -17.861
717 HA ILE 92 HA ILE 92 31.116 32.661 -18.171
718 HB ILE 92 HB ILE 92 30.975 35.081 -20.064
719 HG12 ILE 92 1HG1 ILE 92 30.244 32.186 -20.654
720 HG13 ILE 92 2HG1 ILE 92 29.061 33.429 -20.247
721 HG21 ILE 92 1HG2 ILE 92 32.680 32.536 -20.262
722 HG22 ILE 92 2HG2 ILE 92 32.665 33.880 -21.428
723 HG23 ILE 92 3HG2 ILE 92 33.288 34.140 -19.791
724 HD11 ILE 92 1HD1 ILE 92 30.845 33.381 -22.715
725 HD12 ILE 92 2HD1 ILE 92 29.084 33.162 -22.648
726 HD13 ILE 92 3HD1 ILE 92 29.793 34.747 -22.262
727 H GLU 93 H GLU 93 32.865 32.937 -16.904
728 HA GLU 93 HA GLU 93 33.521 35.698 -15.997
729 HB2 GLU 93 1HB GLU 93 34.359 34.663 -13.932
730 HB3 GLU 93 2HB GLU 93 32.638 34.380 -14.173
731 HG2 GLU 93 1HG GLU 93 33.146 32.076 -14.973
732 HG3 GLU 93 2HG GLU 93 34.864 32.366 -14.644
733 H GLU 94 H GLU 94 35.786 36.120 -15.604
734 HA GLU 94 HA GLU 94 37.750 34.355 -16.900
735 HB2 GLU 94 1HB GLU 94 36.441 36.108 -18.543
736 HB3 GLU 94 2HB GLU 94 37.685 37.171 -17.874
737 HG2 GLU 94 1HG GLU 94 39.413 35.525 -18.621
738 HG3 GLU 94 2HG GLU 94 38.128 34.592 -19.404
739 H ASP 95 H ASP 95 39.915 35.150 -16.404
740 HA ASP 95 HA ASP 95 40.076 37.500 -14.617
741 HB2 ASP 95 1HB ASP 95 39.813 35.466 -13.159
742 HB3 ASP 95 2HB ASP 95 41.330 34.851 -13.829
743 H ILE 96 H ILE 96 40.898 38.237 -16.706
744 HA ILE 96 HA ILE 96 43.599 37.271 -17.415
745 HB ILE 96 HB ILE 96 43.389 38.923 -19.308
746 HG12 ILE 96 1HG1 ILE 96 40.505 39.234 -18.362
747 HG13 ILE 96 2HG1 ILE 96 41.763 40.431 -18.038
748 HG21 ILE 96 1HG2 ILE 96 41.076 36.946 -19.071
749 HG22 ILE 96 2HG2 ILE 96 41.775 37.568 -20.576
750 HG23 ILE 96 3HG2 ILE 96 42.740 36.518 -19.519
751 HD11 ILE 96 1HD1 ILE 96 42.091 40.685 -20.522
752 HD12 ILE 96 2HD1 ILE 96 40.698 39.600 -20.766
753 HD13 ILE 96 3HD1 ILE 96 40.477 41.159 -19.948
754 H ARG 97 H ARG 97 43.252 38.529 -14.812
755 HA ARG 97 HA ARG 97 44.355 41.256 -15.088
756 HB2 ARG 97 1HB ARG 97 43.936 39.484 -12.650
757 HB3 ARG 97 2HB ARG 97 44.412 41.185 -12.601
758 HG2 ARG 97 1HG ARG 97 41.790 40.169 -13.752
759 HG3 ARG 97 2HG ARG 97 42.011 40.788 -12.110
760 HD2 ARG 97 1HD ARG 97 42.815 42.952 -13.089
761 HD3 ARG 97 2HD ARG 97 42.411 42.322 -14.697
762 HE ARG 97 HE ARG 97 40.145 42.571 -14.245
763 HH11 ARG 97 1HH1 ARG 97 41.936 43.119 -11.250
764 HH12 ARG 97 2HH1 ARG 97 40.536 43.739 -10.417
765 HH21 ARG 97 1HH2 ARG 97 38.407 43.367 -13.116
766 HH22 ARG 97 2HH2 ARG 97 38.576 43.874 -11.458
767 H GLN 98 H GLN 98 45.998 39.869 -16.437
768 HA GLN 98 HA GLN 98 48.168 39.474 -16.876
769 HB2 GLN 98 1HB GLN 98 48.911 40.571 -14.122
770 HB3 GLN 98 2HB GLN 98 49.998 40.255 -15.460
771 HG2 GLN 98 1HG GLN 98 49.621 42.571 -15.690
772 HG3 GLN 98 2HG GLN 98 48.510 41.885 -16.870
773 HE21 GLN 98 1HE2 GLN 98 46.929 43.321 -13.329
774 HE22 GLN 98 2HE2 GLN 98 48.436 42.451 -13.306
775 HXT GLN 98 HO GLN 98 48.391 36.862 -14.022
Start of MODEL 2
1 H1 SER 1 1H SER 1 -12.891 38.211 -9.712
2 H2 SER 1 2H SER 1 -11.408 37.903 -9.557
3 H3 SER 1 3H SER 1 -12.617 37.039 -8.808
4 HA SER 1 HA SER 1 -13.114 35.990 -11.062
5 HB2 SER 1 1HB SER 1 -11.142 36.118 -12.645
6 HB3 SER 1 2HB SER 1 -11.947 37.694 -12.384
7 HG SER 1 HG SER 1 -9.707 37.941 -12.169
8 H GLN 2 H GLN 2 -10.460 36.249 -8.888
9 HA GLN 2 HA GLN 2 -9.090 34.724 -7.847
10 HB2 GLN 2 1HB GLN 2 -11.246 32.701 -8.555
11 HB3 GLN 2 2HB GLN 2 -10.011 32.538 -7.287
12 HG2 GLN 2 1HG GLN 2 -11.028 34.511 -6.119
13 HG3 GLN 2 2HG GLN 2 -12.272 34.583 -7.372
14 HE21 GLN 2 1HE2 GLN 2 -13.745 31.417 -6.316
15 HE22 GLN 2 2HE2 GLN 2 -13.170 32.166 -7.785
16 H GLN 3 H GLN 3 -8.605 35.311 -10.556
17 HA GLN 3 HA GLN 3 -8.103 32.917 -12.086
18 HB2 GLN 3 1HB GLN 3 -8.618 35.224 -12.958
19 HB3 GLN 3 2HB GLN 3 -7.010 35.738 -12.452
20 HG2 GLN 3 1HG GLN 3 -5.989 34.155 -14.004
21 HG3 GLN 3 2HG GLN 3 -7.587 33.560 -14.481
22 HE21 GLN 3 1HE2 GLN 3 -6.051 36.530 -16.522
23 HE22 GLN 3 2HE2 GLN 3 -5.182 35.313 -15.604
24 H SER 4 H SER 4 -6.163 31.852 -12.447
25 HA SER 4 HA SER 4 -3.841 32.610 -10.710
26 HB2 SER 4 1HB SER 4 -4.732 29.848 -11.648
27 HB3 SER 4 2HB SER 4 -3.327 30.209 -10.624
28 HG SER 4 HG SER 4 -5.200 29.574 -9.427
29 H HIS 5 H HIS 5 -1.718 31.967 -11.579
30 HA HIS 5 HA HIS 5 -1.636 32.394 -14.517
31 HB2 HIS 5 1HB HIS 5 0.159 32.902 -12.214
32 HB3 HIS 5 2HB HIS 5 0.955 32.432 -13.726
33 HD1 HIS 5 HD1 HIS 5 0.396 33.996 -15.874
34 HD2 HIS 5 HD2 HIS 5 -0.622 35.505 -12.121
35 HE1 HIS 5 HE1 HIS 5 0.008 36.489 -16.156
36 H SER 6 H SER 6 -0.747 29.957 -12.121
37 HA SER 6 HA SER 6 0.274 27.913 -12.294
38 HB2 SER 6 1HB SER 6 -1.088 27.860 -15.007
39 HB3 SER 6 2HB SER 6 -0.618 26.461 -14.019
40 HG SER 6 HG SER 6 -2.847 27.039 -13.792
41 H SER 7 H SER 7 2.054 29.961 -13.054
42 HA SER 7 HA SER 7 3.590 28.694 -15.289
43 HB2 SER 7 1HB SER 7 3.697 31.557 -14.272
44 HB3 SER 7 2HB SER 7 4.566 30.905 -15.676
45 HG SER 7 HG SER 7 1.815 30.533 -15.694
46 HA PRO 8 HA PRO 8 6.504 28.059 -12.006
47 HB2 PRO 8 1HB PRO 8 8.748 27.385 -13.335
48 HB3 PRO 8 2HB PRO 8 7.314 26.323 -13.402
49 HG2 PRO 8 1HG PRO 8 8.212 28.416 -15.374
50 HG3 PRO 8 2HG PRO 8 7.780 26.705 -15.681
51 HD2 PRO 8 1HD PRO 8 5.994 28.738 -16.033
52 HD3 PRO 8 2HD PRO 8 5.496 27.122 -15.427
53 H GLY 9 H GLY 9 8.660 28.845 -11.226
54 HA2 GLY 9 1HA GLY 9 9.351 31.552 -12.304
55 HA3 GLY 9 2HA GLY 9 9.311 31.163 -10.575
56 H GLU 10 H GLU 10 10.456 28.906 -13.025
57 HA GLU 10 HA GLU 10 12.855 28.453 -11.511
58 HB2 GLU 10 1HB GLU 10 11.340 26.878 -12.953
59 HB3 GLU 10 2HB GLU 10 12.438 27.317 -14.267
60 HG2 GLU 10 1HG GLU 10 13.194 25.245 -13.219
61 HG3 GLU 10 2HG GLU 10 14.351 26.528 -12.834
62 H ILE 11 H ILE 11 12.824 31.157 -12.691
63 HA ILE 11 HA ILE 11 15.069 31.182 -14.552
64 HB ILE 11 HB ILE 11 14.169 33.683 -13.166
65 HG12 ILE 11 1HG1 ILE 11 12.301 32.159 -15.042
66 HG13 ILE 11 2HG1 ILE 11 11.992 32.510 -13.336
67 HG21 ILE 11 1HG2 ILE 11 15.764 33.498 -15.054
68 HG22 ILE 11 2HG2 ILE 11 14.421 32.901 -16.060
69 HG23 ILE 11 3HG2 ILE 11 14.378 34.550 -15.391
70 HD11 ILE 11 1HD1 ILE 11 10.699 34.019 -14.630
71 HD12 ILE 11 2HD1 ILE 11 12.001 34.951 -13.861
72 HD13 ILE 11 3HD1 ILE 11 12.095 34.529 -15.594
73 H THR 12 H THR 12 15.188 30.001 -11.775
74 HA THR 12 HA THR 12 16.414 31.835 -10.008
75 HB THR 12 HB THR 12 16.970 29.824 -8.655
76 HG1 THR 12 HG1 THR 12 15.661 28.008 -10.185
77 HG21 THR 12 1HG2 THR 12 14.698 29.052 -8.276
78 HG22 THR 12 2HG2 THR 12 14.184 29.639 -9.869
79 HG23 THR 12 3HG2 THR 12 14.652 30.801 -8.604
80 H SER 13 H SER 13 18.471 32.288 -9.439
81 HA SER 13 HA SER 13 20.564 31.517 -11.349
82 HB2 SER 13 1HB SER 13 21.147 33.180 -8.949
83 HB3 SER 13 2HB SER 13 21.684 33.382 -10.633
84 HG SER 13 HG SER 13 19.525 34.085 -11.114
85 H SER 14 H SER 14 19.290 30.318 -8.510
86 HA SER 14 HA SER 14 21.530 29.626 -6.974
87 HB2 SER 14 1HB SER 14 19.289 27.675 -7.140
88 HB3 SER 14 2HB SER 14 20.029 28.447 -5.720
89 HG SER 14 HG SER 14 18.070 29.414 -5.961
90 HA PRO 15 HA PRO 15 22.094 25.535 -9.144
91 HB2 PRO 15 1HB PRO 15 21.276 25.067 -11.706
92 HB3 PRO 15 2HB PRO 15 20.236 24.733 -10.287
93 HG2 PRO 15 1HG PRO 15 20.282 27.152 -12.076
94 HG3 PRO 15 2HG PRO 15 18.889 26.147 -11.576
95 HD2 PRO 15 1HD PRO 15 19.469 28.441 -10.303
96 HD3 PRO 15 2HD PRO 15 18.854 27.017 -9.416
97 H GLN 16 H GLN 16 22.054 28.473 -11.077
98 HA GLN 16 HA GLN 16 24.331 27.832 -12.751
99 HB2 GLN 16 1HB GLN 16 23.276 30.541 -11.827
100 HB3 GLN 16 2HB GLN 16 24.348 30.252 -13.197
101 HG2 GLN 16 1HG GLN 16 22.551 28.982 -14.330
102 HG3 GLN 16 2HG GLN 16 21.477 29.242 -12.944
103 HE21 GLN 16 1HE2 GLN 16 20.214 32.135 -14.336
104 HE22 GLN 16 2HE2 GLN 16 19.940 30.650 -13.474
105 H GLY 17 H GLY 17 23.805 29.155 -9.528
106 HA2 GLY 17 1HA GLY 17 26.498 30.030 -9.061
107 HA3 GLY 17 2HA GLY 17 25.251 29.704 -7.841
108 H LEU 18 H LEU 18 25.302 26.823 -9.353
109 HA LEU 18 HA LEU 18 27.095 25.677 -7.355
110 HB2 LEU 18 1HB LEU 18 25.762 24.371 -9.741
111 HB3 LEU 18 2HB LEU 18 26.570 23.530 -8.433
112 HG LEU 18 HG LEU 18 24.057 25.188 -8.173
113 HD11 LEU 18 1HD1 LEU 18 22.954 22.996 -7.826
114 HD12 LEU 18 2HD1 LEU 18 24.501 22.180 -8.151
115 HD13 LEU 18 3HD1 LEU 18 23.707 23.126 -9.430
116 HD21 LEU 18 1HD2 LEU 18 25.525 23.472 -6.117
117 HD22 LEU 18 2HD2 LEU 18 23.895 24.152 -5.896
118 HD23 LEU 18 3HD2 LEU 18 25.285 25.238 -6.049
119 H ASP 19 H ASP 19 27.104 26.415 -10.781
120 HA ASP 19 HA ASP 19 29.692 25.180 -11.324
121 HB2 ASP 19 1HB ASP 19 27.681 25.622 -12.908
122 HB3 ASP 19 2HB ASP 19 28.221 27.302 -12.947
123 H ASN 20 H ASN 20 28.321 28.296 -10.461
124 HA ASN 20 HA ASN 20 31.089 29.434 -10.259
125 HB2 ASN 20 1HB ASN 20 28.412 30.710 -10.902
126 HB3 ASN 20 2HB ASN 20 29.778 31.658 -10.310
127 HD21 ASN 20 1HD2 ASN 20 31.749 31.186 -13.244
128 HD22 ASN 20 2HD2 ASN 20 31.921 31.082 -11.515
129 HA PRO 21 HA PRO 21 29.554 29.231 -5.902
130 HB2 PRO 21 1HB PRO 21 32.103 28.986 -4.822
131 HB3 PRO 21 2HB PRO 21 31.127 27.584 -5.326
132 HG2 PRO 21 1HG PRO 21 33.236 29.020 -6.812
133 HG3 PRO 21 2HG PRO 21 33.027 27.267 -6.572
134 HD2 PRO 21 1HD PRO 21 32.266 28.375 -8.855
135 HD3 PRO 21 2HD PRO 21 31.227 27.144 -8.059
136 H ALA 22 H ALA 22 32.088 30.993 -7.626
137 HA ALA 22 HA ALA 22 32.565 33.012 -5.677
138 HB1 ALA 22 1HB ALA 22 33.391 34.347 -7.610
139 HB2 ALA 22 2HB ALA 22 34.033 32.693 -7.622
140 HB3 ALA 22 3HB ALA 22 32.709 33.143 -8.727
141 H LEU 23 H LEU 23 30.140 32.749 -8.288
142 HA LEU 23 HA LEU 23 29.049 35.395 -7.732
143 HB2 LEU 23 1HB LEU 23 27.890 33.112 -9.371
144 HB3 LEU 23 2HB LEU 23 27.338 34.785 -9.368
145 HG LEU 23 HG LEU 23 30.000 33.766 -10.414
146 HD11 LEU 23 1HD1 LEU 23 27.578 34.925 -11.843
147 HD12 LEU 23 2HD1 LEU 23 28.038 33.205 -11.811
148 HD13 LEU 23 3HD1 LEU 23 29.090 34.384 -12.620
149 HD21 LEU 23 1HD2 LEU 23 30.327 36.034 -11.310
150 HD22 LEU 23 2HD2 LEU 23 30.321 36.020 -9.531
151 HD23 LEU 23 3HD2 LEU 23 28.887 36.592 -10.430
152 H LEU 24 H LEU 24 28.264 32.019 -6.882
153 HA LEU 24 HA LEU 24 25.689 32.613 -5.757
154 HB2 LEU 24 1HB LEU 24 26.518 30.346 -6.309
155 HB3 LEU 24 2HB LEU 24 27.661 30.437 -4.991
156 HG LEU 24 HG LEU 24 25.947 30.305 -3.348
157 HD11 LEU 24 1HD1 LEU 24 23.520 30.152 -3.948
158 HD12 LEU 24 2HD1 LEU 24 23.938 30.702 -5.588
159 HD13 LEU 24 3HD1 LEU 24 24.228 31.758 -4.184
160 HD21 LEU 24 1HD2 LEU 24 25.077 28.451 -5.577
161 HD22 LEU 24 2HD2 LEU 24 24.998 28.166 -3.826
162 HD23 LEU 24 3HD2 LEU 24 26.581 28.224 -4.652
163 H ARG 25 H ARG 25 28.984 32.582 -4.426
164 HA ARG 25 HA ARG 25 28.334 33.167 -1.716
165 HB2 ARG 25 1HB ARG 25 30.548 32.461 -2.368
166 HB3 ARG 25 2HB ARG 25 30.705 33.796 -3.500
167 HG2 ARG 25 1HG ARG 25 30.361 34.485 -0.608
168 HG3 ARG 25 2HG ARG 25 31.902 33.766 -1.109
169 HD2 ARG 25 1HD ARG 25 30.624 36.260 -2.279
170 HD3 ARG 25 2HD ARG 25 31.986 36.242 -1.164
171 HE ARG 25 HE ARG 25 32.008 35.288 -4.007
172 HH11 ARG 25 1HH1 ARG 25 33.849 36.297 -1.149
173 HH12 ARG 25 2HH1 ARG 25 35.338 36.395 -2.041
174 HH21 ARG 25 1HH2 ARG 25 33.915 35.474 -5.060
175 HH22 ARG 25 2HH2 ARG 25 35.372 35.920 -4.230
176 H ASP 26 H ASP 26 28.788 35.261 -4.585
177 HA ASP 26 HA ASP 26 28.623 37.727 -3.141
178 HB2 ASP 26 1HB ASP 26 29.519 37.332 -5.499
179 HB3 ASP 26 2HB ASP 26 27.832 37.248 -6.038
180 H MET 27 H MET 27 26.192 35.828 -4.967
181 HA MET 27 HA MET 27 23.985 37.596 -4.506
182 HB2 MET 27 1HB MET 27 24.090 35.696 -6.157
183 HB3 MET 27 2HB MET 27 23.902 34.580 -4.794
184 HG2 MET 27 1HG MET 27 21.709 35.577 -4.274
185 HG3 MET 27 2HG MET 27 21.932 36.749 -5.591
186 HE1 MET 27 1HE MET 27 22.298 32.777 -5.076
187 HE2 MET 27 2HE MET 27 20.639 33.210 -4.593
188 HE3 MET 27 3HE MET 27 20.913 32.227 -6.053
189 H LEU 28 H LEU 28 25.239 34.838 -2.637
190 HA LEU 28 HA LEU 28 23.115 34.803 -0.732
191 HB2 LEU 28 1HB LEU 28 25.938 33.834 -0.794
192 HB3 LEU 28 2HB LEU 28 25.059 33.804 0.727
193 HG LEU 28 HG LEU 28 23.962 32.495 -1.761
194 HD11 LEU 28 1HD1 LEU 28 24.859 30.419 -0.861
195 HD12 LEU 28 2HD1 LEU 28 25.658 31.323 0.451
196 HD13 LEU 28 3HD1 LEU 28 26.147 31.579 -1.233
197 HD21 LEU 28 1HD2 LEU 28 22.635 31.254 -0.118
198 HD22 LEU 28 2HD2 LEU 28 22.379 32.983 0.080
199 HD23 LEU 28 3HD2 LEU 28 23.426 32.126 1.219
200 H LEU 29 H LEU 29 26.264 36.501 -0.779
201 HA LEU 29 HA LEU 29 26.006 37.589 1.874
202 HB2 LEU 29 1HB LEU 29 27.514 38.487 -0.602
203 HB3 LEU 29 2HB LEU 29 27.585 39.381 0.917
204 HG LEU 29 HG LEU 29 28.402 36.475 0.677
205 HD11 LEU 29 1HD1 LEU 29 29.785 37.874 -0.784
206 HD12 LEU 29 2HD1 LEU 29 30.714 37.300 0.619
207 HD13 LEU 29 3HD1 LEU 29 30.113 38.981 0.571
208 HD21 LEU 29 1HD2 LEU 29 29.599 36.892 2.781
209 HD22 LEU 29 2HD2 LEU 29 27.856 37.166 2.962
210 HD23 LEU 29 3HD2 LEU 29 28.956 38.560 2.821
211 H ALA 30 H ALA 30 24.921 38.664 -1.307
212 HA ALA 30 HA ALA 30 23.949 41.218 -0.329
213 HB1 ALA 30 1HB ALA 30 24.682 40.839 -2.688
214 HB2 ALA 30 2HB ALA 30 23.327 39.704 -2.906
215 HB3 ALA 30 3HB ALA 30 23.000 41.419 -2.589
216 H ASN 31 H ASN 31 22.705 38.004 -0.084
217 HA ASN 31 HA ASN 31 19.917 39.073 0.025
218 HB2 ASN 31 1HB ASN 31 20.566 37.315 -1.684
219 HB3 ASN 31 2HB ASN 31 20.744 36.199 -0.348
220 HD21 ASN 31 1HD2 ASN 31 17.263 36.436 -1.985
221 HD22 ASN 31 2HD2 ASN 31 18.854 36.591 -2.707
222 HA PRO 32 HA PRO 32 20.802 38.178 4.347
223 HB2 PRO 32 1HB PRO 32 18.641 39.471 5.451
224 HB3 PRO 32 2HB PRO 32 20.140 40.294 4.920
225 HG2 PRO 32 1HG PRO 32 17.564 39.920 3.393
226 HG3 PRO 32 2HG PRO 32 18.499 41.428 3.699
227 HD2 PRO 32 1HD PRO 32 18.755 40.127 1.408
228 HD3 PRO 32 2HD PRO 32 20.204 40.811 2.224
229 H HIS 33 H HIS 33 17.741 37.507 2.643
230 HA HIS 33 HA HIS 33 16.743 35.807 4.802
231 HB2 HIS 33 1HB HIS 33 15.263 36.958 3.162
232 HB3 HIS 33 2HB HIS 33 15.946 35.942 1.871
233 HD1 HIS 33 HD1 HIS 33 13.860 35.610 5.078
234 HD2 HIS 33 HD2 HIS 33 14.792 33.501 1.604
235 HE1 HIS 33 HE1 HIS 33 12.361 33.566 5.035
236 H GLU 34 H GLU 34 18.445 35.370 1.715
237 HA GLU 34 HA GLU 34 18.261 32.481 1.758
238 HB2 GLU 34 1HB GLU 34 19.470 34.587 0.120
239 HB3 GLU 34 2HB GLU 34 20.392 33.115 0.141
240 HG2 GLU 34 1HG GLU 34 17.462 32.919 -0.351
241 HG3 GLU 34 2HG GLU 34 18.501 33.551 -1.642
242 H LEU 35 H LEU 35 20.587 34.914 2.899
243 HA LEU 35 HA LEU 35 22.571 32.927 3.590
244 HB2 LEU 35 1HB LEU 35 23.881 34.623 4.147
245 HB3 LEU 35 2HB LEU 35 22.764 35.377 3.065
246 HG LEU 35 HG LEU 35 21.638 36.462 4.963
247 HD11 LEU 35 1HD1 LEU 35 23.963 35.337 6.536
248 HD12 LEU 35 2HD1 LEU 35 22.232 35.185 6.882
249 HD13 LEU 35 3HD1 LEU 35 23.023 36.766 7.055
250 HD21 LEU 35 1HD2 LEU 35 24.590 36.890 4.487
251 HD22 LEU 35 2HD2 LEU 35 23.480 38.105 5.143
252 HD23 LEU 35 3HD2 LEU 35 23.263 37.508 3.483
253 H SER 36 H SER 36 19.791 34.311 5.258
254 HA SER 36 HA SER 36 20.605 33.346 7.858
255 HB2 SER 36 1HB SER 36 18.319 33.928 8.593
256 HB3 SER 36 2HB SER 36 19.211 35.269 7.843
257 HG SER 36 HG SER 36 17.942 35.235 6.153
258 H LEU 37 H LEU 37 18.358 32.129 5.306
259 HA LEU 37 HA LEU 37 17.568 29.856 6.896
260 HB2 LEU 37 1HB LEU 37 16.648 28.959 4.963
261 HB3 LEU 37 2HB LEU 37 16.464 30.674 4.907
262 HG LEU 37 HG LEU 37 18.373 30.689 3.246
263 HD11 LEU 37 1HD1 LEU 37 17.382 27.844 2.906
264 HD12 LEU 37 2HD1 LEU 37 19.005 28.321 3.473
265 HD13 LEU 37 3HD1 LEU 37 18.504 28.725 1.824
266 HD21 LEU 37 1HD2 LEU 37 16.083 31.336 2.770
267 HD22 LEU 37 2HD2 LEU 37 15.621 29.635 2.594
268 HD23 LEU 37 3HD2 LEU 37 16.747 30.377 1.429
269 H LEU 38 H LEU 38 20.286 30.635 4.871
270 HA LEU 38 HA LEU 38 21.248 27.976 4.622
271 HB2 LEU 38 1HB LEU 38 21.810 29.915 3.265
272 HB3 LEU 38 2HB LEU 38 22.731 30.595 4.613
273 HG LEU 38 HG LEU 38 24.189 28.563 4.601
274 HD11 LEU 38 1HD1 LEU 38 22.793 28.078 1.955
275 HD12 LEU 38 2HD1 LEU 38 22.709 27.050 3.405
276 HD13 LEU 38 3HD1 LEU 38 24.248 27.238 2.540
277 HD21 LEU 38 1HD2 LEU 38 24.199 30.156 2.025
278 HD22 LEU 38 2HD2 LEU 38 25.578 29.319 2.766
279 HD23 LEU 38 3HD2 LEU 38 24.848 30.714 3.583
280 H LYS 39 H LYS 39 22.010 30.519 7.058
281 HA LYS 39 HA LYS 39 23.834 28.747 8.455
282 HB2 LYS 39 1HB LYS 39 23.591 30.321 10.383
283 HB3 LYS 39 2HB LYS 39 24.206 31.013 8.883
284 HG2 LYS 39 1HG LYS 39 22.177 32.147 8.446
285 HG3 LYS 39 2HG LYS 39 21.286 31.222 9.630
286 HD2 LYS 39 1HD LYS 39 21.583 33.311 10.605
287 HD3 LYS 39 2HD LYS 39 22.794 32.281 11.392
288 HE2 LYS 39 1HE LYS 39 24.538 33.168 9.897
289 HE3 LYS 39 2HE LYS 39 23.320 34.120 9.019
290 HZ1 LYS 39 1HZ LYS 39 22.877 35.346 11.040
291 HZ2 LYS 39 2HZ LYS 39 24.465 35.472 10.647
292 HZ3 LYS 39 3HZ LYS 39 23.993 34.476 11.885
293 H GLU 40 H GLU 40 20.344 29.105 8.523
294 HA GLU 40 HA GLU 40 20.047 27.559 10.994
295 HB2 GLU 40 1HB GLU 40 18.241 28.369 8.704
296 HB3 GLU 40 2HB GLU 40 17.716 27.166 9.887
297 HG2 GLU 40 1HG GLU 40 18.088 28.810 11.699
298 HG3 GLU 40 2HG GLU 40 18.502 30.029 10.476
299 H ARG 41 H ARG 41 19.596 26.848 7.501
300 HA ARG 41 HA ARG 41 19.106 24.038 8.211
301 HB2 ARG 41 1HB ARG 41 19.108 25.414 5.508
302 HB3 ARG 41 2HB ARG 41 18.481 23.810 5.894
303 HG2 ARG 41 1HG ARG 41 17.018 25.112 7.673
304 HG3 ARG 41 2HG ARG 41 17.381 26.517 6.667
305 HD2 ARG 41 1HD ARG 41 15.329 25.719 5.835
306 HD3 ARG 41 2HD ARG 41 16.529 25.106 4.686
307 HE ARG 41 HE ARG 41 16.077 22.930 5.390
308 HH11 ARG 41 1HH1 ARG 41 14.570 25.156 7.703
309 HH12 ARG 41 2HH1 ARG 41 13.728 23.871 8.517
310 HH21 ARG 41 1HH2 ARG 41 14.943 21.361 6.486
311 HH22 ARG 41 2HH2 ARG 41 13.943 21.771 7.850
312 H ASN 42 H ASN 42 21.797 25.805 6.877
313 HA ASN 42 HA ASN 42 23.237 23.213 6.617
314 HB2 ASN 42 1HB ASN 42 22.394 24.151 4.377
315 HB3 ASN 42 2HB ASN 42 23.587 25.418 4.572
316 HD21 ASN 42 1HD2 ASN 42 25.211 22.840 2.594
317 HD22 ASN 42 2HD2 ASN 42 24.038 24.121 2.434
318 HA PRO 43 HA PRO 43 25.440 26.646 8.858
319 HB2 PRO 43 1HB PRO 43 26.547 25.075 10.863
320 HB3 PRO 43 2HB PRO 43 25.014 25.997 10.971
321 HG2 PRO 43 1HG PRO 43 25.424 23.096 10.319
322 HG3 PRO 43 2HG PRO 43 24.238 23.848 11.431
323 HD2 PRO 43 1HD PRO 43 23.525 23.077 8.957
324 HD3 PRO 43 2HD PRO 43 22.906 24.606 9.658
325 HA PRO 44 HA PRO 44 29.515 24.520 8.161
326 HB2 PRO 44 1HB PRO 44 29.801 22.534 6.304
327 HB3 PRO 44 2HB PRO 44 29.516 22.205 8.040
328 HG2 PRO 44 1HG PRO 44 27.520 22.319 5.811
329 HG3 PRO 44 2HG PRO 44 27.812 21.016 7.014
330 HD2 PRO 44 1HD PRO 44 25.864 22.825 7.396
331 HD3 PRO 44 2HD PRO 44 26.887 22.286 8.773
332 H LEU 45 H LEU 45 27.121 24.640 5.436
333 HA LEU 45 HA LEU 45 29.150 25.786 3.658
334 HB2 LEU 45 1HB LEU 45 27.205 24.540 2.789
335 HB3 LEU 45 2HB LEU 45 26.147 25.812 3.386
336 HG LEU 45 HG LEU 45 27.094 27.436 1.840
337 HD11 LEU 45 1HD1 LEU 45 28.971 25.216 0.906
338 HD12 LEU 45 2HD1 LEU 45 29.444 26.725 1.716
339 HD13 LEU 45 3HD1 LEU 45 28.749 26.780 0.094
340 HD21 LEU 45 1HD2 LEU 45 26.492 24.816 0.415
341 HD22 LEU 45 2HD2 LEU 45 26.328 26.458 -0.258
342 HD23 LEU 45 3HD2 LEU 45 25.275 25.934 1.073
343 H ALA 46 H ALA 46 26.596 26.895 5.858
344 HA ALA 46 HA ALA 46 26.727 29.632 5.131
345 HB1 ALA 46 1HB ALA 46 25.041 28.544 6.610
346 HB2 ALA 46 2HB ALA 46 26.258 28.552 7.906
347 HB3 ALA 46 3HB ALA 46 25.687 30.084 7.218
348 H GLU 47 H GLU 47 28.609 27.905 7.726
349 HA GLU 47 HA GLU 47 29.923 30.261 8.615
350 HB2 GLU 47 1HB GLU 47 31.532 28.829 9.702
351 HB3 GLU 47 2HB GLU 47 29.927 28.088 9.831
352 HG2 GLU 47 1HG GLU 47 30.481 26.547 8.021
353 HG3 GLU 47 2HG GLU 47 32.057 27.312 7.812
354 H ALA 48 H ALA 48 30.586 28.214 5.865
355 HA ALA 48 HA ALA 48 33.167 29.176 5.270
356 HB1 ALA 48 1HB ALA 48 31.068 28.169 3.314
357 HB2 ALA 48 2HB ALA 48 32.821 28.059 3.165
358 HB3 ALA 48 3HB ALA 48 31.980 27.082 4.381
359 H LEU 49 H LEU 49 29.903 30.241 4.407
360 HA LEU 49 HA LEU 49 30.727 32.342 2.591
361 HB2 LEU 49 1HB LEU 49 28.440 31.297 2.667
362 HB3 LEU 49 2HB LEU 49 28.204 31.992 4.259
363 HG LEU 49 HG LEU 49 28.594 34.289 3.115
364 HD11 LEU 49 1HD1 LEU 49 27.872 34.329 0.767
365 HD12 LEU 49 2HD1 LEU 49 27.802 32.553 0.752
366 HD13 LEU 49 3HD1 LEU 49 29.359 33.375 0.970
367 HD21 LEU 49 1HD2 LEU 49 26.194 34.438 2.616
368 HD22 LEU 49 2HD2 LEU 49 26.487 33.523 4.112
369 HD23 LEU 49 3HD2 LEU 49 26.083 32.653 2.619
370 H LEU 50 H LEU 50 29.781 32.195 6.048
371 HA LEU 50 HA LEU 50 29.825 35.011 6.481
372 HB2 LEU 50 1HB LEU 50 30.520 32.904 8.545
373 HB3 LEU 50 2HB LEU 50 29.895 34.521 8.835
374 HG LEU 50 HG LEU 50 28.439 32.078 7.902
375 HD11 LEU 50 1HD1 LEU 50 27.929 33.996 10.147
376 HD12 LEU 50 2HD1 LEU 50 28.752 32.419 10.261
377 HD13 LEU 50 3HD1 LEU 50 27.039 32.485 9.791
378 HD21 LEU 50 1HD2 LEU 50 27.608 33.701 6.384
379 HD22 LEU 50 2HD2 LEU 50 27.394 34.888 7.700
380 HD23 LEU 50 3HD2 LEU 50 26.398 33.411 7.631
381 H SER 51 H SER 51 32.323 32.574 6.469
382 HA SER 51 HA SER 51 34.356 34.121 7.819
383 HB2 SER 51 1HB SER 51 34.219 31.627 7.569
384 HB3 SER 51 2HB SER 51 34.605 31.840 5.857
385 HG SER 51 HG SER 51 36.512 33.107 6.817
386 H GLY 52 H GLY 52 33.109 34.144 4.552
387 HA2 GLY 52 1HA GLY 52 33.613 35.748 2.939
388 HA3 GLY 52 2HA GLY 52 35.007 36.257 3.894
389 H ASP 53 H ASP 53 35.836 33.275 3.959
390 HA ASP 53 HA ASP 53 37.655 33.533 1.757
391 HB2 ASP 53 1HB ASP 53 37.918 32.222 4.031
392 HB3 ASP 53 2HB ASP 53 37.211 30.927 3.117
393 H LEU 54 H LEU 54 37.095 33.285 -0.311
394 HA LEU 54 HA LEU 54 34.816 31.783 -1.175
395 HB2 LEU 54 1HB LEU 54 35.982 33.568 -2.471
396 HB3 LEU 54 2HB LEU 54 37.327 32.473 -2.742
397 HG LEU 54 HG LEU 54 35.566 32.871 -4.567
398 HD11 LEU 54 1HD1 LEU 54 37.403 31.237 -4.732
399 HD12 LEU 54 2HD1 LEU 54 35.932 30.734 -5.582
400 HD13 LEU 54 3HD1 LEU 54 36.339 30.012 -4.013
401 HD21 LEU 54 1HD2 LEU 54 33.536 32.395 -3.233
402 HD22 LEU 54 2HD2 LEU 54 34.051 30.694 -3.094
403 HD23 LEU 54 3HD2 LEU 54 33.668 31.375 -4.678
404 H GLU 55 H GLU 55 38.242 30.988 -0.626
405 HA GLU 55 HA GLU 55 38.356 28.506 -1.995
406 HB2 GLU 55 1HB GLU 55 39.642 29.266 0.656
407 HB3 GLU 55 2HB GLU 55 40.111 27.883 -0.333
408 HG2 GLU 55 1HG GLU 55 40.220 30.697 -1.417
409 HG3 GLU 55 2HG GLU 55 41.533 30.010 -0.446
410 H LYS 56 H LYS 56 37.507 29.148 1.445
411 HA LYS 56 HA LYS 56 36.793 26.383 1.848
412 HB2 LYS 56 1HB LYS 56 36.186 26.899 4.039
413 HB3 LYS 56 2HB LYS 56 37.517 28.030 3.647
414 HG2 LYS 56 1HG LYS 56 35.685 29.682 3.199
415 HG3 LYS 56 2HG LYS 56 34.652 28.540 4.024
416 HD2 LYS 56 1HD LYS 56 37.270 29.357 5.255
417 HD3 LYS 56 2HD LYS 56 35.859 30.385 5.374
418 HE2 LYS 56 1HE LYS 56 34.564 28.500 6.401
419 HE3 LYS 56 2HE LYS 56 36.046 27.524 6.361
420 HZ1 LYS 56 1HZ LYS 56 35.649 28.623 8.520
421 HZ2 LYS 56 2HZ LYS 56 35.780 30.109 7.800
422 HZ3 LYS 56 3HZ LYS 56 37.078 29.097 7.855
423 H PHE 57 H PHE 57 34.940 29.259 0.879
424 HA PHE 57 HA PHE 57 32.373 28.030 1.177
425 HB2 PHE 57 1HB PHE 57 32.674 30.445 0.817
426 HB3 PHE 57 2HB PHE 57 33.253 30.133 -0.829
427 HD1 PHE 57 HD1 PHE 57 31.721 29.706 -2.631
428 HD2 PHE 57 HD2 PHE 57 30.286 29.921 1.422
429 HE1 PHE 57 HE1 PHE 57 29.377 29.750 -3.472
430 HE2 PHE 57 HE2 PHE 57 27.935 29.945 0.587
431 HZ PHE 57 HZ PHE 57 27.488 29.858 -1.875
432 H SER 58 H SER 58 34.506 28.219 -1.729
433 HA SER 58 HA SER 58 32.856 26.623 -3.390
434 HB2 SER 58 1HB SER 58 34.776 28.035 -4.126
435 HB3 SER 58 2HB SER 58 35.894 26.902 -3.342
436 HG SER 58 HG SER 58 35.736 26.365 -5.509
437 H ARG 59 H ARG 59 35.504 25.673 -1.125
438 HA ARG 59 HA ARG 59 35.547 22.929 -1.912
439 HB2 ARG 59 1HB ARG 59 37.314 23.827 -0.545
440 HB3 ARG 59 2HB ARG 59 36.181 24.282 0.732
441 HG2 ARG 59 1HG ARG 59 36.108 21.396 0.098
442 HG3 ARG 59 2HG ARG 59 37.704 21.927 0.633
443 HD2 ARG 59 1HD ARG 59 36.868 22.731 2.701
444 HD3 ARG 59 2HD ARG 59 35.185 22.690 2.138
445 HE ARG 59 HE ARG 59 35.928 20.054 2.000
446 HH11 ARG 59 1HH1 ARG 59 36.026 22.433 4.611
447 HH12 ARG 59 2HH1 ARG 59 35.778 21.228 5.845
448 HH21 ARG 59 1HH2 ARG 59 35.571 18.577 3.602
449 HH22 ARG 59 2HH2 ARG 59 35.547 19.078 5.286
450 H VAL 60 H VAL 60 33.685 24.584 0.688
451 HA VAL 60 HA VAL 60 32.426 22.116 1.483
452 HB VAL 60 HB VAL 60 31.524 24.986 1.988
453 HG11 VAL 60 1HG1 VAL 60 30.334 23.890 3.946
454 HG12 VAL 60 2HG1 VAL 60 29.667 23.497 2.359
455 HG13 VAL 60 3HG1 VAL 60 30.690 22.316 3.210
456 HG21 VAL 60 1HG2 VAL 60 32.597 24.714 4.186
457 HG22 VAL 60 2HG2 VAL 60 33.100 23.058 3.778
458 HG23 VAL 60 3HG2 VAL 60 33.797 24.451 2.915
459 H LEU 61 H LEU 61 31.687 24.604 -0.943
460 HA LEU 61 HA LEU 61 29.004 23.849 -1.439
461 HB2 LEU 61 1HB LEU 61 30.468 25.771 -2.443
462 HB3 LEU 61 2HB LEU 61 30.917 24.583 -3.660
463 HG LEU 61 HG LEU 61 28.234 24.303 -3.727
464 HD11 LEU 61 1HD1 LEU 61 27.164 26.467 -3.457
465 HD12 LEU 61 2HD1 LEU 61 28.728 27.227 -3.046
466 HD13 LEU 61 3HD1 LEU 61 27.980 26.041 -1.947
467 HD21 LEU 61 1HD2 LEU 61 28.245 25.492 -5.720
468 HD22 LEU 61 2HD2 LEU 61 29.948 25.024 -5.557
469 HD23 LEU 61 3HD2 LEU 61 29.418 26.670 -5.137
470 H VAL 62 H VAL 62 32.063 22.476 -2.773
471 HA VAL 62 HA VAL 62 30.708 20.602 -4.495
472 HB VAL 62 HB VAL 62 33.510 20.429 -3.290
473 HG11 VAL 62 1HG1 VAL 62 32.789 18.237 -4.099
474 HG12 VAL 62 2HG1 VAL 62 32.230 18.944 -5.634
475 HG13 VAL 62 3HG1 VAL 62 33.969 18.913 -5.236
476 HG21 VAL 62 1HG2 VAL 62 34.234 21.312 -5.510
477 HG22 VAL 62 2HG2 VAL 62 32.527 21.529 -5.962
478 HG23 VAL 62 3HG2 VAL 62 33.222 22.466 -4.625
479 H GLU 63 H GLU 63 32.009 20.390 -1.173
480 HA GLU 63 HA GLU 63 31.508 17.606 -0.759
481 HB2 GLU 63 1HB GLU 63 31.394 19.907 1.220
482 HB3 GLU 63 2HB GLU 63 31.507 18.193 1.658
483 HG2 GLU 63 1HG GLU 63 33.622 19.307 -0.166
484 HG3 GLU 63 2HG GLU 63 33.623 19.849 1.514
485 H GLN 64 H GLN 64 29.452 20.501 -0.366
486 HA GLN 64 HA GLN 64 27.203 19.006 0.697
487 HB2 GLN 64 1HB GLN 64 27.474 21.771 -0.520
488 HB3 GLN 64 2HB GLN 64 25.934 21.123 0.079
489 HG2 GLN 64 1HG GLN 64 28.446 21.434 1.759
490 HG3 GLN 64 2HG GLN 64 27.101 22.570 1.727
491 HE21 GLN 64 1HE2 GLN 64 26.972 19.641 4.322
492 HE22 GLN 64 2HE2 GLN 64 28.409 20.319 3.589
493 H GLN 65 H GLN 65 28.235 19.987 -2.604
494 HA GLN 65 HA GLN 65 25.763 19.216 -3.850
495 HB2 GLN 65 1HB GLN 65 28.604 19.431 -4.853
496 HB3 GLN 65 2HB GLN 65 27.310 18.813 -5.870
497 HG2 GLN 65 1HG GLN 65 26.047 20.914 -5.560
498 HG3 GLN 65 2HG GLN 65 27.372 21.565 -4.585
499 HE21 GLN 65 1HE2 GLN 65 28.964 22.841 -7.407
500 HE22 GLN 65 2HE2 GLN 65 28.551 22.987 -5.718
501 H GLN 66 H GLN 66 28.679 17.379 -2.876
502 HA GLN 66 HA GLN 66 27.906 14.948 -4.168
503 HB2 GLN 66 1HB GLN 66 29.588 15.457 -1.690
504 HB3 GLN 66 2HB GLN 66 29.327 13.853 -2.392
505 HG2 GLN 66 1HG GLN 66 30.324 14.604 -4.510
506 HG3 GLN 66 2HG GLN 66 30.601 16.208 -3.834
507 HE21 GLN 66 1HE2 GLN 66 33.765 15.247 -2.797
508 HE22 GLN 66 2HE2 GLN 66 32.743 16.394 -3.626
509 H ASP 67 H ASP 67 27.095 16.267 -0.909
510 HA ASP 67 HA ASP 67 25.569 13.916 -0.176
511 HB2 ASP 67 1HB ASP 67 26.368 15.638 1.477
512 HB3 ASP 67 2HB ASP 67 25.148 16.740 0.850
513 H ARG 68 H ARG 68 24.807 17.004 -1.736
514 HA ARG 68 HA ARG 68 21.971 16.687 -1.734
515 HB2 ARG 68 1HB ARG 68 23.851 18.177 -3.567
516 HB3 ARG 68 2HB ARG 68 22.108 18.179 -3.829
517 HG2 ARG 68 1HG ARG 68 23.403 19.126 -1.248
518 HG3 ARG 68 2HG ARG 68 22.986 20.192 -2.610
519 HD2 ARG 68 1HD ARG 68 20.616 19.428 -2.431
520 HD3 ARG 68 2HD ARG 68 21.064 18.477 -0.997
521 HE ARG 68 HE ARG 68 21.295 20.421 0.267
522 HH11 ARG 68 1HH1 ARG 68 20.624 21.325 -3.097
523 HH12 ARG 68 2HH1 ARG 68 20.254 22.981 -2.667
524 HH21 ARG 68 1HH2 ARG 68 20.791 22.541 0.721
525 HH22 ARG 68 2HH2 ARG 68 20.340 23.642 -0.550
526 H ALA 69 H ALA 69 24.457 15.465 -3.972
527 HA ALA 69 HA ALA 69 22.687 14.550 -5.983
528 HB1 ALA 69 1HB ALA 69 25.151 14.656 -6.214
529 HB2 ALA 69 2HB ALA 69 25.314 13.310 -5.059
530 HB3 ALA 69 3HB ALA 69 24.519 13.045 -6.630
531 H ARG 70 H ARG 70 23.504 13.132 -2.833
532 HA ARG 70 HA ARG 70 22.362 10.516 -3.364
533 HB2 ARG 70 1HB ARG 70 22.583 11.996 -0.714
534 HB3 ARG 70 2HB ARG 70 22.397 10.254 -0.915
535 HG2 ARG 70 1HG ARG 70 24.637 10.031 -1.758
536 HG3 ARG 70 2HG ARG 70 24.794 11.784 -1.958
537 HD2 ARG 70 1HD ARG 70 25.989 11.191 0.034
538 HD3 ARG 70 2HD ARG 70 24.510 12.055 0.512
539 HE ARG 70 HE ARG 70 24.347 9.120 0.437
540 HH11 ARG 70 1HH1 ARG 70 24.790 11.995 2.498
541 HH12 ARG 70 2HH1 ARG 70 24.447 11.081 3.949
542 HH21 ARG 70 1HH2 ARG 70 23.911 8.060 2.335
543 HH22 ARG 70 2HH2 ARG 70 23.950 8.915 3.859
544 H ARG 71 H ARG 71 21.160 13.587 -2.164
545 HA ARG 71 HA ARG 71 18.517 12.540 -1.410
546 HB2 ARG 71 1HB ARG 71 19.451 15.401 -1.792
547 HB3 ARG 71 2HB ARG 71 18.037 14.870 -0.872
548 HG2 ARG 71 1HG ARG 71 19.481 13.879 0.829
549 HG3 ARG 71 2HG ARG 71 20.918 14.164 -0.168
550 HD2 ARG 71 1HD ARG 71 21.078 15.987 1.161
551 HD3 ARG 71 2HD ARG 71 20.050 16.658 -0.115
552 HE ARG 71 HE ARG 71 18.134 16.400 1.345
553 HH11 ARG 71 1HH1 ARG 71 21.222 15.705 2.966
554 HH12 ARG 71 2HH1 ARG 71 20.494 15.852 4.557
555 HH21 ARG 71 1HH2 ARG 71 17.300 16.531 3.386
556 HH22 ARG 71 2HH2 ARG 71 18.326 16.310 4.787
557 H GLU 72 H GLU 72 20.049 14.048 -4.140
558 HA GLU 72 HA GLU 72 17.837 15.092 -5.552
559 HB2 GLU 72 1HB GLU 72 20.269 15.454 -5.981
560 HB3 GLU 72 2HB GLU 72 20.369 13.808 -6.624
561 HG2 GLU 72 1HG GLU 72 18.839 14.384 -8.409
562 HG3 GLU 72 2HG GLU 72 18.689 16.027 -7.767
563 H GLN 73 H GLN 73 19.019 11.793 -5.185
564 HA GLN 73 HA GLN 73 17.745 10.575 -7.380
565 HB2 GLN 73 1HB GLN 73 18.126 9.445 -4.580
566 HB3 GLN 73 2HB GLN 73 17.867 8.513 -6.067
567 HG2 GLN 73 1HG GLN 73 20.281 10.214 -5.369
568 HG3 GLN 73 2HG GLN 73 20.226 8.465 -5.491
569 HE21 GLN 73 1HE2 GLN 73 21.222 10.579 -8.681
570 HE22 GLN 73 2HE2 GLN 73 21.267 11.153 -7.033
571 H GLU 74 H GLU 74 16.391 11.615 -4.248
572 HA GLU 74 HA GLU 74 13.815 10.333 -4.756
573 HB2 GLU 74 1HB GLU 74 14.659 12.519 -2.825
574 HB3 GLU 74 2HB GLU 74 13.041 11.821 -2.879
575 HG2 GLU 74 1HG GLU 74 15.614 10.307 -2.276
576 HG3 GLU 74 2HG GLU 74 14.409 10.843 -1.084
577 H ARG 75 H ARG 75 15.250 13.515 -5.424
578 HA ARG 75 HA ARG 75 12.706 14.762 -6.055
579 HB2 ARG 75 1HB ARG 75 15.581 15.502 -6.668
580 HB3 ARG 75 2HB ARG 75 14.208 16.457 -7.227
581 HG2 ARG 75 1HG ARG 75 13.447 16.693 -4.872
582 HG3 ARG 75 2HG ARG 75 14.941 15.893 -4.347
583 HD2 ARG 75 1HD ARG 75 16.303 17.643 -5.295
584 HD3 ARG 75 2HD ARG 75 14.907 18.359 -6.125
585 HE ARG 75 HE ARG 75 15.630 18.634 -3.285
586 HH11 ARG 75 1HH1 ARG 75 13.116 19.198 -5.720
587 HH12 ARG 75 2HH1 ARG 75 12.329 20.418 -4.740
588 HH21 ARG 75 1HH2 ARG 75 14.526 20.173 -2.099
589 HH22 ARG 75 2HH2 ARG 75 13.095 20.943 -2.745
590 H ILE 76 H ILE 76 15.254 13.172 -8.025
591 HA ILE 76 HA ILE 76 13.997 13.862 -10.526
592 HB ILE 76 HB ILE 76 15.480 12.214 -11.561
593 HG12 ILE 76 1HG1 ILE 76 16.302 11.467 -8.740
594 HG13 ILE 76 2HG1 ILE 76 15.289 10.468 -9.790
595 HG21 ILE 76 1HG2 ILE 76 16.306 14.481 -10.951
596 HG22 ILE 76 2HG2 ILE 76 16.921 13.834 -9.415
597 HG23 ILE 76 3HG2 ILE 76 17.607 13.280 -10.957
598 HD11 ILE 76 1HD1 ILE 76 17.190 10.328 -11.411
599 HD12 ILE 76 2HD1 ILE 76 18.210 11.191 -10.233
600 HD13 ILE 76 3HD1 ILE 76 17.540 9.597 -9.827
601 H ARG 77 H ARG 77 13.153 11.605 -8.118
602 HA ARG 77 HA ARG 77 11.869 9.564 -9.658
603 HB2 ARG 77 1HB ARG 77 12.272 9.635 -7.130
604 HB3 ARG 77 2HB ARG 77 10.914 10.764 -7.035
605 HG2 ARG 77 1HG ARG 77 9.448 9.029 -8.058
606 HG3 ARG 77 2HG ARG 77 10.812 7.891 -7.973
607 HD2 ARG 77 1HD ARG 77 9.502 9.341 -5.627
608 HD3 ARG 77 2HD ARG 77 9.279 7.629 -6.046
609 HE ARG 77 HE ARG 77 11.477 8.830 -4.550
610 HH11 ARG 77 1HH1 ARG 77 10.713 6.081 -6.645
611 HH12 ARG 77 2HH1 ARG 77 11.980 5.104 -5.956
612 HH21 ARG 77 1HH2 ARG 77 13.019 7.524 -3.695
613 HH22 ARG 77 2HH2 ARG 77 13.266 5.909 -4.330
614 H LEU 78 H LEU 78 10.930 12.793 -8.641
615 HA LEU 78 HA LEU 78 9.268 14.211 -9.162
616 HB2 LEU 78 1HB LEU 78 10.560 13.724 -11.280
617 HB3 LEU 78 2HB LEU 78 9.246 12.709 -11.768
618 HG LEU 78 HG LEU 78 7.778 14.688 -11.960
619 HD11 LEU 78 1HD1 LEU 78 8.813 16.972 -11.773
620 HD12 LEU 78 2HD1 LEU 78 10.252 16.199 -11.042
621 HD13 LEU 78 3HD1 LEU 78 8.676 16.121 -10.217
622 HD21 LEU 78 1HD2 LEU 78 9.140 13.951 -13.868
623 HD22 LEU 78 2HD2 LEU 78 10.449 15.033 -13.343
624 HD23 LEU 78 3HD2 LEU 78 8.889 15.708 -13.868
625 H PHE 79 H PHE 79 6.985 14.326 -10.443
626 HA PHE 79 HA PHE 79 4.818 13.986 -10.398
627 HB2 PHE 79 1HB PHE 79 5.388 11.059 -10.201
628 HB3 PHE 79 2HB PHE 79 3.987 11.853 -10.927
629 HD1 PHE 79 HD1 PHE 79 4.421 13.385 -12.981
630 HD2 PHE 79 HD2 PHE 79 7.261 10.507 -11.513
631 HE1 PHE 79 HE1 PHE 79 5.600 13.437 -15.172
632 HE2 PHE 79 HE2 PHE 79 8.438 10.541 -13.706
633 HZ PHE 79 HZ PHE 79 7.603 11.991 -15.546
634 H SER 80 H SER 80 6.461 12.657 -7.726
635 HA SER 80 HA SER 80 4.191 13.346 -5.977
636 HB2 SER 80 1HB SER 80 5.451 10.562 -5.967
637 HB3 SER 80 2HB SER 80 4.256 11.173 -4.801
638 HG SER 80 HG SER 80 3.317 11.598 -7.272
639 H ALA 81 H ALA 81 6.858 14.316 -6.700
640 HA ALA 81 HA ALA 81 8.122 14.289 -3.992
641 HB1 ALA 81 1HB ALA 81 9.300 12.548 -5.356
642 HB2 ALA 81 2HB ALA 81 9.638 13.782 -6.599
643 HB3 ALA 81 3HB ALA 81 10.352 13.936 -4.977
644 H ASP 82 H ASP 82 6.461 15.921 -5.845
645 HA ASP 82 HA ASP 82 7.997 17.892 -7.150
646 HB2 ASP 82 1HB ASP 82 5.093 17.745 -6.301
647 HB3 ASP 82 2HB ASP 82 5.730 19.035 -7.323
648 HA PRO 83 HA PRO 83 8.916 20.607 -3.888
649 HB2 PRO 83 1HB PRO 83 8.987 23.085 -5.043
650 HB3 PRO 83 2HB PRO 83 10.167 21.804 -5.453
651 HG2 PRO 83 1HG PRO 83 7.601 22.550 -6.858
652 HG3 PRO 83 2HG PRO 83 9.254 22.413 -7.544
653 HD2 PRO 83 1HD PRO 83 7.501 20.387 -7.740
654 HD3 PRO 83 2HD PRO 83 9.237 20.053 -7.401
655 H PHE 84 H PHE 84 8.235 22.308 -2.496
656 HA PHE 84 HA PHE 84 5.293 22.866 -2.598
657 HB2 PHE 84 1HB PHE 84 7.195 22.630 -0.231
658 HB3 PHE 84 2HB PHE 84 5.483 23.086 -0.131
659 HD1 PHE 84 HD1 PHE 84 7.823 20.293 -0.842
660 HD2 PHE 84 HD2 PHE 84 3.719 21.469 -0.335
661 HE1 PHE 84 HE1 PHE 84 7.173 17.901 -0.686
662 HE2 PHE 84 HE2 PHE 84 3.050 19.074 -0.162
663 HZ PHE 84 HZ PHE 84 4.792 17.280 -0.349
664 H ASP 85 H ASP 85 7.725 24.239 -3.761
665 HA ASP 85 HA ASP 85 7.992 26.731 -2.239
666 HB2 ASP 85 1HB ASP 85 9.093 25.860 -4.944
667 HB3 ASP 85 2HB ASP 85 9.542 27.342 -4.070
668 H LEU 86 H LEU 86 5.503 26.644 -2.529
669 HA LEU 86 HA LEU 86 4.369 27.335 -5.082
670 HB2 LEU 86 1HB LEU 86 3.313 27.688 -2.268
671 HB3 LEU 86 2HB LEU 86 2.337 27.787 -3.739
672 HG LEU 86 HG LEU 86 3.771 25.288 -2.746
673 HD11 LEU 86 1HD1 LEU 86 0.823 26.044 -2.694
674 HD12 LEU 86 2HD1 LEU 86 1.904 25.972 -1.286
675 HD13 LEU 86 3HD1 LEU 86 1.523 24.490 -2.177
676 HD21 LEU 86 1HD2 LEU 86 1.807 25.694 -5.040
677 HD22 LEU 86 2HD2 LEU 86 2.388 24.120 -4.450
678 HD23 LEU 86 3HD2 LEU 86 3.523 25.266 -5.179
679 H GLU 87 H GLU 87 5.811 29.206 -2.547
680 HA GLU 87 HA GLU 87 4.667 31.755 -3.297
681 HB2 GLU 87 1HB GLU 87 7.284 31.089 -1.885
682 HB3 GLU 87 2HB GLU 87 6.515 32.673 -1.937
683 HG2 GLU 87 1HG GLU 87 5.418 30.172 -0.607
684 HG3 GLU 87 2HG GLU 87 6.142 31.562 0.210
685 H ALA 88 H ALA 88 7.237 29.739 -4.481
686 HA ALA 88 HA ALA 88 8.600 31.881 -5.907
687 HB1 ALA 88 1HB ALA 88 10.214 30.161 -6.517
688 HB2 ALA 88 2HB ALA 88 9.872 30.062 -4.771
689 HB3 ALA 88 3HB ALA 88 9.136 28.897 -5.900
690 H GLN 89 H GLN 89 5.812 31.317 -6.706
691 HA GLN 89 HA GLN 89 6.262 30.145 -9.415
692 HB2 GLN 89 1HB GLN 89 3.707 30.358 -7.801
693 HB3 GLN 89 2HB GLN 89 3.848 29.651 -9.405
694 HG2 GLN 89 1HG GLN 89 5.162 28.605 -6.903
695 HG3 GLN 89 2HG GLN 89 3.766 27.903 -7.705
696 HE21 GLN 89 1HE2 GLN 89 7.326 26.579 -8.666
697 HE22 GLN 89 2HE2 GLN 89 6.859 27.343 -7.158
698 H ALA 90 H ALA 90 5.163 30.957 -11.167
699 HA ALA 90 HA ALA 90 4.419 32.482 -12.618
700 HB1 ALA 90 1HB ALA 90 3.285 34.094 -10.314
701 HB2 ALA 90 2HB ALA 90 2.713 34.031 -11.994
702 HB3 ALA 90 3HB ALA 90 2.526 32.610 -10.936
703 H LYS 91 H LYS 91 4.267 34.868 -13.147
704 HA LYS 91 HA LYS 91 5.335 36.715 -13.862
705 HB2 LYS 91 1HB LYS 91 5.566 37.061 -11.316
706 HB3 LYS 91 2HB LYS 91 7.248 36.573 -11.553
707 HG2 LYS 91 1HG LYS 91 7.562 38.445 -13.135
708 HG3 LYS 91 2HG LYS 91 5.875 38.940 -12.885
709 HD2 LYS 91 1HD LYS 91 6.342 39.310 -10.509
710 HD3 LYS 91 2HD LYS 91 8.000 38.727 -10.741
711 HE2 LYS 91 1HE LYS 91 8.404 40.552 -12.374
712 HE3 LYS 91 2HE LYS 91 6.775 41.180 -12.064
713 HZ1 LYS 91 1HZ LYS 91 8.928 40.942 -10.040
714 HZ2 LYS 91 2HZ LYS 91 7.417 41.534 -9.757
715 HZ3 LYS 91 3HZ LYS 91 8.446 42.336 -10.769
716 H ILE 92 H ILE 92 7.211 37.503 -14.888
717 HA ILE 92 HA ILE 92 9.461 35.633 -15.272
718 HB ILE 92 HB ILE 92 7.869 36.918 -17.578
719 HG12 ILE 92 1HG1 ILE 92 8.267 33.966 -16.919
720 HG13 ILE 92 2HG1 ILE 92 6.803 34.871 -16.557
721 HG21 ILE 92 1HG2 ILE 92 10.325 36.879 -17.993
722 HG22 ILE 92 2HG2 ILE 92 10.373 35.134 -17.652
723 HG23 ILE 92 3HG2 ILE 92 9.495 35.746 -19.071
724 HD11 ILE 92 1HD1 ILE 92 6.408 33.604 -18.559
725 HD12 ILE 92 2HD1 ILE 92 6.493 35.315 -19.010
726 HD13 ILE 92 3HD1 ILE 92 7.873 34.230 -19.339
727 H GLU 93 H GLU 93 11.301 36.889 -15.232
728 HA GLU 93 HA GLU 93 10.972 39.794 -14.828
729 HB2 GLU 93 1HB GLU 93 13.288 39.735 -14.111
730 HB3 GLU 93 2HB GLU 93 12.356 38.478 -13.281
731 HG2 GLU 93 1HG GLU 93 13.249 36.802 -14.927
732 HG3 GLU 93 2HG GLU 93 14.288 38.066 -15.587
733 H GLU 94 H GLU 94 12.536 41.282 -15.978
734 HA GLU 94 HA GLU 94 12.707 40.432 -18.817
735 HB2 GLU 94 1HB GLU 94 12.878 42.784 -19.373
736 HB3 GLU 94 2HB GLU 94 11.429 42.463 -18.420
737 HG2 GLU 94 1HG GLU 94 12.597 43.364 -16.398
738 HG3 GLU 94 2HG GLU 94 13.988 43.754 -17.416
739 H ASP 95 H ASP 95 14.594 39.971 -19.736
740 HA ASP 95 HA ASP 95 17.070 40.978 -18.413
741 HB2 ASP 95 1HB ASP 95 16.912 38.539 -18.210
742 HB3 ASP 95 2HB ASP 95 16.756 38.403 -19.973
743 H ILE 96 H ILE 96 16.922 42.852 -19.616
744 HA ILE 96 HA ILE 96 17.146 42.602 -22.564
745 HB ILE 96 HB ILE 96 16.856 45.080 -22.570
746 HG12 ILE 96 1HG1 ILE 96 16.511 44.824 -19.551
747 HG13 ILE 96 2HG1 ILE 96 17.986 45.412 -20.315
748 HG21 ILE 96 1HG2 ILE 96 14.516 45.108 -21.923
749 HG22 ILE 96 2HG2 ILE 96 14.871 43.486 -22.557
750 HG23 ILE 96 3HG2 ILE 96 14.736 43.751 -20.797
751 HD11 ILE 96 1HD1 ILE 96 16.697 47.307 -19.577
752 HD12 ILE 96 2HD1 ILE 96 16.658 47.271 -21.356
753 HD13 ILE 96 3HD1 ILE 96 15.246 46.719 -20.421
754 H ARG 97 H ARG 97 19.246 41.871 -20.504
755 HA ARG 97 HA ARG 97 21.323 43.917 -20.767
756 HB2 ARG 97 1HB ARG 97 20.783 42.353 -18.811
757 HB3 ARG 97 2HB ARG 97 21.600 41.088 -19.727
758 HG2 ARG 97 1HG ARG 97 23.699 42.334 -19.621
759 HG3 ARG 97 2HG ARG 97 22.866 43.692 -18.820
760 HD2 ARG 97 1HD ARG 97 22.243 42.243 -16.952
761 HD3 ARG 97 2HD ARG 97 22.989 40.848 -17.747
762 HE ARG 97 HE ARG 97 24.339 43.062 -16.352
763 HH11 ARG 97 1HH1 ARG 97 24.752 40.224 -18.422
764 HH12 ARG 97 2HH1 ARG 97 26.444 40.067 -18.015
765 HH21 ARG 97 1HH2 ARG 97 26.498 42.801 -15.896
766 HH22 ARG 97 2HH2 ARG 97 27.412 41.497 -16.606
767 H GLN 98 H GLN 98 20.699 43.366 -23.237
768 HA GLN 98 HA GLN 98 23.057 41.842 -24.313
769 HB2 GLN 98 1HB GLN 98 20.312 42.126 -25.652
770 HB3 GLN 98 2HB GLN 98 21.761 41.441 -26.403
771 HG2 GLN 98 1HG GLN 98 21.855 39.721 -24.546
772 HG3 GLN 98 2HG GLN 98 20.341 40.366 -23.900
773 HE21 GLN 98 1HE2 GLN 98 18.766 37.892 -25.794
774 HE22 GLN 98 2HE2 GLN 98 19.248 38.421 -24.200
775 HXT GLN 98 HO GLN 98 20.917 44.282 -24.984
Start of MODEL 3
1 H1 SER 1 1H SER 1 5.049 39.161 1.024
2 H2 SER 1 2H SER 1 4.209 40.497 1.030
3 H3 SER 1 3H SER 1 5.786 40.475 0.632
4 HA SER 1 HA SER 1 5.316 39.635 -1.569
5 HB2 SER 1 1HB SER 1 2.395 39.818 -0.742
6 HB3 SER 1 2HB SER 1 3.078 39.024 -2.191
7 HG SER 1 HG SER 1 4.079 38.346 0.340
8 H GLN 2 H GLN 2 5.051 40.931 -3.278
9 HA GLN 2 HA GLN 2 3.684 43.526 -3.020
10 HB2 GLN 2 1HB GLN 2 5.741 44.793 -3.677
11 HB3 GLN 2 2HB GLN 2 5.796 44.130 -2.044
12 HG2 GLN 2 1HG GLN 2 7.256 42.290 -2.805
13 HG3 GLN 2 2HG GLN 2 7.197 42.915 -4.459
14 HE21 GLN 2 1HE2 GLN 2 10.337 44.188 -3.195
15 HE22 GLN 2 2HE2 GLN 2 9.624 42.702 -3.774
16 H GLN 3 H GLN 3 3.010 41.359 -4.472
17 HA GLN 3 HA GLN 3 2.547 40.552 -6.552
18 HB2 GLN 3 1HB GLN 3 3.399 43.297 -7.573
19 HB3 GLN 3 2HB GLN 3 2.504 42.080 -8.475
20 HG2 GLN 3 1HG GLN 3 0.888 43.640 -7.798
21 HG3 GLN 3 2HG GLN 3 0.674 42.256 -6.719
22 HE21 GLN 3 1HE2 GLN 3 2.251 45.755 -5.209
23 HE22 GLN 3 2HE2 GLN 3 2.509 45.340 -6.884
24 H SER 4 H SER 4 4.065 41.347 -9.023
25 HA SER 4 HA SER 4 5.845 40.611 -10.216
26 HB2 SER 4 1HB SER 4 7.405 41.090 -7.661
27 HB3 SER 4 2HB SER 4 8.069 40.986 -9.306
28 HG SER 4 HG SER 4 7.649 43.159 -8.510
29 H HIS 5 H HIS 5 4.329 38.596 -8.537
30 HA HIS 5 HA HIS 5 6.276 36.537 -7.911
31 HB2 HIS 5 1HB HIS 5 3.293 36.243 -8.421
32 HB3 HIS 5 2HB HIS 5 4.338 35.139 -7.517
33 HD1 HIS 5 HD1 HIS 5 5.554 36.551 -5.310
34 HD2 HIS 5 HD2 HIS 5 1.870 37.817 -6.791
35 HE1 HIS 5 HE1 HIS 5 4.473 37.944 -3.499
36 H SER 6 H SER 6 7.027 34.929 -9.257
37 HA SER 6 HA SER 6 5.738 34.439 -11.860
38 HB2 SER 6 1HB SER 6 7.854 34.871 -13.084
39 HB3 SER 6 2HB SER 6 7.230 36.354 -12.330
40 HG SER 6 HG SER 6 9.469 36.087 -11.952
41 H SER 7 H SER 7 6.956 32.615 -12.971
42 HA SER 7 HA SER 7 7.840 30.651 -10.928
43 HB2 SER 7 1HB SER 7 7.574 29.046 -12.835
44 HB3 SER 7 2HB SER 7 6.076 29.932 -12.474
45 HG SER 7 HG SER 7 7.938 30.456 -14.559
46 HA PRO 8 HA PRO 8 11.956 31.265 -12.395
47 HB2 PRO 8 1HB PRO 8 13.203 28.928 -11.836
48 HB3 PRO 8 2HB PRO 8 12.601 30.003 -10.533
49 HG2 PRO 8 1HG PRO 8 11.293 27.587 -11.751
50 HG3 PRO 8 2HG PRO 8 11.588 27.958 -10.023
51 HD2 PRO 8 1HD PRO 8 9.215 28.452 -11.222
52 HD3 PRO 8 2HD PRO 8 9.879 29.535 -9.949
53 H GLY 9 H GLY 9 13.615 30.410 -13.895
54 HA2 GLY 9 1HA GLY 9 12.294 29.291 -16.281
55 HA3 GLY 9 2HA GLY 9 13.893 30.042 -16.216
56 H GLU 10 H GLU 10 14.845 28.433 -13.990
57 HA GLU 10 HA GLU 10 16.338 26.695 -13.907
58 HB2 GLU 10 1HB GLU 10 13.999 25.849 -13.197
59 HB3 GLU 10 2HB GLU 10 14.056 24.887 -14.678
60 HG2 GLU 10 1HG GLU 10 16.132 23.800 -13.903
61 HG3 GLU 10 2HG GLU 10 16.171 24.851 -12.480
62 H ILE 11 H ILE 11 16.694 27.969 -16.254
63 HA ILE 11 HA ILE 11 16.449 26.158 -18.466
64 HB ILE 11 HB ILE 11 16.746 28.953 -17.890
65 HG12 ILE 11 1HG1 ILE 11 15.900 27.673 -20.495
66 HG13 ILE 11 2HG1 ILE 11 14.885 27.697 -19.049
67 HG21 ILE 11 1HG2 ILE 11 18.999 28.778 -18.698
68 HG22 ILE 11 2HG2 ILE 11 18.422 28.087 -20.239
69 HG23 ILE 11 3HG2 ILE 11 18.010 29.759 -19.789
70 HD11 ILE 11 1HD1 ILE 11 14.214 29.498 -20.551
71 HD12 ILE 11 2HD1 ILE 11 14.915 30.189 -19.070
72 HD13 ILE 11 3HD1 ILE 11 15.868 30.147 -20.574
73 H THR 12 H THR 12 18.467 26.431 -16.088
74 HA THR 12 HA THR 12 20.676 25.208 -17.624
75 HB THR 12 HB THR 12 22.335 26.151 -16.027
76 HG1 THR 12 HG1 THR 12 21.461 27.953 -14.718
77 HG21 THR 12 1HG2 THR 12 21.680 27.399 -18.153
78 HG22 THR 12 2HG2 THR 12 22.392 28.390 -16.860
79 HG23 THR 12 3HG2 THR 12 20.635 28.413 -17.128
80 H SER 13 H SER 13 21.925 23.606 -16.314
81 HA SER 13 HA SER 13 20.122 22.085 -14.609
82 HB2 SER 13 1HB SER 13 23.061 21.607 -15.210
83 HB3 SER 13 2HB SER 13 21.874 20.417 -14.631
84 HG SER 13 HG SER 13 20.720 20.794 -16.612
85 H SER 14 H SER 14 22.002 24.716 -13.938
86 HA SER 14 HA SER 14 22.060 24.055 -11.070
87 HB2 SER 14 1HB SER 14 24.565 24.762 -12.644
88 HB3 SER 14 2HB SER 14 24.447 24.786 -10.873
89 HG SER 14 HG SER 14 23.488 22.460 -11.900
90 HA PRO 15 HA PRO 15 21.319 28.489 -12.304
91 HB2 PRO 15 1HB PRO 15 18.837 28.887 -11.227
92 HB3 PRO 15 2HB PRO 15 19.080 28.175 -12.857
93 HG2 PRO 15 1HG PRO 15 18.606 26.770 -10.241
94 HG3 PRO 15 2HG PRO 15 17.774 26.546 -11.812
95 HD2 PRO 15 1HD PRO 15 19.757 24.912 -11.015
96 HD3 PRO 15 2HD PRO 15 19.567 25.397 -12.732
97 H GLN 16 H GLN 16 20.893 26.677 -9.350
98 HA GLN 16 HA GLN 16 21.012 28.925 -7.538
99 HB2 GLN 16 1HB GLN 16 21.402 25.934 -7.166
100 HB3 GLN 16 2HB GLN 16 21.337 27.094 -5.835
101 HG2 GLN 16 1HG GLN 16 19.045 27.327 -7.648
102 HG3 GLN 16 2HG GLN 16 19.188 25.733 -6.897
103 HE21 GLN 16 1HE2 GLN 16 18.182 28.995 -4.675
104 HE22 GLN 16 2HE2 GLN 16 18.649 29.153 -6.362
105 H GLY 17 H GLY 17 23.275 28.743 -9.503
106 HA2 GLY 17 1HA GLY 17 25.526 29.186 -9.469
107 HA3 GLY 17 2HA GLY 17 25.305 29.628 -7.778
108 H LEU 18 H LEU 18 24.692 26.326 -8.853
109 HA LEU 18 HA LEU 18 26.570 25.334 -6.902
110 HB2 LEU 18 1HB LEU 18 25.341 23.819 -9.223
111 HB3 LEU 18 2HB LEU 18 26.023 23.129 -7.760
112 HG LEU 18 HG LEU 18 23.500 24.812 -7.938
113 HD11 LEU 18 1HD1 LEU 18 23.895 21.835 -7.432
114 HD12 LEU 18 2HD1 LEU 18 23.289 22.566 -8.934
115 HD13 LEU 18 3HD1 LEU 18 22.340 22.703 -7.439
116 HD21 LEU 18 1HD2 LEU 18 24.547 25.145 -5.754
117 HD22 LEU 18 2HD2 LEU 18 24.762 23.387 -5.553
118 HD23 LEU 18 3HD2 LEU 18 23.130 24.099 -5.576
119 H ASP 19 H ASP 19 26.630 25.894 -10.364
120 HA ASP 19 HA ASP 19 29.255 24.684 -10.792
121 HB2 ASP 19 1HB ASP 19 27.338 24.921 -12.476
122 HB3 ASP 19 2HB ASP 19 27.731 26.646 -12.541
123 H ASN 20 H ASN 20 27.921 27.729 -9.789
124 HA ASN 20 HA ASN 20 30.585 29.033 -10.048
125 HB2 ASN 20 1HB ASN 20 27.766 30.167 -10.278
126 HB3 ASN 20 2HB ASN 20 29.227 31.139 -10.191
127 HD21 ASN 20 1HD2 ASN 20 30.313 30.373 -13.469
128 HD22 ASN 20 2HD2 ASN 20 30.929 30.623 -11.859
129 HA PRO 21 HA PRO 21 29.513 29.021 -5.532
130 HB2 PRO 21 1HB PRO 21 32.216 28.955 -4.807
131 HB3 PRO 21 2HB PRO 21 31.190 27.514 -4.969
132 HG2 PRO 21 1HG PRO 21 33.051 28.727 -6.907
133 HG3 PRO 21 2HG PRO 21 32.840 27.018 -6.491
134 HD2 PRO 21 1HD PRO 21 31.840 27.969 -8.714
135 HD3 PRO 21 2HD PRO 21 30.892 26.818 -7.708
136 H ALA 22 H ALA 22 31.891 30.779 -7.534
137 HA ALA 22 HA ALA 22 32.379 32.873 -5.660
138 HB1 ALA 22 1HB ALA 22 33.829 32.472 -7.600
139 HB2 ALA 22 2HB ALA 22 32.498 32.896 -8.709
140 HB3 ALA 22 3HB ALA 22 33.194 34.133 -7.635
141 H LEU 23 H LEU 23 29.973 32.545 -8.293
142 HA LEU 23 HA LEU 23 28.875 35.186 -7.854
143 HB2 LEU 23 1HB LEU 23 27.570 32.793 -9.195
144 HB3 LEU 23 2HB LEU 23 27.077 34.473 -9.335
145 HG LEU 23 HG LEU 23 29.595 33.218 -10.472
146 HD11 LEU 23 1HD1 LEU 23 28.522 33.656 -12.632
147 HD12 LEU 23 2HD1 LEU 23 27.127 34.399 -11.814
148 HD13 LEU 23 3HD1 LEU 23 27.457 32.664 -11.616
149 HD21 LEU 23 1HD2 LEU 23 30.110 35.521 -9.863
150 HD22 LEU 23 2HD2 LEU 23 28.654 36.087 -10.712
151 HD23 LEU 23 3HD2 LEU 23 29.987 35.338 -11.623
152 H LEU 24 H LEU 24 28.053 31.862 -6.798
153 HA LEU 24 HA LEU 24 25.587 32.585 -5.556
154 HB2 LEU 24 1HB LEU 24 26.225 30.262 -6.054
155 HB3 LEU 24 2HB LEU 24 27.545 30.357 -4.891
156 HG LEU 24 HG LEU 24 25.979 30.604 -3.061
157 HD11 LEU 24 1HD1 LEU 24 24.139 31.804 -3.987
158 HD12 LEU 24 2HD1 LEU 24 23.523 30.238 -3.433
159 HD13 LEU 24 3HD1 LEU 24 23.809 30.503 -5.169
160 HD21 LEU 24 1HD2 LEU 24 24.950 28.382 -3.150
161 HD22 LEU 24 2HD2 LEU 24 26.634 28.389 -3.710
162 HD23 LEU 24 3HD2 LEU 24 25.310 28.309 -4.888
163 H ARG 25 H ARG 25 28.953 32.420 -4.310
164 HA ARG 25 HA ARG 25 28.357 33.118 -1.616
165 HB2 ARG 25 1HB ARG 25 30.575 32.352 -2.485
166 HB3 ARG 25 2HB ARG 25 30.738 33.870 -3.353
167 HG2 ARG 25 1HG ARG 25 30.414 34.880 -0.898
168 HG3 ARG 25 2HG ARG 25 31.032 33.285 -0.438
169 HD2 ARG 25 1HD ARG 25 32.877 34.811 -0.644
170 HD3 ARG 25 2HD ARG 25 32.951 33.658 -1.994
171 HE ARG 25 HE ARG 25 31.545 35.700 -3.093
172 HH11 ARG 25 1HH1 ARG 25 34.575 35.781 -1.267
173 HH12 ARG 25 2HH1 ARG 25 35.162 37.166 -2.154
174 HH21 ARG 25 1HH2 ARG 25 32.341 37.473 -4.144
175 HH22 ARG 25 2HH2 ARG 25 33.910 38.117 -3.742
176 H ASP 26 H ASP 26 28.969 35.188 -4.501
177 HA ASP 26 HA ASP 26 28.837 37.658 -3.078
178 HB2 ASP 26 1HB ASP 26 29.661 37.197 -5.467
179 HB3 ASP 26 2HB ASP 26 27.961 37.249 -5.955
180 H MET 27 H MET 27 26.303 35.788 -4.808
181 HA MET 27 HA MET 27 24.181 37.660 -4.318
182 HB2 MET 27 1HB MET 27 24.139 35.800 -5.983
183 HB3 MET 27 2HB MET 27 24.013 34.645 -4.649
184 HG2 MET 27 1HG MET 27 21.867 35.631 -3.974
185 HG3 MET 27 2HG MET 27 22.016 36.850 -5.248
186 HE1 MET 27 1HE MET 27 22.578 32.807 -5.205
187 HE2 MET 27 2HE MET 27 21.092 33.189 -4.300
188 HE3 MET 27 3HE MET 27 20.993 32.358 -5.869
189 H LEU 28 H LEU 28 25.350 34.839 -2.451
190 HA LEU 28 HA LEU 28 23.261 34.903 -0.505
191 HB2 LEU 28 1HB LEU 28 26.003 33.783 -0.647
192 HB3 LEU 28 2HB LEU 28 25.158 33.814 0.906
193 HG LEU 28 HG LEU 28 23.897 32.644 -1.583
194 HD11 LEU 28 1HD1 LEU 28 24.677 30.499 -0.743
195 HD12 LEU 28 2HD1 LEU 28 25.588 31.345 0.530
196 HD13 LEU 28 3HD1 LEU 28 26.007 31.592 -1.171
197 HD21 LEU 28 1HD2 LEU 28 22.396 33.182 0.307
198 HD22 LEU 28 2HD2 LEU 28 23.401 32.218 1.396
199 HD23 LEU 28 3HD2 LEU 28 22.517 31.435 0.061
200 H LEU 29 H LEU 29 26.463 36.445 -0.653
201 HA LEU 29 HA LEU 29 26.407 37.520 2.015
202 HB2 LEU 29 1HB LEU 29 27.801 38.352 -0.539
203 HB3 LEU 29 2HB LEU 29 27.985 39.278 0.948
204 HG LEU 29 HG LEU 29 28.657 36.334 0.799
205 HD11 LEU 29 1HD1 LEU 29 30.484 38.711 0.297
206 HD12 LEU 29 2HD1 LEU 29 29.984 37.487 -0.896
207 HD13 LEU 29 3HD1 LEU 29 31.009 37.018 0.477
208 HD21 LEU 29 1HD2 LEU 29 30.058 36.835 2.755
209 HD22 LEU 29 2HD2 LEU 29 28.369 37.279 3.062
210 HD23 LEU 29 3HD2 LEU 29 29.561 38.544 2.685
211 H ALA 30 H ALA 30 25.143 38.655 -1.074
212 HA ALA 30 HA ALA 30 24.325 41.234 0.009
213 HB1 ALA 30 1HB ALA 30 23.340 41.559 -2.223
214 HB2 ALA 30 2HB ALA 30 25.000 40.927 -2.357
215 HB3 ALA 30 3HB ALA 30 23.611 39.843 -2.608
216 H ASN 31 H ASN 31 22.913 38.056 0.057
217 HA ASN 31 HA ASN 31 20.167 39.219 0.172
218 HB2 ASN 31 1HB ASN 31 20.803 37.357 -1.452
219 HB3 ASN 31 2HB ASN 31 20.921 36.303 -0.058
220 HD21 ASN 31 1HD2 ASN 31 17.478 36.573 -1.782
221 HD22 ASN 31 2HD2 ASN 31 19.083 36.677 -2.482
222 HA PRO 32 HA PRO 32 20.900 38.406 4.514
223 HB2 PRO 32 1HB PRO 32 18.748 39.761 5.556
224 HB3 PRO 32 2HB PRO 32 20.249 40.569 4.998
225 HG2 PRO 32 1HG PRO 32 17.674 40.144 3.479
226 HG3 PRO 32 2HG PRO 32 18.601 41.658 3.720
227 HD2 PRO 32 1HD PRO 32 18.876 40.259 1.486
228 HD3 PRO 32 2HD PRO 32 20.308 41.001 2.283
229 H HIS 33 H HIS 33 17.855 37.743 2.780
230 HA HIS 33 HA HIS 33 16.794 36.091 4.943
231 HB2 HIS 33 1HB HIS 33 15.349 37.223 3.263
232 HB3 HIS 33 2HB HIS 33 16.055 36.217 1.993
233 HD1 HIS 33 HD1 HIS 33 13.780 35.957 5.038
234 HD2 HIS 33 HD2 HIS 33 15.042 33.662 1.795
235 HE1 HIS 33 HE1 HIS 33 12.329 33.887 4.991
236 H GLU 34 H GLU 34 18.504 35.554 1.874
237 HA GLU 34 HA GLU 34 18.238 32.679 1.978
238 HB2 GLU 34 1HB GLU 34 19.551 34.708 0.304
239 HB3 GLU 34 2HB GLU 34 20.373 33.184 0.319
240 HG2 GLU 34 1HG GLU 34 17.438 33.539 -0.332
241 HG3 GLU 34 2HG GLU 34 18.730 33.465 -1.542
242 H LEU 35 H LEU 35 20.781 35.031 2.882
243 HA LEU 35 HA LEU 35 22.694 33.077 3.638
244 HB2 LEU 35 1HB LEU 35 23.945 34.744 4.339
245 HB3 LEU 35 2HB LEU 35 22.864 35.514 3.232
246 HG LEU 35 HG LEU 35 21.676 36.601 5.029
247 HD11 LEU 35 1HD1 LEU 35 23.726 35.269 6.792
248 HD12 LEU 35 2HD1 LEU 35 21.957 35.327 6.987
249 HD13 LEU 35 3HD1 LEU 35 22.911 36.797 7.231
250 HD21 LEU 35 1HD2 LEU 35 24.684 36.823 4.861
251 HD22 LEU 35 2HD2 LEU 35 23.592 38.129 5.403
252 HD23 LEU 35 3HD2 LEU 35 23.506 37.522 3.734
253 H SER 36 H SER 36 19.856 34.290 5.250
254 HA SER 36 HA SER 36 20.516 33.289 7.873
255 HB2 SER 36 1HB SER 36 17.893 34.245 6.709
256 HB3 SER 36 2HB SER 36 18.146 33.784 8.405
257 HG SER 36 HG SER 36 19.146 35.989 6.965
258 H LEU 37 H LEU 37 18.497 32.121 5.136
259 HA LEU 37 HA LEU 37 17.600 29.807 6.610
260 HB2 LEU 37 1HB LEU 37 16.670 29.056 4.692
261 HB3 LEU 37 2HB LEU 37 16.634 30.766 4.614
262 HG LEU 37 HG LEU 37 18.339 30.749 2.857
263 HD11 LEU 37 1HD1 LEU 37 19.301 28.555 3.102
264 HD12 LEU 37 2HD1 LEU 37 18.491 28.653 1.538
265 HD13 LEU 37 3HD1 LEU 37 17.715 27.788 2.892
266 HD21 LEU 37 1HD2 LEU 37 15.958 31.101 2.460
267 HD22 LEU 37 2HD2 LEU 37 15.681 29.342 2.430
268 HD23 LEU 37 3HD2 LEU 37 16.651 30.117 1.158
269 H LEU 38 H LEU 38 20.332 30.650 4.647
270 HA LEU 38 HA LEU 38 21.348 28.042 4.365
271 HB2 LEU 38 1HB LEU 38 21.945 30.108 3.161
272 HB3 LEU 38 2HB LEU 38 22.851 30.650 4.586
273 HG LEU 38 HG LEU 38 24.269 28.598 4.456
274 HD11 LEU 38 1HD1 LEU 38 22.826 28.265 1.823
275 HD12 LEU 38 2HD1 LEU 38 22.811 27.160 3.215
276 HD13 LEU 38 3HD1 LEU 38 24.306 27.395 2.297
277 HD21 LEU 38 1HD2 LEU 38 24.327 30.305 1.977
278 HD22 LEU 38 2HD2 LEU 38 25.684 29.396 2.670
279 HD23 LEU 38 3HD2 LEU 38 24.999 30.778 3.551
280 H LYS 39 H LYS 39 22.063 30.498 6.899
281 HA LYS 39 HA LYS 39 23.734 28.623 8.361
282 HB2 LYS 39 1HB LYS 39 23.439 30.168 10.309
283 HB3 LYS 39 2HB LYS 39 24.148 30.871 8.855
284 HG2 LYS 39 1HG LYS 39 22.060 31.953 8.307
285 HG3 LYS 39 2HG LYS 39 21.221 31.187 9.615
286 HD2 LYS 39 1HD LYS 39 21.664 33.377 10.333
287 HD3 LYS 39 2HD LYS 39 22.869 32.380 11.175
288 HE2 LYS 39 1HE LYS 39 24.580 33.012 9.554
289 HE3 LYS 39 2HE LYS 39 23.372 33.838 8.550
290 HZ1 LYS 39 1HZ LYS 39 24.143 34.646 11.292
291 HZ2 LYS 39 2HZ LYS 39 23.027 35.408 10.347
292 HZ3 LYS 39 3HZ LYS 39 24.614 35.400 9.902
293 H GLU 40 H GLU 40 20.261 29.100 8.287
294 HA GLU 40 HA GLU 40 19.820 27.543 10.708
295 HB2 GLU 40 1HB GLU 40 18.171 28.705 8.508
296 HB3 GLU 40 2HB GLU 40 17.520 27.314 9.349
297 HG2 GLU 40 1HG GLU 40 17.933 28.550 11.519
298 HG3 GLU 40 2HG GLU 40 18.232 29.989 10.524
299 H ARG 41 H ARG 41 19.562 26.836 7.180
300 HA ARG 41 HA ARG 41 18.929 24.012 7.798
301 HB2 ARG 41 1HB ARG 41 19.378 25.394 5.139
302 HB3 ARG 41 2HB ARG 41 18.666 23.798 5.369
303 HG2 ARG 41 1HG ARG 41 17.425 26.373 6.428
304 HG3 ARG 41 2HG ARG 41 17.068 25.667 4.860
305 HD2 ARG 41 1HD ARG 41 15.312 24.863 6.169
306 HD3 ARG 41 2HD ARG 41 16.450 23.509 6.187
307 HE ARG 41 HE ARG 41 16.806 23.838 8.460
308 HH11 ARG 41 1HH1 ARG 41 15.015 26.651 7.252
309 HH12 ARG 41 2HH1 ARG 41 14.771 27.274 8.874
310 HH21 ARG 41 1HH2 ARG 41 16.392 24.706 10.466
311 HH22 ARG 41 2HH2 ARG 41 15.510 26.217 10.608
312 H ASN 42 H ASN 42 21.724 25.793 6.563
313 HA ASN 42 HA ASN 42 23.233 23.203 6.458
314 HB2 ASN 42 1HB ASN 42 22.495 24.135 4.184
315 HB3 ASN 42 2HB ASN 42 23.617 25.445 4.453
316 HD21 ASN 42 1HD2 ASN 42 25.356 22.867 2.503
317 HD22 ASN 42 2HD2 ASN 42 24.080 24.034 2.296
318 HA PRO 43 HA PRO 43 25.363 26.566 8.843
319 HB2 PRO 43 1HB PRO 43 26.500 24.865 10.758
320 HB3 PRO 43 2HB PRO 43 24.991 25.817 10.933
321 HG2 PRO 43 1HG PRO 43 25.333 22.942 10.152
322 HG3 PRO 43 2HG PRO 43 24.157 23.684 11.275
323 HD2 PRO 43 1HD PRO 43 23.459 23.006 8.776
324 HD3 PRO 43 2HD PRO 43 22.842 24.520 9.529
325 HA PRO 44 HA PRO 44 29.492 24.606 8.060
326 HB2 PRO 44 1HB PRO 44 29.864 22.598 6.256
327 HB3 PRO 44 2HB PRO 44 29.589 22.300 8.002
328 HG2 PRO 44 1HG PRO 44 27.607 22.272 5.758
329 HG3 PRO 44 2HG PRO 44 27.926 21.018 6.998
330 HD2 PRO 44 1HD PRO 44 25.914 22.769 7.302
331 HD3 PRO 44 2HD PRO 44 26.925 22.288 8.703
332 H LEU 45 H LEU 45 27.145 24.593 5.279
333 HA LEU 45 HA LEU 45 29.153 25.805 3.529
334 HB2 LEU 45 1HB LEU 45 27.264 24.555 2.593
335 HB3 LEU 45 2HB LEU 45 26.150 25.741 3.264
336 HG LEU 45 HG LEU 45 26.958 27.460 1.762
337 HD11 LEU 45 1HD1 LEU 45 28.615 27.054 -0.012
338 HD12 LEU 45 2HD1 LEU 45 28.910 25.414 0.600
339 HD13 LEU 45 3HD1 LEU 45 29.373 26.826 1.572
340 HD21 LEU 45 1HD2 LEU 45 26.511 24.854 0.256
341 HD22 LEU 45 2HD2 LEU 45 26.208 26.500 -0.351
342 HD23 LEU 45 3HD2 LEU 45 25.231 25.855 0.982
343 H ALA 46 H ALA 46 26.646 26.810 5.783
344 HA ALA 46 HA ALA 46 26.654 29.556 5.048
345 HB1 ALA 46 1HB ALA 46 24.996 28.384 6.494
346 HB2 ALA 46 2HB ALA 46 26.187 28.433 7.807
347 HB3 ALA 46 3HB ALA 46 25.565 29.949 7.114
348 H GLU 47 H GLU 47 28.565 27.872 7.647
349 HA GLU 47 HA GLU 47 29.750 30.273 8.594
350 HB2 GLU 47 1HB GLU 47 31.390 28.923 9.697
351 HB3 GLU 47 2HB GLU 47 29.825 28.115 9.803
352 HG2 GLU 47 1HG GLU 47 30.487 26.579 8.014
353 HG3 GLU 47 2HG GLU 47 32.044 27.405 7.859
354 H ALA 48 H ALA 48 30.645 28.195 5.884
355 HA ALA 48 HA ALA 48 33.080 29.408 5.256
356 HB1 ALA 48 1HB ALA 48 32.692 28.437 3.070
357 HB2 ALA 48 2HB ALA 48 32.239 27.287 4.337
358 HB3 ALA 48 3HB ALA 48 30.990 28.187 3.447
359 H LEU 49 H LEU 49 29.761 30.166 4.280
360 HA LEU 49 HA LEU 49 30.469 32.262 2.476
361 HB2 LEU 49 1HB LEU 49 28.294 31.015 2.635
362 HB3 LEU 49 2HB LEU 49 27.942 31.843 4.129
363 HG LEU 49 HG LEU 49 26.763 32.581 2.046
364 HD11 LEU 49 1HD1 LEU 49 26.653 34.881 2.619
365 HD12 LEU 49 2HD1 LEU 49 28.160 34.761 3.549
366 HD13 LEU 49 3HD1 LEU 49 26.709 33.882 4.085
367 HD21 LEU 49 1HD2 LEU 49 29.349 34.038 1.500
368 HD22 LEU 49 2HD2 LEU 49 27.838 34.158 0.585
369 HD23 LEU 49 3HD2 LEU 49 28.747 32.638 0.580
370 H LEU 50 H LEU 50 29.650 32.159 5.952
371 HA LEU 50 HA LEU 50 29.391 34.959 6.276
372 HB2 LEU 50 1HB LEU 50 30.496 33.087 8.397
373 HB3 LEU 50 2HB LEU 50 29.658 34.603 8.651
374 HG LEU 50 HG LEU 50 28.542 31.934 7.948
375 HD11 LEU 50 1HD1 LEU 50 28.973 32.345 10.242
376 HD12 LEU 50 2HD1 LEU 50 27.236 32.213 9.928
377 HD13 LEU 50 3HD1 LEU 50 27.969 33.821 10.186
378 HD21 LEU 50 1HD2 LEU 50 27.055 34.542 7.750
379 HD22 LEU 50 2HD2 LEU 50 26.286 32.934 7.828
380 HD23 LEU 50 3HD2 LEU 50 27.332 33.337 6.462
381 H SER 51 H SER 51 32.200 32.870 6.166
382 HA SER 51 HA SER 51 34.053 34.691 7.387
383 HB2 SER 51 1HB SER 51 34.443 32.351 5.531
384 HB3 SER 51 2HB SER 51 35.691 33.118 6.514
385 HG SER 51 HG SER 51 33.355 31.799 7.479
386 H GLY 52 H GLY 52 32.686 34.380 4.188
387 HA2 GLY 52 1HA GLY 52 32.954 35.849 2.400
388 HA3 GLY 52 2HA GLY 52 34.307 36.628 3.235
389 H ASP 53 H ASP 53 35.347 33.734 3.635
390 HA ASP 53 HA ASP 53 37.270 33.771 1.536
391 HB2 ASP 53 1HB ASP 53 37.542 32.604 3.795
392 HB3 ASP 53 2HB ASP 53 36.434 31.430 3.206
393 H LEU 54 H LEU 54 36.896 33.341 -0.557
394 HA LEU 54 HA LEU 54 34.664 31.765 -1.452
395 HB2 LEU 54 1HB LEU 54 35.818 33.492 -2.808
396 HB3 LEU 54 2HB LEU 54 37.246 32.474 -2.883
397 HG LEU 54 HG LEU 54 35.648 32.610 -4.867
398 HD11 LEU 54 1HD1 LEU 54 36.497 29.848 -4.046
399 HD12 LEU 54 2HD1 LEU 54 37.563 31.079 -4.751
400 HD13 LEU 54 3HD1 LEU 54 36.199 30.442 -5.692
401 HD21 LEU 54 1HD2 LEU 54 33.535 32.133 -3.694
402 HD22 LEU 54 2HD2 LEU 54 34.107 30.479 -3.391
403 HD23 LEU 54 3HD2 LEU 54 33.843 31.033 -5.049
404 H GLU 55 H GLU 55 38.087 31.041 -0.690
405 HA GLU 55 HA GLU 55 38.168 28.514 -1.983
406 HB2 GLU 55 1HB GLU 55 39.599 29.266 0.590
407 HB3 GLU 55 2HB GLU 55 40.042 27.991 -0.547
408 HG2 GLU 55 1HG GLU 55 39.989 30.030 -2.221
409 HG3 GLU 55 2HG GLU 55 40.334 30.946 -0.760
410 H LYS 56 H LYS 56 37.394 29.279 1.424
411 HA LYS 56 HA LYS 56 36.783 26.545 2.021
412 HB2 LYS 56 1HB LYS 56 36.184 27.198 4.172
413 HB3 LYS 56 2HB LYS 56 37.378 28.450 3.681
414 HG2 LYS 56 1HG LYS 56 35.345 29.801 3.134
415 HG3 LYS 56 2HG LYS 56 34.509 28.594 4.091
416 HD2 LYS 56 1HD LYS 56 37.023 29.788 5.210
417 HD3 LYS 56 2HD LYS 56 35.543 30.727 5.250
418 HE2 LYS 56 1HE LYS 56 34.392 28.985 6.526
419 HE3 LYS 56 2HE LYS 56 35.833 27.953 6.444
420 HZ1 LYS 56 1HZ LYS 56 35.712 29.094 8.540
421 HZ2 LYS 56 2HZ LYS 56 35.613 30.572 7.808
422 HZ3 LYS 56 3HZ LYS 56 37.005 29.685 7.698
423 H PHE 57 H PHE 57 34.824 29.300 0.870
424 HA PHE 57 HA PHE 57 32.310 27.975 1.132
425 HB2 PHE 57 1HB PHE 57 32.615 30.407 0.764
426 HB3 PHE 57 2HB PHE 57 33.146 30.076 -0.887
427 HD1 PHE 57 HD1 PHE 57 30.265 30.076 1.432
428 HD2 PHE 57 HD2 PHE 57 31.557 29.458 -2.623
429 HE1 PHE 57 HE1 PHE 57 27.895 30.128 0.674
430 HE2 PHE 57 HE2 PHE 57 29.188 29.489 -3.379
431 HZ PHE 57 HZ PHE 57 27.364 29.813 -1.735
432 H SER 58 H SER 58 34.482 28.217 -1.732
433 HA SER 58 HA SER 58 32.830 26.634 -3.431
434 HB2 SER 58 1HB SER 58 34.689 28.097 -4.195
435 HB3 SER 58 2HB SER 58 35.856 27.004 -3.422
436 HG SER 58 HG SER 58 35.689 26.468 -5.584
437 H ARG 59 H ARG 59 35.441 25.787 -1.147
438 HA ARG 59 HA ARG 59 35.628 23.055 -2.045
439 HB2 ARG 59 1HB ARG 59 37.405 24.146 -0.744
440 HB3 ARG 59 2HB ARG 59 36.319 24.314 0.637
441 HG2 ARG 59 1HG ARG 59 36.495 21.530 -0.301
442 HG3 ARG 59 2HG ARG 59 38.084 22.185 0.123
443 HD2 ARG 59 1HD ARG 59 37.435 22.641 2.349
444 HD3 ARG 59 2HD ARG 59 35.707 22.501 1.971
445 HE ARG 59 HE ARG 59 36.478 19.994 1.405
446 HH11 ARG 59 1HH1 ARG 59 37.345 21.958 4.223
447 HH12 ARG 59 2HH1 ARG 59 37.495 20.557 5.251
448 HH21 ARG 59 1HH2 ARG 59 36.667 18.296 2.747
449 HH22 ARG 59 2HH2 ARG 59 37.141 18.510 4.425
450 H VAL 60 H VAL 60 33.885 24.595 0.700
451 HA VAL 60 HA VAL 60 32.769 22.089 1.524
452 HB VAL 60 HB VAL 60 33.029 24.153 3.002
453 HG11 VAL 60 1HG1 VAL 60 30.553 24.957 1.669
454 HG12 VAL 60 2HG1 VAL 60 31.252 25.687 3.113
455 HG13 VAL 60 3HG1 VAL 60 32.114 25.778 1.577
456 HG21 VAL 60 1HG2 VAL 60 31.771 22.118 3.665
457 HG22 VAL 60 2HG2 VAL 60 31.130 23.606 4.388
458 HG23 VAL 60 3HG2 VAL 60 30.294 22.859 3.006
459 H LEU 61 H LEU 61 31.850 24.518 -0.876
460 HA LEU 61 HA LEU 61 29.165 23.715 -1.298
461 HB2 LEU 61 1HB LEU 61 30.562 25.634 -2.378
462 HB3 LEU 61 2HB LEU 61 31.067 24.423 -3.539
463 HG LEU 61 HG LEU 61 28.417 24.084 -3.763
464 HD11 LEU 61 1HD1 LEU 61 27.961 25.768 -1.997
465 HD12 LEU 61 2HD1 LEU 61 27.285 26.239 -3.571
466 HD13 LEU 61 3HD1 LEU 61 28.789 26.999 -2.992
467 HD21 LEU 61 1HD2 LEU 61 30.254 25.004 -5.458
468 HD22 LEU 61 2HD2 LEU 61 29.469 26.559 -5.098
469 HD23 LEU 61 3HD2 LEU 61 28.521 25.230 -5.764
470 H VAL 62 H VAL 62 32.239 22.385 -2.643
471 HA VAL 62 HA VAL 62 30.899 20.417 -4.278
472 HB VAL 62 HB VAL 62 33.737 20.362 -3.126
473 HG11 VAL 62 1HG1 VAL 62 32.466 18.779 -5.415
474 HG12 VAL 62 2HG1 VAL 62 34.206 18.808 -5.042
475 HG13 VAL 62 3HG1 VAL 62 33.063 18.121 -3.875
476 HG21 VAL 62 1HG2 VAL 62 33.348 22.339 -4.506
477 HG22 VAL 62 2HG2 VAL 62 34.404 21.204 -5.351
478 HG23 VAL 62 3HG2 VAL 62 32.690 21.336 -5.810
479 H GLU 63 H GLU 63 32.303 20.361 -0.989
480 HA GLU 63 HA GLU 63 31.885 17.586 -0.459
481 HB2 GLU 63 1HB GLU 63 31.633 19.931 1.468
482 HB3 GLU 63 2HB GLU 63 31.827 18.242 1.938
483 HG2 GLU 63 1HG GLU 63 33.880 19.788 0.327
484 HG3 GLU 63 2HG GLU 63 33.880 19.718 2.083
485 H GLN 64 H GLN 64 29.739 20.413 -0.073
486 HA GLN 64 HA GLN 64 27.525 18.898 0.983
487 HB2 GLN 64 1HB GLN 64 27.783 21.629 -0.301
488 HB3 GLN 64 2HB GLN 64 26.227 20.978 0.226
489 HG2 GLN 64 1HG GLN 64 28.637 21.335 2.036
490 HG3 GLN 64 2HG GLN 64 27.290 22.473 1.903
491 HE21 GLN 64 1HE2 GLN 64 26.995 19.524 4.494
492 HE22 GLN 64 2HE2 GLN 64 28.482 20.156 3.825
493 H GLN 65 H GLN 65 28.462 19.859 -2.360
494 HA GLN 65 HA GLN 65 25.996 18.950 -3.526
495 HB2 GLN 65 1HB GLN 65 28.784 19.336 -4.628
496 HB3 GLN 65 2HB GLN 65 27.477 18.660 -5.607
497 HG2 GLN 65 1HG GLN 65 26.114 20.682 -5.166
498 HG3 GLN 65 2HG GLN 65 27.469 21.391 -4.291
499 HE21 GLN 65 1HE2 GLN 65 28.841 22.721 -7.187
500 HE22 GLN 65 2HE2 GLN 65 28.634 22.771 -5.450
501 H GLN 66 H GLN 66 29.040 17.253 -2.687
502 HA GLN 66 HA GLN 66 28.357 14.806 -4.019
503 HB2 GLN 66 1HB GLN 66 30.027 15.344 -1.537
504 HB3 GLN 66 2HB GLN 66 29.847 13.748 -2.269
505 HG2 GLN 66 1HG GLN 66 30.792 14.642 -4.387
506 HG3 GLN 66 2HG GLN 66 31.088 16.180 -3.567
507 HE21 GLN 66 1HE2 GLN 66 34.046 15.126 -2.081
508 HE22 GLN 66 2HE2 GLN 66 32.971 16.428 -2.523
509 H ASP 67 H ASP 67 27.524 16.079 -0.775
510 HA ASP 67 HA ASP 67 26.194 13.590 -0.007
511 HB2 ASP 67 1HB ASP 67 27.204 15.247 1.596
512 HB3 ASP 67 2HB ASP 67 25.895 16.359 1.176
513 H ARG 68 H ARG 68 25.215 16.779 -1.247
514 HA ARG 68 HA ARG 68 22.398 16.446 -1.005
515 HB2 ARG 68 1HB ARG 68 24.178 18.068 -2.816
516 HB3 ARG 68 2HB ARG 68 22.459 17.951 -3.169
517 HG2 ARG 68 1HG ARG 68 21.915 18.859 -0.953
518 HG3 ARG 68 2HG ARG 68 23.642 18.980 -0.571
519 HD2 ARG 68 1HD ARG 68 22.767 21.156 -1.290
520 HD3 ARG 68 2HD ARG 68 23.949 20.550 -2.466
521 HE ARG 68 HE ARG 68 21.551 19.644 -3.486
522 HH11 ARG 68 1HH1 ARG 68 22.635 22.894 -2.556
523 HH12 ARG 68 2HH1 ARG 68 21.576 23.655 -3.714
524 HH21 ARG 68 1HH2 ARG 68 20.294 20.654 -4.904
525 HH22 ARG 68 2HH2 ARG 68 20.269 22.407 -5.037
526 H ALA 69 H ALA 69 24.621 15.627 -3.691
527 HA ALA 69 HA ALA 69 22.686 14.822 -5.533
528 HB1 ALA 69 1HB ALA 69 25.058 15.069 -6.088
529 HB2 ALA 69 2HB ALA 69 25.478 13.681 -5.055
530 HB3 ALA 69 3HB ALA 69 24.506 13.436 -6.530
531 H ARG 70 H ARG 70 23.951 13.017 -2.761
532 HA ARG 70 HA ARG 70 22.853 10.451 -3.530
533 HB2 ARG 70 1HB ARG 70 23.506 11.578 -0.774
534 HB3 ARG 70 2HB ARG 70 23.237 9.870 -1.143
535 HG2 ARG 70 1HG ARG 70 25.257 9.730 -2.398
536 HG3 ARG 70 2HG ARG 70 25.399 11.490 -2.486
537 HD2 ARG 70 1HD ARG 70 25.552 11.456 0.075
538 HD3 ARG 70 2HD ARG 70 25.872 9.719 -0.087
539 HE ARG 70 HE ARG 70 27.530 11.973 -1.140
540 HH11 ARG 70 1HH1 ARG 70 27.291 8.509 -0.470
541 HH12 ARG 70 2HH1 ARG 70 28.984 8.241 -0.784
542 HH21 ARG 70 1HH2 ARG 70 29.670 11.554 -1.511
543 HH22 ARG 70 2HH2 ARG 70 30.310 9.943 -1.347
544 H ARG 71 H ARG 71 21.748 13.078 -1.399
545 HA ARG 71 HA ARG 71 19.280 11.754 -0.623
546 HB2 ARG 71 1HB ARG 71 20.058 14.696 -0.587
547 HB3 ARG 71 2HB ARG 71 18.722 13.969 0.315
548 HG2 ARG 71 1HG ARG 71 20.256 12.739 1.720
549 HG3 ARG 71 2HG ARG 71 21.636 13.199 0.705
550 HD2 ARG 71 1HD ARG 71 21.144 15.589 1.208
551 HD3 ARG 71 2HD ARG 71 19.940 15.046 2.392
552 HE ARG 71 HE ARG 71 22.879 14.932 2.618
553 HH11 ARG 71 1HH1 ARG 71 19.851 13.693 3.988
554 HH12 ARG 71 2HH1 ARG 71 20.624 13.262 5.488
555 HH21 ARG 71 1HH2 ARG 71 23.761 14.367 4.487
556 HH22 ARG 71 2HH2 ARG 71 22.816 13.637 5.774
557 H GLU 72 H GLU 72 20.289 13.888 -3.200
558 HA GLU 72 HA GLU 72 17.639 14.667 -3.994
559 HB2 GLU 72 1HB GLU 72 20.360 14.833 -5.221
560 HB3 GLU 72 2HB GLU 72 18.921 15.267 -6.167
561 HG2 GLU 72 1HG GLU 72 18.288 16.975 -4.666
562 HG3 GLU 72 2HG GLU 72 19.348 16.386 -3.389
563 H GLN 73 H GLN 73 19.564 11.803 -4.675
564 HA GLN 73 HA GLN 73 18.314 11.000 -7.078
565 HB2 GLN 73 1HB GLN 73 19.200 9.275 -4.731
566 HB3 GLN 73 2HB GLN 73 18.680 8.644 -6.294
567 HG2 GLN 73 1HG GLN 73 21.099 10.341 -5.746
568 HG3 GLN 73 2HG GLN 73 21.070 8.652 -6.231
569 HE21 GLN 73 1HE2 GLN 73 21.301 11.451 -9.012
570 HE22 GLN 73 2HE2 GLN 73 21.706 11.643 -7.319
571 H GLU 74 H GLU 74 17.127 10.497 -3.700
572 HA GLU 74 HA GLU 74 14.757 9.127 -4.715
573 HB2 GLU 74 1HB GLU 74 13.941 9.351 -2.360
574 HB3 GLU 74 2HB GLU 74 15.496 8.530 -2.526
575 HG2 GLU 74 1HG GLU 74 16.678 10.543 -1.828
576 HG3 GLU 74 2HG GLU 74 15.149 11.432 -1.713
577 H ARG 75 H ARG 75 15.616 12.471 -3.946
578 HA ARG 75 HA ARG 75 12.932 13.448 -3.816
579 HB2 ARG 75 1HB ARG 75 15.523 14.820 -4.588
580 HB3 ARG 75 2HB ARG 75 13.976 15.657 -4.490
581 HG2 ARG 75 1HG ARG 75 13.788 15.000 -2.114
582 HG3 ARG 75 2HG ARG 75 15.414 14.286 -2.211
583 HD2 ARG 75 1HD ARG 75 16.340 16.453 -2.896
584 HD3 ARG 75 2HD ARG 75 14.713 17.163 -2.882
585 HE ARG 75 HE ARG 75 15.293 16.021 -0.329
586 HH11 ARG 75 1HH1 ARG 75 16.129 18.822 -2.310
587 HH12 ARG 75 2HH1 ARG 75 16.467 19.825 -0.925
588 HH21 ARG 75 1HH2 ARG 75 15.741 17.357 1.394
589 HH22 ARG 75 2HH2 ARG 75 16.251 19.005 1.137
590 H ILE 76 H ILE 76 15.218 13.344 -6.604
591 HA ILE 76 HA ILE 76 13.455 14.781 -8.307
592 HB ILE 76 HB ILE 76 14.857 14.065 -10.176
593 HG12 ILE 76 1HG1 ILE 76 16.232 12.209 -8.191
594 HG13 ILE 76 2HG1 ILE 76 15.143 11.688 -9.474
595 HG21 ILE 76 1HG2 ILE 76 16.554 14.647 -7.715
596 HG22 ILE 76 2HG2 ILE 76 16.918 15.080 -9.398
597 HG23 ILE 76 3HG2 ILE 76 15.564 15.857 -8.557
598 HD11 ILE 76 1HD1 ILE 76 16.738 12.674 -11.159
599 HD12 ILE 76 2HD1 ILE 76 17.870 12.989 -9.819
600 HD13 ILE 76 3HD1 ILE 76 17.405 11.322 -10.217
601 H ARG 77 H ARG 77 13.222 11.507 -7.307
602 HA ARG 77 HA ARG 77 11.702 10.648 -9.665
603 HB2 ARG 77 1HB ARG 77 12.419 9.441 -7.017
604 HB3 ARG 77 2HB ARG 77 10.972 8.835 -7.829
605 HG2 ARG 77 1HG ARG 77 12.606 7.389 -8.630
606 HG3 ARG 77 2HG ARG 77 12.490 8.591 -9.928
607 HD2 ARG 77 1HD ARG 77 14.418 9.803 -8.843
608 HD3 ARG 77 2HD ARG 77 14.581 8.429 -7.740
609 HE ARG 77 HE ARG 77 14.616 7.471 -10.416
610 HH11 ARG 77 1HH1 ARG 77 16.652 9.335 -8.225
611 HH12 ARG 77 2HH1 ARG 77 18.134 8.889 -9.059
612 HH21 ARG 77 1HH2 ARG 77 16.543 6.936 -11.428
613 HH22 ARG 77 2HH2 ARG 77 18.057 7.550 -10.819
614 H LEU 78 H LEU 78 10.936 12.733 -7.107
615 HA LEU 78 HA LEU 78 8.028 12.311 -7.627
616 HB2 LEU 78 1HB LEU 78 8.940 11.104 -5.565
617 HB3 LEU 78 2HB LEU 78 9.158 12.684 -4.841
618 HG LEU 78 HG LEU 78 6.472 11.607 -5.768
619 HD11 LEU 78 1HD1 LEU 78 7.762 11.534 -3.008
620 HD12 LEU 78 2HD1 LEU 78 7.485 10.136 -4.075
621 HD13 LEU 78 3HD1 LEU 78 6.103 11.020 -3.399
622 HD21 LEU 78 1HD2 LEU 78 5.592 13.250 -4.055
623 HD22 LEU 78 2HD2 LEU 78 6.326 13.996 -5.481
624 HD23 LEU 78 3HD2 LEU 78 7.231 13.930 -3.955
625 H PHE 79 H PHE 79 10.486 14.403 -6.069
626 HA PHE 79 HA PHE 79 8.611 16.702 -6.184
627 HB2 PHE 79 1HB PHE 79 11.332 16.427 -4.852
628 HB3 PHE 79 2HB PHE 79 10.195 17.762 -4.647
629 HD1 PHE 79 HD1 PHE 79 11.055 14.328 -3.682
630 HD2 PHE 79 HD2 PHE 79 8.095 17.428 -3.336
631 HE1 PHE 79 HE1 PHE 79 10.044 13.128 -1.750
632 HE2 PHE 79 HE2 PHE 79 7.069 16.237 -1.401
633 HZ PHE 79 HZ PHE 79 8.045 14.082 -0.601
634 H SER 80 H SER 80 9.469 18.801 -6.784
635 HA SER 80 HA SER 80 11.447 18.719 -8.968
636 HB2 SER 80 1HB SER 80 9.589 20.941 -8.020
637 HB3 SER 80 2HB SER 80 10.558 20.932 -9.510
638 HG SER 80 HG SER 80 8.425 20.360 -9.947
639 H ALA 81 H ALA 81 12.370 21.255 -8.736
640 HA ALA 81 HA ALA 81 13.409 21.681 -6.007
641 HB1 ALA 81 1HB ALA 81 14.943 20.013 -7.039
642 HB2 ALA 81 2HB ALA 81 15.223 21.130 -8.399
643 HB3 ALA 81 3HB ALA 81 15.752 21.575 -6.758
644 H ASP 82 H ASP 82 11.598 23.199 -7.458
645 HA ASP 82 HA ASP 82 12.438 25.062 -9.279
646 HB2 ASP 82 1HB ASP 82 10.534 25.531 -6.955
647 HB3 ASP 82 2HB ASP 82 10.617 26.505 -8.431
648 HA PRO 83 HA PRO 83 15.296 27.405 -6.725
649 HB2 PRO 83 1HB PRO 83 16.437 28.926 -8.653
650 HB3 PRO 83 2HB PRO 83 16.786 27.172 -8.527
651 HG2 PRO 83 1HG PRO 83 14.804 28.590 -10.269
652 HG3 PRO 83 2HG PRO 83 16.067 27.425 -10.742
653 HD2 PRO 83 1HD PRO 83 13.527 26.640 -10.354
654 HD3 PRO 83 2HD PRO 83 14.905 25.605 -9.848
655 H PHE 84 H PHE 84 15.614 29.661 -6.118
656 HA PHE 84 HA PHE 84 13.227 31.350 -6.737
657 HB2 PHE 84 1HB PHE 84 15.157 31.551 -4.404
658 HB3 PHE 84 2HB PHE 84 13.634 32.428 -4.610
659 HD1 PHE 84 HD1 PHE 84 11.608 30.564 -5.258
660 HD2 PHE 84 HD2 PHE 84 15.060 29.918 -2.763
661 HE1 PHE 84 HE1 PHE 84 10.420 28.708 -4.107
662 HE2 PHE 84 HE2 PHE 84 13.876 28.061 -1.604
663 HZ PHE 84 HZ PHE 84 11.551 27.448 -2.278
664 H ASP 85 H ASP 85 15.902 30.947 -8.171
665 HA ASP 85 HA ASP 85 17.291 33.496 -7.905
666 HB2 ASP 85 1HB ASP 85 17.635 31.274 -9.950
667 HB3 ASP 85 2HB ASP 85 18.804 32.546 -9.559
668 H LEU 86 H LEU 86 14.757 34.109 -8.438
669 HA LEU 86 HA LEU 86 13.995 34.105 -11.214
670 HB2 LEU 86 1HB LEU 86 13.174 35.924 -8.925
671 HB3 LEU 86 2HB LEU 86 12.342 35.810 -10.472
672 HG LEU 86 HG LEU 86 12.571 33.561 -8.440
673 HD11 LEU 86 1HD1 LEU 86 10.245 35.408 -9.112
674 HD12 LEU 86 2HD1 LEU 86 11.205 35.427 -7.611
675 HD13 LEU 86 3HD1 LEU 86 10.188 34.021 -7.998
676 HD21 LEU 86 1HD2 LEU 86 12.299 32.690 -10.698
677 HD22 LEU 86 2HD2 LEU 86 10.937 33.797 -10.996
678 HD23 LEU 86 3HD2 LEU 86 10.788 32.494 -9.793
679 H GLU 87 H GLU 87 15.731 36.373 -9.133
680 HA GLU 87 HA GLU 87 15.941 38.422 -11.224
681 HB2 GLU 87 1HB GLU 87 17.221 38.059 -8.489
682 HB3 GLU 87 2HB GLU 87 17.585 39.424 -9.547
683 HG2 GLU 87 1HG GLU 87 14.746 38.806 -8.706
684 HG3 GLU 87 2HG GLU 87 15.841 39.746 -7.681
685 H ALA 88 H ALA 88 18.048 36.047 -9.631
686 HA ALA 88 HA ALA 88 20.168 35.315 -10.031
687 HB1 ALA 88 1HB ALA 88 18.851 33.993 -11.580
688 HB2 ALA 88 2HB ALA 88 19.026 35.244 -12.840
689 HB3 ALA 88 3HB ALA 88 20.451 34.336 -12.278
690 H GLN 89 H GLN 89 20.259 38.092 -9.836
691 HA GLN 89 HA GLN 89 21.940 39.099 -12.034
692 HB2 GLN 89 1HB GLN 89 21.022 40.353 -9.417
693 HB3 GLN 89 2HB GLN 89 21.964 41.186 -10.659
694 HG2 GLN 89 1HG GLN 89 19.177 40.047 -11.040
695 HG3 GLN 89 2HG GLN 89 19.565 41.749 -10.777
696 HE21 GLN 89 1HE2 GLN 89 19.551 40.299 -14.470
697 HE22 GLN 89 2HE2 GLN 89 18.833 39.506 -13.081
698 H ALA 90 H ALA 90 24.072 39.859 -11.765
699 HA ALA 90 HA ALA 90 25.499 39.251 -9.256
700 HB1 ALA 90 1HB ALA 90 26.325 38.094 -11.968
701 HB2 ALA 90 2HB ALA 90 27.291 38.026 -10.473
702 HB3 ALA 90 3HB ALA 90 25.741 37.154 -10.570
703 H LYS 91 H LYS 91 27.574 40.430 -9.239
704 HA LYS 91 HA LYS 91 27.307 42.942 -10.751
705 HB2 LYS 91 1HB LYS 91 29.308 41.997 -8.668
706 HB3 LYS 91 2HB LYS 91 29.287 43.615 -9.379
707 HG2 LYS 91 1HG LYS 91 27.025 43.995 -8.451
708 HG3 LYS 91 2HG LYS 91 27.059 42.369 -7.745
709 HD2 LYS 91 1HD LYS 91 27.730 43.712 -5.957
710 HD3 LYS 91 2HD LYS 91 29.269 43.129 -6.620
711 HE2 LYS 91 1HE LYS 91 29.285 45.298 -8.025
712 HE3 LYS 91 2HE LYS 91 27.988 45.864 -6.946
713 HZ1 LYS 91 1HZ LYS 91 29.586 45.297 -5.095
714 HZ2 LYS 91 2HZ LYS 91 30.042 46.572 -6.043
715 HZ3 LYS 91 3HZ LYS 91 30.760 45.101 -6.250
716 H ILE 92 H ILE 92 28.961 43.900 -11.954
717 HA ILE 92 HA ILE 92 31.157 42.111 -12.879
718 HB ILE 92 HB ILE 92 29.584 44.056 -14.657
719 HG12 ILE 92 1HG1 ILE 92 29.760 41.018 -14.824
720 HG13 ILE 92 2HG1 ILE 92 28.393 41.893 -14.134
721 HG21 ILE 92 1HG2 ILE 92 32.037 43.949 -15.185
722 HG22 ILE 92 2HG2 ILE 92 31.917 42.182 -15.349
723 HG23 ILE 92 3HG2 ILE 92 31.064 43.251 -16.488
724 HD11 ILE 92 1HD1 ILE 92 27.798 41.251 -16.376
725 HD12 ILE 92 2HD1 ILE 92 28.037 43.013 -16.369
726 HD13 ILE 92 3HD1 ILE 92 29.292 41.943 -17.043
727 H GLU 93 H GLU 93 32.878 43.031 -11.892
728 HA GLU 93 HA GLU 93 33.325 45.921 -12.185
729 HB2 GLU 93 1HB GLU 93 34.048 45.981 -9.862
730 HB3 GLU 93 2HB GLU 93 32.338 45.622 -9.993
731 HG2 GLU 93 1HG GLU 93 32.903 43.199 -9.605
732 HG3 GLU 93 2HG GLU 93 34.575 43.701 -9.284
733 H GLU 94 H GLU 94 35.746 46.299 -11.585
734 HA GLU 94 HA GLU 94 37.189 44.423 -13.233
735 HB2 GLU 94 1HB GLU 94 39.090 45.945 -12.920
736 HB3 GLU 94 2HB GLU 94 37.620 46.767 -13.441
737 HG2 GLU 94 1HG GLU 94 37.237 47.477 -11.050
738 HG3 GLU 94 2HG GLU 94 38.831 46.807 -10.659
739 H ASP 95 H ASP 95 38.317 42.726 -12.750
740 HA ASP 95 HA ASP 95 39.572 42.503 -10.063
741 HB2 ASP 95 1HB ASP 95 37.665 40.908 -10.184
742 HB3 ASP 95 2HB ASP 95 38.362 40.206 -11.653
743 H ILE 96 H ILE 96 41.429 43.296 -10.808
744 HA ILE 96 HA ILE 96 42.738 41.895 -13.080
745 HB ILE 96 HB ILE 96 44.237 43.869 -13.214
746 HG12 ILE 96 1HG1 ILE 96 42.445 45.125 -11.087
747 HG13 ILE 96 2HG1 ILE 96 44.037 44.443 -10.741
748 HG21 ILE 96 1HG2 ILE 96 42.609 45.407 -14.186
749 HG22 ILE 96 2HG2 ILE 96 42.034 43.754 -14.483
750 HG23 ILE 96 3HG2 ILE 96 41.295 44.735 -13.195
751 HD11 ILE 96 1HD1 ILE 96 43.436 46.833 -12.531
752 HD12 ILE 96 2HD1 ILE 96 44.255 46.840 -10.957
753 HD13 ILE 96 3HD1 ILE 96 45.046 46.086 -12.359
754 H ARG 97 H ARG 97 42.469 40.931 -10.262
755 HA ARG 97 HA ARG 97 45.411 40.818 -9.606
756 HB2 ARG 97 1HB ARG 97 44.825 40.345 -7.313
757 HB3 ARG 97 2HB ARG 97 44.064 41.855 -7.819
758 HG2 ARG 97 1HG ARG 97 41.901 40.862 -7.896
759 HG3 ARG 97 2HG ARG 97 42.562 39.219 -7.848
760 HD2 ARG 97 1HD ARG 97 41.678 39.677 -5.699
761 HD3 ARG 97 2HD ARG 97 43.449 39.717 -5.561
762 HE ARG 97 HE ARG 97 42.443 42.342 -6.096
763 HH11 ARG 97 1HH1 ARG 97 42.578 40.001 -3.465
764 HH12 ARG 97 2HH1 ARG 97 42.492 41.233 -2.233
765 HH21 ARG 97 1HH2 ARG 97 42.328 43.863 -4.480
766 HH22 ARG 97 2HH2 ARG 97 42.347 43.385 -2.804
767 H GLN 98 H GLN 98 43.703 39.276 -11.480
768 HA GLN 98 HA GLN 98 43.709 37.216 -12.411
769 HB2 GLN 98 1HB GLN 98 46.044 36.921 -11.431
770 HB3 GLN 98 2HB GLN 98 45.306 36.074 -10.073
771 HG2 GLN 98 1HG GLN 98 44.368 34.364 -11.613
772 HG3 GLN 98 2HG GLN 98 45.012 35.243 -13.003
773 HE21 GLN 98 1HE2 GLN 98 48.046 33.600 -12.859
774 HE22 GLN 98 2HE2 GLN 98 46.808 34.391 -13.797
775 HXT GLN 98 HO GLN 98 41.329 36.517 -9.552
Start of MODEL 4
1 H1 SER 1 1H SER 1 -5.442 43.428 -11.456
2 H2 SER 1 2H SER 1 -6.622 42.532 -11.931
3 H3 SER 1 3H SER 1 -6.846 44.114 -11.562
4 HA SER 1 HA SER 1 -7.279 43.891 -13.904
5 HB2 SER 1 1HB SER 1 -4.726 45.118 -14.357
6 HB3 SER 1 2HB SER 1 -6.270 45.938 -13.944
7 HG SER 1 HG SER 1 -5.345 44.505 -11.876
8 H GLN 2 H GLN 2 -4.579 42.162 -12.771
9 HA GLN 2 HA GLN 2 -4.504 40.520 -15.224
10 HB2 GLN 2 1HB GLN 2 -2.573 42.558 -14.778
11 HB3 GLN 2 2HB GLN 2 -1.782 41.050 -14.321
12 HG2 GLN 2 1HG GLN 2 -3.241 41.275 -16.959
13 HG3 GLN 2 2HG GLN 2 -1.604 41.924 -16.778
14 HE21 GLN 2 1HE2 GLN 2 -0.120 38.851 -17.349
15 HE22 GLN 2 2HE2 GLN 2 -0.057 40.594 -17.404
16 H GLN 3 H GLN 3 -3.427 38.471 -14.744
17 HA GLN 3 HA GLN 3 -3.438 37.867 -11.806
18 HB2 GLN 3 1HB GLN 3 -3.792 36.065 -14.226
19 HB3 GLN 3 2HB GLN 3 -3.707 35.508 -12.551
20 HG2 GLN 3 1HG GLN 3 -5.710 36.880 -12.021
21 HG3 GLN 3 2HG GLN 3 -5.824 37.345 -13.724
22 HE21 GLN 3 1HE2 GLN 3 -7.561 33.999 -12.503
23 HE22 GLN 3 2HE2 GLN 3 -7.005 35.276 -11.449
24 H SER 4 H SER 4 -1.574 37.882 -14.770
25 HA SER 4 HA SER 4 0.607 37.406 -15.247
26 HB2 SER 4 1HB SER 4 1.036 38.288 -12.381
27 HB3 SER 4 2HB SER 4 2.207 38.362 -13.716
28 HG SER 4 HG SER 4 1.095 40.361 -13.331
29 H HIS 5 H HIS 5 -0.737 35.014 -14.390
30 HA HIS 5 HA HIS 5 1.025 33.603 -12.559
31 HB2 HIS 5 1HB HIS 5 -1.486 33.198 -13.064
32 HB3 HIS 5 2HB HIS 5 -0.922 32.330 -14.499
33 HD1 HIS 5 HD1 HIS 5 -0.715 32.207 -10.688
34 HD2 HIS 5 HD2 HIS 5 0.014 29.782 -13.999
35 HE1 HIS 5 HE1 HIS 5 -0.258 29.881 -9.811
36 H SER 6 H SER 6 2.542 31.969 -13.100
37 HA SER 6 HA SER 6 3.180 31.556 -15.964
38 HB2 SER 6 1HB SER 6 4.567 33.489 -15.265
39 HB3 SER 6 2HB SER 6 5.197 32.536 -13.904
40 HG SER 6 HG SER 6 6.602 32.498 -15.717
41 H SER 7 H SER 7 4.332 29.601 -16.307
42 HA SER 7 HA SER 7 4.871 27.895 -13.945
43 HB2 SER 7 1HB SER 7 3.018 27.028 -16.194
44 HB3 SER 7 2HB SER 7 3.481 26.081 -14.765
45 HG SER 7 HG SER 7 2.556 28.121 -13.649
46 HA PRO 8 HA PRO 8 7.739 27.229 -17.510
47 HB2 PRO 8 1HB PRO 8 10.125 27.573 -16.292
48 HB3 PRO 8 2HB PRO 8 9.136 28.983 -16.790
49 HG2 PRO 8 1HG PRO 8 9.318 27.677 -14.090
50 HG3 PRO 8 2HG PRO 8 9.506 29.407 -14.520
51 HD2 PRO 8 1HD PRO 8 7.153 28.387 -13.618
52 HD3 PRO 8 2HD PRO 8 7.216 29.691 -14.853
53 H GLY 9 H GLY 9 9.330 25.538 -17.812
54 HA2 GLY 9 1HA GLY 9 9.236 23.403 -15.701
55 HA3 GLY 9 2HA GLY 9 8.826 23.049 -17.385
56 H GLU 10 H GLU 10 10.980 25.066 -18.172
57 HA GLU 10 HA GLU 10 13.078 23.056 -18.432
58 HB2 GLU 10 1HB GLU 10 14.137 24.797 -19.891
59 HB3 GLU 10 2HB GLU 10 12.506 24.344 -20.373
60 HG2 GLU 10 1HG GLU 10 12.865 26.765 -18.619
61 HG3 GLU 10 2HG GLU 10 13.269 26.876 -20.338
62 H ILE 11 H ILE 11 12.629 24.167 -15.719
63 HA ILE 11 HA ILE 11 14.856 25.831 -15.102
64 HB ILE 11 HB ILE 11 13.643 24.309 -12.920
65 HG12 ILE 11 1HG1 ILE 11 11.755 25.846 -14.726
66 HG13 ILE 11 2HG1 ILE 11 11.694 24.114 -14.350
67 HG21 ILE 11 1HG2 ILE 11 13.356 26.519 -12.000
68 HG22 ILE 11 2HG2 ILE 11 14.907 26.488 -12.852
69 HG23 ILE 11 3HG2 ILE 11 13.490 27.232 -13.630
70 HD11 ILE 11 1HD1 ILE 11 11.018 26.444 -12.536
71 HD12 ILE 11 2HD1 ILE 11 9.988 25.089 -13.045
72 HD13 ILE 11 3HD1 ILE 11 11.318 24.808 -11.898
73 H THR 12 H THR 12 15.020 22.928 -16.254
74 HA THR 12 HA THR 12 16.552 21.484 -14.243
75 HB THR 12 HB THR 12 16.994 19.937 -16.173
76 HG1 THR 12 HG1 THR 12 16.722 21.538 -17.814
77 HG21 THR 12 1HG2 THR 12 14.058 20.648 -15.727
78 HG22 THR 12 2HG2 THR 12 15.038 19.636 -14.636
79 HG23 THR 12 3HG2 THR 12 14.693 19.088 -16.291
80 H SER 13 H SER 13 18.155 22.969 -13.765
81 HA SER 13 HA SER 13 20.588 22.754 -15.367
82 HB2 SER 13 1HB SER 13 19.300 24.679 -16.445
83 HB3 SER 13 2HB SER 13 19.387 25.520 -14.885
84 HG SER 13 HG SER 13 21.092 25.896 -16.592
85 H SER 14 H SER 14 21.946 24.847 -13.991
86 HA SER 14 HA SER 14 21.487 24.114 -11.117
87 HB2 SER 14 1HB SER 14 23.898 24.684 -10.815
88 HB3 SER 14 2HB SER 14 23.634 23.317 -11.915
89 HG SER 14 HG SER 14 24.426 25.960 -12.511
90 HA PRO 15 HA PRO 15 20.936 28.701 -11.827
91 HB2 PRO 15 1HB PRO 15 18.494 29.133 -10.700
92 HB3 PRO 15 2HB PRO 15 18.685 28.565 -12.384
93 HG2 PRO 15 1HG PRO 15 18.167 26.927 -9.923
94 HG3 PRO 15 2HG PRO 15 17.256 26.952 -11.469
95 HD2 PRO 15 1HD PRO 15 19.140 25.094 -11.011
96 HD3 PRO 15 2HD PRO 15 18.975 25.854 -12.631
97 H GLN 16 H GLN 16 20.627 26.532 -9.186
98 HA GLN 16 HA GLN 16 20.752 28.513 -7.071
99 HB2 GLN 16 1HB GLN 16 21.248 25.517 -7.042
100 HB3 GLN 16 2HB GLN 16 21.109 26.554 -5.615
101 HG2 GLN 16 1HG GLN 16 18.815 27.178 -7.008
102 HG3 GLN 16 2HG GLN 16 18.995 25.446 -7.332
103 HE21 GLN 16 1HE2 GLN 16 17.529 26.683 -3.842
104 HE22 GLN 16 2HE2 GLN 16 17.668 27.669 -5.275
105 H GLY 17 H GLY 17 23.017 28.220 -9.273
106 HA2 GLY 17 1HA GLY 17 25.202 28.888 -9.254
107 HA3 GLY 17 2HA GLY 17 24.987 29.313 -7.555
108 H LEU 18 H LEU 18 24.583 26.021 -8.715
109 HA LEU 18 HA LEU 18 26.511 25.015 -6.812
110 HB2 LEU 18 1HB LEU 18 25.399 23.627 -9.275
111 HB3 LEU 18 2HB LEU 18 26.106 22.854 -7.862
112 HG LEU 18 HG LEU 18 23.477 24.365 -7.966
113 HD11 LEU 18 1HD1 LEU 18 23.447 22.196 -9.129
114 HD12 LEU 18 2HD1 LEU 18 22.467 22.144 -7.650
115 HD13 LEU 18 3HD1 LEU 18 24.086 21.393 -7.674
116 HD21 LEU 18 1HD2 LEU 18 24.460 24.605 -5.732
117 HD22 LEU 18 2HD2 LEU 18 24.780 22.853 -5.657
118 HD23 LEU 18 3HD2 LEU 18 23.106 23.464 -5.670
119 H ASP 19 H ASP 19 26.473 25.942 -10.143
120 HA ASP 19 HA ASP 19 29.052 24.770 -10.850
121 HB2 ASP 19 1HB ASP 19 28.522 25.775 -13.031
122 HB3 ASP 19 2HB ASP 19 27.123 24.881 -12.396
123 H ASN 20 H ASN 20 27.763 27.856 -9.774
124 HA ASN 20 HA ASN 20 30.496 29.027 -10.059
125 HB2 ASN 20 1HB ASN 20 27.817 30.099 -10.868
126 HB3 ASN 20 2HB ASN 20 28.911 31.242 -10.087
127 HD21 ASN 20 1HD2 ASN 20 31.432 30.679 -12.746
128 HD22 ASN 20 2HD2 ASN 20 31.380 30.281 -11.052
129 HA PRO 21 HA PRO 21 29.356 29.112 -5.590
130 HB2 PRO 21 1HB PRO 21 32.015 28.916 -4.769
131 HB3 PRO 21 2HB PRO 21 30.936 27.524 -5.007
132 HG2 PRO 21 1HG PRO 21 32.936 28.680 -6.860
133 HG3 PRO 21 2HG PRO 21 32.640 26.973 -6.448
134 HD2 PRO 21 1HD PRO 21 31.740 27.992 -8.713
135 HD3 PRO 21 2HD PRO 21 30.724 26.857 -7.755
136 H ALA 22 H ALA 22 31.813 30.770 -7.565
137 HA ALA 22 HA ALA 22 32.421 32.844 -5.707
138 HB1 ALA 22 1HB ALA 22 32.409 32.913 -8.758
139 HB2 ALA 22 2HB ALA 22 33.212 34.089 -7.689
140 HB3 ALA 22 3HB ALA 22 33.773 32.400 -7.730
141 H LEU 23 H LEU 23 29.917 32.589 -8.243
142 HA LEU 23 HA LEU 23 28.917 35.259 -7.705
143 HB2 LEU 23 1HB LEU 23 27.615 32.984 -9.236
144 HB3 LEU 23 2HB LEU 23 27.160 34.682 -9.289
145 HG LEU 23 HG LEU 23 29.720 33.452 -10.369
146 HD11 LEU 23 1HD1 LEU 23 28.779 34.070 -12.550
147 HD12 LEU 23 2HD1 LEU 23 27.336 34.749 -11.759
148 HD13 LEU 23 3HD1 LEU 23 27.669 33.003 -11.677
149 HD21 LEU 23 1HD2 LEU 23 28.817 36.356 -10.419
150 HD22 LEU 23 2HD2 LEU 23 30.179 35.677 -11.342
151 HD23 LEU 23 3HD2 LEU 23 30.236 35.701 -9.570
152 H LEU 24 H LEU 24 28.058 31.923 -6.749
153 HA LEU 24 HA LEU 24 25.553 32.653 -5.562
154 HB2 LEU 24 1HB LEU 24 26.185 30.318 -6.064
155 HB3 LEU 24 2HB LEU 24 27.474 30.403 -4.868
156 HG LEU 24 HG LEU 24 25.833 30.705 -3.075
157 HD11 LEU 24 1HD1 LEU 24 24.024 31.841 -4.197
158 HD12 LEU 24 2HD1 LEU 24 23.416 30.323 -3.523
159 HD13 LEU 24 3HD1 LEU 24 23.751 30.437 -5.267
160 HD21 LEU 24 1HD2 LEU 24 25.292 28.339 -4.871
161 HD22 LEU 24 2HD2 LEU 24 24.862 28.455 -3.150
162 HD23 LEU 24 3HD2 LEU 24 26.567 28.484 -3.646
163 H ARG 25 H ARG 25 28.898 32.489 -4.308
164 HA ARG 25 HA ARG 25 28.307 33.085 -1.584
165 HB2 ARG 25 1HB ARG 25 30.515 32.335 -2.383
166 HB3 ARG 25 2HB ARG 25 30.668 33.773 -3.365
167 HG2 ARG 25 1HG ARG 25 30.396 34.942 -0.934
168 HG3 ARG 25 2HG ARG 25 31.119 33.406 -0.442
169 HD2 ARG 25 1HD ARG 25 32.851 35.084 -0.856
170 HD3 ARG 25 2HD ARG 25 32.957 33.782 -2.059
171 HE ARG 25 HE ARG 25 31.355 35.597 -3.300
172 HH11 ARG 25 1HH1 ARG 25 34.531 35.939 -1.823
173 HH12 ARG 25 2HH1 ARG 25 34.984 37.241 -2.893
174 HH21 ARG 25 1HH2 ARG 25 31.964 37.324 -4.585
175 HH22 ARG 25 2HH2 ARG 25 33.570 37.979 -4.436
176 H ASP 26 H ASP 26 28.861 35.125 -4.449
177 HA ASP 26 HA ASP 26 28.795 37.625 -3.084
178 HB2 ASP 26 1HB ASP 26 29.321 36.710 -5.605
179 HB3 ASP 26 2HB ASP 26 27.782 37.518 -5.857
180 H MET 27 H MET 27 26.241 35.781 -4.801
181 HA MET 27 HA MET 27 24.103 37.624 -4.421
182 HB2 MET 27 1HB MET 27 24.147 35.568 -5.883
183 HB3 MET 27 2HB MET 27 23.971 34.583 -4.433
184 HG2 MET 27 1HG MET 27 21.978 36.704 -5.227
185 HG3 MET 27 2HG MET 27 21.888 35.045 -5.809
186 HE1 MET 27 1HE MET 27 20.900 32.976 -2.628
187 HE2 MET 27 2HE MET 27 21.164 32.950 -4.386
188 HE3 MET 27 3HE MET 27 22.540 33.158 -3.278
189 H LEU 28 H LEU 28 25.168 34.845 -2.463
190 HA LEU 28 HA LEU 28 23.183 35.026 -0.462
191 HB2 LEU 28 1HB LEU 28 26.004 34.016 -0.466
192 HB3 LEU 28 2HB LEU 28 24.982 33.944 0.970
193 HG LEU 28 HG LEU 28 24.132 32.708 -1.651
194 HD11 LEU 28 1HD1 LEU 28 24.985 30.610 -0.697
195 HD12 LEU 28 2HD1 LEU 28 25.712 31.545 0.635
196 HD13 LEU 28 3HD1 LEU 28 26.259 31.799 -1.033
197 HD21 LEU 28 1HD2 LEU 28 23.349 32.187 1.239
198 HD22 LEU 28 2HD2 LEU 28 22.685 31.373 -0.199
199 HD23 LEU 28 3HD2 LEU 28 22.406 33.095 0.052
200 H LEU 29 H LEU 29 26.409 36.557 -0.652
201 HA LEU 29 HA LEU 29 26.280 37.753 1.960
202 HB2 LEU 29 1HB LEU 29 27.770 38.479 -0.565
203 HB3 LEU 29 2HB LEU 29 27.935 39.421 0.913
204 HG LEU 29 HG LEU 29 28.523 36.456 0.813
205 HD11 LEU 29 1HD1 LEU 29 29.961 37.570 -0.821
206 HD12 LEU 29 2HD1 LEU 29 30.901 37.071 0.602
207 HD13 LEU 29 3HD1 LEU 29 30.440 38.777 0.400
208 HD21 LEU 29 1HD2 LEU 29 29.374 38.637 2.744
209 HD22 LEU 29 2HD2 LEU 29 29.862 36.926 2.825
210 HD23 LEU 29 3HD2 LEU 29 28.164 37.375 3.061
211 H ALA 30 H ALA 30 25.079 38.760 -1.200
212 HA ALA 30 HA ALA 30 24.251 41.386 -0.214
213 HB1 ALA 30 1HB ALA 30 23.642 39.939 -2.830
214 HB2 ALA 30 2HB ALA 30 23.345 41.661 -2.491
215 HB3 ALA 30 3HB ALA 30 25.012 41.034 -2.547
216 H ASN 31 H ASN 31 22.933 38.252 0.124
217 HA ASN 31 HA ASN 31 20.155 39.377 0.193
218 HB2 ASN 31 1HB ASN 31 20.730 37.638 -1.569
219 HB3 ASN 31 2HB ASN 31 20.904 36.490 -0.255
220 HD21 ASN 31 1HD2 ASN 31 17.400 36.754 -1.796
221 HD22 ASN 31 2HD2 ASN 31 18.979 36.849 -2.544
222 HA PRO 32 HA PRO 32 21.049 38.323 4.475
223 HB2 PRO 32 1HB PRO 32 18.964 39.678 5.643
224 HB3 PRO 32 2HB PRO 32 20.480 40.465 5.100
225 HG2 PRO 32 1HG PRO 32 17.865 40.216 3.623
226 HG3 PRO 32 2HG PRO 32 18.843 41.686 3.935
227 HD2 PRO 32 1HD PRO 32 19.038 40.424 1.606
228 HD3 PRO 32 2HD PRO 32 20.516 41.043 2.422
229 H HIS 33 H HIS 33 17.989 37.779 2.749
230 HA HIS 33 HA HIS 33 16.904 36.061 4.854
231 HB2 HIS 33 1HB HIS 33 15.438 37.240 3.256
232 HB3 HIS 33 2HB HIS 33 16.174 36.347 1.919
233 HD1 HIS 33 HD1 HIS 33 13.876 35.799 4.900
234 HD2 HIS 33 HD2 HIS 33 15.244 33.791 1.513
235 HE1 HIS 33 HE1 HIS 33 12.501 33.686 4.690
236 H GLU 34 H GLU 34 18.629 35.645 1.780
237 HA GLU 34 HA GLU 34 18.333 32.770 1.728
238 HB2 GLU 34 1HB GLU 34 19.635 34.897 0.184
239 HB3 GLU 34 2HB GLU 34 20.460 33.381 0.085
240 HG2 GLU 34 1HG GLU 34 17.517 33.739 -0.497
241 HG3 GLU 34 2HG GLU 34 18.786 33.824 -1.728
242 H LEU 35 H LEU 35 20.852 35.052 2.796
243 HA LEU 35 HA LEU 35 22.747 33.013 3.471
244 HB2 LEU 35 1HB LEU 35 24.060 34.667 4.183
245 HB3 LEU 35 2HB LEU 35 22.998 35.482 3.092
246 HG LEU 35 HG LEU 35 21.786 36.470 5.008
247 HD11 LEU 35 1HD1 LEU 35 23.102 36.643 7.144
248 HD12 LEU 35 2HD1 LEU 35 24.047 35.238 6.597
249 HD13 LEU 35 3HD1 LEU 35 22.298 35.092 6.886
250 HD21 LEU 35 1HD2 LEU 35 24.762 36.890 4.665
251 HD22 LEU 35 2HD2 LEU 35 23.635 38.095 5.346
252 HD23 LEU 35 3HD2 LEU 35 23.468 37.566 3.654
253 H SER 36 H SER 36 19.946 34.332 5.104
254 HA SER 36 HA SER 36 20.559 33.274 7.707
255 HB2 SER 36 1HB SER 36 19.012 35.188 7.312
256 HB3 SER 36 2HB SER 36 17.862 34.058 6.567
257 HG SER 36 HG SER 36 17.301 34.231 8.697
258 H LEU 37 H LEU 37 18.433 32.158 4.981
259 HA LEU 37 HA LEU 37 17.575 29.819 6.411
260 HB2 LEU 37 1HB LEU 37 16.707 29.032 4.450
261 HB3 LEU 37 2HB LEU 37 16.580 30.740 4.435
262 HG LEU 37 HG LEU 37 18.322 30.871 2.701
263 HD11 LEU 37 1HD1 LEU 37 18.393 28.693 1.285
264 HD12 LEU 37 2HD1 LEU 37 17.992 27.872 2.823
265 HD13 LEU 37 3HD1 LEU 37 19.473 28.830 2.673
266 HD21 LEU 37 1HD2 LEU 37 15.945 31.146 2.282
267 HD22 LEU 37 2HD2 LEU 37 15.720 29.387 2.213
268 HD23 LEU 37 3HD2 LEU 37 16.668 30.217 0.959
269 H LEU 38 H LEU 38 20.379 30.621 4.576
270 HA LEU 38 HA LEU 38 21.345 27.978 4.258
271 HB2 LEU 38 1HB LEU 38 21.971 30.002 3.039
272 HB3 LEU 38 2HB LEU 38 22.833 30.589 4.471
273 HG LEU 38 HG LEU 38 24.287 28.566 4.428
274 HD11 LEU 38 1HD1 LEU 38 22.933 28.123 1.749
275 HD12 LEU 38 2HD1 LEU 38 22.877 27.057 3.174
276 HD13 LEU 38 3HD1 LEU 38 24.401 27.297 2.311
277 HD21 LEU 38 1HD2 LEU 38 25.714 29.338 2.625
278 HD22 LEU 38 2HD2 LEU 38 25.010 30.713 3.499
279 HD23 LEU 38 3HD2 LEU 38 24.353 30.238 1.915
280 H LYS 39 H LYS 39 21.973 30.420 6.834
281 HA LYS 39 HA LYS 39 23.711 28.551 8.245
282 HB2 LYS 39 1HB LYS 39 23.427 30.064 10.212
283 HB3 LYS 39 2HB LYS 39 24.104 30.815 8.768
284 HG2 LYS 39 1HG LYS 39 22.135 32.020 8.331
285 HG3 LYS 39 2HG LYS 39 21.158 31.029 9.392
286 HD2 LYS 39 1HD LYS 39 21.456 33.063 10.520
287 HD3 LYS 39 2HD LYS 39 22.548 31.919 11.321
288 HE2 LYS 39 1HE LYS 39 24.445 32.813 10.000
289 HE3 LYS 39 2HE LYS 39 23.336 33.931 9.170
290 HZ1 LYS 39 1HZ LYS 39 22.849 34.944 11.303
291 HZ2 LYS 39 2HZ LYS 39 24.474 34.991 11.032
292 HZ3 LYS 39 3HZ LYS 39 23.845 33.895 12.092
293 H GLU 40 H GLU 40 20.243 29.066 8.184
294 HA GLU 40 HA GLU 40 19.747 27.490 10.574
295 HB2 GLU 40 1HB GLU 40 18.036 28.256 8.181
296 HB3 GLU 40 2HB GLU 40 17.422 27.302 9.538
297 HG2 GLU 40 1HG GLU 40 18.560 30.109 9.738
298 HG3 GLU 40 2HG GLU 40 16.838 29.701 9.714
299 H ARG 41 H ARG 41 19.484 26.759 7.036
300 HA ARG 41 HA ARG 41 19.042 23.927 7.764
301 HB2 ARG 41 1HB ARG 41 19.123 25.273 5.044
302 HB3 ARG 41 2HB ARG 41 18.608 23.616 5.385
303 HG2 ARG 41 1HG ARG 41 16.994 24.805 7.102
304 HG3 ARG 41 2HG ARG 41 17.237 26.204 6.045
305 HD2 ARG 41 1HD ARG 41 16.330 23.463 5.084
306 HD3 ARG 41 2HD ARG 41 15.212 24.752 5.531
307 HE ARG 41 HE ARG 41 16.865 24.586 3.107
308 HH11 ARG 41 1HH1 ARG 41 14.734 26.633 5.051
309 HH12 ARG 41 2HH1 ARG 41 14.365 27.678 3.701
310 HH21 ARG 41 1HH2 ARG 41 16.344 25.964 1.444
311 HH22 ARG 41 2HH2 ARG 41 15.261 27.305 1.705
312 H ASN 42 H ASN 42 21.760 25.752 6.536
313 HA ASN 42 HA ASN 42 23.289 23.182 6.447
314 HB2 ASN 42 1HB ASN 42 22.609 24.073 4.131
315 HB3 ASN 42 2HB ASN 42 23.752 25.368 4.403
316 HD21 ASN 42 1HD2 ASN 42 25.484 22.694 2.573
317 HD22 ASN 42 2HD2 ASN 42 24.231 23.876 2.300
318 HA PRO 43 HA PRO 43 25.318 26.623 8.805
319 HB2 PRO 43 1HB PRO 43 26.364 25.020 10.847
320 HB3 PRO 43 2HB PRO 43 24.836 25.950 10.900
321 HG2 PRO 43 1HG PRO 43 25.249 23.056 10.245
322 HG3 PRO 43 2HG PRO 43 24.025 23.822 11.300
323 HD2 PRO 43 1HD PRO 43 23.417 23.053 8.807
324 HD3 PRO 43 2HD PRO 43 22.766 24.588 9.477
325 HA PRO 44 HA PRO 44 29.463 24.593 8.228
326 HB2 PRO 44 1HB PRO 44 29.849 22.571 6.430
327 HB3 PRO 44 2HB PRO 44 29.539 22.276 8.170
328 HG2 PRO 44 1HG PRO 44 27.610 22.269 5.888
329 HG3 PRO 44 2HG PRO 44 27.887 21.020 7.145
330 HD2 PRO 44 1HD PRO 44 25.884 22.791 7.389
331 HD3 PRO 44 2HD PRO 44 26.854 22.312 8.824
332 H LEU 45 H LEU 45 27.164 24.607 5.417
333 HA LEU 45 HA LEU 45 29.226 25.756 3.675
334 HB2 LEU 45 1HB LEU 45 27.287 24.508 2.778
335 HB3 LEU 45 2HB LEU 45 26.211 25.767 3.385
336 HG LEU 45 HG LEU 45 27.126 27.385 1.825
337 HD11 LEU 45 1HD1 LEU 45 28.771 26.730 0.073
338 HD12 LEU 45 2HD1 LEU 45 29.032 25.188 0.919
339 HD13 LEU 45 3HD1 LEU 45 29.473 26.724 1.694
340 HD21 LEU 45 1HD2 LEU 45 26.330 26.405 -0.241
341 HD22 LEU 45 2HD2 LEU 45 25.338 25.784 1.087
342 HD23 LEU 45 3HD2 LEU 45 26.602 24.757 0.373
343 H ALA 46 H ALA 46 26.669 26.863 5.855
344 HA ALA 46 HA ALA 46 26.779 29.603 5.129
345 HB1 ALA 46 1HB ALA 46 25.073 28.496 6.558
346 HB2 ALA 46 2HB ALA 46 26.257 28.489 7.886
347 HB3 ALA 46 3HB ALA 46 25.697 30.035 7.204
348 H GLU 47 H GLU 47 28.671 27.892 7.734
349 HA GLU 47 HA GLU 47 29.951 30.268 8.639
350 HB2 GLU 47 1HB GLU 47 31.607 28.880 9.690
351 HB3 GLU 47 2HB GLU 47 30.011 28.159 9.902
352 HG2 GLU 47 1HG GLU 47 30.469 26.463 8.280
353 HG3 GLU 47 2HG GLU 47 31.951 27.268 7.759
354 H ALA 48 H ALA 48 30.677 28.186 5.908
355 HA ALA 48 HA ALA 48 33.221 29.219 5.280
356 HB1 ALA 48 1HB ALA 48 31.154 28.173 3.329
357 HB2 ALA 48 2HB ALA 48 32.917 28.073 3.216
358 HB3 ALA 48 3HB ALA 48 32.063 27.103 4.420
359 H LEU 49 H LEU 49 29.931 30.247 4.445
360 HA LEU 49 HA LEU 49 30.725 32.362 2.649
361 HB2 LEU 49 1HB LEU 49 28.421 31.369 2.798
362 HB3 LEU 49 2HB LEU 49 28.251 32.074 4.393
363 HG LEU 49 HG LEU 49 28.632 34.355 3.270
364 HD11 LEU 49 1HD1 LEU 49 27.912 34.394 0.889
365 HD12 LEU 49 2HD1 LEU 49 27.992 32.621 0.860
366 HD13 LEU 49 3HD1 LEU 49 29.462 33.580 1.137
367 HD21 LEU 49 1HD2 LEU 49 26.134 32.758 2.646
368 HD22 LEU 49 2HD2 LEU 49 26.274 34.530 2.733
369 HD23 LEU 49 3HD2 LEU 49 26.502 33.554 4.197
370 H LEU 50 H LEU 50 30.031 32.159 6.150
371 HA LEU 50 HA LEU 50 30.046 34.972 6.642
372 HB2 LEU 50 1HB LEU 50 30.952 32.830 8.592
373 HB3 LEU 50 2HB LEU 50 30.336 34.424 8.976
374 HG LEU 50 HG LEU 50 28.842 31.987 8.117
375 HD11 LEU 50 1HD1 LEU 50 27.587 32.370 10.131
376 HD12 LEU 50 2HD1 LEU 50 28.525 33.853 10.446
377 HD13 LEU 50 3HD1 LEU 50 29.325 32.260 10.455
378 HD21 LEU 50 1HD2 LEU 50 27.836 33.630 6.719
379 HD22 LEU 50 2HD2 LEU 50 27.745 34.790 8.069
380 HD23 LEU 50 3HD2 LEU 50 26.750 33.312 8.079
381 H SER 51 H SER 51 32.639 32.655 6.293
382 HA SER 51 HA SER 51 34.669 34.261 7.552
383 HB2 SER 51 1HB SER 51 34.854 31.997 5.557
384 HB3 SER 51 2HB SER 51 36.163 32.606 6.575
385 HG SER 51 HG SER 51 33.723 31.462 7.519
386 H GLY 52 H GLY 52 33.153 34.272 4.404
387 HA2 GLY 52 1HA GLY 52 33.488 35.853 2.716
388 HA3 GLY 52 2HA GLY 52 34.960 36.413 3.528
389 H ASP 53 H ASP 53 36.019 33.695 3.773
390 HA ASP 53 HA ASP 53 37.683 33.469 1.559
391 HB2 ASP 53 1HB ASP 53 36.716 31.556 3.627
392 HB3 ASP 53 2HB ASP 53 37.956 31.128 2.457
393 H LEU 54 H LEU 54 36.808 33.409 -0.477
394 HA LEU 54 HA LEU 54 34.537 31.850 -1.244
395 HB2 LEU 54 1HB LEU 54 35.519 33.630 -2.631
396 HB3 LEU 54 2HB LEU 54 36.964 32.667 -2.883
397 HG LEU 54 HG LEU 54 35.164 32.838 -4.723
398 HD11 LEU 54 1HD1 LEU 54 35.776 30.724 -5.680
399 HD12 LEU 54 2HD1 LEU 54 36.246 30.091 -4.092
400 HD13 LEU 54 3HD1 LEU 54 37.177 31.411 -4.834
401 HD21 LEU 54 1HD2 LEU 54 33.476 31.092 -4.810
402 HD22 LEU 54 2HD2 LEU 54 33.183 32.183 -3.449
403 HD23 LEU 54 3HD2 LEU 54 33.879 30.577 -3.176
404 H GLU 55 H GLU 55 38.016 31.121 -0.874
405 HA GLU 55 HA GLU 55 37.995 28.637 -2.210
406 HB2 GLU 55 1HB GLU 55 39.982 28.086 -0.828
407 HB3 GLU 55 2HB GLU 55 40.071 29.627 -1.682
408 HG2 GLU 55 1HG GLU 55 39.543 30.822 0.416
409 HG3 GLU 55 2HG GLU 55 39.481 29.269 1.269
410 H LYS 56 H LYS 56 37.258 29.283 1.293
411 HA LYS 56 HA LYS 56 36.757 26.440 1.646
412 HB2 LYS 56 1HB LYS 56 36.095 26.896 3.877
413 HB3 LYS 56 2HB LYS 56 37.552 27.857 3.493
414 HG2 LYS 56 1HG LYS 56 35.997 29.746 3.150
415 HG3 LYS 56 2HG LYS 56 34.766 28.767 3.906
416 HD2 LYS 56 1HD LYS 56 37.470 29.152 5.229
417 HD3 LYS 56 2HD LYS 56 36.205 30.359 5.389
418 HE2 LYS 56 1HE LYS 56 34.669 28.597 6.297
419 HE3 LYS 56 2HE LYS 56 36.032 27.470 6.287
420 HZ1 LYS 56 1HZ LYS 56 37.180 29.028 7.784
421 HZ2 LYS 56 2HZ LYS 56 35.766 28.487 8.443
422 HZ3 LYS 56 3HZ LYS 56 35.856 30.010 7.810
423 H PHE 57 H PHE 57 34.818 29.297 0.857
424 HA PHE 57 HA PHE 57 32.277 28.052 1.231
425 HB2 PHE 57 1HB PHE 57 32.553 30.460 0.808
426 HB3 PHE 57 2HB PHE 57 33.088 30.112 -0.840
427 HD1 PHE 57 HD1 PHE 57 30.186 29.952 1.488
428 HD2 PHE 57 HD2 PHE 57 31.524 29.594 -2.591
429 HE1 PHE 57 HE1 PHE 57 27.827 29.950 0.711
430 HE2 PHE 57 HE2 PHE 57 29.164 29.579 -3.364
431 HZ PHE 57 HZ PHE 57 27.318 29.770 -1.726
432 H SER 58 H SER 58 34.307 28.251 -1.727
433 HA SER 58 HA SER 58 32.656 26.543 -3.296
434 HB2 SER 58 1HB SER 58 34.451 28.043 -4.171
435 HB3 SER 58 2HB SER 58 35.669 26.986 -3.430
436 HG SER 58 HG SER 58 35.433 26.364 -5.554
437 H ARG 59 H ARG 59 35.389 25.832 -1.104
438 HA ARG 59 HA ARG 59 35.627 23.075 -1.775
439 HB2 ARG 59 1HB ARG 59 37.250 24.373 -0.405
440 HB3 ARG 59 2HB ARG 59 36.066 24.456 0.893
441 HG2 ARG 59 1HG ARG 59 36.309 21.711 0.324
442 HG3 ARG 59 2HG ARG 59 37.958 22.360 0.227
443 HD2 ARG 59 1HD ARG 59 37.518 23.515 2.446
444 HD3 ARG 59 2HD ARG 59 36.008 22.592 2.542
445 HE ARG 59 HE ARG 59 37.227 20.597 2.847
446 HH11 ARG 59 1HH1 ARG 59 39.463 23.314 2.440
447 HH12 ARG 59 2HH1 ARG 59 40.816 22.404 3.050
448 HH21 ARG 59 1HH2 ARG 59 39.003 19.509 3.601
449 HH22 ARG 59 2HH2 ARG 59 40.557 20.294 3.693
450 H VAL 60 H VAL 60 33.635 24.680 0.797
451 HA VAL 60 HA VAL 60 32.545 22.132 1.614
452 HB VAL 60 HB VAL 60 31.423 24.931 2.080
453 HG11 VAL 60 1HG1 VAL 60 30.769 22.209 3.294
454 HG12 VAL 60 2HG1 VAL 60 30.278 23.754 4.021
455 HG13 VAL 60 3HG1 VAL 60 29.671 23.299 2.415
456 HG21 VAL 60 1HG2 VAL 60 33.156 23.140 3.855
457 HG22 VAL 60 2HG2 VAL 60 33.690 24.631 3.056
458 HG23 VAL 60 3HG2 VAL 60 32.459 24.709 4.325
459 H LEU 61 H LEU 61 31.624 24.592 -0.791
460 HA LEU 61 HA LEU 61 29.027 23.643 -1.339
461 HB2 LEU 61 1HB LEU 61 30.304 25.700 -2.268
462 HB3 LEU 61 2HB LEU 61 30.937 24.599 -3.481
463 HG LEU 61 HG LEU 61 28.272 24.079 -3.709
464 HD11 LEU 61 1HD1 LEU 61 28.548 27.010 -2.958
465 HD12 LEU 61 2HD1 LEU 61 27.767 25.757 -1.961
466 HD13 LEU 61 3HD1 LEU 61 27.068 26.195 -3.530
467 HD21 LEU 61 1HD2 LEU 61 30.103 25.066 -5.411
468 HD22 LEU 61 2HD2 LEU 61 29.181 26.562 -5.112
469 HD23 LEU 61 3HD2 LEU 61 28.361 25.135 -5.743
470 H VAL 62 H VAL 62 32.181 22.548 -2.752
471 HA VAL 62 HA VAL 62 30.793 20.584 -4.377
472 HB VAL 62 HB VAL 62 32.964 21.577 -5.059
473 HG11 VAL 62 1HG1 VAL 62 34.184 21.606 -2.975
474 HG12 VAL 62 2HG1 VAL 62 34.178 19.831 -2.888
475 HG13 VAL 62 3HG1 VAL 62 35.080 20.668 -4.172
476 HG21 VAL 62 1HG2 VAL 62 33.032 18.552 -4.810
477 HG22 VAL 62 2HG2 VAL 62 32.113 19.459 -6.033
478 HG23 VAL 62 3HG2 VAL 62 33.889 19.538 -6.017
479 H GLU 63 H GLU 63 32.378 20.473 -1.186
480 HA GLU 63 HA GLU 63 32.251 17.624 -0.865
481 HB2 GLU 63 1HB GLU 63 32.023 19.870 1.172
482 HB3 GLU 63 2HB GLU 63 32.092 18.161 1.605
483 HG2 GLU 63 1HG GLU 63 34.261 19.689 0.141
484 HG3 GLU 63 2HG GLU 63 34.277 19.253 1.848
485 H GLN 64 H GLN 64 29.848 20.198 -0.226
486 HA GLN 64 HA GLN 64 27.831 18.442 0.839
487 HB2 GLN 64 1HB GLN 64 27.694 21.127 -0.580
488 HB3 GLN 64 2HB GLN 64 26.263 20.312 0.058
489 HG2 GLN 64 1HG GLN 64 28.658 21.073 1.758
490 HG3 GLN 64 2HG GLN 64 27.235 22.094 1.549
491 HE21 GLN 64 1HE2 GLN 64 27.193 19.514 4.480
492 HE22 GLN 64 2HE2 GLN 64 28.605 20.216 3.726
493 H GLN 65 H GLN 65 28.625 19.503 -2.505
494 HA GLN 65 HA GLN 65 26.328 18.210 -3.675
495 HB2 GLN 65 1HB GLN 65 28.996 19.045 -4.832
496 HB3 GLN 65 2HB GLN 65 27.720 18.291 -5.794
497 HG2 GLN 65 1HG GLN 65 26.174 20.111 -5.200
498 HG3 GLN 65 2HG GLN 65 27.443 20.889 -4.264
499 HE21 GLN 65 1HE2 GLN 65 28.781 22.557 -7.008
500 HE22 GLN 65 2HE2 GLN 65 28.671 22.363 -5.268
501 H GLN 66 H GLN 66 29.639 17.037 -2.928
502 HA GLN 66 HA GLN 66 29.333 14.523 -4.278
503 HB2 GLN 66 1HB GLN 66 30.989 15.335 -1.864
504 HB3 GLN 66 2HB GLN 66 31.086 13.742 -2.623
505 HG2 GLN 66 1HG GLN 66 31.833 14.735 -4.713
506 HG3 GLN 66 2HG GLN 66 31.641 16.353 -4.050
507 HE21 GLN 66 1HE2 GLN 66 34.665 16.380 -2.279
508 HE22 GLN 66 2HE2 GLN 66 33.152 17.180 -2.642
509 H ASP 67 H ASP 67 28.557 15.529 -0.889
510 HA ASP 67 HA ASP 67 27.674 12.890 -0.132
511 HB2 ASP 67 1HB ASP 67 28.180 14.752 1.472
512 HB3 ASP 67 2HB ASP 67 26.686 15.536 0.963
513 H ARG 68 H ARG 68 26.006 15.725 -1.514
514 HA ARG 68 HA ARG 68 23.366 14.610 -1.370
515 HB2 ARG 68 1HB ARG 68 24.638 16.632 -3.230
516 HB3 ARG 68 2HB ARG 68 22.943 16.155 -3.385
517 HG2 ARG 68 1HG ARG 68 22.388 17.022 -1.228
518 HG3 ARG 68 2HG ARG 68 24.090 17.187 -0.778
519 HD2 ARG 68 1HD ARG 68 23.234 19.373 -1.276
520 HD3 ARG 68 2HD ARG 68 24.370 18.911 -2.557
521 HE ARG 68 HE ARG 68 21.810 18.144 -3.424
522 HH11 ARG 68 1HH1 ARG 68 23.456 21.174 -2.678
523 HH12 ARG 68 2HH1 ARG 68 22.467 22.093 -3.780
524 HH21 ARG 68 1HH2 ARG 68 20.584 19.382 -4.818
525 HH22 ARG 68 2HH2 ARG 68 20.866 21.096 -4.958
526 H ALA 69 H ALA 69 25.919 14.308 -3.868
527 HA ALA 69 HA ALA 69 24.310 12.741 -5.652
528 HB1 ALA 69 1HB ALA 69 27.342 12.812 -5.298
529 HB2 ALA 69 2HB ALA 69 26.464 12.155 -6.700
530 HB3 ALA 69 3HB ALA 69 26.381 13.893 -6.338
531 H ARG 70 H ARG 70 26.256 11.886 -2.772
532 HA ARG 70 HA ARG 70 26.190 9.063 -3.347
533 HB2 ARG 70 1HB ARG 70 27.654 8.966 -1.672
534 HB3 ARG 70 2HB ARG 70 27.633 10.713 -1.748
535 HG2 ARG 70 1HG ARG 70 27.461 10.323 0.500
536 HG3 ARG 70 2HG ARG 70 25.760 10.545 0.060
537 HD2 ARG 70 1HD ARG 70 25.280 8.325 0.245
538 HD3 ARG 70 2HD ARG 70 26.950 7.838 -0.087
539 HE ARG 70 HE ARG 70 26.810 9.317 2.367
540 HH11 ARG 70 1HH1 ARG 70 26.088 6.112 1.061
541 HH12 ARG 70 2HH1 ARG 70 26.306 5.326 2.603
542 HH21 ARG 70 1HH2 ARG 70 27.074 8.249 4.303
543 HH22 ARG 70 2HH2 ARG 70 26.859 6.521 4.409
544 H ARG 71 H ARG 71 24.062 11.335 -1.708
545 HA ARG 71 HA ARG 71 22.274 9.247 -0.666
546 HB2 ARG 71 1HB ARG 71 21.737 12.182 -1.276
547 HB3 ARG 71 2HB ARG 71 20.659 11.108 -0.381
548 HG2 ARG 71 1HG ARG 71 22.298 10.916 1.427
549 HG3 ARG 71 2HG ARG 71 23.449 11.901 0.510
550 HD2 ARG 71 1HD ARG 71 21.618 13.678 0.411
551 HD3 ARG 71 2HD ARG 71 20.793 12.734 1.668
552 HE ARG 71 HE ARG 71 23.612 13.495 2.195
553 HH11 ARG 71 1HH1 ARG 71 20.205 14.272 2.808
554 HH12 ARG 71 2HH1 ARG 71 20.600 15.292 4.161
555 HH21 ARG 71 1HH2 ARG 71 24.027 14.806 3.870
556 HH22 ARG 71 2HH2 ARG 71 22.731 15.581 4.769
557 H GLU 72 H GLU 72 22.572 11.205 -3.599
558 HA GLU 72 HA GLU 72 20.075 10.599 -4.778
559 HB2 GLU 72 1HB GLU 72 21.763 12.340 -5.441
560 HB3 GLU 72 2HB GLU 72 22.676 11.055 -6.241
561 HG2 GLU 72 1HG GLU 72 20.785 10.602 -7.718
562 HG3 GLU 72 2HG GLU 72 19.818 11.832 -6.877
563 H GLN 73 H GLN 73 23.062 8.704 -4.657
564 HA GLN 73 HA GLN 73 22.447 6.798 -6.668
565 HB2 GLN 73 1HB GLN 73 23.934 6.565 -4.041
566 HB3 GLN 73 2HB GLN 73 23.861 5.253 -5.227
567 HG2 GLN 73 1HG GLN 73 25.079 6.475 -6.837
568 HG3 GLN 73 2HG GLN 73 24.808 8.009 -6.022
569 HE21 GLN 73 1HE2 GLN 73 28.100 7.707 -4.907
570 HE22 GLN 73 2HE2 GLN 73 26.977 8.525 -5.967
571 H GLU 74 H GLU 74 21.325 7.012 -3.273
572 HA GLU 74 HA GLU 74 19.874 4.487 -3.425
573 HB2 GLU 74 1HB GLU 74 19.664 6.808 -1.480
574 HB3 GLU 74 2HB GLU 74 18.834 5.260 -1.312
575 HG2 GLU 74 1HG GLU 74 21.852 5.661 -1.338
576 HG3 GLU 74 2HG GLU 74 20.856 5.354 0.091
577 H ARG 75 H ARG 75 19.203 7.869 -4.218
578 HA ARG 75 HA ARG 75 16.321 7.566 -4.253
579 HB2 ARG 75 1HB ARG 75 18.116 9.560 -5.690
580 HB3 ARG 75 2HB ARG 75 16.361 9.630 -5.641
581 HG2 ARG 75 1HG ARG 75 17.005 9.411 -2.965
582 HG3 ARG 75 2HG ARG 75 18.348 10.365 -3.584
583 HD2 ARG 75 1HD ARG 75 16.452 11.774 -2.764
584 HD3 ARG 75 2HD ARG 75 16.825 12.058 -4.470
585 HE ARG 75 HE ARG 75 14.691 11.409 -4.999
586 HH11 ARG 75 1HH1 ARG 75 15.433 9.915 -1.892
587 HH12 ARG 75 2HH1 ARG 75 13.844 9.210 -1.749
588 HH21 ARG 75 1HH2 ARG 75 12.670 10.489 -4.719
589 HH22 ARG 75 2HH2 ARG 75 12.345 9.505 -3.307
590 H ILE 76 H ILE 76 18.840 7.340 -6.800
591 HA ILE 76 HA ILE 76 16.881 6.802 -8.867
592 HB ILE 76 HB ILE 76 18.775 6.253 -10.313
593 HG12 ILE 76 1HG1 ILE 76 20.530 6.546 -7.851
594 HG13 ILE 76 2HG1 ILE 76 20.097 5.003 -8.579
595 HG21 ILE 76 1HG2 ILE 76 19.478 8.668 -8.562
596 HG22 ILE 76 2HG2 ILE 76 19.863 8.438 -10.282
597 HG23 ILE 76 3HG2 ILE 76 18.179 8.656 -9.779
598 HD11 ILE 76 1HD1 ILE 76 22.325 5.593 -9.314
599 HD12 ILE 76 2HD1 ILE 76 21.225 5.745 -10.701
600 HD13 ILE 76 3HD1 ILE 76 21.780 7.201 -9.841
601 H ARG 77 H ARG 77 18.193 4.911 -6.361
602 HA ARG 77 HA ARG 77 18.184 2.315 -7.558
603 HB2 ARG 77 1HB ARG 77 19.160 3.172 -5.323
604 HB3 ARG 77 2HB ARG 77 17.534 2.967 -4.672
605 HG2 ARG 77 1HG ARG 77 17.616 0.583 -5.118
606 HG3 ARG 77 2HG ARG 77 19.207 0.768 -5.900
607 HD2 ARG 77 1HD ARG 77 20.083 1.723 -3.766
608 HD3 ARG 77 2HD ARG 77 18.514 1.398 -3.004
609 HE ARG 77 HE ARG 77 19.375 -1.020 -4.127
610 HH11 ARG 77 1HH1 ARG 77 20.525 1.195 -1.604
611 HH12 ARG 77 2HH1 ARG 77 21.329 -0.093 -0.740
612 HH21 ARG 77 1HH2 ARG 77 20.403 -2.591 -2.944
613 HH22 ARG 77 2HH2 ARG 77 21.254 -2.189 -1.477
614 H LEU 78 H LEU 78 15.635 4.427 -6.751
615 HA LEU 78 HA LEU 78 13.402 4.352 -6.810
616 HB2 LEU 78 1HB LEU 78 13.681 3.319 -8.926
617 HB3 LEU 78 2HB LEU 78 13.932 1.743 -8.210
618 HG LEU 78 HG LEU 78 11.578 1.688 -7.438
619 HD11 LEU 78 1HD1 LEU 78 9.972 3.281 -8.432
620 HD12 LEU 78 2HD1 LEU 78 11.327 4.240 -9.071
621 HD13 LEU 78 3HD1 LEU 78 11.091 4.080 -7.312
622 HD21 LEU 78 1HD2 LEU 78 11.988 2.148 -10.418
623 HD22 LEU 78 2HD2 LEU 78 10.632 1.270 -9.670
624 HD23 LEU 78 3HD2 LEU 78 12.282 0.630 -9.535
625 H PHE 79 H PHE 79 14.449 1.060 -5.805
626 HA PHE 79 HA PHE 79 12.099 0.824 -4.083
627 HB2 PHE 79 1HB PHE 79 14.634 -0.838 -4.290
628 HB3 PHE 79 2HB PHE 79 13.206 -1.271 -3.342
629 HD1 PHE 79 HD1 PHE 79 11.111 -1.965 -4.452
630 HD2 PHE 79 HD2 PHE 79 14.624 -0.999 -6.742
631 HE1 PHE 79 HE1 PHE 79 10.094 -3.041 -6.458
632 HE2 PHE 79 HE2 PHE 79 13.616 -2.063 -8.754
633 HZ PHE 79 HZ PHE 79 11.347 -3.092 -8.613
634 H SER 80 H SER 80 11.958 1.377 -2.016
635 HA SER 80 HA SER 80 12.372 2.461 -0.078
636 HB2 SER 80 1HB SER 80 15.170 1.306 -0.332
637 HB3 SER 80 2HB SER 80 14.422 1.940 1.150
638 HG SER 80 HG SER 80 13.011 0.262 1.163
639 H ALA 81 H ALA 81 12.886 3.882 -2.592
640 HA ALA 81 HA ALA 81 14.996 5.815 -1.969
641 HB1 ALA 81 1HB ALA 81 14.201 6.914 -4.061
642 HB2 ALA 81 2HB ALA 81 14.561 5.194 -4.302
643 HB3 ALA 81 3HB ALA 81 12.871 5.738 -4.159
644 H ASP 82 H ASP 82 13.466 5.843 0.204
645 HA ASP 82 HA ASP 82 11.130 7.466 0.161
646 HB2 ASP 82 1HB ASP 82 12.191 5.920 2.009
647 HB3 ASP 82 2HB ASP 82 12.964 7.421 2.539
648 HA PRO 83 HA PRO 83 13.119 11.241 -0.674
649 HB2 PRO 83 1HB PRO 83 11.184 13.087 -0.252
650 HB3 PRO 83 2HB PRO 83 11.037 11.846 -1.541
651 HG2 PRO 83 1HG PRO 83 9.946 11.819 1.257
652 HG3 PRO 83 2HG PRO 83 9.074 11.576 -0.292
653 HD2 PRO 83 1HD PRO 83 9.932 9.483 1.202
654 HD3 PRO 83 2HD PRO 83 9.979 9.419 -0.595
655 H PHE 84 H PHE 84 13.986 13.181 0.108
656 HA PHE 84 HA PHE 84 13.777 13.646 3.048
657 HB2 PHE 84 1HB PHE 84 16.285 13.663 1.330
658 HB3 PHE 84 2HB PHE 84 16.205 14.283 2.982
659 HD1 PHE 84 HD1 PHE 84 16.338 11.252 0.902
660 HD2 PHE 84 HD2 PHE 84 15.844 12.770 4.899
661 HE1 PHE 84 HE1 PHE 84 16.764 8.976 1.813
662 HE2 PHE 84 HE2 PHE 84 16.274 10.496 5.823
663 HZ PHE 84 HZ PHE 84 16.732 8.591 4.276
664 H ASP 85 H ASP 85 12.798 14.680 0.308
665 HA ASP 85 HA ASP 85 12.843 17.525 1.059
666 HB2 ASP 85 1HB ASP 85 14.750 17.220 -0.573
667 HB3 ASP 85 2HB ASP 85 13.580 16.603 -1.749
668 H LEU 86 H LEU 86 10.697 17.832 1.208
669 HA LEU 86 HA LEU 86 8.853 16.003 -0.055
670 HB2 LEU 86 1HB LEU 86 7.266 17.965 0.920
671 HB3 LEU 86 2HB LEU 86 7.839 16.570 1.806
672 HG LEU 86 HG LEU 86 9.657 17.971 2.799
673 HD11 LEU 86 1HD1 LEU 86 9.778 19.838 1.208
674 HD12 LEU 86 2HD1 LEU 86 9.314 20.439 2.808
675 HD13 LEU 86 3HD1 LEU 86 8.081 20.257 1.542
676 HD21 LEU 86 1HD2 LEU 86 7.564 17.423 3.963
677 HD22 LEU 86 2HD2 LEU 86 6.781 18.858 3.257
678 HD23 LEU 86 3HD2 LEU 86 8.133 19.045 4.402
679 H GLU 87 H GLU 87 9.925 19.326 -0.779
680 HA GLU 87 HA GLU 87 7.786 19.595 -2.797
681 HB2 GLU 87 1HB GLU 87 10.085 21.433 -2.045
682 HB3 GLU 87 2HB GLU 87 8.872 21.774 -3.291
683 HG2 GLU 87 1HG GLU 87 7.128 21.379 -1.415
684 HG3 GLU 87 2HG GLU 87 8.494 21.579 -0.309
685 H ALA 88 H ALA 88 11.303 19.182 -2.600
686 HA ALA 88 HA ALA 88 12.878 18.581 -4.121
687 HB1 ALA 88 1HB ALA 88 12.338 16.760 -5.644
688 HB2 ALA 88 2HB ALA 88 11.483 16.511 -4.100
689 HB3 ALA 88 3HB ALA 88 10.600 17.127 -5.520
690 H GLN 89 H GLN 89 11.385 21.103 -4.674
691 HA GLN 89 HA GLN 89 12.124 21.379 -7.558
692 HB2 GLN 89 1HB GLN 89 9.677 22.412 -6.079
693 HB3 GLN 89 2HB GLN 89 10.186 23.017 -7.653
694 HG2 GLN 89 1HG GLN 89 9.713 20.954 -8.728
695 HG3 GLN 89 2HG GLN 89 9.592 20.097 -7.188
696 HE21 GLN 89 1HE2 GLN 89 6.258 20.884 -6.590
697 HE22 GLN 89 2HE2 GLN 89 7.736 20.134 -6.010
698 H ALA 90 H ALA 90 12.952 23.422 -8.113
699 HA ALA 90 HA ALA 90 13.012 25.557 -6.116
700 HB1 ALA 90 1HB ALA 90 15.000 24.223 -5.449
701 HB2 ALA 90 2HB ALA 90 15.602 24.280 -7.126
702 HB3 ALA 90 3HB ALA 90 15.491 25.775 -6.167
703 H LYS 91 H LYS 91 12.757 27.452 -7.225
704 HA LYS 91 HA LYS 91 13.893 27.665 -9.940
705 HB2 LYS 91 1HB LYS 91 11.879 28.730 -10.714
706 HB3 LYS 91 2HB LYS 91 11.498 27.099 -10.190
707 HG2 LYS 91 1HG LYS 91 10.469 27.962 -8.160
708 HG3 LYS 91 2HG LYS 91 10.992 29.610 -8.558
709 HD2 LYS 91 1HD LYS 91 9.650 29.511 -10.644
710 HD3 LYS 91 2HD LYS 91 9.023 27.927 -10.139
711 HE2 LYS 91 1HE LYS 91 7.805 28.847 -8.353
712 HE3 LYS 91 2HE LYS 91 8.838 30.290 -8.269
713 HZ1 LYS 91 1HZ LYS 91 7.907 31.101 -10.296
714 HZ2 LYS 91 2HZ LYS 91 6.664 30.771 -9.252
715 HZ3 LYS 91 3HZ LYS 91 6.982 29.741 -10.506
716 H ILE 92 H ILE 92 14.272 29.895 -10.506
717 HA ILE 92 HA ILE 92 14.109 31.887 -8.315
718 HB ILE 92 HB ILE 92 16.660 31.231 -9.908
719 HG12 ILE 92 1HG1 ILE 92 16.161 31.042 -6.907
720 HG13 ILE 92 2HG1 ILE 92 16.207 29.664 -8.009
721 HG21 ILE 92 1HG2 ILE 92 17.716 33.093 -8.666
722 HG22 ILE 92 2HG2 ILE 92 16.301 33.694 -9.545
723 HG23 ILE 92 3HG2 ILE 92 16.198 33.406 -7.795
724 HD11 ILE 92 1HD1 ILE 92 18.599 30.286 -8.577
725 HD12 ILE 92 2HD1 ILE 92 18.528 31.479 -7.264
726 HD13 ILE 92 3HD1 ILE 92 18.331 29.758 -6.903
727 H GLU 93 H GLU 93 13.256 33.711 -9.276
728 HA GLU 93 HA GLU 93 13.643 34.157 -12.159
729 HB2 GLU 93 1HB GLU 93 11.280 34.543 -12.426
730 HB3 GLU 93 2HB GLU 93 11.535 32.906 -11.854
731 HG2 GLU 93 1HG GLU 93 11.041 33.926 -9.489
732 HG3 GLU 93 2HG GLU 93 10.344 35.279 -10.398
733 H GLU 94 H GLU 94 13.030 36.440 -12.710
734 HA GLU 94 HA GLU 94 13.150 38.266 -10.356
735 HB2 GLU 94 1HB GLU 94 14.702 39.701 -11.539
736 HB3 GLU 94 2HB GLU 94 15.404 38.085 -11.386
737 HG2 GLU 94 1HG GLU 94 14.825 37.585 -13.736
738 HG3 GLU 94 2HG GLU 94 14.061 39.172 -13.901
739 H ASP 95 H ASP 95 12.262 40.402 -10.818
740 HA ASP 95 HA ASP 95 10.545 40.488 -13.264
741 HB2 ASP 95 1HB ASP 95 9.106 40.294 -11.276
742 HB3 ASP 95 2HB ASP 95 9.919 41.684 -10.536
743 H ILE 96 H ILE 96 12.371 41.441 -14.318
744 HA ILE 96 HA ILE 96 13.201 44.080 -13.429
745 HB ILE 96 HB ILE 96 14.321 44.169 -15.706
746 HG12 ILE 96 1HG1 ILE 96 13.718 41.192 -15.741
747 HG13 ILE 96 2HG1 ILE 96 12.742 42.368 -16.620
748 HG21 ILE 96 1HG2 ILE 96 15.099 41.869 -13.832
749 HG22 ILE 96 2HG2 ILE 96 16.177 42.675 -14.985
750 HG23 ILE 96 3HG2 ILE 96 15.537 43.574 -13.595
751 HD11 ILE 96 1HD1 ILE 96 15.693 41.773 -17.063
752 HD12 ILE 96 2HD1 ILE 96 14.342 41.391 -18.149
753 HD13 ILE 96 3HD1 ILE 96 14.803 43.087 -17.878
754 H ARG 97 H ARG 97 10.518 43.047 -14.477
755 HA ARG 97 HA ARG 97 8.785 43.713 -15.769
756 HB2 ARG 97 1HB ARG 97 9.248 45.568 -13.962
757 HB3 ARG 97 2HB ARG 97 9.554 46.577 -15.375
758 HG2 ARG 97 1HG ARG 97 7.298 46.071 -16.241
759 HG3 ARG 97 2HG ARG 97 7.001 44.999 -14.850
760 HD2 ARG 97 1HD ARG 97 7.613 47.965 -14.675
761 HD3 ARG 97 2HD ARG 97 5.987 47.245 -14.568
762 HE ARG 97 HE ARG 97 7.515 45.899 -12.664
763 HH11 ARG 97 1HH1 ARG 97 6.596 49.271 -13.187
764 HH12 ARG 97 2HH1 ARG 97 6.675 49.654 -11.488
765 HH21 ARG 97 1HH2 ARG 97 7.601 46.451 -10.531
766 HH22 ARG 97 2HH2 ARG 97 7.244 48.076 -10.006
767 H GLN 98 H GLN 98 11.326 43.377 -17.012
768 HA GLN 98 HA GLN 98 12.276 43.350 -19.093
769 HB2 GLN 98 1HB GLN 98 9.900 42.999 -19.976
770 HB3 GLN 98 2HB GLN 98 9.797 44.741 -20.206
771 HG2 GLN 98 1HG GLN 98 11.889 44.594 -21.669
772 HG3 GLN 98 2HG GLN 98 11.759 42.834 -21.581
773 HE21 GLN 98 1HE2 GLN 98 9.583 44.956 -24.183
774 HE22 GLN 98 2HE2 GLN 98 10.906 45.602 -23.243
775 HXT GLN 98 HO GLN 98 13.700 46.343 -18.487
Start of MODEL 5
1 H1 SER 1 1H SER 1 5.796 49.661 0.246
2 H2 SER 1 2H SER 1 6.796 48.595 1.088
3 H3 SER 1 3H SER 1 6.741 48.574 -0.606
4 HA SER 1 HA SER 1 4.448 47.865 1.210
5 HB2 SER 1 1HB SER 1 3.287 47.251 -0.870
6 HB3 SER 1 2HB SER 1 3.715 48.926 -0.823
7 HG SER 1 HG SER 1 4.430 47.073 -2.607
8 H GLN 2 H GLN 2 3.704 45.623 0.958
9 HA GLN 2 HA GLN 2 5.751 43.688 0.056
10 HB2 GLN 2 1HB GLN 2 5.608 42.434 2.181
11 HB3 GLN 2 2HB GLN 2 6.313 44.037 2.412
12 HG2 GLN 2 1HG GLN 2 4.151 44.875 3.276
13 HG3 GLN 2 2HG GLN 2 3.434 43.273 3.046
14 HE21 GLN 2 1HE2 GLN 2 4.260 42.421 6.292
15 HE22 GLN 2 2HE2 GLN 2 3.084 42.465 5.002
16 H GLN 3 H GLN 3 4.827 41.701 -0.531
17 HA GLN 3 HA GLN 3 2.110 40.987 0.120
18 HB2 GLN 3 1HB GLN 3 2.475 42.690 -2.195
19 HB3 GLN 3 2HB GLN 3 1.987 41.085 -2.736
20 HG2 GLN 3 1HG GLN 3 0.495 42.898 -0.827
21 HG3 GLN 3 2HG GLN 3 0.018 42.412 -2.461
22 HE21 GLN 3 1HE2 GLN 3 -0.737 38.994 -1.326
23 HE22 GLN 3 2HE2 GLN 3 0.238 39.748 -2.566
24 H SER 4 H SER 4 4.456 40.704 -2.558
25 HA SER 4 HA SER 4 5.377 38.945 -3.659
26 HB2 SER 4 1HB SER 4 6.000 38.235 -1.277
27 HB3 SER 4 2HB SER 4 4.641 37.096 -1.383
28 HG SER 4 HG SER 4 6.625 36.155 -2.059
29 H HIS 5 H HIS 5 4.818 36.539 -4.417
30 HA HIS 5 HA HIS 5 1.968 35.949 -4.592
31 HB2 HIS 5 1HB HIS 5 2.557 37.901 -6.281
32 HB3 HIS 5 2HB HIS 5 3.328 36.615 -7.214
33 HD1 HIS 5 HD1 HIS 5 -0.082 37.682 -5.886
34 HD2 HIS 5 HD2 HIS 5 1.580 35.021 -8.630
35 HE1 HIS 5 HE1 HIS 5 -1.998 36.728 -7.239
36 H SER 6 H SER 6 1.718 33.781 -5.393
37 HA SER 6 HA SER 6 4.216 32.228 -5.609
38 HB2 SER 6 1HB SER 6 1.292 31.417 -5.904
39 HB3 SER 6 2HB SER 6 2.676 30.305 -5.802
40 HG SER 6 HG SER 6 3.032 30.978 -3.708
41 H SER 7 H SER 7 5.101 31.598 -7.592
42 HA SER 7 HA SER 7 3.414 31.898 -10.003
43 HB2 SER 7 1HB SER 7 4.456 34.112 -9.684
44 HB3 SER 7 2HB SER 7 6.059 33.353 -9.607
45 HG SER 7 HG SER 7 5.865 32.746 -11.744
46 HA PRO 8 HA PRO 8 6.120 28.473 -11.035
47 HB2 PRO 8 1HB PRO 8 5.414 28.061 -13.627
48 HB3 PRO 8 2HB PRO 8 4.302 27.628 -12.287
49 HG2 PRO 8 1HG PRO 8 4.362 30.134 -13.962
50 HG3 PRO 8 2HG PRO 8 2.980 29.039 -13.628
51 HD2 PRO 8 1HD PRO 8 3.368 31.309 -12.208
52 HD3 PRO 8 2HD PRO 8 2.755 29.808 -11.431
53 H GLY 9 H GLY 9 7.801 28.132 -12.904
54 HA2 GLY 9 1HA GLY 9 8.590 30.255 -14.581
55 HA3 GLY 9 2HA GLY 9 9.409 30.505 -13.036
56 H GLU 10 H GLU 10 9.512 27.538 -12.622
57 HA GLU 10 HA GLU 10 11.035 25.918 -12.821
58 HB2 GLU 10 1HB GLU 10 9.911 26.272 -15.325
59 HB3 GLU 10 2HB GLU 10 11.638 26.206 -15.671
60 HG2 GLU 10 1HG GLU 10 10.808 23.974 -15.825
61 HG3 GLU 10 2HG GLU 10 11.748 24.072 -14.329
62 H ILE 11 H ILE 11 11.983 28.731 -12.498
63 HA ILE 11 HA ILE 11 14.702 28.760 -13.359
64 HB ILE 11 HB ILE 11 13.889 30.363 -10.990
65 HG12 ILE 11 1HG1 ILE 11 12.464 30.735 -13.662
66 HG13 ILE 11 2HG1 ILE 11 11.702 30.285 -12.129
67 HG21 ILE 11 1HG2 ILE 11 14.976 32.091 -12.254
68 HG22 ILE 11 2HG2 ILE 11 15.929 30.609 -12.401
69 HG23 ILE 11 3HG2 ILE 11 14.865 31.104 -13.738
70 HD11 ILE 11 1HD1 ILE 11 11.225 32.562 -12.450
71 HD12 ILE 11 2HD1 ILE 11 12.481 32.481 -11.193
72 HD13 ILE 11 3HD1 ILE 11 12.909 32.947 -12.855
73 H THR 12 H THR 12 13.469 26.493 -11.715
74 HA THR 12 HA THR 12 14.780 26.424 -9.146
75 HB THR 12 HB THR 12 14.240 23.956 -9.339
76 HG1 THR 12 HG1 THR 12 12.986 23.419 -11.249
77 HG21 THR 12 1HG2 THR 12 11.811 24.200 -9.370
78 HG22 THR 12 2HG2 THR 12 11.936 25.764 -10.201
79 HG23 THR 12 3HG2 THR 12 12.519 25.595 -8.527
80 H SER 13 H SER 13 15.800 25.976 -12.420
81 HA SER 13 HA SER 13 18.233 24.478 -11.615
82 HB2 SER 13 1HB SER 13 17.309 25.507 -14.313
83 HB3 SER 13 2HB SER 13 18.768 24.541 -13.996
84 HG SER 13 HG SER 13 16.090 23.752 -13.438
85 H SER 14 H SER 14 19.671 25.704 -10.626
86 HA SER 14 HA SER 14 20.301 28.403 -11.758
87 HB2 SER 14 1HB SER 14 20.896 27.442 -8.951
88 HB3 SER 14 2HB SER 14 20.930 29.108 -9.568
89 HG SER 14 HG SER 14 18.634 28.882 -9.914
90 HA PRO 15 HA PRO 15 23.950 25.587 -12.227
91 HB2 PRO 15 1HB PRO 15 24.729 26.254 -14.770
92 HB3 PRO 15 2HB PRO 15 23.451 25.046 -14.428
93 HG2 PRO 15 1HG PRO 15 23.131 27.959 -15.092
94 HG3 PRO 15 2HG PRO 15 22.351 26.536 -15.861
95 HD2 PRO 15 1HD PRO 15 21.073 27.940 -13.965
96 HD3 PRO 15 2HD PRO 15 20.971 26.144 -13.992
97 H GLN 16 H GLN 16 23.477 28.994 -12.882
98 HA GLN 16 HA GLN 16 26.179 29.838 -13.036
99 HB2 GLN 16 1HB GLN 16 23.824 31.300 -11.777
100 HB3 GLN 16 2HB GLN 16 25.348 32.032 -12.304
101 HG2 GLN 16 1HG GLN 16 24.815 31.242 -14.639
102 HG3 GLN 16 2HG GLN 16 23.218 30.761 -14.035
103 HE21 GLN 16 1HE2 GLN 16 22.266 34.240 -13.382
104 HE22 GLN 16 2HE2 GLN 16 22.249 32.697 -12.570
105 H GLY 17 H GLY 17 24.156 28.964 -10.242
106 HA2 GLY 17 1HA GLY 17 26.193 30.005 -8.405
107 HA3 GLY 17 2HA GLY 17 24.663 29.232 -7.968
108 H LEU 18 H LEU 18 25.260 26.945 -9.833
109 HA LEU 18 HA LEU 18 26.616 25.336 -7.815
110 HB2 LEU 18 1HB LEU 18 25.754 24.655 -10.649
111 HB3 LEU 18 2HB LEU 18 26.316 23.493 -9.454
112 HG LEU 18 HG LEU 18 23.812 25.169 -9.169
113 HD11 LEU 18 1HD1 LEU 18 23.658 23.589 -11.052
114 HD12 LEU 18 2HD1 LEU 18 22.605 23.089 -9.713
115 HD13 LEU 18 3HD1 LEU 18 24.158 22.259 -9.986
116 HD21 LEU 18 1HD2 LEU 18 24.695 24.480 -6.997
117 HD22 LEU 18 2HD2 LEU 18 24.869 22.805 -7.572
118 HD23 LEU 18 3HD2 LEU 18 23.251 23.525 -7.385
119 H ASP 19 H ASP 19 27.355 26.526 -11.051
120 HA ASP 19 HA ASP 19 29.896 25.053 -11.170
121 HB2 ASP 19 1HB ASP 19 28.247 25.484 -13.087
122 HB3 ASP 19 2HB ASP 19 28.822 27.162 -13.064
123 H ASN 20 H ASN 20 28.716 28.293 -10.560
124 HA ASN 20 HA ASN 20 31.529 29.219 -10.237
125 HB2 ASN 20 1HB ASN 20 29.308 30.328 -11.712
126 HB3 ASN 20 2HB ASN 20 29.828 31.454 -10.465
127 HD21 ASN 20 1HD2 ASN 20 31.772 31.565 -13.764
128 HD22 ASN 20 2HD2 ASN 20 30.095 31.155 -13.503
129 HA PRO 21 HA PRO 21 29.637 29.169 -6.026
130 HB2 PRO 21 1HB PRO 21 32.101 29.062 -4.743
131 HB3 PRO 21 2HB PRO 21 31.224 27.618 -5.285
132 HG2 PRO 21 1HG PRO 21 33.378 29.092 -6.644
133 HG3 PRO 21 2HG PRO 21 33.224 27.338 -6.353
134 HD2 PRO 21 1HD PRO 21 32.593 28.335 -8.731
135 HD3 PRO 21 2HD PRO 21 31.525 27.109 -7.965
136 H ALA 22 H ALA 22 32.130 31.079 -7.619
137 HA ALA 22 HA ALA 22 32.447 33.109 -5.651
138 HB1 ALA 22 1HB ALA 22 33.955 32.867 -7.577
139 HB2 ALA 22 2HB ALA 22 32.623 33.248 -8.700
140 HB3 ALA 22 3HB ALA 22 33.222 34.487 -7.571
141 H LEU 23 H LEU 23 30.123 32.709 -8.331
142 HA LEU 23 HA LEU 23 28.848 35.270 -7.891
143 HB2 LEU 23 1HB LEU 23 27.859 32.769 -9.322
144 HB3 LEU 23 2HB LEU 23 27.100 34.357 -9.391
145 HG LEU 23 HG LEU 23 29.848 33.657 -10.475
146 HD11 LEU 23 1HD1 LEU 23 27.225 34.298 -11.892
147 HD12 LEU 23 2HD1 LEU 23 27.931 32.672 -11.714
148 HD13 LEU 23 3HD1 LEU 23 28.779 33.912 -12.663
149 HD21 LEU 23 1HD2 LEU 23 28.269 36.251 -10.614
150 HD22 LEU 23 2HD2 LEU 23 29.743 35.893 -11.546
151 HD23 LEU 23 3HD2 LEU 23 29.817 35.989 -9.776
152 H LEU 24 H LEU 24 28.144 31.899 -6.893
153 HA LEU 24 HA LEU 24 25.629 32.573 -5.698
154 HB2 LEU 24 1HB LEU 24 26.351 30.276 -6.271
155 HB3 LEU 24 2HB LEU 24 27.534 30.316 -4.980
156 HG LEU 24 HG LEU 24 25.866 30.224 -3.303
157 HD11 LEU 24 1HD1 LEU 24 24.194 31.808 -4.049
158 HD12 LEU 24 2HD1 LEU 24 23.405 30.244 -3.804
159 HD13 LEU 24 3HD1 LEU 24 23.785 30.790 -5.453
160 HD21 LEU 24 1HD2 LEU 24 24.765 28.155 -3.794
161 HD22 LEU 24 2HD2 LEU 24 26.314 28.151 -4.671
162 HD23 LEU 24 3HD2 LEU 24 24.805 28.483 -5.543
163 H ARG 25 H ARG 25 28.965 32.455 -4.394
164 HA ARG 25 HA ARG 25 28.329 33.029 -1.683
165 HB2 ARG 25 1HB ARG 25 30.569 32.368 -2.540
166 HB3 ARG 25 2HB ARG 25 30.676 33.878 -3.412
167 HG2 ARG 25 1HG ARG 25 30.360 34.905 -0.957
168 HG3 ARG 25 2HG ARG 25 31.018 33.330 -0.489
169 HD2 ARG 25 1HD ARG 25 32.810 34.964 -0.734
170 HD3 ARG 25 2HD ARG 25 32.944 33.719 -1.993
171 HE ARG 25 HE ARG 25 31.467 35.577 -3.266
172 HH11 ARG 25 1HH1 ARG 25 34.463 35.989 -1.442
173 HH12 ARG 25 2HH1 ARG 25 34.944 37.374 -2.389
174 HH21 ARG 25 1HH2 ARG 25 32.110 37.357 -4.393
175 HH22 ARG 25 2HH2 ARG 25 33.626 38.136 -4.034
176 H ASP 26 H ASP 26 28.854 35.157 -4.528
177 HA ASP 26 HA ASP 26 28.689 37.589 -3.038
178 HB2 ASP 26 1HB ASP 26 29.551 37.089 -5.451
179 HB3 ASP 26 2HB ASP 26 27.868 37.340 -5.933
180 H MET 27 H MET 27 26.232 35.759 -4.917
181 HA MET 27 HA MET 27 24.065 37.578 -4.468
182 HB2 MET 27 1HB MET 27 24.130 35.664 -6.109
183 HB3 MET 27 2HB MET 27 23.918 34.555 -4.745
184 HG2 MET 27 1HG MET 27 21.765 35.644 -4.213
185 HG3 MET 27 2HG MET 27 22.002 36.752 -5.570
186 HE1 MET 27 1HE MET 27 20.697 32.326 -5.755
187 HE2 MET 27 2HE MET 27 22.127 32.807 -4.810
188 HE3 MET 27 3HE MET 27 20.517 33.438 -4.382
189 H LEU 28 H LEU 28 25.269 34.799 -2.605
190 HA LEU 28 HA LEU 28 23.202 34.775 -0.658
191 HB2 LEU 28 1HB LEU 28 25.987 33.773 -0.886
192 HB3 LEU 28 2HB LEU 28 25.289 33.874 0.725
193 HG LEU 28 HG LEU 28 23.834 32.491 -1.530
194 HD11 LEU 28 1HD1 LEU 28 25.785 31.317 0.455
195 HD12 LEU 28 2HD1 LEU 28 26.028 31.485 -1.296
196 HD13 LEU 28 3HD1 LEU 28 24.757 30.406 -0.681
197 HD21 LEU 28 1HD2 LEU 28 22.532 33.097 0.439
198 HD22 LEU 28 2HD2 LEU 28 23.730 32.362 1.512
199 HD23 LEU 28 3HD2 LEU 28 22.771 31.347 0.407
200 H LEU 29 H LEU 29 26.352 36.468 -0.740
201 HA LEU 29 HA LEU 29 26.133 37.538 1.919
202 HB2 LEU 29 1HB LEU 29 27.636 38.431 -0.556
203 HB3 LEU 29 2HB LEU 29 27.767 39.289 0.976
204 HG LEU 29 HG LEU 29 28.433 36.352 0.706
205 HD11 LEU 29 1HD1 LEU 29 30.797 37.037 0.526
206 HD12 LEU 29 2HD1 LEU 29 30.289 38.742 0.422
207 HD13 LEU 29 3HD1 LEU 29 29.836 37.592 -0.860
208 HD21 LEU 29 1HD2 LEU 29 29.227 38.449 2.759
209 HD22 LEU 29 2HD2 LEU 29 29.760 36.751 2.745
210 HD23 LEU 29 3HD2 LEU 29 28.048 37.139 3.001
211 H ALA 30 H ALA 30 25.028 38.637 -1.246
212 HA ALA 30 HA ALA 30 24.098 41.207 -0.254
213 HB1 ALA 30 1HB ALA 30 24.848 40.843 -2.595
214 HB2 ALA 30 2HB ALA 30 23.488 39.730 -2.852
215 HB3 ALA 30 3HB ALA 30 23.175 41.452 -2.524
216 H ASN 31 H ASN 31 22.796 38.009 -0.078
217 HA ASN 31 HA ASN 31 20.015 39.108 -0.004
218 HB2 ASN 31 1HB ASN 31 20.647 37.304 -1.662
219 HB3 ASN 31 2HB ASN 31 20.818 36.203 -0.292
220 HD21 ASN 31 1HD2 ASN 31 17.336 36.487 -1.944
221 HD22 ASN 31 2HD2 ASN 31 18.924 36.645 -2.672
222 HA PRO 32 HA PRO 32 20.865 38.316 4.343
223 HB2 PRO 32 1HB PRO 32 18.749 39.698 5.409
224 HB3 PRO 32 2HB PRO 32 20.256 40.482 4.830
225 HG2 PRO 32 1HG PRO 32 17.656 40.093 3.349
226 HG3 PRO 32 2HG PRO 32 18.605 41.597 3.584
227 HD2 PRO 32 1HD PRO 32 18.839 40.200 1.336
228 HD3 PRO 32 2HD PRO 32 20.299 40.902 2.125
229 H HIS 33 H HIS 33 17.860 37.620 2.605
230 HA HIS 33 HA HIS 33 16.743 36.035 4.790
231 HB2 HIS 33 1HB HIS 33 15.432 37.191 2.930
232 HB3 HIS 33 2HB HIS 33 16.046 35.949 1.829
233 HD1 HIS 33 HD1 HIS 33 13.459 36.551 4.453
234 HD2 HIS 33 HD2 HIS 33 15.056 33.327 2.353
235 HE1 HIS 33 HE1 HIS 33 11.882 34.600 4.791
236 H GLU 34 H GLU 34 18.481 35.376 1.732
237 HA GLU 34 HA GLU 34 18.195 32.512 1.946
238 HB2 GLU 34 1HB GLU 34 19.211 34.427 0.100
239 HB3 GLU 34 2HB GLU 34 20.510 33.301 0.425
240 HG2 GLU 34 1HG GLU 34 17.720 32.512 -0.411
241 HG3 GLU 34 2HG GLU 34 19.077 32.738 -1.517
242 H LEU 35 H LEU 35 20.737 34.882 2.775
243 HA LEU 35 HA LEU 35 22.644 32.959 3.604
244 HB2 LEU 35 1HB LEU 35 23.919 34.686 4.196
245 HB3 LEU 35 2HB LEU 35 22.816 35.403 3.079
246 HG LEU 35 HG LEU 35 21.612 36.490 4.907
247 HD11 LEU 35 1HD1 LEU 35 22.102 35.263 6.878
248 HD12 LEU 35 2HD1 LEU 35 22.921 36.819 7.044
249 HD13 LEU 35 3HD1 LEU 35 23.852 35.365 6.597
250 HD21 LEU 35 1HD2 LEU 35 23.432 38.155 5.146
251 HD22 LEU 35 2HD2 LEU 35 23.324 37.504 3.497
252 HD23 LEU 35 3HD2 LEU 35 24.593 36.920 4.593
253 H SER 36 H SER 36 19.810 34.237 5.171
254 HA SER 36 HA SER 36 20.494 33.375 7.836
255 HB2 SER 36 1HB SER 36 18.890 35.235 7.321
256 HB3 SER 36 2HB SER 36 17.735 34.004 6.760
257 HG SER 36 HG SER 36 17.644 33.172 8.820
258 H LEU 37 H LEU 37 18.417 32.071 5.181
259 HA LEU 37 HA LEU 37 17.594 29.810 6.779
260 HB2 LEU 37 1HB LEU 37 16.573 29.011 4.917
261 HB3 LEU 37 2HB LEU 37 16.545 30.723 4.789
262 HG LEU 37 HG LEU 37 18.241 30.596 2.986
263 HD11 LEU 37 1HD1 LEU 37 18.256 28.472 1.720
264 HD12 LEU 37 2HD1 LEU 37 17.441 27.682 3.094
265 HD13 LEU 37 3HD1 LEU 37 19.079 28.354 3.277
266 HD21 LEU 37 1HD2 LEU 37 15.498 29.343 2.650
267 HD22 LEU 37 2HD2 LEU 37 16.472 30.058 1.347
268 HD23 LEU 37 3HD2 LEU 37 15.872 31.082 2.659
269 H LEU 38 H LEU 38 20.263 30.596 4.741
270 HA LEU 38 HA LEU 38 21.301 27.980 4.462
271 HB2 LEU 38 1HB LEU 38 21.876 30.023 3.200
272 HB3 LEU 38 2HB LEU 38 22.765 30.614 4.612
273 HG LEU 38 HG LEU 38 24.171 28.524 4.536
274 HD11 LEU 38 1HD1 LEU 38 22.673 27.174 3.165
275 HD12 LEU 38 2HD1 LEU 38 24.260 27.332 2.396
276 HD13 LEU 38 3HD1 LEU 38 22.885 28.293 1.803
277 HD21 LEU 38 1HD2 LEU 38 25.673 29.336 2.830
278 HD22 LEU 38 2HD2 LEU 38 24.966 30.712 3.706
279 HD23 LEU 38 3HD2 LEU 38 24.362 30.280 2.090
280 H LYS 39 H LYS 39 21.973 30.502 6.952
281 HA LYS 39 HA LYS 39 23.762 28.693 8.369
282 HB2 LYS 39 1HB LYS 39 23.524 30.267 10.295
283 HB3 LYS 39 2HB LYS 39 24.155 30.960 8.800
284 HG2 LYS 39 1HG LYS 39 22.083 32.058 8.344
285 HG3 LYS 39 2HG LYS 39 21.246 31.228 9.623
286 HD2 LYS 39 1HD LYS 39 21.675 33.396 10.429
287 HD3 LYS 39 2HD LYS 39 22.874 32.363 11.233
288 HE2 LYS 39 1HE LYS 39 24.579 33.047 9.585
289 HE3 LYS 39 2HE LYS 39 23.367 34.010 8.716
290 HZ1 LYS 39 1HZ LYS 39 24.697 35.384 10.192
291 HZ2 LYS 39 2HZ LYS 39 24.248 34.486 11.502
292 HZ3 LYS 39 3HZ LYS 39 23.127 35.383 10.689
293 H GLU 40 H GLU 40 20.290 29.096 8.383
294 HA GLU 40 HA GLU 40 19.925 27.594 10.858
295 HB2 GLU 40 1HB GLU 40 18.142 28.292 8.509
296 HB3 GLU 40 2HB GLU 40 17.594 27.249 9.823
297 HG2 GLU 40 1HG GLU 40 17.916 29.036 11.435
298 HG3 GLU 40 2HG GLU 40 18.584 30.085 10.175
299 H ARG 41 H ARG 41 19.571 26.810 7.359
300 HA ARG 41 HA ARG 41 19.161 23.970 8.127
301 HB2 ARG 41 1HB ARG 41 18.977 25.378 5.449
302 HB3 ARG 41 2HB ARG 41 18.502 23.712 5.788
303 HG2 ARG 41 1HG ARG 41 16.999 24.725 7.631
304 HG3 ARG 41 2HG ARG 41 17.268 26.273 6.816
305 HD2 ARG 41 1HD ARG 41 16.336 25.331 4.736
306 HD3 ARG 41 2HD ARG 41 16.066 23.785 5.579
307 HE ARG 41 HE ARG 41 14.882 26.036 6.977
308 HH11 ARG 41 1HH1 ARG 41 14.278 23.775 4.330
309 HH12 ARG 41 2HH1 ARG 41 12.549 23.954 4.450
310 HH21 ARG 41 1HH2 ARG 41 12.677 26.218 7.065
311 HH22 ARG 41 2HH2 ARG 41 11.659 25.314 5.972
312 H ASN 42 H ASN 42 21.745 25.826 6.768
313 HA ASN 42 HA ASN 42 23.265 23.278 6.403
314 HB2 ASN 42 1HB ASN 42 22.454 24.323 4.213
315 HB3 ASN 42 2HB ASN 42 23.567 25.632 4.532
316 HD21 ASN 42 1HD2 ASN 42 25.374 23.303 2.405
317 HD22 ASN 42 2HD2 ASN 42 24.115 24.512 2.315
318 HA PRO 43 HA PRO 43 25.401 26.600 8.872
319 HB2 PRO 43 1HB PRO 43 26.473 24.904 10.817
320 HB3 PRO 43 2HB PRO 43 24.956 25.853 10.953
321 HG2 PRO 43 1HG PRO 43 25.318 22.978 10.170
322 HG3 PRO 43 2HG PRO 43 24.137 23.714 11.294
323 HD2 PRO 43 1HD PRO 43 23.437 23.063 8.793
324 HD3 PRO 43 2HD PRO 43 22.838 24.582 9.551
325 HA PRO 44 HA PRO 44 29.489 24.473 8.151
326 HB2 PRO 44 1HB PRO 44 29.769 22.546 6.219
327 HB3 PRO 44 2HB PRO 44 29.488 22.166 7.948
328 HG2 PRO 44 1HG PRO 44 27.511 22.352 5.718
329 HG3 PRO 44 2HG PRO 44 27.768 21.025 6.899
330 HD2 PRO 44 1HD PRO 44 25.840 22.838 7.275
331 HD3 PRO 44 2HD PRO 44 26.828 22.260 8.658
332 H LEU 45 H LEU 45 27.199 24.658 5.337
333 HA LEU 45 HA LEU 45 29.280 25.877 3.674
334 HB2 LEU 45 1HB LEU 45 27.336 24.659 2.721
335 HB3 LEU 45 2HB LEU 45 26.283 25.942 3.312
336 HG LEU 45 HG LEU 45 27.330 27.560 1.810
337 HD11 LEU 45 1HD1 LEU 45 29.119 25.256 0.912
338 HD12 LEU 45 2HD1 LEU 45 29.641 26.759 1.705
339 HD13 LEU 45 3HD1 LEU 45 28.970 26.812 0.070
340 HD21 LEU 45 1HD2 LEU 45 26.535 26.652 -0.301
341 HD22 LEU 45 2HD2 LEU 45 25.465 26.121 1.001
342 HD23 LEU 45 3HD2 LEU 45 26.657 24.991 0.322
343 H ALA 46 H ALA 46 26.680 26.897 5.848
344 HA ALA 46 HA ALA 46 26.777 29.654 5.195
345 HB1 ALA 46 1HB ALA 46 25.711 30.028 7.294
346 HB2 ALA 46 2HB ALA 46 25.068 28.531 6.581
347 HB3 ALA 46 3HB ALA 46 26.248 28.448 7.906
348 H GLU 47 H GLU 47 28.651 27.900 7.778
349 HA GLU 47 HA GLU 47 29.928 30.273 8.705
350 HB2 GLU 47 1HB GLU 47 31.554 28.868 9.778
351 HB3 GLU 47 2HB GLU 47 29.950 28.155 9.954
352 HG2 GLU 47 1HG GLU 47 30.446 26.507 8.251
353 HG3 GLU 47 2HG GLU 47 32.004 27.273 7.907
354 H ALA 48 H ALA 48 30.685 28.194 5.982
355 HA ALA 48 HA ALA 48 33.230 29.256 5.383
356 HB1 ALA 48 1HB ALA 48 32.177 27.122 4.488
357 HB2 ALA 48 2HB ALA 48 31.182 28.150 3.428
358 HB3 ALA 48 3HB ALA 48 32.938 28.155 3.268
359 H LEU 49 H LEU 49 29.925 30.220 4.481
360 HA LEU 49 HA LEU 49 30.703 32.353 2.703
361 HB2 LEU 49 1HB LEU 49 28.423 31.289 2.833
362 HB3 LEU 49 2HB LEU 49 28.211 32.039 4.409
363 HG LEU 49 HG LEU 49 28.583 34.290 3.194
364 HD11 LEU 49 1HD1 LEU 49 29.395 33.363 1.080
365 HD12 LEU 49 2HD1 LEU 49 27.882 34.254 0.825
366 HD13 LEU 49 3HD1 LEU 49 27.869 32.478 0.860
367 HD21 LEU 49 1HD2 LEU 49 26.465 33.504 4.179
368 HD22 LEU 49 2HD2 LEU 49 26.085 32.654 2.664
369 HD23 LEU 49 3HD2 LEU 49 26.205 34.430 2.690
370 H LEU 50 H LEU 50 29.988 32.146 6.198
371 HA LEU 50 HA LEU 50 29.974 34.961 6.689
372 HB2 LEU 50 1HB LEU 50 30.872 32.832 8.653
373 HB3 LEU 50 2HB LEU 50 30.248 34.425 9.024
374 HG LEU 50 HG LEU 50 28.778 31.971 8.189
375 HD11 LEU 50 1HD1 LEU 50 28.424 33.878 10.473
376 HD12 LEU 50 2HD1 LEU 50 29.235 32.289 10.519
377 HD13 LEU 50 3HD1 LEU 50 27.498 32.381 10.181
378 HD21 LEU 50 1HD2 LEU 50 27.650 34.768 8.069
379 HD22 LEU 50 2HD2 LEU 50 26.671 33.273 8.089
380 HD23 LEU 50 3HD2 LEU 50 27.775 33.577 6.743
381 H SER 51 H SER 51 32.569 32.642 6.361
382 HA SER 51 HA SER 51 34.597 34.268 7.609
383 HB2 SER 51 1HB SER 51 34.765 31.962 5.661
384 HB3 SER 51 2HB SER 51 36.090 32.598 6.640
385 HG SER 51 HG SER 51 33.675 31.448 7.638
386 H GLY 52 H GLY 52 33.098 34.267 4.456
387 HA2 GLY 52 1HA GLY 52 33.463 35.837 2.770
388 HA3 GLY 52 2HA GLY 52 34.931 36.385 3.588
389 H ASP 53 H ASP 53 36.038 33.688 3.809
390 HA ASP 53 HA ASP 53 37.654 33.501 1.551
391 HB2 ASP 53 1HB ASP 53 36.847 31.645 3.715
392 HB3 ASP 53 2HB ASP 53 37.941 31.127 2.434
393 H LEU 54 H LEU 54 36.840 33.388 -0.463
394 HA LEU 54 HA LEU 54 34.599 31.798 -1.243
395 HB2 LEU 54 1HB LEU 54 35.605 33.585 -2.621
396 HB3 LEU 54 2HB LEU 54 37.049 32.610 -2.848
397 HG LEU 54 HG LEU 54 35.286 32.788 -4.710
398 HD11 LEU 54 1HD1 LEU 54 36.325 30.034 -4.058
399 HD12 LEU 54 2HD1 LEU 54 37.270 31.336 -4.814
400 HD13 LEU 54 3HD1 LEU 54 35.860 30.660 -5.651
401 HD21 LEU 54 1HD2 LEU 54 33.557 31.118 -4.824
402 HD22 LEU 54 2HD2 LEU 54 33.291 32.166 -3.425
403 HD23 LEU 54 3HD2 LEU 54 33.954 30.537 -3.205
404 H GLU 55 H GLU 55 38.047 31.137 -0.760
405 HA GLU 55 HA GLU 55 38.285 28.666 -2.049
406 HB2 GLU 55 1HB GLU 55 39.532 29.292 0.647
407 HB3 GLU 55 2HB GLU 55 40.174 28.268 -0.648
408 HG2 GLU 55 1HG GLU 55 40.117 30.439 -2.046
409 HG3 GLU 55 2HG GLU 55 39.997 31.268 -0.491
410 H LYS 56 H LYS 56 37.374 29.248 1.378
411 HA LYS 56 HA LYS 56 36.789 26.431 1.742
412 HB2 LYS 56 1HB LYS 56 36.081 26.951 3.961
413 HB3 LYS 56 2HB LYS 56 37.557 27.883 3.575
414 HG2 LYS 56 1HG LYS 56 36.063 29.800 3.166
415 HG3 LYS 56 2HG LYS 56 34.785 28.864 3.912
416 HD2 LYS 56 1HD LYS 56 37.483 29.256 5.250
417 HD3 LYS 56 2HD LYS 56 36.190 30.422 5.424
418 HE2 LYS 56 1HE LYS 56 34.711 28.614 6.343
419 HE3 LYS 56 2HE LYS 56 36.100 27.514 6.290
420 HZ1 LYS 56 1HZ LYS 56 35.898 30.024 7.864
421 HZ2 LYS 56 2HZ LYS 56 37.242 29.066 7.803
422 HZ3 LYS 56 3HZ LYS 56 35.848 28.488 8.473
423 H PHE 57 H PHE 57 34.860 29.299 0.914
424 HA PHE 57 HA PHE 57 32.311 28.061 1.235
425 HB2 PHE 57 1HB PHE 57 32.602 30.471 0.827
426 HB3 PHE 57 2HB PHE 57 33.177 30.128 -0.809
427 HD1 PHE 57 HD1 PHE 57 30.214 29.912 1.438
428 HD2 PHE 57 HD2 PHE 57 31.666 29.705 -2.608
429 HE1 PHE 57 HE1 PHE 57 27.871 29.914 0.600
430 HE2 PHE 57 HE2 PHE 57 29.328 29.708 -3.449
431 HZ PHE 57 HZ PHE 57 27.426 29.807 -1.852
432 H SER 58 H SER 58 34.425 28.224 -1.676
433 HA SER 58 HA SER 58 32.778 26.610 -3.321
434 HB2 SER 58 1HB SER 58 34.645 28.014 -4.135
435 HB3 SER 58 2HB SER 58 35.803 26.968 -3.287
436 HG SER 58 HG SER 58 35.627 26.388 -5.478
437 H ARG 59 H ARG 59 35.518 25.698 -1.162
438 HA ARG 59 HA ARG 59 35.587 22.970 -1.947
439 HB2 ARG 59 1HB ARG 59 37.330 24.032 -0.599
440 HB3 ARG 59 2HB ARG 59 36.201 24.290 0.728
441 HG2 ARG 59 1HG ARG 59 36.511 21.454 -0.171
442 HG3 ARG 59 2HG ARG 59 37.950 22.188 0.563
443 HD2 ARG 59 1HD ARG 59 36.666 22.793 2.563
444 HD3 ARG 59 2HD ARG 59 35.185 22.137 1.841
445 HE ARG 59 HE ARG 59 36.925 20.004 1.788
446 HH11 ARG 59 1HH1 ARG 59 35.645 22.065 4.343
447 HH12 ARG 59 2HH1 ARG 59 35.750 20.801 5.539
448 HH21 ARG 59 1HH2 ARG 59 36.992 18.439 3.352
449 HH22 ARG 59 2HH2 ARG 59 36.528 18.799 4.993
450 H VAL 60 H VAL 60 33.683 24.569 0.648
451 HA VAL 60 HA VAL 60 32.489 22.056 1.464
452 HB VAL 60 HB VAL 60 31.603 24.928 2.034
453 HG11 VAL 60 1HG1 VAL 60 30.432 23.839 3.990
454 HG12 VAL 60 2HG1 VAL 60 29.743 23.407 2.415
455 HG13 VAL 60 3HG1 VAL 60 30.795 22.254 3.270
456 HG21 VAL 60 1HG2 VAL 60 33.891 24.385 2.891
457 HG22 VAL 60 2HG2 VAL 60 32.723 24.601 4.208
458 HG23 VAL 60 3HG2 VAL 60 33.224 22.960 3.726
459 H LEU 61 H LEU 61 31.686 24.614 -0.881
460 HA LEU 61 HA LEU 61 28.996 23.881 -1.359
461 HB2 LEU 61 1HB LEU 61 30.338 25.861 -2.311
462 HB3 LEU 61 2HB LEU 61 30.937 24.737 -3.522
463 HG LEU 61 HG LEU 61 28.221 24.341 -3.701
464 HD11 LEU 61 1HD1 LEU 61 27.151 26.491 -3.610
465 HD12 LEU 61 2HD1 LEU 61 28.693 27.303 -3.249
466 HD13 LEU 61 3HD1 LEU 61 27.945 26.215 -2.052
467 HD21 LEU 61 1HD2 LEU 61 28.303 25.554 -5.772
468 HD22 LEU 61 2HD2 LEU 61 29.920 24.845 -5.552
469 HD23 LEU 61 3HD2 LEU 61 29.631 26.555 -5.201
470 H VAL 62 H VAL 62 32.035 22.593 -2.810
471 HA VAL 62 HA VAL 62 30.661 20.770 -4.567
472 HB VAL 62 HB VAL 62 33.488 20.575 -3.420
473 HG11 VAL 62 1HG1 VAL 62 33.930 19.163 -5.450
474 HG12 VAL 62 2HG1 VAL 62 32.776 18.410 -4.339
475 HG13 VAL 62 3HG1 VAL 62 32.189 19.194 -5.821
476 HG21 VAL 62 1HG2 VAL 62 32.455 21.762 -6.024
477 HG22 VAL 62 2HG2 VAL 62 33.128 22.664 -4.658
478 HG23 VAL 62 3HG2 VAL 62 34.168 21.577 -5.589
479 H GLU 63 H GLU 63 32.025 20.394 -1.265
480 HA GLU 63 HA GLU 63 31.439 17.585 -1.078
481 HB2 GLU 63 1HB GLU 63 31.697 19.736 1.048
482 HB3 GLU 63 2HB GLU 63 31.502 18.007 1.405
483 HG2 GLU 63 1HG GLU 63 33.543 17.547 0.022
484 HG3 GLU 63 2HG GLU 63 33.792 19.290 -0.121
485 H GLN 64 H GLN 64 29.485 20.477 -0.317
486 HA GLN 64 HA GLN 64 27.217 18.972 0.663
487 HB2 GLN 64 1HB GLN 64 27.532 21.743 -0.553
488 HB3 GLN 64 2HB GLN 64 25.971 21.124 -0.014
489 HG2 GLN 64 1HG GLN 64 28.389 21.317 1.801
490 HG3 GLN 64 2HG GLN 64 27.200 22.609 1.618
491 HE21 GLN 64 1HE2 GLN 64 26.505 19.930 4.358
492 HE22 GLN 64 2HE2 GLN 64 28.059 20.382 3.708
493 H GLN 65 H GLN 65 28.200 20.120 -2.614
494 HA GLN 65 HA GLN 65 25.759 19.387 -3.917
495 HB2 GLN 65 1HB GLN 65 28.626 19.588 -4.857
496 HB3 GLN 65 2HB GLN 65 27.351 19.010 -5.927
497 HG2 GLN 65 1HG GLN 65 26.156 21.108 -5.738
498 HG3 GLN 65 2HG GLN 65 27.324 21.709 -4.556
499 HE21 GLN 65 1HE2 GLN 65 28.598 23.290 -7.500
500 HE22 GLN 65 2HE2 GLN 65 27.490 23.480 -6.156
501 H GLN 66 H GLN 66 28.699 17.485 -3.145
502 HA GLN 66 HA GLN 66 27.940 15.171 -4.614
503 HB2 GLN 66 1HB GLN 66 29.617 15.501 -2.112
504 HB3 GLN 66 2HB GLN 66 29.412 13.958 -2.944
505 HG2 GLN 66 1HG GLN 66 30.420 14.875 -4.972
506 HG3 GLN 66 2HG GLN 66 30.564 16.458 -4.204
507 HE21 GLN 66 1HE2 GLN 66 33.534 15.747 -2.554
508 HE22 GLN 66 2HE2 GLN 66 32.284 16.905 -2.952
509 H ASP 67 H ASP 67 27.250 16.116 -1.199
510 HA ASP 67 HA ASP 67 25.815 13.641 -0.718
511 HB2 ASP 67 1HB ASP 67 26.873 15.223 1.028
512 HB3 ASP 67 2HB ASP 67 25.413 16.201 0.826
513 H ARG 68 H ARG 68 24.874 16.957 -1.601
514 HA ARG 68 HA ARG 68 22.060 16.538 -1.289
515 HB2 ARG 68 1HB ARG 68 23.683 18.492 -2.928
516 HB3 ARG 68 2HB ARG 68 21.920 18.462 -2.971
517 HG2 ARG 68 1HG ARG 68 21.856 18.806 -0.519
518 HG3 ARG 68 2HG ARG 68 23.621 18.944 -0.512
519 HD2 ARG 68 1HD ARG 68 23.456 20.835 -2.116
520 HD3 ARG 68 2HD ARG 68 21.686 20.713 -2.037
521 HE ARG 68 HE ARG 68 22.969 21.014 0.571
522 HH11 ARG 68 1HH1 ARG 68 21.676 22.813 -2.191
523 HH12 ARG 68 2HH1 ARG 68 21.408 24.255 -1.241
524 HH21 ARG 68 1HH2 ARG 68 22.596 22.878 1.705
525 HH22 ARG 68 2HH2 ARG 68 21.902 24.284 0.930
526 H ALA 69 H ALA 69 24.280 15.964 -4.020
527 HA ALA 69 HA ALA 69 22.329 15.528 -6.007
528 HB1 ALA 69 1HB ALA 69 24.069 14.140 -7.117
529 HB2 ALA 69 2HB ALA 69 24.743 15.658 -6.475
530 HB3 ALA 69 3HB ALA 69 25.014 14.130 -5.606
531 H ARG 70 H ARG 70 23.314 13.440 -3.333
532 HA ARG 70 HA ARG 70 22.219 10.999 -4.382
533 HB2 ARG 70 1HB ARG 70 22.515 11.869 -1.484
534 HB3 ARG 70 2HB ARG 70 22.349 10.207 -2.058
535 HG2 ARG 70 1HG ARG 70 24.545 10.242 -3.034
536 HG3 ARG 70 2HG ARG 70 24.646 12.004 -2.893
537 HD2 ARG 70 1HD ARG 70 25.991 11.204 -1.148
538 HD3 ARG 70 2HD ARG 70 24.481 11.722 -0.386
539 HE ARG 70 HE ARG 70 24.530 8.898 -1.085
540 HH11 ARG 70 1HH1 ARG 70 25.354 11.239 1.456
541 HH12 ARG 70 2HH1 ARG 70 25.411 9.988 2.681
542 HH21 ARG 70 1HH2 ARG 70 24.609 7.394 0.551
543 HH22 ARG 70 2HH2 ARG 70 24.984 7.876 2.181
544 H ARG 71 H ARG 71 20.877 13.480 -2.179
545 HA ARG 71 HA ARG 71 18.279 12.102 -2.074
546 HB2 ARG 71 1HB ARG 71 17.584 13.980 -0.686
547 HB3 ARG 71 2HB ARG 71 19.140 13.353 -0.131
548 HG2 ARG 71 1HG ARG 71 20.313 15.206 -1.106
549 HG3 ARG 71 2HG ARG 71 18.859 15.744 -1.940
550 HD2 ARG 71 1HD ARG 71 17.880 15.996 0.447
551 HD3 ARG 71 2HD ARG 71 19.606 16.074 0.910
552 HE ARG 71 HE ARG 71 18.957 17.659 -1.463
553 HH11 ARG 71 1HH1 ARG 71 18.933 17.827 2.079
554 HH12 ARG 71 2HH1 ARG 71 18.974 19.566 2.076
555 HH21 ARG 71 1HH2 ARG 71 19.034 19.808 -1.397
556 HH22 ARG 71 2HH2 ARG 71 19.024 20.692 0.116
557 H GLU 72 H GLU 72 19.728 14.657 -3.959
558 HA GLU 72 HA GLU 72 17.346 16.056 -4.631
559 HB2 GLU 72 1HB GLU 72 20.104 16.193 -5.378
560 HB3 GLU 72 2HB GLU 72 19.138 16.195 -6.837
561 HG2 GLU 72 1HG GLU 72 19.392 18.447 -6.280
562 HG3 GLU 72 2HG GLU 72 17.740 18.055 -5.796
563 H GLN 73 H GLN 73 18.759 13.148 -5.966
564 HA GLN 73 HA GLN 73 17.412 12.970 -8.430
565 HB2 GLN 73 1HB GLN 73 18.098 10.830 -6.382
566 HB3 GLN 73 2HB GLN 73 17.500 10.466 -8.007
567 HG2 GLN 73 1HG GLN 73 19.447 11.350 -9.038
568 HG3 GLN 73 2HG GLN 73 19.968 12.137 -7.550
569 HE21 GLN 73 1HE2 GLN 73 21.954 9.486 -6.605
570 HE22 GLN 73 2HE2 GLN 73 21.598 11.205 -6.577
571 H GLU 74 H GLU 74 16.200 12.098 -5.162
572 HA GLU 74 HA GLU 74 13.634 11.172 -6.176
573 HB2 GLU 74 1HB GLU 74 14.628 11.967 -3.412
574 HB3 GLU 74 2HB GLU 74 13.005 11.346 -3.723
575 HG2 GLU 74 1HG GLU 74 15.589 9.865 -4.305
576 HG3 GLU 74 2HG GLU 74 14.541 9.599 -2.902
577 H ARG 75 H ARG 75 14.966 14.225 -5.025
578 HA ARG 75 HA ARG 75 12.405 15.513 -4.642
579 HB2 ARG 75 1HB ARG 75 15.234 16.544 -4.929
580 HB3 ARG 75 2HB ARG 75 13.848 17.608 -4.665
581 HG2 ARG 75 1HG ARG 75 13.372 16.657 -2.545
582 HG3 ARG 75 2HG ARG 75 14.458 15.285 -2.812
583 HD2 ARG 75 1HD ARG 75 15.355 17.023 -1.249
584 HD3 ARG 75 2HD ARG 75 16.396 16.647 -2.626
585 HE ARG 75 HE ARG 75 16.181 18.790 -3.404
586 HH11 ARG 75 1HH1 ARG 75 13.652 18.321 -0.976
587 HH12 ARG 75 2HH1 ARG 75 13.197 20.004 -0.999
588 HH21 ARG 75 1HH2 ARG 75 15.528 20.908 -3.386
589 HH22 ARG 75 2HH2 ARG 75 14.240 21.441 -2.337
590 H ILE 76 H ILE 76 14.744 15.512 -7.362
591 HA ILE 76 HA ILE 76 13.041 17.335 -8.891
592 HB ILE 76 HB ILE 76 14.608 17.073 -10.715
593 HG12 ILE 76 1HG1 ILE 76 15.910 14.849 -9.099
594 HG13 ILE 76 2HG1 ILE 76 14.948 14.624 -10.552
595 HG21 ILE 76 1HG2 ILE 76 16.586 17.996 -9.654
596 HG22 ILE 76 2HG2 ILE 76 15.184 18.516 -8.699
597 HG23 ILE 76 3HG2 ILE 76 16.217 17.189 -8.112
598 HD11 ILE 76 1HD1 ILE 76 17.267 14.466 -11.166
599 HD12 ILE 76 2HD1 ILE 76 16.641 16.001 -11.814
600 HD13 ILE 76 3HD1 ILE 76 17.653 15.995 -10.349
601 H ARG 77 H ARG 77 12.984 14.002 -8.227
602 HA ARG 77 HA ARG 77 12.213 12.842 -10.665
603 HB2 ARG 77 1HB ARG 77 12.510 12.031 -8.064
604 HB3 ARG 77 2HB ARG 77 10.768 11.912 -8.226
605 HG2 ARG 77 1HG ARG 77 12.620 10.614 -10.242
606 HG3 ARG 77 2HG ARG 77 12.279 9.845 -8.685
607 HD2 ARG 77 1HD ARG 77 10.675 8.873 -10.053
608 HD3 ARG 77 2HD ARG 77 9.771 10.196 -9.295
609 HE ARG 77 HE ARG 77 9.807 11.415 -11.326
610 HH11 ARG 77 1HH1 ARG 77 11.426 8.297 -11.738
611 HH12 ARG 77 2HH1 ARG 77 11.385 8.407 -13.477
612 HH21 ARG 77 1HH2 ARG 77 9.796 11.488 -13.515
613 HH22 ARG 77 2HH2 ARG 77 10.466 10.191 -14.470
614 H LEU 78 H LEU 78 10.254 14.665 -8.309
615 HA LEU 78 HA LEU 78 8.236 15.153 -10.360
616 HB2 LEU 78 1HB LEU 78 7.899 12.971 -8.514
617 HB3 LEU 78 2HB LEU 78 6.790 14.250 -8.042
618 HG LEU 78 HG LEU 78 6.928 13.027 -10.820
619 HD11 LEU 78 1HD1 LEU 78 6.175 11.419 -9.105
620 HD12 LEU 78 2HD1 LEU 78 4.840 11.886 -10.183
621 HD13 LEU 78 3HD1 LEU 78 4.949 12.584 -8.549
622 HD21 LEU 78 1HD2 LEU 78 4.956 14.983 -9.553
623 HD22 LEU 78 2HD2 LEU 78 4.694 14.145 -11.101
624 HD23 LEU 78 3HD2 LEU 78 6.037 15.286 -10.938
625 H PHE 79 H PHE 79 6.772 16.811 -9.635
626 HA PHE 79 HA PHE 79 6.350 18.830 -8.762
627 HB2 PHE 79 1HB PHE 79 7.165 17.579 -6.149
628 HB3 PHE 79 2HB PHE 79 6.032 18.905 -6.415
629 HD1 PHE 79 HD1 PHE 79 3.960 18.298 -7.994
630 HD2 PHE 79 HD2 PHE 79 6.327 15.453 -5.789
631 HE1 PHE 79 HE1 PHE 79 2.096 16.650 -8.127
632 HE2 PHE 79 HE2 PHE 79 4.469 13.802 -5.914
633 HZ PHE 79 HZ PHE 79 2.350 14.392 -7.092
634 H SER 80 H SER 80 7.742 19.789 -6.224
635 HA SER 80 HA SER 80 9.369 21.282 -5.750
636 HB2 SER 80 1HB SER 80 11.177 19.500 -7.413
637 HB3 SER 80 2HB SER 80 11.671 20.616 -6.123
638 HG SER 80 HG SER 80 10.785 18.065 -5.970
639 H ALA 81 H ALA 81 7.865 21.655 -8.258
640 HA ALA 81 HA ALA 81 9.770 23.214 -9.910
641 HB1 ALA 81 1HB ALA 81 6.840 22.494 -10.396
642 HB2 ALA 81 2HB ALA 81 7.940 23.283 -11.549
643 HB3 ALA 81 3HB ALA 81 8.249 21.608 -11.043
644 H ASP 82 H ASP 82 9.198 24.186 -7.306
645 HA ASP 82 HA ASP 82 7.494 26.588 -7.881
646 HB2 ASP 82 1HB ASP 82 6.581 25.024 -6.163
647 HB3 ASP 82 2HB ASP 82 8.068 25.210 -5.226
648 HA PRO 83 HA PRO 83 11.746 27.951 -7.061
649 HB2 PRO 83 1HB PRO 83 12.066 29.847 -8.939
650 HB3 PRO 83 2HB PRO 83 12.036 28.115 -9.398
651 HG2 PRO 83 1HG PRO 83 9.842 30.146 -9.464
652 HG3 PRO 83 2HG PRO 83 10.373 29.034 -10.762
653 HD2 PRO 83 1HD PRO 83 8.240 28.512 -9.092
654 HD3 PRO 83 2HD PRO 83 9.264 27.216 -9.806
655 H PHE 84 H PHE 84 12.596 29.767 -6.011
656 HA PHE 84 HA PHE 84 10.714 32.039 -5.536
657 HB2 PHE 84 1HB PHE 84 12.341 30.413 -3.607
658 HB3 PHE 84 2HB PHE 84 12.180 32.144 -3.299
659 HD1 PHE 84 HD1 PHE 84 10.458 32.846 -1.926
660 HD2 PHE 84 HD2 PHE 84 9.933 29.220 -4.201
661 HE1 PHE 84 HE1 PHE 84 8.234 32.496 -0.859
662 HE2 PHE 84 HE2 PHE 84 7.702 28.883 -3.160
663 HZ PHE 84 HZ PHE 84 6.850 30.511 -1.476
664 H ASP 85 H ASP 85 13.222 31.034 -7.090
665 HA ASP 85 HA ASP 85 15.128 33.212 -6.552
666 HB2 ASP 85 1HB ASP 85 15.230 30.860 -8.484
667 HB3 ASP 85 2HB ASP 85 16.568 31.969 -8.120
668 H LEU 86 H LEU 86 12.698 34.112 -7.438
669 HA LEU 86 HA LEU 86 12.436 34.273 -10.291
670 HB2 LEU 86 1HB LEU 86 11.359 36.158 -8.174
671 HB3 LEU 86 2HB LEU 86 10.748 35.968 -9.815
672 HG LEU 86 HG LEU 86 10.631 33.859 -7.620
673 HD11 LEU 86 1HD1 LEU 86 8.230 34.338 -7.584
674 HD12 LEU 86 2HD1 LEU 86 8.444 35.604 -8.818
675 HD13 LEU 86 3HD1 LEU 86 9.172 35.793 -7.205
676 HD21 LEU 86 1HD2 LEU 86 9.050 32.677 -9.147
677 HD22 LEU 86 2HD2 LEU 86 10.701 32.747 -9.781
678 HD23 LEU 86 3HD2 LEU 86 9.456 33.841 -10.430
679 H GLU 87 H GLU 87 14.297 36.017 -7.972
680 HA GLU 87 HA GLU 87 14.818 38.368 -9.616
681 HB2 GLU 87 1HB GLU 87 16.112 37.222 -7.121
682 HB3 GLU 87 2HB GLU 87 16.524 38.781 -7.823
683 HG2 GLU 87 1HG GLU 87 13.672 38.169 -7.021
684 HG3 GLU 87 2HG GLU 87 14.868 38.632 -5.809
685 H ALA 88 H ALA 88 16.104 35.185 -9.424
686 HA ALA 88 HA ALA 88 18.866 35.832 -9.953
687 HB1 ALA 88 1HB ALA 88 19.207 33.418 -9.978
688 HB2 ALA 88 2HB ALA 88 18.129 33.858 -8.632
689 HB3 ALA 88 3HB ALA 88 17.451 33.141 -10.117
690 H GLN 89 H GLN 89 17.252 36.970 -11.973
691 HA GLN 89 HA GLN 89 17.168 35.386 -14.354
692 HB2 GLN 89 1HB GLN 89 17.483 38.389 -14.085
693 HB3 GLN 89 2HB GLN 89 16.981 37.522 -15.541
694 HG2 GLN 89 1HG GLN 89 14.987 36.667 -14.274
695 HG3 GLN 89 2HG GLN 89 15.465 37.679 -12.906
696 HE21 GLN 89 1HE2 GLN 89 13.004 39.745 -14.464
697 HE22 GLN 89 2HE2 GLN 89 13.192 38.402 -13.357
698 H ALA 90 H ALA 90 18.714 34.743 -15.697
699 HA ALA 90 HA ALA 90 21.476 35.201 -15.032
700 HB1 ALA 90 1HB ALA 90 20.632 33.062 -15.986
701 HB2 ALA 90 2HB ALA 90 20.258 33.903 -17.512
702 HB3 ALA 90 3HB ALA 90 21.945 33.756 -16.964
703 H LYS 91 H LYS 91 23.002 36.479 -15.971
704 HA LYS 91 HA LYS 91 22.382 37.951 -18.451
705 HB2 LYS 91 1HB LYS 91 21.560 39.239 -16.293
706 HB3 LYS 91 2HB LYS 91 23.287 39.486 -16.029
707 HG2 LYS 91 1HG LYS 91 23.424 40.605 -18.265
708 HG3 LYS 91 2HG LYS 91 21.653 40.483 -18.381
709 HD2 LYS 91 1HD LYS 91 21.443 41.751 -16.259
710 HD3 LYS 91 2HD LYS 91 23.210 41.842 -16.148
711 HE2 LYS 91 1HE LYS 91 23.233 43.074 -18.334
712 HE3 LYS 91 2HE LYS 91 21.453 43.120 -18.269
713 HZ1 LYS 91 1HZ LYS 91 22.425 45.125 -17.306
714 HZ2 LYS 91 2HZ LYS 91 23.309 44.248 -16.225
715 HZ3 LYS 91 3HZ LYS 91 21.657 44.274 -16.125
716 H ILE 92 H ILE 92 24.280 38.895 -19.282
717 HA ILE 92 HA ILE 92 26.832 38.365 -17.861
718 HB ILE 92 HB ILE 92 26.381 37.852 -20.857
719 HG12 ILE 92 1HG1 ILE 92 27.180 35.905 -18.648
720 HG13 ILE 92 2HG1 ILE 92 25.561 36.027 -19.333
721 HG21 ILE 92 1HG2 ILE 92 28.944 37.613 -19.172
722 HG22 ILE 92 2HG2 ILE 92 28.801 37.271 -20.912
723 HG23 ILE 92 3HG2 ILE 92 28.595 38.926 -20.322
724 HD11 ILE 92 1HD1 ILE 92 28.077 35.108 -20.780
725 HD12 ILE 92 2HD1 ILE 92 26.651 34.140 -20.352
726 HD13 ILE 92 3HD1 ILE 92 26.517 35.413 -21.589
727 H GLU 93 H GLU 93 27.562 40.370 -17.509
728 HA GLU 93 HA GLU 93 26.996 42.465 -19.546
729 HB2 GLU 93 1HB GLU 93 27.015 44.022 -17.516
730 HB3 GLU 93 2HB GLU 93 25.565 43.053 -17.785
731 HG2 GLU 93 1HG GLU 93 26.000 41.636 -15.979
732 HG3 GLU 93 2HG GLU 93 27.710 42.090 -15.918
733 H GLU 94 H GLU 94 28.684 43.948 -19.856
734 HA GLU 94 HA GLU 94 31.242 43.411 -18.487
735 HB2 GLU 94 1HB GLU 94 30.588 42.105 -20.869
736 HB3 GLU 94 2HB GLU 94 31.471 43.532 -21.420
737 HG2 GLU 94 1HG GLU 94 32.504 41.609 -19.319
738 HG3 GLU 94 2HG GLU 94 32.867 41.479 -21.049
739 H ASP 95 H ASP 95 32.703 45.130 -18.788
740 HA ASP 95 HA ASP 95 31.842 47.526 -20.279
741 HB2 ASP 95 1HB ASP 95 30.696 47.587 -17.992
742 HB3 ASP 95 2HB ASP 95 32.305 47.682 -17.272
743 H ILE 96 H ILE 96 33.848 45.891 -20.868
744 HA ILE 96 HA ILE 96 36.036 45.362 -20.897
745 HB ILE 96 HB ILE 96 37.539 47.207 -21.580
746 HG12 ILE 96 1HG1 ILE 96 35.170 49.079 -21.240
747 HG13 ILE 96 2HG1 ILE 96 36.411 48.905 -20.002
748 HG21 ILE 96 1HG2 ILE 96 36.329 47.728 -23.647
749 HG22 ILE 96 2HG2 ILE 96 35.930 46.068 -23.163
750 HG23 ILE 96 3HG2 ILE 96 34.766 47.380 -22.872
751 HD11 ILE 96 1HD1 ILE 96 38.149 49.619 -21.637
752 HD12 ILE 96 2HD1 ILE 96 36.867 49.863 -22.855
753 HD13 ILE 96 3HD1 ILE 96 36.898 50.851 -21.380
754 H ARG 97 H ARG 97 35.171 45.285 -18.289
755 HA ARG 97 HA ARG 97 37.299 46.502 -16.626
756 HB2 ARG 97 1HB ARG 97 35.976 45.388 -14.748
757 HB3 ARG 97 2HB ARG 97 35.162 46.661 -15.656
758 HG2 ARG 97 1HG ARG 97 33.957 44.973 -16.979
759 HG3 ARG 97 2HG ARG 97 34.720 43.683 -16.039
760 HD2 ARG 97 1HD ARG 97 33.625 44.543 -14.013
761 HD3 ARG 97 2HD ARG 97 32.933 45.882 -14.958
762 HE ARG 97 HE ARG 97 32.274 43.324 -16.119
763 HH11 ARG 97 1HH1 ARG 97 31.264 45.524 -13.537
764 HH12 ARG 97 2HH1 ARG 97 29.634 44.891 -13.533
765 HH21 ARG 97 1HH2 ARG 97 30.163 42.588 -16.027
766 HH22 ARG 97 2HH2 ARG 97 29.040 43.303 -14.876
767 H GLN 98 H GLN 98 38.513 45.009 -18.330
768 HA GLN 98 HA GLN 98 38.866 42.239 -17.669
769 HB2 GLN 98 1HB GLN 98 39.553 43.276 -19.862
770 HB3 GLN 98 2HB GLN 98 40.839 44.158 -19.027
771 HG2 GLN 98 1HG GLN 98 41.817 42.171 -20.060
772 HG3 GLN 98 2HG GLN 98 41.849 41.945 -18.315
773 HE21 GLN 98 1HE2 GLN 98 39.935 39.045 -18.379
774 HE22 GLN 98 2HE2 GLN 98 40.914 40.162 -17.462
775 HXT GLN 98 HO GLN 98 40.846 42.233 -15.027
Start of MODEL 6
1 H1 SER 1 1H SER 1 -8.986 10.759 -2.241
2 H2 SER 1 2H SER 1 -9.148 10.551 -0.673
3 H3 SER 1 3H SER 1 -8.455 9.428 -1.611
4 HA SER 1 HA SER 1 -7.206 11.913 -0.620
5 HB2 SER 1 1HB SER 1 -6.380 9.033 -0.105
6 HB3 SER 1 2HB SER 1 -5.977 10.492 0.838
7 HG SER 1 HG SER 1 -7.654 9.355 1.882
8 H GLN 2 H GLN 2 -7.512 10.779 -3.380
9 HA GLN 2 HA GLN 2 -4.650 10.305 -4.076
10 HB2 GLN 2 1HB GLN 2 -7.194 10.025 -5.716
11 HB3 GLN 2 2HB GLN 2 -5.559 9.701 -6.311
12 HG2 GLN 2 1HG GLN 2 -5.300 7.924 -4.600
13 HG3 GLN 2 2HG GLN 2 -6.956 8.223 -4.052
14 HE21 GLN 2 1HE2 GLN 2 -8.267 5.974 -6.327
15 HE22 GLN 2 2HE2 GLN 2 -8.319 6.737 -4.756
16 H GLN 3 H GLN 3 -3.448 11.723 -5.167
17 HA GLN 3 HA GLN 3 -4.748 14.003 -6.579
18 HB2 GLN 3 1HB GLN 3 -2.373 14.177 -4.666
19 HB3 GLN 3 2HB GLN 3 -2.818 15.430 -5.826
20 HG2 GLN 3 1HG GLN 3 -3.772 16.244 -3.889
21 HG3 GLN 3 2HG GLN 3 -5.139 15.415 -4.646
22 HE21 GLN 3 1HE2 GLN 3 -5.719 13.627 -1.730
23 HE22 GLN 3 2HE2 GLN 3 -6.341 14.480 -3.124
24 H SER 4 H SER 4 -3.009 14.886 -8.174
25 HA SER 4 HA SER 4 -2.196 12.747 -9.799
26 HB2 SER 4 1HB SER 4 -0.605 15.090 -10.319
27 HB3 SER 4 2HB SER 4 -2.004 14.461 -11.221
28 HG SER 4 HG SER 4 -2.420 16.554 -10.398
29 H HIS 5 H HIS 5 -0.320 14.522 -7.372
30 HA HIS 5 HA HIS 5 1.825 14.299 -6.608
31 HB2 HIS 5 1HB HIS 5 0.380 12.174 -5.990
32 HB3 HIS 5 2HB HIS 5 1.580 11.332 -6.972
33 HD1 HIS 5 HD1 HIS 5 4.216 11.954 -6.148
34 HD2 HIS 5 HD2 HIS 5 1.101 12.487 -3.428
35 HE1 HIS 5 HE1 HIS 5 5.257 12.043 -3.832
36 H SER 6 H SER 6 1.931 14.824 -9.391
37 HA SER 6 HA SER 6 3.802 12.961 -10.639
38 HB2 SER 6 1HB SER 6 2.068 14.222 -11.921
39 HB3 SER 6 2HB SER 6 2.898 15.738 -11.507
40 HG SER 6 HG SER 6 3.548 14.972 -13.550
41 H SER 7 H SER 7 5.955 13.614 -11.391
42 HA SER 7 HA SER 7 7.141 15.925 -9.965
43 HB2 SER 7 1HB SER 7 8.329 13.125 -9.949
44 HB3 SER 7 2HB SER 7 9.060 14.582 -9.241
45 HG SER 7 HG SER 7 6.664 14.483 -8.232
46 HA PRO 8 HA PRO 8 8.814 16.114 -14.089
47 HB2 PRO 8 1HB PRO 8 10.403 18.297 -13.906
48 HB3 PRO 8 2HB PRO 8 8.622 18.443 -13.758
49 HG2 PRO 8 1HG PRO 8 10.687 18.238 -11.581
50 HG3 PRO 8 2HG PRO 8 9.400 19.466 -11.793
51 HD2 PRO 8 1HD PRO 8 9.088 17.314 -10.172
52 HD3 PRO 8 2HD PRO 8 7.727 17.985 -11.136
53 H GLY 9 H GLY 9 10.920 16.106 -15.220
54 HA2 GLY 9 1HA GLY 9 13.177 15.128 -13.533
55 HA3 GLY 9 2HA GLY 9 12.676 14.233 -14.975
56 H GLU 10 H GLU 10 12.359 17.609 -15.099
57 HA GLU 10 HA GLU 10 14.647 17.803 -17.010
58 HB2 GLU 10 1HB GLU 10 12.133 19.478 -16.657
59 HB3 GLU 10 2HB GLU 10 13.375 19.762 -17.887
60 HG2 GLU 10 1HG GLU 10 12.873 17.677 -18.987
61 HG3 GLU 10 2HG GLU 10 11.798 17.174 -17.672
62 H ILE 11 H ILE 11 14.870 17.900 -14.076
63 HA ILE 11 HA ILE 11 15.080 20.660 -13.336
64 HB ILE 11 HB ILE 11 15.138 17.868 -12.168
65 HG12 ILE 11 1HG1 ILE 11 12.962 18.816 -12.611
66 HG13 ILE 11 2HG1 ILE 11 13.199 18.586 -10.883
67 HG21 ILE 11 1HG2 ILE 11 16.806 18.777 -10.986
68 HG22 ILE 11 2HG2 ILE 11 15.936 20.300 -10.687
69 HG23 ILE 11 3HG2 ILE 11 15.385 18.779 -9.933
70 HD11 ILE 11 1HD1 ILE 11 12.024 20.684 -11.263
71 HD12 ILE 11 2HD1 ILE 11 13.646 21.058 -10.647
72 HD13 ILE 11 3HD1 ILE 11 13.280 21.250 -12.379
73 H THR 12 H THR 12 16.847 18.901 -15.207
74 HA THR 12 HA THR 12 19.511 19.118 -14.043
75 HB THR 12 HB THR 12 20.226 18.487 -16.372
76 HG1 THR 12 HG1 THR 12 18.367 19.294 -17.448
77 HG21 THR 12 1HG2 THR 12 19.414 16.180 -16.209
78 HG22 THR 12 2HG2 THR 12 18.113 16.685 -15.110
79 HG23 THR 12 3HG2 THR 12 19.814 16.789 -14.586
80 H SER 13 H SER 13 19.668 21.305 -13.563
81 HA SER 13 HA SER 13 20.817 22.914 -15.717
82 HB2 SER 13 1HB SER 13 18.383 23.439 -15.934
83 HB3 SER 13 2HB SER 13 18.340 23.888 -14.217
84 HG SER 13 HG SER 13 18.633 25.640 -15.806
85 H SER 14 H SER 14 21.800 24.903 -14.680
86 HA SER 14 HA SER 14 22.392 24.385 -11.795
87 HB2 SER 14 1HB SER 14 24.162 25.625 -13.929
88 HB3 SER 14 2HB SER 14 24.612 25.324 -12.239
89 HG SER 14 HG SER 14 25.361 23.615 -13.449
90 HA PRO 15 HA PRO 15 20.913 28.708 -12.608
91 HB2 PRO 15 1HB PRO 15 18.657 28.941 -11.083
92 HB3 PRO 15 2HB PRO 15 18.644 28.268 -12.746
93 HG2 PRO 15 1HG PRO 15 18.729 26.808 -10.119
94 HG3 PRO 15 2HG PRO 15 17.638 26.556 -11.519
95 HD2 PRO 15 1HD PRO 15 19.840 25.035 -11.145
96 HD3 PRO 15 2HD PRO 15 19.310 25.535 -12.787
97 H GLN 16 H GLN 16 20.773 27.082 -9.404
98 HA GLN 16 HA GLN 16 21.181 29.602 -8.015
99 HB2 GLN 16 1HB GLN 16 21.216 26.733 -7.014
100 HB3 GLN 16 2HB GLN 16 21.260 28.174 -5.989
101 HG2 GLN 16 1HG GLN 16 19.064 28.869 -6.961
102 HG3 GLN 16 2HG GLN 16 18.986 27.303 -7.783
103 HE21 GLN 16 1HE2 GLN 16 17.712 27.614 -4.035
104 HE22 GLN 16 2HE2 GLN 16 17.956 28.944 -5.138
105 H GLY 17 H GLY 17 23.364 29.070 -9.844
106 HA2 GLY 17 1HA GLY 17 25.655 29.294 -9.806
107 HA3 GLY 17 2HA GLY 17 25.470 29.809 -8.126
108 H LEU 18 H LEU 18 24.595 26.523 -9.151
109 HA LEU 18 HA LEU 18 26.314 25.468 -7.112
110 HB2 LEU 18 1HB LEU 18 25.559 23.346 -7.668
111 HB3 LEU 18 2HB LEU 18 24.212 24.463 -7.749
112 HG LEU 18 HG LEU 18 24.753 24.439 -10.334
113 HD11 LEU 18 1HD1 LEU 18 25.595 22.328 -11.108
114 HD12 LEU 18 2HD1 LEU 18 25.674 21.691 -9.445
115 HD13 LEU 18 3HD1 LEU 18 26.774 22.980 -9.954
116 HD21 LEU 18 1HD2 LEU 18 23.102 22.604 -10.516
117 HD22 LEU 18 2HD2 LEU 18 22.658 23.779 -9.256
118 HD23 LEU 18 3HD2 LEU 18 23.370 22.212 -8.801
119 H ASP 19 H ASP 19 26.804 26.081 -10.511
120 HA ASP 19 HA ASP 19 29.434 24.687 -10.427
121 HB2 ASP 19 1HB ASP 19 27.850 26.048 -12.637
122 HB3 ASP 19 2HB ASP 19 29.506 25.459 -12.854
123 H ASN 20 H ASN 20 28.138 27.593 -9.506
124 HA ASN 20 HA ASN 20 30.666 29.054 -10.037
125 HB2 ASN 20 1HB ASN 20 27.778 29.999 -10.242
126 HB3 ASN 20 2HB ASN 20 29.170 31.059 -10.219
127 HD21 ASN 20 1HD2 ASN 20 30.099 30.509 -13.530
128 HD22 ASN 20 2HD2 ASN 20 30.605 31.112 -11.978
129 HA PRO 21 HA PRO 21 29.612 29.003 -5.502
130 HB2 PRO 21 1HB PRO 21 32.309 28.994 -4.781
131 HB3 PRO 21 2HB PRO 21 31.329 27.519 -4.972
132 HG2 PRO 21 1HG PRO 21 33.143 28.839 -6.921
133 HG3 PRO 21 2HG PRO 21 33.026 27.118 -6.504
134 HD2 PRO 21 1HD PRO 21 31.938 27.994 -8.706
135 HD3 PRO 21 2HD PRO 21 31.041 26.836 -7.660
136 H ALA 22 H ALA 22 31.962 30.773 -7.513
137 HA ALA 22 HA ALA 22 32.423 32.913 -5.706
138 HB1 ALA 22 1HB ALA 22 33.139 34.155 -7.732
139 HB2 ALA 22 2HB ALA 22 33.820 32.513 -7.683
140 HB3 ALA 22 3HB ALA 22 32.445 32.875 -8.758
141 H LEU 23 H LEU 23 29.972 32.505 -8.287
142 HA LEU 23 HA LEU 23 28.839 35.131 -7.868
143 HB2 LEU 23 1HB LEU 23 27.594 32.685 -9.172
144 HB3 LEU 23 2HB LEU 23 27.008 34.339 -9.295
145 HG LEU 23 HG LEU 23 29.596 33.259 -10.457
146 HD11 LEU 23 1HD1 LEU 23 27.494 32.530 -11.583
147 HD12 LEU 23 2HD1 LEU 23 28.480 33.590 -12.609
148 HD13 LEU 23 3HD1 LEU 23 27.040 34.235 -11.796
149 HD21 LEU 23 1HD2 LEU 23 29.925 35.595 -9.853
150 HD22 LEU 23 2HD2 LEU 23 28.393 36.044 -10.642
151 HD23 LEU 23 3HD2 LEU 23 29.758 35.440 -11.615
152 H LEU 24 H LEU 24 28.028 31.825 -6.768
153 HA LEU 24 HA LEU 24 25.560 32.596 -5.539
154 HB2 LEU 24 1HB LEU 24 26.161 30.264 -6.062
155 HB3 LEU 24 2HB LEU 24 27.448 30.312 -4.863
156 HG LEU 24 HG LEU 24 25.845 30.573 -3.069
157 HD11 LEU 24 1HD1 LEU 24 24.085 31.875 -4.035
158 HD12 LEU 24 2HD1 LEU 24 23.387 30.345 -3.485
159 HD13 LEU 24 3HD1 LEU 24 23.711 30.590 -5.219
160 HD21 LEU 24 1HD2 LEU 24 25.154 28.339 -4.962
161 HD22 LEU 24 2HD2 LEU 24 24.689 28.408 -3.248
162 HD23 LEU 24 3HD2 LEU 24 26.401 28.353 -3.701
163 H ARG 25 H ARG 25 28.912 32.418 -4.340
164 HA ARG 25 HA ARG 25 28.361 32.967 -1.577
165 HB2 ARG 25 1HB ARG 25 30.586 32.272 -2.509
166 HB3 ARG 25 2HB ARG 25 30.713 33.819 -3.327
167 HG2 ARG 25 1HG ARG 25 30.406 34.715 -0.808
168 HG3 ARG 25 2HG ARG 25 31.108 33.128 -0.458
169 HD2 ARG 25 1HD ARG 25 32.908 34.680 -0.637
170 HD3 ARG 25 2HD ARG 25 32.937 33.685 -2.105
171 HE ARG 25 HE ARG 25 31.487 35.742 -3.001
172 HH11 ARG 25 1HH1 ARG 25 34.423 35.887 -1.024
173 HH12 ARG 25 2HH1 ARG 25 34.876 37.437 -1.685
174 HH21 ARG 25 1HH2 ARG 25 32.099 37.760 -3.733
175 HH22 ARG 25 2HH2 ARG 25 33.599 38.458 -3.178
176 H ASP 26 H ASP 26 28.923 35.040 -4.411
177 HA ASP 26 HA ASP 26 28.833 37.500 -2.997
178 HB2 ASP 26 1HB ASP 26 29.370 36.620 -5.535
179 HB3 ASP 26 2HB ASP 26 27.864 37.479 -5.776
180 H MET 27 H MET 27 26.264 35.667 -4.723
181 HA MET 27 HA MET 27 24.160 37.561 -4.285
182 HB2 MET 27 1HB MET 27 24.109 35.565 -5.832
183 HB3 MET 27 2HB MET 27 23.934 34.536 -4.404
184 HG2 MET 27 1HG MET 27 21.829 35.737 -3.830
185 HG3 MET 27 2HG MET 27 22.005 36.691 -5.310
186 HE1 MET 27 1HE MET 27 20.513 33.442 -3.748
187 HE2 MET 27 2HE MET 27 20.828 32.213 -4.992
188 HE3 MET 27 3HE MET 27 22.176 32.917 -4.075
189 H LEU 28 H LEU 28 25.279 34.762 -2.357
190 HA LEU 28 HA LEU 28 23.258 34.897 -0.377
191 HB2 LEU 28 1HB LEU 28 25.990 33.771 -0.600
192 HB3 LEU 28 2HB LEU 28 25.241 33.859 0.999
193 HG LEU 28 HG LEU 28 23.727 32.674 -1.316
194 HD11 LEU 28 1HD1 LEU 28 24.617 30.515 -0.693
195 HD12 LEU 28 2HD1 LEU 28 25.697 31.294 0.491
196 HD13 LEU 28 3HD1 LEU 28 25.897 31.617 -1.237
197 HD21 LEU 28 1HD2 LEU 28 23.733 32.209 1.687
198 HD22 LEU 28 2HD2 LEU 28 22.630 31.459 0.507
199 HD23 LEU 28 3HD2 LEU 28 22.580 33.202 0.797
200 H LEU 29 H LEU 29 26.481 36.400 -0.585
201 HA LEU 29 HA LEU 29 26.448 37.555 2.046
202 HB2 LEU 29 1HB LEU 29 27.848 38.295 -0.533
203 HB3 LEU 29 2HB LEU 29 28.055 39.251 0.929
204 HG LEU 29 HG LEU 29 28.676 36.293 0.840
205 HD11 LEU 29 1HD1 LEU 29 30.023 37.401 -0.871
206 HD12 LEU 29 2HD1 LEU 29 31.036 36.933 0.510
207 HD13 LEU 29 3HD1 LEU 29 30.542 38.632 0.307
208 HD21 LEU 29 1HD2 LEU 29 28.400 37.267 3.086
209 HD22 LEU 29 2HD2 LEU 29 29.597 38.522 2.694
210 HD23 LEU 29 3HD2 LEU 29 30.087 36.812 2.787
211 H ALA 30 H ALA 30 25.177 38.619 -1.065
212 HA ALA 30 HA ALA 30 24.401 41.235 -0.024
213 HB1 ALA 30 1HB ALA 30 23.465 41.560 -2.276
214 HB2 ALA 30 2HB ALA 30 25.118 40.906 -2.373
215 HB3 ALA 30 3HB ALA 30 23.719 39.838 -2.646
216 H ASN 31 H ASN 31 22.978 38.099 0.198
217 HA ASN 31 HA ASN 31 20.249 39.332 0.272
218 HB2 ASN 31 1HB ASN 31 20.766 37.592 -1.473
219 HB3 ASN 31 2HB ASN 31 20.898 36.410 -0.163
220 HD21 ASN 31 1HD2 ASN 31 17.417 36.839 -1.726
221 HD22 ASN 31 2HD2 ASN 31 18.999 36.925 -2.473
222 HA PRO 32 HA PRO 32 20.988 38.350 4.579
223 HB2 PRO 32 1HB PRO 32 18.858 39.697 5.664
224 HB3 PRO 32 2HB PRO 32 20.372 40.499 5.136
225 HG2 PRO 32 1HG PRO 32 17.796 40.171 3.608
226 HG3 PRO 32 2HG PRO 32 18.743 41.663 3.912
227 HD2 PRO 32 1HD PRO 32 19.007 40.344 1.616
228 HD3 PRO 32 2HD PRO 32 20.455 41.019 2.446
229 H HIS 33 H HIS 33 17.957 37.763 2.802
230 HA HIS 33 HA HIS 33 16.857 36.059 4.907
231 HB2 HIS 33 1HB HIS 33 15.427 37.218 3.237
232 HB3 HIS 33 2HB HIS 33 16.167 36.257 1.951
233 HD1 HIS 33 HD1 HIS 33 13.734 35.960 4.840
234 HD2 HIS 33 HD2 HIS 33 15.282 33.631 1.750
235 HE1 HIS 33 HE1 HIS 33 12.338 33.855 4.736
236 H GLU 34 H GLU 34 18.678 35.629 1.884
237 HA GLU 34 HA GLU 34 18.396 32.757 1.860
238 HB2 GLU 34 1HB GLU 34 19.245 34.750 0.126
239 HB3 GLU 34 2HB GLU 34 20.710 33.850 0.434
240 HG2 GLU 34 1HG GLU 34 18.167 32.445 -0.324
241 HG3 GLU 34 2HG GLU 34 19.154 33.238 -1.553
242 H LEU 35 H LEU 35 20.940 35.060 2.899
243 HA LEU 35 HA LEU 35 22.792 33.058 3.675
244 HB2 LEU 35 1HB LEU 35 24.059 34.701 4.405
245 HB3 LEU 35 2HB LEU 35 23.008 35.501 3.297
246 HG LEU 35 HG LEU 35 21.793 36.558 5.114
247 HD11 LEU 35 1HD1 LEU 35 22.051 35.244 7.051
248 HD12 LEU 35 2HD1 LEU 35 23.037 36.683 7.336
249 HD13 LEU 35 3HD1 LEU 35 23.817 35.149 6.860
250 HD21 LEU 35 1HD2 LEU 35 23.709 38.068 5.539
251 HD22 LEU 35 2HD2 LEU 35 23.637 37.501 3.855
252 HD23 LEU 35 3HD2 LEU 35 24.803 36.774 4.977
253 H SER 36 H SER 36 19.946 34.317 5.255
254 HA SER 36 HA SER 36 20.525 33.215 7.860
255 HB2 SER 36 1HB SER 36 17.945 34.260 6.664
256 HB3 SER 36 2HB SER 36 18.151 33.745 8.352
257 HG SER 36 HG SER 36 19.231 35.969 6.997
258 H LEU 37 H LEU 37 18.530 32.174 5.043
259 HA LEU 37 HA LEU 37 17.553 29.845 6.431
260 HB2 LEU 37 1HB LEU 37 16.685 29.144 4.453
261 HB3 LEU 37 2HB LEU 37 16.659 30.859 4.419
262 HG LEU 37 HG LEU 37 18.453 30.853 2.740
263 HD11 LEU 37 1HD1 LEU 37 17.733 27.935 2.616
264 HD12 LEU 37 2HD1 LEU 37 19.324 28.619 2.980
265 HD13 LEU 37 3HD1 LEU 37 18.640 28.824 1.370
266 HD21 LEU 37 1HD2 LEU 37 16.100 31.287 2.274
267 HD22 LEU 37 2HD2 LEU 37 15.796 29.542 2.132
268 HD23 LEU 37 3HD2 LEU 37 16.840 30.364 0.949
269 H LEU 38 H LEU 38 20.372 30.678 4.585
270 HA LEU 38 HA LEU 38 21.318 28.046 4.268
271 HB2 LEU 38 1HB LEU 38 21.992 30.089 3.096
272 HB3 LEU 38 2HB LEU 38 22.878 30.614 4.539
273 HG LEU 38 HG LEU 38 24.237 28.523 4.457
274 HD11 LEU 38 1HD1 LEU 38 22.855 28.212 1.788
275 HD12 LEU 38 2HD1 LEU 38 22.782 27.111 3.185
276 HD13 LEU 38 3HD1 LEU 38 24.299 27.307 2.297
277 HD21 LEU 38 1HD2 LEU 38 24.477 30.125 1.926
278 HD22 LEU 38 2HD2 LEU 38 25.763 29.256 2.783
279 HD23 LEU 38 3HD2 LEU 38 25.026 30.698 3.515
280 H LYS 39 H LYS 39 22.000 30.406 6.894
281 HA LYS 39 HA LYS 39 23.714 28.514 8.274
282 HB2 LYS 39 1HB LYS 39 23.295 29.941 10.312
283 HB3 LYS 39 2HB LYS 39 24.070 30.720 8.932
284 HG2 LYS 39 1HG LYS 39 22.056 31.863 8.347
285 HG3 LYS 39 2HG LYS 39 21.100 30.956 9.486
286 HD2 LYS 39 1HD LYS 39 21.422 33.044 10.481
287 HD3 LYS 39 2HD LYS 39 22.572 31.978 11.311
288 HE2 LYS 39 1HE LYS 39 24.396 32.811 9.883
289 HE3 LYS 39 2HE LYS 39 23.242 33.793 8.954
290 HZ1 LYS 39 1HZ LYS 39 22.766 35.036 10.965
291 HZ2 LYS 39 2HZ LYS 39 24.379 35.106 10.629
292 HZ3 LYS 39 3HZ LYS 39 23.829 34.126 11.837
293 H GLU 40 H GLU 40 20.244 28.938 8.188
294 HA GLU 40 HA GLU 40 19.792 27.210 10.490
295 HB2 GLU 40 1HB GLU 40 18.050 28.267 8.231
296 HB3 GLU 40 2HB GLU 40 17.429 27.184 9.493
297 HG2 GLU 40 1HG GLU 40 18.639 29.937 9.927
298 HG3 GLU 40 2HG GLU 40 16.921 29.526 10.013
299 H ARG 41 H ARG 41 19.409 26.762 6.921
300 HA ARG 41 HA ARG 41 18.817 23.915 7.267
301 HB2 ARG 41 1HB ARG 41 19.539 25.516 4.779
302 HB3 ARG 41 2HB ARG 41 18.879 23.874 4.795
303 HG2 ARG 41 1HG ARG 41 16.862 24.748 5.938
304 HG3 ARG 41 2HG ARG 41 17.491 26.385 5.771
305 HD2 ARG 41 1HD ARG 41 17.658 25.960 3.274
306 HD3 ARG 41 2HD ARG 41 16.730 24.474 3.535
307 HE ARG 41 HE ARG 41 15.240 26.499 4.740
308 HH11 ARG 41 1HH1 ARG 41 16.408 25.944 1.447
309 HH12 ARG 41 2HH1 ARG 41 15.084 26.822 0.733
310 HH21 ARG 41 1HH2 ARG 41 13.573 27.595 3.736
311 HH22 ARG 41 2HH2 ARG 41 13.521 27.725 1.998
312 H ASN 42 H ASN 42 21.705 25.745 6.460
313 HA ASN 42 HA ASN 42 23.270 23.193 6.374
314 HB2 ASN 42 1HB ASN 42 22.601 24.130 4.075
315 HB3 ASN 42 2HB ASN 42 23.719 25.433 4.382
316 HD21 ASN 42 1HD2 ASN 42 25.463 22.797 2.497
317 HD22 ASN 42 2HD2 ASN 42 24.171 23.936 2.248
318 HA PRO 43 HA PRO 43 25.281 26.600 8.811
319 HB2 PRO 43 1HB PRO 43 26.385 24.920 10.766
320 HB3 PRO 43 2HB PRO 43 24.865 25.860 10.896
321 HG2 PRO 43 1HG PRO 43 25.251 22.981 10.146
322 HG3 PRO 43 2HG PRO 43 24.033 23.723 11.226
323 HD2 PRO 43 1HD PRO 43 23.422 23.016 8.712
324 HD3 PRO 43 2HD PRO 43 22.765 24.527 9.435
325 HA PRO 44 HA PRO 44 29.454 24.705 8.114
326 HB2 PRO 44 1HB PRO 44 29.894 22.673 6.354
327 HB3 PRO 44 2HB PRO 44 29.592 22.403 8.102
328 HG2 PRO 44 1HG PRO 44 27.657 22.295 5.821
329 HG3 PRO 44 2HG PRO 44 27.972 21.073 7.091
330 HD2 PRO 44 1HD PRO 44 25.922 22.799 7.311
331 HD3 PRO 44 2HD PRO 44 26.901 22.349 8.746
332 H LEU 45 H LEU 45 27.130 24.651 5.311
333 HA LEU 45 HA LEU 45 29.169 25.840 3.569
334 HB2 LEU 45 1HB LEU 45 27.288 24.578 2.620
335 HB3 LEU 45 2HB LEU 45 26.163 25.758 3.283
336 HG LEU 45 HG LEU 45 26.940 27.468 1.762
337 HD11 LEU 45 1HD1 LEU 45 28.591 27.049 -0.013
338 HD12 LEU 45 2HD1 LEU 45 28.914 25.432 0.649
339 HD13 LEU 45 3HD1 LEU 45 29.347 26.882 1.580
340 HD21 LEU 45 1HD2 LEU 45 25.240 25.817 0.998
341 HD22 LEU 45 2HD2 LEU 45 26.541 24.848 0.268
342 HD23 LEU 45 3HD2 LEU 45 26.194 26.486 -0.337
343 H ALA 46 H ALA 46 26.664 26.862 5.802
344 HA ALA 46 HA ALA 46 26.692 29.609 5.058
345 HB1 ALA 46 1HB ALA 46 25.007 28.454 6.487
346 HB2 ALA 46 2HB ALA 46 26.185 28.496 7.815
347 HB3 ALA 46 3HB ALA 46 25.583 30.016 7.112
348 H GLU 47 H GLU 47 28.578 27.914 7.671
349 HA GLU 47 HA GLU 47 29.762 30.322 8.616
350 HB2 GLU 47 1HB GLU 47 31.373 28.973 9.761
351 HB3 GLU 47 2HB GLU 47 29.797 28.174 9.840
352 HG2 GLU 47 1HG GLU 47 30.499 26.657 8.019
353 HG3 GLU 47 2HG GLU 47 32.090 27.426 7.995
354 H ALA 48 H ALA 48 30.669 28.230 5.923
355 HA ALA 48 HA ALA 48 33.128 29.435 5.320
356 HB1 ALA 48 1HB ALA 48 31.041 28.162 3.537
357 HB2 ALA 48 2HB ALA 48 32.723 28.472 3.104
358 HB3 ALA 48 3HB ALA 48 32.348 27.312 4.391
359 H LEU 49 H LEU 49 29.806 30.172 4.331
360 HA LEU 49 HA LEU 49 30.489 32.244 2.493
361 HB2 LEU 49 1HB LEU 49 28.331 30.976 2.672
362 HB3 LEU 49 2HB LEU 49 27.973 31.818 4.157
363 HG LEU 49 HG LEU 49 26.789 32.516 2.057
364 HD11 LEU 49 1HD1 LEU 49 26.652 34.824 2.619
365 HD12 LEU 49 2HD1 LEU 49 28.143 34.717 3.571
366 HD13 LEU 49 3HD1 LEU 49 26.690 33.826 4.087
367 HD21 LEU 49 1HD2 LEU 49 27.849 34.094 0.602
368 HD22 LEU 49 2HD2 LEU 49 28.785 32.593 0.616
369 HD23 LEU 49 3HD2 LEU 49 29.352 34.012 1.529
370 H LEU 50 H LEU 50 29.665 32.199 5.966
371 HA LEU 50 HA LEU 50 29.373 34.997 6.249
372 HB2 LEU 50 1HB LEU 50 30.515 33.153 8.379
373 HB3 LEU 50 2HB LEU 50 29.673 34.671 8.633
374 HG LEU 50 HG LEU 50 28.565 31.989 7.960
375 HD11 LEU 50 1HD1 LEU 50 27.983 33.901 10.175
376 HD12 LEU 50 2HD1 LEU 50 29.001 32.435 10.246
377 HD13 LEU 50 3HD1 LEU 50 27.263 32.284 9.938
378 HD21 LEU 50 1HD2 LEU 50 27.070 34.590 7.718
379 HD22 LEU 50 2HD2 LEU 50 26.296 32.987 7.848
380 HD23 LEU 50 3HD2 LEU 50 27.333 33.349 6.460
381 H SER 51 H SER 51 32.212 32.947 6.179
382 HA SER 51 HA SER 51 34.039 34.843 7.334
383 HB2 SER 51 1HB SER 51 34.455 32.428 5.586
384 HB3 SER 51 2HB SER 51 35.698 33.245 6.532
385 HG SER 51 HG SER 51 33.371 31.945 7.552
386 H GLY 52 H GLY 52 32.725 34.331 4.129
387 HA2 GLY 52 1HA GLY 52 32.926 35.786 2.320
388 HA3 GLY 52 2HA GLY 52 34.249 36.628 3.135
389 H ASP 53 H ASP 53 35.424 33.779 3.551
390 HA ASP 53 HA ASP 53 37.311 33.862 1.415
391 HB2 ASP 53 1HB ASP 53 37.636 32.717 3.675
392 HB3 ASP 53 2HB ASP 53 36.555 31.518 3.101
393 H LEU 54 H LEU 54 36.939 33.374 -0.676
394 HA LEU 54 HA LEU 54 34.673 31.806 -1.503
395 HB2 LEU 54 1HB LEU 54 35.803 33.513 -2.903
396 HB3 LEU 54 2HB LEU 54 37.221 32.482 -3.008
397 HG LEU 54 HG LEU 54 35.529 32.615 -4.938
398 HD11 LEU 54 1HD1 LEU 54 36.473 29.871 -4.124
399 HD12 LEU 54 2HD1 LEU 54 37.495 31.115 -4.866
400 HD13 LEU 54 3HD1 LEU 54 36.119 30.445 -5.766
401 HD21 LEU 54 1HD2 LEU 54 34.105 30.457 -3.392
402 HD22 LEU 54 2HD2 LEU 54 33.767 30.991 -5.041
403 HD23 LEU 54 3HD2 LEU 54 33.483 32.096 -3.684
404 H GLU 55 H GLU 55 38.110 31.070 -0.839
405 HA GLU 55 HA GLU 55 38.158 28.517 -2.066
406 HB2 GLU 55 1HB GLU 55 39.563 29.340 0.492
407 HB3 GLU 55 2HB GLU 55 40.021 28.013 -0.569
408 HG2 GLU 55 1HG GLU 55 40.031 30.954 -1.266
409 HG3 GLU 55 2HG GLU 55 41.418 29.966 -0.827
410 H LYS 56 H LYS 56 37.503 29.324 1.377
411 HA LYS 56 HA LYS 56 36.839 26.635 2.029
412 HB2 LYS 56 1HB LYS 56 36.209 27.347 4.159
413 HB3 LYS 56 2HB LYS 56 37.431 28.566 3.645
414 HG2 LYS 56 1HG LYS 56 35.411 29.928 3.038
415 HG3 LYS 56 2HG LYS 56 34.563 28.778 4.046
416 HD2 LYS 56 1HD LYS 56 37.099 30.037 5.061
417 HD3 LYS 56 2HD LYS 56 35.585 30.915 5.142
418 HE2 LYS 56 1HE LYS 56 34.563 29.146 6.499
419 HE3 LYS 56 2HE LYS 56 36.059 28.194 6.395
420 HZ1 LYS 56 1HZ LYS 56 35.976 29.392 8.456
421 HZ2 LYS 56 2HZ LYS 56 35.728 30.835 7.696
422 HZ3 LYS 56 3HZ LYS 56 37.176 30.053 7.535
423 H PHE 57 H PHE 57 34.862 29.353 0.817
424 HA PHE 57 HA PHE 57 32.354 28.021 1.143
425 HB2 PHE 57 1HB PHE 57 32.636 30.449 0.728
426 HB3 PHE 57 2HB PHE 57 33.147 30.092 -0.926
427 HD1 PHE 57 HD1 PHE 57 31.541 29.522 -2.644
428 HD2 PHE 57 HD2 PHE 57 30.288 30.036 1.441
429 HE1 PHE 57 HE1 PHE 57 29.161 29.540 -3.371
430 HE2 PHE 57 HE2 PHE 57 27.908 30.066 0.713
431 HZ PHE 57 HZ PHE 57 27.346 29.799 -1.697
432 H SER 58 H SER 58 34.485 28.226 -1.754
433 HA SER 58 HA SER 58 32.848 26.609 -3.428
434 HB2 SER 58 1HB SER 58 34.735 28.038 -4.190
435 HB3 SER 58 2HB SER 58 35.878 26.944 -3.387
436 HG SER 58 HG SER 58 35.765 26.335 -5.509
437 H ARG 59 H ARG 59 35.434 25.775 -1.123
438 HA ARG 59 HA ARG 59 35.619 23.022 -1.947
439 HB2 ARG 59 1HB ARG 59 37.394 24.128 -0.666
440 HB3 ARG 59 2HB ARG 59 36.297 24.366 0.699
441 HG2 ARG 59 1HG ARG 59 36.479 21.543 -0.142
442 HG3 ARG 59 2HG ARG 59 38.046 22.214 0.336
443 HD2 ARG 59 1HD ARG 59 37.355 22.651 2.519
444 HD3 ARG 59 2HD ARG 59 35.639 22.708 2.080
445 HE ARG 59 HE ARG 59 36.306 20.094 1.565
446 HH11 ARG 59 1HH1 ARG 59 36.653 22.116 4.442
447 HH12 ARG 59 2HH1 ARG 59 36.483 20.760 5.522
448 HH21 ARG 59 1HH2 ARG 59 36.051 18.424 2.991
449 HH22 ARG 59 2HH2 ARG 59 36.172 18.709 4.717
450 H VAL 60 H VAL 60 33.801 24.660 0.694
451 HA VAL 60 HA VAL 60 32.700 22.129 1.544
452 HB VAL 60 HB VAL 60 32.963 24.122 3.063
453 HG11 VAL 60 1HG1 VAL 60 31.211 25.750 3.128
454 HG12 VAL 60 2HG1 VAL 60 32.243 25.864 1.706
455 HG13 VAL 60 3HG1 VAL 60 30.657 25.131 1.574
456 HG21 VAL 60 1HG2 VAL 60 30.140 23.046 2.950
457 HG22 VAL 60 2HG2 VAL 60 31.534 22.158 3.612
458 HG23 VAL 60 3HG2 VAL 60 31.003 23.669 4.376
459 H LEU 61 H LEU 61 31.789 24.580 -0.843
460 HA LEU 61 HA LEU 61 29.080 23.876 -1.195
461 HB2 LEU 61 1HB LEU 61 30.384 25.794 -2.245
462 HB3 LEU 61 2HB LEU 61 31.029 24.640 -3.394
463 HG LEU 61 HG LEU 61 28.346 24.220 -3.715
464 HD11 LEU 61 1HD1 LEU 61 28.770 27.169 -3.144
465 HD12 LEU 61 2HD1 LEU 61 27.844 26.037 -2.119
466 HD13 LEU 61 3HD1 LEU 61 27.280 26.412 -3.765
467 HD21 LEU 61 1HD2 LEU 61 28.533 25.287 -5.784
468 HD22 LEU 61 2HD2 LEU 61 30.228 24.895 -5.428
469 HD23 LEU 61 3HD2 LEU 61 29.605 26.545 -5.168
470 H VAL 62 H VAL 62 31.997 22.483 -2.843
471 HA VAL 62 HA VAL 62 30.319 20.672 -4.350
472 HB VAL 62 HB VAL 62 32.535 21.396 -5.175
473 HG11 VAL 62 1HG1 VAL 62 33.710 19.595 -3.019
474 HG12 VAL 62 2HG1 VAL 62 34.606 20.368 -4.343
475 HG13 VAL 62 3HG1 VAL 62 33.837 21.370 -3.104
476 HG21 VAL 62 1HG2 VAL 62 31.450 19.337 -6.031
477 HG22 VAL 62 2HG2 VAL 62 33.223 19.238 -6.095
478 HG23 VAL 62 3HG2 VAL 62 32.331 18.381 -4.815
479 H GLU 63 H GLU 63 32.052 20.419 -1.268
480 HA GLU 63 HA GLU 63 31.689 17.599 -0.900
481 HB2 GLU 63 1HB GLU 63 31.791 19.851 1.138
482 HB3 GLU 63 2HB GLU 63 31.924 18.133 1.530
483 HG2 GLU 63 1HG GLU 63 33.838 19.313 -0.467
484 HG3 GLU 63 2HG GLU 63 34.056 19.688 1.246
485 H GLN 64 H GLN 64 29.665 20.437 -0.149
486 HA GLN 64 HA GLN 64 27.546 18.924 1.086
487 HB2 GLN 64 1HB GLN 64 27.754 21.685 -0.129
488 HB3 GLN 64 2HB GLN 64 26.207 21.046 0.435
489 HG2 GLN 64 1HG GLN 64 28.694 21.279 2.157
490 HG3 GLN 64 2HG GLN 64 27.367 22.446 2.127
491 HE21 GLN 64 1HE2 GLN 64 27.110 19.471 4.654
492 HE22 GLN 64 2HE2 GLN 64 28.570 20.169 3.999
493 H GLN 65 H GLN 65 28.179 19.900 -2.322
494 HA GLN 65 HA GLN 65 25.583 19.042 -3.233
495 HB2 GLN 65 1HB GLN 65 28.246 19.344 -4.642
496 HB3 GLN 65 2HB GLN 65 26.779 18.790 -5.462
497 HG2 GLN 65 1HG GLN 65 25.629 20.881 -4.770
498 HG3 GLN 65 2HG GLN 65 27.148 21.462 -4.088
499 HE21 GLN 65 1HE2 GLN 65 28.234 22.737 -7.126
500 HE22 GLN 65 2HE2 GLN 65 28.306 22.731 -5.375
501 H GLN 66 H GLN 66 28.713 17.333 -2.844
502 HA GLN 66 HA GLN 66 27.859 14.882 -4.050
503 HB2 GLN 66 1HB GLN 66 29.864 15.452 -1.842
504 HB3 GLN 66 2HB GLN 66 29.633 13.856 -2.562
505 HG2 GLN 66 1HG GLN 66 30.320 14.692 -4.744
506 HG3 GLN 66 2HG GLN 66 30.477 16.327 -4.095
507 HE21 GLN 66 1HE2 GLN 66 33.584 15.800 -2.565
508 HE22 GLN 66 2HE2 GLN 66 32.217 16.863 -2.795
509 H ASP 67 H ASP 67 27.683 16.081 -0.659
510 HA ASP 67 HA ASP 67 26.491 13.636 0.305
511 HB2 ASP 67 1HB ASP 67 27.637 15.428 1.690
512 HB3 ASP 67 2HB ASP 67 26.165 16.385 1.508
513 H ARG 68 H ARG 68 25.146 16.748 -0.852
514 HA ARG 68 HA ARG 68 22.418 16.217 -0.188
515 HB2 ARG 68 1HB ARG 68 23.773 17.856 -2.337
516 HB3 ARG 68 2HB ARG 68 22.020 17.651 -2.356
517 HG2 ARG 68 1HG ARG 68 21.754 18.752 -0.270
518 HG3 ARG 68 2HG ARG 68 23.494 18.699 0.071
519 HD2 ARG 68 1HD ARG 68 22.801 20.944 -0.659
520 HD3 ARG 68 2HD ARG 68 23.945 20.210 -1.799
521 HE ARG 68 HE ARG 68 21.644 19.526 -2.982
522 HH11 ARG 68 1HH1 ARG 68 22.540 22.676 -1.635
523 HH12 ARG 68 2HH1 ARG 68 21.548 23.542 -2.778
524 HH21 ARG 68 1HH2 ARG 68 20.416 20.708 -4.402
525 HH22 ARG 68 2HH2 ARG 68 20.372 22.450 -4.309
526 H ALA 69 H ALA 69 24.351 15.245 -3.030
527 HA ALA 69 HA ALA 69 22.186 14.176 -4.523
528 HB1 ALA 69 1HB ALA 69 23.911 12.870 -5.698
529 HB2 ALA 69 2HB ALA 69 24.466 14.538 -5.422
530 HB3 ALA 69 3HB ALA 69 25.080 13.216 -4.401
531 H ARG 70 H ARG 70 23.958 12.795 -1.717
532 HA ARG 70 HA ARG 70 22.866 10.159 -2.129
533 HB2 ARG 70 1HB ARG 70 24.447 9.638 -0.631
534 HB3 ARG 70 2HB ARG 70 25.006 11.304 -0.840
535 HG2 ARG 70 1HG ARG 70 23.535 11.938 1.072
536 HG3 ARG 70 2HG ARG 70 23.240 10.250 1.290
537 HD2 ARG 70 1HD ARG 70 25.901 11.662 1.387
538 HD3 ARG 70 2HD ARG 70 25.021 11.033 2.787
539 HE ARG 70 HE ARG 70 25.418 8.819 1.176
540 HH11 ARG 70 1HH1 ARG 70 27.572 11.235 2.586
541 HH12 ARG 70 2HH1 ARG 70 28.917 10.124 2.674
542 HH21 ARG 70 1HH2 ARG 70 27.178 7.450 1.321
543 HH22 ARG 70 2HH2 ARG 70 28.692 8.017 1.968
544 H ARG 71 H ARG 71 21.961 13.140 -0.463
545 HA ARG 71 HA ARG 71 19.847 11.893 1.148
546 HB2 ARG 71 1HB ARG 71 20.028 14.818 0.322
547 HB3 ARG 71 2HB ARG 71 19.155 14.138 1.693
548 HG2 ARG 71 1HG ARG 71 22.144 14.397 1.367
549 HG3 ARG 71 2HG ARG 71 21.122 15.279 2.489
550 HD2 ARG 71 1HD ARG 71 20.643 13.241 3.706
551 HD3 ARG 71 2HD ARG 71 21.536 12.285 2.503
552 HE ARG 71 HE ARG 71 23.364 14.195 3.390
553 HH11 ARG 71 1HH1 ARG 71 21.526 11.604 4.970
554 HH12 ARG 71 2HH1 ARG 71 22.764 11.356 6.171
555 HH21 ARG 71 1HH2 ARG 71 24.871 13.802 4.879
556 HH22 ARG 71 2HH2 ARG 71 24.636 12.600 6.134
557 H GLU 72 H GLU 72 20.209 13.306 -2.009
558 HA GLU 72 HA GLU 72 17.525 13.831 -2.701
559 HB2 GLU 72 1HB GLU 72 19.995 13.877 -3.972
560 HB3 GLU 72 2HB GLU 72 19.129 12.619 -4.849
561 HG2 GLU 72 1HG GLU 72 18.642 14.535 -6.068
562 HG3 GLU 72 2HG GLU 72 17.214 14.358 -5.034
563 H GLN 73 H GLN 73 19.333 10.796 -2.617
564 HA GLN 73 HA GLN 73 17.517 9.171 -4.056
565 HB2 GLN 73 1HB GLN 73 19.165 8.346 -1.636
566 HB3 GLN 73 2HB GLN 73 18.570 7.298 -2.927
567 HG2 GLN 73 1HG GLN 73 20.705 9.452 -3.145
568 HG3 GLN 73 2HG GLN 73 20.945 7.707 -3.232
569 HE21 GLN 73 1HE2 GLN 73 20.409 9.700 -6.579
570 HE22 GLN 73 2HE2 GLN 73 20.970 10.366 -5.059
571 H GLU 74 H GLU 74 17.571 10.135 -0.620
572 HA GLU 74 HA GLU 74 15.164 8.564 -0.017
573 HB2 GLU 74 1HB GLU 74 16.614 10.669 1.634
574 HB3 GLU 74 2HB GLU 74 15.374 9.545 2.206
575 HG2 GLU 74 1HG GLU 74 16.980 7.683 1.381
576 HG3 GLU 74 2HG GLU 74 18.217 8.951 1.361
577 H ARG 75 H ARG 75 15.919 11.864 -0.929
578 HA ARG 75 HA ARG 75 13.551 13.117 0.040
579 HB2 ARG 75 1HB ARG 75 15.477 13.664 -2.184
580 HB3 ARG 75 2HB ARG 75 14.026 14.647 -2.027
581 HG2 ARG 75 1HG ARG 75 14.644 15.338 0.215
582 HG3 ARG 75 2HG ARG 75 16.076 14.289 0.189
583 HD2 ARG 75 1HD ARG 75 17.149 15.591 -1.444
584 HD3 ARG 75 2HD ARG 75 15.643 16.383 -1.931
585 HE ARG 75 HE ARG 75 16.157 17.043 0.773
586 HH11 ARG 75 1HH1 ARG 75 17.511 17.704 -2.434
587 HH12 ARG 75 2HH1 ARG 75 18.069 19.293 -1.951
588 HH21 ARG 75 1HH2 ARG 75 16.920 19.067 1.300
589 HH22 ARG 75 2HH2 ARG 75 17.755 20.037 0.119
590 H ILE 76 H ILE 76 14.001 11.078 -2.762
591 HA ILE 76 HA ILE 76 11.702 11.899 -4.218
592 HB ILE 76 HB ILE 76 11.769 9.806 -5.386
593 HG12 ILE 76 1HG1 ILE 76 13.398 8.746 -3.054
594 HG13 ILE 76 2HG1 ILE 76 11.756 8.283 -3.480
595 HG21 ILE 76 1HG2 ILE 76 14.023 9.807 -6.192
596 HG22 ILE 76 2HG2 ILE 76 13.740 11.458 -5.613
597 HG23 ILE 76 3HG2 ILE 76 14.680 10.316 -4.623
598 HD11 ILE 76 1HD1 ILE 76 12.640 7.372 -5.667
599 HD12 ILE 76 2HD1 ILE 76 14.286 7.664 -5.045
600 HD13 ILE 76 3HD1 ILE 76 13.211 6.524 -4.211
601 H ARG 77 H ARG 77 11.882 10.232 -1.152
602 HA ARG 77 HA ARG 77 9.240 9.012 -1.255
603 HB2 ARG 77 1HB ARG 77 10.867 10.021 1.091
604 HB3 ARG 77 2HB ARG 77 9.434 9.009 1.219
605 HG2 ARG 77 1HG ARG 77 10.555 7.139 0.216
606 HG3 ARG 77 2HG ARG 77 11.913 8.157 -0.303
607 HD2 ARG 77 1HD ARG 77 12.269 8.697 2.160
608 HD3 ARG 77 2HD ARG 77 11.181 7.339 2.514
609 HE ARG 77 HE ARG 77 13.004 6.236 0.797
610 HH11 ARG 77 1HH1 ARG 77 13.440 8.104 3.763
611 HH12 ARG 77 2HH1 ARG 77 15.005 7.380 4.088
612 HH21 ARG 77 1HH2 ARG 77 14.986 5.331 1.336
613 HH22 ARG 77 2HH2 ARG 77 15.834 5.870 2.771
614 H LEU 78 H LEU 78 10.180 12.213 -1.270
615 HA LEU 78 HA LEU 78 9.193 14.185 -1.213
616 HB2 LEU 78 1HB LEU 78 7.598 12.976 -2.529
617 HB3 LEU 78 2HB LEU 78 6.683 12.594 -1.109
618 HG LEU 78 HG LEU 78 5.691 14.293 -2.638
619 HD11 LEU 78 1HD1 LEU 78 6.143 15.417 0.140
620 HD12 LEU 78 2HD1 LEU 78 5.008 14.104 -0.243
621 HD13 LEU 78 3HD1 LEU 78 4.779 15.717 -0.951
622 HD21 LEU 78 1HD2 LEU 78 7.787 16.197 -1.535
623 HD22 LEU 78 2HD2 LEU 78 6.494 16.561 -2.688
624 HD23 LEU 78 3HD2 LEU 78 7.823 15.487 -3.167
625 H PHE 79 H PHE 79 9.055 15.720 0.111
626 HA PHE 79 HA PHE 79 7.921 15.335 2.832
627 HB2 PHE 79 1HB PHE 79 10.716 16.383 2.179
628 HB3 PHE 79 2HB PHE 79 9.981 16.355 3.785
629 HD1 PHE 79 HD1 PHE 79 10.219 14.460 5.183
630 HD2 PHE 79 HD2 PHE 79 11.110 14.095 0.979
631 HE1 PHE 79 HE1 PHE 79 11.178 12.194 5.580
632 HE2 PHE 79 HE2 PHE 79 12.078 11.856 1.381
633 HZ PHE 79 HZ PHE 79 12.122 10.891 3.675
634 H SER 80 H SER 80 7.224 17.396 3.681
635 HA SER 80 HA SER 80 6.818 19.448 1.637
636 HB2 SER 80 1HB SER 80 6.097 19.422 4.594
637 HB3 SER 80 2HB SER 80 5.512 20.581 3.380
638 HG SER 80 HG SER 80 4.595 18.773 2.265
639 H ALA 81 H ALA 81 8.905 20.133 1.176
640 HA ALA 81 HA ALA 81 9.974 22.178 3.024
641 HB1 ALA 81 1HB ALA 81 11.670 19.827 2.030
642 HB2 ALA 81 2HB ALA 81 12.286 21.256 2.894
643 HB3 ALA 81 3HB ALA 81 11.199 20.118 3.724
644 H ASP 82 H ASP 82 8.484 22.173 0.663
645 HA ASP 82 HA ASP 82 9.929 22.004 -1.724
646 HB2 ASP 82 1HB ASP 82 7.445 23.627 -1.089
647 HB3 ASP 82 2HB ASP 82 7.954 23.095 -2.699
648 HA PRO 83 HA PRO 83 11.984 25.943 -1.801
649 HB2 PRO 83 1HB PRO 83 12.914 25.999 -4.337
650 HB3 PRO 83 2HB PRO 83 13.504 24.776 -3.166
651 HG2 PRO 83 1HG PRO 83 11.362 24.513 -5.265
652 HG3 PRO 83 2HG PRO 83 12.776 23.453 -4.962
653 HD2 PRO 83 1HD PRO 83 10.280 22.912 -3.984
654 HD3 PRO 83 2HD PRO 83 11.782 22.467 -3.097
655 H PHE 84 H PHE 84 11.925 28.071 -2.827
656 HA PHE 84 HA PHE 84 9.584 28.562 -4.620
657 HB2 PHE 84 1HB PHE 84 9.101 30.629 -3.295
658 HB3 PHE 84 2HB PHE 84 8.826 29.141 -2.382
659 HD1 PHE 84 HD1 PHE 84 11.146 32.031 -2.803
660 HD2 PHE 84 HD2 PHE 84 10.102 28.600 -0.418
661 HE1 PHE 84 HE1 PHE 84 12.697 32.809 -1.017
662 HE2 PHE 84 HE2 PHE 84 11.632 29.388 1.385
663 HZ PHE 84 HZ PHE 84 12.948 31.486 1.080
664 H ASP 85 H ASP 85 12.652 28.425 -4.410
665 HA ASP 85 HA ASP 85 13.563 31.125 -4.919
666 HB2 ASP 85 1HB ASP 85 15.161 28.564 -5.176
667 HB3 ASP 85 2HB ASP 85 15.743 30.185 -4.745
668 H LEU 86 H LEU 86 11.777 30.370 -6.966
669 HA LEU 86 HA LEU 86 13.118 29.273 -9.260
670 HB2 LEU 86 1HB LEU 86 11.182 30.109 -10.511
671 HB3 LEU 86 2HB LEU 86 10.719 29.232 -9.059
672 HG LEU 86 HG LEU 86 10.764 31.907 -8.233
673 HD11 LEU 86 1HD1 LEU 86 9.366 33.082 -9.869
674 HD12 LEU 86 2HD1 LEU 86 9.425 31.679 -10.964
675 HD13 LEU 86 3HD1 LEU 86 10.906 32.604 -10.612
676 HD21 LEU 86 1HD2 LEU 86 8.428 30.192 -9.165
677 HD22 LEU 86 2HD2 LEU 86 8.321 31.632 -8.124
678 HD23 LEU 86 3HD2 LEU 86 9.161 30.185 -7.541
679 H GLU 87 H GLU 87 12.936 32.496 -7.945
680 HA GLU 87 HA GLU 87 13.911 33.834 -10.349
681 HB2 GLU 87 1HB GLU 87 13.463 34.646 -7.473
682 HB3 GLU 87 2HB GLU 87 14.187 35.716 -8.670
683 HG2 GLU 87 1HG GLU 87 12.151 35.361 -10.115
684 HG3 GLU 87 2HG GLU 87 11.419 34.485 -8.762
685 H ALA 88 H ALA 88 15.417 32.011 -7.985
686 HA ALA 88 HA ALA 88 17.829 33.553 -7.613
687 HB1 ALA 88 1HB ALA 88 18.588 31.674 -6.263
688 HB2 ALA 88 2HB ALA 88 16.904 32.072 -5.850
689 HB3 ALA 88 3HB ALA 88 17.261 30.660 -6.878
690 H GLN 89 H GLN 89 17.470 33.268 -10.282
691 HA GLN 89 HA GLN 89 19.341 31.138 -11.201
692 HB2 GLN 89 1HB GLN 89 17.744 33.131 -12.808
693 HB3 GLN 89 2HB GLN 89 18.646 31.761 -13.449
694 HG2 GLN 89 1HG GLN 89 17.132 30.221 -12.219
695 HG3 GLN 89 2HG GLN 89 16.220 31.607 -11.623
696 HE21 GLN 89 1HE2 GLN 89 14.068 31.353 -14.310
697 HE22 GLN 89 2HE2 GLN 89 14.310 31.484 -12.576
698 H ALA 90 H ALA 90 21.379 31.514 -11.577
699 HA ALA 90 HA ALA 90 22.465 34.247 -11.508
700 HB1 ALA 90 1HB ALA 90 24.650 33.104 -11.478
701 HB2 ALA 90 2HB ALA 90 23.559 32.368 -10.281
702 HB3 ALA 90 3HB ALA 90 23.861 31.548 -11.832
703 H LYS 91 H LYS 91 24.235 34.786 -13.140
704 HA LYS 91 HA LYS 91 23.572 33.793 -15.890
705 HB2 LYS 91 1HB LYS 91 24.120 36.635 -14.957
706 HB3 LYS 91 2HB LYS 91 24.243 36.130 -16.642
707 HG2 LYS 91 1HG LYS 91 21.846 35.513 -16.635
708 HG3 LYS 91 2HG LYS 91 21.734 36.033 -14.942
709 HD2 LYS 91 1HD LYS 91 20.959 37.904 -16.175
710 HD3 LYS 91 2HD LYS 91 22.632 38.310 -15.749
711 HE2 LYS 91 1HE LYS 91 23.260 37.309 -18.063
712 HE3 LYS 91 2HE LYS 91 21.532 37.415 -18.436
713 HZ1 LYS 91 1HZ LYS 91 22.775 39.367 -19.161
714 HZ2 LYS 91 2HZ LYS 91 23.282 39.670 -17.632
715 HZ3 LYS 91 3HZ LYS 91 21.671 39.803 -18.001
716 H ILE 92 H ILE 92 25.328 33.803 -17.345
717 HA ILE 92 HA ILE 92 28.027 34.357 -16.203
718 HB ILE 92 HB ILE 92 27.294 31.941 -17.952
719 HG12 ILE 92 1HG1 ILE 92 28.301 31.948 -15.076
720 HG13 ILE 92 2HG1 ILE 92 26.606 31.751 -15.523
721 HG21 ILE 92 1HG2 ILE 92 29.552 32.906 -18.454
722 HG22 ILE 92 2HG2 ILE 92 29.993 32.764 -16.736
723 HG23 ILE 92 3HG2 ILE 92 29.691 31.307 -17.712
724 HD11 ILE 92 1HD1 ILE 92 28.884 29.840 -16.154
725 HD12 ILE 92 2HD1 ILE 92 27.480 29.560 -15.107
726 HD13 ILE 92 3HD1 ILE 92 27.256 29.702 -16.862
727 H GLU 93 H GLU 93 28.843 35.955 -17.470
728 HA GLU 93 HA GLU 93 28.219 35.982 -20.369
729 HB2 GLU 93 1HB GLU 93 28.018 38.279 -18.376
730 HB3 GLU 93 2HB GLU 93 27.996 38.470 -20.128
731 HG2 GLU 93 1HG GLU 93 25.963 37.061 -20.254
732 HG3 GLU 93 2HG GLU 93 25.970 36.905 -18.495
733 H GLU 94 H GLU 94 29.966 36.895 -21.600
734 HA GLU 94 HA GLU 94 32.474 37.393 -20.055
735 HB2 GLU 94 1HB GLU 94 32.120 35.652 -22.523
736 HB3 GLU 94 2HB GLU 94 33.668 36.108 -21.812
737 HG2 GLU 94 1HG GLU 94 32.966 34.949 -19.698
738 HG3 GLU 94 2HG GLU 94 31.549 34.338 -20.576
739 H ASP 95 H ASP 95 34.068 38.619 -21.141
740 HA ASP 95 HA ASP 95 33.383 39.749 -23.794
741 HB2 ASP 95 1HB ASP 95 32.673 41.430 -22.054
742 HB3 ASP 95 2HB ASP 95 34.351 41.490 -21.494
743 H ILE 96 H ILE 96 34.993 37.708 -23.661
744 HA ILE 96 HA ILE 96 37.767 38.559 -23.141
745 HB ILE 96 HB ILE 96 36.838 35.900 -24.352
746 HG12 ILE 96 1HG1 ILE 96 37.430 36.532 -21.426
747 HG13 ILE 96 2HG1 ILE 96 35.805 36.385 -22.089
748 HG21 ILE 96 1HG2 ILE 96 39.423 36.641 -22.837
749 HG22 ILE 96 2HG2 ILE 96 39.052 35.066 -23.578
750 HG23 ILE 96 3HG2 ILE 96 39.308 36.482 -24.603
751 HD11 ILE 96 1HD1 ILE 96 36.303 34.013 -22.733
752 HD12 ILE 96 2HD1 ILE 96 37.870 34.161 -21.897
753 HD13 ILE 96 3HD1 ILE 96 36.355 34.318 -20.985
754 H ARG 97 H ARG 97 36.996 40.349 -24.739
755 HA ARG 97 HA ARG 97 37.102 39.595 -27.580
756 HB2 ARG 97 1HB ARG 97 35.684 41.415 -26.432
757 HB3 ARG 97 2HB ARG 97 37.160 42.376 -26.382
758 HG2 ARG 97 1HG ARG 97 37.158 41.735 -28.993
759 HG3 ARG 97 2HG ARG 97 35.414 41.632 -28.688
760 HD2 ARG 97 1HD ARG 97 35.298 43.891 -27.988
761 HD3 ARG 97 2HD ARG 97 37.047 43.988 -27.723
762 HE ARG 97 HE ARG 97 35.629 44.353 -30.236
763 HH11 ARG 97 1HH1 ARG 97 38.775 43.532 -28.827
764 HH12 ARG 97 2HH1 ARG 97 39.646 44.087 -30.235
765 HH21 ARG 97 1HH2 ARG 97 36.814 45.009 -31.999
766 HH22 ARG 97 2HH2 ARG 97 38.552 44.883 -32.003
767 H GLN 98 H GLN 98 39.410 38.802 -26.299
768 HA GLN 98 HA GLN 98 41.462 40.368 -27.741
769 HB2 GLN 98 1HB GLN 98 41.489 41.393 -25.520
770 HB3 GLN 98 2HB GLN 98 41.620 39.826 -24.732
771 HG2 GLN 98 1HG GLN 98 43.823 41.052 -24.867
772 HG3 GLN 98 2HG GLN 98 43.870 39.472 -25.633
773 HE21 GLN 98 1HE2 GLN 98 45.062 40.708 -28.602
774 HE22 GLN 98 2HE2 GLN 98 45.004 39.433 -27.410
775 HXT GLN 98 HO GLN 98 41.210 38.787 -28.894
Start of MODEL 7
1 H1 SER 1 1H SER 1 -7.603 34.345 -6.272
2 H2 SER 1 2H SER 1 -6.276 34.361 -7.142
3 H3 SER 1 3H SER 1 -7.318 35.612 -7.137
4 HA SER 1 HA SER 1 -6.474 36.467 -5.065
5 HB2 SER 1 1HB SER 1 -4.419 34.310 -4.903
6 HB3 SER 1 2HB SER 1 -5.413 35.052 -3.599
7 HG SER 1 HG SER 1 -6.907 33.948 -5.554
8 H GLN 2 H GLN 2 -4.395 37.476 -4.622
9 HA GLN 2 HA GLN 2 -2.363 37.398 -6.735
10 HB2 GLN 2 1HB GLN 2 -2.546 39.734 -7.344
11 HB3 GLN 2 2HB GLN 2 -4.085 38.933 -7.683
12 HG2 GLN 2 1HG GLN 2 -5.045 39.886 -5.605
13 HG3 GLN 2 2HG GLN 2 -3.503 40.676 -5.249
14 HE21 GLN 2 1HE2 GLN 2 -4.579 42.353 -8.694
15 HE22 GLN 2 2HE2 GLN 2 -3.839 40.778 -8.557
16 H GLN 3 H GLN 3 -0.719 39.261 -6.136
17 HA GLN 3 HA GLN 3 -0.635 39.644 -3.173
18 HB2 GLN 3 1HB GLN 3 1.488 38.614 -5.059
19 HB3 GLN 3 2HB GLN 3 1.965 39.620 -3.690
20 HG2 GLN 3 1HG GLN 3 0.381 37.044 -3.467
21 HG3 GLN 3 2HG GLN 3 2.122 37.206 -3.190
22 HE21 GLN 3 1HE2 GLN 3 0.142 37.434 0.029
23 HE22 GLN 3 2HE2 GLN 3 0.098 36.312 -1.309
24 H SER 4 H SER 4 0.780 41.563 -2.655
25 HA SER 4 HA SER 4 0.947 43.526 -4.884
26 HB2 SER 4 1HB SER 4 -0.483 44.038 -2.242
27 HB3 SER 4 2HB SER 4 -0.201 45.231 -3.530
28 HG SER 4 HG SER 4 -1.334 43.204 -4.717
29 H HIS 5 H HIS 5 2.402 45.261 -4.380
30 HA HIS 5 HA HIS 5 4.449 45.986 -3.667
31 HB2 HIS 5 1HB HIS 5 2.786 46.522 -1.738
32 HB3 HIS 5 2HB HIS 5 3.661 45.273 -0.847
33 HD1 HIS 5 HD1 HIS 5 6.382 45.744 -0.673
34 HD2 HIS 5 HD2 HIS 5 3.948 48.964 -1.712
35 HE1 HIS 5 HE1 HIS 5 7.735 47.855 -0.275
36 H SER 6 H SER 6 4.566 43.449 -4.650
37 HA SER 6 HA SER 6 6.782 42.248 -3.069
38 HB2 SER 6 1HB SER 6 5.906 39.996 -3.769
39 HB3 SER 6 2HB SER 6 4.843 40.832 -2.615
40 HG SER 6 HG SER 6 3.405 41.210 -4.155
41 H SER 7 H SER 7 8.067 40.797 -4.658
42 HA SER 7 HA SER 7 7.867 41.840 -7.431
43 HB2 SER 7 1HB SER 7 10.296 42.365 -7.383
44 HB3 SER 7 2HB SER 7 9.389 43.348 -6.216
45 HG SER 7 HG SER 7 10.894 40.997 -5.652
46 HA PRO 8 HA PRO 8 9.081 37.669 -8.258
47 HB2 PRO 8 1HB PRO 8 10.209 37.811 -10.724
48 HB3 PRO 8 2HB PRO 8 8.466 38.161 -10.485
49 HG2 PRO 8 1HG PRO 8 10.777 40.085 -10.639
50 HG3 PRO 8 2HG PRO 8 9.247 40.090 -11.573
51 HD2 PRO 8 1HD PRO 8 9.566 41.607 -9.354
52 HD3 PRO 8 2HD PRO 8 7.996 40.822 -9.738
53 H GLY 9 H GLY 9 11.086 36.341 -8.886
54 HA2 GLY 9 1HA GLY 9 13.674 37.247 -9.074
55 HA3 GLY 9 2HA GLY 9 13.357 37.288 -7.328
56 H GLU 10 H GLU 10 12.150 35.244 -6.557
57 HA GLU 10 HA GLU 10 12.431 33.061 -5.963
58 HB2 GLU 10 1HB GLU 10 11.296 33.076 -8.331
59 HB3 GLU 10 2HB GLU 10 12.796 32.291 -8.842
60 HG2 GLU 10 1HG GLU 10 12.426 30.507 -7.167
61 HG3 GLU 10 2HG GLU 10 10.962 31.330 -6.607
62 H ILE 11 H ILE 11 14.875 34.699 -6.130
63 HA ILE 11 HA ILE 11 17.007 33.275 -7.163
64 HB ILE 11 HB ILE 11 17.535 35.001 -4.858
65 HG12 ILE 11 1HG1 ILE 11 15.931 36.221 -7.121
66 HG13 ILE 11 2HG1 ILE 11 15.375 36.022 -5.449
67 HG21 ILE 11 1HG2 ILE 11 18.987 36.113 -6.469
68 HG22 ILE 11 2HG2 ILE 11 19.102 34.360 -6.704
69 HG23 ILE 11 3HG2 ILE 11 18.092 35.333 -7.800
70 HD11 ILE 11 1HD1 ILE 11 15.997 38.309 -5.706
71 HD12 ILE 11 2HD1 ILE 11 17.252 37.542 -4.707
72 HD13 ILE 11 3HD1 ILE 11 17.564 37.886 -6.427
73 H THR 12 H THR 12 15.123 32.198 -4.908
74 HA THR 12 HA THR 12 17.071 31.155 -2.977
75 HB THR 12 HB THR 12 14.604 31.562 -2.452
76 HG1 THR 12 HG1 THR 12 16.067 30.162 -1.248
77 HG21 THR 12 1HG2 THR 12 13.671 30.521 -4.543
78 HG22 THR 12 2HG2 THR 12 12.966 29.882 -3.043
79 HG23 THR 12 3HG2 THR 12 14.182 28.932 -3.919
80 H SER 13 H SER 13 15.833 30.478 -6.119
81 HA SER 13 HA SER 13 16.979 27.744 -6.136
82 HB2 SER 13 1HB SER 13 16.134 27.597 -8.407
83 HB3 SER 13 2HB SER 13 14.836 28.192 -7.354
84 HG SER 13 HG SER 13 15.279 30.305 -8.112
85 H SER 14 H SER 14 19.012 27.371 -6.844
86 HA SER 14 HA SER 14 20.403 29.463 -8.424
87 HB2 SER 14 1HB SER 14 22.369 29.227 -6.815
88 HB3 SER 14 2HB SER 14 20.961 30.127 -6.215
89 HG SER 14 HG SER 14 20.501 28.581 -4.841
90 HA PRO 15 HA PRO 15 21.406 25.017 -9.365
91 HB2 PRO 15 1HB PRO 15 20.777 24.914 -12.036
92 HB3 PRO 15 2HB PRO 15 19.583 24.598 -10.735
93 HG2 PRO 15 1HG PRO 15 20.081 27.162 -12.245
94 HG3 PRO 15 2HG PRO 15 18.531 26.307 -11.954
95 HD2 PRO 15 1HD PRO 15 19.288 28.377 -10.406
96 HD3 PRO 15 2HD PRO 15 18.474 26.941 -9.691
97 H GLN 16 H GLN 16 21.972 27.965 -11.339
98 HA GLN 16 HA GLN 16 24.477 26.925 -12.407
99 HB2 GLN 16 1HB GLN 16 23.412 29.772 -12.286
100 HB3 GLN 16 2HB GLN 16 24.814 29.226 -13.219
101 HG2 GLN 16 1HG GLN 16 23.260 27.646 -14.453
102 HG3 GLN 16 2HG GLN 16 21.906 28.457 -13.645
103 HE21 GLN 16 1HE2 GLN 16 22.548 31.585 -15.421
104 HE22 GLN 16 2HE2 GLN 16 22.307 31.047 -13.778
105 H GLY 17 H GLY 17 23.474 28.231 -9.395
106 HA2 GLY 17 1HA GLY 17 25.972 29.522 -8.693
107 HA3 GLY 17 2HA GLY 17 24.655 29.072 -7.592
108 H LEU 18 H LEU 18 24.859 26.258 -8.882
109 HA LEU 18 HA LEU 18 26.651 25.144 -6.891
110 HB2 LEU 18 1HB LEU 18 25.439 23.834 -9.349
111 HB3 LEU 18 2HB LEU 18 26.133 23.001 -7.961
112 HG LEU 18 HG LEU 18 23.636 24.726 -7.917
113 HD11 LEU 18 1HD1 LEU 18 23.335 22.671 -9.217
114 HD12 LEU 18 2HD1 LEU 18 22.426 22.596 -7.694
115 HD13 LEU 18 3HD1 LEU 18 23.957 21.703 -7.860
116 HD21 LEU 18 1HD2 LEU 18 24.873 22.946 -5.773
117 HD22 LEU 18 2HD2 LEU 18 23.264 23.700 -5.672
118 HD23 LEU 18 3HD2 LEU 18 24.713 24.718 -5.719
119 H ASP 19 H ASP 19 26.768 25.868 -10.337
120 HA ASP 19 HA ASP 19 29.408 24.660 -10.733
121 HB2 ASP 19 1HB ASP 19 27.556 24.790 -12.458
122 HB3 ASP 19 2HB ASP 19 27.819 26.540 -12.514
123 H ASN 20 H ASN 20 27.959 27.781 -10.051
124 HA ASN 20 HA ASN 20 30.663 29.051 -10.113
125 HB2 ASN 20 1HB ASN 20 27.860 30.220 -10.386
126 HB3 ASN 20 2HB ASN 20 29.317 31.185 -10.168
127 HD21 ASN 20 1HD2 ASN 20 30.615 30.379 -13.419
128 HD22 ASN 20 2HD2 ASN 20 31.162 30.293 -11.768
129 HA PRO 21 HA PRO 21 29.546 28.971 -5.626
130 HB2 PRO 21 1HB PRO 21 32.206 28.919 -4.815
131 HB3 PRO 21 2HB PRO 21 31.246 27.451 -5.109
132 HG2 PRO 21 1HG PRO 21 33.120 28.856 -6.933
133 HG3 PRO 21 2HG PRO 21 33.012 27.120 -6.566
134 HD2 PRO 21 1HD PRO 21 31.982 28.061 -8.788
135 HD3 PRO 21 2HD PRO 21 31.085 26.834 -7.823
136 H ALA 22 H ALA 22 31.939 30.733 -7.597
137 HA ALA 22 HA ALA 22 32.415 32.848 -5.762
138 HB1 ALA 22 1HB ALA 22 33.842 32.425 -7.718
139 HB2 ALA 22 2HB ALA 22 32.501 32.849 -8.812
140 HB3 ALA 22 3HB ALA 22 33.215 34.089 -7.753
141 H LEU 23 H LEU 23 29.925 32.453 -8.293
142 HA LEU 23 HA LEU 23 28.879 35.135 -7.870
143 HB2 LEU 23 1HB LEU 23 27.595 32.759 -9.263
144 HB3 LEU 23 2HB LEU 23 27.079 34.436 -9.369
145 HG LEU 23 HG LEU 23 29.611 33.232 -10.522
146 HD11 LEU 23 1HD1 LEU 23 28.549 33.720 -12.672
147 HD12 LEU 23 2HD1 LEU 23 27.150 34.443 -11.845
148 HD13 LEU 23 3HD1 LEU 23 27.480 32.702 -11.690
149 HD21 LEU 23 1HD2 LEU 23 30.006 35.375 -11.608
150 HD22 LEU 23 2HD2 LEU 23 30.116 35.510 -9.842
151 HD23 LEU 23 3HD2 LEU 23 28.664 36.101 -10.686
152 H LEU 24 H LEU 24 28.042 31.814 -6.820
153 HA LEU 24 HA LEU 24 25.561 32.600 -5.617
154 HB2 LEU 24 1HB LEU 24 26.149 30.271 -6.170
155 HB3 LEU 24 2HB LEU 24 27.397 30.277 -4.931
156 HG LEU 24 HG LEU 24 25.766 30.427 -3.172
157 HD11 LEU 24 1HD1 LEU 24 23.685 30.750 -5.362
158 HD12 LEU 24 2HD1 LEU 24 24.090 31.900 -4.063
159 HD13 LEU 24 3HD1 LEU 24 23.301 30.365 -3.668
160 HD21 LEU 24 1HD2 LEU 24 24.774 28.418 -5.211
161 HD22 LEU 24 2HD2 LEU 24 24.620 28.325 -3.443
162 HD23 LEU 24 3HD2 LEU 24 26.221 28.216 -4.204
163 H ARG 25 H ARG 25 28.898 32.322 -4.356
164 HA ARG 25 HA ARG 25 28.415 33.014 -1.661
165 HB2 ARG 25 1HB ARG 25 30.578 32.281 -2.523
166 HB3 ARG 25 2HB ARG 25 30.696 33.683 -3.562
167 HG2 ARG 25 1HG ARG 25 30.524 34.119 -0.602
168 HG3 ARG 25 2HG ARG 25 32.031 33.494 -1.281
169 HD2 ARG 25 1HD ARG 25 30.639 36.062 -2.108
170 HD3 ARG 25 2HD ARG 25 32.066 35.954 -1.083
171 HE ARG 25 HE ARG 25 31.908 35.478 -4.005
172 HH11 ARG 25 1HH1 ARG 25 33.969 35.689 -1.121
173 HH12 ARG 25 2HH1 ARG 25 35.418 35.836 -2.071
174 HH21 ARG 25 1HH2 ARG 25 33.797 35.647 -5.126
175 HH22 ARG 25 2HH2 ARG 25 35.324 35.800 -4.300
176 H ASP 26 H ASP 26 28.849 35.120 -4.531
177 HA ASP 26 HA ASP 26 28.733 37.553 -3.033
178 HB2 ASP 26 1HB ASP 26 29.609 37.121 -5.409
179 HB3 ASP 26 2HB ASP 26 27.922 37.228 -5.935
180 H MET 27 H MET 27 26.232 35.692 -4.796
181 HA MET 27 HA MET 27 24.073 37.532 -4.447
182 HB2 MET 27 1HB MET 27 24.139 35.446 -5.885
183 HB3 MET 27 2HB MET 27 23.919 34.494 -4.417
184 HG2 MET 27 1HG MET 27 21.988 36.647 -5.263
185 HG3 MET 27 2HG MET 27 21.867 34.992 -5.853
186 HE1 MET 27 1HE MET 27 20.684 32.945 -2.762
187 HE2 MET 27 2HE MET 27 20.890 32.973 -4.527
188 HE3 MET 27 3HE MET 27 22.316 33.025 -3.459
189 H LEU 28 H LEU 28 25.128 34.761 -2.504
190 HA LEU 28 HA LEU 28 23.124 34.915 -0.523
191 HB2 LEU 28 1HB LEU 28 25.929 33.886 -0.511
192 HB3 LEU 28 2HB LEU 28 24.859 33.757 0.886
193 HG LEU 28 HG LEU 28 24.149 32.657 -1.842
194 HD11 LEU 28 1HD1 LEU 28 24.814 30.501 -0.834
195 HD12 LEU 28 2HD1 LEU 28 25.493 31.415 0.533
196 HD13 LEU 28 3HD1 LEU 28 26.149 31.641 -1.098
197 HD21 LEU 28 1HD2 LEU 28 22.206 32.956 -0.491
198 HD22 LEU 28 2HD2 LEU 28 23.002 32.274 0.940
199 HD23 LEU 28 3HD2 LEU 28 22.602 31.236 -0.449
200 H LEU 29 H LEU 29 26.350 36.450 -0.653
201 HA LEU 29 HA LEU 29 26.210 37.575 1.993
202 HB2 LEU 29 1HB LEU 29 27.693 38.388 -0.517
203 HB3 LEU 29 2HB LEU 29 27.851 39.278 0.994
204 HG LEU 29 HG LEU 29 28.502 36.335 0.747
205 HD11 LEU 29 1HD1 LEU 29 29.877 37.619 -0.793
206 HD12 LEU 29 2HD1 LEU 29 30.842 37.033 0.580
207 HD13 LEU 29 3HD1 LEU 29 30.332 38.739 0.516
208 HD21 LEU 29 1HD2 LEU 29 29.818 36.722 2.794
209 HD22 LEU 29 2HD2 LEU 29 28.102 37.085 3.046
210 HD23 LEU 29 3HD2 LEU 29 29.263 38.414 2.829
211 H ALA 30 H ALA 30 25.093 38.667 -1.168
212 HA ALA 30 HA ALA 30 24.282 41.286 -0.177
213 HB1 ALA 30 1HB ALA 30 23.607 39.835 -2.775
214 HB2 ALA 30 2HB ALA 30 23.355 41.566 -2.441
215 HB3 ALA 30 3HB ALA 30 25.007 40.905 -2.523
216 H ASN 31 H ASN 31 22.927 38.153 0.119
217 HA ASN 31 HA ASN 31 20.166 39.314 0.234
218 HB2 ASN 31 1HB ASN 31 20.740 37.536 -1.489
219 HB3 ASN 31 2HB ASN 31 20.904 36.412 -0.151
220 HD21 ASN 31 1HD2 ASN 31 17.428 36.601 -1.708
221 HD22 ASN 31 2HD2 ASN 31 19.023 36.629 -2.437
222 HA PRO 32 HA PRO 32 21.152 38.383 4.543
223 HB2 PRO 32 1HB PRO 32 19.126 39.842 5.697
224 HB3 PRO 32 2HB PRO 32 20.667 40.555 5.115
225 HG2 PRO 32 1HG PRO 32 18.027 40.362 3.668
226 HG3 PRO 32 2HG PRO 32 19.067 41.798 3.926
227 HD2 PRO 32 1HD PRO 32 19.185 40.467 1.640
228 HD3 PRO 32 2HD PRO 32 20.698 41.043 2.427
229 H HIS 33 H HIS 33 18.040 37.921 2.908
230 HA HIS 33 HA HIS 33 16.920 36.289 5.058
231 HB2 HIS 33 1HB HIS 33 15.494 37.506 3.448
232 HB3 HIS 33 2HB HIS 33 16.186 36.573 2.115
233 HD1 HIS 33 HD1 HIS 33 13.944 36.090 5.171
234 HD2 HIS 33 HD2 HIS 33 15.065 34.122 1.672
235 HE1 HIS 33 HE1 HIS 33 12.425 34.082 4.938
236 H GLU 34 H GLU 34 18.599 35.733 1.974
237 HA GLU 34 HA GLU 34 18.185 32.875 2.005
238 HB2 GLU 34 1HB GLU 34 19.487 34.874 0.350
239 HB3 GLU 34 2HB GLU 34 20.423 33.416 0.431
240 HG2 GLU 34 1HG GLU 34 17.505 33.584 -0.370
241 HG3 GLU 34 2HG GLU 34 18.867 33.488 -1.497
242 H LEU 35 H LEU 35 20.825 35.094 2.930
243 HA LEU 35 HA LEU 35 22.652 33.041 3.643
244 HB2 LEU 35 1HB LEU 35 24.014 34.661 4.258
245 HB3 LEU 35 2HB LEU 35 22.925 35.488 3.209
246 HG LEU 35 HG LEU 35 21.852 36.577 5.108
247 HD11 LEU 35 1HD1 LEU 35 23.230 36.706 7.226
248 HD12 LEU 35 2HD1 LEU 35 24.008 35.187 6.703
249 HD13 LEU 35 3HD1 LEU 35 22.257 35.245 7.015
250 HD21 LEU 35 1HD2 LEU 35 23.608 37.505 3.708
251 HD22 LEU 35 2HD2 LEU 35 24.849 36.770 4.743
252 HD23 LEU 35 3HD2 LEU 35 23.806 38.073 5.380
253 H SER 36 H SER 36 19.936 34.450 5.360
254 HA SER 36 HA SER 36 20.601 33.381 7.942
255 HB2 SER 36 1HB SER 36 19.062 35.319 7.547
256 HB3 SER 36 2HB SER 36 17.860 34.174 6.918
257 HG SER 36 HG SER 36 17.766 33.200 8.932
258 H LEU 37 H LEU 37 18.428 32.298 5.265
259 HA LEU 37 HA LEU 37 17.571 29.963 6.716
260 HB2 LEU 37 1HB LEU 37 16.581 29.252 4.802
261 HB3 LEU 37 2HB LEU 37 16.515 30.966 4.826
262 HG LEU 37 HG LEU 37 18.059 31.122 2.980
263 HD11 LEU 37 1HD1 LEU 37 17.898 28.132 3.122
264 HD12 LEU 37 2HD1 LEU 37 19.288 29.174 2.776
265 HD13 LEU 37 3HD1 LEU 37 18.053 28.948 1.537
266 HD21 LEU 37 1HD2 LEU 37 16.263 30.376 1.379
267 HD22 LEU 37 2HD2 LEU 37 15.699 31.386 2.718
268 HD23 LEU 37 3HD2 LEU 37 15.437 29.629 2.754
269 H LEU 38 H LEU 38 20.285 30.764 4.756
270 HA LEU 38 HA LEU 38 21.185 28.113 4.318
271 HB2 LEU 38 1HB LEU 38 21.779 30.166 3.135
272 HB3 LEU 38 2HB LEU 38 22.721 30.694 4.538
273 HG LEU 38 HG LEU 38 24.145 28.656 4.362
274 HD11 LEU 38 1HD1 LEU 38 22.687 28.344 1.727
275 HD12 LEU 38 2HD1 LEU 38 22.670 27.220 3.106
276 HD13 LEU 38 3HD1 LEU 38 24.168 27.471 2.191
277 HD21 LEU 38 1HD2 LEU 38 25.477 29.496 2.484
278 HD22 LEU 38 2HD2 LEU 38 24.885 30.810 3.523
279 HD23 LEU 38 3HD2 LEU 38 24.092 30.488 1.966
280 H LYS 39 H LYS 39 21.985 30.465 6.924
281 HA LYS 39 HA LYS 39 23.731 28.538 8.230
282 HB2 LYS 39 1HB LYS 39 23.451 29.990 10.275
283 HB3 LYS 39 2HB LYS 39 24.187 30.733 8.855
284 HG2 LYS 39 1HG LYS 39 22.188 31.940 8.356
285 HG3 LYS 39 2HG LYS 39 21.262 31.079 9.554
286 HD2 LYS 39 1HD LYS 39 21.736 33.187 10.489
287 HD3 LYS 39 2HD LYS 39 22.843 32.057 11.297
288 HE2 LYS 39 1HE LYS 39 24.663 32.743 9.769
289 HE3 LYS 39 2HE LYS 39 23.544 33.824 8.911
290 HZ1 LYS 39 1HZ LYS 39 24.869 35.023 10.534
291 HZ2 LYS 39 2HZ LYS 39 24.314 34.071 11.762
292 HZ3 LYS 39 3HZ LYS 39 23.277 35.074 10.961
293 H GLU 40 H GLU 40 20.266 29.037 8.282
294 HA GLU 40 HA GLU 40 19.843 27.355 10.615
295 HB2 GLU 40 1HB GLU 40 18.093 28.274 8.322
296 HB3 GLU 40 2HB GLU 40 17.484 27.253 9.629
297 HG2 GLU 40 1HG GLU 40 17.901 28.966 11.265
298 HG3 GLU 40 2HG GLU 40 18.765 29.961 10.087
299 H ARG 41 H ARG 41 19.459 26.837 7.061
300 HA ARG 41 HA ARG 41 18.941 23.976 7.574
301 HB2 ARG 41 1HB ARG 41 19.136 25.499 4.953
302 HB3 ARG 41 2HB ARG 41 18.549 23.843 5.166
303 HG2 ARG 41 1HG ARG 41 16.932 25.022 6.919
304 HG3 ARG 41 2HG ARG 41 17.243 26.437 5.904
305 HD2 ARG 41 1HD ARG 41 16.284 23.745 4.856
306 HD3 ARG 41 2HD ARG 41 15.195 25.061 5.295
307 HE ARG 41 HE ARG 41 16.969 24.926 2.940
308 HH11 ARG 41 1HH1 ARG 41 14.684 26.887 4.790
309 HH12 ARG 41 2HH1 ARG 41 14.355 27.936 3.437
310 HH21 ARG 41 1HH2 ARG 41 16.498 26.316 1.263
311 HH22 ARG 41 2HH2 ARG 41 15.370 27.623 1.484
312 H ASN 42 H ASN 42 21.717 25.817 6.506
313 HA ASN 42 HA ASN 42 23.215 23.242 6.267
314 HB2 ASN 42 1HB ASN 42 22.517 24.249 4.000
315 HB3 ASN 42 2HB ASN 42 23.675 25.513 4.316
316 HD21 ASN 42 1HD2 ASN 42 25.388 22.945 2.346
317 HD22 ASN 42 2HD2 ASN 42 24.150 24.155 2.147
318 HA PRO 43 HA PRO 43 25.266 26.610 8.736
319 HB2 PRO 43 1HB PRO 43 26.308 24.919 10.710
320 HB3 PRO 43 2HB PRO 43 24.800 25.881 10.816
321 HG2 PRO 43 1HG PRO 43 25.155 22.998 10.066
322 HG3 PRO 43 2HG PRO 43 23.945 23.752 11.144
323 HD2 PRO 43 1HD PRO 43 23.324 23.070 8.630
324 HD3 PRO 43 2HD PRO 43 22.702 24.598 9.349
325 HA PRO 44 HA PRO 44 29.389 24.591 8.103
326 HB2 PRO 44 1HB PRO 44 29.794 22.599 6.287
327 HB3 PRO 44 2HB PRO 44 29.458 22.285 8.019
328 HG2 PRO 44 1HG PRO 44 27.549 22.306 5.711
329 HG3 PRO 44 2HG PRO 44 27.810 21.036 6.948
330 HD2 PRO 44 1HD PRO 44 25.813 22.814 7.198
331 HD3 PRO 44 2HD PRO 44 26.764 22.299 8.632
332 H LEU 45 H LEU 45 27.123 24.631 5.253
333 HA LEU 45 HA LEU 45 29.214 25.800 3.561
334 HB2 LEU 45 1HB LEU 45 27.273 24.553 2.636
335 HB3 LEU 45 2HB LEU 45 26.211 25.845 3.198
336 HG LEU 45 HG LEU 45 27.258 27.433 1.663
337 HD11 LEU 45 1HD1 LEU 45 29.564 26.601 1.558
338 HD12 LEU 45 2HD1 LEU 45 28.879 26.652 -0.069
339 HD13 LEU 45 3HD1 LEU 45 29.014 25.098 0.781
340 HD21 LEU 45 1HD2 LEU 45 26.561 24.844 0.218
341 HD22 LEU 45 2HD2 LEU 45 26.422 26.502 -0.411
342 HD23 LEU 45 3HD2 LEU 45 25.371 25.972 0.914
343 H ALA 46 H ALA 46 26.668 26.863 5.748
344 HA ALA 46 HA ALA 46 26.768 29.618 5.045
345 HB1 ALA 46 1HB ALA 46 26.192 28.454 7.765
346 HB2 ALA 46 2HB ALA 46 25.660 30.019 7.106
347 HB3 ALA 46 3HB ALA 46 25.033 28.505 6.419
348 H GLU 47 H GLU 47 28.648 27.835 7.619
349 HA GLU 47 HA GLU 47 29.868 30.211 8.623
350 HB2 GLU 47 1HB GLU 47 31.513 28.813 9.677
351 HB3 GLU 47 2HB GLU 47 29.918 28.071 9.834
352 HG2 GLU 47 1HG GLU 47 30.440 26.454 8.132
353 HG3 GLU 47 2HG GLU 47 31.967 27.260 7.755
354 H ALA 48 H ALA 48 30.690 28.173 5.888
355 HA ALA 48 HA ALA 48 33.169 29.258 5.250
356 HB1 ALA 48 1HB ALA 48 32.814 28.211 3.143
357 HB2 ALA 48 2HB ALA 48 31.973 27.191 4.315
358 HB3 ALA 48 3HB ALA 48 31.063 28.319 3.285
359 H LEU 49 H LEU 49 29.876 30.265 4.368
360 HA LEU 49 HA LEU 49 30.675 32.445 2.682
361 HB2 LEU 49 1HB LEU 49 28.395 31.353 2.783
362 HB3 LEU 49 2HB LEU 49 28.159 32.105 4.355
363 HG LEU 49 HG LEU 49 28.586 34.349 3.102
364 HD11 LEU 49 1HD1 LEU 49 27.866 34.276 0.756
365 HD12 LEU 49 2HD1 LEU 49 27.774 32.505 0.831
366 HD13 LEU 49 3HD1 LEU 49 29.338 33.328 1.011
367 HD21 LEU 49 1HD2 LEU 49 26.203 34.521 2.618
368 HD22 LEU 49 2HD2 LEU 49 26.469 33.656 4.144
369 HD23 LEU 49 3HD2 LEU 49 26.046 32.749 2.674
370 H LEU 50 H LEU 50 29.934 32.146 6.169
371 HA LEU 50 HA LEU 50 29.843 34.945 6.724
372 HB2 LEU 50 1HB LEU 50 30.808 32.810 8.647
373 HB3 LEU 50 2HB LEU 50 30.119 34.370 9.046
374 HG LEU 50 HG LEU 50 28.745 31.883 8.140
375 HD11 LEU 50 1HD1 LEU 50 29.199 32.140 10.479
376 HD12 LEU 50 2HD1 LEU 50 27.460 32.167 10.146
377 HD13 LEU 50 3HD1 LEU 50 28.321 33.693 10.490
378 HD21 LEU 50 1HD2 LEU 50 27.683 33.481 6.747
379 HD22 LEU 50 2HD2 LEU 50 27.528 34.636 8.101
380 HD23 LEU 50 3HD2 LEU 50 26.596 33.113 8.091
381 H SER 51 H SER 51 32.517 32.716 6.369
382 HA SER 51 HA SER 51 34.476 34.390 7.662
383 HB2 SER 51 1HB SER 51 34.737 32.140 5.678
384 HB3 SER 51 2HB SER 51 36.027 32.790 6.694
385 HG SER 51 HG SER 51 33.627 31.554 7.618
386 H GLY 52 H GLY 52 33.046 34.237 4.467
387 HA2 GLY 52 1HA GLY 52 33.280 35.854 2.796
388 HA3 GLY 52 2HA GLY 52 34.708 36.506 3.612
389 H ASP 53 H ASP 53 35.728 33.643 3.806
390 HA ASP 53 HA ASP 53 37.476 33.693 1.575
391 HB2 ASP 53 1HB ASP 53 37.876 32.467 3.765
392 HB3 ASP 53 2HB ASP 53 36.709 31.320 3.239
393 H LEU 54 H LEU 54 37.007 33.308 -0.505
394 HA LEU 54 HA LEU 54 34.658 31.852 -1.319
395 HB2 LEU 54 1HB LEU 54 35.828 33.554 -2.716
396 HB3 LEU 54 2HB LEU 54 37.187 32.461 -2.892
397 HG LEU 54 HG LEU 54 35.446 32.716 -4.773
398 HD11 LEU 54 1HD1 LEU 54 37.325 31.107 -4.791
399 HD12 LEU 54 2HD1 LEU 54 35.885 30.542 -5.661
400 HD13 LEU 54 3HD1 LEU 54 36.255 29.909 -4.047
401 HD21 LEU 54 1HD2 LEU 54 33.955 30.617 -3.197
402 HD22 LEU 54 2HD2 LEU 54 33.587 31.180 -4.828
403 HD23 LEU 54 3HD2 LEU 54 33.412 32.289 -3.453
404 H GLU 55 H GLU 55 38.092 31.012 -0.782
405 HA GLU 55 HA GLU 55 38.018 28.540 -2.163
406 HB2 GLU 55 1HB GLU 55 39.624 29.204 0.321
407 HB3 GLU 55 2HB GLU 55 39.971 27.920 -0.833
408 HG2 GLU 55 1HG GLU 55 39.927 30.865 -1.553
409 HG3 GLU 55 2HG GLU 55 41.352 29.999 -0.994
410 H LYS 56 H LYS 56 37.547 29.200 1.356
411 HA LYS 56 HA LYS 56 36.762 26.490 1.862
412 HB2 LYS 56 1HB LYS 56 36.254 27.070 4.039
413 HB3 LYS 56 2HB LYS 56 37.480 28.301 3.570
414 HG2 LYS 56 1HG LYS 56 35.513 29.773 3.174
415 HG3 LYS 56 2HG LYS 56 34.609 28.542 4.036
416 HD2 LYS 56 1HD LYS 56 37.191 29.469 5.237
417 HD3 LYS 56 2HD LYS 56 35.789 30.511 5.349
418 HE2 LYS 56 1HE LYS 56 34.494 28.727 6.458
419 HE3 LYS 56 2HE LYS 56 35.882 27.633 6.318
420 HZ1 LYS 56 1HZ LYS 56 37.108 29.170 7.752
421 HZ2 LYS 56 2HZ LYS 56 35.754 28.596 8.503
422 HZ3 LYS 56 3HZ LYS 56 35.771 30.133 7.899
423 H PHE 57 H PHE 57 34.848 29.347 0.860
424 HA PHE 57 HA PHE 57 32.316 28.072 1.206
425 HB2 PHE 57 1HB PHE 57 32.564 30.481 0.795
426 HB3 PHE 57 2HB PHE 57 33.126 30.140 -0.846
427 HD1 PHE 57 HD1 PHE 57 31.573 29.589 -2.617
428 HD2 PHE 57 HD2 PHE 57 30.202 29.960 1.446
429 HE1 PHE 57 HE1 PHE 57 29.214 29.560 -3.412
430 HE2 PHE 57 HE2 PHE 57 27.842 29.916 0.656
431 HZ PHE 57 HZ PHE 57 27.348 29.707 -1.782
432 H SER 58 H SER 58 34.406 28.222 -1.716
433 HA SER 58 HA SER 58 32.726 26.561 -3.301
434 HB2 SER 58 1HB SER 58 34.551 28.003 -4.183
435 HB3 SER 58 2HB SER 58 35.748 26.969 -3.379
436 HG SER 58 HG SER 58 35.580 26.286 -5.480
437 H ARG 59 H ARG 59 35.517 25.794 -1.185
438 HA ARG 59 HA ARG 59 35.669 23.050 -1.908
439 HB2 ARG 59 1HB ARG 59 37.376 24.338 -0.658
440 HB3 ARG 59 2HB ARG 59 36.314 24.398 0.746
441 HG2 ARG 59 1HG ARG 59 36.982 21.700 -0.390
442 HG3 ARG 59 2HG ARG 59 38.283 22.578 0.432
443 HD2 ARG 59 1HD ARG 59 36.963 22.744 2.468
444 HD3 ARG 59 2HD ARG 59 35.565 22.010 1.653
445 HE ARG 59 HE ARG 59 37.865 20.296 1.479
446 HH11 ARG 59 1HH1 ARG 59 35.319 21.271 3.717
447 HH12 ARG 59 2HH1 ARG 59 35.330 19.730 4.535
448 HH21 ARG 59 1HH2 ARG 59 37.846 18.379 2.607
449 HH22 ARG 59 2HH2 ARG 59 36.737 18.144 3.928
450 H VAL 60 H VAL 60 33.756 24.669 0.675
451 HA VAL 60 HA VAL 60 32.664 22.132 1.582
452 HB VAL 60 HB VAL 60 31.681 24.983 2.057
453 HG11 VAL 60 1HG1 VAL 60 30.886 22.318 3.303
454 HG12 VAL 60 2HG1 VAL 60 30.496 23.900 4.011
455 HG13 VAL 60 3HG1 VAL 60 29.841 23.459 2.423
456 HG21 VAL 60 1HG2 VAL 60 33.971 24.478 2.972
457 HG22 VAL 60 2HG2 VAL 60 32.775 24.760 4.246
458 HG23 VAL 60 3HG2 VAL 60 33.286 23.101 3.859
459 H LEU 61 H LEU 61 31.709 24.616 -0.794
460 HA LEU 61 HA LEU 61 29.069 23.695 -1.281
461 HB2 LEU 61 1HB LEU 61 30.263 25.771 -2.180
462 HB3 LEU 61 2HB LEU 61 31.004 24.724 -3.374
463 HG LEU 61 HG LEU 61 28.300 24.153 -3.644
464 HD11 LEU 61 1HD1 LEU 61 27.825 26.046 -2.115
465 HD12 LEU 61 2HD1 LEU 61 27.203 26.325 -3.753
466 HD13 LEU 61 3HD1 LEU 61 28.699 27.136 -3.222
467 HD21 LEU 61 1HD2 LEU 61 28.481 25.148 -5.746
468 HD22 LEU 61 2HD2 LEU 61 30.158 24.713 -5.379
469 HD23 LEU 61 3HD2 LEU 61 29.594 26.395 -5.185
470 H VAL 62 H VAL 62 32.225 22.628 -2.608
471 HA VAL 62 HA VAL 62 31.062 20.658 -4.356
472 HB VAL 62 HB VAL 62 33.866 20.816 -3.175
473 HG11 VAL 62 1HG1 VAL 62 34.462 19.314 -5.111
474 HG12 VAL 62 2HG1 VAL 62 33.448 18.527 -3.886
475 HG13 VAL 62 3HG1 VAL 62 32.720 19.085 -5.415
476 HG21 VAL 62 1HG2 VAL 62 32.758 21.600 -5.895
477 HG22 VAL 62 2HG2 VAL 62 33.207 22.717 -4.597
478 HG23 VAL 62 3HG2 VAL 62 34.454 21.731 -5.365
479 H GLU 63 H GLU 63 32.409 20.484 -1.031
480 HA GLU 63 HA GLU 63 32.057 17.660 -0.735
481 HB2 GLU 63 1HB GLU 63 31.842 19.876 1.333
482 HB3 GLU 63 2HB GLU 63 31.833 18.153 1.721
483 HG2 GLU 63 1HG GLU 63 34.084 18.625 0.047
484 HG3 GLU 63 2HG GLU 63 34.065 19.890 1.288
485 H GLN 64 H GLN 64 29.771 20.344 -0.175
486 HA GLN 64 HA GLN 64 27.625 18.699 0.803
487 HB2 GLN 64 1HB GLN 64 27.753 21.433 -0.508
488 HB3 GLN 64 2HB GLN 64 26.235 20.726 0.036
489 HG2 GLN 64 1HG GLN 64 28.621 21.214 1.850
490 HG3 GLN 64 2HG GLN 64 27.264 22.331 1.660
491 HE21 GLN 64 1HE2 GLN 64 26.987 19.535 4.402
492 HE22 GLN 64 2HE2 GLN 64 28.464 20.173 3.719
493 H GLN 65 H GLN 65 28.551 19.763 -2.501
494 HA GLN 65 HA GLN 65 26.094 18.730 -3.630
495 HB2 GLN 65 1HB GLN 65 26.811 19.626 -5.572
496 HB3 GLN 65 2HB GLN 65 27.760 20.539 -4.415
497 HG2 GLN 65 1HG GLN 65 29.706 19.212 -4.922
498 HG3 GLN 65 2HG GLN 65 28.775 18.274 -6.080
499 HE21 GLN 65 1HE2 GLN 65 29.407 22.254 -6.997
500 HE22 GLN 65 2HE2 GLN 65 29.026 21.797 -5.345
501 H GLN 66 H GLN 66 29.381 17.564 -3.272
502 HA GLN 66 HA GLN 66 29.058 15.063 -4.641
503 HB2 GLN 66 1HB GLN 66 30.822 15.847 -2.305
504 HB3 GLN 66 2HB GLN 66 30.796 14.216 -2.980
505 HG2 GLN 66 1HG GLN 66 31.363 15.202 -5.217
506 HG3 GLN 66 2HG GLN 66 31.613 16.750 -4.414
507 HE21 GLN 66 1HE2 GLN 66 34.979 15.584 -4.367
508 HE22 GLN 66 2HE2 GLN 66 33.821 16.545 -5.257
509 H ASP 67 H ASP 67 28.347 15.935 -1.214
510 HA ASP 67 HA ASP 67 27.616 13.315 -0.358
511 HB2 ASP 67 1HB ASP 67 27.816 15.211 1.184
512 HB3 ASP 67 2HB ASP 67 26.458 16.003 0.393
513 H ARG 68 H ARG 68 25.715 15.885 -1.918
514 HA ARG 68 HA ARG 68 23.243 14.385 -1.903
515 HB2 ARG 68 1HB ARG 68 24.236 16.761 -3.480
516 HB3 ARG 68 2HB ARG 68 22.633 16.061 -3.753
517 HG2 ARG 68 1HG ARG 68 21.843 16.687 -1.664
518 HG3 ARG 68 2HG ARG 68 23.462 16.755 -0.952
519 HD2 ARG 68 1HD ARG 68 23.969 18.783 -2.238
520 HD3 ARG 68 2HD ARG 68 22.362 18.723 -2.981
521 HE ARG 68 HE ARG 68 21.444 19.611 -1.061
522 HH11 ARG 68 1HH1 ARG 68 24.693 18.475 -0.222
523 HH12 ARG 68 2HH1 ARG 68 24.636 19.249 1.353
524 HH21 ARG 68 1HH2 ARG 68 21.476 20.534 0.978
525 HH22 ARG 68 2HH2 ARG 68 22.883 20.363 2.000
526 H ALA 69 H ALA 69 25.914 14.675 -4.250
527 HA ALA 69 HA ALA 69 24.681 13.225 -6.345
528 HB1 ALA 69 1HB ALA 69 26.938 12.868 -7.194
529 HB2 ALA 69 2HB ALA 69 26.801 14.521 -6.552
530 HB3 ALA 69 3HB ALA 69 27.636 13.264 -5.608
531 H ARG 70 H ARG 70 26.242 12.082 -3.361
532 HA ARG 70 HA ARG 70 26.435 9.299 -4.119
533 HB2 ARG 70 1HB ARG 70 26.037 10.595 -1.393
534 HB3 ARG 70 2HB ARG 70 26.423 8.890 -1.644
535 HG2 ARG 70 1HG ARG 70 28.563 9.439 -2.563
536 HG3 ARG 70 2HG ARG 70 28.159 11.159 -2.582
537 HD2 ARG 70 1HD ARG 70 27.875 11.076 -0.091
538 HD3 ARG 70 2HD ARG 70 28.475 9.405 -0.127
539 HE ARG 70 HE ARG 70 30.355 11.058 -1.464
540 HH11 ARG 70 1HH1 ARG 70 29.143 10.602 1.820
541 HH12 ARG 70 2HH1 ARG 70 30.629 11.152 2.545
542 HH21 ARG 70 1HH2 ARG 70 32.223 11.754 -0.467
543 HH22 ARG 70 2HH2 ARG 70 32.338 11.793 1.270
544 H ARG 71 H ARG 71 23.861 11.259 -2.686
545 HA ARG 71 HA ARG 71 22.113 8.981 -2.152
546 HB2 ARG 71 1HB ARG 71 21.508 11.958 -2.384
547 HB3 ARG 71 2HB ARG 71 20.454 10.747 -1.645
548 HG2 ARG 71 1HG ARG 71 21.959 10.436 0.199
549 HG3 ARG 71 2HG ARG 71 23.260 11.306 -0.625
550 HD2 ARG 71 1HD ARG 71 21.796 13.352 -0.610
551 HD3 ARG 71 2HD ARG 71 20.713 12.481 0.496
552 HE ARG 71 HE ARG 71 23.418 13.547 1.060
553 HH11 ARG 71 1HH1 ARG 71 20.825 11.453 2.272
554 HH12 ARG 71 2HH1 ARG 71 21.452 11.495 3.898
555 HH21 ARG 71 1HH2 ARG 71 24.148 13.526 3.090
556 HH22 ARG 71 2HH2 ARG 71 23.308 12.654 4.360
557 H GLU 72 H GLU 72 22.787 11.170 -4.747
558 HA GLU 72 HA GLU 72 20.394 10.735 -6.267
559 HB2 GLU 72 1HB GLU 72 22.783 12.289 -6.432
560 HB3 GLU 72 2HB GLU 72 22.561 11.436 -7.959
561 HG2 GLU 72 1HG GLU 72 21.465 13.447 -8.223
562 HG3 GLU 72 2HG GLU 72 20.168 12.287 -7.925
563 H GLN 73 H GLN 73 23.408 9.006 -5.954
564 HA GLN 73 HA GLN 73 23.428 7.524 -8.360
565 HB2 GLN 73 1HB GLN 73 24.112 6.508 -5.577
566 HB3 GLN 73 2HB GLN 73 24.551 5.727 -7.098
567 HG2 GLN 73 1HG GLN 73 25.517 8.407 -6.105
568 HG3 GLN 73 2HG GLN 73 26.453 6.921 -6.196
569 HE21 GLN 73 1HE2 GLN 73 26.366 9.393 -9.311
570 HE22 GLN 73 2HE2 GLN 73 25.844 9.808 -7.688
571 H GLU 74 H GLU 74 21.527 7.013 -5.382
572 HA GLU 74 HA GLU 74 20.388 4.521 -6.263
573 HB2 GLU 74 1HB GLU 74 19.341 6.564 -4.270
574 HB3 GLU 74 2HB GLU 74 18.758 4.903 -4.452
575 HG2 GLU 74 1HG GLU 74 21.534 5.774 -3.563
576 HG3 GLU 74 2HG GLU 74 20.274 5.049 -2.552
577 H ARG 75 H ARG 75 19.552 7.927 -6.805
578 HA ARG 75 HA ARG 75 16.899 7.315 -7.828
579 HB2 ARG 75 1HB ARG 75 18.602 9.755 -8.420
580 HB3 ARG 75 2HB ARG 75 16.855 9.598 -8.620
581 HG2 ARG 75 1HG ARG 75 16.717 9.218 -6.117
582 HG3 ARG 75 2HG ARG 75 18.435 9.670 -6.045
583 HD2 ARG 75 1HD ARG 75 17.720 11.759 -7.387
584 HD3 ARG 75 2HD ARG 75 16.071 11.354 -6.878
585 HE ARG 75 HE ARG 75 18.285 12.405 -5.260
586 HH11 ARG 75 1HH1 ARG 75 15.151 10.748 -5.070
587 HH12 ARG 75 2HH1 ARG 75 14.886 11.256 -3.425
588 HH21 ARG 75 1HH2 ARG 75 17.878 13.002 -3.216
589 HH22 ARG 75 2HH2 ARG 75 16.421 12.515 -2.380
590 H ILE 76 H ILE 76 20.084 7.963 -9.355
591 HA ILE 76 HA ILE 76 18.984 7.757 -12.012
592 HB ILE 76 HB ILE 76 21.267 7.817 -12.844
593 HG12 ILE 76 1HG1 ILE 76 22.134 7.564 -9.952
594 HG13 ILE 76 2HG1 ILE 76 22.274 6.289 -11.156
595 HG21 ILE 76 1HG2 ILE 76 21.018 9.734 -10.473
596 HG22 ILE 76 2HG2 ILE 76 21.878 10.007 -12.005
597 HG23 ILE 76 3HG2 ILE 76 20.110 9.907 -11.995
598 HD11 ILE 76 1HD1 ILE 76 23.784 7.854 -12.489
599 HD12 ILE 76 2HD1 ILE 76 23.781 8.929 -11.070
600 HD13 ILE 76 3HD1 ILE 76 24.438 7.284 -10.938
601 H ARG 77 H ARG 77 19.933 5.394 -9.683
602 HA ARG 77 HA ARG 77 20.498 3.219 -11.466
603 HB2 ARG 77 1HB ARG 77 19.492 3.484 -8.647
604 HB3 ARG 77 2HB ARG 77 19.377 1.912 -9.436
605 HG2 ARG 77 1HG ARG 77 21.980 3.433 -9.357
606 HG3 ARG 77 2HG ARG 77 21.449 2.406 -8.010
607 HD2 ARG 77 1HD ARG 77 21.231 0.490 -9.572
608 HD3 ARG 77 2HD ARG 77 21.801 1.517 -10.898
609 HE ARG 77 HE ARG 77 23.969 1.345 -10.116
610 HH11 ARG 77 1HH1 ARG 77 21.819 0.108 -7.596
611 HH12 ARG 77 2HH1 ARG 77 23.138 -0.544 -6.664
612 HH21 ARG 77 1HH2 ARG 77 25.593 0.486 -8.871
613 HH22 ARG 77 2HH2 ARG 77 25.234 -0.332 -7.376
614 H LEU 78 H LEU 78 17.541 4.912 -10.780
615 HA LEU 78 HA LEU 78 15.872 2.730 -11.846
616 HB2 LEU 78 1HB LEU 78 15.431 5.009 -10.255
617 HB3 LEU 78 2HB LEU 78 14.657 5.386 -11.795
618 HG LEU 78 HG LEU 78 14.139 2.918 -10.117
619 HD11 LEU 78 1HD1 LEU 78 11.981 3.992 -9.598
620 HD12 LEU 78 2HD1 LEU 78 12.462 5.423 -10.539
621 HD13 LEU 78 3HD1 LEU 78 13.343 4.993 -9.053
622 HD21 LEU 78 1HD2 LEU 78 13.699 2.429 -12.465
623 HD22 LEU 78 2HD2 LEU 78 12.769 3.930 -12.637
624 HD23 LEU 78 3HD2 LEU 78 12.156 2.613 -11.610
625 H PHE 79 H PHE 79 16.998 5.988 -12.808
626 HA PHE 79 HA PHE 79 16.686 5.184 -15.658
627 HB2 PHE 79 1HB PHE 79 15.783 7.846 -14.499
628 HB3 PHE 79 2HB PHE 79 15.749 7.384 -16.204
629 HD1 PHE 79 HD1 PHE 79 14.372 5.145 -16.721
630 HD2 PHE 79 HD2 PHE 79 13.833 7.625 -13.247
631 HE1 PHE 79 HE1 PHE 79 12.074 4.229 -16.433
632 HE2 PHE 79 HE2 PHE 79 11.525 6.731 -12.960
633 HZ PHE 79 HZ PHE 79 10.639 5.032 -14.558
634 H SER 80 H SER 80 18.367 5.710 -16.889
635 HA SER 80 HA SER 80 20.305 6.590 -17.640
636 HB2 SER 80 1HB SER 80 19.375 9.082 -16.193
637 HB3 SER 80 2HB SER 80 20.578 9.005 -17.500
638 HG SER 80 HG SER 80 19.020 8.350 -18.906
639 H ALA 81 H ALA 81 21.010 5.027 -15.589
640 HA ALA 81 HA ALA 81 23.017 6.461 -13.972
641 HB1 ALA 81 1HB ALA 81 21.895 4.461 -13.025
642 HB2 ALA 81 2HB ALA 81 22.504 3.473 -14.372
643 HB3 ALA 81 3HB ALA 81 23.637 4.184 -13.199
644 H ASP 82 H ASP 82 23.269 6.986 -16.711
645 HA ASP 82 HA ASP 82 24.920 5.103 -18.087
646 HB2 ASP 82 1HB ASP 82 24.305 8.033 -18.558
647 HB3 ASP 82 2HB ASP 82 25.217 7.023 -19.694
648 HA PRO 83 HA PRO 83 28.855 6.306 -16.494
649 HB2 PRO 83 1HB PRO 83 30.552 5.133 -18.239
650 HB3 PRO 83 2HB PRO 83 29.433 4.148 -17.244
651 HG2 PRO 83 1HG PRO 83 29.098 5.103 -20.081
652 HG3 PRO 83 2HG PRO 83 28.950 3.439 -19.431
653 HD2 PRO 83 1HD PRO 83 26.789 5.067 -19.815
654 HD3 PRO 83 2HD PRO 83 26.866 3.873 -18.472
655 H PHE 84 H PHE 84 31.036 7.261 -17.245
656 HA PHE 84 HA PHE 84 30.621 9.392 -19.296
657 HB2 PHE 84 1HB PHE 84 32.424 9.334 -16.833
658 HB3 PHE 84 2HB PHE 84 32.372 10.631 -18.034
659 HD1 PHE 84 HD1 PHE 84 30.655 9.100 -15.158
660 HD2 PHE 84 HD2 PHE 84 30.430 12.140 -18.195
661 HE1 PHE 84 HE1 PHE 84 28.819 10.215 -13.897
662 HE2 PHE 84 HE2 PHE 84 28.594 13.265 -16.941
663 HZ PHE 84 HZ PHE 84 27.784 12.302 -14.787
664 H ASP 85 H ASP 85 31.130 6.759 -19.826
665 HA ASP 85 HA ASP 85 32.430 5.291 -20.910
666 HB2 ASP 85 1HB ASP 85 32.841 7.309 -22.314
667 HB3 ASP 85 2HB ASP 85 34.371 7.505 -21.457
668 H LEU 86 H LEU 86 33.110 3.819 -19.623
669 HA LEU 86 HA LEU 86 34.755 4.190 -17.375
670 HB2 LEU 86 1HB LEU 86 34.966 1.701 -17.446
671 HB3 LEU 86 2HB LEU 86 33.324 2.328 -17.473
672 HG LEU 86 HG LEU 86 33.870 1.991 -20.172
673 HD11 LEU 86 1HD1 LEU 86 35.036 -0.376 -18.647
674 HD12 LEU 86 2HD1 LEU 86 35.968 0.779 -19.625
675 HD13 LEU 86 3HD1 LEU 86 34.774 -0.274 -20.405
676 HD21 LEU 86 1HD2 LEU 86 32.334 0.078 -19.989
677 HD22 LEU 86 2HD2 LEU 86 31.784 1.439 -18.993
678 HD23 LEU 86 3HD2 LEU 86 32.577 0.040 -18.225
679 H GLU 87 H GLU 87 35.776 3.505 -20.737
680 HA GLU 87 HA GLU 87 38.446 2.734 -19.773
681 HB2 GLU 87 1HB GLU 87 39.059 2.507 -22.047
682 HB3 GLU 87 2HB GLU 87 37.501 1.740 -21.795
683 HG2 GLU 87 1HG GLU 87 36.512 2.973 -23.368
684 HG3 GLU 87 2HG GLU 87 37.239 4.473 -22.795
685 H ALA 88 H ALA 88 36.835 5.536 -20.960
686 HA ALA 88 HA ALA 88 39.185 7.077 -21.456
687 HB1 ALA 88 1HB ALA 88 36.965 7.478 -22.541
688 HB2 ALA 88 2HB ALA 88 36.367 8.075 -20.971
689 HB3 ALA 88 3HB ALA 88 37.669 8.944 -21.815
690 H GLN 89 H GLN 89 37.683 6.248 -18.621
691 HA GLN 89 HA GLN 89 38.650 8.668 -17.188
692 HB2 GLN 89 1HB GLN 89 37.083 6.360 -16.171
693 HB3 GLN 89 2HB GLN 89 37.527 7.757 -15.224
694 HG2 GLN 89 1HG GLN 89 35.694 7.761 -17.629
695 HG3 GLN 89 2HG GLN 89 35.201 7.931 -15.947
696 HE21 GLN 89 1HE2 GLN 89 35.825 11.190 -17.959
697 HE22 GLN 89 2HE2 GLN 89 35.227 9.647 -18.539
698 H ALA 90 H ALA 90 40.598 8.598 -16.873
699 HA ALA 90 HA ALA 90 42.043 6.275 -15.817
700 HB1 ALA 90 1HB ALA 90 43.094 7.753 -17.515
701 HB2 ALA 90 2HB ALA 90 42.981 9.100 -16.351
702 HB3 ALA 90 3HB ALA 90 44.026 7.706 -15.998
703 H LYS 91 H LYS 91 39.984 8.100 -14.606
704 HA LYS 91 HA LYS 91 39.277 8.818 -12.538
705 HB2 LYS 91 1HB LYS 91 40.446 6.595 -11.934
706 HB3 LYS 91 2HB LYS 91 41.757 7.592 -11.312
707 HG2 LYS 91 1HG LYS 91 40.312 8.558 -9.639
708 HG3 LYS 91 2HG LYS 91 38.877 7.813 -10.373
709 HD2 LYS 91 1HD LYS 91 39.616 5.607 -9.773
710 HD3 LYS 91 2HD LYS 91 41.230 6.200 -9.330
711 HE2 LYS 91 1HE LYS 91 39.861 5.726 -7.331
712 HE3 LYS 91 2HE LYS 91 40.327 7.431 -7.438
713 HZ1 LYS 91 1HZ LYS 91 37.695 6.354 -8.224
714 HZ2 LYS 91 2HZ LYS 91 38.152 7.939 -8.287
715 HZ3 LYS 91 3HZ LYS 91 38.022 7.180 -6.831
716 H ILE 92 H ILE 92 40.297 10.137 -10.460
717 HA ILE 92 HA ILE 92 41.970 12.272 -11.711
718 HB ILE 92 HB ILE 92 39.861 12.599 -9.523
719 HG12 ILE 92 1HG1 ILE 92 39.711 13.502 -12.428
720 HG13 ILE 92 2HG1 ILE 92 38.907 12.061 -11.803
721 HG21 ILE 92 1HG2 ILE 92 40.246 15.037 -9.828
722 HG22 ILE 92 2HG2 ILE 92 41.765 14.230 -9.408
723 HG23 ILE 92 3HG2 ILE 92 41.451 14.703 -11.094
724 HD11 ILE 92 1HD1 ILE 92 37.271 13.825 -11.925
725 HD12 ILE 92 2HD1 ILE 92 37.612 13.524 -10.206
726 HD13 ILE 92 3HD1 ILE 92 38.313 14.944 -11.023
727 H GLU 93 H GLU 93 43.917 11.622 -11.015
728 HA GLU 93 HA GLU 93 44.357 11.362 -8.075
729 HB2 GLU 93 1HB GLU 93 45.726 9.869 -10.347
730 HB3 GLU 93 2HB GLU 93 46.066 9.686 -8.627
731 HG2 GLU 93 1HG GLU 93 43.472 8.944 -10.037
732 HG3 GLU 93 2HG GLU 93 44.725 7.827 -9.507
733 H GLU 94 H GLU 94 46.753 11.873 -7.590
734 HA GLU 94 HA GLU 94 47.853 13.784 -9.608
735 HB2 GLU 94 1HB GLU 94 47.796 14.169 -6.597
736 HB3 GLU 94 2HB GLU 94 48.666 15.177 -7.763
737 HG2 GLU 94 1HG GLU 94 46.444 15.680 -8.852
738 HG3 GLU 94 2HG GLU 94 45.659 14.850 -7.495
739 H ASP 95 H ASP 95 49.814 13.281 -10.236
740 HA ASP 95 HA ASP 95 51.457 11.339 -8.788
741 HB2 ASP 95 1HB ASP 95 51.915 12.985 -11.307
742 HB3 ASP 95 2HB ASP 95 53.047 11.764 -10.693
743 H ILE 96 H ILE 96 51.027 13.482 -7.129
744 HA ILE 96 HA ILE 96 52.005 15.176 -5.910
745 HB ILE 96 HB ILE 96 54.708 13.899 -6.548
746 HG12 ILE 96 1HG1 ILE 96 52.662 12.938 -4.498
747 HG13 ILE 96 2HG1 ILE 96 53.025 12.111 -6.014
748 HG21 ILE 96 1HG2 ILE 96 55.280 14.638 -4.255
749 HG22 ILE 96 2HG2 ILE 96 54.635 16.024 -5.143
750 HG23 ILE 96 3HG2 ILE 96 53.606 15.173 -3.968
751 HD11 ILE 96 1HD1 ILE 96 54.206 10.962 -4.275
752 HD12 ILE 96 2HD1 ILE 96 55.413 11.841 -5.241
753 HD13 ILE 96 3HD1 ILE 96 54.906 12.471 -3.653
754 H ARG 97 H ARG 97 51.273 16.316 -8.026
755 HA ARG 97 HA ARG 97 53.277 17.285 -9.843
756 HB2 ARG 97 1HB ARG 97 51.417 18.755 -10.657
757 HB3 ARG 97 2HB ARG 97 51.031 17.036 -10.589
758 HG2 ARG 97 1HG ARG 97 49.717 17.317 -8.584
759 HG3 ARG 97 2HG ARG 97 50.210 19.013 -8.430
760 HD2 ARG 97 1HD ARG 97 49.031 19.605 -10.453
761 HD3 ARG 97 2HD ARG 97 48.683 17.896 -10.802
762 HE ARG 97 HE ARG 97 47.634 18.371 -8.248
763 HH11 ARG 97 1HH1 ARG 97 47.018 19.632 -11.499
764 HH12 ARG 97 2HH1 ARG 97 45.335 19.928 -11.162
765 HH21 ARG 97 1HH2 ARG 97 45.480 18.730 -7.909
766 HH22 ARG 97 2HH2 ARG 97 44.488 19.458 -9.158
767 H GLN 98 H GLN 98 54.266 17.947 -7.339
768 HA GLN 98 HA GLN 98 54.970 20.686 -7.840
769 HB2 GLN 98 1HB GLN 98 52.824 21.027 -6.499
770 HB3 GLN 98 2HB GLN 98 53.586 20.197 -5.148
771 HG2 GLN 98 1HG GLN 98 53.801 22.668 -4.907
772 HG3 GLN 98 2HG GLN 98 55.389 21.918 -5.065
773 HE21 GLN 98 1HE2 GLN 98 53.971 23.867 -8.412
774 HE22 GLN 98 2HE2 GLN 98 52.884 22.871 -7.483
775 HXT GLN 98 HO GLN 98 57.760 19.576 -6.457
Start of MODEL 8
1 H1 SER 1 1H SER 1 -3.374 29.134 -15.352
2 H2 SER 1 2H SER 1 -3.223 29.339 -16.903
3 H3 SER 1 3H SER 1 -2.529 30.338 -15.807
4 HA SER 1 HA SER 1 -0.892 28.449 -15.334
5 HB2 SER 1 1HB SER 1 -0.705 26.913 -17.336
6 HB3 SER 1 2HB SER 1 -2.235 26.706 -16.444
7 HG SER 1 HG SER 1 -1.935 28.486 -18.675
8 H GLN 2 H GLN 2 0.935 29.418 -15.544
9 HA GLN 2 HA GLN 2 1.314 31.443 -17.631
10 HB2 GLN 2 1HB GLN 2 3.154 30.407 -15.432
11 HB3 GLN 2 2HB GLN 2 3.513 31.770 -16.490
12 HG2 GLN 2 1HG GLN 2 2.769 32.688 -14.425
13 HG3 GLN 2 2HG GLN 2 1.460 32.932 -15.587
14 HE21 GLN 2 1HE2 GLN 2 -0.672 31.754 -13.070
15 HE22 GLN 2 2HE2 GLN 2 -0.126 33.120 -14.015
16 H GLN 3 H GLN 3 2.872 28.383 -16.684
17 HA GLN 3 HA GLN 3 4.313 26.966 -17.736
18 HB2 GLN 3 1HB GLN 3 3.112 28.038 -20.313
19 HB3 GLN 3 2HB GLN 3 4.023 26.536 -20.125
20 HG2 GLN 3 1HG GLN 3 2.256 25.684 -18.598
21 HG3 GLN 3 2HG GLN 3 1.326 27.166 -18.880
22 HE21 GLN 3 1HE2 GLN 3 0.543 26.315 -22.282
23 HE22 GLN 3 2HE2 GLN 3 1.023 27.678 -21.299
24 H SER 4 H SER 4 5.701 27.412 -20.335
25 HA SER 4 HA SER 4 7.785 29.204 -19.332
26 HB2 SER 4 1HB SER 4 8.851 28.641 -21.545
27 HB3 SER 4 2HB SER 4 8.425 27.204 -20.584
28 HG SER 4 HG SER 4 6.703 28.316 -22.548
29 H HIS 5 H HIS 5 8.188 31.290 -20.036
30 HA HIS 5 HA HIS 5 6.693 32.420 -22.300
31 HB2 HIS 5 1HB HIS 5 5.187 32.410 -20.184
32 HB3 HIS 5 2HB HIS 5 6.321 33.584 -19.509
33 HD1 HIS 5 HD1 HIS 5 6.008 36.027 -20.241
34 HD2 HIS 5 HD2 HIS 5 3.776 33.322 -22.502
35 HE1 HIS 5 HE1 HIS 5 4.466 37.392 -21.721
36 H SER 6 H SER 6 7.250 34.951 -22.129
37 HA SER 6 HA SER 6 8.796 36.616 -22.130
38 HB2 SER 6 1HB SER 6 10.258 35.250 -19.872
39 HB3 SER 6 2HB SER 6 10.018 36.987 -20.167
40 HG SER 6 HG SER 6 8.438 35.186 -18.860
41 H SER 7 H SER 7 11.508 36.807 -21.599
42 HA SER 7 HA SER 7 12.544 35.683 -24.060
43 HB2 SER 7 1HB SER 7 13.952 37.199 -21.829
44 HB3 SER 7 2HB SER 7 14.571 36.935 -23.473
45 HG SER 7 HG SER 7 13.530 39.005 -23.093
46 HA PRO 8 HA PRO 8 14.364 32.232 -21.912
47 HB2 PRO 8 1HB PRO 8 16.007 31.198 -23.818
48 HB3 PRO 8 2HB PRO 8 14.223 31.059 -23.942
49 HG2 PRO 8 1HG PRO 8 16.068 33.054 -25.229
50 HG3 PRO 8 2HG PRO 8 14.772 32.068 -25.977
51 HD2 PRO 8 1HD PRO 8 14.390 34.655 -25.209
52 HD3 PRO 8 2HD PRO 8 13.092 33.417 -25.103
53 H GLY 9 H GLY 9 16.064 32.073 -20.632
54 HA2 GLY 9 1HA GLY 9 18.445 33.804 -21.157
55 HA3 GLY 9 2HA GLY 9 17.796 33.476 -19.551
56 H GLU 10 H GLU 10 17.483 30.691 -21.105
57 HA GLU 10 HA GLU 10 18.410 28.625 -20.778
58 HB2 GLU 10 1HB GLU 10 19.965 29.826 -22.507
59 HB3 GLU 10 2HB GLU 10 21.160 29.752 -21.205
60 HG2 GLU 10 1HG GLU 10 20.781 27.267 -21.079
61 HG3 GLU 10 2HG GLU 10 19.668 27.399 -22.447
62 H ILE 11 H ILE 11 18.095 30.302 -18.380
63 HA ILE 11 HA ILE 11 20.247 29.936 -16.644
64 HB ILE 11 HB ILE 11 17.286 30.586 -16.452
65 HG12 ILE 11 1HG1 ILE 11 19.559 32.491 -15.867
66 HG13 ILE 11 2HG1 ILE 11 19.086 32.165 -17.530
67 HG21 ILE 11 1HG2 ILE 11 19.314 30.655 -14.270
68 HG22 ILE 11 2HG2 ILE 11 17.706 31.416 -14.205
69 HG23 ILE 11 3HG2 ILE 11 17.843 29.670 -14.390
70 HD11 ILE 11 1HD1 ILE 11 17.239 33.266 -15.384
71 HD12 ILE 11 2HD1 ILE 11 17.995 34.193 -16.696
72 HD13 ILE 11 3HD1 ILE 11 16.792 32.939 -17.072
73 H THR 12 H THR 12 18.348 27.841 -18.056
74 HA THR 12 HA THR 12 17.748 25.836 -16.074
75 HB THR 12 HB THR 12 17.829 24.303 -18.156
76 HG1 THR 12 HG1 THR 12 19.249 25.572 -19.415
77 HG21 THR 12 1HG2 THR 12 16.121 26.824 -18.293
78 HG22 THR 12 2HG2 THR 12 15.725 25.335 -17.401
79 HG23 THR 12 3HG2 THR 12 15.817 25.311 -19.175
80 H SER 13 H SER 13 20.663 26.889 -17.712
81 HA SER 13 HA SER 13 22.148 24.450 -17.035
82 HB2 SER 13 1HB SER 13 23.040 27.177 -18.044
83 HB3 SER 13 2HB SER 13 24.077 25.740 -17.877
84 HG SER 13 HG SER 13 22.907 26.276 -20.017
85 H SER 14 H SER 14 22.628 24.068 -15.017
86 HA SER 14 HA SER 14 23.014 24.344 -12.762
87 HB2 SER 14 1HB SER 14 25.082 25.694 -12.297
88 HB3 SER 14 2HB SER 14 25.246 24.489 -13.584
89 HG SER 14 HG SER 14 24.453 27.017 -14.407
90 HA PRO 15 HA PRO 15 20.741 28.428 -12.609
91 HB2 PRO 15 1HB PRO 15 18.510 27.623 -11.151
92 HB3 PRO 15 2HB PRO 15 18.613 27.562 -12.927
93 HG2 PRO 15 1HG PRO 15 19.188 25.375 -10.948
94 HG3 PRO 15 2HG PRO 15 18.134 25.332 -12.402
95 HD2 PRO 15 1HD PRO 15 20.597 24.365 -12.550
96 HD3 PRO 15 2HD PRO 15 19.983 25.423 -13.871
97 H GLN 16 H GLN 16 21.232 26.160 -9.928
98 HA GLN 16 HA GLN 16 20.824 28.256 -7.950
99 HB2 GLN 16 1HB GLN 16 21.426 26.579 -6.323
100 HB3 GLN 16 2HB GLN 16 20.326 25.875 -7.507
101 HG2 GLN 16 1HG GLN 16 21.774 24.258 -7.971
102 HG3 GLN 16 2HG GLN 16 23.000 25.439 -8.425
103 HE21 GLN 16 1HE2 GLN 16 24.380 25.464 -5.010
104 HE22 GLN 16 2HE2 GLN 16 23.751 26.652 -6.134
105 H GLY 17 H GLY 17 23.259 28.043 -10.148
106 HA2 GLY 17 1HA GLY 17 25.372 29.022 -10.120
107 HA3 GLY 17 2HA GLY 17 25.119 29.468 -8.418
108 H LEU 18 H LEU 18 24.776 26.161 -9.595
109 HA LEU 18 HA LEU 18 26.484 25.213 -7.501
110 HB2 LEU 18 1HB LEU 18 26.145 23.043 -8.274
111 HB3 LEU 18 2HB LEU 18 24.648 23.918 -8.443
112 HG LEU 18 HG LEU 18 25.587 24.195 -10.949
113 HD11 LEU 18 1HD1 LEU 18 27.608 22.852 -10.397
114 HD12 LEU 18 2HD1 LEU 18 26.614 22.122 -11.674
115 HD13 LEU 18 3HD1 LEU 18 26.556 21.478 -10.014
116 HD21 LEU 18 1HD2 LEU 18 24.096 21.814 -9.801
117 HD22 LEU 18 2HD2 LEU 18 24.084 22.320 -11.504
118 HD23 LEU 18 3HD2 LEU 18 23.381 23.376 -10.261
119 H ASP 19 H ASP 19 27.206 26.106 -10.800
120 HA ASP 19 HA ASP 19 29.939 24.963 -10.495
121 HB2 ASP 19 1HB ASP 19 28.298 24.696 -12.581
122 HB3 ASP 19 2HB ASP 19 28.957 26.282 -13.013
123 H ASN 20 H ASN 20 28.325 27.653 -9.660
124 HA ASN 20 HA ASN 20 30.674 29.395 -10.146
125 HB2 ASN 20 1HB ASN 20 27.695 30.043 -10.291
126 HB3 ASN 20 2HB ASN 20 28.967 31.245 -10.262
127 HD21 ASN 20 1HD2 ASN 20 30.025 30.699 -13.580
128 HD22 ASN 20 2HD2 ASN 20 30.582 31.189 -12.007
129 HA PRO 21 HA PRO 21 29.646 29.162 -5.615
130 HB2 PRO 21 1HB PRO 21 32.318 29.038 -4.870
131 HB3 PRO 21 2HB PRO 21 31.324 27.591 -5.174
132 HG2 PRO 21 1HG PRO 21 33.158 29.021 -7.022
133 HG3 PRO 21 2HG PRO 21 33.061 27.285 -6.697
134 HD2 PRO 21 1HD PRO 21 31.985 28.244 -8.850
135 HD3 PRO 21 2HD PRO 21 31.099 27.024 -7.867
136 H ALA 22 H ALA 22 32.005 30.888 -7.649
137 HA ALA 22 HA ALA 22 32.577 32.993 -5.826
138 HB1 ALA 22 1HB ALA 22 32.566 32.984 -8.874
139 HB2 ALA 22 2HB ALA 22 33.330 34.217 -7.845
140 HB3 ALA 22 3HB ALA 22 33.935 32.544 -7.820
141 H LEU 23 H LEU 23 30.040 32.646 -8.315
142 HA LEU 23 HA LEU 23 29.018 35.331 -7.838
143 HB2 LEU 23 1HB LEU 23 27.693 32.988 -9.249
144 HB3 LEU 23 2HB LEU 23 27.210 34.675 -9.340
145 HG LEU 23 HG LEU 23 29.742 33.457 -10.493
146 HD11 LEU 23 1HD1 LEU 23 28.683 33.931 -12.652
147 HD12 LEU 23 2HD1 LEU 23 27.267 34.631 -11.831
148 HD13 LEU 23 3HD1 LEU 23 27.625 32.896 -11.671
149 HD21 LEU 23 1HD2 LEU 23 30.083 35.642 -11.591
150 HD22 LEU 23 2HD2 LEU 23 30.218 35.757 -9.825
151 HD23 LEU 23 3HD2 LEU 23 28.741 36.324 -10.640
152 H LEU 24 H LEU 24 28.156 31.993 -6.875
153 HA LEU 24 HA LEU 24 25.680 32.729 -5.661
154 HB2 LEU 24 1HB LEU 24 26.306 30.424 -6.283
155 HB3 LEU 24 2HB LEU 24 27.547 30.419 -5.034
156 HG LEU 24 HG LEU 24 25.869 30.579 -3.288
157 HD11 LEU 24 1HD1 LEU 24 23.440 30.366 -3.824
158 HD12 LEU 24 2HD1 LEU 24 23.829 30.662 -5.536
159 HD13 LEU 24 3HD1 LEU 24 24.143 31.918 -4.305
160 HD21 LEU 24 1HD2 LEU 24 26.498 28.400 -4.075
161 HD22 LEU 24 2HD2 LEU 24 25.263 28.455 -5.347
162 HD23 LEU 24 3HD2 LEU 24 24.781 28.401 -3.633
163 H ARG 25 H ARG 25 29.013 32.501 -4.403
164 HA ARG 25 HA ARG 25 28.474 33.044 -1.671
165 HB2 ARG 25 1HB ARG 25 30.666 32.377 -2.549
166 HB3 ARG 25 2HB ARG 25 30.783 33.847 -3.492
167 HG2 ARG 25 1HG ARG 25 30.539 34.088 -0.516
168 HG3 ARG 25 2HG ARG 25 32.071 33.520 -1.194
169 HD2 ARG 25 1HD ARG 25 30.669 36.124 -1.882
170 HD3 ARG 25 2HD ARG 25 32.074 35.960 -0.832
171 HE ARG 25 HE ARG 25 31.987 35.661 -3.782
172 HH11 ARG 25 1HH1 ARG 25 33.990 35.734 -0.852
173 HH12 ARG 25 2HH1 ARG 25 35.446 35.999 -1.761
174 HH21 ARG 25 1HH2 ARG 25 33.880 35.989 -4.850
175 HH22 ARG 25 2HH2 ARG 25 35.389 36.126 -3.986
176 H ASP 26 H ASP 26 28.946 35.231 -4.451
177 HA ASP 26 HA ASP 26 28.794 37.631 -2.912
178 HB2 ASP 26 1HB ASP 26 29.588 37.035 -5.392
179 HB3 ASP 26 2HB ASP 26 27.948 37.557 -5.787
180 H MET 27 H MET 27 26.358 35.841 -4.822
181 HA MET 27 HA MET 27 24.158 37.608 -4.453
182 HB2 MET 27 1HB MET 27 24.317 35.609 -5.989
183 HB3 MET 27 2HB MET 27 24.112 34.563 -4.587
184 HG2 MET 27 1HG MET 27 22.103 36.654 -5.441
185 HG3 MET 27 2HG MET 27 22.066 34.983 -5.994
186 HE1 MET 27 1HE MET 27 21.303 32.918 -4.565
187 HE2 MET 27 2HE MET 27 22.617 33.169 -3.392
188 HE3 MET 27 3HE MET 27 20.946 32.973 -2.823
189 H LEU 28 H LEU 28 25.198 34.768 -2.579
190 HA LEU 28 HA LEU 28 23.155 34.814 -0.648
191 HB2 LEU 28 1HB LEU 28 25.932 33.773 -0.782
192 HB3 LEU 28 2HB LEU 28 25.136 33.826 0.789
193 HG LEU 28 HG LEU 28 23.788 32.555 -1.587
194 HD11 LEU 28 1HD1 LEU 28 25.970 31.548 -1.307
195 HD12 LEU 28 2HD1 LEU 28 24.679 30.435 -0.817
196 HD13 LEU 28 3HD1 LEU 28 25.644 31.281 0.416
197 HD21 LEU 28 1HD2 LEU 28 23.554 32.066 1.406
198 HD22 LEU 28 2HD2 LEU 28 22.512 31.404 0.120
199 HD23 LEU 28 3HD2 LEU 28 22.497 33.136 0.487
200 H LEU 29 H LEU 29 26.337 36.452 -0.632
201 HA LEU 29 HA LEU 29 26.052 37.473 2.043
202 HB2 LEU 29 1HB LEU 29 27.649 38.400 -0.352
203 HB3 LEU 29 2HB LEU 29 27.727 39.222 1.206
204 HG LEU 29 HG LEU 29 28.374 36.284 0.871
205 HD11 LEU 29 1HD1 LEU 29 30.241 38.671 0.825
206 HD12 LEU 29 2HD1 LEU 29 29.837 37.614 -0.553
207 HD13 LEU 29 3HD1 LEU 29 30.725 36.957 0.839
208 HD21 LEU 29 1HD2 LEU 29 27.875 36.941 3.175
209 HD22 LEU 29 2HD2 LEU 29 29.041 38.280 3.064
210 HD23 LEU 29 3HD2 LEU 29 29.603 36.591 2.992
211 H ALA 30 H ALA 30 24.998 38.667 -1.105
212 HA ALA 30 HA ALA 30 24.127 41.235 -0.024
213 HB1 ALA 30 1HB ALA 30 24.900 40.970 -2.367
214 HB2 ALA 30 2HB ALA 30 23.533 39.877 -2.690
215 HB3 ALA 30 3HB ALA 30 23.231 41.586 -2.292
216 H ASN 31 H ASN 31 22.794 38.054 -0.019
217 HA ASN 31 HA ASN 31 20.006 39.134 0.031
218 HB2 ASN 31 1HB ASN 31 20.727 37.349 -1.631
219 HB3 ASN 31 2HB ASN 31 20.884 36.258 -0.270
220 HD21 ASN 31 1HD2 ASN 31 17.452 36.355 -1.998
221 HD22 ASN 31 2HD2 ASN 31 19.060 36.515 -2.675
222 HA PRO 32 HA PRO 32 20.730 38.254 4.368
223 HB2 PRO 32 1HB PRO 32 18.529 39.525 5.417
224 HB3 PRO 32 2HB PRO 32 20.014 40.384 4.892
225 HG2 PRO 32 1HG PRO 32 17.469 39.924 3.336
226 HG3 PRO 32 2HG PRO 32 18.350 41.458 3.623
227 HD2 PRO 32 1HD PRO 32 18.691 40.116 1.358
228 HD3 PRO 32 2HD PRO 32 20.097 40.870 2.192
229 H HIS 33 H HIS 33 17.741 37.504 2.590
230 HA HIS 33 HA HIS 33 16.684 35.789 4.708
231 HB2 HIS 33 1HB HIS 33 15.224 36.869 3.038
232 HB3 HIS 33 2HB HIS 33 16.042 35.994 1.737
233 HD1 HIS 33 HD1 HIS 33 13.492 35.125 1.248
234 HD2 HIS 33 HD2 HIS 33 15.352 33.669 4.684
235 HE1 HIS 33 HE1 HIS 33 12.190 33.087 1.987
236 H GLU 34 H GLU 34 18.484 35.374 1.669
237 HA GLU 34 HA GLU 34 18.352 32.492 1.706
238 HB2 GLU 34 1HB GLU 34 19.611 34.624 0.130
239 HB3 GLU 34 2HB GLU 34 20.510 33.145 0.126
240 HG2 GLU 34 1HG GLU 34 17.579 33.326 -0.579
241 HG3 GLU 34 2HG GLU 34 18.890 33.433 -1.766
242 H LEU 35 H LEU 35 20.740 34.935 2.767
243 HA LEU 35 HA LEU 35 22.694 33.005 3.545
244 HB2 LEU 35 1HB LEU 35 23.915 34.725 4.236
245 HB3 LEU 35 2HB LEU 35 22.835 35.453 3.099
246 HG LEU 35 HG LEU 35 21.565 36.493 4.896
247 HD11 LEU 35 1HD1 LEU 35 23.742 35.350 6.646
248 HD12 LEU 35 2HD1 LEU 35 21.978 35.247 6.860
249 HD13 LEU 35 3HD1 LEU 35 22.794 36.801 7.074
250 HD21 LEU 35 1HD2 LEU 35 23.375 38.154 5.219
251 HD22 LEU 35 2HD2 LEU 35 23.312 37.524 3.559
252 HD23 LEU 35 3HD2 LEU 35 24.551 36.926 4.680
253 H SER 36 H SER 36 19.823 34.239 5.120
254 HA SER 36 HA SER 36 20.494 33.315 7.763
255 HB2 SER 36 1HB SER 36 18.908 35.176 7.316
256 HB3 SER 36 2HB SER 36 17.761 34.002 6.634
257 HG SER 36 HG SER 36 17.595 33.038 8.636
258 H LEU 37 H LEU 37 18.461 32.027 5.083
259 HA LEU 37 HA LEU 37 17.624 29.733 6.630
260 HB2 LEU 37 1HB LEU 37 16.712 28.900 4.698
261 HB3 LEU 37 2HB LEU 37 16.581 30.608 4.672
262 HG LEU 37 HG LEU 37 18.374 30.679 2.940
263 HD11 LEU 37 1HD1 LEU 37 19.159 28.380 3.130
264 HD12 LEU 37 2HD1 LEU 37 18.492 28.692 1.521
265 HD13 LEU 37 3HD1 LEU 37 17.538 27.784 2.724
266 HD21 LEU 37 1HD2 LEU 37 16.658 30.244 1.202
267 HD22 LEU 37 2HD2 LEU 37 16.030 31.203 2.555
268 HD23 LEU 37 3HD2 LEU 37 15.637 29.470 2.434
269 H LEU 38 H LEU 38 20.352 30.551 4.661
270 HA LEU 38 HA LEU 38 21.351 27.916 4.433
271 HB2 LEU 38 1HB LEU 38 21.911 29.909 3.131
272 HB3 LEU 38 2HB LEU 38 22.831 30.543 4.509
273 HG LEU 38 HG LEU 38 24.254 28.479 4.475
274 HD11 LEU 38 1HD1 LEU 38 22.771 27.003 3.264
275 HD12 LEU 38 2HD1 LEU 38 24.296 27.173 2.385
276 HD13 LEU 38 3HD1 LEU 38 22.850 28.048 1.827
277 HD21 LEU 38 1HD2 LEU 38 25.688 29.200 2.682
278 HD22 LEU 38 2HD2 LEU 38 24.977 30.625 3.470
279 HD23 LEU 38 3HD2 LEU 38 24.341 30.065 1.908
280 H LYS 39 H LYS 39 22.061 30.479 6.865
281 HA LYS 39 HA LYS 39 23.743 28.654 8.386
282 HB2 LYS 39 1HB LYS 39 23.511 30.272 10.260
283 HB3 LYS 39 2HB LYS 39 24.163 30.939 8.764
284 HG2 LYS 39 1HG LYS 39 22.106 32.052 8.274
285 HG3 LYS 39 2HG LYS 39 21.247 31.236 9.549
286 HD2 LYS 39 1HD LYS 39 21.674 33.417 10.333
287 HD3 LYS 39 2HD LYS 39 22.836 32.377 11.181
288 HE2 LYS 39 1HE LYS 39 24.600 33.029 9.586
289 HE3 LYS 39 2HE LYS 39 23.427 33.989 8.661
290 HZ1 LYS 39 1HZ LYS 39 23.128 35.390 10.606
291 HZ2 LYS 39 2HZ LYS 39 24.716 35.370 10.161
292 HZ3 LYS 39 3HZ LYS 39 24.217 34.501 11.470
293 H GLU 40 H GLU 40 20.277 29.146 8.282
294 HA GLU 40 HA GLU 40 19.743 27.754 10.771
295 HB2 GLU 40 1HB GLU 40 18.103 29.244 9.653
296 HB3 GLU 40 2HB GLU 40 18.053 28.157 8.270
297 HG2 GLU 40 1HG GLU 40 17.184 26.354 9.831
298 HG3 GLU 40 2HG GLU 40 17.020 27.619 11.062
299 H ARG 41 H ARG 41 19.635 26.792 7.305
300 HA ARG 41 HA ARG 41 19.151 23.994 8.158
301 HB2 ARG 41 1HB ARG 41 19.214 25.262 5.401
302 HB3 ARG 41 2HB ARG 41 18.594 23.649 5.807
303 HG2 ARG 41 1HG ARG 41 16.973 24.717 7.344
304 HG3 ARG 41 2HG ARG 41 17.541 26.298 6.830
305 HD2 ARG 41 1HD ARG 41 16.877 25.746 4.499
306 HD3 ARG 41 2HD ARG 41 16.102 24.267 5.136
307 HE ARG 41 HE ARG 41 15.302 26.471 6.753
308 HH11 ARG 41 1HH1 ARG 41 14.745 25.389 3.420
309 HH12 ARG 41 2HH1 ARG 41 13.208 26.206 3.333
310 HH21 ARG 41 1HH2 ARG 41 13.398 27.449 6.573
311 HH22 ARG 41 2HH2 ARG 41 12.445 27.366 5.106
312 H ASN 42 H ASN 42 21.800 25.774 6.768
313 HA ASN 42 HA ASN 42 23.336 23.205 6.606
314 HB2 ASN 42 1HB ASN 42 22.532 24.112 4.344
315 HB3 ASN 42 2HB ASN 42 23.655 25.432 4.580
316 HD21 ASN 42 1HD2 ASN 42 25.387 22.888 2.612
317 HD22 ASN 42 2HD2 ASN 42 24.117 24.065 2.436
318 HA PRO 43 HA PRO 43 25.438 26.634 8.925
319 HB2 PRO 43 1HB PRO 43 26.570 24.998 10.891
320 HB3 PRO 43 2HB PRO 43 25.047 25.930 11.030
321 HG2 PRO 43 1HG PRO 43 25.435 23.044 10.312
322 HG3 PRO 43 2HG PRO 43 24.250 23.792 11.425
323 HD2 PRO 43 1HD PRO 43 23.550 23.061 8.944
324 HD3 PRO 43 2HD PRO 43 22.925 24.587 9.666
325 HA PRO 44 HA PRO 44 29.555 24.635 8.186
326 HB2 PRO 44 1HB PRO 44 29.913 22.626 6.378
327 HB3 PRO 44 2HB PRO 44 29.646 22.329 8.125
328 HG2 PRO 44 1HG PRO 44 27.653 22.309 5.892
329 HG3 PRO 44 2HG PRO 44 27.974 21.055 7.132
330 HD2 PRO 44 1HD PRO 44 25.970 22.813 7.444
331 HD3 PRO 44 2HD PRO 44 26.987 22.332 8.842
332 H LEU 45 H LEU 45 27.196 24.624 5.420
333 HA LEU 45 HA LEU 45 29.215 25.788 3.650
334 HB2 LEU 45 1HB LEU 45 27.272 24.513 2.797
335 HB3 LEU 45 2HB LEU 45 26.207 25.795 3.372
336 HG LEU 45 HG LEU 45 27.131 27.370 1.777
337 HD11 LEU 45 1HD1 LEU 45 28.783 26.662 0.044
338 HD12 LEU 45 2HD1 LEU 45 29.033 25.143 0.931
339 HD13 LEU 45 3HD1 LEU 45 29.481 26.699 1.670
340 HD21 LEU 45 1HD2 LEU 45 26.374 26.328 -0.291
341 HD22 LEU 45 2HD2 LEU 45 25.340 25.801 1.046
342 HD23 LEU 45 3HD2 LEU 45 26.586 24.705 0.407
343 H ALA 46 H ALA 46 26.670 26.872 5.852
344 HA ALA 46 HA ALA 46 26.766 29.615 5.113
345 HB1 ALA 46 1HB ALA 46 25.682 30.040 7.190
346 HB2 ALA 46 2HB ALA 46 25.056 28.512 6.536
347 HB3 ALA 46 3HB ALA 46 26.235 28.489 7.863
348 H GLU 47 H GLU 47 28.638 27.908 7.738
349 HA GLU 47 HA GLU 47 29.885 30.311 8.635
350 HB2 GLU 47 1HB GLU 47 31.475 28.941 9.795
351 HB3 GLU 47 2HB GLU 47 29.867 28.229 9.939
352 HG2 GLU 47 1HG GLU 47 30.441 26.589 8.204
353 HG3 GLU 47 2HG GLU 47 32.057 27.289 8.062
354 H ALA 48 H ALA 48 30.686 28.162 5.989
355 HA ALA 48 HA ALA 48 33.243 29.204 5.386
356 HB1 ALA 48 1HB ALA 48 32.224 27.060 4.522
357 HB2 ALA 48 2HB ALA 48 31.183 28.046 3.471
358 HB3 ALA 48 3HB ALA 48 32.938 28.083 3.267
359 H LEU 49 H LEU 49 29.941 30.149 4.431
360 HA LEU 49 HA LEU 49 30.731 32.255 2.628
361 HB2 LEU 49 1HB LEU 49 28.454 31.193 2.740
362 HB3 LEU 49 2HB LEU 49 28.221 31.937 4.312
363 HG LEU 49 HG LEU 49 28.629 34.189 3.068
364 HD11 LEU 49 1HD1 LEU 49 27.740 32.378 0.803
365 HD12 LEU 49 2HD1 LEU 49 29.336 33.137 0.959
366 HD13 LEU 49 3HD1 LEU 49 27.896 34.146 0.743
367 HD21 LEU 49 1HD2 LEU 49 26.240 34.368 2.657
368 HD22 LEU 49 2HD2 LEU 49 26.531 33.460 4.153
369 HD23 LEU 49 3HD2 LEU 49 26.076 32.596 2.664
370 H LEU 50 H LEU 50 29.947 32.113 6.119
371 HA LEU 50 HA LEU 50 29.902 34.936 6.544
372 HB2 LEU 50 1HB LEU 50 30.780 32.869 8.581
373 HB3 LEU 50 2HB LEU 50 30.118 34.460 8.897
374 HG LEU 50 HG LEU 50 28.711 31.962 8.079
375 HD11 LEU 50 1HD1 LEU 50 28.276 33.888 10.328
376 HD12 LEU 50 2HD1 LEU 50 29.115 32.316 10.406
377 HD13 LEU 50 3HD1 LEU 50 27.386 32.369 10.031
378 HD21 LEU 50 1HD2 LEU 50 26.590 33.231 7.919
379 HD22 LEU 50 2HD2 LEU 50 27.714 33.510 6.583
380 HD23 LEU 50 3HD2 LEU 50 27.550 34.733 7.874
381 H SER 51 H SER 51 32.533 32.641 6.353
382 HA SER 51 HA SER 51 34.506 34.323 7.608
383 HB2 SER 51 1HB SER 51 34.735 31.978 5.717
384 HB3 SER 51 2HB SER 51 36.040 32.652 6.698
385 HG SER 51 HG SER 51 33.631 31.476 7.674
386 H GLY 52 H GLY 52 33.060 34.244 4.442
387 HA2 GLY 52 1HA GLY 52 33.430 35.788 2.737
388 HA3 GLY 52 2HA GLY 52 34.884 36.360 3.563
389 H ASP 53 H ASP 53 36.031 33.654 3.788
390 HA ASP 53 HA ASP 53 37.625 33.572 1.491
391 HB2 ASP 53 1HB ASP 53 37.150 31.882 3.809
392 HB3 ASP 53 2HB ASP 53 37.794 31.053 2.385
393 H LEU 54 H LEU 54 37.006 33.331 -0.523
394 HA LEU 54 HA LEU 54 34.680 31.859 -1.277
395 HB2 LEU 54 1HB LEU 54 35.790 33.600 -2.668
396 HB3 LEU 54 2HB LEU 54 37.131 32.504 -2.956
397 HG LEU 54 HG LEU 54 35.289 32.832 -4.729
398 HD11 LEU 54 1HD1 LEU 54 37.132 31.213 -4.928
399 HD12 LEU 54 2HD1 LEU 54 35.628 30.660 -5.690
400 HD13 LEU 54 3HD1 LEU 54 36.118 29.999 -4.120
401 HD21 LEU 54 1HD2 LEU 54 33.866 30.708 -3.126
402 HD22 LEU 54 2HD2 LEU 54 33.418 31.315 -4.717
403 HD23 LEU 54 3HD2 LEU 54 33.332 32.391 -3.313
404 H GLU 55 H GLU 55 38.134 30.988 -0.941
405 HA GLU 55 HA GLU 55 37.923 28.491 -2.253
406 HB2 GLU 55 1HB GLU 55 39.901 27.812 -0.962
407 HB3 GLU 55 2HB GLU 55 40.080 29.360 -1.786
408 HG2 GLU 55 1HG GLU 55 39.840 30.562 0.305
409 HG3 GLU 55 2HG GLU 55 39.472 29.057 1.167
410 H LYS 56 H LYS 56 37.324 29.251 1.228
411 HA LYS 56 HA LYS 56 36.713 26.470 1.734
412 HB2 LYS 56 1HB LYS 56 36.052 27.092 3.935
413 HB3 LYS 56 2HB LYS 56 37.527 27.998 3.487
414 HG2 LYS 56 1HG LYS 56 36.044 29.909 3.040
415 HG3 LYS 56 2HG LYS 56 34.766 29.012 3.832
416 HD2 LYS 56 1HD LYS 56 37.503 29.492 5.077
417 HD3 LYS 56 2HD LYS 56 36.151 30.584 5.295
418 HE2 LYS 56 1HE LYS 56 34.818 28.708 6.290
419 HE3 LYS 56 2HE LYS 56 36.265 27.686 6.185
420 HZ1 LYS 56 1HZ LYS 56 35.977 30.190 7.750
421 HZ2 LYS 56 2HZ LYS 56 37.390 29.344 7.604
422 HZ3 LYS 56 3HZ LYS 56 36.091 28.662 8.363
423 H PHE 57 H PHE 57 34.781 29.350 0.869
424 HA PHE 57 HA PHE 57 32.243 28.094 1.215
425 HB2 PHE 57 1HB PHE 57 32.494 30.498 0.776
426 HB3 PHE 57 2HB PHE 57 33.085 30.147 -0.853
427 HD1 PHE 57 HD1 PHE 57 31.583 29.761 -2.664
428 HD2 PHE 57 HD2 PHE 57 30.112 29.819 1.384
429 HE1 PHE 57 HE1 PHE 57 29.243 29.726 -3.509
430 HE2 PHE 57 HE2 PHE 57 27.772 29.774 0.537
431 HZ PHE 57 HZ PHE 57 27.342 29.727 -1.921
432 H SER 58 H SER 58 34.327 28.287 -1.724
433 HA SER 58 HA SER 58 32.692 26.582 -3.303
434 HB2 SER 58 1HB SER 58 34.529 28.055 -4.137
435 HB3 SER 58 2HB SER 58 35.711 26.949 -3.412
436 HG SER 58 HG SER 58 34.735 25.283 -4.759
437 H ARG 59 H ARG 59 35.409 25.776 -1.086
438 HA ARG 59 HA ARG 59 35.592 23.032 -1.862
439 HB2 ARG 59 1HB ARG 59 37.315 24.091 -0.523
440 HB3 ARG 59 2HB ARG 59 36.162 24.463 0.756
441 HG2 ARG 59 1HG ARG 59 36.238 21.599 0.236
442 HG3 ARG 59 2HG ARG 59 37.851 22.237 0.613
443 HD2 ARG 59 1HD ARG 59 37.096 23.174 2.689
444 HD3 ARG 59 2HD ARG 59 35.398 22.923 2.248
445 HE ARG 59 HE ARG 59 35.512 20.681 2.814
446 HH11 ARG 59 1HH1 ARG 59 38.758 22.088 3.113
447 HH12 ARG 59 2HH1 ARG 59 39.366 20.700 3.973
448 HH21 ARG 59 1HH2 ARG 59 36.359 18.959 3.825
449 HH22 ARG 59 2HH2 ARG 59 38.024 18.953 4.385
450 H VAL 60 H VAL 60 33.633 24.630 0.699
451 HA VAL 60 HA VAL 60 32.464 22.116 1.511
452 HB VAL 60 HB VAL 60 31.476 24.957 2.031
453 HG11 VAL 60 1HG1 VAL 60 29.681 23.381 2.420
454 HG12 VAL 60 2HG1 VAL 60 30.775 22.262 3.272
455 HG13 VAL 60 3HG1 VAL 60 30.355 23.828 3.996
456 HG21 VAL 60 1HG2 VAL 60 32.582 24.660 4.241
457 HG22 VAL 60 2HG2 VAL 60 33.203 23.076 3.718
458 HG23 VAL 60 3HG2 VAL 60 33.761 24.563 2.926
459 H LEU 61 H LEU 61 31.629 24.620 -0.876
460 HA LEU 61 HA LEU 61 28.984 23.818 -1.448
461 HB2 LEU 61 1HB LEU 61 30.373 25.773 -2.413
462 HB3 LEU 61 2HB LEU 61 31.011 24.608 -3.561
463 HG LEU 61 HG LEU 61 28.345 24.214 -3.934
464 HD11 LEU 61 1HD1 LEU 61 27.228 26.371 -3.940
465 HD12 LEU 61 2HD1 LEU 61 28.699 27.171 -3.332
466 HD13 LEU 61 3HD1 LEU 61 27.812 26.015 -2.297
467 HD21 LEU 61 1HD2 LEU 61 30.229 24.935 -5.612
468 HD22 LEU 61 2HD2 LEU 61 29.615 26.582 -5.313
469 HD23 LEU 61 3HD2 LEU 61 28.541 25.347 -5.974
470 H VAL 62 H VAL 62 32.094 22.475 -2.684
471 HA VAL 62 HA VAL 62 30.807 20.548 -4.412
472 HB VAL 62 HB VAL 62 33.595 20.461 -3.137
473 HG11 VAL 62 1HG1 VAL 62 32.431 18.926 -5.511
474 HG12 VAL 62 2HG1 VAL 62 34.152 18.945 -5.052
475 HG13 VAL 62 3HG1 VAL 62 32.952 18.242 -3.955
476 HG21 VAL 62 1HG2 VAL 62 32.686 21.480 -5.855
477 HG22 VAL 62 2HG2 VAL 62 33.261 22.467 -4.499
478 HG23 VAL 62 3HG2 VAL 62 34.372 21.352 -5.300
479 H GLU 63 H GLU 63 32.080 20.368 -1.058
480 HA GLU 63 HA GLU 63 31.618 17.563 -0.708
481 HB2 GLU 63 1HB GLU 63 31.574 19.865 1.268
482 HB3 GLU 63 2HB GLU 63 31.474 18.167 1.744
483 HG2 GLU 63 1HG GLU 63 33.662 17.724 0.762
484 HG3 GLU 63 2HG GLU 63 33.769 19.394 0.194
485 H GLN 64 H GLN 64 29.503 20.393 -0.172
486 HA GLN 64 HA GLN 64 27.279 18.863 0.835
487 HB2 GLN 64 1HB GLN 64 27.478 21.574 -0.523
488 HB3 GLN 64 2HB GLN 64 25.964 20.916 0.108
489 HG2 GLN 64 1HG GLN 64 28.454 21.416 1.769
490 HG3 GLN 64 2HG GLN 64 27.061 22.497 1.671
491 HE21 GLN 64 1HE2 GLN 64 27.034 19.771 4.466
492 HE22 GLN 64 2HE2 GLN 64 28.437 20.488 3.709
493 H GLN 65 H GLN 65 28.276 19.875 -2.469
494 HA GLN 65 HA GLN 65 25.891 18.911 -3.725
495 HB2 GLN 65 1HB GLN 65 28.693 19.369 -4.751
496 HB3 GLN 65 2HB GLN 65 27.418 18.678 -5.763
497 HG2 GLN 65 1HG GLN 65 26.000 20.669 -5.249
498 HG3 GLN 65 2HG GLN 65 27.375 21.399 -4.440
499 HE21 GLN 65 1HE2 GLN 65 28.724 22.643 -7.388
500 HE22 GLN 65 2HE2 GLN 65 28.674 22.642 -5.637
501 H GLN 66 H GLN 66 28.960 17.254 -2.861
502 HA GLN 66 HA GLN 66 28.308 14.826 -4.232
503 HB2 GLN 66 1HB GLN 66 29.999 15.352 -1.767
504 HB3 GLN 66 2HB GLN 66 29.830 13.759 -2.510
505 HG2 GLN 66 1HG GLN 66 30.719 14.676 -4.636
506 HG3 GLN 66 2HG GLN 66 30.989 16.224 -3.828
507 HE21 GLN 66 1HE2 GLN 66 34.118 15.250 -2.705
508 HE22 GLN 66 2HE2 GLN 66 33.039 16.503 -3.269
509 H ASP 67 H ASP 67 27.493 15.982 -0.931
510 HA ASP 67 HA ASP 67 26.307 13.425 -0.224
511 HB2 ASP 67 1HB ASP 67 27.267 15.143 1.386
512 HB3 ASP 67 2HB ASP 67 25.809 16.099 1.084
513 H ARG 68 H ARG 68 25.017 16.584 -1.303
514 HA ARG 68 HA ARG 68 22.289 15.808 -0.853
515 HB2 ARG 68 1HB ARG 68 21.691 17.806 -1.876
516 HB3 ARG 68 2HB ARG 68 23.206 18.113 -1.047
517 HG2 ARG 68 1HG ARG 68 23.724 19.208 -2.912
518 HG3 ARG 68 2HG ARG 68 24.127 17.600 -3.518
519 HD2 ARG 68 1HD ARG 68 21.793 17.387 -4.349
520 HD3 ARG 68 2HD ARG 68 21.496 19.056 -3.850
521 HE ARG 68 HE ARG 68 22.949 18.117 -6.193
522 HH11 ARG 68 1HH1 ARG 68 22.431 20.868 -4.050
523 HH12 ARG 68 2HH1 ARG 68 22.966 22.028 -5.246
524 HH21 ARG 68 1HH2 ARG 68 23.654 19.657 -7.653
525 HH22 ARG 68 2HH2 ARG 68 23.650 21.350 -7.225
526 H ALA 69 H ALA 69 24.433 15.576 -3.569
527 HA ALA 69 HA ALA 69 22.621 14.766 -5.579
528 HB1 ALA 69 1HB ALA 69 25.488 13.843 -5.121
529 HB2 ALA 69 2HB ALA 69 24.560 13.609 -6.625
530 HB3 ALA 69 3HB ALA 69 24.956 15.251 -6.075
531 H ARG 70 H ARG 70 23.962 12.853 -2.883
532 HA ARG 70 HA ARG 70 23.090 10.303 -3.877
533 HB2 ARG 70 1HB ARG 70 23.527 11.311 -1.037
534 HB3 ARG 70 2HB ARG 70 23.272 9.614 -1.493
535 HG2 ARG 70 1HG ARG 70 25.249 9.813 -3.009
536 HG3 ARG 70 2HG ARG 70 25.556 11.411 -2.318
537 HD2 ARG 70 1HD ARG 70 25.216 9.045 -0.507
538 HD3 ARG 70 2HD ARG 70 26.738 9.257 -1.372
539 HE ARG 70 HE ARG 70 25.608 11.171 0.637
540 HH11 ARG 70 1HH1 ARG 70 28.423 9.958 -1.146
541 HH12 ARG 70 2HH1 ARG 70 29.536 10.874 -0.167
542 HH21 ARG 70 1HH2 ARG 70 27.072 12.285 1.816
543 HH22 ARG 70 2HH2 ARG 70 28.792 12.164 1.477
544 H ARG 71 H ARG 71 21.538 12.740 -1.793
545 HA ARG 71 HA ARG 71 19.106 11.183 -1.426
546 HB2 ARG 71 1HB ARG 71 19.582 14.184 -1.235
547 HB3 ARG 71 2HB ARG 71 18.154 13.330 -0.646
548 HG2 ARG 71 1HG ARG 71 19.497 12.153 1.007
549 HG3 ARG 71 2HG ARG 71 20.977 12.919 0.375
550 HD2 ARG 71 1HD ARG 71 19.986 15.141 0.839
551 HD3 ARG 71 2HD ARG 71 18.586 14.340 1.575
552 HE ARG 71 HE ARG 71 19.876 13.749 3.439
553 HH11 ARG 71 1HH1 ARG 71 21.973 15.243 1.023
554 HH12 ARG 71 2HH1 ARG 71 23.305 15.378 2.154
555 HH21 ARG 71 1HH2 ARG 71 21.655 13.981 4.797
556 HH22 ARG 71 2HH2 ARG 71 23.141 14.679 4.178
557 H GLU 72 H GLU 72 20.283 13.563 -3.759
558 HA GLU 72 HA GLU 72 17.763 14.211 -4.918
559 HB2 GLU 72 1HB GLU 72 20.579 14.279 -5.933
560 HB3 GLU 72 2HB GLU 72 19.237 14.560 -7.047
561 HG2 GLU 72 1HG GLU 72 18.402 16.358 -5.587
562 HG3 GLU 72 2HG GLU 72 19.790 16.121 -4.517
563 H GLN 73 H GLN 73 19.899 11.429 -5.523
564 HA GLN 73 HA GLN 73 18.627 10.479 -7.877
565 HB2 GLN 73 1HB GLN 73 19.919 9.013 -5.556
566 HB3 GLN 73 2HB GLN 73 19.410 8.218 -7.054
567 HG2 GLN 73 1HG GLN 73 20.978 9.463 -8.361
568 HG3 GLN 73 2HG GLN 73 21.333 10.556 -7.023
569 HE21 GLN 73 1HE2 GLN 73 24.071 8.696 -6.077
570 HE22 GLN 73 2HE2 GLN 73 23.299 10.252 -6.306
571 H GLU 74 H GLU 74 17.669 10.219 -4.459
572 HA GLU 74 HA GLU 74 15.365 8.525 -5.089
573 HB2 GLU 74 1HB GLU 74 16.025 10.126 -2.592
574 HB3 GLU 74 2HB GLU 74 14.778 8.883 -2.732
575 HG2 GLU 74 1HG GLU 74 16.540 7.201 -3.215
576 HG3 GLU 74 2HG GLU 74 17.777 8.454 -3.014
577 H ARG 75 H ARG 75 15.985 12.008 -4.615
578 HA ARG 75 HA ARG 75 13.177 12.682 -4.443
579 HB2 ARG 75 1HB ARG 75 15.565 14.408 -5.178
580 HB3 ARG 75 2HB ARG 75 13.930 15.001 -4.890
581 HG2 ARG 75 1HG ARG 75 14.119 13.856 -2.573
582 HG3 ARG 75 2HG ARG 75 15.858 13.795 -2.904
583 HD2 ARG 75 1HD ARG 75 15.474 15.802 -1.678
584 HD3 ARG 75 2HD ARG 75 15.745 16.290 -3.368
585 HE ARG 75 HE ARG 75 12.951 15.868 -2.906
586 HH11 ARG 75 1HH1 ARG 75 15.468 18.233 -2.177
587 HH12 ARG 75 2HH1 ARG 75 14.325 19.542 -2.044
588 HH21 ARG 75 1HH2 ARG 75 11.558 17.583 -2.719
589 HH22 ARG 75 2HH2 ARG 75 12.153 19.177 -2.346
590 H ILE 76 H ILE 76 15.411 12.468 -7.215
591 HA ILE 76 HA ILE 76 13.632 13.773 -9.056
592 HB ILE 76 HB ILE 76 14.968 12.787 -10.858
593 HG12 ILE 76 1HG1 ILE 76 16.456 11.292 -8.673
594 HG13 ILE 76 2HG1 ILE 76 15.311 10.554 -9.789
595 HG21 ILE 76 1HG2 ILE 76 17.061 13.919 -10.298
596 HG22 ILE 76 2HG2 ILE 76 15.691 14.832 -9.639
597 HG23 ILE 76 3HG2 ILE 76 16.680 13.826 -8.568
598 HD11 ILE 76 1HD1 ILE 76 17.544 10.093 -10.568
599 HD12 ILE 76 2HD1 ILE 76 16.801 11.252 -11.693
600 HD13 ILE 76 3HD1 ILE 76 17.990 11.810 -10.490
601 H ARG 77 H ARG 77 13.387 10.732 -7.545
602 HA ARG 77 HA ARG 77 11.952 9.260 -9.558
603 HB2 ARG 77 1HB ARG 77 11.630 9.317 -6.536
604 HB3 ARG 77 2HB ARG 77 10.857 8.138 -7.589
605 HG2 ARG 77 1HG ARG 77 13.868 8.462 -7.482
606 HG3 ARG 77 2HG ARG 77 12.965 7.391 -6.393
607 HD2 ARG 77 1HD ARG 77 11.960 6.280 -8.383
608 HD3 ARG 77 2HD ARG 77 13.017 7.259 -9.422
609 HE ARG 77 HE ARG 77 14.725 6.060 -7.590
610 HH11 ARG 77 1HH1 ARG 77 12.424 4.858 -9.983
611 HH12 ARG 77 2HH1 ARG 77 13.302 3.369 -10.220
612 HH21 ARG 77 1HH2 ARG 77 15.796 4.146 -7.948
613 HH22 ARG 77 2HH2 ARG 77 15.181 2.977 -9.083
614 H LEU 78 H LEU 78 11.080 12.135 -7.839
615 HA LEU 78 HA LEU 78 8.211 11.742 -8.495
616 HB2 LEU 78 1HB LEU 78 9.012 12.556 -6.206
617 HB3 LEU 78 2HB LEU 78 9.512 14.041 -6.987
618 HG LEU 78 HG LEU 78 7.115 14.438 -7.647
619 HD11 LEU 78 1HD1 LEU 78 6.600 11.997 -5.899
620 HD12 LEU 78 2HD1 LEU 78 6.255 12.151 -7.639
621 HD13 LEU 78 3HD1 LEU 78 5.354 13.131 -6.469
622 HD21 LEU 78 1HD2 LEU 78 6.385 15.072 -5.389
623 HD22 LEU 78 2HD2 LEU 78 8.099 15.456 -5.641
624 HD23 LEU 78 3HD2 LEU 78 7.639 14.028 -4.680
625 H PHE 79 H PHE 79 8.912 15.034 -8.497
626 HA PHE 79 HA PHE 79 9.699 15.166 -11.345
627 HB2 PHE 79 1HB PHE 79 7.122 16.361 -10.230
628 HB3 PHE 79 2HB PHE 79 7.764 16.636 -11.851
629 HD1 PHE 79 HD1 PHE 79 7.649 14.891 -13.575
630 HD2 PHE 79 HD2 PHE 79 6.056 14.226 -9.635
631 HE1 PHE 79 HE1 PHE 79 6.406 12.905 -14.418
632 HE2 PHE 79 HE2 PHE 79 4.809 12.239 -10.466
633 HZ PHE 79 HZ PHE 79 4.980 11.574 -12.863
634 H SER 80 H SER 80 10.315 17.351 -11.942
635 HA SER 80 HA SER 80 10.210 19.466 -9.903
636 HB2 SER 80 1HB SER 80 12.854 18.556 -11.133
637 HB3 SER 80 2HB SER 80 12.618 19.962 -10.070
638 HG SER 80 HG SER 80 11.569 17.885 -8.827
639 H ALA 81 H ALA 81 9.874 21.398 -11.031
640 HA ALA 81 HA ALA 81 10.555 21.646 -13.869
641 HB1 ALA 81 1HB ALA 81 7.617 21.367 -13.042
642 HB2 ALA 81 2HB ALA 81 8.207 21.803 -14.662
643 HB3 ALA 81 3HB ALA 81 8.536 20.184 -14.008
644 H ASP 82 H ASP 82 11.137 23.067 -11.464
645 HA ASP 82 HA ASP 82 9.342 25.229 -11.012
646 HB2 ASP 82 1HB ASP 82 12.306 24.944 -10.406
647 HB3 ASP 82 2HB ASP 82 11.213 26.131 -9.674
648 HA PRO 83 HA PRO 83 10.440 27.784 -14.406
649 HB2 PRO 83 1HB PRO 83 9.618 30.247 -13.619
650 HB3 PRO 83 2HB PRO 83 8.455 28.905 -13.870
651 HG2 PRO 83 1HG PRO 83 9.726 29.849 -11.312
652 HG3 PRO 83 2HG PRO 83 7.989 29.600 -11.679
653 HD2 PRO 83 1HD PRO 83 9.468 27.710 -10.417
654 HD3 PRO 83 2HD PRO 83 8.190 27.264 -11.600
655 H PHE 84 H PHE 84 11.751 29.577 -15.176
656 HA PHE 84 HA PHE 84 13.908 30.437 -13.289
657 HB2 PHE 84 1HB PHE 84 14.314 29.410 -16.124
658 HB3 PHE 84 2HB PHE 84 15.565 30.001 -15.031
659 HD1 PHE 84 HD1 PHE 84 13.924 27.112 -16.250
660 HD2 PHE 84 HD2 PHE 84 15.715 28.734 -12.692
661 HE1 PHE 84 HE1 PHE 84 14.206 24.809 -15.349
662 HE2 PHE 84 HE2 PHE 84 15.985 26.437 -11.777
663 HZ PHE 84 HZ PHE 84 15.239 24.466 -13.109
664 H ASP 85 H ASP 85 11.575 31.819 -14.139
665 HA ASP 85 HA ASP 85 12.193 33.491 -16.435
666 HB2 ASP 85 1HB ASP 85 9.891 33.461 -14.447
667 HB3 ASP 85 2HB ASP 85 9.995 34.566 -15.830
668 H LEU 86 H LEU 86 14.239 33.892 -14.790
669 HA LEU 86 HA LEU 86 13.847 36.139 -12.973
670 HB2 LEU 86 1HB LEU 86 16.307 35.036 -14.351
671 HB3 LEU 86 2HB LEU 86 16.331 36.242 -13.068
672 HG LEU 86 HG LEU 86 15.372 33.370 -12.785
673 HD11 LEU 86 1HD1 LEU 86 17.430 33.041 -11.497
674 HD12 LEU 86 2HD1 LEU 86 17.899 34.736 -11.776
675 HD13 LEU 86 3HD1 LEU 86 17.813 33.598 -13.139
676 HD21 LEU 86 1HD2 LEU 86 14.192 34.803 -11.198
677 HD22 LEU 86 2HD2 LEU 86 15.719 35.575 -10.706
678 HD23 LEU 86 3HD2 LEU 86 15.420 33.860 -10.335
679 H GLU 87 H GLU 87 14.247 35.665 -16.368
680 HA GLU 87 HA GLU 87 15.164 38.265 -17.153
681 HB2 GLU 87 1HB GLU 87 13.372 36.258 -18.579
682 HB3 GLU 87 2HB GLU 87 14.193 37.620 -19.346
683 HG2 GLU 87 1HG GLU 87 15.528 35.249 -17.998
684 HG3 GLU 87 2HG GLU 87 15.366 35.513 -19.732
685 H ALA 88 H ALA 88 12.108 37.049 -16.046
686 HA ALA 88 HA ALA 88 10.524 39.153 -17.266
687 HB1 ALA 88 1HB ALA 88 9.652 36.848 -16.903
688 HB2 ALA 88 2HB ALA 88 9.747 37.113 -15.147
689 HB3 ALA 88 3HB ALA 88 8.639 38.092 -16.134
690 H GLN 89 H GLN 89 12.686 39.474 -14.845
691 HA GLN 89 HA GLN 89 10.973 40.780 -12.862
692 HB2 GLN 89 1HB GLN 89 13.993 40.657 -13.145
693 HB3 GLN 89 2HB GLN 89 13.133 41.410 -11.793
694 HG2 GLN 89 1HG GLN 89 13.045 38.478 -12.569
695 HG3 GLN 89 2HG GLN 89 13.860 39.173 -11.165
696 HE21 GLN 89 1HE2 GLN 89 10.160 37.904 -10.777
697 HE22 GLN 89 2HE2 GLN 89 11.321 37.389 -11.979
698 H ALA 90 H ALA 90 11.060 42.966 -12.237
699 HA ALA 90 HA ALA 90 10.905 44.730 -14.496
700 HB1 ALA 90 1HB ALA 90 9.446 44.968 -12.518
701 HB2 ALA 90 2HB ALA 90 10.867 45.341 -11.510
702 HB3 ALA 90 3HB ALA 90 10.378 46.456 -12.804
703 H LYS 91 H LYS 91 12.197 46.290 -15.210
704 HA LYS 91 HA LYS 91 15.005 46.362 -14.274
705 HB2 LYS 91 1HB LYS 91 15.271 47.855 -16.279
706 HB3 LYS 91 2HB LYS 91 14.681 46.234 -16.668
707 HG2 LYS 91 1HG LYS 91 12.558 46.976 -17.232
708 HG3 LYS 91 2HG LYS 91 12.665 48.405 -16.196
709 HD2 LYS 91 1HD LYS 91 12.751 49.242 -18.361
710 HD3 LYS 91 2HD LYS 91 14.416 49.295 -17.771
711 HE2 LYS 91 1HE LYS 91 14.911 47.206 -19.020
712 HE3 LYS 91 2HE LYS 91 13.233 47.194 -19.621
713 HZ1 LYS 91 1HZ LYS 91 15.299 49.257 -20.125
714 HZ2 LYS 91 2HZ LYS 91 13.718 49.495 -20.478
715 HZ3 LYS 91 3HZ LYS 91 14.564 48.292 -21.246
716 H ILE 92 H ILE 92 15.989 48.639 -14.209
717 HA ILE 92 HA ILE 92 14.149 50.678 -13.109
718 HB ILE 92 HB ILE 92 16.873 49.878 -11.922
719 HG12 ILE 92 1HG1 ILE 92 14.115 49.730 -10.629
720 HG13 ILE 92 2HG1 ILE 92 14.946 48.346 -11.339
721 HG21 ILE 92 1HG2 ILE 92 14.909 52.068 -11.030
722 HG22 ILE 92 2HG2 ILE 92 16.454 51.668 -10.243
723 HG23 ILE 92 3HG2 ILE 92 16.450 52.354 -11.874
724 HD11 ILE 92 1HD1 ILE 92 15.845 49.937 -8.904
725 HD12 ILE 92 2HD1 ILE 92 15.269 48.259 -8.955
726 HD13 ILE 92 3HD1 ILE 92 16.829 48.681 -9.694
727 H GLU 93 H GLU 93 14.570 52.549 -14.126
728 HA GLU 93 HA GLU 93 17.090 52.853 -15.691
729 HB2 GLU 93 1HB GLU 93 14.269 53.752 -16.422
730 HB3 GLU 93 2HB GLU 93 15.743 54.183 -17.295
731 HG2 GLU 93 1HG GLU 93 16.142 51.728 -17.711
732 HG3 GLU 93 2HG GLU 93 14.563 51.402 -16.982
733 H GLU 94 H GLU 94 17.641 55.233 -15.962
734 HA GLU 94 HA GLU 94 16.775 56.744 -13.526
735 HB2 GLU 94 1HB GLU 94 19.470 56.730 -14.932
736 HB3 GLU 94 2HB GLU 94 19.032 57.755 -13.565
737 HG2 GLU 94 1HG GLU 94 18.715 55.714 -12.178
738 HG3 GLU 94 2HG GLU 94 19.279 54.737 -13.548
739 H ASP 95 H ASP 95 16.444 58.938 -13.677
740 HA ASP 95 HA ASP 95 16.868 60.210 -16.346
741 HB2 ASP 95 1HB ASP 95 14.449 59.882 -16.022
742 HB3 ASP 95 2HB ASP 95 14.539 60.722 -14.464
743 H ILE 96 H ILE 96 18.934 60.735 -15.412
744 HA ILE 96 HA ILE 96 18.938 62.617 -13.146
745 HB ILE 96 HB ILE 96 21.420 62.554 -13.409
746 HG12 ILE 96 1HG1 ILE 96 20.926 60.458 -15.571
747 HG13 ILE 96 2HG1 ILE 96 21.333 62.140 -15.931
748 HG21 ILE 96 1HG2 ILE 96 20.179 59.750 -13.360
749 HG22 ILE 96 2HG2 ILE 96 21.695 60.261 -12.592
750 HG23 ILE 96 3HG2 ILE 96 20.148 60.885 -11.993
751 HD11 ILE 96 1HD1 ILE 96 23.477 61.858 -14.654
752 HD12 ILE 96 2HD1 ILE 96 23.082 60.134 -14.448
753 HD13 ILE 96 3HD1 ILE 96 23.345 60.795 -16.073
754 H ARG 97 H ARG 97 17.563 63.393 -15.646
755 HA ARG 97 HA ARG 97 19.331 65.387 -16.838
756 HB2 ARG 97 1HB ARG 97 17.489 64.011 -18.004
757 HB3 ARG 97 2HB ARG 97 16.345 65.102 -17.230
758 HG2 ARG 97 1HG ARG 97 16.576 65.897 -19.429
759 HG3 ARG 97 2HG ARG 97 17.550 67.012 -18.470
760 HD2 ARG 97 1HD ARG 97 18.704 64.612 -19.946
761 HD3 ARG 97 2HD ARG 97 18.578 66.225 -20.665
762 HE ARG 97 HE ARG 97 20.485 65.321 -18.644
763 HH11 ARG 97 1HH1 ARG 97 19.014 68.181 -20.106
764 HH12 ARG 97 2HH1 ARG 97 20.311 69.224 -19.588
765 HH21 ARG 97 1HH2 ARG 97 22.089 66.710 -18.012
766 HH22 ARG 97 2HH2 ARG 97 22.019 68.401 -18.423
767 H GLN 98 H GLN 98 17.931 65.268 -14.065
768 HA GLN 98 HA GLN 98 17.238 68.176 -13.881
769 HB2 GLN 98 1HB GLN 98 16.367 65.897 -12.036
770 HB3 GLN 98 2HB GLN 98 15.935 67.600 -11.851
771 HG2 GLN 98 1HG GLN 98 14.836 67.528 -14.138
772 HG3 GLN 98 2HG GLN 98 15.185 65.799 -14.227
773 HE21 GLN 98 1HE2 GLN 98 12.327 64.911 -12.533
774 HE22 GLN 98 2HE2 GLN 98 13.559 64.523 -13.705
775 HXT GLN 98 HO GLN 98 19.508 68.781 -11.527
Start of MODEL 9
1 H1 SER 1 1H SER 1 2.284 0.642 -0.547
2 H2 SER 1 2H SER 1 3.122 -0.350 0.498
3 H3 SER 1 3H SER 1 1.863 -0.981 -0.425
4 HA SER 1 HA SER 1 4.144 -1.565 -1.281
5 HB2 SER 1 1HB SER 1 2.410 0.147 -3.096
6 HB3 SER 1 2HB SER 1 3.535 -1.058 -3.635
7 HG SER 1 HG SER 1 1.006 -1.360 -2.685
8 H GLN 2 H GLN 2 6.085 -0.994 -2.051
9 HA GLN 2 HA GLN 2 6.685 1.895 -2.517
10 HB2 GLN 2 1HB GLN 2 8.312 -0.064 -0.839
11 HB3 GLN 2 2HB GLN 2 8.854 1.549 -1.323
12 HG2 GLN 2 1HG GLN 2 7.006 2.560 -0.032
13 HG3 GLN 2 2HG GLN 2 6.459 0.947 0.451
14 HE21 GLN 2 1HE2 GLN 2 9.057 2.775 2.752
15 HE22 GLN 2 2HE2 GLN 2 7.962 3.537 1.623
16 H GLN 3 H GLN 3 8.101 2.171 -4.259
17 HA GLN 3 HA GLN 3 9.438 -0.200 -5.389
18 HB2 GLN 3 1HB GLN 3 7.030 -0.167 -6.205
19 HB3 GLN 3 2HB GLN 3 7.398 1.345 -7.035
20 HG2 GLN 3 1HG GLN 3 9.163 0.155 -8.338
21 HG3 GLN 3 2HG GLN 3 8.719 -1.352 -7.521
22 HE21 GLN 3 1HE2 GLN 3 6.809 -0.315 -10.825
23 HE22 GLN 3 2HE2 GLN 3 8.357 0.305 -10.307
24 H SER 4 H SER 4 11.218 1.319 -4.649
25 HA SER 4 HA SER 4 11.736 3.342 -6.781
26 HB2 SER 4 1HB SER 4 13.052 4.591 -5.082
27 HB3 SER 4 2HB SER 4 11.326 4.483 -4.675
28 HG SER 4 HG SER 4 13.300 3.817 -3.143
29 H HIS 5 H HIS 5 13.622 3.330 -7.779
30 HA HIS 5 HA HIS 5 16.028 2.144 -6.760
31 HB2 HIS 5 1HB HIS 5 14.781 0.069 -7.539
32 HB3 HIS 5 2HB HIS 5 14.750 0.765 -9.163
33 HD1 HIS 5 HD1 HIS 5 17.432 -0.069 -6.521
34 HD2 HIS 5 HD2 HIS 5 16.848 -0.032 -10.648
35 HE1 HIS 5 HE1 HIS 5 19.547 -0.974 -7.575
36 H SER 6 H SER 6 17.713 3.177 -7.871
37 HA SER 6 HA SER 6 17.243 4.430 -10.490
38 HB2 SER 6 1HB SER 6 17.760 6.707 -9.587
39 HB3 SER 6 2HB SER 6 16.216 6.066 -8.996
40 HG SER 6 HG SER 6 17.379 6.909 -7.270
41 H SER 7 H SER 7 19.303 6.001 -10.791
42 HA SER 7 HA SER 7 21.732 4.901 -9.529
43 HB2 SER 7 1HB SER 7 21.256 4.891 -12.547
44 HB3 SER 7 2HB SER 7 22.759 4.427 -11.724
45 HG SER 7 HG SER 7 20.898 3.001 -10.584
46 HA PRO 8 HA PRO 8 22.616 9.187 -10.208
47 HB2 PRO 8 1HB PRO 8 25.314 9.367 -10.429
48 HB3 PRO 8 2HB PRO 8 24.541 8.833 -8.901
49 HG2 PRO 8 1HG PRO 8 25.691 7.163 -11.123
50 HG3 PRO 8 2HG PRO 8 26.035 7.088 -9.364
51 HD2 PRO 8 1HD PRO 8 24.248 5.427 -10.551
52 HD3 PRO 8 2HD PRO 8 23.992 6.064 -8.892
53 H GLY 9 H GLY 9 23.792 10.754 -11.773
54 HA2 GLY 9 1HA GLY 9 24.227 9.596 -14.460
55 HA3 GLY 9 2HA GLY 9 22.916 10.777 -14.287
56 H GLU 10 H GLU 10 23.606 12.849 -13.095
57 HA GLU 10 HA GLU 10 24.833 14.762 -13.082
58 HB2 GLU 10 1HB GLU 10 26.255 12.873 -11.839
59 HB3 GLU 10 2HB GLU 10 27.429 13.284 -13.092
60 HG2 GLU 10 1HG GLU 10 27.506 15.587 -12.344
61 HG3 GLU 10 2HG GLU 10 26.118 15.333 -11.271
62 H ILE 11 H ILE 11 24.197 13.625 -15.733
63 HA ILE 11 HA ILE 11 26.368 14.210 -17.455
64 HB ILE 11 HB ILE 11 23.406 13.492 -17.721
65 HG12 ILE 11 1HG1 ILE 11 25.807 11.748 -18.379
66 HG13 ILE 11 2HG1 ILE 11 25.071 11.787 -16.787
67 HG21 ILE 11 1HG2 ILE 11 23.924 14.631 -19.652
68 HG22 ILE 11 2HG2 ILE 11 25.455 13.757 -19.862
69 HG23 ILE 11 3HG2 ILE 11 23.896 12.919 -20.055
70 HD11 ILE 11 1HD1 ILE 11 22.870 11.085 -17.830
71 HD12 ILE 11 2HD1 ILE 11 23.758 10.832 -19.353
72 HD13 ILE 11 3HD1 ILE 11 24.172 9.876 -17.915
73 H THR 12 H THR 12 24.518 16.038 -15.665
74 HA THR 12 HA THR 12 24.348 18.316 -17.595
75 HB THR 12 HB THR 12 22.342 19.081 -16.273
76 HG1 THR 12 HG1 THR 12 22.905 17.764 -14.407
77 HG21 THR 12 1HG2 THR 12 22.013 16.271 -17.409
78 HG22 THR 12 2HG2 THR 12 22.078 17.755 -18.391
79 HG23 THR 12 3HG2 THR 12 20.752 17.507 -17.233
80 H SER 13 H SER 13 25.241 20.191 -16.966
81 HA SER 13 HA SER 13 26.656 20.341 -14.421
82 HB2 SER 13 1HB SER 13 27.237 22.622 -15.230
83 HB3 SER 13 2HB SER 13 27.601 21.369 -16.432
84 HG SER 13 HG SER 13 26.487 23.270 -17.241
85 H SER 14 H SER 14 26.354 22.417 -13.095
86 HA SER 14 HA SER 14 23.416 22.943 -12.751
87 HB2 SER 14 1HB SER 14 25.575 22.617 -10.654
88 HB3 SER 14 2HB SER 14 23.904 23.141 -10.341
89 HG SER 14 HG SER 14 24.741 20.664 -11.460
90 HA PRO 15 HA PRO 15 25.716 26.918 -13.610
91 HB2 PRO 15 1HB PRO 15 23.739 28.060 -15.096
92 HB3 PRO 15 2HB PRO 15 24.889 26.867 -15.749
93 HG2 PRO 15 1HG PRO 15 22.131 26.386 -14.718
94 HG3 PRO 15 2HG PRO 15 22.829 25.941 -16.311
95 HD2 PRO 15 1HD PRO 15 22.761 24.157 -14.335
96 HD3 PRO 15 2HD PRO 15 24.228 24.300 -15.366
97 H GLN 16 H GLN 16 22.956 26.009 -12.043
98 HA GLN 16 HA GLN 16 21.898 28.520 -11.097
99 HB2 GLN 16 1HB GLN 16 21.711 25.765 -9.827
100 HB3 GLN 16 2HB GLN 16 20.638 27.139 -9.532
101 HG2 GLN 16 1HG GLN 16 20.927 25.603 -12.140
102 HG3 GLN 16 2HG GLN 16 19.589 25.479 -10.995
103 HE21 GLN 16 1HE2 GLN 16 18.974 27.876 -13.926
104 HE22 GLN 16 2HE2 GLN 16 19.775 26.325 -13.886
105 H GLY 17 H GLY 17 24.627 28.760 -10.773
106 HA2 GLY 17 1HA GLY 17 25.919 29.796 -9.149
107 HA3 GLY 17 2HA GLY 17 24.732 29.356 -7.924
108 H LEU 18 H LEU 18 25.328 26.430 -9.235
109 HA LEU 18 HA LEU 18 27.238 25.870 -7.068
110 HB2 LEU 18 1HB LEU 18 26.037 23.916 -9.030
111 HB3 LEU 18 2HB LEU 18 26.800 23.553 -7.491
112 HG LEU 18 HG LEU 18 24.156 24.950 -7.957
113 HD11 LEU 18 1HD1 LEU 18 24.142 22.485 -8.239
114 HD12 LEU 18 2HD1 LEU 18 23.199 22.981 -6.824
115 HD13 LEU 18 3HD1 LEU 18 24.829 22.291 -6.620
116 HD21 LEU 18 1HD2 LEU 18 23.885 24.869 -5.451
117 HD22 LEU 18 2HD2 LEU 18 25.166 25.974 -5.971
118 HD23 LEU 18 3HD2 LEU 18 25.593 24.375 -5.315
119 H ASP 19 H ASP 19 27.041 25.757 -10.581
120 HA ASP 19 HA ASP 19 29.726 24.828 -11.093
121 HB2 ASP 19 1HB ASP 19 27.468 26.129 -12.525
122 HB3 ASP 19 2HB ASP 19 29.077 26.465 -13.195
123 H ASN 20 H ASN 20 28.257 27.833 -10.122
124 HA ASN 20 HA ASN 20 30.892 29.208 -10.306
125 HB2 ASN 20 1HB ASN 20 28.064 30.270 -10.712
126 HB3 ASN 20 2HB ASN 20 29.490 31.280 -10.538
127 HD21 ASN 20 1HD2 ASN 20 30.676 30.802 -13.774
128 HD22 ASN 20 2HD2 ASN 20 31.089 31.293 -12.156
129 HA PRO 21 HA PRO 21 29.489 29.079 -5.878
130 HB2 PRO 21 1HB PRO 21 32.078 28.910 -4.881
131 HB3 PRO 21 2HB PRO 21 31.094 27.491 -5.310
132 HG2 PRO 21 1HG PRO 21 33.131 28.907 -6.939
133 HG3 PRO 21 2HG PRO 21 32.960 27.163 -6.641
134 HD2 PRO 21 1HD PRO 21 32.103 28.182 -8.894
135 HD3 PRO 21 2HD PRO 21 31.106 26.970 -8.017
136 H ALA 22 H ALA 22 31.982 30.886 -7.651
137 HA ALA 22 HA ALA 22 32.402 32.925 -5.715
138 HB1 ALA 22 1HB ALA 22 33.252 34.248 -7.632
139 HB2 ALA 22 2HB ALA 22 33.886 32.587 -7.647
140 HB3 ALA 22 3HB ALA 22 32.571 33.052 -8.758
141 H LEU 23 H LEU 23 29.937 32.563 -8.271
142 HA LEU 23 HA LEU 23 28.866 35.239 -7.843
143 HB2 LEU 23 1HB LEU 23 27.609 32.840 -9.222
144 HB3 LEU 23 2HB LEU 23 27.052 34.505 -9.317
145 HG LEU 23 HG LEU 23 29.628 33.400 -10.479
146 HD11 LEU 23 1HD1 LEU 23 27.525 32.727 -11.635
147 HD12 LEU 23 2HD1 LEU 23 28.533 33.792 -12.635
148 HD13 LEU 23 3HD1 LEU 23 27.094 34.442 -11.815
149 HD21 LEU 23 1HD2 LEU 23 28.495 36.206 -10.654
150 HD22 LEU 23 2HD2 LEU 23 29.868 35.572 -11.598
151 HD23 LEU 23 3HD2 LEU 23 29.995 35.715 -9.832
152 H LEU 24 H LEU 24 28.045 31.907 -6.831
153 HA LEU 24 HA LEU 24 25.580 32.667 -5.576
154 HB2 LEU 24 1HB LEU 24 26.165 30.364 -6.209
155 HB3 LEU 24 2HB LEU 24 27.432 30.334 -4.991
156 HG LEU 24 HG LEU 24 25.851 30.339 -3.207
157 HD11 LEU 24 1HD1 LEU 24 24.158 31.894 -3.933
158 HD12 LEU 24 2HD1 LEU 24 23.375 30.338 -3.614
159 HD13 LEU 24 3HD1 LEU 24 23.696 30.834 -5.292
160 HD21 LEU 24 1HD2 LEU 24 24.691 28.263 -3.616
161 HD22 LEU 24 2HD2 LEU 24 26.264 28.215 -4.442
162 HD23 LEU 24 3HD2 LEU 24 24.781 28.509 -5.375
163 H ARG 25 H ARG 25 28.932 32.399 -4.381
164 HA ARG 25 HA ARG 25 28.476 33.021 -1.642
165 HB2 ARG 25 1HB ARG 25 30.611 32.256 -2.609
166 HB3 ARG 25 2HB ARG 25 30.753 33.715 -3.558
167 HG2 ARG 25 1HG ARG 25 30.653 33.908 -0.564
168 HG3 ARG 25 2HG ARG 25 32.135 33.366 -1.357
169 HD2 ARG 25 1HD ARG 25 30.706 35.991 -1.843
170 HD3 ARG 25 2HD ARG 25 32.197 35.778 -0.927
171 HE ARG 25 HE ARG 25 31.846 35.603 -3.868
172 HH11 ARG 25 1HH1 ARG 25 34.103 35.567 -1.120
173 HH12 ARG 25 2HH1 ARG 25 35.475 35.832 -2.159
174 HH21 ARG 25 1HH2 ARG 25 33.644 35.913 -5.091
175 HH22 ARG 25 2HH2 ARG 25 35.225 36.010 -4.361
176 H ASP 26 H ASP 26 28.967 35.148 -4.482
177 HA ASP 26 HA ASP 26 28.839 37.591 -3.017
178 HB2 ASP 26 1HB ASP 26 29.689 37.211 -5.375
179 HB3 ASP 26 2HB ASP 26 28.002 37.161 -5.901
180 H MET 27 H MET 27 26.295 35.788 -4.815
181 HA MET 27 HA MET 27 24.181 37.643 -4.309
182 HB2 MET 27 1HB MET 27 24.163 35.714 -5.935
183 HB3 MET 27 2HB MET 27 23.952 34.629 -4.553
184 HG2 MET 27 1HG MET 27 21.845 35.774 -3.977
185 HG3 MET 27 2HG MET 27 22.071 36.863 -5.350
186 HE1 MET 27 1HE MET 27 20.744 32.436 -5.481
187 HE2 MET 27 2HE MET 27 22.181 32.947 -4.568
188 HE3 MET 27 3HE MET 27 20.574 33.547 -4.101
189 H LEU 28 H LEU 28 25.332 34.837 -2.435
190 HA LEU 28 HA LEU 28 23.223 34.882 -0.519
191 HB2 LEU 28 1HB LEU 28 25.989 33.796 -0.619
192 HB3 LEU 28 2HB LEU 28 25.124 33.813 0.923
193 HG LEU 28 HG LEU 28 23.866 32.654 -1.569
194 HD11 LEU 28 1HD1 LEU 28 24.679 30.480 -0.811
195 HD12 LEU 28 2HD1 LEU 28 25.636 31.291 0.452
196 HD13 LEU 28 3HD1 LEU 28 25.996 31.583 -1.258
197 HD21 LEU 28 1HD2 LEU 28 22.424 33.134 0.386
198 HD22 LEU 28 2HD2 LEU 28 23.462 32.135 1.407
199 HD23 LEU 28 3HD2 LEU 28 22.540 31.396 0.074
200 H LEU 29 H LEU 29 26.431 36.460 -0.584
201 HA LEU 29 HA LEU 29 26.216 37.595 2.054
202 HB2 LEU 29 1HB LEU 29 27.735 38.427 -0.429
203 HB3 LEU 29 2HB LEU 29 27.868 39.301 1.095
204 HG LEU 29 HG LEU 29 28.501 36.352 0.865
205 HD11 LEU 29 1HD1 LEU 29 29.883 37.584 -0.718
206 HD12 LEU 29 2HD1 LEU 29 30.851 37.010 0.657
207 HD13 LEU 29 3HD1 LEU 29 30.369 38.723 0.564
208 HD21 LEU 29 1HD2 LEU 29 29.344 38.471 2.881
209 HD22 LEU 29 2HD2 LEU 29 29.823 36.756 2.896
210 HD23 LEU 29 3HD2 LEU 29 28.128 37.203 3.151
211 H ALA 30 H ALA 30 25.166 38.653 -1.143
212 HA ALA 30 HA ALA 30 24.292 41.263 -0.219
213 HB1 ALA 30 1HB ALA 30 23.374 41.472 -2.491
214 HB2 ALA 30 2HB ALA 30 25.030 40.820 -2.549
215 HB3 ALA 30 3HB ALA 30 23.638 39.736 -2.776
216 H ASN 31 H ASN 31 22.923 38.115 0.125
217 HA ASN 31 HA ASN 31 20.174 39.305 0.198
218 HB2 ASN 31 1HB ASN 31 20.758 37.488 -1.500
219 HB3 ASN 31 2HB ASN 31 20.892 36.405 -0.149
220 HD21 ASN 31 1HD2 ASN 31 17.414 36.829 -1.802
221 HD22 ASN 31 2HD2 ASN 31 19.006 36.952 -2.527
222 HA PRO 32 HA PRO 32 20.991 38.357 4.507
223 HB2 PRO 32 1HB PRO 32 18.863 39.691 5.619
224 HB3 PRO 32 2HB PRO 32 20.370 40.499 5.075
225 HG2 PRO 32 1HG PRO 32 17.778 40.160 3.570
226 HG3 PRO 32 2HG PRO 32 18.726 41.654 3.859
227 HD2 PRO 32 1HD PRO 32 18.965 40.334 1.566
228 HD3 PRO 32 2HD PRO 32 20.420 41.015 2.379
229 H HIS 33 H HIS 33 17.918 37.745 2.807
230 HA HIS 33 HA HIS 33 16.880 36.035 4.936
231 HB2 HIS 33 1HB HIS 33 15.427 37.213 3.300
232 HB3 HIS 33 2HB HIS 33 16.117 36.233 1.999
233 HD1 HIS 33 HD1 HIS 33 14.054 35.762 5.206
234 HD2 HIS 33 HD2 HIS 33 14.906 33.833 1.607
235 HE1 HIS 33 HE1 HIS 33 12.524 33.755 5.066
236 H GLU 34 H GLU 34 18.588 35.607 1.865
237 HA GLU 34 HA GLU 34 18.350 32.726 1.815
238 HB2 GLU 34 1HB GLU 34 19.841 34.844 0.362
239 HB3 GLU 34 2HB GLU 34 20.384 33.227 0.132
240 HG2 GLU 34 1HG GLU 34 17.598 34.265 -0.421
241 HG3 GLU 34 2HG GLU 34 18.847 33.932 -1.631
242 H LEU 35 H LEU 35 20.814 35.063 2.923
243 HA LEU 35 HA LEU 35 22.729 33.044 3.608
244 HB2 LEU 35 1HB LEU 35 24.026 34.698 4.320
245 HB3 LEU 35 2HB LEU 35 22.969 35.485 3.200
246 HG LEU 35 HG LEU 35 21.751 36.542 5.031
247 HD11 LEU 35 1HD1 LEU 35 23.906 35.300 6.747
248 HD12 LEU 35 2HD1 LEU 35 22.142 35.257 6.980
249 HD13 LEU 35 3HD1 LEU 35 23.015 36.776 7.203
250 HD21 LEU 35 1HD2 LEU 35 24.745 36.873 4.786
251 HD22 LEU 35 2HD2 LEU 35 23.622 38.134 5.359
252 HD23 LEU 35 3HD2 LEU 35 23.514 37.533 3.690
253 H SER 36 H SER 36 19.903 34.333 5.187
254 HA SER 36 HA SER 36 20.535 33.357 7.827
255 HB2 SER 36 1HB SER 36 18.965 35.240 7.400
256 HB3 SER 36 2HB SER 36 17.817 34.086 6.691
257 HG SER 36 HG SER 36 17.626 33.087 8.671
258 H LEU 37 H LEU 37 18.448 32.142 5.131
259 HA LEU 37 HA LEU 37 17.605 29.824 6.607
260 HB2 LEU 37 1HB LEU 37 16.727 29.027 4.650
261 HB3 LEU 37 2HB LEU 37 16.617 30.740 4.611
262 HG LEU 37 HG LEU 37 18.439 30.784 2.921
263 HD11 LEU 37 1HD1 LEU 37 19.282 28.516 3.139
264 HD12 LEU 37 2HD1 LEU 37 18.608 28.766 1.523
265 HD13 LEU 37 3HD1 LEU 37 17.682 27.861 2.749
266 HD21 LEU 37 1HD2 LEU 37 16.095 31.246 2.456
267 HD22 LEU 37 2HD2 LEU 37 15.757 29.504 2.323
268 HD23 LEU 37 3HD2 LEU 37 16.806 30.306 1.131
269 H LEU 38 H LEU 38 20.380 30.657 4.715
270 HA LEU 38 HA LEU 38 21.378 28.021 4.458
271 HB2 LEU 38 1HB LEU 38 21.965 30.035 3.187
272 HB3 LEU 38 2HB LEU 38 22.873 30.637 4.584
273 HG LEU 38 HG LEU 38 24.286 28.570 4.516
274 HD11 LEU 38 1HD1 LEU 38 24.338 27.304 2.409
275 HD12 LEU 38 2HD1 LEU 38 22.914 28.210 1.842
276 HD13 LEU 38 3HD1 LEU 38 22.791 27.140 3.255
277 HD21 LEU 38 1HD2 LEU 38 25.027 30.739 3.573
278 HD22 LEU 38 2HD2 LEU 38 24.384 30.231 1.997
279 HD23 LEU 38 3HD2 LEU 38 25.728 29.335 2.738
280 H LYS 39 H LYS 39 22.093 30.546 6.926
281 HA LYS 39 HA LYS 39 23.779 28.707 8.428
282 HB2 LYS 39 1HB LYS 39 23.613 30.316 10.290
283 HB3 LYS 39 2HB LYS 39 24.185 31.023 8.778
284 HG2 LYS 39 1HG LYS 39 22.188 32.206 8.433
285 HG3 LYS 39 2HG LYS 39 21.271 31.218 9.549
286 HD2 LYS 39 1HD LYS 39 21.576 33.273 10.628
287 HD3 LYS 39 2HD LYS 39 22.724 32.163 11.404
288 HE2 LYS 39 1HE LYS 39 24.551 33.071 10.015
289 HE3 LYS 39 2HE LYS 39 23.394 34.128 9.172
290 HZ1 LYS 39 1HZ LYS 39 24.541 35.307 10.939
291 HZ2 LYS 39 2HZ LYS 39 24.008 34.230 12.071
292 HZ3 LYS 39 3HZ LYS 39 22.931 35.204 11.289
293 H GLU 40 H GLU 40 20.344 29.238 8.326
294 HA GLU 40 HA GLU 40 19.760 27.884 10.825
295 HB2 GLU 40 1HB GLU 40 18.233 29.473 9.694
296 HB3 GLU 40 2HB GLU 40 18.169 28.413 8.295
297 HG2 GLU 40 1HG GLU 40 17.200 26.665 9.993
298 HG3 GLU 40 2HG GLU 40 16.822 28.111 10.946
299 H ARG 41 H ARG 41 19.572 26.935 7.355
300 HA ARG 41 HA ARG 41 18.995 24.152 8.207
301 HB2 ARG 41 1HB ARG 41 18.960 25.479 5.474
302 HB3 ARG 41 2HB ARG 41 18.321 23.876 5.872
303 HG2 ARG 41 1HG ARG 41 16.807 24.937 7.522
304 HG3 ARG 41 2HG ARG 41 17.395 26.519 7.044
305 HD2 ARG 41 1HD ARG 41 16.533 26.167 4.765
306 HD3 ARG 41 2HD ARG 41 15.820 24.620 5.309
307 HE ARG 41 HE ARG 41 15.078 26.591 7.197
308 HH11 ARG 41 1HH1 ARG 41 14.379 26.012 3.770
309 HH12 ARG 41 2HH1 ARG 41 12.839 26.823 3.876
310 HH21 ARG 41 1HH2 ARG 41 13.184 27.583 7.248
311 HH22 ARG 41 2HH2 ARG 41 12.159 27.701 5.836
312 H ASN 42 H ASN 42 21.638 25.871 6.776
313 HA ASN 42 HA ASN 42 23.101 23.268 6.535
314 HB2 ASN 42 1HB ASN 42 22.303 24.282 4.307
315 HB3 ASN 42 2HB ASN 42 23.501 25.524 4.560
316 HD21 ASN 42 1HD2 ASN 42 25.130 22.998 2.515
317 HD22 ASN 42 2HD2 ASN 42 23.965 24.290 2.382
318 HA PRO 43 HA PRO 43 25.354 26.608 8.876
319 HB2 PRO 43 1HB PRO 43 26.417 24.925 10.841
320 HB3 PRO 43 2HB PRO 43 24.936 25.925 10.980
321 HG2 PRO 43 1HG PRO 43 25.196 23.023 10.249
322 HG3 PRO 43 2HG PRO 43 24.055 23.815 11.380
323 HD2 PRO 43 1HD PRO 43 23.290 23.140 8.907
324 HD3 PRO 43 2HD PRO 43 22.762 24.701 9.632
325 HA PRO 44 HA PRO 44 29.402 24.396 8.142
326 HB2 PRO 44 1HB PRO 44 29.616 22.451 6.225
327 HB3 PRO 44 2HB PRO 44 29.340 22.080 7.954
328 HG2 PRO 44 1HG PRO 44 27.335 22.307 5.756
329 HG3 PRO 44 2HG PRO 44 27.586 20.974 6.926
330 HD2 PRO 44 1HD PRO 44 25.705 22.822 7.357
331 HD3 PRO 44 2HD PRO 44 26.721 22.235 8.716
332 H LEU 45 H LEU 45 27.088 24.528 5.347
333 HA LEU 45 HA LEU 45 29.143 25.715 3.635
334 HB2 LEU 45 1HB LEU 45 27.210 24.458 2.717
335 HB3 LEU 45 2HB LEU 45 26.140 25.734 3.301
336 HG LEU 45 HG LEU 45 27.126 27.345 1.768
337 HD11 LEU 45 1HD1 LEU 45 28.987 25.097 0.868
338 HD12 LEU 45 2HD1 LEU 45 29.467 26.610 1.671
339 HD13 LEU 45 3HD1 LEU 45 28.790 26.657 0.040
340 HD21 LEU 45 1HD2 LEU 45 25.301 25.850 0.990
341 HD22 LEU 45 2HD2 LEU 45 26.522 24.733 0.330
342 HD23 LEU 45 3HD2 LEU 45 26.360 26.379 -0.329
343 H ALA 46 H ALA 46 26.610 26.764 5.856
344 HA ALA 46 HA ALA 46 26.645 29.499 5.119
345 HB1 ALA 46 1HB ALA 46 25.016 28.353 6.599
346 HB2 ALA 46 2HB ALA 46 26.234 28.398 7.888
347 HB3 ALA 46 3HB ALA 46 25.611 29.915 7.201
348 H GLU 47 H GLU 47 28.598 27.851 7.719
349 HA GLU 47 HA GLU 47 29.826 30.267 8.580
350 HB2 GLU 47 1HB GLU 47 31.544 28.912 9.610
351 HB3 GLU 47 2HB GLU 47 29.961 28.178 9.867
352 HG2 GLU 47 1HG GLU 47 30.407 26.459 8.253
353 HG3 GLU 47 2HG GLU 47 31.874 27.275 7.697
354 H ALA 48 H ALA 48 30.608 28.144 5.905
355 HA ALA 48 HA ALA 48 33.059 29.251 5.180
356 HB1 ALA 48 1HB ALA 48 30.977 28.127 3.281
357 HB2 ALA 48 2HB ALA 48 32.734 28.056 3.140
358 HB3 ALA 48 3HB ALA 48 31.921 27.089 4.374
359 H LEU 49 H LEU 49 29.734 30.079 4.281
360 HA LEU 49 HA LEU 49 30.449 32.171 2.457
361 HB2 LEU 49 1HB LEU 49 28.273 30.927 2.623
362 HB3 LEU 49 2HB LEU 49 27.924 31.773 4.110
363 HG LEU 49 HG LEU 49 26.776 32.499 1.984
364 HD11 LEU 49 1HD1 LEU 49 28.131 34.660 3.555
365 HD12 LEU 49 2HD1 LEU 49 26.654 33.788 4.025
366 HD13 LEU 49 3HD1 LEU 49 26.663 34.806 2.570
367 HD21 LEU 49 1HD2 LEU 49 27.873 34.079 0.553
368 HD22 LEU 49 2HD2 LEU 49 28.807 32.574 0.573
369 HD23 LEU 49 3HD2 LEU 49 29.360 33.986 1.506
370 H LEU 50 H LEU 50 29.640 32.082 5.939
371 HA LEU 50 HA LEU 50 29.372 34.885 6.238
372 HB2 LEU 50 1HB LEU 50 30.458 33.011 8.371
373 HB3 LEU 50 2HB LEU 50 29.658 34.546 8.622
374 HG LEU 50 HG LEU 50 28.471 31.896 7.952
375 HD11 LEU 50 1HD1 LEU 50 28.907 32.362 10.242
376 HD12 LEU 50 2HD1 LEU 50 27.167 32.259 9.923
377 HD13 LEU 50 3HD1 LEU 50 27.936 33.856 10.143
378 HD21 LEU 50 1HD2 LEU 50 27.064 34.545 7.683
379 HD22 LEU 50 2HD2 LEU 50 26.239 32.968 7.810
380 HD23 LEU 50 3HD2 LEU 50 27.299 33.294 6.431
381 H SER 51 H SER 51 32.195 32.808 6.183
382 HA SER 51 HA SER 51 34.031 34.651 7.393
383 HB2 SER 51 1HB SER 51 34.451 32.327 5.522
384 HB3 SER 51 2HB SER 51 35.693 33.103 6.508
385 HG SER 51 HG SER 51 33.371 31.754 7.470
386 H GLY 52 H GLY 52 32.704 34.299 4.174
387 HA2 GLY 52 1HA GLY 52 32.923 35.841 2.429
388 HA3 GLY 52 2HA GLY 52 34.289 36.598 3.261
389 H ASP 53 H ASP 53 35.455 33.815 3.633
390 HA ASP 53 HA ASP 53 37.285 33.822 1.480
391 HB2 ASP 53 1HB ASP 53 37.614 32.668 3.718
392 HB3 ASP 53 2HB ASP 53 36.493 31.484 3.175
393 H LEU 54 H LEU 54 36.935 33.349 -0.606
394 HA LEU 54 HA LEU 54 34.655 31.824 -1.469
395 HB2 LEU 54 1HB LEU 54 35.859 33.510 -2.861
396 HB3 LEU 54 2HB LEU 54 37.231 32.421 -2.965
397 HG LEU 54 HG LEU 54 35.541 32.615 -4.900
398 HD11 LEU 54 1HD1 LEU 54 37.428 31.028 -4.842
399 HD12 LEU 54 2HD1 LEU 54 36.009 30.410 -5.711
400 HD13 LEU 54 3HD1 LEU 54 36.365 29.839 -4.071
401 HD21 LEU 54 1HD2 LEU 54 33.684 31.089 -4.961
402 HD22 LEU 54 2HD2 LEU 54 33.484 32.203 -3.593
403 HD23 LEU 54 3HD2 LEU 54 34.031 30.533 -3.320
404 H GLU 55 H GLU 55 38.079 31.046 -0.780
405 HA GLU 55 HA GLU 55 38.091 28.528 -2.080
406 HB2 GLU 55 1HB GLU 55 39.590 29.328 0.434
407 HB3 GLU 55 2HB GLU 55 39.987 27.972 -0.618
408 HG2 GLU 55 1HG GLU 55 39.952 30.841 -1.588
409 HG3 GLU 55 2HG GLU 55 41.357 30.087 -0.836
410 H LYS 56 H LYS 56 37.500 29.262 1.404
411 HA LYS 56 HA LYS 56 36.749 26.557 1.971
412 HB2 LYS 56 1HB LYS 56 36.208 27.225 4.124
413 HB3 LYS 56 2HB LYS 56 37.400 28.473 3.619
414 HG2 LYS 56 1HG LYS 56 35.409 29.860 3.101
415 HG3 LYS 56 2HG LYS 56 34.510 28.655 3.998
416 HD2 LYS 56 1HD LYS 56 37.030 29.768 5.207
417 HD3 LYS 56 2HD LYS 56 35.561 30.721 5.253
418 HE2 LYS 56 1HE LYS 56 34.372 28.937 6.454
419 HE3 LYS 56 2HE LYS 56 35.815 27.910 6.376
420 HZ1 LYS 56 1HZ LYS 56 35.566 30.487 7.811
421 HZ2 LYS 56 2HZ LYS 56 36.951 29.586 7.728
422 HZ3 LYS 56 3HZ LYS 56 35.620 28.989 8.504
423 H PHE 57 H PHE 57 34.861 29.347 0.788
424 HA PHE 57 HA PHE 57 32.316 28.089 1.158
425 HB2 PHE 57 1HB PHE 57 32.596 30.491 0.688
426 HB3 PHE 57 2HB PHE 57 33.142 30.107 -0.946
427 HD1 PHE 57 HD1 PHE 57 30.239 30.001 1.372
428 HD2 PHE 57 HD2 PHE 57 31.574 29.547 -2.690
429 HE1 PHE 57 HE1 PHE 57 27.873 29.999 0.605
430 HE2 PHE 57 HE2 PHE 57 29.210 29.539 -3.468
431 HZ PHE 57 HZ PHE 57 27.358 29.742 -1.821
432 H SER 58 H SER 58 34.437 28.200 -1.748
433 HA SER 58 HA SER 58 32.746 26.537 -3.327
434 HB2 SER 58 1HB SER 58 34.558 28.019 -4.191
435 HB3 SER 58 2HB SER 58 35.763 26.947 -3.452
436 HG SER 58 HG SER 58 35.588 26.261 -5.514
437 H ARG 59 H ARG 59 35.446 25.790 -1.120
438 HA ARG 59 HA ARG 59 35.696 23.041 -1.856
439 HB2 ARG 59 1HB ARG 59 37.327 24.371 -0.536
440 HB3 ARG 59 2HB ARG 59 36.210 24.388 0.824
441 HG2 ARG 59 1HG ARG 59 37.092 21.744 -0.352
442 HG3 ARG 59 2HG ARG 59 38.226 22.649 0.658
443 HD2 ARG 59 1HD ARG 59 35.442 21.808 1.537
444 HD3 ARG 59 2HD ARG 59 36.927 20.925 1.904
445 HE ARG 59 HE ARG 59 37.237 23.614 2.758
446 HH11 ARG 59 1HH1 ARG 59 35.416 20.708 3.667
447 HH12 ARG 59 2HH1 ARG 59 35.342 21.196 5.348
448 HH21 ARG 59 1HH2 ARG 59 37.068 24.148 4.911
449 HH22 ARG 59 2HH2 ARG 59 36.230 23.101 6.024
450 H VAL 60 H VAL 60 33.730 24.636 0.705
451 HA VAL 60 HA VAL 60 32.619 22.081 1.535
452 HB VAL 60 HB VAL 60 31.587 24.927 2.012
453 HG11 VAL 60 1HG1 VAL 60 29.779 23.352 2.340
454 HG12 VAL 60 2HG1 VAL 60 30.832 22.249 3.256
455 HG13 VAL 60 3HG1 VAL 60 30.383 23.828 3.938
456 HG21 VAL 60 1HG2 VAL 60 33.865 24.495 2.961
457 HG22 VAL 60 2HG2 VAL 60 32.643 24.718 4.225
458 HG23 VAL 60 3HG2 VAL 60 33.219 23.082 3.822
459 H LEU 61 H LEU 61 31.740 24.613 -0.828
460 HA LEU 61 HA LEU 61 29.104 23.740 -1.359
461 HB2 LEU 61 1HB LEU 61 30.329 25.802 -2.230
462 HB3 LEU 61 2HB LEU 61 31.061 24.759 -3.432
463 HG LEU 61 HG LEU 61 28.361 24.203 -3.713
464 HD11 LEU 61 1HD1 LEU 61 27.879 26.048 -2.121
465 HD12 LEU 61 2HD1 LEU 61 27.223 26.350 -3.742
466 HD13 LEU 61 3HD1 LEU 61 28.710 27.178 -3.220
467 HD21 LEU 61 1HD2 LEU 61 30.370 25.115 -5.362
468 HD22 LEU 61 2HD2 LEU 61 29.272 26.516 -5.333
469 HD23 LEU 61 3HD2 LEU 61 28.675 24.922 -5.828
470 H VAL 62 H VAL 62 32.222 22.630 -2.827
471 HA VAL 62 HA VAL 62 30.798 20.736 -4.500
472 HB VAL 62 HB VAL 62 33.007 21.616 -5.149
473 HG11 VAL 62 1HG1 VAL 62 34.139 19.840 -2.965
474 HG12 VAL 62 2HG1 VAL 62 35.077 20.661 -4.231
475 HG13 VAL 62 3HG1 VAL 62 34.196 21.617 -3.036
476 HG21 VAL 62 1HG2 VAL 62 33.874 19.543 -6.088
477 HG22 VAL 62 2HG2 VAL 62 32.966 18.594 -4.888
478 HG23 VAL 62 3HG2 VAL 62 32.099 19.533 -6.127
479 H GLU 63 H GLU 63 32.370 20.478 -1.294
480 HA GLU 63 HA GLU 63 32.038 17.636 -1.075
481 HB2 GLU 63 1HB GLU 63 32.137 19.842 0.995
482 HB3 GLU 63 2HB GLU 63 31.885 18.147 1.430
483 HG2 GLU 63 1HG GLU 63 33.980 17.628 0.117
484 HG3 GLU 63 2HG GLU 63 34.292 19.364 0.091
485 H GLN 64 H GLN 64 29.835 20.341 -0.364
486 HA GLN 64 HA GLN 64 27.697 18.776 0.725
487 HB2 GLN 64 1HB GLN 64 27.808 21.376 -0.840
488 HB3 GLN 64 2HB GLN 64 26.280 20.684 -0.323
489 HG2 GLN 64 1HG GLN 64 28.486 21.252 1.658
490 HG3 GLN 64 2HG GLN 64 27.355 22.510 1.133
491 HE21 GLN 64 1HE2 GLN 64 26.270 20.328 4.161
492 HE22 GLN 64 2HE2 GLN 64 27.906 20.637 3.634
493 H GLN 65 H GLN 65 28.579 19.675 -2.641
494 HA GLN 65 HA GLN 65 26.255 18.428 -3.794
495 HB2 GLN 65 1HB GLN 65 28.944 19.176 -4.952
496 HB3 GLN 65 2HB GLN 65 27.638 18.471 -5.913
497 HG2 GLN 65 1HG GLN 65 26.167 20.336 -5.361
498 HG3 GLN 65 2HG GLN 65 27.407 21.043 -4.325
499 HE21 GLN 65 1HE2 GLN 65 29.224 22.505 -6.931
500 HE22 GLN 65 2HE2 GLN 65 29.177 22.085 -5.229
501 H GLN 66 H GLN 66 29.523 17.162 -3.028
502 HA GLN 66 HA GLN 66 29.183 14.651 -4.356
503 HB2 GLN 66 1HB GLN 66 30.745 15.432 -1.868
504 HB3 GLN 66 2HB GLN 66 30.859 13.852 -2.639
505 HG2 GLN 66 1HG GLN 66 31.532 16.486 -3.981
506 HG3 GLN 66 2HG GLN 66 32.703 15.384 -3.272
507 HE21 GLN 66 1HE2 GLN 66 31.685 14.918 -7.054
508 HE22 GLN 66 2HE2 GLN 66 31.553 16.390 -6.116
509 H ASP 67 H ASP 67 28.187 15.788 -1.106
510 HA ASP 67 HA ASP 67 27.203 13.153 -0.364
511 HB2 ASP 67 1HB ASP 67 27.849 15.047 1.233
512 HB3 ASP 67 2HB ASP 67 26.288 15.772 0.820
513 H ARG 68 H ARG 68 25.809 16.074 -1.791
514 HA ARG 68 HA ARG 68 23.081 15.242 -1.625
515 HB2 ARG 68 1HB ARG 68 24.538 17.114 -3.483
516 HB3 ARG 68 2HB ARG 68 22.806 16.811 -3.622
517 HG2 ARG 68 1HG ARG 68 22.362 17.708 -1.461
518 HG3 ARG 68 2HG ARG 68 24.080 17.728 -1.047
519 HD2 ARG 68 1HD ARG 68 24.366 19.313 -3.051
520 HD3 ARG 68 2HD ARG 68 22.600 19.503 -2.978
521 HE ARG 68 HE ARG 68 23.740 19.853 -0.371
522 HH11 ARG 68 1HH1 ARG 68 23.522 21.564 -3.451
523 HH12 ARG 68 2HH1 ARG 68 23.717 23.127 -2.703
524 HH21 ARG 68 1HH2 ARG 68 24.008 21.856 0.516
525 HH22 ARG 68 2HH2 ARG 68 23.967 23.290 -0.488
526 H ALA 69 H ALA 69 25.621 14.610 -4.047
527 HA ALA 69 HA ALA 69 24.000 13.452 -6.028
528 HB1 ALA 69 1HB ALA 69 26.409 13.937 -6.301
529 HB2 ALA 69 2HB ALA 69 26.810 12.628 -5.163
530 HB3 ALA 69 3HB ALA 69 26.045 12.249 -6.724
531 H ARG 70 H ARG 70 25.012 12.075 -2.920
532 HA ARG 70 HA ARG 70 24.293 9.350 -3.598
533 HB2 ARG 70 1HB ARG 70 24.397 10.670 -0.854
534 HB3 ARG 70 2HB ARG 70 24.455 8.936 -1.203
535 HG2 ARG 70 1HG ARG 70 26.579 9.365 -2.482
536 HG3 ARG 70 2HG ARG 70 26.532 11.032 -1.877
537 HD2 ARG 70 1HD ARG 70 26.148 9.085 0.273
538 HD3 ARG 70 2HD ARG 70 27.660 8.793 -0.595
539 HE ARG 70 HE ARG 70 26.973 11.121 1.088
540 HH11 ARG 70 1HH1 ARG 70 29.266 9.857 -1.308
541 HH12 ARG 70 2HH1 ARG 70 30.513 10.967 -0.814
542 HH21 ARG 70 1HH2 ARG 70 28.581 12.465 1.646
543 HH22 ARG 70 2HH2 ARG 70 30.136 12.426 0.834
544 H ARG 71 H ARG 71 22.629 11.946 -1.786
545 HA ARG 71 HA ARG 71 20.263 10.280 -1.386
546 HB2 ARG 71 1HB ARG 71 19.297 12.359 -0.432
547 HB3 ARG 71 2HB ARG 71 20.809 11.846 0.320
548 HG2 ARG 71 1HG ARG 71 22.028 13.544 -0.977
549 HG3 ARG 71 2HG ARG 71 20.505 14.091 -1.691
550 HD2 ARG 71 1HD ARG 71 21.152 14.115 1.275
551 HD3 ARG 71 2HD ARG 71 21.300 15.503 0.190
552 HE ARG 71 HE ARG 71 18.921 15.552 -0.092
553 HH11 ARG 71 1HH1 ARG 71 19.946 13.319 2.450
554 HH12 ARG 71 2HH1 ARG 71 18.362 13.279 3.177
555 HH21 ARG 71 1HH2 ARG 71 16.934 15.453 0.905
556 HH22 ARG 71 2HH2 ARG 71 16.693 14.460 2.316
557 H GLU 72 H GLU 72 21.267 12.626 -3.761
558 HA GLU 72 HA GLU 72 18.695 13.422 -4.668
559 HB2 GLU 72 1HB GLU 72 21.418 13.689 -5.585
560 HB3 GLU 72 2HB GLU 72 20.369 13.295 -6.934
561 HG2 GLU 72 1HG GLU 72 20.398 15.630 -6.857
562 HG3 GLU 72 2HG GLU 72 18.838 15.168 -6.170
563 H GLN 73 H GLN 73 20.555 10.521 -5.335
564 HA GLN 73 HA GLN 73 19.120 9.568 -7.589
565 HB2 GLN 73 1HB GLN 73 20.414 8.082 -5.277
566 HB3 GLN 73 2HB GLN 73 19.839 7.305 -6.758
567 HG2 GLN 73 1HG GLN 73 21.423 8.538 -8.099
568 HG3 GLN 73 2HG GLN 73 21.911 9.512 -6.710
569 HE21 GLN 73 1HE2 GLN 73 24.444 7.359 -5.837
570 HE22 GLN 73 2HE2 GLN 73 23.770 8.979 -5.870
571 H GLU 74 H GLU 74 18.369 9.292 -4.080
572 HA GLU 74 HA GLU 74 15.963 7.728 -4.592
573 HB2 GLU 74 1HB GLU 74 16.878 9.311 -2.161
574 HB3 GLU 74 2HB GLU 74 15.434 8.293 -2.214
575 HG2 GLU 74 1HG GLU 74 18.306 7.371 -2.560
576 HG3 GLU 74 2HG GLU 74 17.269 7.101 -1.151
577 H ARG 75 H ARG 75 16.764 11.176 -4.199
578 HA ARG 75 HA ARG 75 14.058 12.078 -3.893
579 HB2 ARG 75 1HB ARG 75 16.509 13.480 -4.982
580 HB3 ARG 75 2HB ARG 75 14.956 14.274 -4.726
581 HG2 ARG 75 1HG ARG 75 15.060 13.829 -2.337
582 HG3 ARG 75 2HG ARG 75 16.560 12.903 -2.548
583 HD2 ARG 75 1HD ARG 75 17.166 15.102 -1.817
584 HD3 ARG 75 2HD ARG 75 17.612 14.930 -3.521
585 HE ARG 75 HE ARG 75 14.980 16.101 -3.129
586 HH11 ARG 75 1HH1 ARG 75 18.436 16.851 -3.432
587 HH12 ARG 75 2HH1 ARG 75 18.110 18.507 -3.888
588 HH21 ARG 75 1HH2 ARG 75 14.667 18.218 -3.722
589 HH22 ARG 75 2HH2 ARG 75 16.025 19.257 -4.052
590 H ILE 76 H ILE 76 16.045 11.623 -6.874
591 HA ILE 76 HA ILE 76 13.958 12.747 -8.537
592 HB ILE 76 HB ILE 76 15.159 11.765 -10.457
593 HG12 ILE 76 1HG1 ILE 76 17.009 10.484 -8.412
594 HG13 ILE 76 2HG1 ILE 76 15.787 9.610 -9.331
595 HG21 ILE 76 1HG2 ILE 76 17.145 12.976 -8.468
596 HG22 ILE 76 2HG2 ILE 76 17.214 13.058 -10.241
597 HG23 ILE 76 3HG2 ILE 76 15.930 13.912 -9.367
598 HD11 ILE 76 1HD1 ILE 76 18.259 10.986 -10.438
599 HD12 ILE 76 2HD1 ILE 76 17.935 9.243 -10.354
600 HD13 ILE 76 3HD1 ILE 76 16.973 10.269 -11.442
601 H ARG 77 H ARG 77 14.408 9.671 -6.992
602 HA ARG 77 HA ARG 77 12.512 8.313 -8.759
603 HB2 ARG 77 1HB ARG 77 14.452 7.557 -6.792
604 HB3 ARG 77 2HB ARG 77 12.881 6.933 -6.272
605 HG2 ARG 77 1HG ARG 77 14.115 6.512 -9.001
606 HG3 ARG 77 2HG ARG 77 14.142 5.341 -7.671
607 HD2 ARG 77 1HD ARG 77 11.684 5.232 -7.698
608 HD3 ARG 77 2HD ARG 77 11.630 6.461 -8.970
609 HE ARG 77 HE ARG 77 13.275 4.266 -9.802
610 HH11 ARG 77 1HH1 ARG 77 9.877 5.169 -9.385
611 HH12 ARG 77 2HH1 ARG 77 9.334 4.070 -10.624
612 HH21 ARG 77 1HH2 ARG 77 12.516 2.891 -11.358
613 HH22 ARG 77 2HH2 ARG 77 10.814 2.800 -11.729
614 H LEU 78 H LEU 78 12.367 10.213 -5.877
615 HA LEU 78 HA LEU 78 10.094 9.047 -4.650
616 HB2 LEU 78 1HB LEU 78 11.732 10.666 -3.672
617 HB3 LEU 78 2HB LEU 78 11.006 11.950 -4.617
618 HG LEU 78 HG LEU 78 9.423 10.392 -2.560
619 HD11 LEU 78 1HD1 LEU 78 11.469 11.279 -1.505
620 HD12 LEU 78 2HD1 LEU 78 10.030 12.152 -0.946
621 HD13 LEU 78 3HD1 LEU 78 11.106 12.900 -2.150
622 HD21 LEU 78 1HD2 LEU 78 8.004 11.776 -3.976
623 HD22 LEU 78 2HD2 LEU 78 9.091 13.172 -3.782
624 HD23 LEU 78 3HD2 LEU 78 8.146 12.562 -2.402
625 H PHE 79 H PHE 79 10.364 11.798 -6.921
626 HA PHE 79 HA PHE 79 7.577 12.382 -6.842
627 HB2 PHE 79 1HB PHE 79 9.579 13.075 -9.002
628 HB3 PHE 79 2HB PHE 79 8.038 13.881 -8.695
629 HD1 PHE 79 HD1 PHE 79 7.759 14.810 -6.194
630 HD2 PHE 79 HD2 PHE 79 11.528 13.995 -8.111
631 HE1 PHE 79 HE1 PHE 79 8.901 16.341 -4.592
632 HE2 PHE 79 HE2 PHE 79 12.677 15.521 -6.515
633 HZ PHE 79 HZ PHE 79 11.361 16.707 -4.754
634 H SER 80 H SER 80 6.148 10.946 -7.332
635 HA SER 80 HA SER 80 6.318 9.553 -9.994
636 HB2 SER 80 1HB SER 80 5.083 8.547 -7.399
637 HB3 SER 80 2HB SER 80 5.211 7.653 -8.929
638 HG SER 80 HG SER 80 7.345 8.563 -7.267
639 H ALA 81 H ALA 81 5.194 12.096 -9.626
640 HA ALA 81 HA ALA 81 3.323 13.369 -9.919
641 HB1 ALA 81 1HB ALA 81 1.989 10.815 -10.923
642 HB2 ALA 81 2HB ALA 81 1.479 12.487 -11.244
643 HB3 ALA 81 3HB ALA 81 3.013 11.880 -11.915
644 H ASP 82 H ASP 82 3.896 12.308 -7.437
645 HA ASP 82 HA ASP 82 1.277 11.738 -6.157
646 HB2 ASP 82 1HB ASP 82 2.653 10.751 -4.377
647 HB3 ASP 82 2HB ASP 82 3.115 10.042 -5.924
648 HA PRO 83 HA PRO 83 1.702 15.701 -4.318
649 HB2 PRO 83 1HB PRO 83 1.035 15.501 -1.692
650 HB3 PRO 83 2HB PRO 83 -0.175 15.236 -2.986
651 HG2 PRO 83 1HG PRO 83 1.461 13.218 -1.482
652 HG3 PRO 83 2HG PRO 83 -0.316 13.275 -1.716
653 HD2 PRO 83 1HD PRO 83 1.256 11.750 -3.292
654 HD3 PRO 83 2HD PRO 83 -0.147 12.634 -3.981
655 H PHE 84 H PHE 84 3.010 17.069 -2.885
656 HA PHE 84 HA PHE 84 5.646 15.840 -2.534
657 HB2 PHE 84 1HB PHE 84 4.813 18.733 -2.173
658 HB3 PHE 84 2HB PHE 84 6.459 18.116 -2.371
659 HD1 PHE 84 HD1 PHE 84 6.657 16.519 -4.618
660 HD2 PHE 84 HD2 PHE 84 3.890 19.763 -4.036
661 HE1 PHE 84 HE1 PHE 84 6.443 16.768 -7.084
662 HE2 PHE 84 HE2 PHE 84 3.666 20.021 -6.504
663 HZ PHE 84 HZ PHE 84 4.945 18.520 -8.035
664 H ASP 85 H ASP 85 3.236 15.605 -0.634
665 HA ASP 85 HA ASP 85 4.251 16.704 1.884
666 HB2 ASP 85 1HB ASP 85 1.896 14.907 1.204
667 HB3 ASP 85 2HB ASP 85 2.232 15.570 2.814
668 H LEU 86 H LEU 86 6.218 15.235 0.906
669 HA LEU 86 HA LEU 86 6.134 12.430 1.353
670 HB2 LEU 86 1HB LEU 86 8.608 12.586 1.333
671 HB3 LEU 86 2HB LEU 86 7.827 13.396 -0.017
672 HG LEU 86 HG LEU 86 8.156 15.454 1.836
673 HD11 LEU 86 1HD1 LEU 86 9.620 13.976 3.198
674 HD12 LEU 86 2HD1 LEU 86 10.499 15.362 2.523
675 HD13 LEU 86 3HD1 LEU 86 10.680 13.749 1.788
676 HD21 LEU 86 1HD2 LEU 86 8.464 15.591 -0.594
677 HD22 LEU 86 2HD2 LEU 86 9.963 14.640 -0.471
678 HD23 LEU 86 3HD2 LEU 86 9.864 16.258 0.266
679 H GLU 87 H GLU 87 6.849 15.102 3.591
680 HA GLU 87 HA GLU 87 7.492 13.171 5.725
681 HB2 GLU 87 1HB GLU 87 7.859 15.114 7.139
682 HB3 GLU 87 2HB GLU 87 8.782 15.189 5.644
683 HG2 GLU 87 1HG GLU 87 7.091 16.798 4.730
684 HG3 GLU 87 2HG GLU 87 6.330 16.817 6.333
685 H ALA 88 H ALA 88 4.923 15.380 4.817
686 HA ALA 88 HA ALA 88 2.800 15.747 5.576
687 HB1 ALA 88 1HB ALA 88 1.426 13.692 5.793
688 HB2 ALA 88 2HB ALA 88 2.509 13.637 4.389
689 HB3 ALA 88 3HB ALA 88 2.914 12.718 5.861
690 H GLN 89 H GLN 89 4.829 15.925 7.738
691 HA GLN 89 HA GLN 89 3.379 14.869 10.078
692 HB2 GLN 89 1HB GLN 89 5.356 15.402 11.330
693 HB3 GLN 89 2HB GLN 89 5.834 14.569 9.846
694 HG2 GLN 89 1HG GLN 89 6.374 16.814 8.839
695 HG3 GLN 89 2HG GLN 89 6.052 17.547 10.415
696 HE21 GLN 89 1HE2 GLN 89 9.710 16.697 9.858
697 HE22 GLN 89 2HE2 GLN 89 8.516 17.457 8.815
698 H ALA 90 H ALA 90 2.832 16.169 11.895
699 HA ALA 90 HA ALA 90 1.856 18.839 11.247
700 HB1 ALA 90 1HB ALA 90 1.259 18.914 13.660
701 HB2 ALA 90 2HB ALA 90 0.696 17.395 12.923
702 HB3 ALA 90 3HB ALA 90 2.162 17.405 13.937
703 H LYS 91 H LYS 91 2.921 20.775 11.699
704 HA LYS 91 HA LYS 91 5.541 20.658 13.091
705 HB2 LYS 91 1HB LYS 91 5.537 20.256 10.448
706 HB3 LYS 91 2HB LYS 91 5.377 22.014 10.414
707 HG2 LYS 91 1HG LYS 91 7.459 22.197 11.763
708 HG3 LYS 91 2HG LYS 91 7.610 20.425 11.731
709 HD2 LYS 91 1HD LYS 91 7.681 20.486 9.267
710 HD3 LYS 91 2HD LYS 91 7.523 22.254 9.313
711 HE2 LYS 91 1HE LYS 91 9.637 22.356 10.653
712 HE3 LYS 91 2HE LYS 91 9.826 20.599 10.399
713 HZ1 LYS 91 1HZ LYS 91 9.666 22.693 8.307
714 HZ2 LYS 91 2HZ LYS 91 9.726 21.065 7.993
715 HZ3 LYS 91 3HZ LYS 91 11.010 21.821 8.710
716 H ILE 92 H ILE 92 6.432 22.926 13.302
717 HA ILE 92 HA ILE 92 4.331 25.023 13.277
718 HB ILE 92 HB ILE 92 6.432 24.554 15.471
719 HG12 ILE 92 1HG1 ILE 92 3.393 24.458 15.688
720 HG13 ILE 92 2HG1 ILE 92 4.417 23.028 15.553
721 HG21 ILE 92 1HG2 ILE 92 6.039 26.979 14.962
722 HG22 ILE 92 2HG2 ILE 92 4.296 26.747 15.230
723 HG23 ILE 92 3HG2 ILE 92 5.445 26.553 16.574
724 HD11 ILE 92 1HD1 ILE 92 3.846 23.320 17.877
725 HD12 ILE 92 2HD1 ILE 92 5.573 23.702 17.690
726 HD13 ILE 92 3HD1 ILE 92 4.380 25.014 17.862
727 H GLU 93 H GLU 93 5.057 26.640 12.078
728 HA GLU 93 HA GLU 93 7.984 27.011 11.591
729 HB2 GLU 93 1HB GLU 93 5.653 27.161 9.630
730 HB3 GLU 93 2HB GLU 93 7.276 27.734 9.267
731 HG2 GLU 93 1HG GLU 93 6.745 24.847 10.039
732 HG3 GLU 93 2HG GLU 93 6.539 25.428 8.386
733 H GLU 94 H GLU 94 8.395 29.361 11.012
734 HA GLU 94 HA GLU 94 6.161 31.134 11.817
735 HB2 GLU 94 1HB GLU 94 7.613 32.443 13.232
736 HB3 GLU 94 2HB GLU 94 7.582 30.763 13.774
737 HG2 GLU 94 1HG GLU 94 9.784 30.362 12.753
738 HG3 GLU 94 2HG GLU 94 9.828 32.035 12.169
739 H ASP 95 H ASP 95 6.035 33.088 10.874
740 HA ASP 95 HA ASP 95 8.294 34.200 9.361
741 HB2 ASP 95 1HB ASP 95 7.056 32.843 7.639
742 HB3 ASP 95 2HB ASP 95 5.603 33.792 7.987
743 H ILE 96 H ILE 96 8.127 35.563 11.248
744 HA ILE 96 HA ILE 96 5.627 36.961 11.783
745 HB ILE 96 HB ILE 96 8.337 37.679 12.995
746 HG12 ILE 96 1HG1 ILE 96 6.422 35.493 13.927
747 HG13 ILE 96 2HG1 ILE 96 7.987 35.202 13.164
748 HG21 ILE 96 1HG2 ILE 96 5.487 37.780 14.165
749 HG22 ILE 96 2HG2 ILE 96 6.965 38.443 14.905
750 HG23 ILE 96 3HG2 ILE 96 6.310 39.177 13.435
751 HD11 ILE 96 1HD1 ILE 96 8.264 34.897 15.524
752 HD12 ILE 96 2HD1 ILE 96 9.099 36.400 15.079
753 HD13 ILE 96 3HD1 ILE 96 7.512 36.463 15.889
754 H ARG 97 H ARG 97 5.916 37.482 9.287
755 HA ARG 97 HA ARG 97 7.531 39.867 8.768
756 HB2 ARG 97 1HB ARG 97 6.433 37.736 7.296
757 HB3 ARG 97 2HB ARG 97 5.585 39.168 6.713
758 HG2 ARG 97 1HG ARG 97 7.633 40.202 6.033
759 HG3 ARG 97 2HG ARG 97 8.601 38.980 6.894
760 HD2 ARG 97 1HD ARG 97 7.679 37.231 5.438
761 HD3 ARG 97 2HD ARG 97 6.758 38.447 4.544
762 HE ARG 97 HE ARG 97 9.154 39.454 4.154
763 HH11 ARG 97 1HH1 ARG 97 8.368 36.009 4.212
764 HH12 ARG 97 2HH1 ARG 97 9.640 35.610 3.081
765 HH21 ARG 97 1HH2 ARG 97 10.755 38.870 2.721
766 HH22 ARG 97 2HH2 ARG 97 10.972 37.201 2.265
767 H GLN 98 H GLN 98 4.884 39.535 10.364
768 HA GLN 98 HA GLN 98 3.712 42.131 9.480
769 HB2 GLN 98 1HB GLN 98 2.248 40.198 8.799
770 HB3 GLN 98 2HB GLN 98 2.047 39.784 10.504
771 HG2 GLN 98 1HG GLN 98 1.026 42.004 10.956
772 HG3 GLN 98 2HG GLN 98 1.360 42.523 9.303
773 HE21 GLN 98 1HE2 GLN 98 -1.924 41.618 8.578
774 HE22 GLN 98 2HE2 GLN 98 -0.775 42.916 8.776
775 HXT GLN 98 HO GLN 98 4.609 43.133 10.761
Start of MODEL 10
1 H1 SER 1 1H SER 1 24.499 33.304 -14.041
2 H2 SER 1 2H SER 1 24.038 33.089 -15.486
3 H3 SER 1 3H SER 1 25.414 32.374 -14.934
4 HA SER 1 HA SER 1 23.553 30.827 -15.555
5 HB2 SER 1 1HB SER 1 24.765 30.644 -12.761
6 HB3 SER 1 2HB SER 1 24.309 29.289 -13.831
7 HG SER 1 HG SER 1 26.661 30.010 -13.824
8 H GLN 2 H GLN 2 23.051 33.104 -13.127
9 HA GLN 2 HA GLN 2 20.775 31.866 -11.802
10 HB2 GLN 2 1HB GLN 2 21.805 34.726 -11.885
11 HB3 GLN 2 2HB GLN 2 20.393 34.227 -10.951
12 HG2 GLN 2 1HG GLN 2 22.247 34.322 -9.447
13 HG3 GLN 2 2HG GLN 2 21.835 32.622 -9.684
14 HE21 GLN 2 1HE2 GLN 2 25.101 31.816 -10.490
15 HE22 GLN 2 2HE2 GLN 2 23.571 31.387 -9.754
16 H GLN 3 H GLN 3 19.151 31.292 -13.151
17 HA GLN 3 HA GLN 3 18.205 33.025 -15.279
18 HB2 GLN 3 1HB GLN 3 16.873 30.607 -13.995
19 HB3 GLN 3 2HB GLN 3 16.430 31.349 -15.536
20 HG2 GLN 3 1HG GLN 3 19.021 29.901 -14.896
21 HG3 GLN 3 2HG GLN 3 17.710 29.327 -15.932
22 HE21 GLN 3 1HE2 GLN 3 20.678 31.292 -17.588
23 HE22 GLN 3 2HE2 GLN 3 20.721 30.427 -16.066
24 H SER 4 H SER 4 17.764 33.046 -11.935
25 HA SER 4 HA SER 4 16.343 34.079 -10.491
26 HB2 SER 4 1HB SER 4 16.982 36.006 -12.014
27 HB3 SER 4 2HB SER 4 15.415 35.782 -12.821
28 HG SER 4 HG SER 4 14.437 36.056 -10.745
29 H HIS 5 H HIS 5 15.279 31.812 -12.285
30 HA HIS 5 HA HIS 5 12.394 32.352 -12.337
31 HB2 HIS 5 1HB HIS 5 14.169 29.999 -13.038
32 HB3 HIS 5 2HB HIS 5 12.425 29.793 -12.853
33 HD1 HIS 5 HD1 HIS 5 14.249 32.693 -14.638
34 HD2 HIS 5 HD2 HIS 5 11.573 29.569 -15.386
35 HE1 HIS 5 HE1 HIS 5 13.458 32.947 -17.021
36 H SER 6 H SER 6 11.194 32.194 -10.571
37 HA SER 6 HA SER 6 12.152 30.635 -8.243
38 HB2 SER 6 1HB SER 6 9.646 32.328 -8.579
39 HB3 SER 6 2HB SER 6 10.327 31.720 -7.055
40 HG SER 6 HG SER 6 10.926 33.888 -7.433
41 H SER 7 H SER 7 10.770 29.793 -11.012
42 HA SER 7 HA SER 7 8.293 28.603 -10.310
43 HB2 SER 7 1HB SER 7 10.213 27.783 -12.517
44 HB3 SER 7 2HB SER 7 8.458 27.520 -12.475
45 HG SER 7 HG SER 7 9.057 29.348 -13.736
46 HA PRO 8 HA PRO 8 9.981 24.915 -8.475
47 HB2 PRO 8 1HB PRO 8 7.796 23.294 -8.410
48 HB3 PRO 8 2HB PRO 8 7.949 24.695 -7.299
49 HG2 PRO 8 1HG PRO 8 6.480 24.496 -9.911
50 HG3 PRO 8 2HG PRO 8 5.893 25.102 -8.329
51 HD2 PRO 8 1HD PRO 8 6.799 26.763 -10.268
52 HD3 PRO 8 2HD PRO 8 7.088 27.093 -8.526
53 H GLY 9 H GLY 9 10.567 22.870 -9.244
54 HA2 GLY 9 1HA GLY 9 10.535 21.083 -10.847
55 HA3 GLY 9 2HA GLY 9 9.751 22.164 -11.998
56 H GLU 10 H GLU 10 11.861 24.213 -11.094
57 HA GLU 10 HA GLU 10 13.664 23.692 -13.269
58 HB2 GLU 10 1HB GLU 10 13.740 25.806 -11.088
59 HB3 GLU 10 2HB GLU 10 14.761 25.824 -12.530
60 HG2 GLU 10 1HG GLU 10 11.734 26.014 -12.496
61 HG3 GLU 10 2HG GLU 10 12.865 27.350 -12.754
62 H ILE 11 H ILE 11 13.809 21.775 -11.001
63 HA ILE 11 HA ILE 11 16.414 22.039 -9.921
64 HB ILE 11 HB ILE 11 15.186 19.446 -9.796
65 HG12 ILE 11 1HG1 ILE 11 13.323 21.661 -8.936
66 HG13 ILE 11 2HG1 ILE 11 13.063 20.540 -10.287
67 HG21 ILE 11 1HG2 ILE 11 15.431 21.612 -7.746
68 HG22 ILE 11 2HG2 ILE 11 15.324 19.865 -7.399
69 HG23 ILE 11 3HG2 ILE 11 16.765 20.523 -8.197
70 HD11 ILE 11 1HD1 ILE 11 13.062 19.851 -7.333
71 HD12 ILE 11 2HD1 ILE 11 11.711 19.775 -8.483
72 HD13 ILE 11 3HD1 ILE 11 13.065 18.633 -8.636
73 H THR 12 H THR 12 15.427 21.544 -12.842
74 HA THR 12 HA THR 12 16.975 19.183 -13.671
75 HB THR 12 HB THR 12 16.335 20.060 -15.968
76 HG1 THR 12 HG1 THR 12 14.744 21.796 -15.875
77 HG21 THR 12 1HG2 THR 12 14.850 18.475 -14.702
78 HG22 THR 12 2HG2 THR 12 13.957 19.562 -15.787
79 HG23 THR 12 3HG2 THR 12 13.980 19.881 -14.040
80 H SER 13 H SER 13 17.492 22.467 -12.979
81 HA SER 13 HA SER 13 20.076 22.474 -14.479
82 HB2 SER 13 1HB SER 13 18.094 24.763 -14.130
83 HB3 SER 13 2HB SER 13 19.697 24.893 -14.883
84 HG SER 13 HG SER 13 17.485 23.345 -15.775
85 H SER 14 H SER 14 21.513 24.277 -13.551
86 HA SER 14 HA SER 14 21.163 24.372 -10.575
87 HB2 SER 14 1HB SER 14 23.715 24.373 -12.227
88 HB3 SER 14 2HB SER 14 23.625 24.517 -10.457
89 HG SER 14 HG SER 14 22.525 22.340 -11.915
90 HA PRO 15 HA PRO 15 21.346 28.648 -12.420
91 HB2 PRO 15 1HB PRO 15 19.105 29.776 -11.352
92 HB3 PRO 15 2HB PRO 15 19.064 28.777 -12.834
93 HG2 PRO 15 1HG PRO 15 18.489 27.938 -10.015
94 HG3 PRO 15 2HG PRO 15 17.478 27.727 -11.482
95 HD2 PRO 15 1HD PRO 15 19.073 25.747 -10.606
96 HD3 PRO 15 2HD PRO 15 18.895 26.078 -12.363
97 H GLN 16 H GLN 16 20.858 27.332 -9.277
98 HA GLN 16 HA GLN 16 21.386 29.678 -7.738
99 HB2 GLN 16 1HB GLN 16 21.602 26.729 -7.120
100 HB3 GLN 16 2HB GLN 16 21.962 27.978 -5.925
101 HG2 GLN 16 1HG GLN 16 19.287 27.670 -7.336
102 HG3 GLN 16 2HG GLN 16 19.666 27.079 -5.711
103 HE21 GLN 16 1HE2 GLN 16 19.225 30.173 -4.128
104 HE22 GLN 16 2HE2 GLN 16 19.672 28.496 -3.983
105 H GLY 17 H GLY 17 23.575 28.222 -9.833
106 HA2 GLY 17 1HA GLY 17 25.815 28.910 -10.001
107 HA3 GLY 17 2HA GLY 17 25.671 29.707 -8.426
108 H LEU 18 H LEU 18 24.880 26.302 -8.976
109 HA LEU 18 HA LEU 18 26.732 25.450 -6.925
110 HB2 LEU 18 1HB LEU 18 25.570 23.794 -9.193
111 HB3 LEU 18 2HB LEU 18 26.279 23.184 -7.703
112 HG LEU 18 HG LEU 18 23.695 24.741 -7.986
113 HD11 LEU 18 1HD1 LEU 18 22.650 22.634 -7.259
114 HD12 LEU 18 2HD1 LEU 18 24.254 21.860 -7.169
115 HD13 LEU 18 3HD1 LEU 18 23.605 22.391 -8.733
116 HD21 LEU 18 1HD2 LEU 18 25.041 23.645 -5.470
117 HD22 LEU 18 2HD2 LEU 18 23.362 24.236 -5.547
118 HD23 LEU 18 3HD2 LEU 18 24.704 25.354 -5.838
119 H ASP 19 H ASP 19 26.845 25.856 -10.393
120 HA ASP 19 HA ASP 19 29.515 24.749 -10.788
121 HB2 ASP 19 1HB ASP 19 27.701 24.867 -12.518
122 HB3 ASP 19 2HB ASP 19 27.829 26.632 -12.479
123 H ASN 20 H ASN 20 28.076 27.788 -9.875
124 HA ASN 20 HA ASN 20 30.708 29.156 -10.091
125 HB2 ASN 20 1HB ASN 20 27.867 30.262 -10.258
126 HB3 ASN 20 2HB ASN 20 29.339 31.215 -10.284
127 HD21 ASN 20 1HD2 ASN 20 30.182 30.415 -13.605
128 HD22 ASN 20 2HD2 ASN 20 30.900 30.720 -12.051
129 HA PRO 21 HA PRO 21 29.522 29.112 -5.584
130 HB2 PRO 21 1HB PRO 21 32.181 28.976 -4.762
131 HB3 PRO 21 2HB PRO 21 31.162 27.544 -5.039
132 HG2 PRO 21 1HG PRO 21 33.090 28.855 -6.883
133 HG3 PRO 21 2HG PRO 21 32.915 27.131 -6.506
134 HD2 PRO 21 1HD PRO 21 31.936 28.074 -8.722
135 HD3 PRO 21 2HD PRO 21 30.981 26.908 -7.738
136 H ALA 22 H ALA 22 31.926 30.787 -7.581
137 HA ALA 22 HA ALA 22 32.480 32.929 -5.803
138 HB1 ALA 22 1HB ALA 22 33.844 32.429 -7.778
139 HB2 ALA 22 2HB ALA 22 32.483 32.857 -8.849
140 HB3 ALA 22 3HB ALA 22 33.249 34.104 -7.835
141 H LEU 23 H LEU 23 29.905 32.501 -8.252
142 HA LEU 23 HA LEU 23 28.884 35.205 -7.855
143 HB2 LEU 23 1HB LEU 23 27.539 32.813 -9.155
144 HB3 LEU 23 2HB LEU 23 27.037 34.490 -9.281
145 HG LEU 23 HG LEU 23 29.535 33.262 -10.482
146 HD11 LEU 23 1HD1 LEU 23 28.392 33.646 -12.619
147 HD12 LEU 23 2HD1 LEU 23 26.995 34.349 -11.768
148 HD13 LEU 23 3HD1 LEU 23 27.391 32.630 -11.567
149 HD21 LEU 23 1HD2 LEU 23 29.849 35.354 -11.670
150 HD22 LEU 23 2HD2 LEU 23 30.002 35.573 -9.914
151 HD23 LEU 23 3HD2 LEU 23 28.514 36.092 -10.743
152 H LEU 24 H LEU 24 28.028 31.894 -6.784
153 HA LEU 24 HA LEU 24 25.566 32.652 -5.550
154 HB2 LEU 24 1HB LEU 24 26.129 30.335 -6.071
155 HB3 LEU 24 2HB LEU 24 27.472 30.373 -4.936
156 HG LEU 24 HG LEU 24 25.999 30.528 -3.058
157 HD11 LEU 24 1HD1 LEU 24 23.700 30.735 -5.015
158 HD12 LEU 24 2HD1 LEU 24 24.171 31.895 -3.758
159 HD13 LEU 24 3HD1 LEU 24 23.505 30.324 -3.298
160 HD21 LEU 24 1HD2 LEU 24 26.489 28.344 -4.075
161 HD22 LEU 24 2HD2 LEU 24 24.953 28.426 -4.951
162 HD23 LEU 24 3HD2 LEU 24 24.962 28.368 -3.173
163 H ARG 25 H ARG 25 28.890 32.403 -4.263
164 HA ARG 25 HA ARG 25 28.302 33.027 -1.550
165 HB2 ARG 25 1HB ARG 25 30.507 32.299 -2.176
166 HB3 ARG 25 2HB ARG 25 30.631 33.534 -3.403
167 HG2 ARG 25 1HG ARG 25 30.534 35.177 -1.295
168 HG3 ARG 25 2HG ARG 25 31.100 33.734 -0.441
169 HD2 ARG 25 1HD ARG 25 32.992 35.118 -1.190
170 HD3 ARG 25 2HD ARG 25 32.983 33.567 -2.035
171 HE ARG 25 HE ARG 25 32.349 34.617 -4.021
172 HH11 ARG 25 1HH1 ARG 25 32.312 37.069 -1.447
173 HH12 ARG 25 2HH1 ARG 25 32.169 38.391 -2.609
174 HH21 ARG 25 1HH2 ARG 25 32.045 36.275 -5.346
175 HH22 ARG 25 2HH2 ARG 25 31.979 37.925 -4.752
176 H ASP 26 H ASP 26 28.889 35.134 -4.375
177 HA ASP 26 HA ASP 26 28.796 37.574 -2.904
178 HB2 ASP 26 1HB ASP 26 29.540 36.880 -5.372
179 HB3 ASP 26 2HB ASP 26 27.926 37.452 -5.761
180 H MET 27 H MET 27 26.295 35.800 -4.767
181 HA MET 27 HA MET 27 24.167 37.667 -4.358
182 HB2 MET 27 1HB MET 27 24.209 35.722 -5.959
183 HB3 MET 27 2HB MET 27 23.973 34.648 -4.575
184 HG2 MET 27 1HG MET 27 21.820 35.720 -4.088
185 HG3 MET 27 2HG MET 27 22.081 36.857 -5.420
186 HE1 MET 27 1HE MET 27 22.422 32.840 -4.982
187 HE2 MET 27 2HE MET 27 20.849 33.349 -4.326
188 HE3 MET 27 3HE MET 27 20.920 32.378 -5.816
189 H LEU 28 H LEU 28 25.300 34.884 -2.435
190 HA LEU 28 HA LEU 28 23.199 34.921 -0.531
191 HB2 LEU 28 1HB LEU 28 25.971 33.885 -0.659
192 HB3 LEU 28 2HB LEU 28 25.167 33.954 0.908
193 HG LEU 28 HG LEU 28 23.819 32.678 -1.462
194 HD11 LEU 28 1HD1 LEU 28 24.723 30.567 -0.670
195 HD12 LEU 28 2HD1 LEU 28 25.703 31.442 0.533
196 HD13 LEU 28 3HD1 LEU 28 25.995 31.685 -1.199
197 HD21 LEU 28 1HD2 LEU 28 22.510 33.242 0.570
198 HD22 LEU 28 2HD2 LEU 28 23.607 32.256 1.541
199 HD23 LEU 28 3HD2 LEU 28 22.596 31.498 0.287
200 H LEU 29 H LEU 29 26.402 36.520 -0.560
201 HA LEU 29 HA LEU 29 26.162 37.642 2.071
202 HB2 LEU 29 1HB LEU 29 27.728 38.472 -0.390
203 HB3 LEU 29 2HB LEU 29 27.872 39.315 1.152
204 HG LEU 29 HG LEU 29 28.387 36.349 0.922
205 HD11 LEU 29 1HD1 LEU 29 29.852 37.414 -0.697
206 HD12 LEU 29 2HD1 LEU 29 30.791 36.873 0.712
207 HD13 LEU 29 3HD1 LEU 29 30.385 38.598 0.527
208 HD21 LEU 29 1HD2 LEU 29 29.334 38.449 2.902
209 HD22 LEU 29 2HD2 LEU 29 29.754 36.719 2.936
210 HD23 LEU 29 3HD2 LEU 29 28.075 37.228 3.192
211 H ALA 30 H ALA 30 25.094 38.697 -1.119
212 HA ALA 30 HA ALA 30 24.204 41.302 -0.161
213 HB1 ALA 30 1HB ALA 30 24.988 40.927 -2.485
214 HB2 ALA 30 2HB ALA 30 23.621 39.821 -2.761
215 HB3 ALA 30 3HB ALA 30 23.319 41.546 -2.443
216 H ASN 31 H ASN 31 22.874 38.130 0.078
217 HA ASN 31 HA ASN 31 20.100 39.267 0.122
218 HB2 ASN 31 1HB ASN 31 20.713 37.534 -1.606
219 HB3 ASN 31 2HB ASN 31 20.884 36.378 -0.288
220 HD21 ASN 31 1HD2 ASN 31 17.411 36.658 -1.913
221 HD22 ASN 31 2HD2 ASN 31 19.005 36.805 -2.630
222 HA PRO 32 HA PRO 32 20.892 38.304 4.443
223 HB2 PRO 32 1HB PRO 32 18.750 39.642 5.527
224 HB3 PRO 32 2HB PRO 32 20.270 40.444 5.012
225 HG2 PRO 32 1HG PRO 32 17.703 40.124 3.462
226 HG3 PRO 32 2HG PRO 32 18.651 41.613 3.777
227 HD2 PRO 32 1HD PRO 32 18.931 40.313 1.481
228 HD3 PRO 32 2HD PRO 32 20.377 40.970 2.330
229 H HIS 33 H HIS 33 17.867 37.696 2.671
230 HA HIS 33 HA HIS 33 16.768 35.998 4.777
231 HB2 HIS 33 1HB HIS 33 15.345 37.158 3.106
232 HB3 HIS 33 2HB HIS 33 16.084 36.197 1.820
233 HD1 HIS 33 HD1 HIS 33 13.600 35.930 4.658
234 HD2 HIS 33 HD2 HIS 33 15.240 33.543 1.661
235 HE1 HIS 33 HE1 HIS 33 12.212 33.819 4.557
236 H GLU 34 H GLU 34 18.582 35.526 1.747
237 HA GLU 34 HA GLU 34 18.274 32.643 1.797
238 HB2 GLU 34 1HB GLU 34 19.346 34.659 0.049
239 HB3 GLU 34 2HB GLU 34 20.514 33.375 0.210
240 HG2 GLU 34 1HG GLU 34 17.609 32.863 -0.482
241 HG3 GLU 34 2HG GLU 34 18.832 33.219 -1.709
242 H LEU 35 H LEU 35 20.778 34.990 2.788
243 HA LEU 35 HA LEU 35 22.692 33.017 3.540
244 HB2 LEU 35 1HB LEU 35 23.951 34.680 4.243
245 HB3 LEU 35 2HB LEU 35 22.890 35.456 3.124
246 HG LEU 35 HG LEU 35 21.668 36.510 4.955
247 HD11 LEU 35 1HD1 LEU 35 22.026 35.229 6.901
248 HD12 LEU 35 2HD1 LEU 35 22.932 36.727 7.134
249 HD13 LEU 35 3HD1 LEU 35 23.792 35.231 6.677
250 HD21 LEU 35 1HD2 LEU 35 24.664 36.805 4.715
251 HD22 LEU 35 2HD2 LEU 35 23.561 38.076 5.309
252 HD23 LEU 35 3HD2 LEU 35 23.436 37.495 3.635
253 H SER 36 H SER 36 19.853 34.285 5.126
254 HA SER 36 HA SER 36 20.489 33.294 7.758
255 HB2 SER 36 1HB SER 36 18.934 35.198 7.319
256 HB3 SER 36 2HB SER 36 17.778 34.045 6.622
257 HG SER 36 HG SER 36 17.230 34.256 8.742
258 H LEU 37 H LEU 37 18.435 32.119 5.030
259 HA LEU 37 HA LEU 37 17.571 29.791 6.481
260 HB2 LEU 37 1HB LEU 37 16.671 29.032 4.545
261 HB3 LEU 37 2HB LEU 37 16.606 30.743 4.487
262 HG LEU 37 HG LEU 37 18.337 30.757 2.744
263 HD11 LEU 37 1HD1 LEU 37 19.256 28.534 3.002
264 HD12 LEU 37 2HD1 LEU 37 18.533 28.715 1.399
265 HD13 LEU 37 3HD1 LEU 37 17.671 27.817 2.675
266 HD21 LEU 37 1HD2 LEU 37 16.651 30.193 1.027
267 HD22 LEU 37 2HD2 LEU 37 15.958 31.140 2.356
268 HD23 LEU 37 3HD2 LEU 37 15.672 29.386 2.272
269 H LEU 38 H LEU 38 20.334 30.634 4.570
270 HA LEU 38 HA LEU 38 21.320 28.003 4.298
271 HB2 LEU 38 1HB LEU 38 21.923 30.016 3.055
272 HB3 LEU 38 2HB LEU 38 22.832 30.605 4.457
273 HG LEU 38 HG LEU 38 24.227 28.517 4.399
274 HD11 LEU 38 1HD1 LEU 38 22.830 28.178 1.740
275 HD12 LEU 38 2HD1 LEU 38 22.750 27.094 3.149
276 HD13 LEU 38 3HD1 LEU 38 24.272 27.279 2.267
277 HD21 LEU 38 1HD2 LEU 38 25.696 29.260 2.656
278 HD22 LEU 38 2HD2 LEU 38 24.993 30.677 3.465
279 HD23 LEU 38 3HD2 LEU 38 24.376 30.160 1.881
280 H LYS 39 H LYS 39 22.034 30.476 6.813
281 HA LYS 39 HA LYS 39 23.771 28.627 8.228
282 HB2 LYS 39 1HB LYS 39 23.503 30.140 10.187
283 HB3 LYS 39 2HB LYS 39 24.145 30.892 8.728
284 HG2 LYS 39 1HG LYS 39 22.145 32.073 8.319
285 HG3 LYS 39 2HG LYS 39 21.208 31.087 9.418
286 HD2 LYS 39 1HD LYS 39 21.526 33.134 10.518
287 HD3 LYS 39 2HD LYS 39 22.659 32.007 11.289
288 HE2 LYS 39 1HE LYS 39 24.492 32.900 9.869
289 HE3 LYS 39 2HE LYS 39 23.341 34.018 9.096
290 HZ1 LYS 39 1HZ LYS 39 22.959 35.015 11.269
291 HZ2 LYS 39 2HZ LYS 39 24.562 35.090 10.886
292 HZ3 LYS 39 3HZ LYS 39 24.025 33.978 11.983
293 H GLU 40 H GLU 40 20.299 29.102 8.233
294 HA GLU 40 HA GLU 40 19.873 27.540 10.634
295 HB2 GLU 40 1HB GLU 40 18.275 29.205 9.613
296 HB3 GLU 40 2HB GLU 40 18.007 28.081 8.288
297 HG2 GLU 40 1HG GLU 40 16.175 27.770 9.719
298 HG3 GLU 40 2HG GLU 40 17.231 26.386 10.034
299 H ARG 41 H ARG 41 19.506 26.833 7.120
300 HA ARG 41 HA ARG 41 18.945 24.005 7.721
301 HB2 ARG 41 1HB ARG 41 19.294 25.471 5.080
302 HB3 ARG 41 2HB ARG 41 18.619 23.844 5.287
303 HG2 ARG 41 1HG ARG 41 16.836 24.779 6.672
304 HG3 ARG 41 2HG ARG 41 17.461 26.403 6.438
305 HD2 ARG 41 1HD ARG 41 17.160 26.136 3.981
306 HD3 ARG 41 2HD ARG 41 16.361 24.578 4.286
307 HE ARG 41 HE ARG 41 15.039 26.417 5.909
308 HH11 ARG 41 1HH1 ARG 41 15.570 26.150 2.426
309 HH12 ARG 41 2HH1 ARG 41 14.080 26.967 2.045
310 HH21 ARG 41 1HH2 ARG 41 13.148 27.436 5.339
311 HH22 ARG 41 2HH2 ARG 41 12.734 27.674 3.665
312 H ASN 42 H ASN 42 21.703 25.817 6.606
313 HA ASN 42 HA ASN 42 23.254 23.257 6.446
314 HB2 ASN 42 1HB ASN 42 22.523 24.223 4.173
315 HB3 ASN 42 2HB ASN 42 23.678 25.497 4.457
316 HD21 ASN 42 1HD2 ASN 42 25.348 22.872 2.509
317 HD22 ASN 42 2HD2 ASN 42 24.093 24.067 2.303
318 HA PRO 43 HA PRO 43 25.347 26.652 8.839
319 HB2 PRO 43 1HB PRO 43 26.434 24.972 10.800
320 HB3 PRO 43 2HB PRO 43 24.933 25.943 10.935
321 HG2 PRO 43 1HG PRO 43 25.256 23.050 10.210
322 HG3 PRO 43 2HG PRO 43 24.071 23.826 11.300
323 HD2 PRO 43 1HD PRO 43 23.403 23.111 8.804
324 HD3 PRO 43 2HD PRO 43 22.792 24.645 9.520
325 HA PRO 44 HA PRO 44 29.458 24.610 8.111
326 HB2 PRO 44 1HB PRO 44 29.789 22.577 6.319
327 HB3 PRO 44 2HB PRO 44 29.520 22.306 8.070
328 HG2 PRO 44 1HG PRO 44 27.539 22.285 5.834
329 HG3 PRO 44 2HG PRO 44 27.835 21.045 7.091
330 HD2 PRO 44 1HD PRO 44 25.853 22.832 7.360
331 HD3 PRO 44 2HD PRO 44 26.848 22.349 8.773
332 H LEU 45 H LEU 45 27.111 24.659 5.334
333 HA LEU 45 HA LEU 45 29.164 25.799 3.582
334 HB2 LEU 45 1HB LEU 45 27.255 24.579 2.642
335 HB3 LEU 45 2HB LEU 45 26.157 25.780 3.313
336 HG LEU 45 HG LEU 45 26.928 27.470 1.782
337 HD11 LEU 45 1HD1 LEU 45 28.582 27.067 0.013
338 HD12 LEU 45 2HD1 LEU 45 28.910 25.446 0.660
339 HD13 LEU 45 3HD1 LEU 45 29.339 26.888 1.603
340 HD21 LEU 45 1HD2 LEU 45 26.548 24.851 0.278
341 HD22 LEU 45 2HD2 LEU 45 26.180 26.489 -0.313
342 HD23 LEU 45 3HD2 LEU 45 25.238 25.797 1.018
343 H ALA 46 H ALA 46 26.670 26.896 5.800
344 HA ALA 46 HA ALA 46 26.806 29.647 5.081
345 HB1 ALA 46 1HB ALA 46 26.218 28.496 7.801
346 HB2 ALA 46 2HB ALA 46 25.710 30.069 7.143
347 HB3 ALA 46 3HB ALA 46 25.062 28.564 6.455
348 H GLU 47 H GLU 47 28.629 27.868 7.684
349 HA GLU 47 HA GLU 47 29.886 30.208 8.686
350 HB2 GLU 47 1HB GLU 47 31.509 28.793 9.738
351 HB3 GLU 47 2HB GLU 47 29.916 28.044 9.863
352 HG2 GLU 47 1HG GLU 47 30.474 26.489 8.082
353 HG3 GLU 47 2HG GLU 47 32.041 27.268 7.842
354 H ALA 48 H ALA 48 30.688 28.223 5.889
355 HA ALA 48 HA ALA 48 33.249 29.355 5.399
356 HB1 ALA 48 1HB ALA 48 32.466 27.282 4.386
357 HB2 ALA 48 2HB ALA 48 31.192 28.172 3.519
358 HB3 ALA 48 3HB ALA 48 32.891 28.469 3.144
359 H LEU 49 H LEU 49 29.950 30.283 4.456
360 HA LEU 49 HA LEU 49 30.715 32.439 2.715
361 HB2 LEU 49 1HB LEU 49 28.446 31.350 2.824
362 HB3 LEU 49 2HB LEU 49 28.219 32.068 4.411
363 HG LEU 49 HG LEU 49 28.582 34.343 3.221
364 HD11 LEU 49 1HD1 LEU 49 27.815 34.302 0.870
365 HD12 LEU 49 2HD1 LEU 49 27.849 32.529 0.899
366 HD13 LEU 49 3HD1 LEU 49 29.353 33.455 1.091
367 HD21 LEU 49 1HD2 LEU 49 26.074 32.705 2.736
368 HD22 LEU 49 2HD2 LEU 49 26.199 34.480 2.787
369 HD23 LEU 49 3HD2 LEU 49 26.491 33.531 4.257
370 H LEU 50 H LEU 50 29.997 32.164 6.206
371 HA LEU 50 HA LEU 50 29.955 34.975 6.743
372 HB2 LEU 50 1HB LEU 50 30.878 32.838 8.682
373 HB3 LEU 50 2HB LEU 50 30.199 34.407 9.066
374 HG LEU 50 HG LEU 50 28.812 31.927 8.148
375 HD11 LEU 50 1HD1 LEU 50 28.398 33.720 10.514
376 HD12 LEU 50 2HD1 LEU 50 29.263 32.161 10.492
377 HD13 LEU 50 3HD1 LEU 50 27.525 32.206 10.156
378 HD21 LEU 50 1HD2 LEU 50 27.618 34.692 8.129
379 HD22 LEU 50 2HD2 LEU 50 26.671 33.179 8.117
380 HD23 LEU 50 3HD2 LEU 50 27.759 33.542 6.769
381 H SER 51 H SER 51 32.553 32.628 6.485
382 HA SER 51 HA SER 51 34.584 34.265 7.691
383 HB2 SER 51 1HB SER 51 34.736 31.945 5.754
384 HB3 SER 51 2HB SER 51 36.064 32.582 6.724
385 HG SER 51 HG SER 51 33.659 31.417 7.718
386 H GLY 52 H GLY 52 33.093 34.134 4.527
387 HA2 GLY 52 1HA GLY 52 33.401 35.695 2.817
388 HA3 GLY 52 2HA GLY 52 34.865 36.289 3.614
389 H ASP 53 H ASP 53 36.014 33.589 3.875
390 HA ASP 53 HA ASP 53 37.569 33.475 1.558
391 HB2 ASP 53 1HB ASP 53 37.268 31.902 3.940
392 HB3 ASP 53 2HB ASP 53 37.756 30.961 2.518
393 H LEU 54 H LEU 54 36.934 33.273 -0.391
394 HA LEU 54 HA LEU 54 34.628 31.737 -1.136
395 HB2 LEU 54 1HB LEU 54 35.531 33.621 -2.419
396 HB3 LEU 54 2HB LEU 54 36.981 32.701 -2.771
397 HG LEU 54 HG LEU 54 35.103 33.015 -4.485
398 HD11 LEU 54 1HD1 LEU 54 36.408 30.358 -4.229
399 HD12 LEU 54 2HD1 LEU 54 37.150 31.827 -4.903
400 HD13 LEU 54 3HD1 LEU 54 35.758 31.083 -5.711
401 HD21 LEU 54 1HD2 LEU 54 33.183 32.094 -3.265
402 HD22 LEU 54 2HD2 LEU 54 33.961 30.513 -3.205
403 HD23 LEU 54 3HD2 LEU 54 33.480 31.202 -4.752
404 H GLU 55 H GLU 55 38.085 31.042 -0.853
405 HA GLU 55 HA GLU 55 38.098 28.558 -2.149
406 HB2 GLU 55 1HB GLU 55 40.008 27.948 -0.983
407 HB3 GLU 55 2HB GLU 55 40.084 29.621 -1.495
408 HG2 GLU 55 1HG GLU 55 40.929 29.777 0.489
409 HG3 GLU 55 2HG GLU 55 39.267 30.144 0.891
410 H LYS 56 H LYS 56 37.297 29.197 1.292
411 HA LYS 56 HA LYS 56 36.724 26.418 1.738
412 HB2 LYS 56 1HB LYS 56 36.016 27.031 3.948
413 HB3 LYS 56 2HB LYS 56 37.503 27.914 3.518
414 HG2 LYS 56 1HG LYS 56 36.076 29.848 3.075
415 HG3 LYS 56 2HG LYS 56 34.780 28.987 3.859
416 HD2 LYS 56 1HD LYS 56 37.519 29.393 5.102
417 HD3 LYS 56 2HD LYS 56 36.189 30.518 5.327
418 HE2 LYS 56 1HE LYS 56 34.811 28.675 6.304
419 HE3 LYS 56 2HE LYS 56 36.223 27.605 6.179
420 HZ1 LYS 56 1HZ LYS 56 36.032 30.093 7.779
421 HZ2 LYS 56 2HZ LYS 56 37.410 29.192 7.616
422 HZ3 LYS 56 3HZ LYS 56 36.085 28.552 8.370
423 H PHE 57 H PHE 57 34.826 29.285 0.856
424 HA PHE 57 HA PHE 57 32.280 28.033 1.151
425 HB2 PHE 57 1HB PHE 57 32.599 30.456 0.781
426 HB3 PHE 57 2HB PHE 57 33.129 30.123 -0.872
427 HD1 PHE 57 HD1 PHE 57 31.552 29.627 -2.630
428 HD2 PHE 57 HD2 PHE 57 30.243 30.008 1.454
429 HE1 PHE 57 HE1 PHE 57 29.183 29.644 -3.387
430 HE2 PHE 57 HE2 PHE 57 27.876 30.028 0.697
431 HZ PHE 57 HZ PHE 57 27.350 29.829 -1.727
432 H SER 58 H SER 58 34.392 28.270 -1.761
433 HA SER 58 HA SER 58 32.752 26.655 -3.432
434 HB2 SER 58 1HB SER 58 34.641 28.095 -4.190
435 HB3 SER 58 2HB SER 58 35.783 26.968 -3.431
436 HG SER 58 HG SER 58 34.891 25.331 -4.833
437 H ARG 59 H ARG 59 35.354 25.784 -1.136
438 HA ARG 59 HA ARG 59 35.519 23.037 -1.989
439 HB2 ARG 59 1HB ARG 59 37.298 24.071 -0.670
440 HB3 ARG 59 2HB ARG 59 36.173 24.380 0.658
441 HG2 ARG 59 1HG ARG 59 35.851 21.939 0.937
442 HG3 ARG 59 2HG ARG 59 37.053 21.647 -0.330
443 HD2 ARG 59 1HD ARG 59 38.792 22.528 1.004
444 HD3 ARG 59 2HD ARG 59 37.638 23.286 2.132
445 HE ARG 59 HE ARG 59 37.071 20.522 2.104
446 HH11 ARG 59 1HH1 ARG 59 39.725 22.604 3.199
447 HH12 ARG 59 2HH1 ARG 59 40.179 21.491 4.460
448 HH21 ARG 59 1HH2 ARG 59 37.678 19.198 3.682
449 HH22 ARG 59 2HH2 ARG 59 39.034 19.564 4.731
450 H VAL 60 H VAL 60 33.748 24.635 0.715
451 HA VAL 60 HA VAL 60 32.666 22.096 1.529
452 HB VAL 60 HB VAL 60 32.984 24.107 3.042
453 HG11 VAL 60 1HG1 VAL 60 30.431 24.966 1.899
454 HG12 VAL 60 2HG1 VAL 60 31.300 25.693 3.249
455 HG13 VAL 60 3HG1 VAL 60 31.991 25.755 1.624
456 HG21 VAL 60 1HG2 VAL 60 30.243 22.818 3.082
457 HG22 VAL 60 2HG2 VAL 60 31.737 22.070 3.697
458 HG23 VAL 60 3HG2 VAL 60 31.103 23.539 4.464
459 H LEU 61 H LEU 61 31.699 24.608 -0.759
460 HA LEU 61 HA LEU 61 29.015 23.804 -1.184
461 HB2 LEU 61 1HB LEU 61 30.274 25.796 -2.152
462 HB3 LEU 61 2HB LEU 61 30.975 24.700 -3.319
463 HG LEU 61 HG LEU 61 28.282 24.218 -3.648
464 HD11 LEU 61 1HD1 LEU 61 27.766 26.076 -2.095
465 HD12 LEU 61 2HD1 LEU 61 27.201 26.394 -3.753
466 HD13 LEU 61 3HD1 LEU 61 28.681 27.185 -3.154
467 HD21 LEU 61 1HD2 LEU 61 29.446 26.530 -5.172
468 HD22 LEU 61 2HD2 LEU 61 28.523 25.136 -5.740
469 HD23 LEU 61 3HD2 LEU 61 30.233 24.935 -5.328
470 H VAL 62 H VAL 62 32.062 22.568 -2.710
471 HA VAL 62 HA VAL 62 30.503 20.644 -4.243
472 HB VAL 62 HB VAL 62 32.625 21.575 -5.115
473 HG11 VAL 62 1HG1 VAL 62 33.984 19.850 -3.017
474 HG12 VAL 62 2HG1 VAL 62 34.791 20.619 -4.399
475 HG13 VAL 62 3HG1 VAL 62 34.035 21.622 -3.157
476 HG21 VAL 62 1HG2 VAL 62 31.665 19.475 -5.992
477 HG22 VAL 62 2HG2 VAL 62 33.438 19.488 -6.102
478 HG23 VAL 62 3HG2 VAL 62 32.632 18.553 -4.817
479 H GLU 63 H GLU 63 32.368 20.508 -1.206
480 HA GLU 63 HA GLU 63 32.140 17.657 -0.900
481 HB2 GLU 63 1HB GLU 63 32.404 19.873 1.157
482 HB3 GLU 63 2HB GLU 63 32.338 18.158 1.572
483 HG2 GLU 63 1HG GLU 63 34.311 17.900 -0.128
484 HG3 GLU 63 2HG GLU 63 34.513 19.648 0.082
485 H GLN 64 H GLN 64 29.930 20.338 -0.062
486 HA GLN 64 HA GLN 64 27.948 18.727 1.247
487 HB2 GLN 64 1HB GLN 64 27.925 21.357 -0.234
488 HB3 GLN 64 2HB GLN 64 26.404 20.610 0.252
489 HG2 GLN 64 1HG GLN 64 28.649 21.156 2.209
490 HG3 GLN 64 2HG GLN 64 27.373 22.329 1.846
491 HE21 GLN 64 1HE2 GLN 64 26.681 19.668 4.646
492 HE22 GLN 64 2HE2 GLN 64 28.251 20.186 4.088
493 H GLN 65 H GLN 65 28.546 19.484 -2.207
494 HA GLN 65 HA GLN 65 26.110 18.182 -3.075
495 HB2 GLN 65 1HB GLN 65 28.652 18.938 -4.528
496 HB3 GLN 65 2HB GLN 65 27.261 18.188 -5.324
497 HG2 GLN 65 1HG GLN 65 25.826 20.052 -4.685
498 HG3 GLN 65 2HG GLN 65 27.136 20.792 -3.770
499 HE21 GLN 65 1HE2 GLN 65 28.594 22.365 -6.515
500 HE22 GLN 65 2HE2 GLN 65 28.654 22.016 -4.796
501 H GLN 66 H GLN 66 29.428 17.039 -2.440
502 HA GLN 66 HA GLN 66 29.015 14.410 -3.559
503 HB2 GLN 66 1HB GLN 66 30.818 15.371 -1.307
504 HB3 GLN 66 2HB GLN 66 30.838 13.734 -1.959
505 HG2 GLN 66 1HG GLN 66 31.493 14.584 -4.153
506 HG3 GLN 66 2HG GLN 66 31.436 16.242 -3.543
507 HE21 GLN 66 1HE2 GLN 66 34.728 16.138 -2.490
508 HE22 GLN 66 2HE2 GLN 66 33.379 17.037 -3.141
509 H ASP 67 H ASP 67 28.384 15.864 -0.339
510 HA ASP 67 HA ASP 67 27.528 13.390 0.880
511 HB2 ASP 67 1HB ASP 67 28.138 15.448 2.139
512 HB3 ASP 67 2HB ASP 67 26.677 16.223 1.533
513 H ARG 68 H ARG 68 25.891 15.976 -0.883
514 HA ARG 68 HA ARG 68 23.220 15.106 -0.434
515 HB2 ARG 68 1HB ARG 68 24.500 16.578 -2.736
516 HB3 ARG 68 2HB ARG 68 22.790 16.149 -2.753
517 HG2 ARG 68 1HG ARG 68 22.371 17.455 -0.762
518 HG3 ARG 68 2HG ARG 68 24.098 17.794 -0.572
519 HD2 ARG 68 1HD ARG 68 24.077 18.913 -2.808
520 HD3 ARG 68 2HD ARG 68 22.317 18.681 -2.858
521 HE ARG 68 HE ARG 68 23.054 19.970 -0.416
522 HH11 ARG 68 1HH1 ARG 68 22.818 20.700 -3.866
523 HH12 ARG 68 2HH1 ARG 68 22.574 22.402 -3.583
524 HH21 ARG 68 1HH2 ARG 68 22.727 22.148 -0.134
525 HH22 ARG 68 2HH2 ARG 68 22.502 23.202 -1.503
526 H ALA 69 H ALA 69 25.598 14.095 -2.919
527 HA ALA 69 HA ALA 69 23.831 12.398 -4.343
528 HB1 ALA 69 1HB ALA 69 26.833 12.081 -3.898
529 HB2 ALA 69 2HB ALA 69 25.871 11.322 -5.191
530 HB3 ALA 69 3HB ALA 69 26.062 13.089 -5.149
531 H ARG 70 H ARG 70 25.532 11.828 -1.276
532 HA ARG 70 HA ARG 70 25.172 8.950 -1.283
533 HB2 ARG 70 1HB ARG 70 25.432 10.831 1.098
534 HB3 ARG 70 2HB ARG 70 25.688 9.086 1.117
535 HG2 ARG 70 1HG ARG 70 27.681 9.307 -0.243
536 HG3 ARG 70 2HG ARG 70 27.349 11.022 -0.515
537 HD2 ARG 70 1HD ARG 70 27.476 11.349 1.998
538 HD3 ARG 70 2HD ARG 70 28.134 9.707 2.096
539 HE ARG 70 HE ARG 70 29.432 12.122 1.018
540 HH11 ARG 70 1HH1 ARG 70 29.651 8.610 1.334
541 HH12 ARG 70 2HH1 ARG 70 31.355 8.594 0.966
542 HH21 ARG 70 1HH2 ARG 70 31.596 12.020 0.552
543 HH22 ARG 70 2HH2 ARG 70 32.436 10.495 0.542
544 H ARG 71 H ARG 71 23.399 11.650 0.248
545 HA ARG 71 HA ARG 71 21.338 9.889 1.319
546 HB2 ARG 71 1HB ARG 71 20.214 11.936 1.974
547 HB3 ARG 71 2HB ARG 71 21.905 11.917 2.463
548 HG2 ARG 71 1HG ARG 71 22.449 13.425 0.603
549 HG3 ARG 71 2HG ARG 71 20.736 13.475 0.154
550 HD2 ARG 71 1HD ARG 71 21.176 15.436 1.438
551 HD3 ARG 71 2HD ARG 71 20.253 14.339 2.475
552 HE ARG 71 HE ARG 71 23.248 14.619 2.652
553 HH11 ARG 71 1HH1 ARG 71 20.111 14.470 4.311
554 HH12 ARG 71 2HH1 ARG 71 20.857 14.571 5.880
555 HH21 ARG 71 1HH2 ARG 71 24.090 14.746 4.638
556 HH22 ARG 71 2HH2 ARG 71 23.073 14.709 6.070
557 H GLU 72 H GLU 72 21.796 11.601 -1.626
558 HA GLU 72 HA GLU 72 19.187 11.891 -2.617
559 HB2 GLU 72 1HB GLU 72 21.272 12.668 -3.706
560 HB3 GLU 72 2HB GLU 72 21.646 11.004 -4.150
561 HG2 GLU 72 1HG GLU 72 19.594 10.945 -5.527
562 HG3 GLU 72 2HG GLU 72 19.287 12.641 -5.102
563 H GLN 73 H GLN 73 21.173 8.951 -2.417
564 HA GLN 73 HA GLN 73 19.616 7.290 -4.095
565 HB2 GLN 73 1HB GLN 73 21.029 6.474 -1.530
566 HB3 GLN 73 2HB GLN 73 20.629 5.437 -2.906
567 HG2 GLN 73 1HG GLN 73 22.667 7.696 -2.826
568 HG3 GLN 73 2HG GLN 73 22.998 5.969 -2.971
569 HE21 GLN 73 1HE2 GLN 73 22.663 8.139 -6.254
570 HE22 GLN 73 2HE2 GLN 73 23.043 8.739 -4.651
571 H GLU 74 H GLU 74 19.144 8.249 -0.698
572 HA GLU 74 HA GLU 74 16.739 6.581 -0.414
573 HB2 GLU 74 1HB GLU 74 17.804 8.861 1.295
574 HB3 GLU 74 2HB GLU 74 16.517 7.739 1.747
575 HG2 GLU 74 1HG GLU 74 18.116 5.871 1.711
576 HG3 GLU 74 2HG GLU 74 19.413 6.975 1.215
577 H ARG 75 H ARG 75 17.532 9.954 -1.205
578 HA ARG 75 HA ARG 75 14.892 10.965 -0.758
579 HB2 ARG 75 1HB ARG 75 17.103 11.994 -2.556
580 HB3 ARG 75 2HB ARG 75 15.615 12.865 -2.211
581 HG2 ARG 75 1HG ARG 75 16.608 12.178 0.325
582 HG3 ARG 75 2HG ARG 75 18.039 12.648 -0.612
583 HD2 ARG 75 1HD ARG 75 17.148 14.627 0.445
584 HD3 ARG 75 2HD ARG 75 16.826 14.739 -1.299
585 HE ARG 75 HE ARG 75 14.613 13.514 0.078
586 HH11 ARG 75 1HH1 ARG 75 16.044 16.687 -0.510
587 HH12 ARG 75 2HH1 ARG 75 14.534 17.518 -0.252
588 HH21 ARG 75 1HH2 ARG 75 12.718 14.644 0.385
589 HH22 ARG 75 2HH2 ARG 75 12.688 16.378 0.254
590 H ILE 76 H ILE 76 16.263 9.375 -3.611
591 HA ILE 76 HA ILE 76 14.229 10.243 -5.428
592 HB ILE 76 HB ILE 76 14.838 8.302 -6.829
593 HG12 ILE 76 1HG1 ILE 76 16.758 7.582 -4.598
594 HG13 ILE 76 2HG1 ILE 76 15.242 6.730 -4.886
595 HG21 ILE 76 1HG2 ILE 76 16.139 10.444 -6.816
596 HG22 ILE 76 2HG2 ILE 76 17.262 9.719 -5.652
597 HG23 ILE 76 3HG2 ILE 76 17.118 9.041 -7.284
598 HD11 ILE 76 1HD1 ILE 76 16.074 6.127 -7.178
599 HD12 ILE 76 2HD1 ILE 76 17.641 6.860 -6.750
600 HD13 ILE 76 3HD1 ILE 76 17.046 5.451 -5.849
601 H ARG 77 H ARG 77 14.074 8.043 -2.775
602 HA ARG 77 HA ARG 77 11.916 6.358 -3.480
603 HB2 ARG 77 1HB ARG 77 13.148 6.342 -1.314
604 HB3 ARG 77 2HB ARG 77 12.385 7.879 -0.889
605 HG2 ARG 77 1HG ARG 77 10.170 6.764 -0.980
606 HG3 ARG 77 2HG ARG 77 11.003 5.218 -1.243
607 HD2 ARG 77 1HD ARG 77 12.168 5.480 0.902
608 HD3 ARG 77 2HD ARG 77 11.446 7.085 1.112
609 HE ARG 77 HE ARG 77 9.386 6.141 1.641
610 HH11 ARG 77 1HH1 ARG 77 11.642 3.567 0.743
611 HH12 ARG 77 2HH1 ARG 77 10.595 2.312 1.347
612 HH21 ARG 77 1HH2 ARG 77 8.116 4.489 2.396
613 HH22 ARG 77 2HH2 ARG 77 8.638 2.829 2.280
614 H LEU 78 H LEU 78 11.911 9.809 -2.806
615 HA LEU 78 HA LEU 78 10.416 11.458 -2.962
616 HB2 LEU 78 1HB LEU 78 10.244 10.674 -5.194
617 HB3 LEU 78 2HB LEU 78 9.074 9.448 -4.755
618 HG LEU 78 HG LEU 78 7.394 11.192 -4.250
619 HD11 LEU 78 1HD1 LEU 78 8.827 13.086 -3.700
620 HD12 LEU 78 2HD1 LEU 78 7.790 13.500 -5.076
621 HD13 LEU 78 3HD1 LEU 78 9.501 13.094 -5.348
622 HD21 LEU 78 1HD2 LEU 78 8.634 11.324 -7.026
623 HD22 LEU 78 2HD2 LEU 78 6.965 11.775 -6.602
624 HD23 LEU 78 3HD2 LEU 78 7.494 10.088 -6.438
625 H PHE 79 H PHE 79 8.392 8.519 -2.518
626 HA PHE 79 HA PHE 79 6.288 10.080 -1.286
627 HB2 PHE 79 1HB PHE 79 6.767 7.083 -1.301
628 HB3 PHE 79 2HB PHE 79 5.243 7.897 -0.921
629 HD1 PHE 79 HD1 PHE 79 7.369 6.571 -3.542
630 HD2 PHE 79 HD2 PHE 79 4.123 9.290 -2.774
631 HE1 PHE 79 HE1 PHE 79 6.784 6.544 -5.961
632 HE2 PHE 79 HE2 PHE 79 3.525 9.266 -5.194
633 HZ PHE 79 HZ PHE 79 4.858 7.892 -6.793
634 H SER 80 H SER 80 5.649 10.168 0.839
635 HA SER 80 HA SER 80 5.905 10.404 3.079
636 HB2 SER 80 1HB SER 80 7.680 7.949 2.967
637 HB3 SER 80 2HB SER 80 6.835 8.595 4.385
638 HG SER 80 HG SER 80 4.862 8.185 3.270
639 H ALA 81 H ALA 81 7.471 12.000 1.534
640 HA ALA 81 HA ALA 81 9.731 12.523 3.384
641 HB1 ALA 81 1HB ALA 81 11.241 13.031 1.511
642 HB2 ALA 81 2HB ALA 81 10.686 11.346 1.376
643 HB3 ALA 81 3HB ALA 81 9.975 12.604 0.335
644 H ASP 82 H ASP 82 7.022 13.413 3.056
645 HA ASP 82 HA ASP 82 6.843 15.847 1.557
646 HB2 ASP 82 1HB ASP 82 4.839 15.952 3.498
647 HB3 ASP 82 2HB ASP 82 4.694 15.265 1.875
648 HA PRO 83 HA PRO 83 8.507 18.763 4.390
649 HB2 PRO 83 1HB PRO 83 7.129 21.040 3.864
650 HB3 PRO 83 2HB PRO 83 8.186 20.287 2.629
651 HG2 PRO 83 1HG PRO 83 5.223 20.021 3.015
652 HG3 PRO 83 2HG PRO 83 6.129 20.475 1.535
653 HD2 PRO 83 1HD PRO 83 5.291 17.941 1.968
654 HD3 PRO 83 2HD PRO 83 6.872 18.281 1.179
655 H PHE 84 H PHE 84 8.113 20.139 6.289
656 HA PHE 84 HA PHE 84 5.548 19.471 7.624
657 HB2 PHE 84 1HB PHE 84 8.264 19.689 8.938
658 HB3 PHE 84 2HB PHE 84 6.751 19.243 9.733
659 HD1 PHE 84 HD1 PHE 84 9.640 18.037 7.948
660 HD2 PHE 84 HD2 PHE 84 5.561 17.094 8.937
661 HE1 PHE 84 HE1 PHE 84 10.068 15.643 7.410
662 HE2 PHE 84 HE2 PHE 84 5.979 14.699 8.402
663 HZ PHE 84 HZ PHE 84 8.235 13.968 7.638
664 H ASP 85 H ASP 85 6.898 21.898 6.256
665 HA ASP 85 HA ASP 85 6.369 23.915 8.365
666 HB2 ASP 85 1HB ASP 85 7.291 25.498 6.579
667 HB3 ASP 85 2HB ASP 85 8.444 24.358 7.277
668 H LEU 86 H LEU 86 4.248 22.450 7.739
669 HA LEU 86 HA LEU 86 2.733 23.273 5.466
670 HB2 LEU 86 1HB LEU 86 0.821 22.308 6.668
671 HB3 LEU 86 2HB LEU 86 2.222 21.247 6.665
672 HG LEU 86 HG LEU 86 2.416 22.694 9.081
673 HD11 LEU 86 1HD1 LEU 86 0.260 22.302 10.165
674 HD12 LEU 86 2HD1 LEU 86 -0.420 21.678 8.642
675 HD13 LEU 86 3HD1 LEU 86 0.059 23.388 8.775
676 HD21 LEU 86 1HD2 LEU 86 3.085 20.360 8.707
677 HD22 LEU 86 2HD2 LEU 86 1.375 19.886 8.542
678 HD23 LEU 86 3HD2 LEU 86 1.989 20.496 10.097
679 H GLU 87 H GLU 87 3.173 24.713 8.643
680 HA GLU 87 HA GLU 87 0.992 26.638 8.299
681 HB2 GLU 87 1HB GLU 87 3.362 26.618 10.202
682 HB3 GLU 87 2HB GLU 87 1.952 27.681 10.307
683 HG2 GLU 87 1HG GLU 87 0.512 25.701 10.676
684 HG3 GLU 87 2HG GLU 87 1.956 24.669 10.644
685 H ALA 88 H ALA 88 4.464 26.449 7.837
686 HA ALA 88 HA ALA 88 6.075 28.011 7.332
687 HB1 ALA 88 1HB ALA 88 4.074 28.238 5.075
688 HB2 ALA 88 2HB ALA 88 5.748 28.846 5.006
689 HB3 ALA 88 3HB ALA 88 5.447 27.102 5.217
690 H GLN 89 H GLN 89 5.004 29.213 9.320
691 HA GLN 89 HA GLN 89 3.755 31.761 8.764
692 HB2 GLN 89 1HB GLN 89 5.154 30.750 11.272
693 HB3 GLN 89 2HB GLN 89 4.152 32.198 11.158
694 HG2 GLN 89 1HG GLN 89 2.255 30.648 10.407
695 HG3 GLN 89 2HG GLN 89 3.281 29.316 10.964
696 HE21 GLN 89 1HE2 GLN 89 2.145 29.692 14.233
697 HE22 GLN 89 2HE2 GLN 89 2.657 28.630 12.938
698 H ALA 90 H ALA 90 4.719 33.767 9.765
699 HA ALA 90 HA ALA 90 6.197 35.424 9.837
700 HB1 ALA 90 1HB ALA 90 7.305 33.845 11.404
701 HB2 ALA 90 2HB ALA 90 8.325 33.326 10.041
702 HB3 ALA 90 3HB ALA 90 8.419 35.000 10.629
703 H LYS 91 H LYS 91 5.931 33.788 7.335
704 HA LYS 91 HA LYS 91 8.073 34.896 5.647
705 HB2 LYS 91 1HB LYS 91 6.846 33.991 3.761
706 HB3 LYS 91 2HB LYS 91 6.943 32.758 5.024
707 HG2 LYS 91 1HG LYS 91 4.618 33.283 5.698
708 HG3 LYS 91 2HG LYS 91 4.524 34.502 4.412
709 HD2 LYS 91 1HD LYS 91 4.935 32.776 2.715
710 HD3 LYS 91 2HD LYS 91 5.060 31.540 3.984
711 HE2 LYS 91 1HE LYS 91 2.599 33.228 3.368
712 HE3 LYS 91 2HE LYS 91 2.838 31.533 2.903
713 HZ1 LYS 91 1HZ LYS 91 3.093 31.083 5.352
714 HZ2 LYS 91 2HZ LYS 91 1.572 31.530 4.878
715 HZ3 LYS 91 3HZ LYS 91 2.556 32.614 5.634
716 H ILE 92 H ILE 92 7.679 36.582 4.075
717 HA ILE 92 HA ILE 92 5.232 38.211 4.515
718 HB ILE 92 HB ILE 92 8.081 39.358 4.369
719 HG12 ILE 92 1HG1 ILE 92 6.098 39.451 6.681
720 HG13 ILE 92 2HG1 ILE 92 7.470 38.347 6.595
721 HG21 ILE 92 1HG2 ILE 92 6.981 41.576 4.635
722 HG22 ILE 92 2HG2 ILE 92 6.350 40.758 3.197
723 HG23 ILE 92 3HG2 ILE 92 5.383 40.793 4.688
724 HD11 ILE 92 1HD1 ILE 92 8.093 40.176 8.022
725 HD12 ILE 92 2HD1 ILE 92 9.013 40.341 6.510
726 HD13 ILE 92 3HD1 ILE 92 7.598 41.379 6.814
727 H GLU 93 H GLU 93 4.287 38.341 2.594
728 HA GLU 93 HA GLU 93 5.984 38.159 0.134
729 HB2 GLU 93 1HB GLU 93 3.725 37.653 -0.957
730 HB3 GLU 93 2HB GLU 93 4.437 36.390 0.042
731 HG2 GLU 93 1HG GLU 93 2.399 38.293 1.210
732 HG3 GLU 93 2HG GLU 93 1.893 36.899 0.247
733 H GLU 94 H GLU 94 5.239 39.555 -1.697
734 HA GLU 94 HA GLU 94 3.756 41.978 -0.905
735 HB2 GLU 94 1HB GLU 94 6.325 42.159 -0.371
736 HB3 GLU 94 2HB GLU 94 6.484 42.234 -2.126
737 HG2 GLU 94 1HG GLU 94 4.541 44.137 -1.561
738 HG3 GLU 94 2HG GLU 94 5.716 44.302 -0.247
739 H ASP 95 H ASP 95 3.246 43.245 -2.717
740 HA ASP 95 HA ASP 95 4.070 42.574 -5.388
741 HB2 ASP 95 1HB ASP 95 2.356 40.764 -4.941
742 HB3 ASP 95 2HB ASP 95 1.139 42.037 -4.793
743 H ILE 96 H ILE 96 4.449 44.941 -4.291
744 HA ILE 96 HA ILE 96 2.168 46.627 -5.302
745 HB ILE 96 HB ILE 96 3.133 48.531 -4.100
746 HG12 ILE 96 1HG1 ILE 96 5.075 46.643 -2.770
747 HG13 ILE 96 2HG1 ILE 96 5.536 47.573 -4.190
748 HG21 ILE 96 1HG2 ILE 96 1.462 46.991 -2.990
749 HG22 ILE 96 2HG2 ILE 96 2.814 46.129 -2.222
750 HG23 ILE 96 3HG2 ILE 96 2.510 47.838 -1.833
751 HD11 ILE 96 1HD1 ILE 96 5.021 49.673 -2.948
752 HD12 ILE 96 2HD1 ILE 96 4.649 48.698 -1.504
753 HD13 ILE 96 3HD1 ILE 96 6.294 48.702 -2.174
754 H ARG 97 H ARG 97 4.163 45.026 -6.759
755 HA ARG 97 HA ARG 97 6.048 46.948 -7.916
756 HB2 ARG 97 1HB ARG 97 5.686 44.071 -7.762
757 HB3 ARG 97 2HB ARG 97 5.995 44.540 -9.431
758 HG2 ARG 97 1HG ARG 97 8.114 44.096 -8.484
759 HG3 ARG 97 2HG ARG 97 7.990 45.863 -8.580
760 HD2 ARG 97 1HD ARG 97 7.277 45.895 -6.175
761 HD3 ARG 97 2HD ARG 97 7.545 44.142 -6.107
762 HE ARG 97 HE ARG 97 9.901 45.350 -7.102
763 HH11 ARG 97 1HH1 ARG 97 8.083 45.229 -4.069
764 HH12 ARG 97 2HH1 ARG 97 9.496 45.551 -3.108
765 HH21 ARG 97 1HH2 ARG 97 11.670 45.728 -5.795
766 HH22 ARG 97 2HH2 ARG 97 11.487 45.812 -4.065
767 H GLN 98 H GLN 98 3.212 47.502 -8.253
768 HA GLN 98 HA GLN 98 1.749 48.318 -9.814
769 HB2 GLN 98 1HB GLN 98 3.991 49.629 -10.182
770 HB3 GLN 98 2HB GLN 98 4.154 48.671 -11.647
771 HG2 GLN 98 1HG GLN 98 1.648 49.536 -12.109
772 HG3 GLN 98 2HG GLN 98 2.102 50.809 -10.976
773 HE21 GLN 98 1HE2 GLN 98 3.876 50.455 -14.669
774 HE22 GLN 98 2HE2 GLN 98 3.009 49.115 -13.952
775 HXT GLN 98 HO GLN 98 1.957 45.780 -9.833
Start of MODEL 11
1 H1 SER 1 1H SER 1 -13.903 5.845 -15.394
2 H2 SER 1 2H SER 1 -13.211 7.075 -16.128
3 H3 SER 1 3H SER 1 -14.343 7.287 -14.978
4 HA SER 1 HA SER 1 -12.775 6.912 -13.203
5 HB2 SER 1 1HB SER 1 -10.526 6.601 -15.141
6 HB3 SER 1 2HB SER 1 -10.868 5.696 -13.621
7 HG SER 1 HG SER 1 -12.884 5.546 -15.403
8 H GLN 2 H GLN 2 -11.319 8.426 -12.360
9 HA GLN 2 HA GLN 2 -10.693 10.762 -14.095
10 HB2 GLN 2 1HB GLN 2 -12.876 11.151 -12.930
11 HB3 GLN 2 2HB GLN 2 -12.062 10.920 -11.379
12 HG2 GLN 2 1HG GLN 2 -10.634 12.877 -11.834
13 HG3 GLN 2 2HG GLN 2 -11.441 13.103 -13.396
14 HE21 GLN 2 1HE2 GLN 2 -12.970 14.815 -10.165
15 HE22 GLN 2 2HE2 GLN 2 -11.335 14.220 -10.319
16 H GLN 3 H GLN 3 -8.523 10.949 -13.946
17 HA GLN 3 HA GLN 3 -7.265 10.998 -11.278
18 HB2 GLN 3 1HB GLN 3 -7.240 8.591 -12.073
19 HB3 GLN 3 2HB GLN 3 -6.319 9.121 -13.484
20 HG2 GLN 3 1HG GLN 3 -4.485 9.860 -12.019
21 HG3 GLN 3 2HG GLN 3 -5.420 9.393 -10.594
22 HE21 GLN 3 1HE2 GLN 3 -3.671 6.372 -10.701
23 HE22 GLN 3 2HE2 GLN 3 -4.000 7.857 -9.843
24 H SER 4 H SER 4 -5.337 12.251 -11.332
25 HA SER 4 HA SER 4 -4.978 13.899 -13.748
26 HB2 SER 4 1HB SER 4 -3.218 14.982 -12.272
27 HB3 SER 4 2HB SER 4 -4.865 15.018 -11.601
28 HG SER 4 HG SER 4 -2.784 13.197 -10.932
29 H HIS 5 H HIS 5 -3.215 13.745 -15.116
30 HA HIS 5 HA HIS 5 -1.262 11.552 -14.524
31 HB2 HIS 5 1HB HIS 5 -2.350 12.432 -17.222
32 HB3 HIS 5 2HB HIS 5 -1.092 11.218 -16.961
33 HD1 HIS 5 HD1 HIS 5 -2.684 9.867 -14.437
34 HD2 HIS 5 HD2 HIS 5 -4.126 10.583 -18.283
35 HE1 HIS 5 HE1 HIS 5 -4.579 8.236 -14.832
36 H SER 6 H SER 6 -1.759 14.798 -15.921
37 HA SER 6 HA SER 6 1.102 15.149 -16.422
38 HB2 SER 6 1HB SER 6 -0.045 17.631 -16.573
39 HB3 SER 6 2HB SER 6 -0.001 16.470 -17.921
40 HG SER 6 HG SER 6 -2.130 17.344 -17.370
41 H SER 7 H SER 7 2.521 16.297 -15.149
42 HA SER 7 HA SER 7 1.571 17.877 -12.858
43 HB2 SER 7 1HB SER 7 3.351 15.416 -12.529
44 HB3 SER 7 2HB SER 7 3.032 16.626 -11.267
45 HG SER 7 HG SER 7 0.731 15.694 -12.388
46 HA PRO 8 HA PRO 8 5.309 19.797 -14.276
47 HB2 PRO 8 1HB PRO 8 6.200 21.256 -12.165
48 HB3 PRO 8 2HB PRO 8 4.656 21.665 -12.986
49 HG2 PRO 8 1HG PRO 8 5.107 20.035 -10.505
50 HG3 PRO 8 2HG PRO 8 4.013 21.436 -10.747
51 HD2 PRO 8 1HD PRO 8 3.137 18.880 -10.920
52 HD3 PRO 8 2HD PRO 8 2.497 20.171 -11.996
53 H GLY 9 H GLY 9 7.652 19.836 -13.936
54 HA2 GLY 9 1HA GLY 9 8.702 17.925 -11.940
55 HA3 GLY 9 2HA GLY 9 8.951 17.523 -13.643
56 H GLU 10 H GLU 10 8.933 20.848 -12.712
57 HA GLU 10 HA GLU 10 11.791 21.061 -13.425
58 HB2 GLU 10 1HB GLU 10 9.642 23.151 -12.936
59 HB3 GLU 10 2HB GLU 10 11.298 23.506 -13.456
60 HG2 GLU 10 1HG GLU 10 10.957 22.255 -15.524
61 HG3 GLU 10 2HG GLU 10 9.328 21.790 -15.005
62 H ILE 11 H ILE 11 10.839 19.900 -10.881
63 HA ILE 11 HA ILE 11 11.299 21.653 -8.765
64 HB ILE 11 HB ILE 11 11.429 18.588 -8.785
65 HG12 ILE 11 1HG1 ILE 11 8.844 20.233 -8.768
66 HG13 ILE 11 2HG1 ILE 11 9.438 19.396 -10.194
67 HG21 ILE 11 1HG2 ILE 11 10.242 20.576 -6.899
68 HG22 ILE 11 2HG2 ILE 11 10.288 18.813 -6.670
69 HG23 ILE 11 3HG2 ILE 11 11.782 19.733 -6.694
70 HD11 ILE 11 1HD1 ILE 11 9.290 17.227 -8.993
71 HD12 ILE 11 2HD1 ILE 11 8.506 18.083 -7.647
72 HD13 ILE 11 3HD1 ILE 11 7.737 18.050 -9.246
73 H THR 12 H THR 12 13.389 20.796 -10.945
74 HA THR 12 HA THR 12 15.586 19.577 -9.580
75 HB THR 12 HB THR 12 16.925 20.517 -11.531
76 HG1 THR 12 HG1 THR 12 15.192 22.296 -11.673
77 HG21 THR 12 1HG2 THR 12 15.820 19.125 -13.215
78 HG22 THR 12 2HG2 THR 12 14.319 19.105 -12.269
79 HG23 THR 12 3HG2 THR 12 15.781 18.299 -11.642
80 H SER 13 H SER 13 17.384 20.359 -8.598
81 HA SER 13 HA SER 13 17.190 23.026 -7.442
82 HB2 SER 13 1HB SER 13 19.474 21.025 -7.409
83 HB3 SER 13 2HB SER 13 19.331 22.484 -6.407
84 HG SER 13 HG SER 13 17.911 20.048 -6.281
85 H SER 14 H SER 14 17.559 24.737 -8.677
86 HA SER 14 HA SER 14 20.119 24.784 -10.221
87 HB2 SER 14 1HB SER 14 18.106 24.542 -11.701
88 HB3 SER 14 2HB SER 14 17.547 26.121 -11.113
89 HG SER 14 HG SER 14 18.752 26.333 -13.029
90 HA PRO 15 HA PRO 15 20.026 28.457 -7.436
91 HB2 PRO 15 1HB PRO 15 22.494 28.202 -6.393
92 HB3 PRO 15 2HB PRO 15 21.113 27.257 -5.777
93 HG2 PRO 15 1HG PRO 15 23.201 26.448 -7.732
94 HG3 PRO 15 2HG PRO 15 22.692 25.614 -6.231
95 HD2 PRO 15 1HD PRO 15 21.707 24.909 -8.651
96 HD3 PRO 15 2HD PRO 15 20.676 24.892 -7.181
97 H GLN 16 H GLN 16 21.689 27.233 -9.990
98 HA GLN 16 HA GLN 16 22.791 28.028 -11.792
99 HB2 GLN 16 1HB GLN 16 21.191 30.080 -11.204
100 HB3 GLN 16 2HB GLN 16 22.746 30.878 -10.921
101 HG2 GLN 16 1HG GLN 16 23.463 30.142 -13.193
102 HG3 GLN 16 2HG GLN 16 21.836 29.486 -13.445
103 HE21 GLN 16 1HE2 GLN 16 20.410 32.570 -14.250
104 HE22 GLN 16 2HE2 GLN 16 20.217 30.842 -14.069
105 H GLY 17 H GLY 17 23.825 29.681 -8.796
106 HA2 GLY 17 1HA GLY 17 26.587 29.856 -9.702
107 HA3 GLY 17 2HA GLY 17 25.971 30.188 -8.082
108 H LEU 18 H LEU 18 25.026 27.128 -9.354
109 HA LEU 18 HA LEU 18 26.552 25.621 -7.450
110 HB2 LEU 18 1HB LEU 18 25.728 23.688 -8.505
111 HB3 LEU 18 2HB LEU 18 24.442 24.865 -8.447
112 HG LEU 18 HG LEU 18 25.417 25.305 -10.966
113 HD11 LEU 18 1HD1 LEU 18 25.589 22.320 -10.421
114 HD12 LEU 18 2HD1 LEU 18 26.991 23.391 -10.607
115 HD13 LEU 18 3HD1 LEU 18 25.877 23.150 -11.973
116 HD21 LEU 18 1HD2 LEU 18 23.479 23.958 -11.712
117 HD22 LEU 18 2HD2 LEU 18 23.084 25.056 -10.378
118 HD23 LEU 18 3HD2 LEU 18 23.311 23.319 -10.059
119 H ASP 19 H ASP 19 27.087 26.519 -10.833
120 HA ASP 19 HA ASP 19 29.591 24.995 -11.008
121 HB2 ASP 19 1HB ASP 19 27.732 25.932 -12.817
122 HB3 ASP 19 2HB ASP 19 29.006 27.151 -12.972
123 H ASN 20 H ASN 20 28.440 28.240 -10.372
124 HA ASN 20 HA ASN 20 31.214 29.210 -10.110
125 HB2 ASN 20 1HB ASN 20 29.184 30.090 -11.684
126 HB3 ASN 20 2HB ASN 20 29.022 31.173 -10.317
127 HD21 ASN 20 1HD2 ASN 20 31.774 31.803 -12.999
128 HD22 ASN 20 2HD2 ASN 20 30.330 30.869 -13.213
129 HA PRO 21 HA PRO 21 29.727 29.360 -5.761
130 HB2 PRO 21 1HB PRO 21 32.286 29.319 -4.689
131 HB3 PRO 21 2HB PRO 21 31.353 27.853 -5.054
132 HG2 PRO 21 1HG PRO 21 33.416 29.208 -6.668
133 HG3 PRO 21 2HG PRO 21 33.245 27.477 -6.292
134 HD2 PRO 21 1HD PRO 21 32.478 28.426 -8.644
135 HD3 PRO 21 2HD PRO 21 31.480 27.198 -7.788
136 H ALA 22 H ALA 22 32.120 31.179 -7.630
137 HA ALA 22 HA ALA 22 32.496 33.288 -5.733
138 HB1 ALA 22 1HB ALA 22 33.296 34.585 -7.673
139 HB2 ALA 22 2HB ALA 22 33.984 32.944 -7.665
140 HB3 ALA 22 3HB ALA 22 32.652 33.348 -8.773
141 H LEU 23 H LEU 23 30.119 32.773 -8.356
142 HA LEU 23 HA LEU 23 28.828 35.342 -7.913
143 HB2 LEU 23 1HB LEU 23 27.790 32.841 -9.294
144 HB3 LEU 23 2HB LEU 23 27.046 34.434 -9.354
145 HG LEU 23 HG LEU 23 29.739 33.689 -10.533
146 HD11 LEU 23 1HD1 LEU 23 28.610 33.967 -12.689
147 HD12 LEU 23 2HD1 LEU 23 27.088 34.380 -11.865
148 HD13 LEU 23 3HD1 LEU 23 27.765 32.743 -11.718
149 HD21 LEU 23 1HD2 LEU 23 28.208 36.310 -10.615
150 HD22 LEU 23 2HD2 LEU 23 29.634 35.923 -11.607
151 HD23 LEU 23 3HD2 LEU 23 29.784 36.017 -9.844
152 H LEU 24 H LEU 24 28.226 31.961 -6.892
153 HA LEU 24 HA LEU 24 25.712 32.546 -5.666
154 HB2 LEU 24 1HB LEU 24 26.687 30.284 -6.230
155 HB3 LEU 24 2HB LEU 24 27.699 30.417 -4.818
156 HG LEU 24 HG LEU 24 25.995 29.917 -3.373
157 HD11 LEU 24 1HD1 LEU 24 23.554 30.165 -3.828
158 HD12 LEU 24 2HD1 LEU 24 23.944 30.958 -5.371
159 HD13 LEU 24 3HD1 LEU 24 24.412 31.711 -3.828
160 HD21 LEU 24 1HD2 LEU 24 24.786 28.046 -4.269
161 HD22 LEU 24 2HD2 LEU 24 26.350 28.116 -5.111
162 HD23 LEU 24 3HD2 LEU 24 24.881 28.697 -5.920
163 H ARG 25 H ARG 25 29.055 32.637 -4.404
164 HA ARG 25 HA ARG 25 28.443 33.242 -1.695
165 HB2 ARG 25 1HB ARG 25 30.680 32.645 -2.471
166 HB3 ARG 25 2HB ARG 25 30.742 34.049 -3.518
167 HG2 ARG 25 1HG ARG 25 30.389 34.573 -0.597
168 HG3 ARG 25 2HG ARG 25 31.953 33.927 -1.118
169 HD2 ARG 25 1HD ARG 25 30.610 36.431 -2.193
170 HD3 ARG 25 2HD ARG 25 31.972 36.391 -1.067
171 HE ARG 25 HE ARG 25 33.034 35.036 -3.099
172 HH11 ARG 25 1HH1 ARG 25 31.098 37.991 -3.258
173 HH12 ARG 25 2HH1 ARG 25 31.869 38.531 -4.716
174 HH21 ARG 25 1HH2 ARG 25 33.985 35.806 -4.968
175 HH22 ARG 25 2HH2 ARG 25 33.466 37.319 -5.660
176 H ASP 26 H ASP 26 28.805 35.335 -4.574
177 HA ASP 26 HA ASP 26 28.524 37.790 -3.143
178 HB2 ASP 26 1HB ASP 26 29.289 37.170 -5.621
179 HB3 ASP 26 2HB ASP 26 27.598 37.529 -5.987
180 H MET 27 H MET 27 26.154 35.777 -4.935
181 HA MET 27 HA MET 27 23.872 37.438 -4.545
182 HB2 MET 27 1HB MET 27 24.045 35.395 -6.031
183 HB3 MET 27 2HB MET 27 23.960 34.403 -4.570
184 HG2 MET 27 1HG MET 27 21.753 35.592 -4.067
185 HG3 MET 27 2HG MET 27 21.839 36.207 -5.721
186 HE1 MET 27 1HE MET 27 22.261 32.841 -3.616
187 HE2 MET 27 2HE MET 27 20.592 33.423 -3.425
188 HE3 MET 27 3HE MET 27 20.911 31.911 -4.303
189 H LEU 28 H LEU 28 25.188 34.770 -2.567
190 HA LEU 28 HA LEU 28 23.100 34.751 -0.663
191 HB2 LEU 28 1HB LEU 28 25.914 33.808 -0.779
192 HB3 LEU 28 2HB LEU 28 25.119 33.872 0.798
193 HG LEU 28 HG LEU 28 23.757 32.553 -1.543
194 HD11 LEU 28 1HD1 LEU 28 24.692 30.437 -0.779
195 HD12 LEU 28 2HD1 LEU 28 25.715 31.311 0.386
196 HD13 LEU 28 3HD1 LEU 28 25.943 31.555 -1.359
197 HD21 LEU 28 1HD2 LEU 28 22.481 33.091 0.506
198 HD22 LEU 28 2HD2 LEU 28 23.625 32.151 1.469
199 HD23 LEU 28 3HD2 LEU 28 22.609 31.346 0.247
200 H LEU 29 H LEU 29 26.221 36.514 -0.674
201 HA LEU 29 HA LEU 29 25.833 37.645 1.944
202 HB2 LEU 29 1HB LEU 29 27.453 38.548 -0.450
203 HB3 LEU 29 2HB LEU 29 27.503 39.371 1.111
204 HG LEU 29 HG LEU 29 28.189 36.437 0.781
205 HD11 LEU 29 1HD1 LEU 29 30.536 37.130 0.781
206 HD12 LEU 29 2HD1 LEU 29 30.037 38.842 0.756
207 HD13 LEU 29 3HD1 LEU 29 29.659 37.778 -0.623
208 HD21 LEU 29 1HD2 LEU 29 27.655 37.086 3.080
209 HD22 LEU 29 2HD2 LEU 29 28.803 38.440 2.984
210 HD23 LEU 29 3HD2 LEU 29 29.389 36.760 2.917
211 H ALA 30 H ALA 30 24.812 38.624 -1.285
212 HA ALA 30 HA ALA 30 23.828 41.216 -0.388
213 HB1 ALA 30 1HB ALA 30 24.650 40.826 -2.695
214 HB2 ALA 30 2HB ALA 30 23.326 39.667 -2.968
215 HB3 ALA 30 3HB ALA 30 22.960 41.386 -2.686
216 H ASN 31 H ASN 31 22.605 38.015 -0.099
217 HA ASN 31 HA ASN 31 19.793 39.053 -0.083
218 HB2 ASN 31 1HB ASN 31 20.447 37.298 -1.774
219 HB3 ASN 31 2HB ASN 31 20.672 36.178 -0.427
220 HD21 ASN 31 1HD2 ASN 31 17.161 36.325 -2.011
221 HD22 ASN 31 2HD2 ASN 31 18.732 36.535 -2.761
222 HA PRO 32 HA PRO 32 20.672 38.243 4.238
223 HB2 PRO 32 1HB PRO 32 18.496 39.519 5.331
224 HB3 PRO 32 2HB PRO 32 19.966 40.373 4.757
225 HG2 PRO 32 1HG PRO 32 17.382 39.889 3.278
226 HG3 PRO 32 2HG PRO 32 18.268 41.429 3.526
227 HD2 PRO 32 1HD PRO 32 18.557 40.069 1.264
228 HD3 PRO 32 2HD PRO 32 19.987 40.821 2.056
229 H HIS 33 H HIS 33 17.637 37.457 2.553
230 HA HIS 33 HA HIS 33 16.660 35.788 4.738
231 HB2 HIS 33 1HB HIS 33 15.180 36.855 3.033
232 HB3 HIS 33 2HB HIS 33 15.893 35.809 1.797
233 HD1 HIS 33 HD1 HIS 33 13.475 35.754 4.693
234 HD2 HIS 33 HD2 HIS 33 15.095 33.126 1.895
235 HE1 HIS 33 HE1 HIS 33 12.115 33.626 4.807
236 H GLU 34 H GLU 34 18.390 35.278 1.667
237 HA GLU 34 HA GLU 34 18.245 32.391 1.805
238 HB2 GLU 34 1HB GLU 34 19.211 34.414 0.008
239 HB3 GLU 34 2HB GLU 34 20.464 33.216 0.223
240 HG2 GLU 34 1HG GLU 34 17.626 32.448 -0.445
241 HG3 GLU 34 2HG GLU 34 18.783 32.914 -1.698
242 H LEU 35 H LEU 35 20.635 34.873 2.740
243 HA LEU 35 HA LEU 35 22.634 32.984 3.509
244 HB2 LEU 35 1HB LEU 35 23.855 34.722 4.150
245 HB3 LEU 35 2HB LEU 35 22.758 35.413 3.007
246 HG LEU 35 HG LEU 35 21.506 36.494 4.800
247 HD11 LEU 35 1HD1 LEU 35 23.716 35.413 6.549
248 HD12 LEU 35 2HD1 LEU 35 21.957 35.301 6.792
249 HD13 LEU 35 3HD1 LEU 35 22.762 36.864 6.952
250 HD21 LEU 35 1HD2 LEU 35 24.484 36.932 4.520
251 HD22 LEU 35 2HD2 LEU 35 23.317 38.167 5.065
252 HD23 LEU 35 3HD2 LEU 35 23.216 37.510 3.419
253 H SER 36 H SER 36 19.781 34.217 5.098
254 HA SER 36 HA SER 36 20.513 33.371 7.755
255 HB2 SER 36 1HB SER 36 18.891 35.197 7.290
256 HB3 SER 36 2HB SER 36 17.752 33.991 6.656
257 HG SER 36 HG SER 36 17.609 33.087 8.678
258 H LEU 37 H LEU 37 18.431 31.983 5.152
259 HA LEU 37 HA LEU 37 17.662 29.717 6.763
260 HB2 LEU 37 1HB LEU 37 16.747 28.812 4.866
261 HB3 LEU 37 2HB LEU 37 16.590 30.518 4.774
262 HG LEU 37 HG LEU 37 18.371 30.548 3.029
263 HD11 LEU 37 1HD1 LEU 37 17.635 27.613 2.960
264 HD12 LEU 37 2HD1 LEU 37 19.239 28.289 3.304
265 HD13 LEU 37 3HD1 LEU 37 18.535 28.490 1.694
266 HD21 LEU 37 1HD2 LEU 37 15.991 30.967 2.643
267 HD22 LEU 37 2HD2 LEU 37 15.685 29.217 2.543
268 HD23 LEU 37 3HD2 LEU 37 16.681 30.023 1.310
269 H LEU 38 H LEU 38 20.354 30.530 4.749
270 HA LEU 38 HA LEU 38 21.404 27.911 4.564
271 HB2 LEU 38 1HB LEU 38 21.908 29.903 3.208
272 HB3 LEU 38 2HB LEU 38 22.850 30.560 4.558
273 HG LEU 38 HG LEU 38 24.275 28.488 4.510
274 HD11 LEU 38 1HD1 LEU 38 22.847 28.086 1.872
275 HD12 LEU 38 2HD1 LEU 38 22.741 27.043 3.306
276 HD13 LEU 38 3HD1 LEU 38 24.273 27.181 2.431
277 HD21 LEU 38 1HD2 LEU 38 25.685 29.221 2.702
278 HD22 LEU 38 2HD2 LEU 38 24.985 30.645 3.500
279 HD23 LEU 38 3HD2 LEU 38 24.329 30.086 1.947
280 H LYS 39 H LYS 39 22.140 30.555 6.893
281 HA LYS 39 HA LYS 39 23.874 28.805 8.437
282 HB2 LYS 39 1HB LYS 39 23.706 30.485 10.244
283 HB3 LYS 39 2HB LYS 39 24.271 31.118 8.697
284 HG2 LYS 39 1HG LYS 39 22.198 32.214 8.285
285 HG3 LYS 39 2HG LYS 39 21.375 31.375 9.571
286 HD2 LYS 39 1HD LYS 39 21.766 33.560 10.357
287 HD3 LYS 39 2HD LYS 39 22.962 32.544 11.184
288 HE2 LYS 39 1HE LYS 39 24.692 33.248 9.577
289 HE3 LYS 39 2HE LYS 39 23.484 34.178 8.664
290 HZ1 LYS 39 1HZ LYS 39 24.287 34.713 11.467
291 HZ2 LYS 39 2HZ LYS 39 23.168 35.571 10.611
292 HZ3 LYS 39 3HZ LYS 39 24.752 35.594 10.152
293 H GLU 40 H GLU 40 20.409 29.257 8.396
294 HA GLU 40 HA GLU 40 19.972 27.972 10.961
295 HB2 GLU 40 1HB GLU 40 18.299 29.431 9.823
296 HB3 GLU 40 2HB GLU 40 18.156 28.241 8.530
297 HG2 GLU 40 1HG GLU 40 17.355 26.574 10.236
298 HG3 GLU 40 2HG GLU 40 17.345 27.885 11.428
299 H ARG 41 H ARG 41 19.725 26.868 7.538
300 HA ARG 41 HA ARG 41 19.351 24.101 8.577
301 HB2 ARG 41 1HB ARG 41 18.965 25.293 5.821
302 HB3 ARG 41 2HB ARG 41 18.537 23.655 6.324
303 HG2 ARG 41 1HG ARG 41 17.163 24.729 8.174
304 HG3 ARG 41 2HG ARG 41 17.422 26.269 7.356
305 HD2 ARG 41 1HD ARG 41 16.281 25.414 5.366
306 HD3 ARG 41 2HD ARG 41 15.994 23.871 6.221
307 HE ARG 41 HE ARG 41 15.149 26.484 7.426
308 HH11 ARG 41 1HH1 ARG 41 14.190 23.251 6.316
309 HH12 ARG 41 2HH1 ARG 41 12.623 23.381 7.062
310 HH21 ARG 41 1HH2 ARG 41 13.197 26.568 8.315
311 HH22 ARG 41 2HH2 ARG 41 12.057 25.248 8.176
312 H ASN 42 H ASN 42 21.824 25.838 6.916
313 HA ASN 42 HA ASN 42 23.302 23.252 6.625
314 HB2 ASN 42 1HB ASN 42 22.398 24.250 4.427
315 HB3 ASN 42 2HB ASN 42 23.586 25.511 4.633
316 HD21 ASN 42 1HD2 ASN 42 25.193 23.049 2.520
317 HD22 ASN 42 2HD2 ASN 42 24.006 24.324 2.451
318 HA PRO 43 HA PRO 43 25.534 26.662 8.873
319 HB2 PRO 43 1HB PRO 43 26.653 25.055 10.858
320 HB3 PRO 43 2HB PRO 43 25.139 26.003 10.996
321 HG2 PRO 43 1HG PRO 43 25.492 23.104 10.308
322 HG3 PRO 43 2HG PRO 43 24.346 23.872 11.451
323 HD2 PRO 43 1HD PRO 43 23.555 23.139 9.002
324 HD3 PRO 43 2HD PRO 43 22.990 24.691 9.719
325 HA PRO 44 HA PRO 44 29.574 24.471 8.094
326 HB2 PRO 44 1HB PRO 44 29.776 22.516 6.188
327 HB3 PRO 44 2HB PRO 44 29.534 22.155 7.924
328 HG2 PRO 44 1HG PRO 44 27.489 22.348 5.757
329 HG3 PRO 44 2HG PRO 44 27.774 21.024 6.931
330 HD2 PRO 44 1HD PRO 44 25.882 22.854 7.385
331 HD3 PRO 44 2HD PRO 44 26.928 22.285 8.728
332 H LEU 45 H LEU 45 27.179 24.618 5.367
333 HA LEU 45 HA LEU 45 29.199 25.773 3.599
334 HB2 LEU 45 1HB LEU 45 27.221 24.542 2.747
335 HB3 LEU 45 2HB LEU 45 26.186 25.837 3.350
336 HG LEU 45 HG LEU 45 27.126 27.416 1.769
337 HD11 LEU 45 1HD1 LEU 45 28.765 26.703 0.024
338 HD12 LEU 45 2HD1 LEU 45 28.993 25.171 0.893
339 HD13 LEU 45 3HD1 LEU 45 29.464 26.711 1.646
340 HD21 LEU 45 1HD2 LEU 45 26.537 24.781 0.362
341 HD22 LEU 45 2HD2 LEU 45 26.347 26.418 -0.310
342 HD23 LEU 45 3HD2 LEU 45 25.309 25.884 1.023
343 H ALA 46 H ALA 46 26.668 26.875 5.817
344 HA ALA 46 HA ALA 46 26.793 29.615 5.102
345 HB1 ALA 46 1HB ALA 46 26.303 28.493 7.855
346 HB2 ALA 46 2HB ALA 46 25.742 30.042 7.185
347 HB3 ALA 46 3HB ALA 46 25.103 28.513 6.544
348 H GLU 47 H GLU 47 28.671 27.900 7.710
349 HA GLU 47 HA GLU 47 29.972 30.267 8.603
350 HB2 GLU 47 1HB GLU 47 31.611 28.856 9.661
351 HB3 GLU 47 2HB GLU 47 30.005 28.152 9.867
352 HG2 GLU 47 1HG GLU 47 30.466 26.504 8.141
353 HG3 GLU 47 2HG GLU 47 32.034 27.239 7.798
354 H ALA 48 H ALA 48 30.686 28.163 5.896
355 HA ALA 48 HA ALA 48 33.244 29.175 5.282
356 HB1 ALA 48 1HB ALA 48 31.198 28.082 3.333
357 HB2 ALA 48 2HB ALA 48 32.962 27.999 3.234
358 HB3 ALA 48 3HB ALA 48 32.110 27.045 4.453
359 H LEU 49 H LEU 49 29.961 30.193 4.402
360 HA LEU 49 HA LEU 49 30.778 32.283 2.577
361 HB2 LEU 49 1HB LEU 49 28.480 31.264 2.706
362 HB3 LEU 49 2HB LEU 49 28.276 32.013 4.281
363 HG LEU 49 HG LEU 49 28.712 34.257 3.042
364 HD11 LEU 49 1HD1 LEU 49 29.417 33.230 0.920
365 HD12 LEU 49 2HD1 LEU 49 27.975 34.241 0.709
366 HD13 LEU 49 3HD1 LEU 49 27.818 32.472 0.755
367 HD21 LEU 49 1HD2 LEU 49 26.602 33.569 4.110
368 HD22 LEU 49 2HD2 LEU 49 26.143 32.691 2.631
369 HD23 LEU 49 3HD2 LEU 49 26.323 34.462 2.603
370 H LEU 50 H LEU 50 30.012 32.125 6.073
371 HA LEU 50 HA LEU 50 30.031 34.945 6.523
372 HB2 LEU 50 1HB LEU 50 30.864 32.847 8.544
373 HB3 LEU 50 2HB LEU 50 30.221 34.443 8.869
374 HG LEU 50 HG LEU 50 28.783 31.972 8.017
375 HD11 LEU 50 1HD1 LEU 50 27.467 32.364 9.985
376 HD12 LEU 50 2HD1 LEU 50 28.379 33.865 10.303
377 HD13 LEU 50 3HD1 LEU 50 29.197 32.281 10.354
378 HD21 LEU 50 1HD2 LEU 50 26.678 33.267 7.885
379 HD22 LEU 50 2HD2 LEU 50 27.805 33.578 6.558
380 HD23 LEU 50 3HD2 LEU 50 27.652 34.762 7.885
381 H SER 51 H SER 51 32.579 32.555 6.404
382 HA SER 51 HA SER 51 34.619 34.108 7.687
383 HB2 SER 51 1HB SER 51 34.368 31.549 7.005
384 HB3 SER 51 2HB SER 51 35.235 32.088 5.563
385 HG SER 51 HG SER 51 36.991 32.559 6.771
386 H GLY 52 H GLY 52 33.251 34.178 4.463
387 HA2 GLY 52 1HA GLY 52 33.690 35.770 2.802
388 HA3 GLY 52 2HA GLY 52 35.103 36.332 3.711
389 H ASP 53 H ASP 53 36.122 33.595 4.027
390 HA ASP 53 HA ASP 53 37.911 33.351 1.904
391 HB2 ASP 53 1HB ASP 53 36.846 31.463 3.938
392 HB3 ASP 53 2HB ASP 53 38.189 31.067 2.876
393 H LEU 54 H LEU 54 37.127 33.257 -0.167
394 HA LEU 54 HA LEU 54 34.868 31.707 -0.937
395 HB2 LEU 54 1HB LEU 54 35.874 33.474 -2.347
396 HB3 LEU 54 2HB LEU 54 37.322 32.477 -2.540
397 HG LEU 54 HG LEU 54 35.638 30.679 -3.473
398 HD11 LEU 54 1HD1 LEU 54 33.744 31.592 -4.630
399 HD12 LEU 54 2HD1 LEU 54 34.101 33.214 -3.987
400 HD13 LEU 54 3HD1 LEU 54 33.611 31.901 -2.890
401 HD21 LEU 54 1HD2 LEU 54 36.530 33.113 -4.939
402 HD22 LEU 54 2HD2 LEU 54 36.037 31.558 -5.667
403 HD23 LEU 54 3HD2 LEU 54 37.453 31.612 -4.590
404 H GLU 55 H GLU 55 38.313 30.879 -0.586
405 HA GLU 55 HA GLU 55 38.246 28.457 -2.041
406 HB2 GLU 55 1HB GLU 55 40.141 27.774 -0.596
407 HB3 GLU 55 2HB GLU 55 40.349 29.344 -1.366
408 HG2 GLU 55 1HG GLU 55 40.510 30.428 0.605
409 HG3 GLU 55 2HG GLU 55 39.221 29.481 1.357
410 H LYS 56 H LYS 56 37.201 29.201 1.216
411 HA LYS 56 HA LYS 56 36.711 26.333 1.738
412 HB2 LYS 56 1HB LYS 56 36.050 26.819 3.954
413 HB3 LYS 56 2HB LYS 56 37.542 27.732 3.574
414 HG2 LYS 56 1HG LYS 56 36.117 29.678 3.290
415 HG3 LYS 56 2HG LYS 56 34.797 28.760 3.958
416 HD2 LYS 56 1HD LYS 56 37.471 28.943 5.390
417 HD3 LYS 56 2HD LYS 56 36.282 30.219 5.542
418 HE2 LYS 56 1HE LYS 56 34.617 28.500 6.356
419 HE3 LYS 56 2HE LYS 56 35.961 27.344 6.427
420 HZ1 LYS 56 1HZ LYS 56 37.072 28.829 7.975
421 HZ2 LYS 56 2HZ LYS 56 35.560 28.499 8.554
422 HZ3 LYS 56 3HZ LYS 56 35.879 29.959 7.845
423 H PHE 57 H PHE 57 34.865 29.259 0.971
424 HA PHE 57 HA PHE 57 32.296 28.078 1.237
425 HB2 PHE 57 1HB PHE 57 32.652 30.476 0.841
426 HB3 PHE 57 2HB PHE 57 33.221 30.124 -0.796
427 HD1 PHE 57 HD1 PHE 57 31.699 29.997 -2.591
428 HD2 PHE 57 HD2 PHE 57 30.247 29.720 1.453
429 HE1 PHE 57 HE1 PHE 57 29.361 30.041 -3.425
430 HE2 PHE 57 HE2 PHE 57 27.904 29.781 0.619
431 HZ PHE 57 HZ PHE 57 27.463 29.940 -1.830
432 H SER 58 H SER 58 34.479 28.151 -1.605
433 HA SER 58 HA SER 58 32.793 26.567 -3.279
434 HB2 SER 58 1HB SER 58 34.679 27.966 -4.083
435 HB3 SER 58 2HB SER 58 35.824 26.883 -3.263
436 HG SER 58 HG SER 58 35.635 26.308 -5.438
437 H ARG 59 H ARG 59 35.417 25.687 -1.021
438 HA ARG 59 HA ARG 59 35.576 22.935 -1.739
439 HB2 ARG 59 1HB ARG 59 37.188 24.176 -0.321
440 HB3 ARG 59 2HB ARG 59 35.983 24.267 0.963
441 HG2 ARG 59 1HG ARG 59 35.999 21.766 1.079
442 HG3 ARG 59 2HG ARG 59 37.343 21.776 -0.088
443 HD2 ARG 59 1HD ARG 59 37.284 23.159 2.617
444 HD3 ARG 59 2HD ARG 59 38.159 21.662 2.240
445 HE ARG 59 HE ARG 59 39.410 23.100 0.513
446 HH11 ARG 59 1HH1 ARG 59 38.236 24.535 3.535
447 HH12 ARG 59 2HH1 ARG 59 39.403 25.837 3.443
448 HH21 ARG 59 1HH2 ARG 59 40.852 24.789 0.526
449 HH22 ARG 59 2HH2 ARG 59 40.819 25.988 1.806
450 H VAL 60 H VAL 60 33.558 24.608 0.729
451 HA VAL 60 HA VAL 60 32.321 22.092 1.469
452 HB VAL 60 HB VAL 60 31.354 24.923 2.048
453 HG11 VAL 60 1HG1 VAL 60 29.581 23.316 2.391
454 HG12 VAL 60 2HG1 VAL 60 30.689 22.190 3.214
455 HG13 VAL 60 3HG1 VAL 60 30.247 23.726 3.982
456 HG21 VAL 60 1HG2 VAL 60 33.641 24.541 2.944
457 HG22 VAL 60 2HG2 VAL 60 32.456 24.594 4.256
458 HG23 VAL 60 3HG2 VAL 60 33.101 23.031 3.704
459 H LEU 61 H LEU 61 31.626 24.683 -0.872
460 HA LEU 61 HA LEU 61 28.950 24.003 -1.450
461 HB2 LEU 61 1HB LEU 61 30.348 25.964 -2.337
462 HB3 LEU 61 2HB LEU 61 30.983 24.849 -3.535
463 HG LEU 61 HG LEU 61 28.268 24.504 -3.838
464 HD11 LEU 61 1HD1 LEU 61 27.233 26.687 -3.755
465 HD12 LEU 61 2HD1 LEU 61 28.768 27.452 -3.277
466 HD13 LEU 61 3HD1 LEU 61 27.926 26.342 -2.161
467 HD21 LEU 61 1HD2 LEU 61 28.471 25.683 -5.881
468 HD22 LEU 61 2HD2 LEU 61 30.103 25.055 -5.578
469 HD23 LEU 61 3HD2 LEU 61 29.719 26.756 -5.244
470 H VAL 62 H VAL 62 31.987 22.657 -2.898
471 HA VAL 62 HA VAL 62 30.464 20.920 -4.628
472 HB VAL 62 HB VAL 62 32.783 21.619 -5.155
473 HG11 VAL 62 1HG1 VAL 62 34.706 20.452 -4.155
474 HG12 VAL 62 2HG1 VAL 62 33.850 21.452 -2.977
475 HG13 VAL 62 3HG1 VAL 62 33.635 19.685 -2.965
476 HG21 VAL 62 1HG2 VAL 62 31.740 19.645 -6.232
477 HG22 VAL 62 2HG2 VAL 62 33.505 19.491 -6.104
478 HG23 VAL 62 3HG2 VAL 62 32.455 18.603 -4.976
479 H GLU 63 H GLU 63 31.843 20.481 -1.373
480 HA GLU 63 HA GLU 63 31.283 17.678 -1.165
481 HB2 GLU 63 1HB GLU 63 31.383 19.885 0.921
482 HB3 GLU 63 2HB GLU 63 31.173 18.180 1.323
483 HG2 GLU 63 1HG GLU 63 33.563 19.366 -0.135
484 HG3 GLU 63 2HG GLU 63 33.526 18.908 1.571
485 H GLN 64 H GLN 64 29.304 20.577 -0.453
486 HA GLN 64 HA GLN 64 27.006 19.065 0.428
487 HB2 GLN 64 1HB GLN 64 27.324 21.883 -0.651
488 HB3 GLN 64 2HB GLN 64 25.778 21.228 -0.106
489 HG2 GLN 64 1HG GLN 64 28.256 21.464 1.629
490 HG3 GLN 64 2HG GLN 64 26.920 22.614 1.603
491 HE21 GLN 64 1HE2 GLN 64 26.703 19.823 4.267
492 HE22 GLN 64 2HE2 GLN 64 28.126 20.578 3.596
493 H GLN 65 H GLN 65 28.138 20.177 -2.779
494 HA GLN 65 HA GLN 65 25.653 19.583 -4.108
495 HB2 GLN 65 1HB GLN 65 28.481 19.941 -5.061
496 HB3 GLN 65 2HB GLN 65 27.222 19.351 -6.148
497 HG2 GLN 65 1HG GLN 65 25.846 21.353 -5.569
498 HG3 GLN 65 2HG GLN 65 27.233 21.992 -4.681
499 HE21 GLN 65 1HE2 GLN 65 28.833 23.195 -7.526
500 HE22 GLN 65 2HE2 GLN 65 28.813 23.023 -5.781
501 H GLN 66 H GLN 66 28.543 17.595 -3.392
502 HA GLN 66 HA GLN 66 27.758 15.356 -4.992
503 HB2 GLN 66 1HB GLN 66 29.331 15.532 -2.398
504 HB3 GLN 66 2HB GLN 66 29.128 14.037 -3.315
505 HG2 GLN 66 1HG GLN 66 30.293 14.980 -5.222
506 HG3 GLN 66 2HG GLN 66 30.397 16.551 -4.425
507 HE21 GLN 66 1HE2 GLN 66 33.223 15.801 -2.538
508 HE22 GLN 66 2HE2 GLN 66 32.015 16.966 -3.026
509 H ASP 67 H ASP 67 26.984 16.276 -1.601
510 HA ASP 67 HA ASP 67 25.372 13.898 -1.224
511 HB2 ASP 67 1HB ASP 67 26.457 15.353 0.573
512 HB3 ASP 67 2HB ASP 67 25.099 16.460 0.343
513 H ARG 68 H ARG 68 24.728 17.230 -2.245
514 HA ARG 68 HA ARG 68 21.874 17.139 -2.173
515 HB2 ARG 68 1HB ARG 68 23.926 18.698 -3.658
516 HB3 ARG 68 2HB ARG 68 22.330 18.652 -4.380
517 HG2 ARG 68 1HG ARG 68 22.458 19.327 -1.479
518 HG3 ARG 68 2HG ARG 68 23.094 20.522 -2.627
519 HD2 ARG 68 1HD ARG 68 20.939 20.298 -3.933
520 HD3 ARG 68 2HD ARG 68 20.299 19.325 -2.595
521 HE ARG 68 HE ARG 68 21.298 21.716 -1.485
522 HH11 ARG 68 1HH1 ARG 68 18.720 20.851 -3.755
523 HH12 ARG 68 2HH1 ARG 68 17.757 22.235 -3.314
524 HH21 ARG 68 1HH2 ARG 68 19.999 23.465 -0.997
525 HH22 ARG 68 2HH2 ARG 68 18.467 23.680 -1.795
526 H ALA 69 H ALA 69 24.206 16.023 -4.652
527 HA ALA 69 HA ALA 69 22.283 15.442 -6.651
528 HB1 ALA 69 1HB ALA 69 23.999 13.925 -7.567
529 HB2 ALA 69 2HB ALA 69 24.734 15.452 -7.024
530 HB3 ALA 69 3HB ALA 69 24.893 13.985 -6.030
531 H ARG 70 H ARG 70 23.257 13.598 -3.777
532 HA ARG 70 HA ARG 70 21.857 11.163 -4.517
533 HB2 ARG 70 1HB ARG 70 22.522 12.209 -1.737
534 HB3 ARG 70 2HB ARG 70 22.150 10.541 -2.164
535 HG2 ARG 70 1HG ARG 70 24.241 10.299 -3.337
536 HG3 ARG 70 2HG ARG 70 24.541 12.043 -3.278
537 HD2 ARG 70 1HD ARG 70 25.911 11.113 -1.590
538 HD3 ARG 70 2HD ARG 70 24.549 11.887 -0.769
539 HE ARG 70 HE ARG 70 24.297 9.007 -1.330
540 HH11 ARG 70 1HH1 ARG 70 25.004 11.489 1.112
541 HH12 ARG 70 2HH1 ARG 70 24.859 10.337 2.418
542 HH21 ARG 70 1HH2 ARG 70 24.098 7.640 0.405
543 HH22 ARG 70 2HH2 ARG 70 24.327 8.227 2.030
544 H ARG 71 H ARG 71 21.095 13.991 -2.474
545 HA ARG 71 HA ARG 71 18.476 13.138 -1.659
546 HB2 ARG 71 1HB ARG 71 19.460 15.982 -2.145
547 HB3 ARG 71 2HB ARG 71 18.081 15.521 -1.151
548 HG2 ARG 71 1HG ARG 71 19.545 14.553 0.535
549 HG3 ARG 71 2HG ARG 71 20.950 14.745 -0.521
550 HD2 ARG 71 1HD ARG 71 20.284 17.276 -0.557
551 HD3 ARG 71 2HD ARG 71 19.375 16.885 0.912
552 HE ARG 71 HE ARG 71 22.005 15.861 1.241
553 HH11 ARG 71 1HH1 ARG 71 20.497 19.053 0.925
554 HH12 ARG 71 2HH1 ARG 71 21.792 19.834 1.795
555 HH21 ARG 71 1HH2 ARG 71 23.574 16.923 2.321
556 HH22 ARG 71 2HH2 ARG 71 23.517 18.666 2.557
557 H GLU 72 H GLU 72 19.712 14.819 -4.503
558 HA GLU 72 HA GLU 72 17.309 15.909 -5.448
559 HB2 GLU 72 1HB GLU 72 19.713 16.352 -6.167
560 HB3 GLU 72 2HB GLU 72 19.593 14.907 -7.166
561 HG2 GLU 72 1HG GLU 72 19.180 16.738 -8.575
562 HG3 GLU 72 2HG GLU 72 17.607 15.987 -8.286
563 H GLN 73 H GLN 73 18.648 12.656 -5.899
564 HA GLN 73 HA GLN 73 16.974 11.845 -8.038
565 HB2 GLN 73 1HB GLN 73 17.870 10.127 -5.690
566 HB3 GLN 73 2HB GLN 73 17.394 9.565 -7.295
567 HG2 GLN 73 1HG GLN 73 19.869 11.147 -6.555
568 HG3 GLN 73 2HG GLN 73 19.800 9.471 -7.096
569 HE21 GLN 73 1HE2 GLN 73 20.361 12.304 -9.776
570 HE22 GLN 73 2HE2 GLN 73 20.692 12.423 -8.057
571 H GLU 74 H GLU 74 16.450 11.905 -4.515
572 HA GLU 74 HA GLU 74 13.822 10.689 -4.718
573 HB2 GLU 74 1HB GLU 74 15.004 12.276 -2.419
574 HB3 GLU 74 2HB GLU 74 13.659 11.123 -2.362
575 HG2 GLU 74 1HG GLU 74 15.514 9.502 -3.396
576 HG3 GLU 74 2HG GLU 74 16.606 10.627 -2.579
577 H ARG 75 H ARG 75 15.108 14.000 -4.603
578 HA ARG 75 HA ARG 75 12.602 15.292 -4.088
579 HB2 ARG 75 1HB ARG 75 15.121 16.259 -5.463
580 HB3 ARG 75 2HB ARG 75 13.708 17.276 -5.179
581 HG2 ARG 75 1HG ARG 75 13.904 16.835 -2.738
582 HG3 ARG 75 2HG ARG 75 15.387 15.925 -3.045
583 HD2 ARG 75 1HD ARG 75 16.002 18.152 -2.378
584 HD3 ARG 75 2HD ARG 75 16.367 17.981 -4.102
585 HE ARG 75 HE ARG 75 14.120 19.530 -2.902
586 HH11 ARG 75 1HH1 ARG 75 16.026 18.762 -5.799
587 HH12 ARG 75 2HH1 ARG 75 15.177 19.970 -6.746
588 HH21 ARG 75 1HH2 ARG 75 13.167 21.078 -4.196
589 HH22 ARG 75 2HH2 ARG 75 13.656 21.243 -5.868
590 H ILE 76 H ILE 76 14.195 14.459 -7.207
591 HA ILE 76 HA ILE 76 12.069 15.742 -8.718
592 HB ILE 76 HB ILE 76 13.072 14.740 -10.707
593 HG12 ILE 76 1HG1 ILE 76 14.915 13.229 -8.815
594 HG13 ILE 76 2HG1 ILE 76 13.585 12.507 -9.714
595 HG21 ILE 76 1HG2 ILE 76 15.229 15.873 -10.597
596 HG22 ILE 76 2HG2 ILE 76 14.082 16.789 -9.604
597 HG23 ILE 76 3HG2 ILE 76 15.280 15.731 -8.827
598 HD11 ILE 76 1HD1 ILE 76 15.642 12.014 -10.868
599 HD12 ILE 76 2HD1 ILE 76 14.728 13.181 -11.852
600 HD13 ILE 76 3HD1 ILE 76 16.118 13.725 -10.879
601 H ARG 77 H ARG 77 12.360 12.711 -7.125
602 HA ARG 77 HA ARG 77 10.273 11.366 -8.722
603 HB2 ARG 77 1HB ARG 77 11.947 10.731 -6.309
604 HB3 ARG 77 2HB ARG 77 10.439 9.845 -6.547
605 HG2 ARG 77 1HG ARG 77 11.176 8.877 -8.566
606 HG3 ARG 77 2HG ARG 77 12.510 10.035 -8.746
607 HD2 ARG 77 1HD ARG 77 13.165 7.690 -7.966
608 HD3 ARG 77 2HD ARG 77 13.760 9.045 -6.999
609 HE ARG 77 HE ARG 77 11.247 7.796 -6.105
610 HH11 ARG 77 1HH1 ARG 77 14.730 8.093 -5.605
611 HH12 ARG 77 2HH1 ARG 77 14.635 7.511 -3.959
612 HH21 ARG 77 1HH2 ARG 77 11.225 7.038 -4.003
613 HH22 ARG 77 2HH2 ARG 77 12.705 6.928 -3.085
614 H LEU 78 H LEU 78 10.463 13.643 -6.181
615 HA LEU 78 HA LEU 78 7.757 13.008 -5.129
616 HB2 LEU 78 1HB LEU 78 10.139 14.474 -4.206
617 HB3 LEU 78 2HB LEU 78 8.659 15.396 -4.013
618 HG LEU 78 HG LEU 78 9.306 14.193 -1.975
619 HD11 LEU 78 1HD1 LEU 78 6.713 13.122 -3.166
620 HD12 LEU 78 2HD1 LEU 78 6.926 14.742 -2.451
621 HD13 LEU 78 3HD1 LEU 78 7.111 13.291 -1.443
622 HD21 LEU 78 1HD2 LEU 78 10.323 12.189 -3.031
623 HD22 LEU 78 2HD2 LEU 78 8.703 11.633 -3.509
624 HD23 LEU 78 3HD2 LEU 78 9.125 11.775 -1.787
625 H PHE 79 H PHE 79 6.360 15.056 -4.899
626 HA PHE 79 HA PHE 79 6.505 16.578 -7.464
627 HB2 PHE 79 1HB PHE 79 4.091 15.803 -5.792
628 HB3 PHE 79 2HB PHE 79 4.052 16.775 -7.268
629 HD1 PHE 79 HD1 PHE 79 4.810 13.373 -5.913
630 HD2 PHE 79 HD2 PHE 79 4.104 15.746 -9.433
631 HE1 PHE 79 HE1 PHE 79 4.631 11.292 -7.274
632 HE2 PHE 79 HE2 PHE 79 3.921 13.673 -10.803
633 HZ PHE 79 HZ PHE 79 4.183 11.440 -9.724
634 H SER 80 H SER 80 6.050 18.774 -7.395
635 HA SER 80 HA SER 80 5.473 20.065 -4.815
636 HB2 SER 80 1HB SER 80 8.132 19.851 -5.686
637 HB3 SER 80 2HB SER 80 7.618 21.440 -6.289
638 HG SER 80 HG SER 80 7.481 22.172 -4.295
639 H ALA 81 H ALA 81 4.575 22.156 -5.273
640 HA ALA 81 HA ALA 81 4.129 22.894 -8.104
641 HB1 ALA 81 1HB ALA 81 2.306 21.269 -7.597
642 HB2 ALA 81 2HB ALA 81 1.841 22.243 -6.179
643 HB3 ALA 81 3HB ALA 81 1.668 22.916 -7.816
644 H ASP 82 H ASP 82 5.691 24.086 -6.142
645 HA ASP 82 HA ASP 82 4.362 25.941 -4.476
646 HB2 ASP 82 1HB ASP 82 7.136 26.079 -5.705
647 HB3 ASP 82 2HB ASP 82 6.589 26.977 -4.280
648 HA PRO 83 HA PRO 83 3.224 28.961 -7.489
649 HB2 PRO 83 1HB PRO 83 2.672 31.127 -5.951
650 HB3 PRO 83 2HB PRO 83 1.679 29.636 -5.856
651 HG2 PRO 83 1HG PRO 83 3.962 30.506 -4.131
652 HG3 PRO 83 2HG PRO 83 2.320 29.992 -3.638
653 HD2 PRO 83 1HD PRO 83 4.425 28.282 -3.622
654 HD3 PRO 83 2HD PRO 83 2.773 27.736 -4.083
655 H PHE 84 H PHE 84 3.852 30.993 -8.478
656 HA PHE 84 HA PHE 84 6.635 31.773 -7.817
657 HB2 PHE 84 1HB PHE 84 6.885 32.469 -10.128
658 HB3 PHE 84 2HB PHE 84 6.265 30.814 -10.105
659 HD1 PHE 84 HD1 PHE 84 5.529 34.327 -10.926
660 HD2 PHE 84 HD2 PHE 84 3.896 30.348 -10.723
661 HE1 PHE 84 HE1 PHE 84 3.580 35.062 -12.289
662 HE2 PHE 84 HE2 PHE 84 1.943 31.075 -12.084
663 HZ PHE 84 HZ PHE 84 1.775 33.439 -12.862
664 H ASP 85 H ASP 85 3.591 32.544 -7.631
665 HA ASP 85 HA ASP 85 3.862 35.492 -7.744
666 HB2 ASP 85 1HB ASP 85 1.338 35.404 -7.665
667 HB3 ASP 85 2HB ASP 85 2.068 34.699 -9.102
668 H LEU 86 H LEU 86 5.252 34.517 -5.780
669 HA LEU 86 HA LEU 86 3.922 33.944 -3.328
670 HB2 LEU 86 1HB LEU 86 6.554 35.381 -3.851
671 HB3 LEU 86 2HB LEU 86 6.053 34.741 -2.288
672 HG LEU 86 HG LEU 86 6.454 33.009 -4.753
673 HD11 LEU 86 1HD1 LEU 86 8.625 32.395 -3.772
674 HD12 LEU 86 2HD1 LEU 86 8.386 33.592 -2.477
675 HD13 LEU 86 3HD1 LEU 86 8.559 34.125 -4.166
676 HD21 LEU 86 1HD2 LEU 86 6.331 32.307 -1.792
677 HD22 LEU 86 2HD2 LEU 86 6.540 31.170 -3.149
678 HD23 LEU 86 3HD2 LEU 86 5.017 32.057 -2.961
679 H GLU 87 H GLU 87 4.816 36.995 -4.905
680 HA GLU 87 HA GLU 87 3.684 38.586 -2.690
681 HB2 GLU 87 1HB GLU 87 4.722 39.416 -5.420
682 HB3 GLU 87 2HB GLU 87 4.209 40.511 -4.127
683 HG2 GLU 87 1HG GLU 87 5.994 39.516 -2.669
684 HG3 GLU 87 2HG GLU 87 6.583 38.628 -4.088
685 H ALA 88 H ALA 88 2.835 37.434 -5.873
686 HA ALA 88 HA ALA 88 1.050 37.679 -7.251
687 HB1 ALA 88 1HB ALA 88 -0.427 37.627 -4.593
688 HB2 ALA 88 2HB ALA 88 -1.136 37.270 -6.186
689 HB3 ALA 88 3HB ALA 88 0.129 36.212 -5.525
690 H GLN 89 H GLN 89 2.239 40.290 -6.507
691 HA GLN 89 HA GLN 89 -0.184 41.997 -6.685
692 HB2 GLN 89 1HB GLN 89 1.040 43.714 -5.616
693 HB3 GLN 89 2HB GLN 89 1.268 42.251 -4.661
694 HG2 GLN 89 1HG GLN 89 3.521 41.960 -5.676
695 HG3 GLN 89 2HG GLN 89 3.283 43.433 -6.622
696 HE21 GLN 89 1HE2 GLN 89 5.178 44.038 -3.389
697 HE22 GLN 89 2HE2 GLN 89 5.325 42.763 -4.585
698 H ALA 90 H ALA 90 -0.131 43.871 -7.919
699 HA ALA 90 HA ALA 90 0.153 45.065 -9.831
700 HB1 ALA 90 1HB ALA 90 2.129 45.707 -8.360
701 HB2 ALA 90 2HB ALA 90 3.131 44.614 -9.341
702 HB3 ALA 90 3HB ALA 90 2.350 46.034 -10.089
703 H LYS 91 H LYS 91 2.336 45.069 -11.690
704 HA LYS 91 HA LYS 91 2.595 42.531 -13.032
705 HB2 LYS 91 1HB LYS 91 0.199 44.029 -13.578
706 HB3 LYS 91 2HB LYS 91 1.275 44.211 -14.970
707 HG2 LYS 91 1HG LYS 91 1.487 41.767 -15.131
708 HG3 LYS 91 2HG LYS 91 0.425 41.591 -13.722
709 HD2 LYS 91 1HD LYS 91 -1.373 42.787 -14.985
710 HD3 LYS 91 2HD LYS 91 -0.305 42.821 -16.403
711 HE2 LYS 91 1HE LYS 91 -1.840 40.951 -16.600
712 HE3 LYS 91 2HE LYS 91 -0.189 40.341 -16.350
713 HZ1 LYS 91 1HZ LYS 91 -0.729 40.053 -13.996
714 HZ2 LYS 91 2HZ LYS 91 -1.769 39.180 -14.936
715 HZ3 LYS 91 3HZ LYS 91 -2.267 40.592 -14.245
716 H ILE 92 H ILE 92 3.712 42.999 -15.188
717 HA ILE 92 HA ILE 92 4.998 45.689 -15.234
718 HB ILE 92 HB ILE 92 6.317 43.007 -15.928
719 HG12 ILE 92 1HG1 ILE 92 7.036 44.986 -13.725
720 HG13 ILE 92 2HG1 ILE 92 6.104 43.511 -13.461
721 HG21 ILE 92 1HG2 ILE 92 6.992 44.891 -17.449
722 HG22 ILE 92 2HG2 ILE 92 7.473 45.850 -16.029
723 HG23 ILE 92 3HG2 ILE 92 8.341 44.349 -16.437
724 HD11 ILE 92 1HD1 ILE 92 8.064 42.168 -14.301
725 HD12 ILE 92 2HD1 ILE 92 9.008 43.678 -14.360
726 HD13 ILE 92 3HD1 ILE 92 8.385 43.080 -12.808
727 H GLU 93 H GLU 93 4.254 46.648 -17.030
728 HA GLU 93 HA GLU 93 3.011 44.987 -19.144
729 HB2 GLU 93 1HB GLU 93 3.124 48.010 -18.793
730 HB3 GLU 93 2HB GLU 93 2.162 47.137 -19.989
731 HG2 GLU 93 1HG GLU 93 1.796 47.068 -16.966
732 HG3 GLU 93 2HG GLU 93 0.763 47.901 -18.134
733 H GLU 94 H GLU 94 3.583 45.451 -21.428
734 HA GLU 94 HA GLU 94 6.436 46.325 -21.677
735 HB2 GLU 94 1HB GLU 94 4.920 44.146 -23.149
736 HB3 GLU 94 2HB GLU 94 6.495 44.770 -23.644
737 HG2 GLU 94 1HG GLU 94 7.402 44.078 -21.413
738 HG3 GLU 94 2HG GLU 94 5.844 43.288 -21.089
739 H ASP 95 H ASP 95 6.835 47.960 -22.991
740 HA ASP 95 HA ASP 95 5.260 48.121 -25.485
741 HB2 ASP 95 1HB ASP 95 4.383 49.904 -23.929
742 HB3 ASP 95 2HB ASP 95 5.995 50.635 -23.954
743 H ILE 96 H ILE 96 7.201 46.822 -25.904
744 HA ILE 96 HA ILE 96 9.794 48.122 -25.910
745 HB ILE 96 HB ILE 96 10.543 46.023 -27.041
746 HG12 ILE 96 1HG1 ILE 96 7.616 45.168 -26.898
747 HG13 ILE 96 2HG1 ILE 96 8.396 45.734 -28.375
748 HG21 ILE 96 1HG2 ILE 96 10.247 46.173 -24.516
749 HG22 ILE 96 2HG2 ILE 96 8.657 45.399 -24.702
750 HG23 ILE 96 3HG2 ILE 96 10.131 44.524 -25.156
751 HD11 ILE 96 1HD1 ILE 96 10.039 43.834 -28.181
752 HD12 ILE 96 2HD1 ILE 96 9.092 43.226 -26.797
753 HD13 ILE 96 3HD1 ILE 96 8.350 43.322 -28.407
754 H ARG 97 H ARG 97 7.555 49.329 -27.491
755 HA ARG 97 HA ARG 97 8.276 48.903 -30.306
756 HB2 ARG 97 1HB ARG 97 6.004 49.387 -29.059
757 HB3 ARG 97 2HB ARG 97 6.432 51.072 -29.322
758 HG2 ARG 97 1HG ARG 97 6.515 50.669 -31.759
759 HG3 ARG 97 2HG ARG 97 6.169 48.947 -31.485
760 HD2 ARG 97 1HD ARG 97 4.350 51.289 -30.798
761 HD3 ARG 97 2HD ARG 97 4.114 50.118 -32.115
762 HE ARG 97 HE ARG 97 4.359 48.785 -29.574
763 HH11 ARG 97 1HH1 ARG 97 2.011 50.674 -31.408
764 HH12 ARG 97 2HH1 ARG 97 0.656 49.960 -30.576
765 HH21 ARG 97 1HH2 ARG 97 2.603 47.925 -28.563
766 HH22 ARG 97 2HH2 ARG 97 0.990 48.420 -28.992
767 H GLN 98 H GLN 98 10.441 49.863 -28.896
768 HA GLN 98 HA GLN 98 12.161 51.330 -28.988
769 HB2 GLN 98 1HB GLN 98 11.775 51.014 -31.472
770 HB3 GLN 98 2HB GLN 98 10.879 52.533 -31.481
771 HG2 GLN 98 1HG GLN 98 12.914 53.710 -30.562
772 HG3 GLN 98 2HG GLN 98 13.803 52.186 -30.621
773 HE21 GLN 98 1HE2 GLN 98 13.728 54.511 -33.807
774 HE22 GLN 98 2HE2 GLN 98 13.409 55.012 -32.164
775 HXT GLN 98 HO GLN 98 9.397 53.071 -29.640
Start of MODEL 12
1 H1 SER 1 1H SER 1 33.637 46.271 -18.236
2 H2 SER 1 2H SER 1 32.313 46.792 -17.546
3 H3 SER 1 3H SER 1 32.457 46.680 -19.172
4 HA SER 1 HA SER 1 32.192 44.291 -17.488
5 HB2 SER 1 1HB SER 1 29.887 45.750 -18.831
6 HB3 SER 1 2HB SER 1 29.819 44.497 -17.563
7 HG SER 1 HG SER 1 29.521 46.574 -16.635
8 H GLN 2 H GLN 2 31.534 42.438 -18.521
9 HA GLN 2 HA GLN 2 32.127 42.369 -21.422
10 HB2 GLN 2 1HB GLN 2 31.426 40.192 -19.412
11 HB3 GLN 2 2HB GLN 2 31.775 39.906 -21.123
12 HG2 GLN 2 1HG GLN 2 34.042 40.843 -20.816
13 HG3 GLN 2 2HG GLN 2 33.704 41.094 -19.097
14 HE21 GLN 2 1HE2 GLN 2 35.071 37.567 -20.351
15 HE22 GLN 2 2HE2 GLN 2 35.052 39.015 -21.328
16 H GLN 3 H GLN 3 30.555 41.995 -22.987
17 HA GLN 3 HA GLN 3 27.868 42.741 -22.286
18 HB2 GLN 3 1HB GLN 3 27.336 42.416 -24.612
19 HB3 GLN 3 2HB GLN 3 28.895 43.229 -24.488
20 HG2 GLN 3 1HG GLN 3 29.663 41.726 -25.949
21 HG3 GLN 3 2HG GLN 3 29.607 40.536 -24.645
22 HE21 GLN 3 1HE2 GLN 3 27.440 39.883 -27.858
23 HE22 GLN 3 2HE2 GLN 3 28.890 40.853 -27.748
24 H SER 4 H SER 4 26.004 41.507 -22.204
25 HA SER 4 HA SER 4 26.006 38.617 -22.478
26 HB2 SER 4 1HB SER 4 25.449 38.245 -20.043
27 HB3 SER 4 2HB SER 4 27.138 38.722 -20.309
28 HG SER 4 HG SER 4 26.700 40.748 -19.606
29 H HIS 5 H HIS 5 23.714 37.966 -21.373
30 HA HIS 5 HA HIS 5 21.796 40.167 -22.021
31 HB2 HIS 5 1HB HIS 5 21.438 37.167 -22.385
32 HB3 HIS 5 2HB HIS 5 20.237 38.412 -22.745
33 HD1 HIS 5 HD1 HIS 5 23.101 36.601 -24.246
34 HD2 HIS 5 HD2 HIS 5 20.982 40.116 -24.960
35 HE1 HIS 5 HE1 HIS 5 23.679 37.346 -26.592
36 H SER 6 H SER 6 19.986 40.334 -20.628
37 HA SER 6 HA SER 6 20.452 39.605 -17.905
38 HB2 SER 6 1HB SER 6 17.825 40.398 -19.223
39 HB3 SER 6 2HB SER 6 18.246 40.546 -17.503
40 HG SER 6 HG SER 6 18.583 42.530 -18.449
41 H SER 7 H SER 7 19.489 38.032 -16.609
42 HA SER 7 HA SER 7 18.006 35.873 -18.056
43 HB2 SER 7 1HB SER 7 20.275 35.185 -17.381
44 HB3 SER 7 2HB SER 7 19.910 35.627 -15.701
45 HG SER 7 HG SER 7 18.340 34.031 -15.651
46 HA PRO 8 HA PRO 8 15.339 37.492 -14.688
47 HB2 PRO 8 1HB PRO 8 12.941 37.399 -15.963
48 HB3 PRO 8 2HB PRO 8 14.113 38.717 -16.283
49 HG2 PRO 8 1HG PRO 8 13.665 36.173 -17.829
50 HG3 PRO 8 2HG PRO 8 13.692 37.863 -18.429
51 HD2 PRO 8 1HD PRO 8 15.868 36.260 -18.573
52 HD3 PRO 8 2HD PRO 8 16.017 38.018 -18.228
53 H GLY 9 H GLY 9 13.322 36.432 -13.698
54 HA2 GLY 9 1HA GLY 9 12.006 34.498 -13.302
55 HA3 GLY 9 2HA GLY 9 13.078 33.554 -14.346
56 H GLU 10 H GLU 10 14.339 35.679 -11.879
57 HA GLU 10 HA GLU 10 15.681 33.487 -10.540
58 HB2 GLU 10 1HB GLU 10 15.531 36.458 -9.929
59 HB3 GLU 10 2HB GLU 10 16.624 35.309 -9.134
60 HG2 GLU 10 1HG GLU 10 17.695 34.811 -11.300
61 HG3 GLU 10 2HG GLU 10 16.606 35.949 -12.111
62 H ILE 11 H ILE 11 12.732 33.533 -10.426
63 HA ILE 11 HA ILE 11 12.105 33.679 -7.613
64 HB ILE 11 HB ILE 11 10.400 32.773 -9.986
65 HG12 ILE 11 1HG1 ILE 11 10.952 35.673 -9.186
66 HG13 ILE 11 2HG1 ILE 11 11.408 34.920 -10.716
67 HG21 ILE 11 1HG2 ILE 11 8.628 33.502 -8.697
68 HG22 ILE 11 2HG2 ILE 11 9.716 32.621 -7.623
69 HG23 ILE 11 3HG2 ILE 11 9.708 34.385 -7.600
70 HD11 ILE 11 1HD1 ILE 11 9.495 36.277 -11.150
71 HD12 ILE 11 2HD1 ILE 11 8.952 34.585 -11.219
72 HD13 ILE 11 3HD1 ILE 11 8.596 35.584 -9.786
73 H THR 12 H THR 12 14.188 31.926 -8.745
74 HA THR 12 HA THR 12 13.051 29.236 -8.202
75 HB THR 12 HB THR 12 14.334 28.338 -10.183
76 HG1 THR 12 HG1 THR 12 14.417 30.988 -11.181
77 HG21 THR 12 1HG2 THR 12 12.774 28.986 -11.917
78 HG22 THR 12 2HG2 THR 12 12.309 30.447 -11.022
79 HG23 THR 12 3HG2 THR 12 11.887 28.843 -10.381
80 H SER 13 H SER 13 14.976 27.637 -8.150
81 HA SER 13 HA SER 13 16.922 28.605 -6.267
82 HB2 SER 13 1HB SER 13 16.988 26.045 -7.903
83 HB3 SER 13 2HB SER 13 17.776 26.346 -6.338
84 HG SER 13 HG SER 13 15.535 26.747 -5.569
85 H SER 14 H SER 14 19.326 28.133 -6.636
86 HA SER 14 HA SER 14 20.159 29.346 -9.219
87 HB2 SER 14 1HB SER 14 22.235 29.880 -7.822
88 HB3 SER 14 2HB SER 14 20.729 30.714 -7.386
89 HG SER 14 HG SER 14 21.488 29.941 -5.490
90 HA PRO 15 HA PRO 15 21.994 25.117 -9.350
91 HB2 PRO 15 1HB PRO 15 21.604 24.567 -12.002
92 HB3 PRO 15 2HB PRO 15 20.348 24.263 -10.758
93 HG2 PRO 15 1HG PRO 15 20.649 26.632 -12.587
94 HG3 PRO 15 2HG PRO 15 19.203 25.617 -12.285
95 HD2 PRO 15 1HD PRO 15 19.556 27.971 -11.011
96 HD3 PRO 15 2HD PRO 15 18.846 26.557 -10.157
97 H GLN 16 H GLN 16 22.242 27.975 -11.440
98 HA GLN 16 HA GLN 16 24.893 27.283 -12.409
99 HB2 GLN 16 1HB GLN 16 23.539 30.003 -12.272
100 HB3 GLN 16 2HB GLN 16 24.967 29.581 -13.227
101 HG2 GLN 16 1HG GLN 16 22.134 28.586 -13.591
102 HG3 GLN 16 2HG GLN 16 23.063 29.616 -14.690
103 HE21 GLN 16 1HE2 GLN 16 25.180 26.796 -15.716
104 HE22 GLN 16 2HE2 GLN 16 25.368 28.444 -15.173
105 H GLY 17 H GLY 17 23.628 28.427 -9.429
106 HA2 GLY 17 1HA GLY 17 26.040 29.857 -8.616
107 HA3 GLY 17 2HA GLY 17 24.680 29.357 -7.581
108 H LEU 18 H LEU 18 24.923 26.581 -8.866
109 HA LEU 18 HA LEU 18 26.807 25.519 -6.882
110 HB2 LEU 18 1HB LEU 18 25.435 24.080 -9.176
111 HB3 LEU 18 2HB LEU 18 26.228 23.330 -7.803
112 HG LEU 18 HG LEU 18 23.713 25.016 -7.680
113 HD11 LEU 18 1HD1 LEU 18 22.577 22.870 -7.257
114 HD12 LEU 18 2HD1 LEU 18 24.119 22.008 -7.470
115 HD13 LEU 18 3HD1 LEU 18 23.383 22.875 -8.838
116 HD21 LEU 18 1HD2 LEU 18 23.523 24.109 -5.356
117 HD22 LEU 18 2HD2 LEU 18 24.936 25.158 -5.564
118 HD23 LEU 18 3HD2 LEU 18 25.144 23.390 -5.529
119 H ASP 19 H ASP 19 26.658 26.034 -10.366
120 HA ASP 19 HA ASP 19 29.179 24.736 -10.961
121 HB2 ASP 19 1HB ASP 19 27.169 25.136 -12.504
122 HB3 ASP 19 2HB ASP 19 27.691 26.824 -12.593
123 H ASN 20 H ASN 20 28.039 27.988 -10.256
124 HA ASN 20 HA ASN 20 30.865 28.943 -10.165
125 HB2 ASN 20 1HB ASN 20 28.262 30.442 -10.686
126 HB3 ASN 20 2HB ASN 20 29.827 31.198 -10.437
127 HD21 ASN 20 1HD2 ASN 20 30.965 30.740 -13.659
128 HD22 ASN 20 2HD2 ASN 20 31.351 31.205 -12.025
129 HA PRO 21 HA PRO 21 29.301 29.041 -5.799
130 HB2 PRO 21 1HB PRO 21 31.891 28.837 -4.762
131 HB3 PRO 21 2HB PRO 21 30.829 27.452 -5.068
132 HG2 PRO 21 1HG PRO 21 32.970 28.575 -6.747
133 HG3 PRO 21 2HG PRO 21 32.625 26.878 -6.367
134 HD2 PRO 21 1HD PRO 21 31.938 27.889 -8.703
135 HD3 PRO 21 2HD PRO 21 30.831 26.773 -7.828
136 H ALA 22 H ALA 22 31.841 30.676 -7.633
137 HA ALA 22 HA ALA 22 32.394 32.772 -5.797
138 HB1 ALA 22 1HB ALA 22 33.216 33.990 -7.783
139 HB2 ALA 22 2HB ALA 22 33.788 32.304 -7.766
140 HB3 ALA 22 3HB ALA 22 32.449 32.786 -8.842
141 H LEU 23 H LEU 23 29.847 32.402 -8.258
142 HA LEU 23 HA LEU 23 28.838 35.108 -7.856
143 HB2 LEU 23 1HB LEU 23 27.565 32.700 -9.210
144 HB3 LEU 23 2HB LEU 23 26.988 34.360 -9.298
145 HG LEU 23 HG LEU 23 29.569 33.292 -10.478
146 HD11 LEU 23 1HD1 LEU 23 27.009 34.284 -11.795
147 HD12 LEU 23 2HD1 LEU 23 27.485 32.577 -11.628
148 HD13 LEU 23 3HD1 LEU 23 28.458 33.674 -12.628
149 HD21 LEU 23 1HD2 LEU 23 28.391 36.076 -10.639
150 HD22 LEU 23 2HD2 LEU 23 29.772 35.467 -11.589
151 HD23 LEU 23 3HD2 LEU 23 29.901 35.605 -9.824
152 H LEU 24 H LEU 24 27.965 31.805 -6.782
153 HA LEU 24 HA LEU 24 25.507 32.616 -5.553
154 HB2 LEU 24 1HB LEU 24 26.084 30.288 -6.094
155 HB3 LEU 24 2HB LEU 24 27.340 30.290 -4.871
156 HG LEU 24 HG LEU 24 25.745 30.384 -3.103
157 HD11 LEU 24 1HD1 LEU 24 23.268 30.386 -3.527
158 HD12 LEU 24 2HD1 LEU 24 23.614 30.818 -5.223
159 HD13 LEU 24 3HD1 LEU 24 24.071 31.918 -3.895
160 HD21 LEU 24 1HD2 LEU 24 24.543 28.311 -3.426
161 HD22 LEU 24 2HD2 LEU 24 26.141 28.194 -4.197
162 HD23 LEU 24 3HD2 LEU 24 24.688 28.460 -5.192
163 H ARG 25 H ARG 25 28.847 32.364 -4.339
164 HA ARG 25 HA ARG 25 28.364 32.991 -1.617
165 HB2 ARG 25 1HB ARG 25 30.494 32.197 -2.460
166 HB3 ARG 25 2HB ARG 25 30.650 33.553 -3.542
167 HG2 ARG 25 1HG ARG 25 30.592 33.998 -0.563
168 HG3 ARG 25 2HG ARG 25 32.061 33.419 -1.351
169 HD2 ARG 25 1HD ARG 25 30.604 36.019 -1.855
170 HD3 ARG 25 2HD ARG 25 32.201 35.811 -1.146
171 HE ARG 25 HE ARG 25 31.494 35.270 -4.005
172 HH11 ARG 25 1HH1 ARG 25 33.898 36.298 -1.618
173 HH12 ARG 25 2HH1 ARG 25 35.051 36.731 -2.851
174 HH21 ARG 25 1HH2 ARG 25 32.983 35.851 -5.489
175 HH22 ARG 25 2HH2 ARG 25 34.545 36.467 -5.014
176 H ASP 26 H ASP 26 28.827 35.037 -4.486
177 HA ASP 26 HA ASP 26 28.824 37.525 -3.100
178 HB2 ASP 26 1HB ASP 26 29.370 36.696 -5.615
179 HB3 ASP 26 2HB ASP 26 27.767 37.374 -5.886
180 H MET 27 H MET 27 26.215 35.745 -4.810
181 HA MET 27 HA MET 27 24.102 37.608 -4.348
182 HB2 MET 27 1HB MET 27 24.086 35.566 -5.859
183 HB3 MET 27 2HB MET 27 23.909 34.582 -4.404
184 HG2 MET 27 1HG MET 27 21.810 35.883 -3.883
185 HG3 MET 27 2HG MET 27 21.967 36.624 -5.482
186 HE1 MET 27 1HE MET 27 22.089 33.058 -3.678
187 HE2 MET 27 2HE MET 27 20.479 33.769 -3.445
188 HE3 MET 27 3HE MET 27 20.669 32.316 -4.446
189 H LEU 28 H LEU 28 25.234 34.818 -2.436
190 HA LEU 28 HA LEU 28 23.214 34.911 -0.468
191 HB2 LEU 28 1HB LEU 28 25.957 33.813 -0.706
192 HB3 LEU 28 2HB LEU 28 25.243 33.914 0.900
193 HG LEU 28 HG LEU 28 23.701 32.670 -1.359
194 HD11 LEU 28 1HD1 LEU 28 25.877 31.605 -1.276
195 HD12 LEU 28 2HD1 LEU 28 24.602 30.524 -0.680
196 HD13 LEU 28 3HD1 LEU 28 25.696 31.336 0.468
197 HD21 LEU 28 1HD2 LEU 28 23.740 32.236 1.650
198 HD22 LEU 28 2HD2 LEU 28 22.595 31.527 0.484
199 HD23 LEU 28 3HD2 LEU 28 22.599 33.269 0.785
200 H LEU 29 H LEU 29 26.424 36.491 -0.594
201 HA LEU 29 HA LEU 29 26.239 37.584 2.065
202 HB2 LEU 29 1HB LEU 29 27.788 38.436 -0.392
203 HB3 LEU 29 2HB LEU 29 27.945 39.249 1.163
204 HG LEU 29 HG LEU 29 28.493 36.295 0.795
205 HD11 LEU 29 1HD1 LEU 29 30.444 38.609 0.720
206 HD12 LEU 29 2HD1 LEU 29 29.941 37.609 -0.667
207 HD13 LEU 29 3HD1 LEU 29 30.853 36.875 0.670
208 HD21 LEU 29 1HD2 LEU 29 28.088 36.946 3.117
209 HD22 LEU 29 2HD2 LEU 29 29.290 38.249 2.978
210 HD23 LEU 29 3HD2 LEU 29 29.798 36.545 2.871
211 H ALA 30 H ALA 30 25.154 38.703 -1.100
212 HA ALA 30 HA ALA 30 24.329 41.311 -0.083
213 HB1 ALA 30 1HB ALA 30 23.446 41.628 -2.361
214 HB2 ALA 30 2HB ALA 30 25.104 40.982 -2.416
215 HB3 ALA 30 3HB ALA 30 23.720 39.905 -2.721
216 H ASN 31 H ASN 31 22.953 38.184 0.172
217 HA ASN 31 HA ASN 31 20.206 39.379 0.234
218 HB2 ASN 31 1HB ASN 31 20.716 37.666 -1.534
219 HB3 ASN 31 2HB ASN 31 20.893 36.475 -0.239
220 HD21 ASN 31 1HD2 ASN 31 17.380 36.830 -1.736
221 HD22 ASN 31 2HD2 ASN 31 18.952 36.907 -2.500
222 HA PRO 32 HA PRO 32 21.052 38.386 4.531
223 HB2 PRO 32 1HB PRO 32 18.942 39.737 5.654
224 HB3 PRO 32 2HB PRO 32 20.459 40.530 5.116
225 HG2 PRO 32 1HG PRO 32 17.862 40.236 3.615
226 HG3 PRO 32 2HG PRO 32 18.828 41.717 3.919
227 HD2 PRO 32 1HD PRO 32 19.055 40.415 1.611
228 HD3 PRO 32 2HD PRO 32 20.521 41.061 2.431
229 H HIS 33 H HIS 33 18.009 37.817 2.785
230 HA HIS 33 HA HIS 33 16.905 36.112 4.881
231 HB2 HIS 33 1HB HIS 33 15.538 37.347 3.165
232 HB3 HIS 33 2HB HIS 33 16.194 36.275 1.923
233 HD1 HIS 33 HD1 HIS 33 13.314 35.995 1.905
234 HD2 HIS 33 HD2 HIS 33 15.578 33.998 4.786
235 HE1 HIS 33 HE1 HIS 33 11.884 34.109 2.794
236 H GLU 34 H GLU 34 18.614 35.654 1.773
237 HA GLU 34 HA GLU 34 18.355 32.787 1.800
238 HB2 GLU 34 1HB GLU 34 19.335 34.790 0.068
239 HB3 GLU 34 2HB GLU 34 20.671 33.694 0.324
240 HG2 GLU 34 1HG GLU 34 17.941 32.673 -0.408
241 HG3 GLU 34 2HG GLU 34 19.032 33.302 -1.644
242 H LEU 35 H LEU 35 20.857 35.091 2.888
243 HA LEU 35 HA LEU 35 22.711 33.050 3.625
244 HB2 LEU 35 1HB LEU 35 24.027 34.683 4.301
245 HB3 LEU 35 2HB LEU 35 22.963 35.482 3.202
246 HG LEU 35 HG LEU 35 21.824 36.608 5.006
247 HD11 LEU 35 1HD1 LEU 35 22.047 35.353 6.958
248 HD12 LEU 35 2HD1 LEU 35 23.105 36.746 7.204
249 HD13 LEU 35 3HD1 LEU 35 23.804 35.167 6.754
250 HD21 LEU 35 1HD2 LEU 35 24.837 36.759 4.841
251 HD22 LEU 35 2HD2 LEU 35 23.775 38.083 5.394
252 HD23 LEU 35 3HD2 LEU 35 23.676 37.497 3.719
253 H SER 36 H SER 36 19.915 34.375 5.245
254 HA SER 36 HA SER 36 20.623 33.358 7.857
255 HB2 SER 36 1HB SER 36 18.535 34.162 8.635
256 HB3 SER 36 2HB SER 36 19.174 35.375 7.515
257 HG SER 36 HG SER 36 17.782 34.239 5.896
258 H LEU 37 H LEU 37 18.618 32.244 5.134
259 HA LEU 37 HA LEU 37 17.572 29.998 6.646
260 HB2 LEU 37 1HB LEU 37 16.565 29.342 4.718
261 HB3 LEU 37 2HB LEU 37 16.655 31.053 4.630
262 HG LEU 37 HG LEU 37 18.411 30.858 2.905
263 HD11 LEU 37 1HD1 LEU 37 17.396 28.019 2.856
264 HD12 LEU 37 2HD1 LEU 37 19.059 28.549 3.187
265 HD13 LEU 37 3HD1 LEU 37 18.371 28.800 1.583
266 HD21 LEU 37 1HD2 LEU 37 15.623 29.791 2.387
267 HD22 LEU 37 2HD2 LEU 37 16.713 30.503 1.170
268 HD23 LEU 37 3HD2 LEU 37 16.089 31.505 2.495
269 H LEU 38 H LEU 38 20.311 30.750 4.615
270 HA LEU 38 HA LEU 38 21.198 28.104 4.296
271 HB2 LEU 38 1HB LEU 38 21.910 30.101 3.067
272 HB3 LEU 38 2HB LEU 38 22.840 30.632 4.484
273 HG LEU 38 HG LEU 38 24.132 28.483 4.416
274 HD11 LEU 38 1HD1 LEU 38 22.590 27.116 3.171
275 HD12 LEU 38 2HD1 LEU 38 24.113 27.227 2.286
276 HD13 LEU 38 3HD1 LEU 38 22.713 28.188 1.758
277 HD21 LEU 38 1HD2 LEU 38 24.376 30.076 1.875
278 HD22 LEU 38 2HD2 LEU 38 25.643 29.133 2.684
279 HD23 LEU 38 3HD2 LEU 38 25.001 30.598 3.454
280 H LYS 39 H LYS 39 22.007 30.451 6.888
281 HA LYS 39 HA LYS 39 23.728 28.544 8.228
282 HB2 LYS 39 1HB LYS 39 23.301 29.968 10.293
283 HB3 LYS 39 2HB LYS 39 24.126 30.705 8.919
284 HG2 LYS 39 1HG LYS 39 22.100 31.842 8.259
285 HG3 LYS 39 2HG LYS 39 21.173 31.060 9.501
286 HD2 LYS 39 1HD LYS 39 21.639 33.222 10.312
287 HD3 LYS 39 2HD LYS 39 22.772 32.162 11.176
288 HE2 LYS 39 1HE LYS 39 24.563 32.767 9.587
289 HE3 LYS 39 2HE LYS 39 23.420 33.754 8.656
290 HZ1 LYS 39 1HZ LYS 39 24.217 34.258 11.463
291 HZ2 LYS 39 2HZ LYS 39 23.156 35.173 10.591
292 HZ3 LYS 39 3HZ LYS 39 24.744 35.104 10.149
293 H GLU 40 H GLU 40 20.251 28.870 8.158
294 HA GLU 40 HA GLU 40 19.910 27.137 10.494
295 HB2 GLU 40 1HB GLU 40 18.289 28.919 9.749
296 HB3 GLU 40 2HB GLU 40 17.913 27.937 8.335
297 HG2 GLU 40 1HG GLU 40 17.681 26.401 10.818
298 HG3 GLU 40 2HG GLU 40 16.675 27.857 10.851
299 H ARG 41 H ARG 41 19.382 26.817 6.942
300 HA ARG 41 HA ARG 41 18.806 23.970 7.140
301 HB2 ARG 41 1HB ARG 41 19.543 25.687 4.738
302 HB3 ARG 41 2HB ARG 41 18.855 24.064 4.655
303 HG2 ARG 41 1HG ARG 41 17.420 26.385 5.996
304 HG3 ARG 41 2HG ARG 41 17.267 26.028 4.274
305 HD2 ARG 41 1HD ARG 41 15.906 24.267 4.627
306 HD3 ARG 41 2HD ARG 41 16.836 23.693 6.030
307 HE ARG 41 HE ARG 41 15.733 25.802 7.174
308 HH11 ARG 41 1HH1 ARG 41 14.078 23.584 4.960
309 HH12 ARG 41 2HH1 ARG 41 12.533 23.885 5.703
310 HH21 ARG 41 1HH2 ARG 41 13.812 26.120 8.033
311 HH22 ARG 41 2HH2 ARG 41 12.375 25.318 7.426
312 H ASN 42 H ASN 42 21.756 25.788 6.354
313 HA ASN 42 HA ASN 42 23.252 23.208 6.287
314 HB2 ASN 42 1HB ASN 42 22.665 24.094 3.947
315 HB3 ASN 42 2HB ASN 42 23.765 25.407 4.262
316 HD21 ASN 42 1HD2 ASN 42 25.626 22.752 2.507
317 HD22 ASN 42 2HD2 ASN 42 24.273 23.770 2.159
318 HA PRO 43 HA PRO 43 25.193 26.628 8.756
319 HB2 PRO 43 1HB PRO 43 26.240 24.944 10.742
320 HB3 PRO 43 2HB PRO 43 24.721 25.889 10.830
321 HG2 PRO 43 1HG PRO 43 25.117 23.010 10.101
322 HG3 PRO 43 2HG PRO 43 23.867 23.762 11.134
323 HD2 PRO 43 1HD PRO 43 23.343 23.039 8.604
324 HD3 PRO 43 2HD PRO 43 22.657 24.550 9.299
325 HA PRO 44 HA PRO 44 29.373 24.715 8.170
326 HB2 PRO 44 1HB PRO 44 29.846 22.681 6.422
327 HB3 PRO 44 2HB PRO 44 29.521 22.419 8.166
328 HG2 PRO 44 1HG PRO 44 27.620 22.307 5.867
329 HG3 PRO 44 2HG PRO 44 27.920 21.084 7.138
330 HD2 PRO 44 1HD PRO 44 25.865 22.796 7.335
331 HD3 PRO 44 2HD PRO 44 26.838 22.370 8.783
332 H LEU 45 H LEU 45 27.124 24.647 5.286
333 HA LEU 45 HA LEU 45 29.190 25.813 3.580
334 HB2 LEU 45 1HB LEU 45 27.141 24.708 2.689
335 HB3 LEU 45 2HB LEU 45 26.182 26.041 3.301
336 HG LEU 45 HG LEU 45 27.274 27.588 1.770
337 HD11 LEU 45 1HD1 LEU 45 28.860 26.773 0.012
338 HD12 LEU 45 2HD1 LEU 45 28.953 25.209 0.848
339 HD13 LEU 45 3HD1 LEU 45 29.550 26.689 1.638
340 HD21 LEU 45 1HD2 LEU 45 26.372 26.763 -0.297
341 HD22 LEU 45 2HD2 LEU 45 25.346 26.148 1.008
342 HD23 LEU 45 3HD2 LEU 45 26.528 25.072 0.236
343 H ALA 46 H ALA 46 26.646 26.922 5.752
344 HA ALA 46 HA ALA 46 26.809 29.672 5.083
345 HB1 ALA 46 1HB ALA 46 26.192 28.522 7.802
346 HB2 ALA 46 2HB ALA 46 25.681 30.088 7.135
347 HB3 ALA 46 3HB ALA 46 25.047 28.578 6.444
348 H GLU 47 H GLU 47 28.628 27.897 7.705
349 HA GLU 47 HA GLU 47 29.895 30.278 8.642
350 HB2 GLU 47 1HB GLU 47 31.488 28.872 9.769
351 HB3 GLU 47 2HB GLU 47 29.860 28.205 9.937
352 HG2 GLU 47 1HG GLU 47 30.347 26.556 8.207
353 HG3 GLU 47 2HG GLU 47 31.975 27.213 8.006
354 H ALA 48 H ALA 48 30.691 28.154 5.959
355 HA ALA 48 HA ALA 48 33.258 29.209 5.401
356 HB1 ALA 48 1HB ALA 48 32.247 27.072 4.509
357 HB2 ALA 48 2HB ALA 48 31.229 28.072 3.450
358 HB3 ALA 48 3HB ALA 48 32.985 28.107 3.278
359 H LEU 49 H LEU 49 29.964 30.165 4.445
360 HA LEU 49 HA LEU 49 30.748 32.263 2.637
361 HB2 LEU 49 1HB LEU 49 28.470 31.227 2.762
362 HB3 LEU 49 2HB LEU 49 28.258 31.948 4.347
363 HG LEU 49 HG LEU 49 28.661 34.216 3.139
364 HD11 LEU 49 1HD1 LEU 49 29.349 33.229 1.005
365 HD12 LEU 49 2HD1 LEU 49 27.884 34.207 0.819
366 HD13 LEU 49 3HD1 LEU 49 27.768 32.437 0.852
367 HD21 LEU 49 1HD2 LEU 49 26.103 32.638 2.740
368 HD22 LEU 49 2HD2 LEU 49 26.274 34.410 2.773
369 HD23 LEU 49 3HD2 LEU 49 26.583 33.465 4.241
370 H LEU 50 H LEU 50 29.997 32.140 6.136
371 HA LEU 50 HA LEU 50 29.943 34.956 6.554
372 HB2 LEU 50 1HB LEU 50 30.897 32.915 8.582
373 HB3 LEU 50 2HB LEU 50 30.210 34.495 8.902
374 HG LEU 50 HG LEU 50 28.836 31.972 8.102
375 HD11 LEU 50 1HD1 LEU 50 29.287 32.307 10.425
376 HD12 LEU 50 2HD1 LEU 50 27.548 32.329 10.089
377 HD13 LEU 50 3HD1 LEU 50 28.415 33.862 10.384
378 HD21 LEU 50 1HD2 LEU 50 27.624 34.725 7.953
379 HD22 LEU 50 2HD2 LEU 50 26.687 33.208 8.010
380 HD23 LEU 50 3HD2 LEU 50 27.774 33.514 6.648
381 H SER 51 H SER 51 32.598 32.713 6.261
382 HA SER 51 HA SER 51 34.576 34.382 7.521
383 HB2 SER 51 1HB SER 51 34.814 32.115 5.536
384 HB3 SER 51 2HB SER 51 36.110 32.763 6.543
385 HG SER 51 HG SER 51 33.707 31.554 7.501
386 H GLY 52 H GLY 52 33.103 34.298 4.336
387 HA2 GLY 52 1HA GLY 52 33.401 35.920 2.667
388 HA3 GLY 52 2HA GLY 52 34.852 36.514 3.489
389 H ASP 53 H ASP 53 35.938 33.773 3.717
390 HA ASP 53 HA ASP 53 37.584 33.582 1.459
391 HB2 ASP 53 1HB ASP 53 36.785 31.797 3.670
392 HB3 ASP 53 2HB ASP 53 37.844 31.220 2.389
393 H LEU 54 H LEU 54 36.667 33.489 -0.540
394 HA LEU 54 HA LEU 54 34.416 31.867 -1.202
395 HB2 LEU 54 1HB LEU 54 35.307 33.665 -2.638
396 HB3 LEU 54 2HB LEU 54 36.750 32.717 -2.950
397 HG LEU 54 HG LEU 54 34.872 32.852 -4.698
398 HD11 LEU 54 1HD1 LEU 54 36.873 31.423 -4.907
399 HD12 LEU 54 2HD1 LEU 54 35.427 30.738 -5.675
400 HD13 LEU 54 3HD1 LEU 54 35.977 30.110 -4.111
401 HD21 LEU 54 1HD2 LEU 54 33.675 30.618 -3.063
402 HD22 LEU 54 2HD2 LEU 54 33.179 31.117 -4.673
403 HD23 LEU 54 3HD2 LEU 54 32.972 32.225 -3.309
404 H GLU 55 H GLU 55 37.907 31.213 -0.963
405 HA GLU 55 HA GLU 55 37.863 28.736 -2.278
406 HB2 GLU 55 1HB GLU 55 39.890 28.171 -1.148
407 HB3 GLU 55 2HB GLU 55 39.913 29.800 -1.811
408 HG2 GLU 55 1HG GLU 55 40.618 30.496 0.091
409 HG3 GLU 55 2HG GLU 55 39.059 30.119 0.811
410 H LYS 56 H LYS 56 37.283 29.361 1.229
411 HA LYS 56 HA LYS 56 36.766 26.555 1.670
412 HB2 LYS 56 1HB LYS 56 36.064 27.102 3.895
413 HB3 LYS 56 2HB LYS 56 37.541 28.028 3.465
414 HG2 LYS 56 1HG LYS 56 36.035 29.922 3.065
415 HG3 LYS 56 2HG LYS 56 34.785 29.004 3.865
416 HD2 LYS 56 1HD LYS 56 37.533 29.442 5.093
417 HD3 LYS 56 2HD LYS 56 36.216 30.575 5.316
418 HE2 LYS 56 1HE LYS 56 34.828 28.743 6.304
419 HE3 LYS 56 2HE LYS 56 36.254 27.686 6.221
420 HZ1 LYS 56 1HZ LYS 56 36.083 28.716 8.383
421 HZ2 LYS 56 2HZ LYS 56 36.017 30.231 7.730
422 HZ3 LYS 56 3HZ LYS 56 37.406 29.346 7.617
423 H PHE 57 H PHE 57 34.750 29.355 0.846
424 HA PHE 57 HA PHE 57 32.246 28.048 1.245
425 HB2 PHE 57 1HB PHE 57 32.454 30.456 0.781
426 HB3 PHE 57 2HB PHE 57 33.007 30.094 -0.857
427 HD1 PHE 57 HD1 PHE 57 30.096 29.899 1.444
428 HD2 PHE 57 HD2 PHE 57 31.472 29.539 -2.618
429 HE1 PHE 57 HE1 PHE 57 27.738 29.838 0.653
430 HE2 PHE 57 HE2 PHE 57 29.116 29.472 -3.413
431 HZ PHE 57 HZ PHE 57 27.248 29.619 -1.782
432 H SER 58 H SER 58 34.286 28.233 -1.720
433 HA SER 58 HA SER 58 32.691 26.447 -3.261
434 HB2 SER 58 1HB SER 58 34.435 27.982 -4.153
435 HB3 SER 58 2HB SER 58 35.685 26.980 -3.388
436 HG SER 58 HG SER 58 35.497 26.291 -5.480
437 H ARG 59 H ARG 59 35.453 25.840 -1.060
438 HA ARG 59 HA ARG 59 35.854 23.100 -1.724
439 HB2 ARG 59 1HB ARG 59 37.357 24.588 -0.376
440 HB3 ARG 59 2HB ARG 59 36.180 24.542 0.932
441 HG2 ARG 59 1HG ARG 59 36.567 21.925 0.726
442 HG3 ARG 59 2HG ARG 59 38.094 22.449 -0.013
443 HD2 ARG 59 1HD ARG 59 37.007 23.244 2.710
444 HD3 ARG 59 2HD ARG 59 38.341 22.119 2.403
445 HE ARG 59 HE ARG 59 38.784 24.802 1.319
446 HH11 ARG 59 1HH1 ARG 59 39.169 22.775 4.187
447 HH12 ARG 59 2HH1 ARG 59 40.409 23.800 4.855
448 HH21 ARG 59 1HH2 ARG 59 40.344 26.102 2.267
449 HH22 ARG 59 2HH2 ARG 59 41.074 25.617 3.780
450 H VAL 60 H VAL 60 33.750 24.661 0.727
451 HA VAL 60 HA VAL 60 32.744 22.105 1.663
452 HB VAL 60 HB VAL 60 31.736 24.957 2.033
453 HG11 VAL 60 1HG1 VAL 60 30.484 23.944 3.946
454 HG12 VAL 60 2HG1 VAL 60 29.904 23.484 2.330
455 HG13 VAL 60 3HG1 VAL 60 30.879 22.339 3.277
456 HG21 VAL 60 1HG2 VAL 60 32.726 24.700 4.303
457 HG22 VAL 60 2HG2 VAL 60 33.317 23.080 3.860
458 HG23 VAL 60 3HG2 VAL 60 33.962 24.523 3.045
459 H LEU 61 H LEU 61 31.723 24.538 -0.733
460 HA LEU 61 HA LEU 61 29.128 23.530 -1.220
461 HB2 LEU 61 1HB LEU 61 30.245 25.670 -2.097
462 HB3 LEU 61 2HB LEU 61 30.981 24.669 -3.336
463 HG LEU 61 HG LEU 61 28.302 24.014 -3.563
464 HD11 LEU 61 1HD1 LEU 61 27.091 26.143 -3.481
465 HD12 LEU 61 2HD1 LEU 61 28.565 26.968 -2.911
466 HD13 LEU 61 3HD1 LEU 61 27.769 25.739 -1.891
467 HD21 LEU 61 1HD2 LEU 61 29.114 26.456 -5.076
468 HD22 LEU 61 2HD2 LEU 61 28.428 24.932 -5.644
469 HD23 LEU 61 3HD2 LEU 61 30.159 25.026 -5.275
470 H VAL 62 H VAL 62 32.287 22.614 -2.738
471 HA VAL 62 HA VAL 62 30.998 20.737 -4.499
472 HB VAL 62 HB VAL 62 33.226 21.727 -4.977
473 HG11 VAL 62 1HG1 VAL 62 34.264 19.827 -2.843
474 HG12 VAL 62 2HG1 VAL 62 35.260 20.721 -4.010
475 HG13 VAL 62 3HG1 VAL 62 34.305 21.604 -2.817
476 HG21 VAL 62 1HG2 VAL 62 32.415 19.692 -6.127
477 HG22 VAL 62 2HG2 VAL 62 34.185 19.721 -5.981
478 HG23 VAL 62 3HG2 VAL 62 33.223 18.694 -4.893
479 H GLU 63 H GLU 63 32.357 20.421 -1.231
480 HA GLU 63 HA GLU 63 32.127 17.564 -1.086
481 HB2 GLU 63 1HB GLU 63 31.994 19.741 1.016
482 HB3 GLU 63 2HB GLU 63 31.767 18.038 1.421
483 HG2 GLU 63 1HG GLU 63 34.232 19.256 0.144
484 HG3 GLU 63 2HG GLU 63 34.073 18.716 1.823
485 H GLN 64 H GLN 64 29.747 20.169 -0.240
486 HA GLN 64 HA GLN 64 27.641 18.348 0.372
487 HB2 GLN 64 1HB GLN 64 27.815 21.207 -0.529
488 HB3 GLN 64 2HB GLN 64 26.242 20.420 -0.304
489 HG2 GLN 64 1HG GLN 64 26.436 20.327 1.925
490 HG3 GLN 64 2HG GLN 64 28.166 20.022 1.901
491 HE21 GLN 64 1HE2 GLN 64 27.959 23.180 3.478
492 HE22 GLN 64 2HE2 GLN 64 27.796 21.469 3.793
493 H GLN 65 H GLN 65 28.839 19.586 -2.741
494 HA GLN 65 HA GLN 65 26.521 18.555 -4.187
495 HB2 GLN 65 1HB GLN 65 29.276 19.370 -5.115
496 HB3 GLN 65 2HB GLN 65 28.039 18.716 -6.195
497 HG2 GLN 65 1HG GLN 65 26.486 20.536 -5.394
498 HG3 GLN 65 2HG GLN 65 27.863 21.266 -4.576
499 HE21 GLN 65 1HE2 GLN 65 28.946 22.911 -7.423
500 HE22 GLN 65 2HE2 GLN 65 28.951 22.740 -5.676
501 H GLN 66 H GLN 66 29.675 17.130 -3.236
502 HA GLN 66 HA GLN 66 29.242 14.675 -4.732
503 HB2 GLN 66 1HB GLN 66 30.805 15.248 -2.186
504 HB3 GLN 66 2HB GLN 66 30.820 13.701 -3.032
505 HG2 GLN 66 1HG GLN 66 31.802 14.759 -5.003
506 HG3 GLN 66 2HG GLN 66 31.749 16.333 -4.202
507 HE21 GLN 66 1HE2 GLN 66 34.663 15.875 -2.368
508 HE22 GLN 66 2HE2 GLN 66 33.371 16.922 -2.892
509 H ASP 67 H ASP 67 28.365 15.908 -1.519
510 HA ASP 67 HA ASP 67 27.292 13.430 -0.567
511 HB2 ASP 67 1HB ASP 67 28.041 15.498 0.743
512 HB3 ASP 67 2HB ASP 67 26.464 16.189 0.347
513 H ARG 68 H ARG 68 25.854 16.178 -2.285
514 HA ARG 68 HA ARG 68 23.141 15.349 -1.917
515 HB2 ARG 68 1HB ARG 68 22.571 17.069 -3.258
516 HB3 ARG 68 2HB ARG 68 24.236 17.548 -2.970
517 HG2 ARG 68 1HG ARG 68 24.915 16.810 -5.128
518 HG3 ARG 68 2HG ARG 68 23.395 15.974 -5.386
519 HD2 ARG 68 1HD ARG 68 22.240 18.185 -5.297
520 HD3 ARG 68 2HD ARG 68 23.849 18.945 -5.347
521 HE ARG 68 HE ARG 68 22.535 17.288 -7.456
522 HH11 ARG 68 1HH1 ARG 68 25.359 19.215 -6.531
523 HH12 ARG 68 2HH1 ARG 68 25.984 19.275 -8.155
524 HH21 ARG 68 1HH2 ARG 68 23.411 17.361 -9.478
525 HH22 ARG 68 2HH2 ARG 68 24.890 18.231 -9.800
526 H ALA 69 H ALA 69 25.598 14.564 -4.315
527 HA ALA 69 HA ALA 69 23.988 13.075 -6.082
528 HB1 ALA 69 1HB ALA 69 26.337 13.748 -6.526
529 HB2 ALA 69 2HB ALA 69 26.895 12.527 -5.355
530 HB3 ALA 69 3HB ALA 69 26.057 12.018 -6.839
531 H ARG 70 H ARG 70 25.355 12.084 -2.960
532 HA ARG 70 HA ARG 70 24.864 9.269 -3.316
533 HB2 ARG 70 1HB ARG 70 24.958 10.871 -0.730
534 HB3 ARG 70 2HB ARG 70 25.137 9.118 -0.893
535 HG2 ARG 70 1HG ARG 70 27.149 9.568 -2.359
536 HG3 ARG 70 2HG ARG 70 27.016 11.271 -1.897
537 HD2 ARG 70 1HD ARG 70 26.977 9.385 0.380
538 HD3 ARG 70 2HD ARG 70 28.479 9.357 -0.546
539 HE ARG 70 HE ARG 70 27.394 11.623 1.042
540 HH11 ARG 70 1HH1 ARG 70 29.996 10.503 -1.104
541 HH12 ARG 70 2HH1 ARG 70 31.060 11.792 -0.608
542 HH21 ARG 70 1HH2 ARG 70 28.798 13.193 1.599
543 HH22 ARG 70 2HH2 ARG 70 30.399 13.289 0.893
544 H ARG 71 H ARG 71 22.955 11.871 -1.769
545 HA ARG 71 HA ARG 71 20.759 10.021 -1.193
546 HB2 ARG 71 1HB ARG 71 19.551 12.061 -0.482
547 HB3 ARG 71 2HB ARG 71 21.078 11.777 0.352
548 HG2 ARG 71 1HG ARG 71 22.156 13.498 -1.007
549 HG3 ARG 71 2HG ARG 71 20.630 13.791 -1.866
550 HD2 ARG 71 1HD ARG 71 19.671 14.854 -0.076
551 HD3 ARG 71 2HD ARG 71 20.555 13.887 1.115
552 HE ARG 71 HE ARG 71 21.420 16.393 -0.123
553 HH11 ARG 71 1HH1 ARG 71 22.500 13.558 1.705
554 HH12 ARG 71 2HH1 ARG 71 23.947 14.377 2.264
555 HH21 ARG 71 1HH2 ARG 71 23.300 17.334 0.653
556 HH22 ARG 71 2HH2 ARG 71 24.372 16.415 1.694
557 H GLU 72 H GLU 72 21.576 12.165 -3.791
558 HA GLU 72 HA GLU 72 19.000 12.675 -4.847
559 HB2 GLU 72 1HB GLU 72 21.748 12.588 -5.973
560 HB3 GLU 72 2HB GLU 72 20.400 12.553 -7.118
561 HG2 GLU 72 1HG GLU 72 19.475 14.605 -6.145
562 HG3 GLU 72 2HG GLU 72 20.793 14.664 -4.971
563 H GLN 73 H GLN 73 20.965 9.768 -5.065
564 HA GLN 73 HA GLN 73 19.580 8.423 -7.139
565 HB2 GLN 73 1HB GLN 73 20.899 7.394 -4.601
566 HB3 GLN 73 2HB GLN 73 20.389 6.358 -5.945
567 HG2 GLN 73 1HG GLN 73 21.991 7.317 -7.428
568 HG3 GLN 73 2HG GLN 73 22.298 8.679 -6.348
569 HE21 GLN 73 1HE2 GLN 73 25.050 7.157 -4.974
570 HE22 GLN 73 2HE2 GLN 73 24.229 8.606 -5.517
571 H GLU 74 H GLU 74 18.777 8.804 -3.674
572 HA GLU 74 HA GLU 74 16.330 7.211 -3.958
573 HB2 GLU 74 1HB GLU 74 17.482 8.941 -1.761
574 HB3 GLU 74 2HB GLU 74 15.852 8.263 -1.670
575 HG2 GLU 74 1HG GLU 74 18.382 6.653 -2.053
576 HG3 GLU 74 2HG GLU 74 17.544 6.886 -0.507
577 H ARG 75 H ARG 75 17.244 10.656 -3.969
578 HA ARG 75 HA ARG 75 14.608 11.682 -3.633
579 HB2 ARG 75 1HB ARG 75 16.984 12.886 -5.059
580 HB3 ARG 75 2HB ARG 75 15.467 13.736 -4.783
581 HG2 ARG 75 1HG ARG 75 15.736 13.362 -2.328
582 HG3 ARG 75 2HG ARG 75 17.335 12.671 -2.645
583 HD2 ARG 75 1HD ARG 75 17.585 15.004 -2.018
584 HD3 ARG 75 2HD ARG 75 18.020 14.802 -3.722
585 HE ARG 75 HE ARG 75 16.207 16.100 -4.358
586 HH11 ARG 75 1HH1 ARG 75 15.852 15.392 -0.908
587 HH12 ARG 75 2HH1 ARG 75 14.561 16.546 -0.718
588 HH21 ARG 75 1HH2 ARG 75 14.552 17.543 -4.023
589 HH22 ARG 75 2HH2 ARG 75 13.841 17.734 -2.445
590 H ILE 76 H ILE 76 16.130 10.521 -6.623
591 HA ILE 76 HA ILE 76 14.204 11.735 -8.378
592 HB ILE 76 HB ILE 76 14.906 10.058 -10.058
593 HG12 ILE 76 1HG1 ILE 76 16.676 8.919 -7.872
594 HG13 ILE 76 2HG1 ILE 76 15.170 8.167 -8.389
595 HG21 ILE 76 1HG2 ILE 76 17.273 11.196 -8.509
596 HG22 ILE 76 2HG2 ILE 76 17.214 10.822 -10.241
597 HG23 ILE 76 3HG2 ILE 76 16.229 12.143 -9.588
598 HD11 ILE 76 1HD1 ILE 76 16.122 7.935 -10.696
599 HD12 ILE 76 2HD1 ILE 76 17.671 8.561 -10.072
600 HD13 ILE 76 3HD1 ILE 76 17.015 7.032 -9.450
601 H ARG 77 H ARG 77 13.907 9.109 -6.179
602 HA ARG 77 HA ARG 77 11.769 7.683 -7.524
603 HB2 ARG 77 1HB ARG 77 12.455 7.838 -4.571
604 HB3 ARG 77 2HB ARG 77 11.417 6.639 -5.334
605 HG2 ARG 77 1HG ARG 77 13.318 5.742 -6.615
606 HG3 ARG 77 2HG ARG 77 14.365 7.035 -6.019
607 HD2 ARG 77 1HD ARG 77 14.936 5.157 -4.743
608 HD3 ARG 77 2HD ARG 77 13.943 6.162 -3.671
609 HE ARG 77 HE ARG 77 12.155 4.419 -4.877
610 HH11 ARG 77 1HH1 ARG 77 15.061 3.997 -2.878
611 HH12 ARG 77 2HH1 ARG 77 14.504 2.455 -2.277
612 HH21 ARG 77 1HH2 ARG 77 11.527 2.470 -4.026
613 HH22 ARG 77 2HH2 ARG 77 12.546 1.621 -2.896
614 H LEU 78 H LEU 78 11.938 10.673 -6.052
615 HA LEU 78 HA LEU 78 10.552 12.377 -5.793
616 HB2 LEU 78 1HB LEU 78 9.849 11.543 -7.954
617 HB3 LEU 78 2HB LEU 78 8.597 10.618 -7.193
618 HG LEU 78 HG LEU 78 7.873 12.639 -8.454
619 HD11 LEU 78 1HD1 LEU 78 6.128 13.306 -6.980
620 HD12 LEU 78 2HD1 LEU 78 7.047 12.818 -5.545
621 HD13 LEU 78 3HD1 LEU 78 6.452 11.586 -6.677
622 HD21 LEU 78 1HD2 LEU 78 8.137 14.850 -7.556
623 HD22 LEU 78 2HD2 LEU 78 9.749 14.122 -7.711
624 HD23 LEU 78 3HD2 LEU 78 8.968 14.240 -6.115
625 H PHE 79 H PHE 79 9.516 13.324 -4.294
626 HA PHE 79 HA PHE 79 7.718 11.826 -2.460
627 HB2 PHE 79 1HB PHE 79 10.227 13.393 -1.702
628 HB3 PHE 79 2HB PHE 79 9.020 12.810 -0.549
629 HD1 PHE 79 HD1 PHE 79 9.113 10.621 0.326
630 HD2 PHE 79 HD2 PHE 79 11.509 11.620 -3.116
631 HE1 PHE 79 HE1 PHE 79 10.318 8.450 0.535
632 HE2 PHE 79 HE2 PHE 79 12.705 9.456 -2.903
633 HZ PHE 79 HZ PHE 79 12.129 7.869 -1.081
634 H SER 80 H SER 80 7.166 13.732 -0.720
635 HA SER 80 HA SER 80 5.395 15.493 -1.613
636 HB2 SER 80 1HB SER 80 7.368 16.226 0.564
637 HB3 SER 80 2HB SER 80 5.653 16.676 0.436
638 HG SER 80 HG SER 80 5.819 14.970 1.851
639 H ALA 81 H ALA 81 5.481 16.725 -3.236
640 HA ALA 81 HA ALA 81 7.886 18.239 -3.935
641 HB1 ALA 81 1HB ALA 81 5.214 17.938 -5.327
642 HB2 ALA 81 2HB ALA 81 6.730 18.553 -6.033
643 HB3 ALA 81 3HB ALA 81 6.605 16.841 -5.525
644 H ASP 82 H ASP 82 7.168 19.220 -1.670
645 HA ASP 82 HA ASP 82 5.056 21.148 -1.608
646 HB2 ASP 82 1HB ASP 82 7.569 20.811 0.076
647 HB3 ASP 82 2HB ASP 82 6.207 21.860 0.499
648 HA PRO 83 HA PRO 83 7.044 24.533 -3.594
649 HB2 PRO 83 1HB PRO 83 6.059 26.739 -2.329
650 HB3 PRO 83 2HB PRO 83 5.019 25.678 -3.334
651 HG2 PRO 83 1HG PRO 83 5.423 25.641 -0.352
652 HG3 PRO 83 2HG PRO 83 3.887 25.725 -1.277
653 HD2 PRO 83 1HD PRO 83 4.822 23.375 -0.338
654 HD3 PRO 83 2HD PRO 83 4.047 23.473 -1.956
655 H PHE 84 H PHE 84 8.550 26.352 -3.330
656 HA PHE 84 HA PHE 84 10.260 26.043 -0.902
657 HB2 PHE 84 1HB PHE 84 12.120 26.718 -2.408
658 HB3 PHE 84 2HB PHE 84 11.347 25.215 -2.919
659 HD1 PHE 84 HD1 PHE 84 10.181 25.041 -5.032
660 HD2 PHE 84 HD2 PHE 84 11.727 28.837 -3.703
661 HE1 PHE 84 HE1 PHE 84 9.775 26.002 -7.298
662 HE2 PHE 84 HE2 PHE 84 11.330 29.798 -5.957
663 HZ PHE 84 HZ PHE 84 10.351 28.389 -7.763
664 H ASP 85 H ASP 85 7.925 27.821 -1.780
665 HA ASP 85 HA ASP 85 7.143 29.876 -1.425
666 HB2 ASP 85 1HB ASP 85 8.452 29.760 0.664
667 HB3 ASP 85 2HB ASP 85 9.775 30.599 -0.158
668 H LEU 86 H LEU 86 6.658 31.073 -2.988
669 HA LEU 86 HA LEU 86 8.550 31.859 -5.052
670 HB2 LEU 86 1HB LEU 86 6.574 33.009 -5.989
671 HB3 LEU 86 2HB LEU 86 6.326 31.300 -5.679
672 HG LEU 86 HG LEU 86 5.295 32.389 -3.387
673 HD11 LEU 86 1HD1 LEU 86 3.874 34.277 -4.021
674 HD12 LEU 86 2HD1 LEU 86 4.541 34.268 -5.674
675 HD13 LEU 86 3HD1 LEU 86 5.573 34.703 -4.291
676 HD21 LEU 86 1HD2 LEU 86 4.274 30.653 -4.795
677 HD22 LEU 86 2HD2 LEU 86 3.852 31.876 -6.019
678 HD23 LEU 86 3HD2 LEU 86 3.102 31.929 -4.406
679 H GLU 87 H GLU 87 7.330 33.255 -2.114
680 HA GLU 87 HA GLU 87 7.843 36.024 -2.905
681 HB2 GLU 87 1HB GLU 87 7.324 34.739 -0.203
682 HB3 GLU 87 2HB GLU 87 7.510 36.472 -0.471
683 HG2 GLU 87 1HG GLU 87 5.582 36.376 -2.085
684 HG3 GLU 87 2HG GLU 87 5.346 34.680 -1.636
685 H ALA 88 H ALA 88 9.685 33.397 -1.659
686 HA ALA 88 HA ALA 88 11.860 34.946 -0.541
687 HB1 ALA 88 1HB ALA 88 11.282 32.649 0.225
688 HB2 ALA 88 2HB ALA 88 11.704 32.009 -1.380
689 HB3 ALA 88 3HB ALA 88 12.964 32.738 -0.353
690 H GLN 89 H GLN 89 11.144 35.643 -3.301
691 HA GLN 89 HA GLN 89 13.239 34.503 -5.010
692 HB2 GLN 89 1HB GLN 89 12.095 35.758 -6.786
693 HB3 GLN 89 2HB GLN 89 11.005 34.742 -5.850
694 HG2 GLN 89 1HG GLN 89 9.680 36.572 -5.903
695 HG3 GLN 89 2HG GLN 89 10.638 37.058 -4.503
696 HE21 GLN 89 1HE2 GLN 89 11.683 39.978 -6.018
697 HE22 GLN 89 2HE2 GLN 89 11.375 39.052 -4.568
698 H ALA 90 H ALA 90 14.482 35.746 -6.475
699 HA ALA 90 HA ALA 90 16.000 37.275 -7.093
700 HB1 ALA 90 1HB ALA 90 14.314 39.399 -5.724
701 HB2 ALA 90 2HB ALA 90 15.355 39.571 -7.163
702 HB3 ALA 90 3HB ALA 90 13.860 38.624 -7.260
703 H LYS 91 H LYS 91 16.769 39.779 -5.931
704 HA LYS 91 HA LYS 91 18.342 39.004 -3.553
705 HB2 LYS 91 1HB LYS 91 20.384 39.545 -4.770
706 HB3 LYS 91 2HB LYS 91 19.550 38.237 -5.596
707 HG2 LYS 91 1HG LYS 91 18.549 40.527 -6.840
708 HG3 LYS 91 2HG LYS 91 20.240 40.944 -6.537
709 HD2 LYS 91 1HD LYS 91 20.960 38.898 -7.695
710 HD3 LYS 91 2HD LYS 91 19.259 38.428 -7.933
711 HE2 LYS 91 1HE LYS 91 18.878 40.542 -9.185
712 HE3 LYS 91 2HE LYS 91 20.599 40.927 -9.024
713 HZ1 LYS 91 1HZ LYS 91 20.131 39.913 -11.132
714 HZ2 LYS 91 2HZ LYS 91 19.454 38.586 -10.424
715 HZ3 LYS 91 3HZ LYS 91 21.069 38.880 -10.249
716 H ILE 92 H ILE 92 19.959 41.130 -3.336
717 HA ILE 92 HA ILE 92 18.293 43.551 -3.842
718 HB ILE 92 HB ILE 92 20.132 43.052 -1.439
719 HG12 ILE 92 1HG1 ILE 92 17.094 43.290 -1.528
720 HG13 ILE 92 2HG1 ILE 92 17.978 41.772 -1.349
721 HG21 ILE 92 1HG2 ILE 92 19.342 45.262 -0.635
722 HG22 ILE 92 2HG2 ILE 92 20.076 45.440 -2.233
723 HG23 ILE 92 3HG2 ILE 92 18.305 45.440 -2.072
724 HD11 ILE 92 1HD1 ILE 92 19.009 42.725 0.775
725 HD12 ILE 92 2HD1 ILE 92 17.840 44.062 0.642
726 HD13 ILE 92 3HD1 ILE 92 17.262 42.394 0.837
727 H GLU 93 H GLU 93 19.284 44.631 -5.424
728 HA GLU 93 HA GLU 93 22.221 44.435 -5.726
729 HB2 GLU 93 1HB GLU 93 20.121 45.892 -7.384
730 HB3 GLU 93 2HB GLU 93 21.835 45.749 -7.779
731 HG2 GLU 93 1HG GLU 93 21.191 44.002 -9.026
732 HG3 GLU 93 2HG GLU 93 21.193 43.116 -7.495
733 H GLU 94 H GLU 94 23.597 45.941 -4.961
734 HA GLU 94 HA GLU 94 22.553 48.695 -4.455
735 HB2 GLU 94 1HB GLU 94 24.513 47.099 -2.755
736 HB3 GLU 94 2HB GLU 94 24.216 48.835 -2.594
737 HG2 GLU 94 1HG GLU 94 21.776 48.257 -2.163
738 HG3 GLU 94 2HG GLU 94 22.302 46.570 -1.998
739 H ASP 95 H ASP 95 24.101 50.355 -4.880
740 HA ASP 95 HA ASP 95 26.725 49.542 -5.913
741 HB2 ASP 95 1HB ASP 95 25.237 49.609 -7.922
742 HB3 ASP 95 2HB ASP 95 24.877 51.304 -7.557
743 H ILE 96 H ILE 96 27.774 50.543 -4.346
744 HA ILE 96 HA ILE 96 27.090 53.325 -3.694
745 HB ILE 96 HB ILE 96 28.616 53.065 -1.757
746 HG12 ILE 96 1HG1 ILE 96 29.028 50.203 -2.728
747 HG13 ILE 96 2HG1 ILE 96 30.200 51.498 -2.979
748 HG21 ILE 96 1HG2 ILE 96 26.192 52.303 -1.635
749 HG22 ILE 96 2HG2 ILE 96 26.740 50.644 -1.965
750 HG23 ILE 96 3HG2 ILE 96 27.260 51.477 -0.485
751 HD11 ILE 96 1HD1 ILE 96 30.375 51.775 -0.489
752 HD12 ILE 96 2HD1 ILE 96 29.306 50.361 -0.299
753 HD13 ILE 96 3HD1 ILE 96 30.894 50.178 -1.074
754 H ARG 97 H ARG 97 28.565 52.207 -6.093
755 HA ARG 97 HA ARG 97 31.135 53.693 -5.903
756 HB2 ARG 97 1HB ARG 97 30.870 51.418 -7.028
757 HB3 ARG 97 2HB ARG 97 29.967 52.242 -8.298
758 HG2 ARG 97 1HG ARG 97 31.983 53.686 -8.699
759 HG3 ARG 97 2HG ARG 97 32.870 52.668 -7.545
760 HD2 ARG 97 1HD ARG 97 32.419 50.690 -8.927
761 HD3 ARG 97 2HD ARG 97 31.434 51.668 -10.030
762 HE ARG 97 HE ARG 97 33.344 52.596 -10.967
763 HH11 ARG 97 1HH1 ARG 97 34.293 50.610 -8.207
764 HH12 ARG 97 2HH1 ARG 97 35.986 50.673 -8.625
765 HH21 ARG 97 1HH2 ARG 97 35.510 52.634 -11.437
766 HH22 ARG 97 2HH2 ARG 97 36.658 51.794 -10.431
767 H GLN 98 H GLN 98 29.535 55.544 -5.449
768 HA GLN 98 HA GLN 98 28.593 57.545 -6.055
769 HB2 GLN 98 1HB GLN 98 30.906 57.761 -7.152
770 HB3 GLN 98 2HB GLN 98 30.156 57.312 -8.681
771 HG2 GLN 98 1HG GLN 98 28.646 59.308 -8.525
772 HG3 GLN 98 2HG GLN 98 29.357 59.725 -6.968
773 HE21 GLN 98 1HE2 GLN 98 31.391 61.871 -8.847
774 HE22 GLN 98 2HE2 GLN 98 30.007 61.745 -7.793
775 HXT GLN 98 HO GLN 98 26.070 55.733 -7.713
Start of MODEL 13
1 H1 SER 1 1H SER 1 -3.888 34.034 -0.947
2 H2 SER 1 2H SER 1 -4.971 35.011 -0.333
3 H3 SER 1 3H SER 1 -4.354 35.232 -1.817
4 HA SER 1 HA SER 1 -6.443 33.287 -1.041
5 HB2 SER 1 1HB SER 1 -6.624 35.634 -2.972
6 HB3 SER 1 2HB SER 1 -7.958 34.721 -2.217
7 HG SER 1 HG SER 1 -7.603 36.693 -1.095
8 H GLN 2 H GLN 2 -3.823 33.036 -2.493
9 HA GLN 2 HA GLN 2 -4.890 31.463 -4.801
10 HB2 GLN 2 1HB GLN 2 -2.442 33.278 -4.862
11 HB3 GLN 2 2HB GLN 2 -2.922 32.159 -6.144
12 HG2 GLN 2 1HG GLN 2 -5.039 33.448 -6.428
13 HG3 GLN 2 2HG GLN 2 -4.465 34.604 -5.216
14 HE21 GLN 2 1HE2 GLN 2 -2.708 36.470 -7.542
15 HE22 GLN 2 2HE2 GLN 2 -3.547 36.367 -6.013
16 H GLN 3 H GLN 3 -3.562 29.609 -5.284
17 HA GLN 3 HA GLN 3 -1.232 29.091 -3.570
18 HB2 GLN 3 1HB GLN 3 -2.124 26.970 -2.710
19 HB3 GLN 3 2HB GLN 3 -3.095 28.335 -2.150
20 HG2 GLN 3 1HG GLN 3 -4.804 27.826 -3.884
21 HG3 GLN 3 2HG GLN 3 -3.837 26.445 -4.419
22 HE21 GLN 3 1HE2 GLN 3 -5.834 24.505 -2.321
23 HE22 GLN 3 2HE2 GLN 3 -5.364 24.903 -3.955
24 H SER 4 H SER 4 0.091 27.430 -4.443
25 HA SER 4 HA SER 4 -0.779 25.858 -6.730
26 HB2 SER 4 1HB SER 4 -0.326 28.042 -7.846
27 HB3 SER 4 2HB SER 4 1.304 28.051 -7.136
28 HG SER 4 HG SER 4 1.222 27.220 -9.304
29 H HIS 5 H HIS 5 0.782 24.234 -7.155
30 HA HIS 5 HA HIS 5 3.270 24.274 -5.530
31 HB2 HIS 5 1HB HIS 5 1.365 21.902 -5.657
32 HB3 HIS 5 2HB HIS 5 2.944 21.934 -4.861
33 HD1 HIS 5 HD1 HIS 5 2.996 24.098 -2.936
34 HD2 HIS 5 HD2 HIS 5 -0.620 22.267 -3.899
35 HE1 HIS 5 HE1 HIS 5 1.390 24.602 -1.049
36 H SER 6 H SER 6 1.303 22.518 -7.919
37 HA SER 6 HA SER 6 1.743 21.637 -9.954
38 HB2 SER 6 1HB SER 6 4.197 23.410 -10.063
39 HB3 SER 6 2HB SER 6 3.219 22.799 -11.416
40 HG SER 6 HG SER 6 2.694 24.856 -9.596
41 H SER 7 H SER 7 3.772 20.852 -11.430
42 HA SER 7 HA SER 7 5.695 19.306 -9.791
43 HB2 SER 7 1HB SER 7 5.139 17.247 -11.103
44 HB3 SER 7 2HB SER 7 3.821 17.767 -10.031
45 HG SER 7 HG SER 7 4.038 18.263 -12.821
46 HA PRO 8 HA PRO 8 7.088 21.281 -13.706
47 HB2 PRO 8 1HB PRO 8 9.241 22.647 -12.849
48 HB3 PRO 8 2HB PRO 8 7.591 23.236 -12.518
49 HG2 PRO 8 1HG PRO 8 9.406 21.624 -10.752
50 HG3 PRO 8 2HG PRO 8 8.568 23.168 -10.391
51 HD2 PRO 8 1HD PRO 8 7.526 20.774 -9.661
52 HD3 PRO 8 2HD PRO 8 6.479 22.125 -10.218
53 H GLY 9 H GLY 9 9.260 21.149 -14.872
54 HA2 GLY 9 1HA GLY 9 10.212 18.366 -14.454
55 HA3 GLY 9 2HA GLY 9 10.261 19.289 -15.961
56 H GLU 10 H GLU 10 11.328 20.663 -12.926
57 HA GLU 10 HA GLU 10 13.899 21.248 -14.143
58 HB2 GLU 10 1HB GLU 10 13.224 21.875 -11.276
59 HB3 GLU 10 2HB GLU 10 14.228 22.772 -12.423
60 HG2 GLU 10 1HG GLU 10 11.228 22.547 -12.298
61 HG3 GLU 10 2HG GLU 10 12.202 24.001 -12.107
62 H ILE 11 H ILE 11 13.815 18.550 -13.992
63 HA ILE 11 HA ILE 11 15.108 17.519 -11.699
64 HB ILE 11 HB ILE 11 14.992 16.274 -14.476
65 HG12 ILE 11 1HG1 ILE 11 12.721 17.168 -14.179
66 HG13 ILE 11 2HG1 ILE 11 12.718 15.431 -14.034
67 HG21 ILE 11 1HG2 ILE 11 16.062 15.033 -12.815
68 HG22 ILE 11 2HG2 ILE 11 14.716 15.282 -11.697
69 HG23 ILE 11 3HG2 ILE 11 14.493 14.283 -13.149
70 HD11 ILE 11 1HD1 ILE 11 12.444 15.560 -11.574
71 HD12 ILE 11 2HD1 ILE 11 12.584 17.333 -11.626
72 HD13 ILE 11 3HD1 ILE 11 11.191 16.530 -12.373
73 H THR 12 H THR 12 16.111 19.645 -13.773
74 HA THR 12 HA THR 12 18.973 18.771 -13.767
75 HB THR 12 HB THR 12 19.246 20.241 -15.807
76 HG1 THR 12 HG1 THR 12 17.147 21.340 -15.317
77 HG21 THR 12 1HG2 THR 12 18.928 17.768 -16.060
78 HG22 THR 12 2HG2 THR 12 18.299 18.700 -17.437
79 HG23 THR 12 3HG2 THR 12 17.177 18.046 -16.226
80 H SER 13 H SER 13 20.404 20.477 -13.088
81 HA SER 13 HA SER 13 19.093 23.027 -12.337
82 HB2 SER 13 1HB SER 13 18.930 21.448 -10.405
83 HB3 SER 13 2HB SER 13 20.702 21.356 -10.380
84 HG SER 13 HG SER 13 19.246 23.068 -9.129
85 H SER 14 H SER 14 20.414 24.721 -12.060
86 HA SER 14 HA SER 14 23.311 24.562 -12.273
87 HB2 SER 14 1HB SER 14 21.776 25.846 -14.566
88 HB3 SER 14 2HB SER 14 23.534 25.857 -14.339
89 HG SER 14 HG SER 14 22.673 23.329 -14.193
90 HA PRO 15 HA PRO 15 21.970 29.154 -11.810
91 HB2 PRO 15 1HB PRO 15 19.396 29.707 -11.061
92 HB3 PRO 15 2HB PRO 15 19.937 29.603 -12.750
93 HG2 PRO 15 1HG PRO 15 18.673 27.480 -11.114
94 HG3 PRO 15 2HG PRO 15 18.159 28.139 -12.700
95 HD2 PRO 15 1HD PRO 15 19.566 25.943 -12.602
96 HD3 PRO 15 2HD PRO 15 19.997 27.205 -13.802
97 H GLN 16 H GLN 16 20.938 26.568 -9.921
98 HA GLN 16 HA GLN 16 20.669 27.692 -7.340
99 HB2 GLN 16 1HB GLN 16 20.419 25.250 -8.254
100 HB3 GLN 16 2HB GLN 16 22.137 25.109 -7.871
101 HG2 GLN 16 1HG GLN 16 21.575 25.808 -5.517
102 HG3 GLN 16 2HG GLN 16 19.865 25.723 -5.970
103 HE21 GLN 16 1HE2 GLN 16 19.775 22.182 -6.110
104 HE22 GLN 16 2HE2 GLN 16 19.035 23.647 -6.724
105 H GLY 17 H GLY 17 23.430 27.655 -9.434
106 HA2 GLY 17 1HA GLY 17 25.383 28.871 -9.035
107 HA3 GLY 17 2HA GLY 17 24.992 28.949 -7.313
108 H LEU 18 H LEU 18 24.723 25.828 -8.621
109 HA LEU 18 HA LEU 18 26.780 24.784 -6.972
110 HB2 LEU 18 1HB LEU 18 26.259 22.677 -7.883
111 HB3 LEU 18 2HB LEU 18 24.787 23.583 -7.587
112 HG LEU 18 HG LEU 18 25.134 24.136 -10.221
113 HD11 LEU 18 1HD1 LEU 18 27.170 22.692 -10.265
114 HD12 LEU 18 2HD1 LEU 18 25.885 22.112 -11.352
115 HD13 LEU 18 3HD1 LEU 18 26.171 21.309 -9.786
116 HD21 LEU 18 1HD2 LEU 18 23.106 23.304 -9.149
117 HD22 LEU 18 2HD2 LEU 18 23.831 21.691 -8.975
118 HD23 LEU 18 3HD2 LEU 18 23.475 22.338 -10.593
119 H ASP 19 H ASP 19 26.812 25.757 -10.358
120 HA ASP 19 HA ASP 19 29.511 24.661 -10.790
121 HB2 ASP 19 1HB ASP 19 28.082 24.651 -12.702
122 HB3 ASP 19 2HB ASP 19 27.573 26.322 -12.413
123 H ASN 20 H ASN 20 27.967 27.710 -9.962
124 HA ASN 20 HA ASN 20 30.598 29.019 -9.997
125 HB2 ASN 20 1HB ASN 20 28.350 29.606 -11.391
126 HB3 ASN 20 2HB ASN 20 28.151 30.686 -10.022
127 HD21 ASN 20 1HD2 ASN 20 30.384 31.756 -12.912
128 HD22 ASN 20 2HD2 ASN 20 28.968 30.765 -12.953
129 HA PRO 21 HA PRO 21 29.530 29.168 -5.506
130 HB2 PRO 21 1HB PRO 21 32.207 29.119 -4.755
131 HB3 PRO 21 2HB PRO 21 31.202 27.662 -4.911
132 HG2 PRO 21 1HG PRO 21 33.080 28.872 -6.862
133 HG3 PRO 21 2HG PRO 21 32.909 27.169 -6.389
134 HD2 PRO 21 1HD PRO 21 31.877 28.029 -8.655
135 HD3 PRO 21 2HD PRO 21 30.960 26.888 -7.611
136 H ALA 22 H ALA 22 31.838 30.858 -7.635
137 HA ALA 22 HA ALA 22 32.444 32.978 -5.821
138 HB1 ALA 22 1HB ALA 22 32.408 32.940 -8.871
139 HB2 ALA 22 2HB ALA 22 33.168 34.191 -7.859
140 HB3 ALA 22 3HB ALA 22 33.789 32.525 -7.824
141 H LEU 23 H LEU 23 29.915 32.596 -8.330
142 HA LEU 23 HA LEU 23 28.808 35.243 -7.791
143 HB2 LEU 23 1HB LEU 23 27.603 32.867 -9.251
144 HB3 LEU 23 2HB LEU 23 26.937 34.492 -9.216
145 HG LEU 23 HG LEU 23 29.530 33.649 -10.534
146 HD11 LEU 23 1HD1 LEU 23 27.436 32.949 -11.683
147 HD12 LEU 23 2HD1 LEU 23 28.338 34.160 -12.615
148 HD13 LEU 23 3HD1 LEU 23 26.895 34.642 -11.695
149 HD21 LEU 23 1HD2 LEU 23 29.805 35.897 -9.704
150 HD22 LEU 23 2HD2 LEU 23 28.229 36.377 -10.373
151 HD23 LEU 23 3HD2 LEU 23 29.570 35.938 -11.458
152 H LEU 24 H LEU 24 28.082 31.891 -6.791
153 HA LEU 24 HA LEU 24 25.578 32.549 -5.579
154 HB2 LEU 24 1HB LEU 24 26.266 30.246 -6.109
155 HB3 LEU 24 2HB LEU 24 27.551 30.337 -4.907
156 HG LEU 24 HG LEU 24 25.934 30.525 -3.111
157 HD11 LEU 24 1HD1 LEU 24 23.495 30.202 -3.535
158 HD12 LEU 24 2HD1 LEU 24 23.806 30.434 -5.273
159 HD13 LEU 24 3HD1 LEU 24 24.125 31.753 -4.111
160 HD21 LEU 24 1HD2 LEU 24 25.230 28.272 -4.991
161 HD22 LEU 24 2HD2 LEU 24 24.954 28.311 -3.235
162 HD23 LEU 24 3HD2 LEU 24 26.612 28.316 -3.874
163 H ARG 25 H ARG 25 28.928 32.449 -4.316
164 HA ARG 25 HA ARG 25 28.333 33.095 -1.616
165 HB2 ARG 25 1HB ARG 25 30.568 32.434 -2.452
166 HB3 ARG 25 2HB ARG 25 30.643 33.903 -3.410
167 HG2 ARG 25 1HG ARG 25 30.401 35.103 -1.073
168 HG3 ARG 25 2HG ARG 25 30.962 33.546 -0.442
169 HD2 ARG 25 1HD ARG 25 32.855 35.028 -0.795
170 HD3 ARG 25 2HD ARG 25 32.921 33.687 -1.962
171 HE ARG 25 HE ARG 25 31.559 35.604 -3.345
172 HH11 ARG 25 1HH1 ARG 25 34.650 35.744 -1.646
173 HH12 ARG 25 2HH1 ARG 25 35.285 36.955 -2.729
174 HH21 ARG 25 1HH2 ARG 25 32.414 37.143 -4.665
175 HH22 ARG 25 2HH2 ARG 25 34.034 37.734 -4.415
176 H ASP 26 H ASP 26 28.809 35.196 -4.491
177 HA ASP 26 HA ASP 26 28.656 37.636 -3.008
178 HB2 ASP 26 1HB ASP 26 29.519 37.150 -5.407
179 HB3 ASP 26 2HB ASP 26 27.833 37.358 -5.902
180 H MET 27 H MET 27 26.200 35.758 -4.806
181 HA MET 27 HA MET 27 24.001 37.540 -4.440
182 HB2 MET 27 1HB MET 27 24.089 35.515 -5.926
183 HB3 MET 27 2HB MET 27 23.976 34.493 -4.496
184 HG2 MET 27 1HG MET 27 21.889 36.550 -5.233
185 HG3 MET 27 2HG MET 27 21.848 34.889 -5.820
186 HE1 MET 27 1HE MET 27 22.585 33.023 -3.330
187 HE2 MET 27 2HE MET 27 20.973 32.785 -2.627
188 HE3 MET 27 3HE MET 27 21.182 32.773 -4.394
189 H LEU 28 H LEU 28 25.119 34.763 -2.520
190 HA LEU 28 HA LEU 28 23.139 34.872 -0.518
191 HB2 LEU 28 1HB LEU 28 25.912 33.826 -0.715
192 HB3 LEU 28 2HB LEU 28 25.139 33.898 0.865
193 HG LEU 28 HG LEU 28 23.758 32.587 -1.467
194 HD11 LEU 28 1HD1 LEU 28 25.956 31.616 -1.224
195 HD12 LEU 28 2HD1 LEU 28 24.696 30.490 -0.683
196 HD13 LEU 28 3HD1 LEU 28 25.680 31.374 0.510
197 HD21 LEU 28 1HD2 LEU 28 22.587 31.395 0.328
198 HD22 LEU 28 2HD2 LEU 28 22.453 33.141 0.567
199 HD23 LEU 28 3HD2 LEU 28 23.590 32.215 1.550
200 H LEU 29 H LEU 29 26.344 36.454 -0.669
201 HA LEU 29 HA LEU 29 26.194 37.573 1.974
202 HB2 LEU 29 1HB LEU 29 27.701 38.378 -0.523
203 HB3 LEU 29 2HB LEU 29 27.849 39.279 0.983
204 HG LEU 29 HG LEU 29 28.479 36.325 0.779
205 HD11 LEU 29 1HD1 LEU 29 29.913 37.538 -0.774
206 HD12 LEU 29 2HD1 LEU 29 30.849 36.994 0.636
207 HD13 LEU 29 3HD1 LEU 29 30.352 38.699 0.503
208 HD21 LEU 29 1HD2 LEU 29 29.780 36.734 2.833
209 HD22 LEU 29 2HD2 LEU 29 28.066 37.122 3.061
210 HD23 LEU 29 3HD2 LEU 29 29.246 38.433 2.829
211 H ALA 30 H ALA 30 25.059 38.703 -1.171
212 HA ALA 30 HA ALA 30 24.252 41.307 -0.140
213 HB1 ALA 30 1HB ALA 30 23.294 41.603 -2.392
214 HB2 ALA 30 2HB ALA 30 24.951 40.956 -2.495
215 HB3 ALA 30 3HB ALA 30 23.558 39.878 -2.744
216 H ASN 31 H ASN 31 22.857 38.152 0.014
217 HA ASN 31 HA ASN 31 20.106 39.324 0.158
218 HB2 ASN 31 1HB ASN 31 20.657 37.570 -1.569
219 HB3 ASN 31 2HB ASN 31 20.875 36.424 -0.246
220 HD21 ASN 31 1HD2 ASN 31 17.363 36.536 -1.721
221 HD22 ASN 31 2HD2 ASN 31 18.938 36.608 -2.484
222 HA PRO 32 HA PRO 32 21.024 38.405 4.472
223 HB2 PRO 32 1HB PRO 32 18.932 39.787 5.597
224 HB3 PRO 32 2HB PRO 32 20.451 40.561 5.038
225 HG2 PRO 32 1HG PRO 32 17.841 40.270 3.555
226 HG3 PRO 32 2HG PRO 32 18.822 41.745 3.830
227 HD2 PRO 32 1HD PRO 32 19.021 40.422 1.542
228 HD3 PRO 32 2HD PRO 32 20.499 41.055 2.350
229 H HIS 33 H HIS 33 17.960 37.838 2.768
230 HA HIS 33 HA HIS 33 16.877 36.169 4.903
231 HB2 HIS 33 1HB HIS 33 15.421 37.328 3.280
232 HB3 HIS 33 2HB HIS 33 16.137 36.393 1.960
233 HD1 HIS 33 HD1 HIS 33 14.069 35.799 5.139
234 HD2 HIS 33 HD2 HIS 33 14.954 33.998 1.485
235 HE1 HIS 33 HE1 HIS 33 12.579 33.767 4.941
236 H GLU 34 H GLU 34 18.576 35.624 1.805
237 HA GLU 34 HA GLU 34 18.219 32.756 1.925
238 HB2 GLU 34 1HB GLU 34 19.284 34.706 0.122
239 HB3 GLU 34 2HB GLU 34 20.470 33.439 0.315
240 HG2 GLU 34 1HG GLU 34 17.564 32.959 -0.385
241 HG3 GLU 34 2HG GLU 34 18.854 33.137 -1.583
242 H LEU 35 H LEU 35 20.818 35.049 2.790
243 HA LEU 35 HA LEU 35 22.672 33.051 3.570
244 HB2 LEU 35 1HB LEU 35 23.980 34.714 4.187
245 HB3 LEU 35 2HB LEU 35 22.877 35.501 3.123
246 HG LEU 35 HG LEU 35 21.760 36.587 4.987
247 HD11 LEU 35 1HD1 LEU 35 23.094 36.764 7.128
248 HD12 LEU 35 2HD1 LEU 35 23.913 35.256 6.633
249 HD13 LEU 35 3HD1 LEU 35 22.155 35.282 6.912
250 HD21 LEU 35 1HD2 LEU 35 23.684 38.120 5.289
251 HD22 LEU 35 2HD2 LEU 35 23.518 37.542 3.618
252 HD23 LEU 35 3HD2 LEU 35 24.758 36.834 4.672
253 H SER 36 H SER 36 19.872 34.374 5.209
254 HA SER 36 HA SER 36 20.619 33.372 7.814
255 HB2 SER 36 1HB SER 36 18.552 34.158 8.623
256 HB3 SER 36 2HB SER 36 19.125 35.363 7.464
257 HG SER 36 HG SER 36 17.702 34.165 5.910
258 H LEU 37 H LEU 37 18.589 32.216 5.119
259 HA LEU 37 HA LEU 37 17.595 29.957 6.645
260 HB2 LEU 37 1HB LEU 37 16.574 29.270 4.757
261 HB3 LEU 37 2HB LEU 37 16.636 30.982 4.656
262 HG LEU 37 HG LEU 37 18.278 30.844 2.852
263 HD11 LEU 37 1HD1 LEU 37 19.141 28.608 3.091
264 HD12 LEU 37 2HD1 LEU 37 18.291 28.738 1.549
265 HD13 LEU 37 3HD1 LEU 37 17.513 27.920 2.931
266 HD21 LEU 37 1HD2 LEU 37 16.504 30.302 1.218
267 HD22 LEU 37 2HD2 LEU 37 15.900 31.313 2.544
268 HD23 LEU 37 3HD2 LEU 37 15.543 29.568 2.520
269 H LEU 38 H LEU 38 20.307 30.706 4.610
270 HA LEU 38 HA LEU 38 21.244 28.069 4.316
271 HB2 LEU 38 1HB LEU 38 21.915 30.103 3.102
272 HB3 LEU 38 2HB LEU 38 22.835 30.629 4.525
273 HG LEU 38 HG LEU 38 24.162 28.502 4.438
274 HD11 LEU 38 1HD1 LEU 38 22.671 27.118 3.158
275 HD12 LEU 38 2HD1 LEU 38 24.194 27.288 2.273
276 HD13 LEU 38 3HD1 LEU 38 22.765 28.221 1.766
277 HD21 LEU 38 1HD2 LEU 38 25.667 29.209 2.711
278 HD22 LEU 38 2HD2 LEU 38 25.007 30.643 3.526
279 HD23 LEU 38 3HD2 LEU 38 24.384 30.158 1.934
280 H LYS 39 H LYS 39 22.012 30.486 6.870
281 HA LYS 39 HA LYS 39 23.677 28.567 8.279
282 HB2 LYS 39 1HB LYS 39 23.400 30.091 10.262
283 HB3 LYS 39 2HB LYS 39 24.161 30.769 8.823
284 HG2 LYS 39 1HG LYS 39 22.141 31.948 8.249
285 HG3 LYS 39 2HG LYS 39 21.245 31.206 9.541
286 HD2 LYS 39 1HD LYS 39 21.810 33.385 10.280
287 HD3 LYS 39 2HD LYS 39 22.912 32.292 11.144
288 HE2 LYS 39 1HE LYS 39 24.695 32.788 9.503
289 HE3 LYS 39 2HE LYS 39 23.581 33.826 8.592
290 HZ1 LYS 39 1HZ LYS 39 25.014 35.112 10.046
291 HZ2 LYS 39 2HZ LYS 39 24.470 34.303 11.377
292 HZ3 LYS 39 3HZ LYS 39 23.443 35.271 10.522
293 H GLU 40 H GLU 40 20.210 29.069 8.231
294 HA GLU 40 HA GLU 40 19.783 27.513 10.662
295 HB2 GLU 40 1HB GLU 40 18.154 29.187 9.719
296 HB3 GLU 40 2HB GLU 40 17.882 28.091 8.362
297 HG2 GLU 40 1HG GLU 40 17.207 26.338 10.096
298 HG3 GLU 40 2HG GLU 40 17.188 27.659 11.275
299 H ARG 41 H ARG 41 19.431 26.884 7.138
300 HA ARG 41 HA ARG 41 18.816 24.056 7.625
301 HB2 ARG 41 1HB ARG 41 19.415 25.594 5.071
302 HB3 ARG 41 2HB ARG 41 18.792 23.942 5.133
303 HG2 ARG 41 1HG ARG 41 17.340 26.352 6.288
304 HG3 ARG 41 2HG ARG 41 17.082 25.702 4.667
305 HD2 ARG 41 1HD ARG 41 15.706 24.119 5.461
306 HD3 ARG 41 2HD ARG 41 16.949 23.552 6.588
307 HE ARG 41 HE ARG 41 15.655 25.999 7.502
308 HH11 ARG 41 1HH1 ARG 41 15.317 22.474 7.472
309 HH12 ARG 41 2HH1 ARG 41 14.279 22.480 8.870
310 HH21 ARG 41 1HH2 ARG 41 14.345 25.933 9.232
311 HH22 ARG 41 2HH2 ARG 41 13.735 24.414 9.862
312 H ASN 42 H ASN 42 21.681 25.821 6.535
313 HA ASN 42 HA ASN 42 23.181 23.229 6.488
314 HB2 ASN 42 1HB ASN 42 22.484 24.147 4.191
315 HB3 ASN 42 2HB ASN 42 23.620 25.446 4.466
316 HD21 ASN 42 1HD2 ASN 42 25.351 22.823 2.577
317 HD22 ASN 42 2HD2 ASN 42 24.108 24.023 2.337
318 HA PRO 43 HA PRO 43 25.267 26.637 8.856
319 HB2 PRO 43 1HB PRO 43 26.314 24.992 10.862
320 HB3 PRO 43 2HB PRO 43 24.804 25.952 10.952
321 HG2 PRO 43 1HG PRO 43 25.164 23.054 10.263
322 HG3 PRO 43 2HG PRO 43 23.957 23.829 11.332
323 HD2 PRO 43 1HD PRO 43 23.327 23.091 8.833
324 HD3 PRO 43 2HD PRO 43 22.699 24.627 9.528
325 HA PRO 44 HA PRO 44 29.379 24.579 8.242
326 HB2 PRO 44 1HB PRO 44 29.762 22.540 6.475
327 HB3 PRO 44 2HB PRO 44 29.434 22.273 8.218
328 HG2 PRO 44 1HG PRO 44 27.513 22.246 5.920
329 HG3 PRO 44 2HG PRO 44 27.773 21.008 7.188
330 HD2 PRO 44 1HD PRO 44 25.789 22.804 7.404
331 HD3 PRO 44 2HD PRO 44 26.745 22.321 8.844
332 H LEU 45 H LEU 45 27.105 24.570 5.399
333 HA LEU 45 HA LEU 45 29.189 25.703 3.683
334 HB2 LEU 45 1HB LEU 45 27.248 24.467 2.773
335 HB3 LEU 45 2HB LEU 45 26.193 25.770 3.316
336 HG LEU 45 HG LEU 45 27.256 27.337 1.772
337 HD11 LEU 45 1HD1 LEU 45 28.903 26.584 0.065
338 HD12 LEU 45 2HD1 LEU 45 29.021 25.007 0.872
339 HD13 LEU 45 3HD1 LEU 45 29.577 26.485 1.694
340 HD21 LEU 45 1HD2 LEU 45 26.459 26.365 -0.310
341 HD22 LEU 45 2HD2 LEU 45 25.379 25.900 1.014
342 HD23 LEU 45 3HD2 LEU 45 26.554 24.727 0.377
343 H ALA 46 H ALA 46 26.634 26.816 5.837
344 HA ALA 46 HA ALA 46 26.732 29.550 5.095
345 HB1 ALA 46 1HB ALA 46 26.204 28.447 7.851
346 HB2 ALA 46 2HB ALA 46 25.656 29.994 7.168
347 HB3 ALA 46 3HB ALA 46 25.022 28.463 6.525
348 H GLU 47 H GLU 47 28.632 27.843 7.704
349 HA GLU 47 HA GLU 47 29.885 30.243 8.597
350 HB2 GLU 47 1HB GLU 47 31.571 28.868 9.645
351 HB3 GLU 47 2HB GLU 47 29.966 28.178 9.904
352 HG2 GLU 47 1HG GLU 47 30.369 26.454 8.291
353 HG3 GLU 47 2HG GLU 47 31.884 27.198 7.772
354 H ALA 48 H ALA 48 30.660 28.130 5.898
355 HA ALA 48 HA ALA 48 33.155 29.171 5.234
356 HB1 ALA 48 1HB ALA 48 31.931 27.099 4.322
357 HB2 ALA 48 2HB ALA 48 31.044 28.225 3.270
358 HB3 ALA 48 3HB ALA 48 32.796 28.085 3.138
359 H LEU 49 H LEU 49 29.881 30.206 4.384
360 HA LEU 49 HA LEU 49 30.669 32.360 2.645
361 HB2 LEU 49 1HB LEU 49 28.403 31.293 2.711
362 HB3 LEU 49 2HB LEU 49 28.161 31.969 4.314
363 HG LEU 49 HG LEU 49 28.553 34.276 3.172
364 HD11 LEU 49 1HD1 LEU 49 27.780 32.513 0.826
365 HD12 LEU 49 2HD1 LEU 49 29.296 33.416 1.027
366 HD13 LEU 49 3HD1 LEU 49 27.770 34.288 0.829
367 HD21 LEU 49 1HD2 LEU 49 26.464 33.483 4.207
368 HD22 LEU 49 2HD2 LEU 49 26.027 32.669 2.686
369 HD23 LEU 49 3HD2 LEU 49 26.169 34.444 2.747
370 H LEU 50 H LEU 50 29.829 32.147 6.124
371 HA LEU 50 HA LEU 50 29.745 34.958 6.601
372 HB2 LEU 50 1HB LEU 50 30.670 32.905 8.626
373 HB3 LEU 50 2HB LEU 50 29.913 34.452 8.940
374 HG LEU 50 HG LEU 50 28.663 31.893 8.050
375 HD11 LEU 50 1HD1 LEU 50 28.111 33.706 10.368
376 HD12 LEU 50 2HD1 LEU 50 29.034 32.180 10.392
377 HD13 LEU 50 3HD1 LEU 50 27.305 32.153 10.008
378 HD21 LEU 50 1HD2 LEU 50 27.331 34.593 7.963
379 HD22 LEU 50 2HD2 LEU 50 26.478 33.024 7.903
380 HD23 LEU 50 3HD2 LEU 50 27.595 33.462 6.609
381 H SER 51 H SER 51 32.361 32.685 6.402
382 HA SER 51 HA SER 51 34.350 34.298 7.717
383 HB2 SER 51 1HB SER 51 34.278 31.784 7.306
384 HB3 SER 51 2HB SER 51 34.766 32.164 5.647
385 HG SER 51 HG SER 51 36.527 33.423 6.793
386 H GLY 52 H GLY 52 33.024 34.220 4.466
387 HA2 GLY 52 1HA GLY 52 33.347 35.863 2.838
388 HA3 GLY 52 2HA GLY 52 34.753 36.476 3.720
389 H ASP 53 H ASP 53 35.639 33.522 3.846
390 HA ASP 53 HA ASP 53 37.483 33.652 1.665
391 HB2 ASP 53 1HB ASP 53 37.851 32.410 3.855
392 HB3 ASP 53 2HB ASP 53 36.698 31.268 3.297
393 H LEU 54 H LEU 54 36.931 33.373 -0.428
394 HA LEU 54 HA LEU 54 34.648 31.843 -1.272
395 HB2 LEU 54 1HB LEU 54 35.719 33.609 -2.629
396 HB3 LEU 54 2HB LEU 54 37.153 32.615 -2.805
397 HG LEU 54 HG LEU 54 35.472 32.798 -4.718
398 HD11 LEU 54 1HD1 LEU 54 36.363 30.009 -4.028
399 HD12 LEU 54 2HD1 LEU 54 37.411 31.272 -4.706
400 HD13 LEU 54 3HD1 LEU 54 36.026 30.671 -5.638
401 HD21 LEU 54 1HD2 LEU 54 33.688 31.181 -4.878
402 HD22 LEU 54 2HD2 LEU 54 33.408 32.267 -3.509
403 HD23 LEU 54 3HD2 LEU 54 34.009 30.618 -3.231
404 H GLU 55 H GLU 55 38.105 31.079 -0.719
405 HA GLU 55 HA GLU 55 38.085 28.608 -2.126
406 HB2 GLU 55 1HB GLU 55 39.729 29.316 0.324
407 HB3 GLU 55 2HB GLU 55 40.065 28.024 -0.825
408 HG2 GLU 55 1HG GLU 55 39.794 30.493 -2.276
409 HG3 GLU 55 2HG GLU 55 40.890 30.758 -0.912
410 H LYS 56 H LYS 56 37.494 29.242 1.403
411 HA LYS 56 HA LYS 56 36.830 26.477 1.853
412 HB2 LYS 56 1HB LYS 56 36.209 27.024 4.040
413 HB3 LYS 56 2HB LYS 56 37.466 28.246 3.628
414 HG2 LYS 56 1HG LYS 56 35.505 29.712 3.131
415 HG3 LYS 56 2HG LYS 56 34.589 28.506 4.009
416 HD2 LYS 56 1HD LYS 56 37.146 29.548 5.198
417 HD3 LYS 56 2HD LYS 56 35.683 30.501 5.291
418 HE2 LYS 56 1HE LYS 56 34.507 28.644 6.436
419 HE3 LYS 56 2HE LYS 56 36.003 27.691 6.383
420 HZ1 LYS 56 1HZ LYS 56 35.650 28.849 8.506
421 HZ2 LYS 56 2HZ LYS 56 35.715 30.312 7.740
422 HZ3 LYS 56 3HZ LYS 56 37.046 29.341 7.775
423 H PHE 57 H PHE 57 34.887 29.310 0.859
424 HA PHE 57 HA PHE 57 32.368 28.005 1.162
425 HB2 PHE 57 1HB PHE 57 32.621 30.432 0.813
426 HB3 PHE 57 2HB PHE 57 33.164 30.129 -0.845
427 HD1 PHE 57 HD1 PHE 57 30.258 29.772 1.474
428 HD2 PHE 57 HD2 PHE 57 31.608 29.761 -2.614
429 HE1 PHE 57 HE1 PHE 57 27.893 29.776 0.695
430 HE2 PHE 57 HE2 PHE 57 29.246 29.751 -3.392
431 HZ PHE 57 HZ PHE 57 27.392 29.773 -1.753
432 H SER 58 H SER 58 34.478 28.235 -1.750
433 HA SER 58 HA SER 58 32.817 26.590 -3.375
434 HB2 SER 58 1HB SER 58 34.623 28.074 -4.214
435 HB3 SER 58 2HB SER 58 35.832 27.033 -3.439
436 HG SER 58 HG SER 58 35.663 26.428 -5.572
437 H ARG 59 H ARG 59 35.542 25.773 -1.205
438 HA ARG 59 HA ARG 59 35.709 23.035 -2.042
439 HB2 ARG 59 1HB ARG 59 37.461 24.203 -0.773
440 HB3 ARG 59 2HB ARG 59 36.380 24.354 0.612
441 HG2 ARG 59 1HG ARG 59 36.753 21.569 -0.352
442 HG3 ARG 59 2HG ARG 59 38.244 22.342 0.208
443 HD2 ARG 59 1HD ARG 59 35.668 22.206 1.819
444 HD3 ARG 59 2HD ARG 59 37.034 21.088 1.997
445 HE ARG 59 HE ARG 59 38.043 23.717 2.230
446 HH11 ARG 59 1HH1 ARG 59 35.949 21.548 4.064
447 HH12 ARG 59 2HH1 ARG 59 36.347 22.298 5.588
448 HH21 ARG 59 1HH2 ARG 59 38.514 24.617 4.205
449 HH22 ARG 59 2HH2 ARG 59 37.782 24.002 5.662
450 H VAL 60 H VAL 60 33.890 24.617 0.618
451 HA VAL 60 HA VAL 60 32.734 22.123 1.501
452 HB VAL 60 HB VAL 60 31.828 25.000 1.987
453 HG11 VAL 60 1HG1 VAL 60 30.954 22.370 3.257
454 HG12 VAL 60 2HG1 VAL 60 30.603 23.976 3.937
455 HG13 VAL 60 3HG1 VAL 60 29.943 23.522 2.356
456 HG21 VAL 60 1HG2 VAL 60 33.353 23.052 3.789
457 HG22 VAL 60 2HG2 VAL 60 34.103 24.389 2.897
458 HG23 VAL 60 3HG2 VAL 60 32.920 24.735 4.170
459 H LEU 61 H LEU 61 31.858 24.569 -0.944
460 HA LEU 61 HA LEU 61 29.203 23.741 -1.417
461 HB2 LEU 61 1HB LEU 61 30.602 25.668 -2.485
462 HB3 LEU 61 2HB LEU 61 31.109 24.456 -3.651
463 HG LEU 61 HG LEU 61 28.469 24.090 -3.863
464 HD11 LEU 61 1HD1 LEU 61 27.286 26.209 -3.611
465 HD12 LEU 61 2HD1 LEU 61 28.779 27.006 -3.047
466 HD13 LEU 61 3HD1 LEU 61 28.006 25.736 -2.059
467 HD21 LEU 61 1HD2 LEU 61 29.574 26.577 -5.158
468 HD22 LEU 61 2HD2 LEU 61 28.504 25.349 -5.829
469 HD23 LEU 61 3HD2 LEU 61 30.222 24.978 -5.593
470 H VAL 62 H VAL 62 32.281 22.376 -2.717
471 HA VAL 62 HA VAL 62 30.935 20.427 -4.369
472 HB VAL 62 HB VAL 62 33.741 20.293 -3.159
473 HG11 VAL 62 1HG1 VAL 62 32.436 18.724 -5.448
474 HG12 VAL 62 2HG1 VAL 62 34.178 18.702 -5.069
475 HG13 VAL 62 3HG1 VAL 62 33.009 18.063 -3.898
476 HG21 VAL 62 1HG2 VAL 62 34.471 21.094 -5.394
477 HG22 VAL 62 2HG2 VAL 62 32.767 21.308 -5.861
478 HG23 VAL 62 3HG2 VAL 62 33.468 22.281 -4.549
479 H GLU 63 H GLU 63 32.313 20.288 -1.060
480 HA GLU 63 HA GLU 63 31.760 17.526 -0.599
481 HB2 GLU 63 1HB GLU 63 31.777 19.882 1.332
482 HB3 GLU 63 2HB GLU 63 31.713 18.188 1.826
483 HG2 GLU 63 1HG GLU 63 33.963 19.529 0.300
484 HG3 GLU 63 2HG GLU 63 33.985 19.053 2.002
485 H GLN 64 H GLN 64 29.733 20.430 -0.186
486 HA GLN 64 HA GLN 64 27.474 18.999 0.904
487 HB2 GLN 64 1HB GLN 64 27.774 21.679 -0.483
488 HB3 GLN 64 2HB GLN 64 26.218 21.072 0.100
489 HG2 GLN 64 1HG GLN 64 28.671 21.498 1.828
490 HG3 GLN 64 2HG GLN 64 27.302 22.605 1.701
491 HE21 GLN 64 1HE2 GLN 64 27.156 19.741 4.394
492 HE22 GLN 64 2HE2 GLN 64 28.604 20.382 3.657
493 H GLN 65 H GLN 65 28.545 19.762 -2.429
494 HA GLN 65 HA GLN 65 26.088 18.869 -3.631
495 HB2 GLN 65 1HB GLN 65 28.902 19.169 -4.671
496 HB3 GLN 65 2HB GLN 65 27.629 18.438 -5.651
497 HG2 GLN 65 1HG GLN 65 26.265 20.457 -5.449
498 HG3 GLN 65 2HG GLN 65 27.495 21.206 -4.432
499 HE21 GLN 65 1HE2 GLN 65 29.183 22.532 -7.141
500 HE22 GLN 65 2HE2 GLN 65 28.790 22.571 -5.436
501 H GLN 66 H GLN 66 28.988 17.097 -2.454
502 HA GLN 66 HA GLN 66 28.268 14.627 -3.716
503 HB2 GLN 66 1HB GLN 66 29.645 15.015 -1.031
504 HB3 GLN 66 2HB GLN 66 29.653 13.557 -2.016
505 HG2 GLN 66 1HG GLN 66 30.950 16.207 -2.616
506 HG3 GLN 66 2HG GLN 66 31.742 14.688 -2.302
507 HE21 GLN 66 1HE2 GLN 66 31.022 15.739 -6.032
508 HE22 GLN 66 2HE2 GLN 66 31.137 16.804 -4.646
509 H ASP 67 H ASP 67 27.449 16.042 -0.529
510 HA ASP 67 HA ASP 67 25.802 13.857 0.358
511 HB2 ASP 67 1HB ASP 67 26.701 15.665 1.826
512 HB3 ASP 67 2HB ASP 67 25.631 16.797 1.016
513 H ARG 68 H ARG 68 25.138 16.867 -1.401
514 HA ARG 68 HA ARG 68 22.291 16.578 -1.407
515 HB2 ARG 68 1HB ARG 68 24.155 18.009 -3.305
516 HB3 ARG 68 2HB ARG 68 22.418 17.907 -3.587
517 HG2 ARG 68 1HG ARG 68 22.082 18.900 -1.271
518 HG3 ARG 68 2HG ARG 68 23.815 19.263 -1.283
519 HD2 ARG 68 1HD ARG 68 22.999 21.215 -2.152
520 HD3 ARG 68 2HD ARG 68 23.254 20.304 -3.651
521 HE ARG 68 HE ARG 68 20.758 19.655 -3.397
522 HH11 ARG 68 1HH1 ARG 68 21.996 22.777 -2.266
523 HH12 ARG 68 2HH1 ARG 68 20.445 23.544 -2.442
524 HH21 ARG 68 1HH2 ARG 68 18.859 20.680 -3.591
525 HH22 ARG 68 2HH2 ARG 68 18.697 22.387 -3.206
526 H ALA 69 H ALA 69 24.828 15.391 -3.652
527 HA ALA 69 HA ALA 69 23.051 14.296 -5.534
528 HB1 ALA 69 1HB ALA 69 25.727 13.185 -4.628
529 HB2 ALA 69 2HB ALA 69 24.891 12.814 -6.153
530 HB3 ALA 69 3HB ALA 69 25.482 14.463 -5.842
531 H ARG 70 H ARG 70 23.943 12.983 -2.312
532 HA ARG 70 HA ARG 70 22.771 10.416 -2.886
533 HB2 ARG 70 1HB ARG 70 23.874 9.900 -1.026
534 HB3 ARG 70 2HB ARG 70 24.481 11.568 -1.029
535 HG2 ARG 70 1HG ARG 70 22.920 12.269 0.575
536 HG3 ARG 70 2HG ARG 70 21.959 10.807 0.384
537 HD2 ARG 70 1HD ARG 70 23.228 9.696 1.856
538 HD3 ARG 70 2HD ARG 70 24.707 10.175 0.995
539 HE ARG 70 HE ARG 70 24.086 12.476 2.308
540 HH11 ARG 70 1HH1 ARG 70 24.383 9.150 3.502
541 HH12 ARG 70 2HH1 ARG 70 24.908 9.678 5.076
542 HH21 ARG 70 1HH2 ARG 70 24.741 13.057 4.279
543 HH22 ARG 70 2HH2 ARG 70 25.102 11.870 5.522
544 H ARG 71 H ARG 71 21.639 13.354 -1.133
545 HA ARG 71 HA ARG 71 19.056 12.064 -0.584
546 HB2 ARG 71 1HB ARG 71 18.573 14.044 0.685
547 HB3 ARG 71 2HB ARG 71 20.176 13.416 1.067
548 HG2 ARG 71 1HG ARG 71 20.930 15.223 -0.713
549 HG3 ARG 71 2HG ARG 71 19.403 15.983 -0.248
550 HD2 ARG 71 1HD ARG 71 21.643 15.126 1.631
551 HD3 ARG 71 2HD ARG 71 21.309 16.789 1.116
552 HE ARG 71 HE ARG 71 18.946 15.732 2.257
553 HH11 ARG 71 1HH1 ARG 71 22.201 16.633 3.338
554 HH12 ARG 71 2HH1 ARG 71 21.632 17.044 4.941
555 HH21 ARG 71 1HH2 ARG 71 18.328 16.248 4.328
556 HH22 ARG 71 2HH2 ARG 71 19.497 16.817 5.489
557 H GLU 72 H GLU 72 20.182 14.437 -2.911
558 HA GLU 72 HA GLU 72 17.646 15.665 -3.385
559 HB2 GLU 72 1HB GLU 72 20.006 16.454 -4.026
560 HB3 GLU 72 2HB GLU 72 19.868 15.384 -5.427
561 HG2 GLU 72 1HG GLU 72 19.258 17.534 -6.146
562 HG3 GLU 72 2HG GLU 72 17.744 16.632 -5.976
563 H GLN 73 H GLN 73 19.211 12.771 -4.688
564 HA GLN 73 HA GLN 73 17.488 12.320 -6.898
565 HB2 GLN 73 1HB GLN 73 18.952 10.397 -5.071
566 HB3 GLN 73 2HB GLN 73 18.060 9.895 -6.517
567 HG2 GLN 73 1HG GLN 73 19.492 11.384 -7.895
568 HG3 GLN 73 2HG GLN 73 20.431 11.778 -6.452
569 HE21 GLN 73 1HE2 GLN 73 22.470 8.989 -6.734
570 HE22 GLN 73 2HE2 GLN 73 22.158 10.568 -6.032
571 H GLU 74 H GLU 74 17.049 11.712 -3.424
572 HA GLU 74 HA GLU 74 14.661 10.119 -3.743
573 HB2 GLU 74 1HB GLU 74 15.568 11.804 -1.383
574 HB3 GLU 74 2HB GLU 74 14.352 10.528 -1.346
575 HG2 GLU 74 1HG GLU 74 16.081 8.867 -1.945
576 HG3 GLU 74 2HG GLU 74 17.306 10.148 -1.963
577 H ARG 75 H ARG 75 15.348 13.593 -3.446
578 HA ARG 75 HA ARG 75 12.583 14.356 -3.028
579 HB2 ARG 75 1HB ARG 75 14.944 15.983 -4.020
580 HB3 ARG 75 2HB ARG 75 13.360 16.631 -3.584
581 HG2 ARG 75 1HG ARG 75 13.676 15.693 -1.279
582 HG3 ARG 75 2HG ARG 75 15.323 15.231 -1.745
583 HD2 ARG 75 1HD ARG 75 15.468 17.314 -0.601
584 HD3 ARG 75 2HD ARG 75 15.758 17.636 -2.310
585 HE ARG 75 HE ARG 75 13.260 18.263 -0.806
586 HH11 ARG 75 1HH1 ARG 75 15.298 18.870 -3.663
587 HH12 ARG 75 2HH1 ARG 75 14.281 20.197 -4.173
588 HH21 ARG 75 1HH2 ARG 75 12.055 19.960 -1.555
589 HH22 ARG 75 2HH2 ARG 75 12.509 20.801 -3.011
590 H ILE 76 H ILE 76 14.748 14.569 -5.883
591 HA ILE 76 HA ILE 76 12.707 15.550 -7.624
592 HB ILE 76 HB ILE 76 14.220 15.130 -9.470
593 HG12 ILE 76 1HG1 ILE 76 15.863 13.530 -7.484
594 HG13 ILE 76 2HG1 ILE 76 14.968 12.873 -8.845
595 HG21 ILE 76 1HG2 ILE 76 15.853 16.068 -7.062
596 HG22 ILE 76 2HG2 ILE 76 16.046 16.557 -8.757
597 HG23 ILE 76 3HG2 ILE 76 14.605 17.053 -7.853
598 HD11 ILE 76 1HD1 ILE 76 17.301 12.942 -9.444
599 HD12 ILE 76 2HD1 ILE 76 16.473 14.197 -10.388
600 HD13 ILE 76 3HD1 ILE 76 17.443 14.645 -8.966
601 H ARG 77 H ARG 77 13.279 12.408 -6.416
602 HA ARG 77 HA ARG 77 12.108 10.799 -8.453
603 HB2 ARG 77 1HB ARG 77 13.079 10.485 -5.850
604 HB3 ARG 77 2HB ARG 77 11.376 10.088 -5.690
605 HG2 ARG 77 1HG ARG 77 13.227 8.810 -7.732
606 HG3 ARG 77 2HG ARG 77 12.912 8.148 -6.114
607 HD2 ARG 77 1HD ARG 77 10.457 8.188 -6.667
608 HD3 ARG 77 2HD ARG 77 10.902 8.595 -8.335
609 HE ARG 77 HE ARG 77 12.347 6.283 -7.542
610 HH11 ARG 77 1HH1 ARG 77 9.041 7.233 -8.304
611 HH12 ARG 77 2HH1 ARG 77 8.586 5.626 -8.807
612 HH21 ARG 77 1HH2 ARG 77 11.708 4.251 -8.203
613 HH22 ARG 77 2HH2 ARG 77 10.082 3.967 -8.762
614 H LEU 78 H LEU 78 10.719 13.234 -6.412
615 HA LEU 78 HA LEU 78 8.023 12.410 -7.376
616 HB2 LEU 78 1HB LEU 78 8.385 11.912 -4.945
617 HB3 LEU 78 2HB LEU 78 8.645 13.632 -4.671
618 HG LEU 78 HG LEU 78 6.328 14.081 -5.459
619 HD11 LEU 78 1HD1 LEU 78 4.739 12.164 -5.596
620 HD12 LEU 78 2HD1 LEU 78 6.131 11.052 -5.562
621 HD13 LEU 78 3HD1 LEU 78 5.922 12.193 -6.914
622 HD21 LEU 78 1HD2 LEU 78 6.558 12.056 -3.200
623 HD22 LEU 78 2HD2 LEU 78 5.219 13.203 -3.445
624 HD23 LEU 78 3HD2 LEU 78 6.844 13.808 -3.067
625 H PHE 79 H PHE 79 9.904 15.199 -6.030
626 HA PHE 79 HA PHE 79 8.619 16.930 -8.086
627 HB2 PHE 79 1HB PHE 79 8.675 17.556 -5.101
628 HB3 PHE 79 2HB PHE 79 8.244 18.703 -6.371
629 HD1 PHE 79 HD1 PHE 79 6.889 16.625 -3.940
630 HD2 PHE 79 HD2 PHE 79 6.327 17.724 -8.062
631 HE1 PHE 79 HE1 PHE 79 4.500 15.932 -3.794
632 HE2 PHE 79 HE2 PHE 79 3.943 17.023 -7.927
633 HZ PHE 79 HZ PHE 79 3.025 16.120 -5.794
634 H SER 80 H SER 80 9.779 18.941 -8.443
635 HA SER 80 HA SER 80 12.341 19.268 -7.011
636 HB2 SER 80 1HB SER 80 12.883 18.182 -9.224
637 HB3 SER 80 2HB SER 80 12.034 19.519 -10.039
638 HG SER 80 HG SER 80 14.249 19.992 -9.922
639 H ALA 81 H ALA 81 12.940 21.555 -7.221
640 HA ALA 81 HA ALA 81 10.873 23.419 -8.123
641 HB1 ALA 81 1HB ALA 81 10.511 24.435 -5.904
642 HB2 ALA 81 2HB ALA 81 10.032 22.722 -5.876
643 HB3 ALA 81 3HB ALA 81 11.580 23.230 -5.151
644 H ASP 82 H ASP 82 13.626 22.938 -8.856
645 HA ASP 82 HA ASP 82 15.210 25.119 -7.687
646 HB2 ASP 82 1HB ASP 82 15.613 22.866 -9.554
647 HB3 ASP 82 2HB ASP 82 16.340 24.371 -10.136
648 HA PRO 83 HA PRO 83 13.368 27.924 -10.549
649 HB2 PRO 83 1HB PRO 83 15.251 29.840 -10.928
650 HB3 PRO 83 2HB PRO 83 14.424 29.632 -9.354
651 HG2 PRO 83 1HG PRO 83 17.071 28.631 -10.253
652 HG3 PRO 83 2HG PRO 83 16.656 29.508 -8.757
653 HD2 PRO 83 1HD PRO 83 16.913 26.782 -8.849
654 HD3 PRO 83 2HD PRO 83 15.726 27.590 -7.767
655 H PHE 84 H PHE 84 13.483 28.645 -12.788
656 HA PHE 84 HA PHE 84 14.789 26.533 -14.367
657 HB2 PHE 84 1HB PHE 84 13.131 27.172 -16.099
658 HB3 PHE 84 2HB PHE 84 12.388 26.741 -14.556
659 HD1 PHE 84 HD1 PHE 84 13.203 29.574 -16.828
660 HD2 PHE 84 HD2 PHE 84 11.135 28.342 -13.257
661 HE1 PHE 84 HE1 PHE 84 12.012 31.756 -16.775
662 HE2 PHE 84 HE2 PHE 84 9.936 30.527 -13.196
663 HZ PHE 84 HZ PHE 84 10.376 32.241 -14.953
664 H ASP 85 H ASP 85 16.032 29.197 -13.463
665 HA ASP 85 HA ASP 85 16.591 30.630 -15.922
666 HB2 ASP 85 1HB ASP 85 17.944 30.756 -13.207
667 HB3 ASP 85 2HB ASP 85 18.166 31.915 -14.527
668 H LEU 86 H LEU 86 17.157 27.991 -16.369
669 HA LEU 86 HA LEU 86 19.955 27.284 -16.094
670 HB2 LEU 86 1HB LEU 86 17.805 26.424 -18.071
671 HB3 LEU 86 2HB LEU 86 19.348 25.603 -17.850
672 HG LEU 86 HG LEU 86 17.321 25.877 -15.607
673 HD11 LEU 86 1HD1 LEU 86 17.585 23.598 -17.603
674 HD12 LEU 86 2HD1 LEU 86 16.234 24.754 -17.505
675 HD13 LEU 86 3HD1 LEU 86 16.530 23.630 -16.167
676 HD21 LEU 86 1HD2 LEU 86 19.562 23.884 -16.100
677 HD22 LEU 86 2HD2 LEU 86 18.506 23.970 -14.668
678 HD23 LEU 86 3HD2 LEU 86 19.651 25.280 -15.013
679 H GLU 87 H GLU 87 17.993 29.139 -18.289
680 HA GLU 87 HA GLU 87 19.893 29.306 -20.460
681 HB2 GLU 87 1HB GLU 87 18.404 31.068 -21.268
682 HB3 GLU 87 2HB GLU 87 17.520 29.634 -20.756
683 HG2 GLU 87 1HG GLU 87 16.866 30.754 -18.661
684 HG3 GLU 87 2HG GLU 87 17.735 32.209 -19.179
685 H ALA 88 H ALA 88 19.336 31.073 -17.550
686 HA ALA 88 HA ALA 88 20.783 33.446 -18.319
687 HB1 ALA 88 1HB ALA 88 20.350 34.214 -16.076
688 HB2 ALA 88 2HB ALA 88 18.897 33.385 -16.679
689 HB3 ALA 88 3HB ALA 88 19.986 32.563 -15.532
690 H GLN 89 H GLN 89 22.280 30.660 -18.111
691 HA GLN 89 HA GLN 89 24.259 31.358 -16.036
692 HB2 GLN 89 1HB GLN 89 24.151 28.982 -17.899
693 HB3 GLN 89 2HB GLN 89 25.253 29.186 -16.537
694 HG2 GLN 89 1HG GLN 89 22.232 28.944 -16.388
695 HG3 GLN 89 2HG GLN 89 23.407 27.718 -15.906
696 HE21 GLN 89 1HE2 GLN 89 22.210 30.518 -13.328
697 HE22 GLN 89 2HE2 GLN 89 21.420 30.164 -14.849
698 H ALA 90 H ALA 90 26.071 32.335 -16.341
699 HA ALA 90 HA ALA 90 27.592 32.160 -18.835
700 HB1 ALA 90 1HB ALA 90 25.962 33.967 -19.381
701 HB2 ALA 90 2HB ALA 90 26.428 34.836 -17.899
702 HB3 ALA 90 3HB ALA 90 27.606 34.623 -19.216
703 H LYS 91 H LYS 91 29.689 33.421 -18.552
704 HA LYS 91 HA LYS 91 30.372 33.946 -15.699
705 HB2 LYS 91 1HB LYS 91 31.835 32.132 -17.650
706 HB3 LYS 91 2HB LYS 91 32.655 32.893 -16.279
707 HG2 LYS 91 1HG LYS 91 31.121 31.823 -14.717
708 HG3 LYS 91 2HG LYS 91 30.223 31.096 -16.055
709 HD2 LYS 91 1HD LYS 91 32.211 29.778 -16.690
710 HD3 LYS 91 2HD LYS 91 33.120 30.497 -15.333
711 HE2 LYS 91 1HE LYS 91 31.554 29.575 -13.723
712 HE3 LYS 91 2HE LYS 91 30.471 29.047 -15.008
713 HZ1 LYS 91 1HZ LYS 91 32.218 27.447 -15.668
714 HZ2 LYS 91 2HZ LYS 91 31.575 27.172 -14.174
715 HZ3 LYS 91 3HZ LYS 91 33.078 27.853 -14.318
716 H ILE 92 H ILE 92 31.714 35.680 -15.440
717 HA ILE 92 HA ILE 92 32.915 36.962 -17.819
718 HB ILE 92 HB ILE 92 31.196 38.413 -15.715
719 HG12 ILE 92 1HG1 ILE 92 30.732 38.153 -18.718
720 HG13 ILE 92 2HG1 ILE 92 29.892 37.196 -17.497
721 HG21 ILE 92 1HG2 ILE 92 33.224 39.717 -16.424
722 HG22 ILE 92 2HG2 ILE 92 32.726 39.553 -18.124
723 HG23 ILE 92 3HG2 ILE 92 31.731 40.486 -16.981
724 HD11 ILE 92 1HD1 ILE 92 29.679 40.205 -17.901
725 HD12 ILE 92 2HD1 ILE 92 28.425 38.980 -18.174
726 HD13 ILE 92 3HD1 ILE 92 28.970 39.331 -16.520
727 H GLU 93 H GLU 93 34.948 37.514 -17.265
728 HA GLU 93 HA GLU 93 35.735 37.608 -14.402
729 HB2 GLU 93 1HB GLU 93 37.816 36.488 -15.060
730 HB3 GLU 93 2HB GLU 93 36.407 35.466 -15.334
731 HG2 GLU 93 1HG GLU 93 36.496 36.162 -17.773
732 HG3 GLU 93 2HG GLU 93 38.047 36.944 -17.422
733 H GLU 94 H GLU 94 37.950 38.838 -14.288
734 HA GLU 94 HA GLU 94 37.873 41.025 -16.308
735 HB2 GLU 94 1HB GLU 94 38.045 42.680 -14.538
736 HB3 GLU 94 2HB GLU 94 36.606 41.691 -14.336
737 HG2 GLU 94 1HG GLU 94 37.286 41.742 -12.157
738 HG3 GLU 94 2HG GLU 94 38.156 40.292 -12.665
739 H ASP 95 H ASP 95 39.689 42.218 -16.655
740 HA ASP 95 HA ASP 95 42.182 41.495 -15.244
741 HB2 ASP 95 1HB ASP 95 42.091 40.126 -17.366
742 HB3 ASP 95 2HB ASP 95 42.006 41.637 -18.283
743 H ILE 96 H ILE 96 40.865 43.637 -14.509
744 HA ILE 96 HA ILE 96 41.653 45.909 -16.260
745 HB ILE 96 HB ILE 96 40.463 47.370 -14.648
746 HG12 ILE 96 1HG1 ILE 96 39.390 44.904 -13.276
747 HG13 ILE 96 2HG1 ILE 96 40.845 45.693 -12.674
748 HG21 ILE 96 1HG2 ILE 96 38.195 46.639 -15.259
749 HG22 ILE 96 2HG2 ILE 96 39.298 46.312 -16.610
750 HG23 ILE 96 3HG2 ILE 96 38.771 44.982 -15.555
751 HD11 ILE 96 1HD1 ILE 96 38.093 46.964 -12.941
752 HD12 ILE 96 2HD1 ILE 96 38.892 46.461 -11.436
753 HD13 ILE 96 3HD1 ILE 96 39.564 47.805 -12.389
754 H ARG 97 H ARG 97 43.809 44.479 -15.507
755 HA ARG 97 HA ARG 97 45.045 45.696 -13.127
756 HB2 ARG 97 1HB ARG 97 46.209 43.917 -15.297
757 HB3 ARG 97 2HB ARG 97 47.017 44.343 -13.789
758 HG2 ARG 97 1HG ARG 97 44.425 42.753 -13.961
759 HG3 ARG 97 2HG ARG 97 46.036 42.048 -13.827
760 HD2 ARG 97 1HD ARG 97 45.394 42.007 -11.626
761 HD3 ARG 97 2HD ARG 97 46.227 43.566 -11.681
762 HE ARG 97 HE ARG 97 44.210 44.646 -11.301
763 HH11 ARG 97 1HH1 ARG 97 43.443 41.296 -12.180
764 HH12 ARG 97 2HH1 ARG 97 41.759 41.503 -11.746
765 HH21 ARG 97 1HH2 ARG 97 42.053 44.765 -10.766
766 HH22 ARG 97 2HH2 ARG 97 41.012 43.367 -10.981
767 H GLN 98 H GLN 98 44.279 47.152 -15.726
768 HA GLN 98 HA GLN 98 44.898 49.015 -16.850
769 HB2 GLN 98 1HB GLN 98 45.381 49.797 -14.504
770 HB3 GLN 98 2HB GLN 98 47.077 49.381 -14.743
771 HG2 GLN 98 1HG GLN 98 47.237 50.984 -16.637
772 HG3 GLN 98 2HG GLN 98 45.514 51.347 -16.496
773 HE21 GLN 98 1HE2 GLN 98 46.516 54.083 -14.567
774 HE22 GLN 98 2HE2 GLN 98 45.882 53.534 -16.099
775 HXT GLN 98 HO GLN 98 47.698 47.431 -16.011
Start of MODEL 14
1 H1 SER 1 1H SER 1 5.561 1.466 -2.651
2 H2 SER 1 2H SER 1 4.495 2.534 -2.159
3 H3 SER 1 3H SER 1 5.592 2.889 -3.300
4 HA SER 1 HA SER 1 3.102 1.336 -3.650
5 HB2 SER 1 1HB SER 1 3.965 4.009 -4.842
6 HB3 SER 1 2HB SER 1 2.357 3.245 -4.956
7 HG SER 1 HG SER 1 2.517 4.850 -3.248
8 H GLN 2 H GLN 2 5.851 0.600 -4.209
9 HA GLN 2 HA GLN 2 7.076 -0.561 -5.793
10 HB2 GLN 2 1HB GLN 2 4.350 -0.985 -7.061
11 HB3 GLN 2 2HB GLN 2 5.816 -1.913 -7.404
12 HG2 GLN 2 1HG GLN 2 5.877 -2.577 -4.976
13 HG3 GLN 2 2HG GLN 2 4.289 -1.814 -4.788
14 HE21 GLN 2 1HE2 GLN 2 2.680 -4.272 -6.939
15 HE22 GLN 2 2HE2 GLN 2 2.758 -2.536 -6.748
16 H GLN 3 H GLN 3 7.685 1.861 -6.266
17 HA GLN 3 HA GLN 3 7.046 2.545 -9.089
18 HB2 GLN 3 1HB GLN 3 8.317 4.138 -6.838
19 HB3 GLN 3 2HB GLN 3 8.035 4.747 -8.475
20 HG2 GLN 3 1HG GLN 3 5.629 4.517 -8.206
21 HG3 GLN 3 2HG GLN 3 5.838 3.756 -6.623
22 HE21 GLN 3 1HE2 GLN 3 5.562 7.713 -6.869
23 HE22 GLN 3 2HE2 GLN 3 5.190 6.621 -8.182
24 H SER 4 H SER 4 8.749 3.152 -10.535
25 HA SER 4 HA SER 4 10.984 1.391 -10.519
26 HB2 SER 4 1HB SER 4 10.667 3.988 -12.069
27 HB3 SER 4 2HB SER 4 11.687 2.597 -12.502
28 HG SER 4 HG SER 4 9.762 2.485 -13.654
29 H HIS 5 H HIS 5 13.126 1.684 -10.038
30 HA HIS 5 HA HIS 5 13.987 4.283 -8.871
31 HB2 HIS 5 1HB HIS 5 15.029 2.897 -6.991
32 HB3 HIS 5 2HB HIS 5 13.280 3.120 -6.937
33 HD1 HIS 5 HD1 HIS 5 11.752 1.018 -7.418
34 HD2 HIS 5 HD2 HIS 5 15.861 0.261 -7.382
35 HE1 HIS 5 HE1 HIS 5 12.047 -1.496 -7.317
36 H SER 6 H SER 6 14.595 3.409 -11.402
37 HA SER 6 HA SER 6 17.477 2.757 -11.150
38 HB2 SER 6 1HB SER 6 15.699 1.228 -13.070
39 HB3 SER 6 2HB SER 6 17.396 0.907 -12.651
40 HG SER 6 HG SER 6 16.489 0.651 -10.412
41 H SER 7 H SER 7 15.464 4.987 -12.247
42 HA SER 7 HA SER 7 16.275 5.031 -15.068
43 HB2 SER 7 1HB SER 7 13.993 5.680 -14.138
44 HB3 SER 7 2HB SER 7 14.763 7.162 -13.537
45 HG SER 7 HG SER 7 14.957 7.883 -15.544
46 HA PRO 8 HA PRO 8 19.763 7.607 -14.048
47 HB2 PRO 8 1HB PRO 8 20.742 8.137 -16.459
48 HB3 PRO 8 2HB PRO 8 20.686 6.472 -15.824
49 HG2 PRO 8 1HG PRO 8 18.770 7.840 -17.694
50 HG3 PRO 8 2HG PRO 8 19.595 6.262 -17.898
51 HD2 PRO 8 1HD PRO 8 17.053 6.493 -16.905
52 HD3 PRO 8 2HD PRO 8 18.181 5.193 -16.390
53 H GLY 9 H GLY 9 17.579 9.025 -13.645
54 HA2 GLY 9 1HA GLY 9 17.262 11.345 -15.300
55 HA3 GLY 9 2HA GLY 9 16.551 11.090 -13.710
56 H GLU 10 H GLU 10 20.022 11.335 -14.630
57 HA GLU 10 HA GLU 10 20.224 13.466 -12.594
58 HB2 GLU 10 1HB GLU 10 21.682 11.197 -12.973
59 HB3 GLU 10 2HB GLU 10 22.693 12.359 -13.820
60 HG2 GLU 10 1HG GLU 10 23.356 13.409 -11.900
61 HG3 GLU 10 2HG GLU 10 21.776 13.237 -11.130
62 H ILE 11 H ILE 11 19.340 13.648 -15.412
63 HA ILE 11 HA ILE 11 21.153 15.286 -16.804
64 HB ILE 11 HB ILE 11 18.375 15.284 -17.639
65 HG12 ILE 11 1HG1 ILE 11 19.483 12.538 -17.054
66 HG13 ILE 11 2HG1 ILE 11 18.068 13.287 -16.287
67 HG21 ILE 11 1HG2 ILE 11 20.471 15.518 -18.978
68 HG22 ILE 11 2HG2 ILE 11 20.761 13.796 -18.630
69 HG23 ILE 11 3HG2 ILE 11 19.358 14.294 -19.619
70 HD11 ILE 11 1HD1 ILE 11 16.978 13.345 -18.569
71 HD12 ILE 11 2HD1 ILE 11 18.323 12.328 -19.143
72 HD13 ILE 11 3HD1 ILE 11 17.248 11.733 -17.864
73 H THR 12 H THR 12 20.349 16.302 -14.129
74 HA THR 12 HA THR 12 18.483 18.502 -14.666
75 HB THR 12 HB THR 12 18.450 17.447 -12.439
76 HG1 THR 12 HG1 THR 12 19.522 20.081 -12.241
77 HG21 THR 12 1HG2 THR 12 20.844 16.824 -12.236
78 HG22 THR 12 2HG2 THR 12 20.278 17.757 -10.836
79 HG23 THR 12 3HG2 THR 12 21.270 18.545 -12.082
80 H SER 13 H SER 13 18.971 20.675 -14.746
81 HA SER 13 HA SER 13 21.731 21.325 -15.566
82 HB2 SER 13 1HB SER 13 20.746 23.566 -16.029
83 HB3 SER 13 2HB SER 13 19.873 22.260 -16.859
84 HG SER 13 HG SER 13 18.339 23.524 -15.922
85 H SER 14 H SER 14 22.755 23.272 -14.519
86 HA SER 14 HA SER 14 22.190 23.256 -11.585
87 HB2 SER 14 1HB SER 14 24.811 23.675 -13.058
88 HB3 SER 14 2HB SER 14 24.589 23.687 -11.297
89 HG SER 14 HG SER 14 25.277 21.633 -12.253
90 HA PRO 15 HA PRO 15 22.061 27.695 -13.092
91 HB2 PRO 15 1HB PRO 15 19.516 28.417 -12.515
92 HB3 PRO 15 2HB PRO 15 19.929 27.531 -14.009
93 HG2 PRO 15 1HG PRO 15 18.888 26.433 -11.428
94 HG3 PRO 15 2HG PRO 15 18.248 26.202 -13.087
95 HD2 PRO 15 1HD PRO 15 19.893 24.390 -11.939
96 HD3 PRO 15 2HD PRO 15 19.995 24.776 -13.691
97 H GLN 16 H GLN 16 21.270 25.945 -10.325
98 HA GLN 16 HA GLN 16 20.816 28.049 -8.420
99 HB2 GLN 16 1HB GLN 16 21.705 25.170 -8.025
100 HB3 GLN 16 2HB GLN 16 21.073 26.230 -6.759
101 HG2 GLN 16 1HG GLN 16 18.905 26.335 -7.882
102 HG3 GLN 16 2HG GLN 16 19.522 25.370 -9.229
103 HE21 GLN 16 1HE2 GLN 16 17.846 22.799 -7.455
104 HE22 GLN 16 2HE2 GLN 16 17.628 24.039 -8.666
105 H GLY 17 H GLY 17 23.378 28.350 -9.989
106 HA2 GLY 17 1HA GLY 17 25.458 29.206 -9.545
107 HA3 GLY 17 2HA GLY 17 24.965 29.347 -7.855
108 H LEU 18 H LEU 18 24.852 26.147 -9.156
109 HA LEU 18 HA LEU 18 26.778 25.256 -7.219
110 HB2 LEU 18 1HB LEU 18 25.735 23.752 -9.630
111 HB3 LEU 18 2HB LEU 18 26.442 23.060 -8.190
112 HG LEU 18 HG LEU 18 23.779 24.483 -8.391
113 HD11 LEU 18 1HD1 LEU 18 22.842 22.255 -7.905
114 HD12 LEU 18 2HD1 LEU 18 24.484 21.565 -7.894
115 HD13 LEU 18 3HD1 LEU 18 23.809 22.239 -9.393
116 HD21 LEU 18 1HD2 LEU 18 23.414 23.702 -6.039
117 HD22 LEU 18 2HD2 LEU 18 24.695 24.919 -6.173
118 HD23 LEU 18 3HD2 LEU 18 25.122 23.201 -5.973
119 H ASP 19 H ASP 19 26.861 25.870 -10.683
120 HA ASP 19 HA ASP 19 29.555 24.867 -11.121
121 HB2 ASP 19 1HB ASP 19 27.714 25.082 -12.847
122 HB3 ASP 19 2HB ASP 19 27.905 26.839 -12.747
123 H ASN 20 H ASN 20 28.095 27.795 -9.949
124 HA ASN 20 HA ASN 20 30.709 29.201 -10.118
125 HB2 ASN 20 1HB ASN 20 27.854 30.245 -10.365
126 HB3 ASN 20 2HB ASN 20 29.282 31.255 -10.232
127 HD21 ASN 20 1HD2 ASN 20 30.446 30.568 -13.515
128 HD22 ASN 20 2HD2 ASN 20 31.043 30.759 -11.890
129 HA PRO 21 HA PRO 21 29.536 29.022 -5.628
130 HB2 PRO 21 1HB PRO 21 32.217 28.948 -4.860
131 HB3 PRO 21 2HB PRO 21 31.217 27.497 -5.095
132 HG2 PRO 21 1HG PRO 21 33.084 28.813 -6.953
133 HG3 PRO 21 2HG PRO 21 32.914 27.089 -6.596
134 HD2 PRO 21 1HD PRO 21 31.926 28.069 -8.801
135 HD3 PRO 21 2HD PRO 21 30.981 26.880 -7.835
136 H ALA 22 H ALA 22 31.997 30.796 -7.532
137 HA ALA 22 HA ALA 22 32.431 32.862 -5.628
138 HB1 ALA 22 1HB ALA 22 32.594 32.962 -8.674
139 HB2 ALA 22 2HB ALA 22 33.279 34.163 -7.553
140 HB3 ALA 22 3HB ALA 22 33.909 32.501 -7.562
141 H LEU 23 H LEU 23 30.105 32.622 -8.339
142 HA LEU 23 HA LEU 23 29.002 35.247 -7.850
143 HB2 LEU 23 1HB LEU 23 27.707 32.892 -9.258
144 HB3 LEU 23 2HB LEU 23 27.221 34.575 -9.373
145 HG LEU 23 HG LEU 23 29.758 33.343 -10.492
146 HD11 LEU 23 1HD1 LEU 23 27.635 32.799 -11.678
147 HD12 LEU 23 2HD1 LEU 23 28.723 33.799 -12.661
148 HD13 LEU 23 3HD1 LEU 23 27.314 34.538 -11.864
149 HD21 LEU 23 1HD2 LEU 23 28.800 36.211 -10.692
150 HD22 LEU 23 2HD2 LEU 23 30.149 35.489 -11.603
151 HD23 LEU 23 3HD2 LEU 23 30.252 35.637 -9.838
152 H LEU 24 H LEU 24 28.164 31.920 -6.861
153 HA LEU 24 HA LEU 24 25.656 32.629 -5.689
154 HB2 LEU 24 1HB LEU 24 26.336 30.337 -6.300
155 HB3 LEU 24 2HB LEU 24 27.549 30.347 -5.036
156 HG LEU 24 HG LEU 24 25.904 30.334 -3.317
157 HD11 LEU 24 1HD1 LEU 24 23.444 30.251 -3.822
158 HD12 LEU 24 2HD1 LEU 24 23.823 30.754 -5.486
159 HD13 LEU 24 3HD1 LEU 24 24.199 31.827 -4.110
160 HD21 LEU 24 1HD2 LEU 24 24.969 28.452 -5.482
161 HD22 LEU 24 2HD2 LEU 24 24.818 28.234 -3.725
162 HD23 LEU 24 3HD2 LEU 24 26.422 28.218 -4.491
163 H ARG 25 H ARG 25 28.976 32.459 -4.382
164 HA ARG 25 HA ARG 25 28.322 32.899 -1.633
165 HB2 ARG 25 1HB ARG 25 30.597 32.280 -2.544
166 HB3 ARG 25 2HB ARG 25 30.718 33.886 -3.246
167 HG2 ARG 25 1HG ARG 25 30.284 34.601 -0.692
168 HG3 ARG 25 2HG ARG 25 31.007 33.007 -0.415
169 HD2 ARG 25 1HD ARG 25 32.787 34.578 -0.411
170 HD3 ARG 25 2HD ARG 25 32.885 33.724 -1.961
171 HE ARG 25 HE ARG 25 31.431 35.842 -2.711
172 HH11 ARG 25 1HH1 ARG 25 34.304 35.830 -0.629
173 HH12 ARG 25 2HH1 ARG 25 34.757 37.437 -1.131
174 HH21 ARG 25 1HH2 ARG 25 32.055 37.916 -3.248
175 HH22 ARG 25 2HH2 ARG 25 33.522 38.579 -2.570
176 H ASP 26 H ASP 26 28.997 35.059 -4.369
177 HA ASP 26 HA ASP 26 28.823 37.477 -2.895
178 HB2 ASP 26 1HB ASP 26 29.477 36.657 -5.433
179 HB3 ASP 26 2HB ASP 26 27.999 37.548 -5.717
180 H MET 27 H MET 27 26.346 35.712 -4.815
181 HA MET 27 HA MET 27 24.209 37.577 -4.419
182 HB2 MET 27 1HB MET 27 24.229 35.624 -6.019
183 HB3 MET 27 2HB MET 27 24.041 34.551 -4.627
184 HG2 MET 27 1HG MET 27 21.907 35.783 -4.071
185 HG3 MET 27 2HG MET 27 22.084 36.642 -5.607
186 HE1 MET 27 1HE MET 27 22.312 32.974 -4.101
187 HE2 MET 27 2HE MET 27 20.637 33.507 -3.830
188 HE3 MET 27 3HE MET 27 20.979 32.184 -4.970
189 H LEU 28 H LEU 28 25.244 34.718 -2.531
190 HA LEU 28 HA LEU 28 23.130 34.814 -0.652
191 HB2 LEU 28 1HB LEU 28 25.824 33.620 -0.789
192 HB3 LEU 28 2HB LEU 28 24.994 33.671 0.769
193 HG LEU 28 HG LEU 28 23.587 32.631 -1.682
194 HD11 LEU 28 1HD1 LEU 28 24.303 30.417 -0.984
195 HD12 LEU 28 2HD1 LEU 28 25.364 31.164 0.234
196 HD13 LEU 28 3HD1 LEU 28 25.647 31.459 -1.487
197 HD21 LEU 28 1HD2 LEU 28 22.235 31.471 -0.028
198 HD22 LEU 28 2HD2 LEU 28 22.320 33.190 0.389
199 HD23 LEU 28 3HD2 LEU 28 23.299 32.031 1.285
200 H LEU 29 H LEU 29 26.382 36.274 -0.650
201 HA LEU 29 HA LEU 29 26.261 37.319 2.022
202 HB2 LEU 29 1HB LEU 29 27.758 38.115 -0.480
203 HB3 LEU 29 2HB LEU 29 27.888 39.078 0.986
204 HG LEU 29 HG LEU 29 28.568 36.131 0.923
205 HD11 LEU 29 1HD1 LEU 29 30.923 36.827 0.705
206 HD12 LEU 29 2HD1 LEU 29 30.400 38.516 0.485
207 HD13 LEU 29 3HD1 LEU 29 29.962 37.278 -0.719
208 HD21 LEU 29 1HD2 LEU 29 29.891 36.700 2.931
209 HD22 LEU 29 2HD2 LEU 29 28.171 37.063 3.158
210 HD23 LEU 29 3HD2 LEU 29 29.319 38.382 2.826
211 H ALA 30 H ALA 30 25.153 38.545 -1.090
212 HA ALA 30 HA ALA 30 24.385 41.136 -0.003
213 HB1 ALA 30 1HB ALA 30 25.098 40.831 -2.357
214 HB2 ALA 30 2HB ALA 30 23.684 39.788 -2.649
215 HB3 ALA 30 3HB ALA 30 23.456 41.509 -2.254
216 H ASN 31 H ASN 31 22.900 38.003 0.007
217 HA ASN 31 HA ASN 31 20.177 39.223 0.104
218 HB2 ASN 31 1HB ASN 31 20.806 37.341 -1.509
219 HB3 ASN 31 2HB ASN 31 20.896 36.298 -0.111
220 HD21 ASN 31 1HD2 ASN 31 17.471 36.677 -1.886
221 HD22 ASN 31 2HD2 ASN 31 19.084 36.791 -2.570
222 HA PRO 32 HA PRO 32 20.898 38.430 4.453
223 HB2 PRO 32 1HB PRO 32 18.733 39.784 5.479
224 HB3 PRO 32 2HB PRO 32 20.238 40.590 4.930
225 HG2 PRO 32 1HG PRO 32 17.676 40.160 3.390
226 HG3 PRO 32 2HG PRO 32 18.603 41.675 3.631
227 HD2 PRO 32 1HD PRO 32 18.895 40.271 1.407
228 HD3 PRO 32 2HD PRO 32 20.325 41.003 2.218
229 H HIS 33 H HIS 33 17.840 37.745 2.744
230 HA HIS 33 HA HIS 33 16.807 36.088 4.919
231 HB2 HIS 33 1HB HIS 33 15.334 37.196 3.260
232 HB3 HIS 33 2HB HIS 33 16.053 36.221 1.973
233 HD1 HIS 33 HD1 HIS 33 13.828 35.853 5.049
234 HD2 HIS 33 HD2 HIS 33 15.055 33.675 1.714
235 HE1 HIS 33 HE1 HIS 33 12.407 33.765 4.973
236 H GLU 34 H GLU 34 18.522 35.573 1.858
237 HA GLU 34 HA GLU 34 18.270 32.689 1.932
238 HB2 GLU 34 1HB GLU 34 19.644 34.747 0.308
239 HB3 GLU 34 2HB GLU 34 20.302 33.156 0.201
240 HG2 GLU 34 1HG GLU 34 17.406 33.855 -0.319
241 HG3 GLU 34 2HG GLU 34 18.649 33.701 -1.573
242 H LEU 35 H LEU 35 20.768 35.064 2.886
243 HA LEU 35 HA LEU 35 22.725 33.123 3.595
244 HB2 LEU 35 1HB LEU 35 23.947 34.771 4.338
245 HB3 LEU 35 2HB LEU 35 22.884 35.538 3.211
246 HG LEU 35 HG LEU 35 21.675 36.634 4.982
247 HD11 LEU 35 1HD1 LEU 35 22.905 36.828 7.202
248 HD12 LEU 35 2HD1 LEU 35 23.676 35.272 6.782
249 HD13 LEU 35 3HD1 LEU 35 21.909 35.387 6.959
250 HD21 LEU 35 1HD2 LEU 35 24.686 36.804 4.841
251 HD22 LEU 35 2HD2 LEU 35 23.616 38.136 5.363
252 HD23 LEU 35 3HD2 LEU 35 23.530 37.514 3.699
253 H SER 36 H SER 36 19.875 34.303 5.209
254 HA SER 36 HA SER 36 20.567 33.323 7.832
255 HB2 SER 36 1HB SER 36 17.916 34.223 6.675
256 HB3 SER 36 2HB SER 36 18.185 33.781 8.374
257 HG SER 36 HG SER 36 19.167 35.987 6.910
258 H LEU 37 H LEU 37 18.565 32.100 5.116
259 HA LEU 37 HA LEU 37 17.702 29.765 6.582
260 HB2 LEU 37 1HB LEU 37 16.825 28.981 4.662
261 HB3 LEU 37 2HB LEU 37 16.738 30.686 4.583
262 HG LEU 37 HG LEU 37 18.444 30.722 2.829
263 HD11 LEU 37 1HD1 LEU 37 17.960 27.740 2.941
264 HD12 LEU 37 2HD1 LEU 37 19.507 28.597 3.058
265 HD13 LEU 37 3HD1 LEU 37 18.636 28.592 1.524
266 HD21 LEU 37 1HD2 LEU 37 16.797 30.029 1.123
267 HD22 LEU 37 2HD2 LEU 37 16.051 30.976 2.423
268 HD23 LEU 37 3HD2 LEU 37 15.852 29.207 2.385
269 H LEU 38 H LEU 38 20.442 30.656 4.676
270 HA LEU 38 HA LEU 38 21.491 28.060 4.394
271 HB2 LEU 38 1HB LEU 38 22.058 30.142 3.203
272 HB3 LEU 38 2HB LEU 38 22.969 30.681 4.624
273 HG LEU 38 HG LEU 38 24.388 28.622 4.471
274 HD11 LEU 38 1HD1 LEU 38 22.929 28.350 1.846
275 HD12 LEU 38 2HD1 LEU 38 22.905 27.228 3.226
276 HD13 LEU 38 3HD1 LEU 38 24.399 27.453 2.300
277 HD21 LEU 38 1HD2 LEU 38 25.798 29.430 2.673
278 HD22 LEU 38 2HD2 LEU 38 25.149 30.795 3.605
279 HD23 LEU 38 3HD2 LEU 38 24.449 30.386 2.025
280 H LYS 39 H LYS 39 22.181 30.545 6.895
281 HA LYS 39 HA LYS 39 23.794 28.664 8.420
282 HB2 LYS 39 1HB LYS 39 23.565 30.259 10.314
283 HB3 LYS 39 2HB LYS 39 24.267 30.919 8.838
284 HG2 LYS 39 1HG LYS 39 22.231 32.078 8.307
285 HG3 LYS 39 2HG LYS 39 21.345 31.296 9.587
286 HD2 LYS 39 1HD LYS 39 21.838 33.483 10.345
287 HD3 LYS 39 2HD LYS 39 22.954 32.412 11.216
288 HE2 LYS 39 1HE LYS 39 24.752 32.973 9.626
289 HE3 LYS 39 2HE LYS 39 23.626 33.971 8.684
290 HZ1 LYS 39 1HZ LYS 39 24.975 35.311 10.170
291 HZ2 LYS 39 2HZ LYS 39 24.425 34.486 11.490
292 HZ3 LYS 39 3HZ LYS 39 23.387 35.413 10.605
293 H GLU 40 H GLU 40 20.350 29.210 8.282
294 HA GLU 40 HA GLU 40 19.751 27.801 10.743
295 HB2 GLU 40 1HB GLU 40 18.171 29.340 9.566
296 HB3 GLU 40 2HB GLU 40 18.128 28.228 8.207
297 HG2 GLU 40 1HG GLU 40 17.281 26.503 10.027
298 HG3 GLU 40 2HG GLU 40 16.834 27.977 10.899
299 H ARG 41 H ARG 41 19.711 26.890 7.265
300 HA ARG 41 HA ARG 41 19.196 24.077 8.087
301 HB2 ARG 41 1HB ARG 41 19.077 25.440 5.381
302 HB3 ARG 41 2HB ARG 41 18.502 23.810 5.765
303 HG2 ARG 41 1HG ARG 41 17.023 24.812 7.496
304 HG3 ARG 41 2HG ARG 41 17.518 26.410 6.963
305 HD2 ARG 41 1HD ARG 41 16.581 25.973 4.738
306 HD3 ARG 41 2HD ARG 41 15.950 24.412 5.350
307 HE ARG 41 HE ARG 41 15.216 26.354 7.245
308 HH11 ARG 41 1HH1 ARG 41 14.446 25.840 3.826
309 HH12 ARG 41 2HH1 ARG 41 12.916 26.660 3.975
310 HH21 ARG 41 1HH2 ARG 41 13.341 27.351 7.355
311 HH22 ARG 41 2HH2 ARG 41 12.284 27.506 5.967
312 H ASN 42 H ASN 42 21.794 25.843 6.628
313 HA ASN 42 HA ASN 42 23.281 23.253 6.362
314 HB2 ASN 42 1HB ASN 42 22.537 24.280 4.128
315 HB3 ASN 42 2HB ASN 42 23.690 25.551 4.434
316 HD21 ASN 42 1HD2 ASN 42 25.359 22.985 2.396
317 HD22 ASN 42 2HD2 ASN 42 24.100 24.176 2.227
318 HA PRO 43 HA PRO 43 25.432 26.519 8.857
319 HB2 PRO 43 1HB PRO 43 26.557 24.746 10.715
320 HB3 PRO 43 2HB PRO 43 25.057 25.704 10.921
321 HG2 PRO 43 1HG PRO 43 25.376 22.853 10.044
322 HG3 PRO 43 2HG PRO 43 24.206 23.566 11.194
323 HD2 PRO 43 1HD PRO 43 23.498 22.978 8.678
324 HD3 PRO 43 2HD PRO 43 22.900 24.475 9.479
325 HA PRO 44 HA PRO 44 29.543 24.566 7.988
326 HB2 PRO 44 1HB PRO 44 29.894 22.615 6.118
327 HB3 PRO 44 2HB PRO 44 29.632 22.262 7.854
328 HG2 PRO 44 1HG PRO 44 27.636 22.312 5.623
329 HG3 PRO 44 2HG PRO 44 27.958 21.020 6.822
330 HD2 PRO 44 1HD PRO 44 25.954 22.771 7.187
331 HD3 PRO 44 2HD PRO 44 26.965 22.235 8.570
332 H LEU 45 H LEU 45 27.181 24.618 5.214
333 HA LEU 45 HA LEU 45 29.173 25.897 3.500
334 HB2 LEU 45 1HB LEU 45 27.284 24.634 2.559
335 HB3 LEU 45 2HB LEU 45 26.172 25.826 3.227
336 HG LEU 45 HG LEU 45 26.999 27.542 1.729
337 HD11 LEU 45 1HD1 LEU 45 29.402 26.875 1.565
338 HD12 LEU 45 2HD1 LEU 45 28.661 27.111 -0.029
339 HD13 LEU 45 3HD1 LEU 45 28.926 25.468 0.594
340 HD21 LEU 45 1HD2 LEU 45 25.262 25.947 0.938
341 HD22 LEU 45 2HD2 LEU 45 26.539 24.946 0.211
342 HD23 LEU 45 3HD2 LEU 45 26.245 26.598 -0.385
343 H ALA 46 H ALA 46 26.717 26.836 5.812
344 HA ALA 46 HA ALA 46 26.688 29.601 5.136
345 HB1 ALA 46 1HB ALA 46 26.274 28.396 7.863
346 HB2 ALA 46 2HB ALA 46 25.644 29.934 7.231
347 HB3 ALA 46 3HB ALA 46 25.062 28.393 6.568
348 H GLU 47 H GLU 47 28.641 27.857 7.656
349 HA GLU 47 HA GLU 47 29.833 30.208 8.650
350 HB2 GLU 47 1HB GLU 47 31.577 28.888 9.614
351 HB3 GLU 47 2HB GLU 47 29.985 28.190 9.887
352 HG2 GLU 47 1HG GLU 47 30.506 26.341 8.914
353 HG3 GLU 47 2HG GLU 47 31.166 27.117 7.493
354 H ALA 48 H ALA 48 30.699 28.252 5.868
355 HA ALA 48 HA ALA 48 33.097 29.493 5.203
356 HB1 ALA 48 1HB ALA 48 32.658 28.630 3.023
357 HB2 ALA 48 2HB ALA 48 32.145 27.435 4.220
358 HB3 ALA 48 3HB ALA 48 30.945 28.440 3.376
359 H LEU 49 H LEU 49 29.772 30.344 4.343
360 HA LEU 49 HA LEU 49 30.521 32.530 2.666
361 HB2 LEU 49 1HB LEU 49 28.261 31.364 2.773
362 HB3 LEU 49 2HB LEU 49 27.987 32.144 4.330
363 HG LEU 49 HG LEU 49 28.463 34.355 2.949
364 HD11 LEU 49 1HD1 LEU 49 29.059 33.130 0.910
365 HD12 LEU 49 2HD1 LEU 49 27.646 34.164 0.669
366 HD13 LEU 49 3HD1 LEU 49 27.435 32.415 0.864
367 HD21 LEU 49 1HD2 LEU 49 26.385 33.797 4.147
368 HD22 LEU 49 2HD2 LEU 49 25.851 32.835 2.750
369 HD23 LEU 49 3HD2 LEU 49 26.075 34.591 2.591
370 H LEU 50 H LEU 50 29.765 32.208 6.155
371 HA LEU 50 HA LEU 50 29.620 35.007 6.731
372 HB2 LEU 50 1HB LEU 50 30.675 32.918 8.653
373 HB3 LEU 50 2HB LEU 50 29.892 34.434 9.042
374 HG LEU 50 HG LEU 50 28.679 31.867 8.141
375 HD11 LEU 50 1HD1 LEU 50 28.176 33.604 10.521
376 HD12 LEU 50 2HD1 LEU 50 29.139 32.104 10.466
377 HD13 LEU 50 3HD1 LEU 50 27.395 32.040 10.158
378 HD21 LEU 50 1HD2 LEU 50 27.258 34.517 8.174
379 HD22 LEU 50 2HD2 LEU 50 26.462 32.920 8.105
380 HD23 LEU 50 3HD2 LEU 50 27.512 33.431 6.781
381 H SER 51 H SER 51 32.310 32.743 6.499
382 HA SER 51 HA SER 51 34.281 34.454 7.674
383 HB2 SER 51 1HB SER 51 34.503 32.154 5.732
384 HB3 SER 51 2HB SER 51 35.814 32.838 6.691
385 HG SER 51 HG SER 51 33.464 31.574 7.686
386 H GLY 52 H GLY 52 32.805 34.184 4.499
387 HA2 GLY 52 1HA GLY 52 32.997 35.705 2.747
388 HA3 GLY 52 2HA GLY 52 34.362 36.487 3.562
389 H ASP 53 H ASP 53 35.392 33.547 3.864
390 HA ASP 53 HA ASP 53 37.287 33.671 1.737
391 HB2 ASP 53 1HB ASP 53 37.596 32.389 3.950
392 HB3 ASP 53 2HB ASP 53 36.475 31.247 3.328
393 H LEU 54 H LEU 54 36.830 33.346 -0.370
394 HA LEU 54 HA LEU 54 34.553 31.836 -1.264
395 HB2 LEU 54 1HB LEU 54 35.658 33.586 -2.612
396 HB3 LEU 54 2HB LEU 54 37.101 32.594 -2.731
397 HG LEU 54 HG LEU 54 35.466 32.746 -4.700
398 HD11 LEU 54 1HD1 LEU 54 37.435 31.237 -4.582
399 HD12 LEU 54 2HD1 LEU 54 36.097 30.626 -5.577
400 HD13 LEU 54 3HD1 LEU 54 36.363 29.971 -3.951
401 HD21 LEU 54 1HD2 LEU 54 33.377 32.204 -3.544
402 HD22 LEU 54 2HD2 LEU 54 33.989 30.571 -3.220
403 HD23 LEU 54 3HD2 LEU 54 33.716 31.093 -4.881
404 H GLU 55 H GLU 55 37.986 31.055 -0.633
405 HA GLU 55 HA GLU 55 38.012 28.585 -2.015
406 HB2 GLU 55 1HB GLU 55 39.455 29.167 0.580
407 HB3 GLU 55 2HB GLU 55 39.922 28.014 -0.664
408 HG2 GLU 55 1HG GLU 55 39.855 31.025 -0.915
409 HG3 GLU 55 2HG GLU 55 41.264 30.003 -0.699
410 H LYS 56 H LYS 56 37.374 29.207 1.471
411 HA LYS 56 HA LYS 56 36.699 26.487 1.948
412 HB2 LYS 56 1HB LYS 56 36.136 27.030 4.124
413 HB3 LYS 56 2HB LYS 56 37.329 28.302 3.693
414 HG2 LYS 56 1HG LYS 56 35.289 29.693 3.280
415 HG3 LYS 56 2HG LYS 56 34.470 28.409 4.156
416 HD2 LYS 56 1HD LYS 56 36.997 29.372 5.402
417 HD3 LYS 56 2HD LYS 56 35.643 30.493 5.418
418 HE2 LYS 56 1HE LYS 56 34.215 28.815 6.497
419 HE3 LYS 56 2HE LYS 56 35.528 27.639 6.446
420 HZ1 LYS 56 1HZ LYS 56 36.731 29.026 7.997
421 HZ2 LYS 56 2HZ LYS 56 35.233 28.646 8.599
422 HZ3 LYS 56 3HZ LYS 56 35.520 30.157 7.990
423 H PHE 57 H PHE 57 34.691 29.335 1.003
424 HA PHE 57 HA PHE 57 32.216 27.981 1.141
425 HB2 PHE 57 1HB PHE 57 32.507 30.420 0.819
426 HB3 PHE 57 2HB PHE 57 33.074 30.115 -0.829
427 HD1 PHE 57 HD1 PHE 57 31.538 29.528 -2.611
428 HD2 PHE 57 HD2 PHE 57 30.133 30.023 1.425
429 HE1 PHE 57 HE1 PHE 57 29.192 29.570 -3.434
430 HE2 PHE 57 HE2 PHE 57 27.780 30.067 0.602
431 HZ PHE 57 HZ PHE 57 27.314 29.839 -1.841
432 H SER 58 H SER 58 34.419 28.229 -1.723
433 HA SER 58 HA SER 58 32.754 26.630 -3.381
434 HB2 SER 58 1HB SER 58 34.604 28.096 -4.166
435 HB3 SER 58 2HB SER 58 35.779 26.979 -3.443
436 HG SER 58 HG SER 58 35.039 25.372 -4.864
437 H ARG 59 H ARG 59 35.360 25.788 -1.122
438 HA ARG 59 HA ARG 59 35.620 23.053 -1.989
439 HB2 ARG 59 1HB ARG 59 37.316 24.336 -0.714
440 HB3 ARG 59 2HB ARG 59 36.254 24.360 0.686
441 HG2 ARG 59 1HG ARG 59 37.081 21.710 -0.520
442 HG3 ARG 59 2HG ARG 59 38.239 22.615 0.466
443 HD2 ARG 59 1HD ARG 59 35.485 21.707 1.378
444 HD3 ARG 59 2HD ARG 59 37.021 20.936 1.794
445 HE ARG 59 HE ARG 59 37.205 23.645 2.548
446 HH11 ARG 59 1HH1 ARG 59 35.326 20.793 3.505
447 HH12 ARG 59 2HH1 ARG 59 35.130 21.382 5.136
448 HH21 ARG 59 1HH2 ARG 59 36.902 24.304 4.648
449 HH22 ARG 59 2HH2 ARG 59 35.991 23.326 5.766
450 H VAL 60 H VAL 60 33.769 24.642 0.637
451 HA VAL 60 HA VAL 60 32.665 22.113 1.490
452 HB VAL 60 HB VAL 60 32.920 24.122 2.990
453 HG11 VAL 60 1HG1 VAL 60 31.257 25.740 3.099
454 HG12 VAL 60 2HG1 VAL 60 32.151 25.807 1.585
455 HG13 VAL 60 3HG1 VAL 60 30.559 25.070 1.627
456 HG21 VAL 60 1HG2 VAL 60 31.565 22.132 3.566
457 HG22 VAL 60 2HG2 VAL 60 30.983 23.632 4.315
458 HG23 VAL 60 3HG2 VAL 60 30.140 22.965 2.896
459 H LEU 61 H LEU 61 31.731 24.627 -0.838
460 HA LEU 61 HA LEU 61 29.063 23.832 -1.289
461 HB2 LEU 61 1HB LEU 61 30.340 25.817 -2.263
462 HB3 LEU 61 2HB LEU 61 31.017 24.708 -3.438
463 HG LEU 61 HG LEU 61 28.328 24.249 -3.753
464 HD11 LEU 61 1HD1 LEU 61 27.903 26.072 -2.090
465 HD12 LEU 61 2HD1 LEU 61 27.206 26.383 -3.691
466 HD13 LEU 61 3HD1 LEU 61 28.710 27.208 -3.208
467 HD21 LEU 61 1HD2 LEU 61 30.275 25.076 -5.420
468 HD22 LEU 61 2HD2 LEU 61 29.428 26.628 -5.217
469 HD23 LEU 61 3HD2 LEU 61 28.553 25.221 -5.832
470 H VAL 62 H VAL 62 32.090 22.575 -2.842
471 HA VAL 62 HA VAL 62 30.542 20.739 -4.451
472 HB VAL 62 HB VAL 62 32.765 21.554 -5.153
473 HG11 VAL 62 1HG1 VAL 62 33.874 19.746 -2.981
474 HG12 VAL 62 2HG1 VAL 62 34.820 20.489 -4.286
475 HG13 VAL 62 3HG1 VAL 62 34.018 21.516 -3.093
476 HG21 VAL 62 1HG2 VAL 62 31.765 19.509 -6.114
477 HG22 VAL 62 2HG2 VAL 62 33.540 19.442 -6.104
478 HG23 VAL 62 3HG2 VAL 62 32.607 18.538 -4.887
479 H GLU 63 H GLU 63 32.143 20.462 -1.299
480 HA GLU 63 HA GLU 63 31.767 17.640 -0.936
481 HB2 GLU 63 1HB GLU 63 31.728 19.963 1.006
482 HB3 GLU 63 2HB GLU 63 31.578 18.287 1.532
483 HG2 GLU 63 1HG GLU 63 33.776 17.753 0.705
484 HG3 GLU 63 2HG GLU 63 33.940 19.354 -0.031
485 H GLN 64 H GLN 64 29.648 20.441 -0.240
486 HA GLN 64 HA GLN 64 27.477 18.890 0.804
487 HB2 GLN 64 1HB GLN 64 27.653 21.640 -0.460
488 HB3 GLN 64 2HB GLN 64 26.125 20.966 0.114
489 HG2 GLN 64 1HG GLN 64 28.586 21.340 1.849
490 HG3 GLN 64 2HG GLN 64 27.229 22.469 1.762
491 HE21 GLN 64 1HE2 GLN 64 27.049 19.507 4.349
492 HE22 GLN 64 2HE2 GLN 64 28.504 20.160 3.636
493 H GLN 65 H GLN 65 28.298 19.949 -2.530
494 HA GLN 65 HA GLN 65 25.846 19.004 -3.690
495 HB2 GLN 65 1HB GLN 65 28.635 19.362 -4.823
496 HB3 GLN 65 2HB GLN 65 27.284 18.764 -5.789
497 HG2 GLN 65 1HG GLN 65 26.026 20.826 -5.338
498 HG3 GLN 65 2HG GLN 65 27.381 21.450 -4.397
499 HE21 GLN 65 1HE2 GLN 65 28.973 22.759 -7.185
500 HE22 GLN 65 2HE2 GLN 65 28.731 22.747 -5.451
501 H GLN 66 H GLN 66 28.987 17.358 -3.055
502 HA GLN 66 HA GLN 66 28.248 14.918 -4.347
503 HB2 GLN 66 1HB GLN 66 30.153 15.501 -2.057
504 HB3 GLN 66 2HB GLN 66 30.002 13.916 -2.818
505 HG2 GLN 66 1HG GLN 66 30.754 14.788 -4.934
506 HG3 GLN 66 2HG GLN 66 30.745 16.436 -4.315
507 HE21 GLN 66 1HE2 GLN 66 33.897 16.266 -2.876
508 HE22 GLN 66 2HE2 GLN 66 32.475 17.214 -3.258
509 H ASP 67 H ASP 67 27.904 15.978 -0.908
510 HA ASP 67 HA ASP 67 26.829 13.425 -0.094
511 HB2 ASP 67 1HB ASP 67 27.866 15.261 1.365
512 HB3 ASP 67 2HB ASP 67 26.298 16.072 1.257
513 H ARG 68 H ARG 68 25.402 16.447 -1.264
514 HA ARG 68 HA ARG 68 22.647 15.719 -0.770
515 HB2 ARG 68 1HB ARG 68 24.031 17.604 -2.677
516 HB3 ARG 68 2HB ARG 68 22.311 17.249 -2.856
517 HG2 ARG 68 1HG ARG 68 21.822 18.093 -0.663
518 HG3 ARG 68 2HG ARG 68 23.545 18.303 -0.294
519 HD2 ARG 68 1HD ARG 68 22.422 20.442 -0.936
520 HD3 ARG 68 2HD ARG 68 23.762 20.007 -2.011
521 HE ARG 68 HE ARG 68 22.294 19.753 -3.770
522 HH11 ARG 68 1HH1 ARG 68 20.357 19.896 -0.822
523 HH12 ARG 68 2HH1 ARG 68 18.861 19.977 -1.708
524 HH21 ARG 68 1HH2 ARG 68 20.355 19.868 -4.819
525 HH22 ARG 68 2HH2 ARG 68 18.865 19.965 -3.928
526 H ALA 69 H ALA 69 24.872 15.256 -3.549
527 HA ALA 69 HA ALA 69 22.987 14.181 -5.321
528 HB1 ALA 69 1HB ALA 69 25.312 14.776 -5.948
529 HB2 ALA 69 2HB ALA 69 25.917 13.382 -5.022
530 HB3 ALA 69 3HB ALA 69 24.897 13.123 -6.455
531 H ARG 70 H ARG 70 24.701 12.560 -2.632
532 HA ARG 70 HA ARG 70 24.039 9.906 -3.343
533 HB2 ARG 70 1HB ARG 70 24.183 11.101 -0.543
534 HB3 ARG 70 2HB ARG 70 24.296 9.379 -0.957
535 HG2 ARG 70 1HG ARG 70 26.243 10.120 -2.481
536 HG3 ARG 70 2HG ARG 70 26.225 11.598 -1.512
537 HD2 ARG 70 1HD ARG 70 26.453 8.814 -0.337
538 HD3 ARG 70 2HD ARG 70 27.849 9.824 -0.749
539 HE ARG 70 HE ARG 70 26.207 11.386 0.930
540 HH11 ARG 70 1HH1 ARG 70 28.099 8.410 1.204
541 HH12 ARG 70 2HH1 ARG 70 28.404 8.658 2.902
542 HH21 ARG 70 1HH2 ARG 70 26.638 11.640 3.058
543 HH22 ARG 70 2HH2 ARG 70 27.580 10.454 3.944
544 H ARG 71 H ARG 71 22.095 12.164 -1.336
545 HA ARG 71 HA ARG 71 19.962 10.155 -1.132
546 HB2 ARG 71 1HB ARG 71 18.845 11.710 0.252
547 HB3 ARG 71 2HB ARG 71 20.552 11.768 0.662
548 HG2 ARG 71 1HG ARG 71 20.559 13.836 -0.962
549 HG3 ARG 71 2HG ARG 71 18.829 13.851 -0.638
550 HD2 ARG 71 1HD ARG 71 19.864 15.313 0.937
551 HD3 ARG 71 2HD ARG 71 19.435 13.835 1.829
552 HE ARG 71 HE ARG 71 22.099 13.608 0.793
553 HH11 ARG 71 1HH1 ARG 71 20.373 15.348 3.342
554 HH12 ARG 71 2HH1 ARG 71 21.808 15.486 4.324
555 HH21 ARG 71 1HH2 ARG 71 23.842 13.784 2.105
556 HH22 ARG 71 2HH2 ARG 71 23.744 14.619 3.629
557 H GLU 72 H GLU 72 20.738 12.916 -3.087
558 HA GLU 72 HA GLU 72 18.057 13.284 -4.137
559 HB2 GLU 72 1HB GLU 72 20.682 14.459 -4.598
560 HB3 GLU 72 2HB GLU 72 19.824 14.190 -6.106
561 HG2 GLU 72 1HG GLU 72 19.310 16.401 -5.347
562 HG3 GLU 72 2HG GLU 72 17.859 15.404 -5.176
563 H GLN 73 H GLN 73 20.857 11.316 -5.088
564 HA GLN 73 HA GLN 73 19.941 10.518 -7.636
565 HB2 GLN 73 1HB GLN 73 21.702 9.252 -5.564
566 HB3 GLN 73 2HB GLN 73 21.200 8.324 -6.985
567 HG2 GLN 73 1HG GLN 73 22.110 10.076 -8.462
568 HG3 GLN 73 2HG GLN 73 22.659 10.986 -7.068
569 HE21 GLN 73 1HE2 GLN 73 25.548 9.114 -8.323
570 HE22 GLN 73 2HE2 GLN 73 24.496 10.409 -8.882
571 H GLU 74 H GLU 74 19.063 9.308 -4.401
572 HA GLU 74 HA GLU 74 17.572 7.054 -5.341
573 HB2 GLU 74 1HB GLU 74 17.053 8.786 -2.883
574 HB3 GLU 74 2HB GLU 74 16.485 7.134 -3.129
575 HG2 GLU 74 1HG GLU 74 18.808 6.314 -3.049
576 HG3 GLU 74 2HG GLU 74 19.393 7.977 -2.871
577 H ARG 75 H ARG 75 16.739 10.452 -4.805
578 HA ARG 75 HA ARG 75 13.902 10.097 -5.181
579 HB2 ARG 75 1HB ARG 75 15.644 12.554 -5.420
580 HB3 ARG 75 2HB ARG 75 13.878 12.558 -5.362
581 HG2 ARG 75 1HG ARG 75 13.882 11.700 -3.105
582 HG3 ARG 75 2HG ARG 75 15.631 11.408 -3.164
583 HD2 ARG 75 1HD ARG 75 15.273 13.427 -1.964
584 HD3 ARG 75 2HD ARG 75 15.987 13.816 -3.539
585 HE ARG 75 HE ARG 75 13.108 13.907 -3.617
586 HH11 ARG 75 1HH1 ARG 75 15.939 15.832 -2.689
587 HH12 ARG 75 2HH1 ARG 75 15.050 17.331 -2.835
588 HH21 ARG 75 1HH2 ARG 75 12.077 15.859 -3.799
589 HH22 ARG 75 2HH2 ARG 75 12.919 17.346 -3.467
590 H ILE 76 H ILE 76 16.525 11.200 -7.327
591 HA ILE 76 HA ILE 76 14.719 11.775 -9.533
592 HB ILE 76 HB ILE 76 16.688 12.260 -10.837
593 HG12 ILE 76 1HG1 ILE 76 18.176 10.935 -8.573
594 HG13 ILE 76 2HG1 ILE 76 18.129 10.437 -10.255
595 HG21 ILE 76 1HG2 ILE 76 17.131 13.312 -8.008
596 HG22 ILE 76 2HG2 ILE 76 17.520 14.123 -9.543
597 HG23 ILE 76 3HG2 ILE 76 15.827 13.877 -9.075
598 HD11 ILE 76 1HD1 ILE 76 19.562 12.823 -9.052
599 HD12 ILE 76 2HD1 ILE 76 20.257 11.427 -9.894
600 HD13 ILE 76 3HD1 ILE 76 19.315 12.625 -10.802
601 H ARG 77 H ARG 77 16.175 8.897 -8.399
602 HA ARG 77 HA ARG 77 16.496 7.496 -10.795
603 HB2 ARG 77 1HB ARG 77 16.752 6.899 -8.072
604 HB3 ARG 77 2HB ARG 77 15.620 5.724 -8.716
605 HG2 ARG 77 1HG ARG 77 17.700 4.654 -9.051
606 HG3 ARG 77 2HG ARG 77 17.378 5.376 -10.629
607 HD2 ARG 77 1HD ARG 77 19.111 6.741 -8.547
608 HD3 ARG 77 2HD ARG 77 19.759 5.573 -9.704
609 HE ARG 77 HE ARG 77 18.326 7.507 -11.177
610 HH11 ARG 77 1HH1 ARG 77 21.299 7.350 -9.259
611 HH12 ARG 77 2HH1 ARG 77 22.028 8.672 -10.158
612 HH21 ARG 77 1HH2 ARG 77 19.349 9.184 -12.216
613 HH22 ARG 77 2HH2 ARG 77 20.976 9.660 -11.749
614 H LEU 78 H LEU 78 13.560 8.681 -9.778
615 HA LEU 78 HA LEU 78 12.061 6.559 -11.238
616 HB2 LEU 78 1HB LEU 78 11.252 7.025 -9.001
617 HB3 LEU 78 2HB LEU 78 11.211 8.745 -9.349
618 HG LEU 78 HG LEU 78 9.368 8.445 -10.860
619 HD11 LEU 78 1HD1 LEU 78 8.151 6.286 -11.003
620 HD12 LEU 78 2HD1 LEU 78 9.498 5.506 -10.141
621 HD13 LEU 78 3HD1 LEU 78 9.753 6.212 -11.751
622 HD21 LEU 78 1HD2 LEU 78 7.676 7.840 -9.187
623 HD22 LEU 78 2HD2 LEU 78 8.956 8.845 -8.484
624 HD23 LEU 78 3HD2 LEU 78 8.942 7.093 -8.181
625 H PHE 79 H PHE 79 11.272 7.101 -13.113
626 HA PHE 79 HA PHE 79 11.140 7.965 -15.155
627 HB2 PHE 79 1HB PHE 79 10.454 10.413 -13.580
628 HB3 PHE 79 2HB PHE 79 10.125 10.138 -15.282
629 HD1 PHE 79 HD1 PHE 79 8.661 10.175 -12.181
630 HD2 PHE 79 HD2 PHE 79 8.881 7.722 -15.704
631 HE1 PHE 79 HE1 PHE 79 6.453 9.153 -11.601
632 HE2 PHE 79 HE2 PHE 79 6.699 6.667 -15.125
633 HZ PHE 79 HZ PHE 79 5.474 7.385 -13.071
634 H SER 80 H SER 80 11.687 10.093 -16.528
635 HA SER 80 HA SER 80 13.303 11.265 -17.603
636 HB2 SER 80 1HB SER 80 13.329 12.479 -15.389
637 HB3 SER 80 2HB SER 80 14.751 11.515 -14.955
638 HG SER 80 HG SER 80 15.351 13.495 -15.893
639 H ALA 81 H ALA 81 14.273 9.994 -19.061
640 HA ALA 81 HA ALA 81 16.820 8.682 -18.224
641 HB1 ALA 81 1HB ALA 81 14.603 7.288 -19.800
642 HB2 ALA 81 2HB ALA 81 16.194 6.603 -19.397
643 HB3 ALA 81 3HB ALA 81 15.019 6.938 -18.105
644 H ASP 82 H ASP 82 15.833 11.062 -19.760
645 HA ASP 82 HA ASP 82 16.423 10.282 -22.557
646 HB2 ASP 82 1HB ASP 82 14.984 12.725 -21.474
647 HB3 ASP 82 2HB ASP 82 14.978 12.126 -23.142
648 HA PRO 83 HA PRO 83 19.844 13.210 -21.839
649 HB2 PRO 83 1HB PRO 83 21.782 12.090 -23.339
650 HB3 PRO 83 2HB PRO 83 21.317 11.359 -21.765
651 HG2 PRO 83 1HG PRO 83 20.441 10.621 -24.544
652 HG3 PRO 83 2HG PRO 83 21.081 9.557 -23.251
653 HD2 PRO 83 1HD PRO 83 18.389 9.882 -23.742
654 HD3 PRO 83 2HD PRO 83 19.047 9.537 -22.106
655 H PHE 84 H PHE 84 20.844 14.775 -23.315
656 HA PHE 84 HA PHE 84 19.866 14.665 -26.112
657 HB2 PHE 84 1HB PHE 84 19.728 17.104 -24.311
658 HB3 PHE 84 2HB PHE 84 19.292 17.059 -26.024
659 HD1 PHE 84 HD1 PHE 84 17.340 15.603 -26.764
660 HD2 PHE 84 HD2 PHE 84 18.155 16.463 -22.629
661 HE1 PHE 84 HE1 PHE 84 15.017 14.922 -26.170
662 HE2 PHE 84 HE2 PHE 84 15.837 15.787 -22.025
663 HZ PHE 84 HZ PHE 84 14.262 15.012 -23.794
664 H ASP 85 H ASP 85 22.416 14.440 -24.417
665 HA ASP 85 HA ASP 85 24.169 15.863 -26.322
666 HB2 ASP 85 1HB ASP 85 23.891 16.482 -23.410
667 HB3 ASP 85 2HB ASP 85 25.540 16.297 -24.020
668 H LEU 86 H LEU 86 24.882 13.930 -27.131
669 HA LEU 86 HA LEU 86 25.350 11.643 -25.410
670 HB2 LEU 86 1HB LEU 86 26.155 12.194 -28.279
671 HB3 LEU 86 2HB LEU 86 26.282 10.635 -27.474
672 HG LEU 86 HG LEU 86 23.679 12.106 -28.029
673 HD11 LEU 86 1HD1 LEU 86 24.818 11.347 -30.081
674 HD12 LEU 86 2HD1 LEU 86 23.344 10.404 -29.771
675 HD13 LEU 86 3HD1 LEU 86 24.942 9.704 -29.411
676 HD21 LEU 86 1HD2 LEU 86 23.460 10.638 -26.081
677 HD22 LEU 86 2HD2 LEU 86 24.217 9.296 -26.970
678 HD23 LEU 86 3HD2 LEU 86 22.624 9.917 -27.469
679 H GLU 87 H GLU 87 27.370 14.114 -26.949
680 HA GLU 87 HA GLU 87 29.853 12.819 -26.145
681 HB2 GLU 87 1HB GLU 87 29.495 15.699 -27.025
682 HB3 GLU 87 2HB GLU 87 30.935 14.692 -27.156
683 HG2 GLU 87 1HG GLU 87 28.355 14.493 -28.753
684 HG3 GLU 87 2HG GLU 87 29.958 14.935 -29.352
685 H ALA 88 H ALA 88 27.710 15.297 -24.971
686 HA ALA 88 HA ALA 88 27.586 16.579 -23.120
687 HB1 ALA 88 1HB ALA 88 29.098 14.275 -21.840
688 HB2 ALA 88 2HB ALA 88 28.075 15.467 -21.004
689 HB3 ALA 88 3HB ALA 88 27.345 14.320 -22.154
690 H GLN 89 H GLN 89 30.172 16.910 -24.745
691 HA GLN 89 HA GLN 89 32.047 17.887 -22.720
692 HB2 GLN 89 1HB GLN 89 33.393 18.620 -24.631
693 HB3 GLN 89 2HB GLN 89 32.915 16.928 -24.795
694 HG2 GLN 89 1HG GLN 89 31.213 17.514 -26.442
695 HG3 GLN 89 2HG GLN 89 31.538 19.236 -26.212
696 HE21 GLN 89 1HE2 GLN 89 33.853 19.266 -28.762
697 HE22 GLN 89 2HE2 GLN 89 32.543 20.037 -27.902
698 H ALA 90 H ALA 90 32.488 20.046 -22.223
699 HA ALA 90 HA ALA 90 31.101 22.217 -23.580
700 HB1 ALA 90 1HB ALA 90 29.276 21.385 -22.094
701 HB2 ALA 90 2HB ALA 90 30.363 21.507 -20.690
702 HB3 ALA 90 3HB ALA 90 29.854 22.978 -21.555
703 H LYS 91 H LYS 91 31.775 24.287 -22.640
704 HA LYS 91 HA LYS 91 33.262 25.800 -21.877
705 HB2 LYS 91 1HB LYS 91 32.544 24.271 -19.815
706 HB3 LYS 91 2HB LYS 91 34.258 23.901 -19.819
707 HG2 LYS 91 1HG LYS 91 34.811 26.238 -19.465
708 HG3 LYS 91 2HG LYS 91 33.105 26.708 -19.664
709 HD2 LYS 91 1HD LYS 91 33.724 24.591 -17.665
710 HD3 LYS 91 2HD LYS 91 34.234 26.243 -17.260
711 HE2 LYS 91 1HE LYS 91 31.905 27.037 -17.626
712 HE3 LYS 91 2HE LYS 91 31.403 25.375 -17.995
713 HZ1 LYS 91 1HZ LYS 91 30.972 26.053 -15.659
714 HZ2 LYS 91 2HZ LYS 91 32.592 26.204 -15.406
715 HZ3 LYS 91 3HZ LYS 91 31.949 24.730 -15.758
716 H ILE 92 H ILE 92 35.582 26.214 -21.284
717 HA ILE 92 HA ILE 92 37.745 26.299 -21.775
718 HB ILE 92 HB ILE 92 37.542 23.332 -22.155
719 HG12 ILE 92 1HG1 ILE 92 38.256 24.985 -19.712
720 HG13 ILE 92 2HG1 ILE 92 36.749 24.107 -19.943
721 HG21 ILE 92 1HG2 ILE 92 40.007 23.314 -21.752
722 HG22 ILE 92 2HG2 ILE 92 39.625 24.311 -23.162
723 HG23 ILE 92 3HG2 ILE 92 39.996 25.089 -21.605
724 HD11 ILE 92 1HD1 ILE 92 38.064 21.955 -20.029
725 HD12 ILE 92 2HD1 ILE 92 39.508 22.892 -19.565
726 HD13 ILE 92 3HD1 ILE 92 38.114 22.804 -18.467
727 H GLU 93 H GLU 93 37.652 27.576 -23.398
728 HA GLU 93 HA GLU 93 37.720 26.436 -26.153
729 HB2 GLU 93 1HB GLU 93 36.730 28.732 -26.751
730 HB3 GLU 93 2HB GLU 93 35.652 27.554 -26.004
731 HG2 GLU 93 1HG GLU 93 37.033 29.734 -24.387
732 HG3 GLU 93 2HG GLU 93 35.471 29.980 -25.176
733 H GLU 94 H GLU 94 39.169 27.520 -27.621
734 HA GLU 94 HA GLU 94 41.515 28.541 -26.185
735 HB2 GLU 94 1HB GLU 94 41.067 27.834 -29.102
736 HB3 GLU 94 2HB GLU 94 42.597 28.397 -28.420
737 HG2 GLU 94 1HG GLU 94 42.563 26.423 -26.877
738 HG3 GLU 94 2HG GLU 94 41.157 25.815 -27.773
739 H ASP 95 H ASP 95 42.089 30.569 -25.990
740 HA ASP 95 HA ASP 95 41.664 32.362 -28.314
741 HB2 ASP 95 1HB ASP 95 40.061 33.109 -26.562
742 HB3 ASP 95 2HB ASP 95 41.413 33.293 -25.432
743 H ILE 96 H ILE 96 43.677 31.990 -29.016
744 HA ILE 96 HA ILE 96 45.922 32.657 -27.161
745 HB ILE 96 HB ILE 96 46.400 31.188 -29.769
746 HG12 ILE 96 1HG1 ILE 96 45.442 29.838 -27.204
747 HG13 ILE 96 2HG1 ILE 96 44.527 29.940 -28.713
748 HG21 ILE 96 1HG2 ILE 96 48.285 32.022 -28.269
749 HG22 ILE 96 2HG2 ILE 96 47.700 30.926 -26.996
750 HG23 ILE 96 3HG2 ILE 96 48.321 30.270 -28.531
751 HD11 ILE 96 1HD1 ILE 96 45.445 27.739 -28.590
752 HD12 ILE 96 2HD1 ILE 96 46.346 28.611 -29.850
753 HD13 ILE 96 3HD1 ILE 96 47.073 28.351 -28.243
754 H ARG 97 H ARG 97 44.087 34.474 -28.618
755 HA ARG 97 HA ARG 97 45.652 35.484 -30.901
756 HB2 ARG 97 1HB ARG 97 43.118 35.424 -30.729
757 HB3 ARG 97 2HB ARG 97 43.234 36.702 -29.523
758 HG2 ARG 97 1HG ARG 97 44.732 37.635 -31.714
759 HG3 ARG 97 2HG ARG 97 43.289 36.883 -32.424
760 HD2 ARG 97 1HD ARG 97 41.821 38.290 -31.203
761 HD3 ARG 97 2HD ARG 97 43.080 38.745 -30.044
762 HE ARG 97 HE ARG 97 42.610 39.899 -32.690
763 HH11 ARG 97 1HH1 ARG 97 44.929 39.610 -30.022
764 HH12 ARG 97 2HH1 ARG 97 45.758 41.079 -30.481
765 HH21 ARG 97 1HH2 ARG 97 43.737 41.745 -33.204
766 HH22 ARG 97 2HH2 ARG 97 45.110 42.245 -32.253
767 H GLN 98 H GLN 98 47.397 35.535 -29.066
768 HA GLN 98 HA GLN 98 49.022 36.740 -28.057
769 HB2 GLN 98 1HB GLN 98 48.815 38.187 -30.101
770 HB3 GLN 98 2HB GLN 98 47.751 39.269 -29.200
771 HG2 GLN 98 1HG GLN 98 49.549 39.724 -27.552
772 HG3 GLN 98 2HG GLN 98 50.606 38.556 -28.351
773 HE21 GLN 98 1HE2 GLN 98 51.940 41.064 -30.322
774 HE22 GLN 98 2HE2 GLN 98 52.189 39.704 -29.260
775 HXT GLN 98 HO GLN 98 46.544 38.645 -25.755
Start of MODEL 15
1 H1 SER 1 1H SER 1 -0.380 52.781 -0.740
2 H2 SER 1 2H SER 1 -1.235 53.934 -1.322
3 H3 SER 1 3H SER 1 0.354 53.762 -1.682
4 HA SER 1 HA SER 1 -1.943 52.335 -2.903
5 HB2 SER 1 1HB SER 1 -1.266 54.634 -3.752
6 HB3 SER 1 2HB SER 1 0.330 53.961 -4.160
7 HG SER 1 HG SER 1 -0.868 52.339 -5.430
8 H GLN 2 H GLN 2 0.773 51.614 -1.460
9 HA GLN 2 HA GLN 2 2.014 49.868 -3.474
10 HB2 GLN 2 1HB GLN 2 3.312 51.092 -1.718
11 HB3 GLN 2 2HB GLN 2 2.542 50.085 -0.486
12 HG2 GLN 2 1HG GLN 2 3.550 48.074 -1.483
13 HG3 GLN 2 2HG GLN 2 4.283 49.064 -2.757
14 HE21 GLN 2 1HE2 GLN 2 6.388 48.425 0.479
15 HE22 GLN 2 2HE2 GLN 2 5.128 47.408 -0.177
16 H GLN 3 H GLN 3 1.108 48.000 -4.004
17 HA GLN 3 HA GLN 3 -0.058 46.278 -1.864
18 HB2 GLN 3 1HB GLN 3 -1.272 46.842 -4.602
19 HB3 GLN 3 2HB GLN 3 -1.853 45.632 -3.448
20 HG2 GLN 3 1HG GLN 3 -2.320 47.463 -1.818
21 HG3 GLN 3 2HG GLN 3 -1.838 48.643 -3.049
22 HE21 GLN 3 1HE2 GLN 3 -4.971 48.739 -4.500
23 HE22 GLN 3 2HE2 GLN 3 -3.412 49.479 -4.225
24 H SER 4 H SER 4 -0.253 43.970 -2.788
25 HA SER 4 HA SER 4 1.669 43.391 -4.956
26 HB2 SER 4 1HB SER 4 2.897 41.775 -3.533
27 HB3 SER 4 2HB SER 4 3.067 43.432 -2.919
28 HG SER 4 HG SER 4 2.568 41.889 -1.273
29 H HIS 5 H HIS 5 1.707 40.799 -5.065
30 HA HIS 5 HA HIS 5 -1.023 39.736 -4.525
31 HB2 HIS 5 1HB HIS 5 -0.785 40.560 -6.928
32 HB3 HIS 5 2HB HIS 5 0.510 39.372 -7.134
33 HD1 HIS 5 HD1 HIS 5 -0.236 36.776 -7.068
34 HD2 HIS 5 HD2 HIS 5 -3.341 39.574 -7.036
35 HE1 HIS 5 HE1 HIS 5 -2.370 35.528 -7.597
36 H SER 6 H SER 6 -0.959 37.408 -4.251
37 HA SER 6 HA SER 6 1.438 36.470 -2.995
38 HB2 SER 6 1HB SER 6 0.228 34.251 -3.077
39 HB3 SER 6 2HB SER 6 -0.714 35.575 -2.351
40 HG SER 6 HG SER 6 -0.890 34.773 -5.077
41 H SER 7 H SER 7 3.262 35.870 -3.945
42 HA SER 7 HA SER 7 3.204 34.062 -6.262
43 HB2 SER 7 1HB SER 7 3.208 36.314 -7.309
44 HB3 SER 7 2HB SER 7 4.650 36.745 -6.367
45 HG SER 7 HG SER 7 5.788 35.127 -7.437
46 HA PRO 8 HA PRO 8 6.576 33.757 -3.094
47 HB2 PRO 8 1HB PRO 8 6.217 31.240 -2.131
48 HB3 PRO 8 2HB PRO 8 5.250 32.629 -1.534
49 HG2 PRO 8 1HG PRO 8 4.544 30.582 -3.613
50 HG3 PRO 8 2HG PRO 8 3.597 31.122 -2.190
51 HD2 PRO 8 1HD PRO 8 3.195 32.121 -4.683
52 HD3 PRO 8 2HD PRO 8 2.999 33.134 -3.211
53 H GLY 9 H GLY 9 8.502 32.780 -3.274
54 HA2 GLY 9 1HA GLY 9 9.600 30.626 -4.304
55 HA3 GLY 9 2HA GLY 9 8.957 31.274 -5.820
56 H GLU 10 H GLU 10 10.049 33.447 -3.350
57 HA GLU 10 HA GLU 10 12.266 34.277 -5.022
58 HB2 GLU 10 1HB GLU 10 12.560 36.074 -3.305
59 HB3 GLU 10 2HB GLU 10 10.948 36.051 -4.018
60 HG2 GLU 10 1HG GLU 10 11.485 34.610 -1.405
61 HG3 GLU 10 2HG GLU 10 11.196 36.353 -1.436
62 H ILE 11 H ILE 11 11.783 31.990 -3.059
63 HA ILE 11 HA ILE 11 14.237 31.831 -1.578
64 HB ILE 11 HB ILE 11 11.987 29.801 -2.045
65 HG12 ILE 11 1HG1 ILE 11 10.936 31.834 -1.197
66 HG13 ILE 11 2HG1 ILE 11 10.958 30.596 0.044
67 HG21 ILE 11 1HG2 ILE 11 14.056 30.170 0.053
68 HG22 ILE 11 2HG2 ILE 11 12.700 29.018 0.148
69 HG23 ILE 11 3HG2 ILE 11 13.906 28.869 -1.139
70 HD11 ILE 11 1HD1 ILE 11 11.451 32.840 0.977
71 HD12 ILE 11 2HD1 ILE 11 12.825 31.743 1.212
72 HD13 ILE 11 3HD1 ILE 11 12.879 32.978 -0.065
73 H THR 12 H THR 12 15.284 32.185 -3.787
74 HA THR 12 HA THR 12 15.062 30.220 -5.840
75 HB THR 12 HB THR 12 17.135 31.237 -6.767
76 HG1 THR 12 HG1 THR 12 17.669 31.720 -4.264
77 HG21 THR 12 1HG2 THR 12 15.333 33.393 -5.596
78 HG22 THR 12 2HG2 THR 12 14.883 32.387 -6.994
79 HG23 THR 12 3HG2 THR 12 16.290 33.470 -7.087
80 H SER 13 H SER 13 15.920 28.271 -6.137
81 HA SER 13 HA SER 13 17.599 27.112 -4.085
82 HB2 SER 13 1HB SER 13 15.844 25.834 -5.301
83 HB3 SER 13 2HB SER 13 16.795 25.993 -6.793
84 HG SER 13 HG SER 13 18.543 25.023 -5.336
85 H SER 14 H SER 14 18.322 29.008 -6.710
86 HA SER 14 HA SER 14 20.207 29.412 -7.983
87 HB2 SER 14 1HB SER 14 21.550 28.643 -5.377
88 HB3 SER 14 2HB SER 14 22.200 29.708 -6.647
89 HG SER 14 HG SER 14 20.029 30.147 -4.882
90 HA PRO 15 HA PRO 15 21.496 24.971 -8.500
91 HB2 PRO 15 1HB PRO 15 20.711 24.500 -11.084
92 HB3 PRO 15 2HB PRO 15 19.630 24.254 -9.675
93 HG2 PRO 15 1HG PRO 15 19.825 26.648 -11.496
94 HG3 PRO 15 2HG PRO 15 18.371 25.719 -11.007
95 HD2 PRO 15 1HD PRO 15 19.042 28.010 -9.756
96 HD3 PRO 15 2HD PRO 15 18.397 26.610 -8.828
97 H GLN 16 H GLN 16 21.726 27.741 -10.772
98 HA GLN 16 HA GLN 16 24.214 26.783 -11.943
99 HB2 GLN 16 1HB GLN 16 22.852 29.498 -11.898
100 HB3 GLN 16 2HB GLN 16 24.365 29.172 -12.759
101 HG2 GLN 16 1HG GLN 16 23.255 27.490 -14.142
102 HG3 GLN 16 2HG GLN 16 21.732 27.749 -13.276
103 HE21 GLN 16 1HE2 GLN 16 22.780 30.151 -16.326
104 HE22 GLN 16 2HE2 GLN 16 23.719 28.753 -15.855
105 H GLY 17 H GLY 17 23.352 28.189 -8.934
106 HA2 GLY 17 1HA GLY 17 25.880 29.561 -8.477
107 HA3 GLY 17 2HA GLY 17 24.628 29.184 -7.273
108 H LEU 18 H LEU 18 24.741 26.305 -8.437
109 HA LEU 18 HA LEU 18 26.711 25.298 -6.536
110 HB2 LEU 18 1HB LEU 18 25.220 23.845 -8.746
111 HB3 LEU 18 2HB LEU 18 26.069 23.100 -7.404
112 HG LEU 18 HG LEU 18 23.602 24.839 -7.154
113 HD11 LEU 18 1HD1 LEU 18 23.919 21.818 -6.959
114 HD12 LEU 18 2HD1 LEU 18 23.174 22.705 -8.309
115 HD13 LEU 18 3HD1 LEU 18 22.414 22.744 -6.706
116 HD21 LEU 18 1HD2 LEU 18 24.962 24.920 -5.109
117 HD22 LEU 18 2HD2 LEU 18 25.072 23.146 -5.083
118 HD23 LEU 18 3HD2 LEU 18 23.504 23.954 -4.829
119 H ASP 19 H ASP 19 26.459 25.861 -9.993
120 HA ASP 19 HA ASP 19 28.982 24.556 -10.670
121 HB2 ASP 19 1HB ASP 19 26.664 25.434 -11.993
122 HB3 ASP 19 2HB ASP 19 27.919 26.555 -12.549
123 H ASN 20 H ASN 20 27.757 27.736 -9.836
124 HA ASN 20 HA ASN 20 30.520 28.860 -10.046
125 HB2 ASN 20 1HB ASN 20 27.783 30.140 -10.400
126 HB3 ASN 20 2HB ASN 20 29.262 31.064 -10.157
127 HD21 ASN 20 1HD2 ASN 20 30.639 30.273 -13.337
128 HD22 ASN 20 2HD2 ASN 20 31.120 30.321 -11.664
129 HA PRO 21 HA PRO 21 29.418 28.945 -5.545
130 HB2 PRO 21 1HB PRO 21 32.099 28.864 -4.766
131 HB3 PRO 21 2HB PRO 21 31.078 27.422 -4.971
132 HG2 PRO 21 1HG PRO 21 32.991 28.651 -6.883
133 HG3 PRO 21 2HG PRO 21 32.789 26.940 -6.447
134 HD2 PRO 21 1HD PRO 21 31.786 27.863 -8.700
135 HD3 PRO 21 2HD PRO 21 30.838 26.717 -7.687
136 H ALA 22 H ALA 22 31.842 30.630 -7.541
137 HA ALA 22 HA ALA 22 32.355 32.769 -5.748
138 HB1 ALA 22 1HB ALA 22 33.141 33.970 -7.773
139 HB2 ALA 22 2HB ALA 22 33.757 32.302 -7.711
140 HB3 ALA 22 3HB ALA 22 32.406 32.717 -8.798
141 H LEU 23 H LEU 23 29.822 32.351 -8.232
142 HA LEU 23 HA LEU 23 28.797 35.052 -7.846
143 HB2 LEU 23 1HB LEU 23 27.492 32.657 -9.184
144 HB3 LEU 23 2HB LEU 23 26.974 34.333 -9.309
145 HG LEU 23 HG LEU 23 29.509 33.130 -10.463
146 HD11 LEU 23 1HD1 LEU 23 28.427 33.554 -12.618
147 HD12 LEU 23 2HD1 LEU 23 27.016 34.263 -11.795
148 HD13 LEU 23 3HD1 LEU 23 27.384 32.534 -11.609
149 HD21 LEU 23 1HD2 LEU 23 28.503 35.977 -10.671
150 HD22 LEU 23 2HD2 LEU 23 29.851 35.264 -11.596
151 HD23 LEU 23 3HD2 LEU 23 29.975 35.428 -9.834
152 H LEU 24 H LEU 24 27.978 31.762 -6.714
153 HA LEU 24 HA LEU 24 25.500 32.545 -5.497
154 HB2 LEU 24 1HB LEU 24 26.133 30.210 -5.962
155 HB3 LEU 24 2HB LEU 24 27.404 30.296 -4.754
156 HG LEU 24 HG LEU 24 25.820 30.455 -2.970
157 HD11 LEU 24 1HD1 LEU 24 24.097 31.873 -3.833
158 HD12 LEU 24 2HD1 LEU 24 23.340 30.330 -3.406
159 HD13 LEU 24 3HD1 LEU 24 23.687 30.705 -5.110
160 HD21 LEU 24 1HD2 LEU 24 26.285 28.224 -3.948
161 HD22 LEU 24 2HD2 LEU 24 24.807 28.371 -4.919
162 HD23 LEU 24 3HD2 LEU 24 24.705 28.328 -3.145
163 H ARG 25 H ARG 25 28.852 32.363 -4.299
164 HA ARG 25 HA ARG 25 28.386 33.121 -1.610
165 HB2 ARG 25 1HB ARG 25 30.524 32.314 -2.384
166 HB3 ARG 25 2HB ARG 25 30.660 33.595 -3.564
167 HG2 ARG 25 1HG ARG 25 30.561 34.338 -0.653
168 HG3 ARG 25 2HG ARG 25 32.037 33.611 -1.302
169 HD2 ARG 25 1HD ARG 25 30.690 36.153 -2.278
170 HD3 ARG 25 2HD ARG 25 32.199 36.045 -1.376
171 HE ARG 25 HE ARG 25 31.778 35.122 -4.190
172 HH11 ARG 25 1HH1 ARG 25 34.006 36.247 -1.678
173 HH12 ARG 25 2HH1 ARG 25 35.327 36.398 -2.803
174 HH21 ARG 25 1HH2 ARG 25 33.492 35.339 -5.540
175 HH22 ARG 25 2HH2 ARG 25 35.044 35.876 -4.953
176 H ASP 26 H ASP 26 28.781 35.108 -4.567
177 HA ASP 26 HA ASP 26 28.731 37.612 -3.189
178 HB2 ASP 26 1HB ASP 26 29.495 37.061 -5.576
179 HB3 ASP 26 2HB ASP 26 27.786 37.142 -6.028
180 H MET 27 H MET 27 26.157 35.703 -4.788
181 HA MET 27 HA MET 27 24.003 37.546 -4.387
182 HB2 MET 27 1HB MET 27 24.019 35.462 -5.808
183 HB3 MET 27 2HB MET 27 23.882 34.506 -4.331
184 HG2 MET 27 1HG MET 27 21.890 36.645 -5.060
185 HG3 MET 27 2HG MET 27 21.760 35.000 -5.679
186 HE1 MET 27 1HE MET 27 20.915 32.962 -4.377
187 HE2 MET 27 2HE MET 27 22.334 32.999 -3.305
188 HE3 MET 27 3HE MET 27 20.702 32.891 -2.612
189 H LEU 28 H LEU 28 25.141 34.821 -2.417
190 HA LEU 28 HA LEU 28 23.188 35.034 -0.384
191 HB2 LEU 28 1HB LEU 28 25.978 33.967 -0.445
192 HB3 LEU 28 2HB LEU 28 24.969 33.895 1.002
193 HG LEU 28 HG LEU 28 24.088 32.744 -1.649
194 HD11 LEU 28 1HD1 LEU 28 25.581 31.529 0.654
195 HD12 LEU 28 2HD1 LEU 28 26.135 31.730 -1.016
196 HD13 LEU 28 3HD1 LEU 28 24.813 30.603 -0.658
197 HD21 LEU 28 1HD2 LEU 28 23.169 32.348 1.222
198 HD22 LEU 28 2HD2 LEU 28 22.594 31.403 -0.174
199 HD23 LEU 28 3HD2 LEU 28 22.279 33.141 -0.088
200 H LEU 29 H LEU 29 26.404 36.562 -0.657
201 HA LEU 29 HA LEU 29 26.361 37.734 1.974
202 HB2 LEU 29 1HB LEU 29 27.746 38.504 -0.605
203 HB3 LEU 29 2HB LEU 29 27.953 39.429 0.879
204 HG LEU 29 HG LEU 29 28.613 36.484 0.675
205 HD11 LEU 29 1HD1 LEU 29 29.932 37.737 -0.945
206 HD12 LEU 29 2HD1 LEU 29 30.946 37.184 0.406
207 HD13 LEU 29 3HD1 LEU 29 30.429 38.886 0.323
208 HD21 LEU 29 1HD2 LEU 29 28.291 37.284 2.970
209 HD22 LEU 29 2HD2 LEU 29 29.437 38.613 2.680
210 HD23 LEU 29 3HD2 LEU 29 30.000 36.924 2.665
211 H ALA 30 H ALA 30 25.088 38.748 -1.154
212 HA ALA 30 HA ALA 30 24.289 41.371 -0.156
213 HB1 ALA 30 1HB ALA 30 23.318 41.639 -2.401
214 HB2 ALA 30 2HB ALA 30 24.975 40.998 -2.511
215 HB3 ALA 30 3HB ALA 30 23.584 39.912 -2.738
216 H ASN 31 H ASN 31 22.931 38.222 0.159
217 HA ASN 31 HA ASN 31 20.185 39.407 0.294
218 HB2 ASN 31 1HB ASN 31 20.690 37.647 -1.455
219 HB3 ASN 31 2HB ASN 31 20.830 36.484 -0.137
220 HD21 ASN 31 1HD2 ASN 31 17.354 36.716 -1.583
221 HD22 ASN 31 2HD2 ASN 31 18.935 36.721 -2.359
222 HA PRO 32 HA PRO 32 21.013 38.398 4.591
223 HB2 PRO 32 1HB PRO 32 18.937 39.791 5.717
224 HB3 PRO 32 2HB PRO 32 20.465 40.556 5.173
225 HG2 PRO 32 1HG PRO 32 17.860 40.308 3.680
226 HG3 PRO 32 2HG PRO 32 18.851 41.772 3.982
227 HD2 PRO 32 1HD PRO 32 19.044 40.466 1.672
228 HD3 PRO 32 2HD PRO 32 20.520 41.098 2.482
229 H HIS 33 H HIS 33 17.949 37.889 2.846
230 HA HIS 33 HA HIS 33 16.813 36.241 4.974
231 HB2 HIS 33 1HB HIS 33 15.451 37.482 3.283
232 HB3 HIS 33 2HB HIS 33 16.082 36.411 2.026
233 HD1 HIS 33 HD1 HIS 33 13.822 36.360 5.085
234 HD2 HIS 33 HD2 HIS 33 14.883 33.936 1.863
235 HE1 HIS 33 HE1 HIS 33 12.226 34.402 5.089
236 H GLU 34 H GLU 34 18.455 35.700 1.874
237 HA GLU 34 HA GLU 34 18.138 32.853 1.902
238 HB2 GLU 34 1HB GLU 34 19.405 34.951 0.305
239 HB3 GLU 34 2HB GLU 34 20.277 33.443 0.247
240 HG2 GLU 34 1HG GLU 34 18.576 33.787 -1.566
241 HG3 GLU 34 2HG GLU 34 18.454 32.300 -0.636
242 H LEU 35 H LEU 35 20.676 35.104 2.964
243 HA LEU 35 HA LEU 35 22.579 33.042 3.555
244 HB2 LEU 35 1HB LEU 35 23.915 34.664 4.266
245 HB3 LEU 35 2HB LEU 35 22.843 35.484 3.183
246 HG LEU 35 HG LEU 35 21.691 36.543 5.047
247 HD11 LEU 35 1HD1 LEU 35 23.797 35.177 6.721
248 HD12 LEU 35 2HD1 LEU 35 22.034 35.225 6.967
249 HD13 LEU 35 3HD1 LEU 35 22.989 36.690 7.214
250 HD21 LEU 35 1HD2 LEU 35 24.694 36.787 4.794
251 HD22 LEU 35 2HD2 LEU 35 23.613 38.066 5.412
252 HD23 LEU 35 3HD2 LEU 35 23.476 37.517 3.729
253 H SER 36 H SER 36 19.807 34.334 5.223
254 HA SER 36 HA SER 36 20.480 33.299 7.829
255 HB2 SER 36 1HB SER 36 18.946 35.228 7.445
256 HB3 SER 36 2HB SER 36 17.748 34.098 6.782
257 HG SER 36 HG SER 36 17.666 33.073 8.782
258 H LEU 37 H LEU 37 18.369 32.158 5.130
259 HA LEU 37 HA LEU 37 17.520 29.818 6.591
260 HB2 LEU 37 1HB LEU 37 16.606 29.058 4.645
261 HB3 LEU 37 2HB LEU 37 16.497 30.763 4.634
262 HG LEU 37 HG LEU 37 18.262 30.833 2.886
263 HD11 LEU 37 1HD1 LEU 37 17.521 27.903 2.725
264 HD12 LEU 37 2HD1 LEU 37 19.128 28.571 3.060
265 HD13 LEU 37 3HD1 LEU 37 18.397 28.814 1.471
266 HD21 LEU 37 1HD2 LEU 37 15.577 29.537 2.341
267 HD22 LEU 37 2HD2 LEU 37 16.585 30.383 1.143
268 HD23 LEU 37 3HD2 LEU 37 15.894 31.280 2.501
269 H LEU 38 H LEU 38 20.256 30.698 4.670
270 HA LEU 38 HA LEU 38 21.221 28.065 4.287
271 HB2 LEU 38 1HB LEU 38 21.820 30.107 3.084
272 HB3 LEU 38 2HB LEU 38 22.731 30.664 4.497
273 HG LEU 38 HG LEU 38 24.142 28.601 4.380
274 HD11 LEU 38 1HD1 LEU 38 24.195 27.407 2.218
275 HD12 LEU 38 2HD1 LEU 38 22.743 28.298 1.709
276 HD13 LEU 38 3HD1 LEU 38 22.674 27.180 3.092
277 HD21 LEU 38 1HD2 LEU 38 24.187 30.393 1.955
278 HD22 LEU 38 2HD2 LEU 38 25.543 29.413 2.559
279 HD23 LEU 38 3HD2 LEU 38 24.914 30.757 3.535
280 H LYS 39 H LYS 39 21.933 30.465 6.864
281 HA LYS 39 HA LYS 39 23.682 28.582 8.225
282 HB2 LYS 39 1HB LYS 39 23.418 30.070 10.220
283 HB3 LYS 39 2HB LYS 39 24.102 30.812 8.774
284 HG2 LYS 39 1HG LYS 39 22.090 31.993 8.316
285 HG3 LYS 39 2HG LYS 39 21.173 31.087 9.495
286 HD2 LYS 39 1HD LYS 39 21.595 33.201 10.462
287 HD3 LYS 39 2HD LYS 39 22.703 32.074 11.270
288 HE2 LYS 39 1HE LYS 39 24.539 32.812 9.779
289 HE3 LYS 39 2HE LYS 39 23.418 33.903 8.936
290 HZ1 LYS 39 1HZ LYS 39 23.109 35.093 11.018
291 HZ2 LYS 39 2HZ LYS 39 24.707 35.072 10.610
292 HZ3 LYS 39 3HZ LYS 39 24.146 34.080 11.804
293 H GLU 40 H GLU 40 20.194 29.015 8.225
294 HA GLU 40 HA GLU 40 19.759 27.369 10.591
295 HB2 GLU 40 1HB GLU 40 18.096 28.117 8.168
296 HB3 GLU 40 2HB GLU 40 17.520 26.940 9.345
297 HG2 GLU 40 1HG GLU 40 17.716 28.680 11.105
298 HG3 GLU 40 2HG GLU 40 18.101 29.854 9.832
299 H ARG 41 H ARG 41 19.525 26.776 7.056
300 HA ARG 41 HA ARG 41 19.030 23.920 7.607
301 HB2 ARG 41 1HB ARG 41 19.224 25.435 4.983
302 HB3 ARG 41 2HB ARG 41 18.539 23.814 5.213
303 HG2 ARG 41 1HG ARG 41 16.853 24.767 6.730
304 HG3 ARG 41 2HG ARG 41 17.516 26.369 6.491
305 HD2 ARG 41 1HD ARG 41 17.090 26.038 4.004
306 HD3 ARG 41 2HD ARG 41 16.033 24.690 4.496
307 HE ARG 41 HE ARG 41 15.383 26.917 6.114
308 HH11 ARG 41 1HH1 ARG 41 15.202 26.147 2.666
309 HH12 ARG 41 2HH1 ARG 41 13.891 27.264 2.396
310 HH21 ARG 41 1HH2 ARG 41 13.729 28.308 5.697
311 HH22 ARG 41 2HH2 ARG 41 13.067 28.465 4.090
312 H ASN 42 H ASN 42 21.730 25.784 6.490
313 HA ASN 42 HA ASN 42 23.300 23.251 6.273
314 HB2 ASN 42 1HB ASN 42 22.585 24.217 3.998
315 HB3 ASN 42 2HB ASN 42 23.710 25.517 4.305
316 HD21 ASN 42 1HD2 ASN 42 25.433 22.883 2.376
317 HD22 ASN 42 2HD2 ASN 42 24.139 24.023 2.145
318 HA PRO 43 HA PRO 43 25.311 26.650 8.717
319 HB2 PRO 43 1HB PRO 43 26.370 24.994 10.702
320 HB3 PRO 43 2HB PRO 43 24.847 25.929 10.802
321 HG2 PRO 43 1HG PRO 43 25.248 23.049 10.081
322 HG3 PRO 43 2HG PRO 43 24.027 23.794 11.153
323 HD2 PRO 43 1HD PRO 43 23.420 23.074 8.638
324 HD3 PRO 43 2HD PRO 43 22.759 24.588 9.355
325 HA PRO 44 HA PRO 44 29.433 24.615 8.034
326 HB2 PRO 44 1HB PRO 44 29.781 22.599 6.221
327 HB3 PRO 44 2HB PRO 44 29.505 22.313 7.970
328 HG2 PRO 44 1HG PRO 44 27.544 22.299 5.722
329 HG3 PRO 44 2HG PRO 44 27.835 21.057 6.976
330 HD2 PRO 44 1HD PRO 44 25.842 22.834 7.234
331 HD3 PRO 44 2HD PRO 44 26.823 22.344 8.654
332 H LEU 45 H LEU 45 27.104 24.672 5.231
333 HA LEU 45 HA LEU 45 29.157 25.856 3.512
334 HB2 LEU 45 1HB LEU 45 27.247 24.649 2.561
335 HB3 LEU 45 2HB LEU 45 26.152 25.855 3.235
336 HG LEU 45 HG LEU 45 27.004 27.566 1.743
337 HD11 LEU 45 1HD1 LEU 45 29.387 26.899 1.552
338 HD12 LEU 45 2HD1 LEU 45 28.646 27.086 -0.042
339 HD13 LEU 45 3HD1 LEU 45 28.914 25.462 0.623
340 HD21 LEU 45 1HD2 LEU 45 26.504 24.993 0.196
341 HD22 LEU 45 2HD2 LEU 45 26.201 26.658 -0.359
342 HD23 LEU 45 3HD2 LEU 45 25.238 25.977 0.965
343 H ALA 46 H ALA 46 26.670 26.928 5.751
344 HA ALA 46 HA ALA 46 26.768 29.685 5.042
345 HB1 ALA 46 1HB ALA 46 25.670 30.089 7.124
346 HB2 ALA 46 2HB ALA 46 25.028 28.581 6.433
347 HB3 ALA 46 3HB ALA 46 26.197 28.518 7.770
348 H GLU 47 H GLU 47 28.618 27.898 7.622
349 HA GLU 47 HA GLU 47 29.879 30.232 8.636
350 HB2 GLU 47 1HB GLU 47 31.520 28.814 9.656
351 HB3 GLU 47 2HB GLU 47 29.930 28.062 9.803
352 HG2 GLU 47 1HG GLU 47 30.454 26.461 8.097
353 HG3 GLU 47 2HG GLU 47 31.951 27.295 7.676
354 H ALA 48 H ALA 48 30.702 28.253 5.830
355 HA ALA 48 HA ALA 48 33.208 29.370 5.289
356 HB1 ALA 48 1HB ALA 48 32.262 27.359 4.253
357 HB2 ALA 48 2HB ALA 48 31.077 28.373 3.400
358 HB3 ALA 48 3HB ALA 48 32.797 28.552 3.063
359 H LEU 49 H LEU 49 29.942 30.391 4.367
360 HA LEU 49 HA LEU 49 30.795 32.554 2.696
361 HB2 LEU 49 1HB LEU 49 28.487 31.514 2.778
362 HB3 LEU 49 2HB LEU 49 28.260 32.242 4.362
363 HG LEU 49 HG LEU 49 28.731 34.501 3.131
364 HD11 LEU 49 1HD1 LEU 49 27.838 32.684 0.868
365 HD12 LEU 49 2HD1 LEU 49 29.414 33.492 1.013
366 HD13 LEU 49 3HD1 LEU 49 27.942 34.453 0.798
367 HD21 LEU 49 1HD2 LEU 49 26.632 33.872 4.220
368 HD22 LEU 49 2HD2 LEU 49 26.152 32.939 2.783
369 HD23 LEU 49 3HD2 LEU 49 26.328 34.710 2.686
370 H LEU 50 H LEU 50 30.017 32.237 6.173
371 HA LEU 50 HA LEU 50 30.022 35.032 6.774
372 HB2 LEU 50 1HB LEU 50 30.900 32.836 8.670
373 HB3 LEU 50 2HB LEU 50 30.243 34.406 9.084
374 HG LEU 50 HG LEU 50 28.821 31.967 8.112
375 HD11 LEU 50 1HD1 LEU 50 29.262 32.169 10.470
376 HD12 LEU 50 2HD1 LEU 50 27.527 32.237 10.120
377 HD13 LEU 50 3HD1 LEU 50 28.415 33.738 10.501
378 HD21 LEU 50 1HD2 LEU 50 26.704 33.252 8.082
379 HD22 LEU 50 2HD2 LEU 50 27.809 33.634 6.755
380 HD23 LEU 50 3HD2 LEU 50 27.671 34.751 8.139
381 H SER 51 H SER 51 32.598 32.669 6.456
382 HA SER 51 HA SER 51 34.624 34.241 7.752
383 HB2 SER 51 1HB SER 51 34.800 32.011 5.730
384 HB3 SER 51 2HB SER 51 36.111 32.597 6.756
385 HG SER 51 HG SER 51 33.664 31.462 7.680
386 H GLY 52 H GLY 52 33.218 34.151 4.533
387 HA2 GLY 52 1HA GLY 52 33.504 35.759 2.868
388 HA3 GLY 52 2HA GLY 52 34.896 36.426 3.735
389 H ASP 53 H ASP 53 35.723 33.391 3.865
390 HA ASP 53 HA ASP 53 37.612 33.542 1.701
391 HB2 ASP 53 1HB ASP 53 38.015 32.295 3.871
392 HB3 ASP 53 2HB ASP 53 36.822 31.162 3.365
393 H LEU 54 H LEU 54 37.015 33.310 -0.377
394 HA LEU 54 HA LEU 54 34.703 31.851 -1.228
395 HB2 LEU 54 1HB LEU 54 35.846 33.584 -2.574
396 HB3 LEU 54 2HB LEU 54 37.227 32.518 -2.777
397 HG LEU 54 HG LEU 54 35.504 32.790 -4.656
398 HD11 LEU 54 1HD1 LEU 54 35.951 30.639 -5.596
399 HD12 LEU 54 2HD1 LEU 54 36.324 29.972 -3.996
400 HD13 LEU 54 3HD1 LEU 54 37.384 31.199 -4.712
401 HD21 LEU 54 1HD2 LEU 54 33.457 32.330 -3.370
402 HD22 LEU 54 2HD2 LEU 54 33.999 30.653 -3.154
403 HD23 LEU 54 3HD2 LEU 54 33.648 31.259 -4.774
404 H GLU 55 H GLU 55 38.136 30.945 -0.710
405 HA GLU 55 HA GLU 55 38.024 28.477 -2.116
406 HB2 GLU 55 1HB GLU 55 39.607 29.102 0.389
407 HB3 GLU 55 2HB GLU 55 39.933 27.793 -0.734
408 HG2 GLU 55 1HG GLU 55 40.008 30.731 -1.472
409 HG3 GLU 55 2HG GLU 55 41.389 29.806 -0.901
410 H LYS 56 H LYS 56 37.534 29.106 1.410
411 HA LYS 56 HA LYS 56 36.781 26.389 1.879
412 HB2 LYS 56 1HB LYS 56 36.265 26.918 4.067
413 HB3 LYS 56 2HB LYS 56 37.503 28.142 3.632
414 HG2 LYS 56 1HG LYS 56 35.568 29.661 3.292
415 HG3 LYS 56 2HG LYS 56 34.629 28.408 4.085
416 HD2 LYS 56 1HD LYS 56 37.198 29.182 5.398
417 HD3 LYS 56 2HD LYS 56 35.866 30.320 5.481
418 HE2 LYS 56 1HE LYS 56 34.402 28.588 6.471
419 HE3 LYS 56 2HE LYS 56 35.725 27.416 6.382
420 HZ1 LYS 56 1HZ LYS 56 36.945 28.827 7.939
421 HZ2 LYS 56 2HZ LYS 56 35.500 28.344 8.581
422 HZ3 LYS 56 3HZ LYS 56 35.677 29.886 8.014
423 H PHE 57 H PHE 57 34.868 29.264 0.936
424 HA PHE 57 HA PHE 57 32.340 27.970 1.174
425 HB2 PHE 57 1HB PHE 57 32.666 30.410 0.848
426 HB3 PHE 57 2HB PHE 57 33.171 30.095 -0.818
427 HD1 PHE 57 HD1 PHE 57 30.320 30.061 1.540
428 HD2 PHE 57 HD2 PHE 57 31.556 29.512 -2.546
429 HE1 PHE 57 HE1 PHE 57 27.939 30.104 0.818
430 HE2 PHE 57 HE2 PHE 57 29.175 29.545 -3.271
431 HZ PHE 57 HZ PHE 57 27.367 29.841 -1.595
432 H SER 58 H SER 58 34.478 28.208 -1.716
433 HA SER 58 HA SER 58 32.798 26.665 -3.422
434 HB2 SER 58 1HB SER 58 34.683 28.103 -4.175
435 HB3 SER 58 2HB SER 58 35.831 26.992 -3.402
436 HG SER 58 HG SER 58 35.731 26.370 -5.497
437 H ARG 59 H ARG 59 35.428 25.786 -1.183
438 HA ARG 59 HA ARG 59 35.555 23.048 -2.021
439 HB2 ARG 59 1HB ARG 59 37.316 24.217 -0.684
440 HB3 ARG 59 2HB ARG 59 36.204 24.247 0.691
441 HG2 ARG 59 1HG ARG 59 36.136 21.590 0.101
442 HG3 ARG 59 2HG ARG 59 37.738 21.960 -0.529
443 HD2 ARG 59 1HD ARG 59 38.490 22.675 1.647
444 HD3 ARG 59 2HD ARG 59 36.828 22.648 2.279
445 HE ARG 59 HE ARG 59 36.799 20.256 2.207
446 HH11 ARG 59 1HH1 ARG 59 40.002 21.509 1.328
447 HH12 ARG 59 2HH1 ARG 59 40.744 19.943 1.522
448 HH21 ARG 59 1HH2 ARG 59 37.774 18.359 2.395
449 HH22 ARG 59 2HH2 ARG 59 39.502 18.175 2.140
450 H VAL 60 H VAL 60 33.839 24.617 0.761
451 HA VAL 60 HA VAL 60 32.783 22.071 1.577
452 HB VAL 60 HB VAL 60 33.045 24.101 3.077
453 HG11 VAL 60 1HG1 VAL 60 31.297 25.667 3.238
454 HG12 VAL 60 2HG1 VAL 60 32.040 25.737 1.636
455 HG13 VAL 60 3HG1 VAL 60 30.482 24.923 1.859
456 HG21 VAL 60 1HG2 VAL 60 30.318 22.774 3.092
457 HG22 VAL 60 2HG2 VAL 60 31.814 22.061 3.743
458 HG23 VAL 60 3HG2 VAL 60 31.142 23.532 4.477
459 H LEU 61 H LEU 61 31.782 24.536 -0.734
460 HA LEU 61 HA LEU 61 29.116 23.640 -1.140
461 HB2 LEU 61 1HB LEU 61 30.290 25.706 -2.049
462 HB3 LEU 61 2HB LEU 61 31.015 24.674 -3.259
463 HG LEU 61 HG LEU 61 28.324 24.105 -3.536
464 HD11 LEU 61 1HD1 LEU 61 28.706 27.060 -2.935
465 HD12 LEU 61 2HD1 LEU 61 27.810 25.894 -1.929
466 HD13 LEU 61 3HD1 LEU 61 27.217 26.296 -3.552
467 HD21 LEU 61 1HD2 LEU 61 30.290 24.989 -5.201
468 HD22 LEU 61 2HD2 LEU 61 29.293 26.461 -5.086
469 HD23 LEU 61 3HD2 LEU 61 28.577 24.941 -5.630
470 H VAL 62 H VAL 62 32.207 22.595 -2.756
471 HA VAL 62 HA VAL 62 30.739 20.656 -4.331
472 HB VAL 62 HB VAL 62 32.883 21.637 -5.110
473 HG11 VAL 62 1HG1 VAL 62 34.170 19.878 -2.994
474 HG12 VAL 62 2HG1 VAL 62 35.030 20.641 -4.349
475 HG13 VAL 62 3HG1 VAL 62 34.243 21.648 -3.133
476 HG21 VAL 62 1HG2 VAL 62 33.738 19.593 -6.128
477 HG22 VAL 62 2HG2 VAL 62 32.923 18.612 -4.887
478 HG23 VAL 62 3HG2 VAL 62 31.965 19.547 -6.061
479 H GLU 63 H GLU 63 32.438 20.522 -1.226
480 HA GLU 63 HA GLU 63 32.319 17.668 -0.912
481 HB2 GLU 63 1HB GLU 63 32.119 19.829 1.217
482 HB3 GLU 63 2HB GLU 63 32.435 18.122 1.524
483 HG2 GLU 63 1HG GLU 63 34.341 19.152 -0.415
484 HG3 GLU 63 2HG GLU 63 34.305 20.189 1.018
485 H GLN 64 H GLN 64 29.976 20.272 -0.137
486 HA GLN 64 HA GLN 64 27.930 18.547 0.919
487 HB2 GLN 64 1HB GLN 64 27.888 21.274 -0.405
488 HB3 GLN 64 2HB GLN 64 26.411 20.482 0.138
489 HG2 GLN 64 1HG GLN 64 28.737 20.961 2.017
490 HG3 GLN 64 2HG GLN 64 27.508 22.195 1.708
491 HE21 GLN 64 1HE2 GLN 64 26.794 19.576 4.522
492 HE22 GLN 64 2HE2 GLN 64 28.363 20.041 3.913
493 H GLN 65 H GLN 65 28.688 19.680 -2.413
494 HA GLN 65 HA GLN 65 26.324 18.504 -3.561
495 HB2 GLN 65 1HB GLN 65 28.995 19.282 -4.751
496 HB3 GLN 65 2HB GLN 65 27.699 18.550 -5.703
497 HG2 GLN 65 1HG GLN 65 26.180 20.393 -5.004
498 HG3 GLN 65 2HG GLN 65 27.543 21.176 -4.207
499 HE21 GLN 65 1HE2 GLN 65 28.804 22.584 -7.138
500 HE22 GLN 65 2HE2 GLN 65 28.935 22.390 -5.401
501 H GLN 66 H GLN 66 29.607 17.183 -2.932
502 HA GLN 66 HA GLN 66 29.142 14.722 -4.333
503 HB2 GLN 66 1HB GLN 66 30.917 15.435 -1.976
504 HB3 GLN 66 2HB GLN 66 30.892 13.831 -2.713
505 HG2 GLN 66 1HG GLN 66 31.574 14.796 -4.864
506 HG3 GLN 66 2HG GLN 66 31.612 16.402 -4.139
507 HE21 GLN 66 1HE2 GLN 66 34.761 16.029 -2.709
508 HE22 GLN 66 2HE2 GLN 66 33.383 17.053 -3.041
509 H ASP 67 H ASP 67 28.610 15.686 -0.903
510 HA ASP 67 HA ASP 67 27.644 13.139 -0.024
511 HB2 ASP 67 1HB ASP 67 28.269 15.033 1.474
512 HB3 ASP 67 2HB ASP 67 26.839 15.895 0.893
513 H ARG 68 H ARG 68 25.987 15.991 -1.401
514 HA ARG 68 HA ARG 68 23.330 14.924 -1.193
515 HB2 ARG 68 1HB ARG 68 24.620 16.926 -3.063
516 HB3 ARG 68 2HB ARG 68 22.939 16.432 -3.245
517 HG2 ARG 68 1HG ARG 68 22.412 17.262 -1.004
518 HG3 ARG 68 2HG ARG 68 24.109 17.720 -0.752
519 HD2 ARG 68 1HD ARG 68 22.820 19.682 -1.430
520 HD3 ARG 68 2HD ARG 68 23.965 19.238 -2.718
521 HE ARG 68 HE ARG 68 21.436 17.915 -3.126
522 HH11 ARG 68 1HH1 ARG 68 22.929 21.106 -3.533
523 HH12 ARG 68 2HH1 ARG 68 21.836 21.537 -4.817
524 HH21 ARG 68 1HH2 ARG 68 20.118 18.515 -4.716
525 HH22 ARG 68 2HH2 ARG 68 20.252 20.084 -5.484
526 H ALA 69 H ALA 69 25.795 14.743 -3.795
527 HA ALA 69 HA ALA 69 24.165 13.393 -5.657
528 HB1 ALA 69 1HB ALA 69 27.175 13.139 -5.233
529 HB2 ALA 69 2HB ALA 69 26.287 12.677 -6.700
530 HB3 ALA 69 3HB ALA 69 26.363 14.385 -6.208
531 H ARG 70 H ARG 70 25.953 12.102 -2.847
532 HA ARG 70 HA ARG 70 25.905 9.376 -3.600
533 HB2 ARG 70 1HB ARG 70 25.525 10.543 -0.800
534 HB3 ARG 70 2HB ARG 70 26.032 8.884 -1.189
535 HG2 ARG 70 1HG ARG 70 27.857 10.331 -2.578
536 HG3 ARG 70 2HG ARG 70 27.502 11.420 -1.235
537 HD2 ARG 70 1HD ARG 70 29.319 10.132 -0.476
538 HD3 ARG 70 2HD ARG 70 27.899 9.424 0.313
539 HE ARG 70 HE ARG 70 28.145 7.487 -0.967
540 HH11 ARG 70 1HH1 ARG 70 30.384 9.930 -2.203
541 HH12 ARG 70 2HH1 ARG 70 31.224 8.782 -3.208
542 HH21 ARG 70 1HH2 ARG 70 29.261 6.089 -2.283
543 HH22 ARG 70 2HH2 ARG 70 30.597 6.650 -3.250
544 H ARG 71 H ARG 71 23.423 11.207 -1.788
545 HA ARG 71 HA ARG 71 21.590 8.902 -1.942
546 HB2 ARG 71 1HB ARG 71 19.984 10.494 -0.822
547 HB3 ARG 71 2HB ARG 71 21.456 10.109 0.071
548 HG2 ARG 71 1HG ARG 71 22.446 12.279 -0.660
549 HG3 ARG 71 2HG ARG 71 20.903 12.689 -1.430
550 HD2 ARG 71 1HD ARG 71 19.766 12.706 0.671
551 HD3 ARG 71 2HD ARG 71 21.136 11.936 1.493
552 HE ARG 71 HE ARG 71 20.864 14.766 0.772
553 HH11 ARG 71 1HH1 ARG 71 23.123 12.249 1.816
554 HH12 ARG 71 2HH1 ARG 71 24.291 13.414 2.397
555 HH21 ARG 71 1HH2 ARG 71 22.421 16.177 1.559
556 HH22 ARG 71 2HH2 ARG 71 23.905 15.547 2.258
557 H GLU 72 H GLU 72 22.039 11.997 -3.616
558 HA GLU 72 HA GLU 72 19.382 11.810 -4.791
559 HB2 GLU 72 1HB GLU 72 21.608 13.783 -5.281
560 HB3 GLU 72 2HB GLU 72 20.026 13.827 -6.076
561 HG2 GLU 72 1HG GLU 72 19.003 13.772 -3.715
562 HG3 GLU 72 2HG GLU 72 20.620 14.156 -3.120
563 H GLN 73 H GLN 73 22.583 10.795 -5.917
564 HA GLN 73 HA GLN 73 21.955 10.646 -8.693
565 HB2 GLN 73 1HB GLN 73 23.759 9.032 -6.896
566 HB3 GLN 73 2HB GLN 73 23.504 8.562 -8.580
567 HG2 GLN 73 1HG GLN 73 24.307 10.731 -9.361
568 HG3 GLN 73 2HG GLN 73 24.535 11.273 -7.695
569 HE21 GLN 73 1HE2 GLN 73 27.532 9.482 -9.524
570 HE22 GLN 73 2HE2 GLN 73 26.182 10.282 -10.291
571 H GLU 74 H GLU 74 21.126 8.527 -5.959
572 HA GLU 74 HA GLU 74 20.055 6.403 -7.550
573 HB2 GLU 74 1HB GLU 74 19.308 7.302 -4.745
574 HB3 GLU 74 2HB GLU 74 18.889 5.751 -5.480
575 HG2 GLU 74 1HG GLU 74 21.673 5.957 -5.771
576 HG3 GLU 74 2HG GLU 74 21.338 6.572 -4.142
577 H ARG 75 H ARG 75 18.694 9.428 -6.316
578 HA ARG 75 HA ARG 75 15.945 8.777 -6.942
579 HB2 ARG 75 1HB ARG 75 17.305 11.453 -6.531
580 HB3 ARG 75 2HB ARG 75 15.560 11.202 -6.626
581 HG2 ARG 75 1HG ARG 75 15.574 9.889 -4.593
582 HG3 ARG 75 2HG ARG 75 17.348 9.895 -4.550
583 HD2 ARG 75 1HD ARG 75 16.581 11.538 -3.000
584 HD3 ARG 75 2HD ARG 75 17.302 12.361 -4.392
585 HE ARG 75 HE ARG 75 14.350 11.992 -4.207
586 HH11 ARG 75 1HH1 ARG 75 17.100 14.218 -4.472
587 HH12 ARG 75 2HH1 ARG 75 16.073 15.587 -4.746
588 HH21 ARG 75 1HH2 ARG 75 13.117 13.803 -4.558
589 HH22 ARG 75 2HH2 ARG 75 13.866 15.357 -4.797
590 H ILE 76 H ILE 76 18.478 10.669 -8.616
591 HA ILE 76 HA ILE 76 16.665 11.437 -10.745
592 HB ILE 76 HB ILE 76 18.587 12.476 -11.824
593 HG12 ILE 76 1HG1 ILE 76 20.244 11.062 -9.718
594 HG13 ILE 76 2HG1 ILE 76 20.250 10.711 -11.441
595 HG21 ILE 76 1HG2 ILE 76 17.449 13.555 -9.819
596 HG22 ILE 76 2HG2 ILE 76 18.784 12.956 -8.808
597 HG23 ILE 76 3HG2 ILE 76 19.103 14.115 -10.114
598 HD11 ILE 76 1HD1 ILE 76 21.335 13.187 -10.045
599 HD12 ILE 76 2HD1 ILE 76 22.226 11.979 -10.993
600 HD13 ILE 76 3HD1 ILE 76 21.108 13.093 -11.807
601 H ARG 77 H ARG 77 18.536 8.641 -10.138
602 HA ARG 77 HA ARG 77 19.368 7.736 -12.632
603 HB2 ARG 77 1HB ARG 77 19.602 6.807 -10.237
604 HB3 ARG 77 2HB ARG 77 18.111 5.939 -10.544
605 HG2 ARG 77 1HG ARG 77 19.131 4.527 -12.100
606 HG3 ARG 77 2HG ARG 77 20.436 5.687 -12.449
607 HD2 ARG 77 1HD ARG 77 21.266 3.797 -11.083
608 HD3 ARG 77 2HD ARG 77 21.388 5.345 -10.225
609 HE ARG 77 HE ARG 77 18.921 3.908 -9.665
610 HH11 ARG 77 1HH1 ARG 77 22.290 4.278 -8.640
611 HH12 ARG 77 2HH1 ARG 77 21.935 3.706 -7.016
612 HH21 ARG 77 1HH2 ARG 77 18.598 3.167 -7.579
613 HH22 ARG 77 2HH2 ARG 77 19.941 3.098 -6.448
614 H LEU 78 H LEU 78 16.089 8.108 -11.677
615 HA LEU 78 HA LEU 78 14.800 6.141 -13.296
616 HB2 LEU 78 1HB LEU 78 13.696 7.524 -11.574
617 HB3 LEU 78 2HB LEU 78 14.012 8.973 -12.523
618 HG LEU 78 HG LEU 78 12.460 8.230 -14.259
619 HD11 LEU 78 1HD1 LEU 78 12.043 5.805 -12.469
620 HD12 LEU 78 2HD1 LEU 78 12.691 5.820 -14.129
621 HD13 LEU 78 3HD1 LEU 78 10.997 6.256 -13.838
622 HD21 LEU 78 1HD2 LEU 78 11.286 8.044 -11.462
623 HD22 LEU 78 2HD2 LEU 78 10.420 8.493 -12.951
624 HD23 LEU 78 3HD2 LEU 78 11.697 9.549 -12.316
625 H PHE 79 H PHE 79 16.350 9.208 -14.011
626 HA PHE 79 HA PHE 79 15.630 8.907 -16.903
627 HB2 PHE 79 1HB PHE 79 16.295 11.463 -15.402
628 HB3 PHE 79 2HB PHE 79 15.748 11.326 -17.077
629 HD1 PHE 79 HD1 PHE 79 13.380 10.181 -17.411
630 HD2 PHE 79 HD2 PHE 79 14.754 11.894 -13.711
631 HE1 PHE 79 HE1 PHE 79 11.019 10.423 -16.654
632 HE2 PHE 79 HE2 PHE 79 12.398 12.146 -12.945
633 HZ PHE 79 HZ PHE 79 10.523 11.417 -14.421
634 H SER 80 H SER 80 17.270 9.854 -18.383
635 HA SER 80 HA SER 80 19.986 9.099 -17.618
636 HB2 SER 80 1HB SER 80 18.892 10.397 -20.146
637 HB3 SER 80 2HB SER 80 20.520 9.711 -19.948
638 HG SER 80 HG SER 80 19.651 7.702 -19.757
639 H ALA 81 H ALA 81 19.960 10.728 -15.817
640 HA ALA 81 HA ALA 81 20.327 13.551 -16.629
641 HB1 ALA 81 1HB ALA 81 19.046 12.998 -14.582
642 HB2 ALA 81 2HB ALA 81 20.475 12.179 -13.909
643 HB3 ALA 81 3HB ALA 81 20.509 13.934 -14.192
644 H ASP 82 H ASP 82 22.158 11.986 -17.875
645 HA ASP 82 HA ASP 82 24.548 11.482 -16.371
646 HB2 ASP 82 1HB ASP 82 23.954 11.634 -19.341
647 HB3 ASP 82 2HB ASP 82 25.491 11.064 -18.668
648 HA PRO 83 HA PRO 83 26.440 15.443 -16.602
649 HB2 PRO 83 1HB PRO 83 29.078 14.893 -16.325
650 HB3 PRO 83 2HB PRO 83 27.908 14.516 -15.020
651 HG2 PRO 83 1HG PRO 83 28.991 12.701 -17.164
652 HG3 PRO 83 2HG PRO 83 28.968 12.453 -15.388
653 HD2 PRO 83 1HD PRO 83 27.064 11.404 -17.009
654 HD3 PRO 83 2HD PRO 83 26.669 12.011 -15.363
655 H PHE 84 H PHE 84 28.143 16.780 -17.723
656 HA PHE 84 HA PHE 84 28.380 15.989 -20.589
657 HB2 PHE 84 1HB PHE 84 28.352 18.750 -19.315
658 HB3 PHE 84 2HB PHE 84 28.436 18.397 -21.046
659 HD1 PHE 84 HD1 PHE 84 26.476 17.094 -22.107
660 HD2 PHE 84 HD2 PHE 84 26.252 18.981 -18.245
661 HE1 PHE 84 HE1 PHE 84 23.990 17.060 -22.241
662 HE2 PHE 84 HE2 PHE 84 23.763 18.945 -18.366
663 HZ PHE 84 HZ PHE 84 22.627 17.986 -20.369
664 H ASP 85 H ASP 85 30.136 15.554 -18.119
665 HA ASP 85 HA ASP 85 32.288 15.476 -17.527
666 HB2 ASP 85 1HB ASP 85 32.106 14.546 -19.985
667 HB3 ASP 85 2HB ASP 85 33.203 15.889 -20.334
668 H LEU 86 H LEU 86 32.095 17.478 -16.365
669 HA LEU 86 HA LEU 86 32.801 19.981 -17.578
670 HB2 LEU 86 1HB LEU 86 32.836 19.126 -14.666
671 HB3 LEU 86 2HB LEU 86 32.960 20.786 -15.240
672 HG LEU 86 HG LEU 86 30.544 18.976 -15.593
673 HD11 LEU 86 1HD1 LEU 86 30.940 19.674 -13.256
674 HD12 LEU 86 2HD1 LEU 86 29.493 20.452 -13.933
675 HD13 LEU 86 3HD1 LEU 86 31.000 21.378 -13.776
676 HD21 LEU 86 1HD2 LEU 86 30.669 20.574 -17.429
677 HD22 LEU 86 2HD2 LEU 86 30.978 21.908 -16.292
678 HD23 LEU 86 3HD2 LEU 86 29.404 21.086 -16.296
679 H GLU 87 H GLU 87 34.719 17.423 -16.103
680 HA GLU 87 HA GLU 87 37.049 19.129 -15.717
681 HB2 GLU 87 1HB GLU 87 38.188 17.103 -15.141
682 HB3 GLU 87 2HB GLU 87 36.620 17.188 -14.353
683 HG2 GLU 87 1HG GLU 87 35.721 15.601 -15.991
684 HG3 GLU 87 2HG GLU 87 37.347 15.438 -16.689
685 H ALA 88 H ALA 88 35.708 17.248 -18.206
686 HA ALA 88 HA ALA 88 37.979 16.965 -19.909
687 HB1 ALA 88 1HB ALA 88 35.061 17.072 -20.677
688 HB2 ALA 88 2HB ALA 88 36.389 16.442 -21.672
689 HB3 ALA 88 3HB ALA 88 35.955 15.626 -20.157
690 H GLN 89 H GLN 89 36.758 19.834 -18.924
691 HA GLN 89 HA GLN 89 36.462 21.341 -21.320
692 HB2 GLN 89 1HB GLN 89 36.764 23.308 -19.902
693 HB3 GLN 89 2HB GLN 89 35.688 22.130 -19.151
694 HG2 GLN 89 1HG GLN 89 36.902 22.476 -17.295
695 HG3 GLN 89 2HG GLN 89 38.097 21.411 -18.041
696 HE21 GLN 89 1HE2 GLN 89 40.509 23.886 -18.379
697 HE22 GLN 89 2HE2 GLN 89 40.052 22.205 -18.575
698 H ALA 90 H ALA 90 37.828 22.747 -22.425
699 HA ALA 90 HA ALA 90 40.525 21.775 -22.738
700 HB1 ALA 90 1HB ALA 90 40.691 23.528 -24.475
701 HB2 ALA 90 2HB ALA 90 39.177 22.607 -24.642
702 HB3 ALA 90 3HB ALA 90 39.157 24.236 -23.916
703 H LYS 91 H LYS 91 42.468 22.764 -22.296
704 HA LYS 91 HA LYS 91 42.405 25.041 -20.342
705 HB2 LYS 91 1HB LYS 91 43.325 22.678 -19.702
706 HB3 LYS 91 2HB LYS 91 44.667 23.082 -20.775
707 HG2 LYS 91 1HG LYS 91 44.367 25.280 -18.998
708 HG3 LYS 91 2HG LYS 91 44.267 23.806 -18.017
709 HD2 LYS 91 1HD LYS 91 46.378 22.988 -18.961
710 HD3 LYS 91 2HD LYS 91 46.444 24.374 -20.068
711 HE2 LYS 91 1HE LYS 91 46.485 25.888 -18.049
712 HE3 LYS 91 2HE LYS 91 46.688 24.437 -17.039
713 HZ1 LYS 91 1HZ LYS 91 48.737 23.976 -18.142
714 HZ2 LYS 91 2HZ LYS 91 48.796 25.579 -17.753
715 HZ3 LYS 91 3HZ LYS 91 48.488 25.110 -19.305
716 H ILE 92 H ILE 92 44.352 26.450 -20.508
717 HA ILE 92 HA ILE 92 45.485 26.720 -23.166
718 HB ILE 92 HB ILE 92 45.101 29.252 -22.679
719 HG12 ILE 92 1HG1 ILE 92 42.763 29.667 -21.719
720 HG13 ILE 92 2HG1 ILE 92 42.900 28.102 -20.946
721 HG21 ILE 92 1HG2 ILE 92 42.744 27.562 -23.597
722 HG22 ILE 92 2HG2 ILE 92 43.019 29.277 -23.999
723 HG23 ILE 92 3HG2 ILE 92 44.129 28.031 -24.609
724 HD11 ILE 92 1HD1 ILE 92 44.736 28.873 -19.557
725 HD12 ILE 92 2HD1 ILE 92 44.926 30.352 -20.528
726 HD13 ILE 92 3HD1 ILE 92 43.484 30.127 -19.511
727 H GLU 93 H GLU 93 47.340 28.175 -22.877
728 HA GLU 93 HA GLU 93 48.677 27.581 -20.306
729 HB2 GLU 93 1HB GLU 93 49.808 28.375 -23.010
730 HB3 GLU 93 2HB GLU 93 50.769 28.134 -21.545
731 HG2 GLU 93 1HG GLU 93 49.133 26.051 -23.018
732 HG3 GLU 93 2HG GLU 93 50.897 26.127 -22.864
733 H GLU 94 H GLU 94 50.272 29.184 -19.522
734 HA GLU 94 HA GLU 94 48.889 31.594 -18.878
735 HB2 GLU 94 1HB GLU 94 51.831 30.880 -18.580
736 HB3 GLU 94 2HB GLU 94 51.002 32.199 -17.747
737 HG2 GLU 94 1HG GLU 94 49.549 30.552 -16.597
738 HG3 GLU 94 2HG GLU 94 50.410 29.234 -17.413
739 H ASP 95 H ASP 95 49.152 33.690 -19.513
740 HA ASP 95 HA ASP 95 49.937 34.174 -22.209
741 HB2 ASP 95 1HB ASP 95 49.279 36.120 -19.974
742 HB3 ASP 95 2HB ASP 95 49.284 36.492 -21.709
743 H ILE 96 H ILE 96 52.286 33.280 -21.373
744 HA ILE 96 HA ILE 96 54.529 33.735 -21.163
745 HB ILE 96 HB ILE 96 54.090 36.290 -22.760
746 HG12 ILE 96 1HG1 ILE 96 53.919 33.447 -23.860
747 HG13 ILE 96 2HG1 ILE 96 52.548 34.548 -23.693
748 HG21 ILE 96 1HG2 ILE 96 56.208 35.621 -23.842
749 HG22 ILE 96 2HG2 ILE 96 56.442 35.523 -22.092
750 HG23 ILE 96 3HG2 ILE 96 56.176 34.037 -23.030
751 HD11 ILE 96 1HD1 ILE 96 54.912 34.874 -25.574
752 HD12 ILE 96 2HD1 ILE 96 53.208 34.595 -25.990
753 HD13 ILE 96 3HD1 ILE 96 53.700 36.146 -25.273
754 H ARG 97 H ARG 97 53.357 34.441 -18.856
755 HA ARG 97 HA ARG 97 54.033 37.149 -18.029
756 HB2 ARG 97 1HB ARG 97 53.436 36.288 -15.759
757 HB3 ARG 97 2HB ARG 97 52.179 36.053 -16.979
758 HG2 ARG 97 1HG ARG 97 52.296 33.787 -16.876
759 HG3 ARG 97 2HG ARG 97 54.055 33.782 -16.681
760 HD2 ARG 97 1HD ARG 97 53.680 34.636 -14.318
761 HD3 ARG 97 2HD ARG 97 51.962 34.256 -14.556
762 HE ARG 97 HE ARG 97 52.450 31.957 -14.557
763 HH11 ARG 97 1HH1 ARG 97 55.495 33.789 -14.469
764 HH12 ARG 97 2HH1 ARG 97 56.423 32.364 -14.078
765 HH21 ARG 97 1HH2 ARG 97 53.690 30.229 -14.155
766 HH22 ARG 97 2HH2 ARG 97 55.413 30.373 -13.884
767 H GLN 98 H GLN 98 56.236 36.491 -19.084
768 HA GLN 98 HA GLN 98 58.457 36.198 -18.984
769 HB2 GLN 98 1HB GLN 98 58.130 38.271 -17.606
770 HB3 GLN 98 2HB GLN 98 58.315 37.298 -16.145
771 HG2 GLN 98 1HG GLN 98 60.595 36.625 -16.836
772 HG3 GLN 98 2HG GLN 98 60.376 37.376 -18.417
773 HE21 GLN 98 1HE2 GLN 98 61.818 40.305 -17.316
774 HE22 GLN 98 2HE2 GLN 98 61.684 39.065 -18.536
775 HXT GLN 98 HO GLN 98 58.899 33.729 -16.060
Start of MODEL 16
1 H1 SER 1 1H SER 1 22.466 47.640 11.718
2 H2 SER 1 2H SER 1 23.949 47.682 12.283
3 H3 SER 1 3H SER 1 23.401 46.428 11.414
4 HA SER 1 HA SER 1 24.274 49.054 10.366
5 HB2 SER 1 1HB SER 1 25.453 46.285 9.898
6 HB3 SER 1 2HB SER 1 26.199 47.868 9.560
7 HG SER 1 HG SER 1 26.963 46.956 11.553
8 H GLN 2 H GLN 2 21.847 47.194 10.027
9 HA GLN 2 HA GLN 2 21.742 47.395 7.040
10 HB2 GLN 2 1HB GLN 2 22.095 44.997 8.019
11 HB3 GLN 2 2HB GLN 2 20.438 45.154 8.611
12 HG2 GLN 2 1HG GLN 2 19.797 45.660 6.166
13 HG3 GLN 2 2HG GLN 2 21.414 45.086 5.744
14 HE21 GLN 2 1HE2 GLN 2 18.526 42.474 6.053
15 HE22 GLN 2 2HE2 GLN 2 18.398 44.167 5.618
16 H GLN 3 H GLN 3 19.504 47.686 6.283
17 HA GLN 3 HA GLN 3 17.571 48.513 8.403
18 HB2 GLN 3 1HB GLN 3 18.378 50.087 5.927
19 HB3 GLN 3 2HB GLN 3 16.923 50.429 6.873
20 HG2 GLN 3 1HG GLN 3 19.725 50.464 8.048
21 HG3 GLN 3 2HG GLN 3 18.934 51.888 7.366
22 HE21 GLN 3 1HE2 GLN 3 18.107 50.735 11.122
23 HE22 GLN 3 2HE2 GLN 3 19.312 49.936 10.136
24 H SER 4 H SER 4 17.485 48.708 4.829
25 HA SER 4 HA SER 4 14.947 47.262 4.797
26 HB2 SER 4 1HB SER 4 15.548 49.204 3.283
27 HB3 SER 4 2HB SER 4 16.673 48.116 2.443
28 HG SER 4 HG SER 4 14.595 48.199 1.449
29 H HIS 5 H HIS 5 14.677 45.458 3.131
30 HA HIS 5 HA HIS 5 17.010 43.767 2.626
31 HB2 HIS 5 1HB HIS 5 15.956 41.790 3.768
32 HB3 HIS 5 2HB HIS 5 16.549 43.021 4.883
33 HD1 HIS 5 HD1 HIS 5 14.781 44.350 6.296
34 HD2 HIS 5 HD2 HIS 5 13.181 41.451 3.757
35 HE1 HIS 5 HE1 HIS 5 12.370 44.015 6.985
36 H SER 6 H SER 6 16.529 42.204 1.025
37 HA SER 6 HA SER 6 13.758 41.977 0.021
38 HB2 SER 6 1HB SER 6 16.105 42.881 -1.713
39 HB3 SER 6 2HB SER 6 14.477 42.479 -2.297
40 HG SER 6 HG SER 6 14.811 44.743 -2.020
41 H SER 7 H SER 7 13.594 40.029 -1.346
42 HA SER 7 HA SER 7 16.018 38.455 -1.790
43 HB2 SER 7 1HB SER 7 15.167 36.478 -0.549
44 HB3 SER 7 2HB SER 7 15.498 37.847 0.532
45 HG SER 7 HG SER 7 12.944 37.169 -0.523
46 HA PRO 8 HA PRO 8 13.137 37.105 -4.963
47 HB2 PRO 8 1HB PRO 8 14.635 35.305 -6.285
48 HB3 PRO 8 2HB PRO 8 15.144 37.020 -6.229
49 HG2 PRO 8 1HG PRO 8 16.061 34.708 -4.542
50 HG3 PRO 8 2HG PRO 8 17.042 35.916 -5.429
51 HD2 PRO 8 1HD PRO 8 16.408 36.092 -2.751
52 HD3 PRO 8 2HD PRO 8 16.743 37.522 -3.790
53 H GLY 9 H GLY 9 12.568 34.677 -5.919
54 HA2 GLY 9 1HA GLY 9 11.901 33.035 -3.519
55 HA3 GLY 9 2HA GLY 9 11.055 33.002 -5.074
56 H GLU 10 H GLU 10 14.558 33.055 -4.852
57 HA GLU 10 HA GLU 10 14.607 30.558 -6.360
58 HB2 GLU 10 1HB GLU 10 16.791 32.498 -5.554
59 HB3 GLU 10 2HB GLU 10 17.050 31.083 -6.588
60 HG2 GLU 10 1HG GLU 10 15.552 31.972 -8.281
61 HG3 GLU 10 2HG GLU 10 15.106 33.324 -7.232
62 H ILE 11 H ILE 11 13.976 30.667 -3.459
63 HA ILE 11 HA ILE 11 15.891 29.088 -2.083
64 HB ILE 11 HB ILE 11 12.967 29.088 -1.322
65 HG12 ILE 11 1HG1 ILE 11 14.660 31.641 -1.346
66 HG13 ILE 11 2HG1 ILE 11 13.159 31.377 -2.244
67 HG21 ILE 11 1HG2 ILE 11 13.946 29.486 0.822
68 HG22 ILE 11 2HG2 ILE 11 14.822 28.196 -0.016
69 HG23 ILE 11 3HG2 ILE 11 15.504 29.829 0.032
70 HD11 ILE 11 1HD1 ILE 11 13.447 31.699 0.765
71 HD12 ILE 11 2HD1 ILE 11 12.624 32.772 -0.383
72 HD13 ILE 11 3HD1 ILE 11 11.943 31.165 -0.030
73 H THR 12 H THR 12 15.194 28.098 -4.703
74 HA THR 12 HA THR 12 13.678 25.585 -4.099
75 HB THR 12 HB THR 12 13.154 25.583 -6.552
76 HG1 THR 12 HG1 THR 12 14.942 26.846 -7.249
77 HG21 THR 12 1HG2 THR 12 11.538 27.387 -6.543
78 HG22 THR 12 2HG2 THR 12 12.411 28.232 -5.253
79 HG23 THR 12 3HG2 THR 12 11.601 26.685 -4.911
80 H SER 13 H SER 13 14.258 23.956 -6.021
81 HA SER 13 HA SER 13 17.022 23.203 -5.743
82 HB2 SER 13 1HB SER 13 14.954 22.372 -7.821
83 HB3 SER 13 2HB SER 13 16.466 21.515 -7.445
84 HG SER 13 HG SER 13 14.571 20.658 -6.384
85 H SER 14 H SER 14 18.504 23.005 -7.593
86 HA SER 14 HA SER 14 19.809 23.952 -9.198
87 HB2 SER 14 1HB SER 14 17.164 24.613 -10.517
88 HB3 SER 14 2HB SER 14 18.744 24.434 -11.312
89 HG SER 14 HG SER 14 17.400 22.534 -11.396
90 HA PRO 15 HA PRO 15 19.194 28.396 -7.810
91 HB2 PRO 15 1HB PRO 15 21.506 28.662 -6.441
92 HB3 PRO 15 2HB PRO 15 20.065 27.896 -5.735
93 HG2 PRO 15 1HG PRO 15 22.407 26.578 -7.028
94 HG3 PRO 15 2HG PRO 15 21.727 26.301 -5.388
95 HD2 PRO 15 1HD PRO 15 21.022 24.730 -7.435
96 HD3 PRO 15 2HD PRO 15 19.796 25.269 -6.236
97 H GLN 16 H GLN 16 21.228 26.626 -9.635
98 HA GLN 16 HA GLN 16 22.554 26.966 -11.451
99 HB2 GLN 16 1HB GLN 16 20.865 29.035 -11.609
100 HB3 GLN 16 2HB GLN 16 22.375 29.935 -11.403
101 HG2 GLN 16 1HG GLN 16 23.334 28.717 -13.321
102 HG3 GLN 16 2HG GLN 16 21.804 27.843 -13.509
103 HE21 GLN 16 1HE2 GLN 16 20.149 30.451 -15.160
104 HE22 GLN 16 2HE2 GLN 16 20.035 28.874 -14.419
105 H GLY 17 H GLY 17 23.170 29.280 -8.812
106 HA2 GLY 17 1HA GLY 17 25.980 29.554 -9.345
107 HA3 GLY 17 2HA GLY 17 25.155 29.879 -7.817
108 H LEU 18 H LEU 18 24.389 26.772 -8.680
109 HA LEU 18 HA LEU 18 26.075 25.486 -6.752
110 HB2 LEU 18 1HB LEU 18 25.112 23.466 -7.471
111 HB3 LEU 18 2HB LEU 18 23.854 24.693 -7.470
112 HG LEU 18 HG LEU 18 24.660 24.811 -10.081
113 HD11 LEU 18 1HD1 LEU 18 26.240 22.930 -9.645
114 HD12 LEU 18 2HD1 LEU 18 25.017 22.548 -10.877
115 HD13 LEU 18 3HD1 LEU 18 24.856 21.901 -9.223
116 HD21 LEU 18 1HD2 LEU 18 22.660 23.458 -10.552
117 HD22 LEU 18 2HD2 LEU 18 22.371 24.655 -9.273
118 HD23 LEU 18 3HD2 LEU 18 22.613 22.944 -8.849
119 H ASP 19 H ASP 19 26.462 26.265 -10.154
120 HA ASP 19 HA ASP 19 28.899 24.570 -10.371
121 HB2 ASP 19 1HB ASP 19 27.165 24.815 -12.226
122 HB3 ASP 19 2HB ASP 19 27.700 26.494 -12.393
123 H ASN 20 H ASN 20 27.827 27.825 -9.815
124 HA ASN 20 HA ASN 20 30.625 28.845 -10.021
125 HB2 ASN 20 1HB ASN 20 27.929 30.232 -10.295
126 HB3 ASN 20 2HB ASN 20 29.469 31.080 -10.174
127 HD21 ASN 20 1HD2 ASN 20 30.559 30.220 -13.422
128 HD22 ASN 20 2HD2 ASN 20 31.160 30.383 -11.796
129 HA PRO 21 HA PRO 21 29.597 29.032 -5.517
130 HB2 PRO 21 1HB PRO 21 32.287 28.990 -4.760
131 HB3 PRO 21 2HB PRO 21 31.276 27.536 -4.925
132 HG2 PRO 21 1HG PRO 21 33.156 28.748 -6.869
133 HG3 PRO 21 2HG PRO 21 32.970 27.041 -6.409
134 HD2 PRO 21 1HD PRO 21 31.953 27.930 -8.668
135 HD3 PRO 21 2HD PRO 21 31.019 26.787 -7.638
136 H ALA 22 H ALA 22 31.996 30.729 -7.545
137 HA ALA 22 HA ALA 22 32.485 32.879 -5.757
138 HB1 ALA 22 1HB ALA 22 33.276 34.080 -7.773
139 HB2 ALA 22 2HB ALA 22 33.898 32.414 -7.714
140 HB3 ALA 22 3HB ALA 22 32.550 32.827 -8.805
141 H LEU 23 H LEU 23 29.991 32.457 -8.283
142 HA LEU 23 HA LEU 23 28.943 35.140 -7.902
143 HB2 LEU 23 1HB LEU 23 27.624 32.735 -9.207
144 HB3 LEU 23 2HB LEU 23 27.133 34.413 -9.368
145 HG LEU 23 HG LEU 23 29.649 33.145 -10.492
146 HD11 LEU 23 1HD1 LEU 23 28.569 33.525 -12.657
147 HD12 LEU 23 2HD1 LEU 23 27.171 34.279 -11.853
148 HD13 LEU 23 3HD1 LEU 23 27.511 32.550 -11.619
149 HD21 LEU 23 1HD2 LEU 23 28.688 35.998 -10.790
150 HD22 LEU 23 2HD2 LEU 23 30.028 35.234 -11.685
151 HD23 LEU 23 3HD2 LEU 23 30.148 35.456 -9.928
152 H LEU 24 H LEU 24 28.092 31.836 -6.800
153 HA LEU 24 HA LEU 24 25.619 32.636 -5.607
154 HB2 LEU 24 1HB LEU 24 26.257 30.301 -6.144
155 HB3 LEU 24 2HB LEU 24 27.445 30.328 -4.854
156 HG LEU 24 HG LEU 24 25.749 30.443 -3.173
157 HD11 LEU 24 1HD1 LEU 24 23.305 30.419 -3.735
158 HD12 LEU 24 2HD1 LEU 24 23.733 30.804 -5.420
159 HD13 LEU 24 3HD1 LEU 24 24.116 31.948 -4.107
160 HD21 LEU 24 1HD2 LEU 24 24.846 28.472 -5.287
161 HD22 LEU 24 2HD2 LEU 24 24.572 28.359 -3.533
162 HD23 LEU 24 3HD2 LEU 24 26.220 28.240 -4.186
163 H ARG 25 H ARG 25 28.950 32.414 -4.336
164 HA ARG 25 HA ARG 25 28.420 33.071 -1.636
165 HB2 ARG 25 1HB ARG 25 30.582 32.304 -2.477
166 HB3 ARG 25 2HB ARG 25 30.738 33.709 -3.505
167 HG2 ARG 25 1HG ARG 25 30.546 34.100 -0.539
168 HG3 ARG 25 2HG ARG 25 32.053 33.491 -1.233
169 HD2 ARG 25 1HD ARG 25 30.661 36.083 -1.969
170 HD3 ARG 25 2HD ARG 25 32.115 35.933 -0.986
171 HE ARG 25 HE ARG 25 31.874 35.561 -3.917
172 HH11 ARG 25 1HH1 ARG 25 34.016 35.650 -1.085
173 HH12 ARG 25 2HH1 ARG 25 35.438 35.823 -2.072
174 HH21 ARG 25 1HH2 ARG 25 33.729 35.757 -5.083
175 HH22 ARG 25 2HH2 ARG 25 35.282 35.868 -4.297
176 H ASP 26 H ASP 26 28.932 35.153 -4.502
177 HA ASP 26 HA ASP 26 28.832 37.606 -3.045
178 HB2 ASP 26 1HB ASP 26 29.705 37.127 -5.412
179 HB3 ASP 26 2HB ASP 26 28.021 37.253 -5.942
180 H MET 27 H MET 27 26.315 35.792 -4.838
181 HA MET 27 HA MET 27 24.177 37.643 -4.481
182 HB2 MET 27 1HB MET 27 24.228 35.589 -5.954
183 HB3 MET 27 2HB MET 27 24.016 34.603 -4.510
184 HG2 MET 27 1HG MET 27 22.066 36.753 -5.348
185 HG3 MET 27 2HG MET 27 21.952 35.087 -5.909
186 HE1 MET 27 1HE MET 27 21.026 33.059 -4.515
187 HE2 MET 27 2HE MET 27 22.435 33.171 -3.435
188 HE3 MET 27 3HE MET 27 20.799 33.081 -2.750
189 H LEU 28 H LEU 28 25.172 34.819 -2.574
190 HA LEU 28 HA LEU 28 23.160 34.970 -0.608
191 HB2 LEU 28 1HB LEU 28 25.908 33.844 -0.715
192 HB3 LEU 28 2HB LEU 28 25.003 33.843 0.793
193 HG LEU 28 HG LEU 28 23.871 32.660 -1.738
194 HD11 LEU 28 1HD1 LEU 28 25.973 31.618 -1.232
195 HD12 LEU 28 2HD1 LEU 28 24.631 30.521 -0.845
196 HD13 LEU 28 3HD1 LEU 28 25.483 31.386 0.456
197 HD21 LEU 28 1HD2 LEU 28 23.261 32.253 1.216
198 HD22 LEU 28 2HD2 LEU 28 22.451 31.438 -0.145
199 HD23 LEU 28 3HD2 LEU 28 22.293 33.182 0.067
200 H LEU 29 H LEU 29 26.408 36.480 -0.678
201 HA LEU 29 HA LEU 29 26.240 37.529 1.997
202 HB2 LEU 29 1HB LEU 29 27.778 38.385 -0.461
203 HB3 LEU 29 2HB LEU 29 27.908 39.251 1.066
204 HG LEU 29 HG LEU 29 28.559 36.313 0.769
205 HD11 LEU 29 1HD1 LEU 29 29.984 37.656 -0.677
206 HD12 LEU 29 2HD1 LEU 29 30.898 37.008 0.703
207 HD13 LEU 29 3HD1 LEU 29 30.397 38.717 0.694
208 HD21 LEU 29 1HD2 LEU 29 29.221 38.326 2.946
209 HD22 LEU 29 2HD2 LEU 29 29.808 36.646 2.873
210 HD23 LEU 29 3HD2 LEU 29 28.077 36.969 3.074
211 H ALA 30 H ALA 30 25.150 38.726 -1.137
212 HA ALA 30 HA ALA 30 24.370 41.324 -0.068
213 HB1 ALA 30 1HB ALA 30 23.417 41.667 -2.314
214 HB2 ALA 30 2HB ALA 30 25.064 40.999 -2.431
215 HB3 ALA 30 3HB ALA 30 23.655 39.946 -2.694
216 H ASN 31 H ASN 31 22.985 38.182 0.071
217 HA ASN 31 HA ASN 31 20.218 39.311 0.197
218 HB2 ASN 31 1HB ASN 31 20.860 37.520 -1.469
219 HB3 ASN 31 2HB ASN 31 21.049 36.422 -0.109
220 HD21 ASN 31 1HD2 ASN 31 17.635 36.358 -1.674
221 HD22 ASN 31 2HD2 ASN 31 19.239 36.424 -2.372
222 HA PRO 32 HA PRO 32 21.133 38.465 4.527
223 HB2 PRO 32 1HB PRO 32 19.038 39.857 5.641
224 HB3 PRO 32 2HB PRO 32 20.546 40.630 5.051
225 HG2 PRO 32 1HG PRO 32 17.928 40.278 3.588
226 HG3 PRO 32 2HG PRO 32 18.888 41.771 3.826
227 HD2 PRO 32 1HD PRO 32 19.094 40.409 1.572
228 HD3 PRO 32 2HD PRO 32 20.567 41.077 2.361
229 H HIS 33 H HIS 33 17.987 37.896 2.936
230 HA HIS 33 HA HIS 33 17.002 36.243 5.134
231 HB2 HIS 33 1HB HIS 33 15.493 37.434 3.567
232 HB3 HIS 33 2HB HIS 33 16.120 36.460 2.232
233 HD1 HIS 33 HD1 HIS 33 14.260 35.887 5.561
234 HD2 HIS 33 HD2 HIS 33 14.760 34.183 1.788
235 HE1 HIS 33 HE1 HIS 33 12.662 33.933 5.416
236 H GLU 34 H GLU 34 18.569 35.695 1.988
237 HA GLU 34 HA GLU 34 18.212 32.824 2.069
238 HB2 GLU 34 1HB GLU 34 19.383 34.822 0.328
239 HB3 GLU 34 2HB GLU 34 20.359 33.398 0.389
240 HG2 GLU 34 1HG GLU 34 17.396 33.294 -0.178
241 HG3 GLU 34 2HG GLU 34 18.600 33.547 -1.451
242 H LEU 35 H LEU 35 20.807 35.107 2.960
243 HA LEU 35 HA LEU 35 22.707 33.069 3.568
244 HB2 LEU 35 1HB LEU 35 24.050 34.701 4.221
245 HB3 LEU 35 2HB LEU 35 22.950 35.513 3.169
246 HG LEU 35 HG LEU 35 21.869 36.601 5.055
247 HD11 LEU 35 1HD1 LEU 35 22.264 35.278 6.973
248 HD12 LEU 35 2HD1 LEU 35 23.241 36.735 7.184
249 HD13 LEU 35 3HD1 LEU 35 24.016 35.212 6.667
250 HD21 LEU 35 1HD2 LEU 35 23.818 38.101 5.334
251 HD22 LEU 35 2HD2 LEU 35 23.631 37.525 3.664
252 HD23 LEU 35 3HD2 LEU 35 24.865 36.799 4.713
253 H SER 36 H SER 36 19.995 34.388 5.325
254 HA SER 36 HA SER 36 20.787 33.342 7.887
255 HB2 SER 36 1HB SER 36 19.288 35.355 7.438
256 HB3 SER 36 2HB SER 36 17.986 34.172 7.183
257 HG SER 36 HG SER 36 18.232 33.484 9.280
258 H LEU 37 H LEU 37 18.467 32.294 5.334
259 HA LEU 37 HA LEU 37 17.581 30.013 6.871
260 HB2 LEU 37 1HB LEU 37 16.522 29.304 4.951
261 HB3 LEU 37 2HB LEU 37 16.496 31.025 4.995
262 HG LEU 37 HG LEU 37 18.308 30.981 3.243
263 HD11 LEU 37 1HD1 LEU 37 18.712 28.577 3.290
264 HD12 LEU 37 2HD1 LEU 37 18.128 29.116 1.702
265 HD13 LEU 37 3HD1 LEU 37 17.021 28.288 2.831
266 HD21 LEU 37 1HD2 LEU 37 15.419 30.253 2.728
267 HD22 LEU 37 2HD2 LEU 37 16.523 31.021 1.565
268 HD23 LEU 37 3HD2 LEU 37 16.053 31.887 3.037
269 H LEU 38 H LEU 38 20.247 30.737 4.773
270 HA LEU 38 HA LEU 38 21.091 28.064 4.423
271 HB2 LEU 38 1HB LEU 38 21.675 30.045 3.150
272 HB3 LEU 38 2HB LEU 38 22.687 30.616 4.489
273 HG LEU 38 HG LEU 38 24.066 28.559 4.354
274 HD11 LEU 38 1HD1 LEU 38 22.522 27.055 3.285
275 HD12 LEU 38 2HD1 LEU 38 23.956 27.229 2.260
276 HD13 LEU 38 3HD1 LEU 38 22.453 28.083 1.834
277 HD21 LEU 38 1HD2 LEU 38 25.358 29.232 2.422
278 HD22 LEU 38 2HD2 LEU 38 24.756 30.662 3.286
279 HD23 LEU 38 3HD2 LEU 38 23.966 30.137 1.782
280 H LYS 39 H LYS 39 22.020 30.472 6.939
281 HA LYS 39 HA LYS 39 23.763 28.554 8.265
282 HB2 LYS 39 1HB LYS 39 23.536 30.055 10.281
283 HB3 LYS 39 2HB LYS 39 24.233 30.779 8.830
284 HG2 LYS 39 1HG LYS 39 22.229 31.958 8.352
285 HG3 LYS 39 2HG LYS 39 21.331 31.107 9.581
286 HD2 LYS 39 1HD LYS 39 21.743 33.186 10.509
287 HD3 LYS 39 2HD LYS 39 22.956 32.136 11.268
288 HE2 LYS 39 1HE LYS 39 24.666 32.948 9.717
289 HE3 LYS 39 2HE LYS 39 23.445 33.877 8.817
290 HZ1 LYS 39 1HZ LYS 39 24.646 35.277 10.370
291 HZ2 LYS 39 2HZ LYS 39 24.194 34.333 11.646
292 HZ3 LYS 39 3HZ LYS 39 23.059 35.186 10.807
293 H GLU 40 H GLU 40 20.315 29.139 8.408
294 HA GLU 40 HA GLU 40 19.866 27.559 10.795
295 HB2 GLU 40 1HB GLU 40 18.292 29.235 9.989
296 HB3 GLU 40 2HB GLU 40 18.183 28.431 8.439
297 HG2 GLU 40 1HG GLU 40 17.380 26.502 10.341
298 HG3 GLU 40 2HG GLU 40 16.626 28.021 10.836
299 H ARG 41 H ARG 41 19.375 26.889 7.279
300 HA ARG 41 HA ARG 41 18.806 24.083 7.841
301 HB2 ARG 41 1HB ARG 41 19.322 25.495 5.200
302 HB3 ARG 41 2HB ARG 41 18.578 23.904 5.391
303 HG2 ARG 41 1HG ARG 41 17.394 26.454 6.545
304 HG3 ARG 41 2HG ARG 41 17.000 25.854 4.941
305 HD2 ARG 41 1HD ARG 41 16.661 24.123 7.403
306 HD3 ARG 41 2HD ARG 41 15.425 25.280 6.902
307 HE ARG 41 HE ARG 41 16.140 22.785 5.556
308 HH11 ARG 41 1HH1 ARG 41 14.387 25.837 5.329
309 HH12 ARG 41 2HH1 ARG 41 13.371 25.271 4.026
310 HH21 ARG 41 1HH2 ARG 41 14.809 22.122 3.893
311 HH22 ARG 41 2HH2 ARG 41 13.611 23.201 3.232
312 H ASN 42 H ASN 42 21.660 25.815 6.623
313 HA ASN 42 HA ASN 42 23.116 23.200 6.533
314 HB2 ASN 42 1HB ASN 42 22.329 24.165 4.264
315 HB3 ASN 42 2HB ASN 42 23.560 25.378 4.477
316 HD21 ASN 42 1HD2 ASN 42 25.085 22.702 2.520
317 HD22 ASN 42 2HD2 ASN 42 23.951 24.021 2.339
318 HA PRO 43 HA PRO 43 25.356 26.573 8.820
319 HB2 PRO 43 1HB PRO 43 26.475 24.874 10.748
320 HB3 PRO 43 2HB PRO 43 24.997 25.871 10.927
321 HG2 PRO 43 1HG PRO 43 25.248 22.974 10.179
322 HG3 PRO 43 2HG PRO 43 24.115 23.762 11.319
323 HD2 PRO 43 1HD PRO 43 23.337 23.085 8.853
324 HD3 PRO 43 2HD PRO 43 22.802 24.639 9.586
325 HA PRO 44 HA PRO 44 29.435 24.473 8.012
326 HB2 PRO 44 1HB PRO 44 29.695 22.489 6.153
327 HB3 PRO 44 2HB PRO 44 29.442 22.160 7.896
328 HG2 PRO 44 1HG PRO 44 27.413 22.264 5.698
329 HG3 PRO 44 2HG PRO 44 27.712 20.969 6.900
330 HD2 PRO 44 1HD PRO 44 25.777 22.776 7.299
331 HD3 PRO 44 2HD PRO 44 26.813 22.241 8.664
332 H LEU 45 H LEU 45 27.062 24.544 5.275
333 HA LEU 45 HA LEU 45 29.063 25.729 3.497
334 HB2 LEU 45 1HB LEU 45 27.163 24.460 2.579
335 HB3 LEU 45 2HB LEU 45 26.048 25.636 3.270
336 HG LEU 45 HG LEU 45 26.805 27.363 1.750
337 HD11 LEU 45 1HD1 LEU 45 28.748 25.320 0.583
338 HD12 LEU 45 2HD1 LEU 45 29.203 26.774 1.497
339 HD13 LEU 45 3HD1 LEU 45 28.410 26.937 -0.075
340 HD21 LEU 45 1HD2 LEU 45 25.068 25.760 1.010
341 HD22 LEU 45 2HD2 LEU 45 26.329 24.751 0.263
342 HD23 LEU 45 3HD2 LEU 45 26.016 26.393 -0.348
343 H ALA 46 H ALA 46 26.581 26.776 5.746
344 HA ALA 46 HA ALA 46 26.645 29.518 4.985
345 HB1 ALA 46 1HB ALA 46 24.949 28.409 6.389
346 HB2 ALA 46 2HB ALA 46 26.122 28.394 7.722
347 HB3 ALA 46 3HB ALA 46 25.565 29.942 7.043
348 H GLU 47 H GLU 47 28.551 27.791 7.571
349 HA GLU 47 HA GLU 47 29.721 30.182 8.568
350 HB2 GLU 47 1HB GLU 47 31.390 28.832 9.624
351 HB3 GLU 47 2HB GLU 47 29.822 28.029 9.764
352 HG2 GLU 47 1HG GLU 47 30.424 26.461 8.007
353 HG3 GLU 47 2HG GLU 47 31.950 27.305 7.722
354 H ALA 48 H ALA 48 30.576 28.179 5.801
355 HA ALA 48 HA ALA 48 33.050 29.347 5.229
356 HB1 ALA 48 1HB ALA 48 32.113 27.291 4.230
357 HB2 ALA 48 2HB ALA 48 30.945 28.293 3.337
358 HB3 ALA 48 3HB ALA 48 32.672 28.461 3.028
359 H LEU 49 H LEU 49 29.757 30.252 4.283
360 HA LEU 49 HA LEU 49 30.529 32.441 2.607
361 HB2 LEU 49 1HB LEU 49 28.283 31.325 2.626
362 HB3 LEU 49 2HB LEU 49 28.004 31.954 4.241
363 HG LEU 49 HG LEU 49 28.325 34.296 3.175
364 HD11 LEU 49 1HD1 LEU 49 27.683 32.589 0.751
365 HD12 LEU 49 2HD1 LEU 49 29.170 33.522 1.029
366 HD13 LEU 49 3HD1 LEU 49 27.629 34.363 0.812
367 HD21 LEU 49 1HD2 LEU 49 26.252 33.380 4.128
368 HD22 LEU 49 2HD2 LEU 49 25.886 32.610 2.566
369 HD23 LEU 49 3HD2 LEU 49 25.954 34.383 2.697
370 H LEU 50 H LEU 50 29.699 32.135 6.079
371 HA LEU 50 HA LEU 50 29.538 34.930 6.626
372 HB2 LEU 50 1HB LEU 50 30.512 32.825 8.576
373 HB3 LEU 50 2HB LEU 50 29.767 34.365 8.954
374 HG LEU 50 HG LEU 50 28.494 31.833 8.021
375 HD11 LEU 50 1HD1 LEU 50 27.146 32.077 9.986
376 HD12 LEU 50 2HD1 LEU 50 27.954 33.626 10.357
377 HD13 LEU 50 3HD1 LEU 50 28.876 32.098 10.365
378 HD21 LEU 50 1HD2 LEU 50 27.421 33.410 6.598
379 HD22 LEU 50 2HD2 LEU 50 27.179 34.543 7.958
380 HD23 LEU 50 3HD2 LEU 50 26.309 32.985 7.905
381 H SER 51 H SER 51 32.260 32.745 6.348
382 HA SER 51 HA SER 51 34.172 34.482 7.627
383 HB2 SER 51 1HB SER 51 34.496 32.196 5.692
384 HB3 SER 51 2HB SER 51 35.764 32.895 6.702
385 HG SER 51 HG SER 51 33.385 31.624 7.631
386 H GLY 52 H GLY 52 32.778 34.233 4.419
387 HA2 GLY 52 1HA GLY 52 33.004 35.806 2.708
388 HA3 GLY 52 2HA GLY 52 34.395 36.522 3.537
389 H ASP 53 H ASP 53 35.495 33.696 3.821
390 HA ASP 53 HA ASP 53 37.316 33.752 1.659
391 HB2 ASP 53 1HB ASP 53 37.646 32.529 3.865
392 HB3 ASP 53 2HB ASP 53 36.511 31.368 3.290
393 H LEU 54 H LEU 54 36.959 33.346 -0.428
394 HA LEU 54 HA LEU 54 34.664 31.880 -1.355
395 HB2 LEU 54 1HB LEU 54 35.900 33.591 -2.685
396 HB3 LEU 54 2HB LEU 54 37.268 32.502 -2.797
397 HG LEU 54 HG LEU 54 35.626 32.766 -4.762
398 HD11 LEU 54 1HD1 LEU 54 36.103 30.586 -5.628
399 HD12 LEU 54 2HD1 LEU 54 36.409 29.959 -3.997
400 HD13 LEU 54 3HD1 LEU 54 37.502 31.163 -4.700
401 HD21 LEU 54 1HD2 LEU 54 34.059 30.659 -3.270
402 HD22 LEU 54 2HD2 LEU 54 33.771 31.234 -4.915
403 HD23 LEU 54 3HD2 LEU 54 33.529 32.334 -3.542
404 H GLU 55 H GLU 55 38.073 31.047 -0.654
405 HA GLU 55 HA GLU 55 38.069 28.569 -2.035
406 HB2 GLU 55 1HB GLU 55 39.552 29.315 0.504
407 HB3 GLU 55 2HB GLU 55 39.932 27.948 -0.538
408 HG2 GLU 55 1HG GLU 55 39.954 30.808 -1.507
409 HG3 GLU 55 2HG GLU 55 41.334 30.017 -0.749
410 H LYS 56 H LYS 56 37.433 29.247 1.445
411 HA LYS 56 HA LYS 56 36.740 26.527 1.948
412 HB2 LYS 56 1HB LYS 56 36.167 27.110 4.107
413 HB3 LYS 56 2HB LYS 56 37.367 28.365 3.654
414 HG2 LYS 56 1HG LYS 56 35.352 29.768 3.180
415 HG3 LYS 56 2HG LYS 56 34.490 28.525 4.074
416 HD2 LYS 56 1HD LYS 56 37.019 29.598 5.267
417 HD3 LYS 56 2HD LYS 56 35.574 30.587 5.330
418 HE2 LYS 56 1HE LYS 56 34.342 28.806 6.496
419 HE3 LYS 56 2HE LYS 56 35.766 27.751 6.400
420 HZ1 LYS 56 1HZ LYS 56 35.617 28.798 8.545
421 HZ2 LYS 56 2HZ LYS 56 35.562 30.309 7.882
422 HZ3 LYS 56 3HZ LYS 56 36.939 29.402 7.763
423 H PHE 57 H PHE 57 34.760 29.336 0.907
424 HA PHE 57 HA PHE 57 32.264 27.981 1.110
425 HB2 PHE 57 1HB PHE 57 32.541 30.421 0.776
426 HB3 PHE 57 2HB PHE 57 33.082 30.113 -0.881
427 HD1 PHE 57 HD1 PHE 57 31.514 29.588 -2.640
428 HD2 PHE 57 HD2 PHE 57 30.186 29.934 1.438
429 HE1 PHE 57 HE1 PHE 57 29.147 29.589 -3.411
430 HE2 PHE 57 HE2 PHE 57 27.817 29.942 0.670
431 HZ PHE 57 HZ PHE 57 27.299 29.763 -1.764
432 H SER 58 H SER 58 34.426 28.279 -1.759
433 HA SER 58 HA SER 58 32.885 26.619 -3.472
434 HB2 SER 58 1HB SER 58 34.774 28.089 -4.162
435 HB3 SER 58 2HB SER 58 35.907 27.005 -3.331
436 HG SER 58 HG SER 58 35.879 26.395 -5.447
437 H ARG 59 H ARG 59 35.398 25.838 -1.074
438 HA ARG 59 HA ARG 59 35.711 23.094 -1.861
439 HB2 ARG 59 1HB ARG 59 37.369 24.260 -0.478
440 HB3 ARG 59 2HB ARG 59 36.186 24.478 0.813
441 HG2 ARG 59 1HG ARG 59 36.632 21.656 -0.011
442 HG3 ARG 59 2HG ARG 59 38.032 22.461 0.721
443 HD2 ARG 59 1HD ARG 59 36.720 23.045 2.704
444 HD3 ARG 59 2HD ARG 59 35.255 22.395 1.961
445 HE ARG 59 HE ARG 59 36.025 20.176 2.273
446 HH11 ARG 59 1HH1 ARG 59 38.335 22.495 3.634
447 HH12 ARG 59 2HH1 ARG 59 39.106 21.268 4.600
448 HH21 ARG 59 1HH2 ARG 59 37.041 18.709 3.462
449 HH22 ARG 59 2HH2 ARG 59 38.386 19.143 4.508
450 H VAL 60 H VAL 60 33.731 24.649 0.720
451 HA VAL 60 HA VAL 60 32.653 22.077 1.450
452 HB VAL 60 HB VAL 60 32.820 23.986 3.035
453 HG11 VAL 60 1HG1 VAL 60 30.554 25.059 1.490
454 HG12 VAL 60 2HG1 VAL 60 31.077 25.641 3.073
455 HG13 VAL 60 3HG1 VAL 60 32.140 25.783 1.675
456 HG21 VAL 60 1HG2 VAL 60 31.372 22.012 3.452
457 HG22 VAL 60 2HG2 VAL 60 30.774 23.495 4.222
458 HG23 VAL 60 3HG2 VAL 60 30.009 22.899 2.729
459 H LEU 61 H LEU 61 31.764 24.558 -0.912
460 HA LEU 61 HA LEU 61 29.108 23.706 -1.407
461 HB2 LEU 61 1HB LEU 61 30.409 25.723 -2.348
462 HB3 LEU 61 2HB LEU 61 31.046 24.615 -3.550
463 HG LEU 61 HG LEU 61 28.362 24.149 -3.802
464 HD11 LEU 61 1HD1 LEU 61 28.728 27.088 -3.113
465 HD12 LEU 61 2HD1 LEU 61 27.867 25.889 -2.113
466 HD13 LEU 61 3HD1 LEU 61 27.235 26.325 -3.713
467 HD21 LEU 61 1HD2 LEU 61 28.450 25.349 -5.817
468 HD22 LEU 61 2HD2 LEU 61 30.139 24.878 -5.549
469 HD23 LEU 61 3HD2 LEU 61 29.594 26.531 -5.182
470 H VAL 62 H VAL 62 32.220 22.542 -2.842
471 HA VAL 62 HA VAL 62 30.778 20.559 -4.416
472 HB VAL 62 HB VAL 62 32.925 21.527 -5.190
473 HG11 VAL 62 1HG1 VAL 62 34.210 19.887 -2.976
474 HG12 VAL 62 2HG1 VAL 62 35.073 20.666 -4.320
475 HG13 VAL 62 3HG1 VAL 62 34.207 21.659 -3.143
476 HG21 VAL 62 1HG2 VAL 62 33.854 19.456 -6.082
477 HG22 VAL 62 2HG2 VAL 62 33.027 18.518 -4.817
478 HG23 VAL 62 3HG2 VAL 62 32.080 19.371 -6.059
479 H GLU 63 H GLU 63 32.435 20.561 -1.275
480 HA GLU 63 HA GLU 63 32.352 17.727 -0.840
481 HB2 GLU 63 1HB GLU 63 32.171 20.044 1.100
482 HB3 GLU 63 2HB GLU 63 32.294 18.360 1.608
483 HG2 GLU 63 1HG GLU 63 34.355 19.190 -0.336
484 HG3 GLU 63 2HG GLU 63 34.398 20.066 1.201
485 H GLN 64 H GLN 64 29.910 20.286 -0.297
486 HA GLN 64 HA GLN 64 27.951 18.605 0.955
487 HB2 GLN 64 1HB GLN 64 27.843 21.166 -0.648
488 HB3 GLN 64 2HB GLN 64 26.364 20.383 -0.096
489 HG2 GLN 64 1HG GLN 64 28.591 21.063 1.832
490 HG3 GLN 64 2HG GLN 64 27.369 22.254 1.362
491 HE21 GLN 64 1HE2 GLN 64 26.527 19.808 4.322
492 HE22 GLN 64 2HE2 GLN 64 28.129 20.203 3.750
493 H GLN 65 H GLN 65 28.838 19.116 -2.442
494 HA GLN 65 HA GLN 65 26.457 17.704 -3.402
495 HB2 GLN 65 1HB GLN 65 29.007 18.560 -4.797
496 HB3 GLN 65 2HB GLN 65 27.641 17.770 -5.601
497 HG2 GLN 65 1HG GLN 65 26.156 19.622 -4.880
498 HG3 GLN 65 2HG GLN 65 27.532 20.424 -4.127
499 HE21 GLN 65 1HE2 GLN 65 28.427 22.076 -7.032
500 HE22 GLN 65 2HE2 GLN 65 28.484 21.944 -5.285
501 H GLN 66 H GLN 66 29.853 16.898 -2.681
502 HA GLN 66 HA GLN 66 29.711 14.186 -3.667
503 HB2 GLN 66 1HB GLN 66 31.451 15.504 -1.554
504 HB3 GLN 66 2HB GLN 66 31.651 13.838 -2.095
505 HG2 GLN 66 1HG GLN 66 32.055 14.641 -4.401
506 HG3 GLN 66 2HG GLN 66 31.917 16.306 -3.830
507 HE21 GLN 66 1HE2 GLN 66 35.115 16.433 -2.400
508 HE22 GLN 66 2HE2 GLN 66 33.563 17.212 -2.586
509 H ASP 67 H ASP 67 28.972 15.734 -0.535
510 HA ASP 67 HA ASP 67 28.576 13.385 1.005
511 HB2 ASP 67 1HB ASP 67 28.565 15.697 1.905
512 HB3 ASP 67 2HB ASP 67 27.015 15.983 1.111
513 H ARG 68 H ARG 68 26.389 15.137 -1.165
514 HA ARG 68 HA ARG 68 24.056 13.593 -0.569
515 HB2 ARG 68 1HB ARG 68 24.880 15.087 -3.072
516 HB3 ARG 68 2HB ARG 68 23.281 14.364 -2.848
517 HG2 ARG 68 1HG ARG 68 22.709 15.851 -1.120
518 HG3 ARG 68 2HG ARG 68 24.395 16.279 -0.811
519 HD2 ARG 68 1HD ARG 68 24.454 17.296 -3.128
520 HD3 ARG 68 2HD ARG 68 22.689 17.135 -3.152
521 HE ARG 68 HE ARG 68 24.333 18.835 -1.337
522 HH11 ARG 68 1HH1 ARG 68 21.096 17.911 -2.417
523 HH12 ARG 68 2HH1 ARG 68 20.342 19.251 -1.598
524 HH21 ARG 68 1HH2 ARG 68 23.301 20.502 -0.312
525 HH22 ARG 68 2HH2 ARG 68 21.574 20.701 -0.438
526 H ALA 69 H ALA 69 26.799 12.972 -2.740
527 HA ALA 69 HA ALA 69 25.533 10.629 -3.912
528 HB1 ALA 69 1HB ALA 69 27.394 11.880 -5.023
529 HB2 ALA 69 2HB ALA 69 28.496 11.364 -3.727
530 HB3 ALA 69 3HB ALA 69 27.770 10.154 -4.811
531 H ARG 70 H ARG 70 27.756 11.252 -1.178
532 HA ARG 70 HA ARG 70 28.325 8.495 -0.593
533 HB2 ARG 70 1HB ARG 70 28.389 11.006 1.107
534 HB3 ARG 70 2HB ARG 70 28.959 9.427 1.669
535 HG2 ARG 70 1HG ARG 70 30.658 9.354 0.021
536 HG3 ARG 70 2HG ARG 70 29.994 10.763 -0.820
537 HD2 ARG 70 1HD ARG 70 31.968 11.390 0.533
538 HD3 ARG 70 2HD ARG 70 30.495 12.194 1.112
539 HE ARG 70 HE ARG 70 30.822 9.767 2.552
540 HH11 ARG 70 1HH1 ARG 70 32.333 12.954 2.340
541 HH12 ARG 70 2HH1 ARG 70 32.876 12.904 3.993
542 HH21 ARG 70 1HH2 ARG 70 31.542 9.778 4.649
543 HH22 ARG 70 2HH2 ARG 70 32.436 11.136 5.274
544 H ARG 71 H ARG 71 25.940 10.746 0.853
545 HA ARG 71 HA ARG 71 25.047 8.860 2.812
546 HB2 ARG 71 1HB ARG 71 23.256 10.335 3.192
547 HB3 ARG 71 2HB ARG 71 24.668 11.326 2.812
548 HG2 ARG 71 1HG ARG 71 23.778 11.558 0.473
549 HG3 ARG 71 2HG ARG 71 22.311 10.727 1.009
550 HD2 ARG 71 1HD ARG 71 23.412 13.373 1.998
551 HD3 ARG 71 2HD ARG 71 21.907 13.099 1.097
552 HE ARG 71 HE ARG 71 22.357 12.806 3.949
553 HH11 ARG 71 1HH1 ARG 71 20.322 11.556 1.315
554 HH12 ARG 71 2HH1 ARG 71 19.034 11.142 2.408
555 HH21 ARG 71 1HH2 ARG 71 20.686 12.214 5.257
556 HH22 ARG 71 2HH2 ARG 71 19.241 11.492 4.602
557 H GLU 72 H GLU 72 24.337 9.262 -0.574
558 HA GLU 72 HA GLU 72 21.958 7.550 -0.402
559 HB2 GLU 72 1HB GLU 72 23.541 8.564 -2.768
560 HB3 GLU 72 2HB GLU 72 22.152 7.474 -2.908
561 HG2 GLU 72 1HG GLU 72 22.136 10.264 -1.707
562 HG3 GLU 72 2HG GLU 72 21.405 9.769 -3.239
563 H GLN 73 H GLN 73 25.418 7.059 -1.032
564 HA GLN 73 HA GLN 73 25.242 4.375 -1.966
565 HB2 GLN 73 1HB GLN 73 27.382 5.785 -0.355
566 HB3 GLN 73 2HB GLN 73 27.568 4.153 -0.989
567 HG2 GLN 73 1HG GLN 73 27.597 4.876 -3.214
568 HG3 GLN 73 2HG GLN 73 26.856 6.426 -2.826
569 HE21 GLN 73 1HE2 GLN 73 30.035 7.827 -3.072
570 HE22 GLN 73 2HE2 GLN 73 28.407 7.724 -3.702
571 H GLU 74 H GLU 74 25.276 5.673 1.386
572 HA GLU 74 HA GLU 74 25.334 2.990 2.513
573 HB2 GLU 74 1HB GLU 74 24.831 4.124 4.661
574 HB3 GLU 74 2HB GLU 74 26.246 4.748 3.813
575 HG2 GLU 74 1HG GLU 74 24.883 6.610 2.956
576 HG3 GLU 74 2HG GLU 74 23.525 6.042 3.942
577 H ARG 75 H ARG 75 22.768 5.260 1.562
578 HA ARG 75 HA ARG 75 20.661 3.782 2.861
579 HB2 ARG 75 1HB ARG 75 20.688 5.671 0.489
580 HB3 ARG 75 2HB ARG 75 19.211 4.911 1.088
581 HG2 ARG 75 1HG ARG 75 19.546 5.953 3.290
582 HG3 ARG 75 2HG ARG 75 21.034 6.708 2.711
583 HD2 ARG 75 1HD ARG 75 19.409 8.392 2.483
584 HD3 ARG 75 2HD ARG 75 19.597 7.733 0.848
585 HE ARG 75 HE ARG 75 17.439 6.759 2.668
586 HH11 ARG 75 1HH1 ARG 75 18.330 8.210 -0.454
587 HH12 ARG 75 2HH1 ARG 75 16.695 8.074 -1.050
588 HH21 ARG 75 1HH2 ARG 75 15.413 6.625 1.803
589 HH22 ARG 75 2HH2 ARG 75 15.091 7.195 0.190
590 H ILE 76 H ILE 76 22.070 3.578 -0.450
591 HA ILE 76 HA ILE 76 20.140 1.531 -1.173
592 HB ILE 76 HB ILE 76 21.365 1.280 -3.259
593 HG12 ILE 76 1HG1 ILE 76 23.461 3.122 -2.062
594 HG13 ILE 76 2HG1 ILE 76 23.664 1.393 -2.309
595 HG21 ILE 76 1HG2 ILE 76 21.239 4.238 -2.507
596 HG22 ILE 76 2HG2 ILE 76 21.045 3.530 -4.124
597 HG23 ILE 76 3HG2 ILE 76 19.819 3.240 -2.877
598 HD11 ILE 76 1HD1 ILE 76 23.366 3.524 -4.453
599 HD12 ILE 76 2HD1 ILE 76 24.796 2.539 -4.086
600 HD13 ILE 76 3HD1 ILE 76 23.350 1.773 -4.780
601 H ARG 77 H ARG 77 23.213 1.412 0.495
602 HA ARG 77 HA ARG 77 23.585 -1.422 -0.203
603 HB2 ARG 77 1HB ARG 77 25.526 -1.413 0.985
604 HB3 ARG 77 2HB ARG 77 25.455 0.273 0.495
605 HG2 ARG 77 1HG ARG 77 24.751 0.908 2.765
606 HG3 ARG 77 2HG ARG 77 24.617 -0.788 3.228
607 HD2 ARG 77 1HD ARG 77 26.666 -0.254 4.117
608 HD3 ARG 77 2HD ARG 77 27.122 -0.940 2.555
609 HE ARG 77 HE ARG 77 27.607 1.271 1.742
610 HH11 ARG 77 1HH1 ARG 77 26.832 1.262 5.206
611 HH12 ARG 77 2HH1 ARG 77 27.627 2.790 5.469
612 HH21 ARG 77 1HH2 ARG 77 28.569 3.229 2.175
613 HH22 ARG 77 2HH2 ARG 77 28.562 3.884 3.791
614 H LEU 78 H LEU 78 22.049 0.466 2.200
615 HA LEU 78 HA LEU 78 20.660 0.116 3.901
616 HB2 LEU 78 1HB LEU 78 19.523 -1.137 2.185
617 HB3 LEU 78 2HB LEU 78 20.354 -2.595 2.650
618 HG LEU 78 HG LEU 78 18.490 -1.139 4.542
619 HD11 LEU 78 1HD1 LEU 78 17.298 -1.603 2.445
620 HD12 LEU 78 2HD1 LEU 78 16.710 -2.655 3.748
621 HD13 LEU 78 3HD1 LEU 78 17.814 -3.306 2.512
622 HD21 LEU 78 1HD2 LEU 78 18.159 -3.462 5.475
623 HD22 LEU 78 2HD2 LEU 78 19.800 -2.838 5.687
624 HD23 LEU 78 3HD2 LEU 78 19.465 -4.029 4.407
625 H PHE 79 H PHE 79 22.679 -2.902 3.668
626 HA PHE 79 HA PHE 79 22.618 -3.162 6.577
627 HB2 PHE 79 1HB PHE 79 24.772 -4.634 5.895
628 HB3 PHE 79 2HB PHE 79 23.108 -5.236 5.830
629 HD1 PHE 79 HD1 PHE 79 22.040 -5.780 3.748
630 HD2 PHE 79 HD2 PHE 79 25.890 -3.866 3.763
631 HE1 PHE 79 HE1 PHE 79 22.288 -6.277 1.317
632 HE2 PHE 79 HE2 PHE 79 26.153 -4.355 1.334
633 HZ PHE 79 HZ PHE 79 24.348 -5.563 0.104
634 H SER 80 H SER 80 23.574 -1.778 7.850
635 HA SER 80 HA SER 80 26.419 -1.138 7.347
636 HB2 SER 80 1HB SER 80 24.322 0.909 8.185
637 HB3 SER 80 2HB SER 80 26.057 1.205 7.973
638 HG SER 80 HG SER 80 24.113 0.565 6.002
639 H ALA 81 H ALA 81 27.526 -1.110 9.282
640 HA ALA 81 HA ALA 81 25.924 -1.780 11.733
641 HB1 ALA 81 1HB ALA 81 27.322 -3.687 10.922
642 HB2 ALA 81 2HB ALA 81 28.763 -2.642 11.002
643 HB3 ALA 81 3HB ALA 81 27.891 -3.072 12.492
644 H ASP 82 H ASP 82 26.952 0.681 10.329
645 HA ASP 82 HA ASP 82 28.656 1.854 12.467
646 HB2 ASP 82 1HB ASP 82 28.543 3.216 9.858
647 HB3 ASP 82 2HB ASP 82 29.955 2.740 10.814
648 HA PRO 83 HA PRO 83 25.165 4.569 12.818
649 HB2 PRO 83 1HB PRO 83 26.186 6.849 13.881
650 HB3 PRO 83 2HB PRO 83 26.149 5.324 14.828
651 HG2 PRO 83 1HG PRO 83 28.391 6.501 13.213
652 HG3 PRO 83 2HG PRO 83 28.411 5.945 14.919
653 HD2 PRO 83 1HD PRO 83 29.270 4.356 12.878
654 HD3 PRO 83 2HD PRO 83 28.394 3.671 14.292
655 H PHE 84 H PHE 84 24.235 6.508 11.830
656 HA PHE 84 HA PHE 84 25.665 7.224 9.344
657 HB2 PHE 84 1HB PHE 84 22.739 7.610 10.035
658 HB3 PHE 84 2HB PHE 84 23.482 7.824 8.445
659 HD1 PHE 84 HD1 PHE 84 21.856 5.519 10.680
660 HD2 PHE 84 HD2 PHE 84 24.547 5.748 7.334
661 HE1 PHE 84 HE1 PHE 84 21.371 3.136 10.137
662 HE2 PHE 84 HE2 PHE 84 24.051 3.377 6.765
663 HZ PHE 84 HZ PHE 84 22.449 2.067 8.162
664 H ASP 85 H ASP 85 25.582 8.367 12.228
665 HA ASP 85 HA ASP 85 26.103 11.100 11.446
666 HB2 ASP 85 1HB ASP 85 23.564 10.996 11.683
667 HB3 ASP 85 2HB ASP 85 23.822 10.662 13.402
668 H LEU 86 H LEU 86 28.007 11.166 12.440
669 HA LEU 86 HA LEU 86 28.491 9.795 14.962
670 HB2 LEU 86 1HB LEU 86 30.757 10.849 14.754
671 HB3 LEU 86 2HB LEU 86 30.271 9.791 13.439
672 HG LEU 86 HG LEU 86 29.525 12.219 12.415
673 HD11 LEU 86 1HD1 LEU 86 31.345 13.806 12.793
674 HD12 LEU 86 2HD1 LEU 86 32.132 12.686 13.933
675 HD13 LEU 86 3HD1 LEU 86 30.572 13.428 14.342
676 HD21 LEU 86 1HD2 LEU 86 31.566 12.024 11.047
677 HD22 LEU 86 2HD2 LEU 86 30.782 10.447 11.275
678 HD23 LEU 86 3HD2 LEU 86 32.240 10.857 12.210
679 H GLU 87 H GLU 87 27.797 13.138 13.987
680 HA GLU 87 HA GLU 87 28.528 14.145 16.655
681 HB2 GLU 87 1HB GLU 87 27.858 16.346 15.739
682 HB3 GLU 87 2HB GLU 87 29.105 15.516 14.817
683 HG2 GLU 87 1HG GLU 87 27.403 14.817 13.153
684 HG3 GLU 87 2HG GLU 87 26.202 15.789 14.028
685 H ALA 88 H ALA 88 25.657 13.568 14.723
686 HA ALA 88 HA ALA 88 23.439 13.495 15.216
687 HB1 ALA 88 1HB ALA 88 22.825 12.230 17.211
688 HB2 ALA 88 2HB ALA 88 24.272 11.524 16.445
689 HB3 ALA 88 3HB ALA 88 24.433 12.523 17.916
690 H GLN 89 H GLN 89 24.502 16.111 15.578
691 HA GLN 89 HA GLN 89 23.190 17.134 18.008
692 HB2 GLN 89 1HB GLN 89 24.163 19.247 17.506
693 HB3 GLN 89 2HB GLN 89 25.402 18.007 17.311
694 HG2 GLN 89 1HG GLN 89 25.143 18.126 14.858
695 HG3 GLN 89 2HG GLN 89 23.886 19.359 15.051
696 HE21 GLN 89 1HE2 GLN 89 27.517 20.658 14.610
697 HE22 GLN 89 2HE2 GLN 89 26.793 19.208 13.932
698 H ALA 90 H ALA 90 21.583 18.745 18.016
699 HA ALA 90 HA ALA 90 19.592 18.362 15.892
700 HB1 ALA 90 1HB ALA 90 18.949 18.255 18.296
701 HB2 ALA 90 2HB ALA 90 19.460 19.950 18.498
702 HB3 ALA 90 3HB ALA 90 18.087 19.553 17.440
703 H LYS 91 H LYS 91 18.313 20.343 15.220
704 HA LYS 91 HA LYS 91 19.987 22.797 14.911
705 HB2 LYS 91 1HB LYS 91 18.293 21.397 12.796
706 HB3 LYS 91 2HB LYS 91 18.932 23.036 12.642
707 HG2 LYS 91 1HG LYS 91 21.236 22.157 12.803
708 HG3 LYS 91 2HG LYS 91 20.582 20.507 12.900
709 HD2 LYS 91 1HD LYS 91 19.497 20.823 10.699
710 HD3 LYS 91 2HD LYS 91 20.209 22.451 10.594
711 HE2 LYS 91 1HE LYS 91 22.466 21.486 10.704
712 HE3 LYS 91 2HE LYS 91 21.778 19.856 10.873
713 HZ1 LYS 91 1HZ LYS 91 22.425 20.368 8.586
714 HZ2 LYS 91 2HZ LYS 91 21.357 21.628 8.527
715 HZ3 LYS 91 3HZ LYS 91 20.806 20.083 8.694
716 H ILE 92 H ILE 92 18.388 24.629 14.246
717 HA ILE 92 HA ILE 92 15.699 24.227 15.443
718 HB ILE 92 HB ILE 92 17.561 26.620 15.951
719 HG12 ILE 92 1HG1 ILE 92 16.469 24.604 17.960
720 HG13 ILE 92 2HG1 ILE 92 18.094 24.529 17.276
721 HG21 ILE 92 1HG2 ILE 92 15.159 27.273 15.706
722 HG22 ILE 92 2HG2 ILE 92 14.708 26.084 16.951
723 HG23 ILE 92 3HG2 ILE 92 15.709 27.495 17.374
724 HD11 ILE 92 1HD1 ILE 92 18.254 25.533 19.458
725 HD12 ILE 92 2HD1 ILE 92 18.574 26.801 18.253
726 HD13 ILE 92 3HD1 ILE 92 16.994 26.724 19.074
727 H GLU 93 H GLU 93 14.264 24.814 13.976
728 HA GLU 93 HA GLU 93 15.165 26.251 11.554
729 HB2 GLU 93 1HB GLU 93 12.867 25.664 10.722
730 HB3 GLU 93 2HB GLU 93 13.912 24.293 11.088
731 HG2 GLU 93 1HG GLU 93 11.934 25.269 13.151
732 HG3 GLU 93 2HG GLU 93 11.404 24.246 11.807
733 H GLU 94 H GLU 94 13.857 27.990 10.610
734 HA GLU 94 HA GLU 94 12.250 29.564 12.568
735 HB2 GLU 94 1HB GLU 94 14.654 30.579 10.996
736 HB3 GLU 94 2HB GLU 94 13.425 31.629 11.691
737 HG2 GLU 94 1HG GLU 94 13.979 30.638 13.947
738 HG3 GLU 94 2HG GLU 94 15.396 29.897 13.176
739 H ASP 95 H ASP 95 10.883 31.149 11.553
740 HA ASP 95 HA ASP 95 10.867 31.136 8.576
741 HB2 ASP 95 1HB ASP 95 8.921 29.784 9.379
742 HB3 ASP 95 2HB ASP 95 8.338 31.207 10.256
743 H ILE 96 H ILE 96 12.326 32.907 9.191
744 HA ILE 96 HA ILE 96 11.004 35.321 10.279
745 HB ILE 96 HB ILE 96 13.316 36.325 10.034
746 HG12 ILE 96 1HG1 ILE 96 14.213 33.473 9.456
747 HG13 ILE 96 2HG1 ILE 96 13.953 34.659 8.173
748 HG21 ILE 96 1HG2 ILE 96 13.149 33.743 11.663
749 HG22 ILE 96 2HG2 ILE 96 14.272 35.082 11.957
750 HG23 ILE 96 3HG2 ILE 96 12.525 35.324 12.169
751 HD11 ILE 96 1HD1 ILE 96 15.632 36.151 9.300
752 HD12 ILE 96 2HD1 ILE 96 15.985 34.799 10.411
753 HD13 ILE 96 3HD1 ILE 96 16.272 34.620 8.669
754 H ARG 97 H ARG 97 9.961 34.307 7.819
755 HA ARG 97 HA ARG 97 11.137 35.934 5.668
756 HB2 ARG 97 1HB ARG 97 10.119 33.595 5.488
757 HB3 ARG 97 2HB ARG 97 8.538 34.374 5.588
758 HG2 ARG 97 1HG ARG 97 9.016 35.641 3.556
759 HG3 ARG 97 2HG ARG 97 10.668 34.989 3.514
760 HD2 ARG 97 1HD ARG 97 9.711 32.693 3.353
761 HD3 ARG 97 2HD ARG 97 8.090 33.405 3.249
762 HE ARG 97 HE ARG 97 10.183 33.383 1.187
763 HH11 ARG 97 1HH1 ARG 97 7.114 34.825 2.173
764 HH12 ARG 97 2HH1 ARG 97 6.740 35.364 0.557
765 HH21 ARG 97 1HH2 ARG 97 9.649 34.107 -0.841
766 HH22 ARG 97 2HH2 ARG 97 8.156 34.962 -1.121
767 H GLN 98 H GLN 98 10.738 37.764 7.274
768 HA GLN 98 HA GLN 98 9.877 39.807 7.678
769 HB2 GLN 98 1HB GLN 98 9.795 39.861 5.120
770 HB3 GLN 98 2HB GLN 98 8.061 39.550 5.245
771 HG2 GLN 98 1HG GLN 98 7.828 41.613 6.687
772 HG3 GLN 98 2HG GLN 98 9.561 41.903 6.517
773 HE21 GLN 98 1HE2 GLN 98 9.334 43.362 3.368
774 HE22 GLN 98 2HE2 GLN 98 10.357 42.852 4.692
775 HXT GLN 98 HO GLN 98 7.334 37.853 6.799
Start of MODEL 17
1 H1 SER 1 1H SER 1 18.673 27.998 -13.981
2 H2 SER 1 2H SER 1 19.880 28.068 -14.993
3 H3 SER 1 3H SER 1 18.331 28.096 -15.493
4 HA SER 1 HA SER 1 18.075 30.394 -15.080
5 HB2 SER 1 1HB SER 1 19.125 30.479 -12.884
6 HB3 SER 1 2HB SER 1 20.703 30.037 -13.577
7 HG SER 1 HG SER 1 20.989 32.122 -13.644
8 H GLN 2 H GLN 2 18.573 31.902 -16.517
9 HA GLN 2 HA GLN 2 20.946 31.395 -18.273
10 HB2 GLN 2 1HB GLN 2 18.336 31.236 -19.067
11 HB3 GLN 2 2HB GLN 2 18.679 32.929 -19.430
12 HG2 GLN 2 1HG GLN 2 20.502 30.675 -20.341
13 HG3 GLN 2 2HG GLN 2 19.088 31.168 -21.277
14 HE21 GLN 2 1HE2 GLN 2 22.491 33.374 -21.376
15 HE22 GLN 2 2HE2 GLN 2 22.341 31.988 -20.327
16 H GLN 3 H GLN 3 20.723 32.896 -15.798
17 HA GLN 3 HA GLN 3 21.474 34.851 -14.890
18 HB2 GLN 3 1HB GLN 3 22.741 35.225 -17.631
19 HB3 GLN 3 2HB GLN 3 23.167 36.118 -16.170
20 HG2 GLN 3 1HG GLN 3 24.831 34.449 -16.384
21 HG3 GLN 3 2HG GLN 3 23.761 33.883 -15.097
22 HE21 GLN 3 1HE2 GLN 3 23.270 30.810 -16.640
23 HE22 GLN 3 2HE2 GLN 3 23.385 31.773 -15.180
24 H SER 4 H SER 4 18.894 34.862 -16.394
25 HA SER 4 HA SER 4 18.536 37.506 -17.509
26 HB2 SER 4 1HB SER 4 17.073 35.646 -18.143
27 HB3 SER 4 2HB SER 4 16.591 35.416 -16.450
28 HG SER 4 HG SER 4 14.998 36.621 -17.254
29 H HIS 5 H HIS 5 17.382 39.239 -16.572
30 HA HIS 5 HA HIS 5 17.969 39.861 -13.856
31 HB2 HIS 5 1HB HIS 5 17.426 41.421 -15.820
32 HB3 HIS 5 2HB HIS 5 15.725 41.053 -15.516
33 HD1 HIS 5 HD1 HIS 5 18.710 42.802 -13.932
34 HD2 HIS 5 HD2 HIS 5 14.615 42.334 -13.333
35 HE1 HIS 5 HE1 HIS 5 18.031 44.472 -12.158
36 H SER 6 H SER 6 15.357 38.092 -15.334
37 HA SER 6 HA SER 6 14.261 37.587 -12.611
38 HB2 SER 6 1HB SER 6 12.605 37.883 -15.154
39 HB3 SER 6 2HB SER 6 11.994 37.480 -13.532
40 HG SER 6 HG SER 6 13.248 39.616 -13.054
41 H SER 7 H SER 7 14.717 35.498 -12.222
42 HA SER 7 HA SER 7 14.848 33.649 -14.568
43 HB2 SER 7 1HB SER 7 17.058 34.175 -13.615
44 HB3 SER 7 2HB SER 7 16.509 33.589 -12.032
45 HG SER 7 HG SER 7 16.174 31.541 -12.974
46 HA PRO 8 HA PRO 8 11.818 31.624 -11.820
47 HB2 PRO 8 1HB PRO 8 10.417 30.317 -13.745
48 HB3 PRO 8 2HB PRO 8 10.157 32.063 -13.433
49 HG2 PRO 8 1HG PRO 8 11.890 30.752 -15.516
50 HG3 PRO 8 2HG PRO 8 10.635 32.015 -15.731
51 HD2 PRO 8 1HD PRO 8 13.263 32.631 -15.544
52 HD3 PRO 8 2HD PRO 8 11.997 33.686 -14.825
53 H GLY 9 H GLY 9 11.311 29.156 -11.771
54 HA2 GLY 9 1HA GLY 9 12.177 26.932 -12.516
55 HA3 GLY 9 2HA GLY 9 13.787 27.670 -12.636
56 H GLU 10 H GLU 10 11.536 28.525 -10.143
57 HA GLU 10 HA GLU 10 13.373 27.962 -8.014
58 HB2 GLU 10 1HB GLU 10 11.512 28.792 -6.604
59 HB3 GLU 10 2HB GLU 10 11.841 29.851 -7.972
60 HG2 GLU 10 1HG GLU 10 9.703 27.780 -8.368
61 HG3 GLU 10 2HG GLU 10 9.348 29.103 -7.251
62 H ILE 11 H ILE 11 12.514 25.571 -9.538
63 HA ILE 11 HA ILE 11 11.019 23.979 -7.677
64 HB ILE 11 HB ILE 11 12.295 23.718 -10.404
65 HG12 ILE 11 1HG1 ILE 11 9.403 23.228 -9.625
66 HG13 ILE 11 2HG1 ILE 11 10.027 24.828 -10.032
67 HG21 ILE 11 1HG2 ILE 11 11.462 21.428 -10.561
68 HG22 ILE 11 2HG2 ILE 11 12.772 21.681 -9.405
69 HG23 ILE 11 3HG2 ILE 11 11.107 21.484 -8.814
70 HD11 ILE 11 1HD1 ILE 11 8.970 23.908 -12.002
71 HD12 ILE 11 2HD1 ILE 11 10.725 23.946 -12.287
72 HD13 ILE 11 3HD1 ILE 11 9.918 22.409 -11.883
73 H THR 12 H THR 12 13.957 25.127 -8.200
74 HA THR 12 HA THR 12 15.251 23.418 -6.186
75 HB THR 12 HB THR 12 15.805 22.346 -8.421
76 HG1 THR 12 HG1 THR 12 18.043 22.290 -7.963
77 HG21 THR 12 1HG2 THR 12 17.302 23.457 -9.963
78 HG22 THR 12 2HG2 THR 12 17.393 24.895 -8.924
79 HG23 THR 12 3HG2 THR 12 15.871 24.488 -9.752
80 H SER 13 H SER 13 17.286 24.453 -5.428
81 HA SER 13 HA SER 13 16.971 27.410 -5.556
82 HB2 SER 13 1HB SER 13 18.530 25.688 -3.595
83 HB3 SER 13 2HB SER 13 18.215 27.430 -3.457
84 HG SER 13 HG SER 13 15.967 26.904 -3.360
85 H SER 14 H SER 14 18.505 28.688 -6.372
86 HA SER 14 HA SER 14 20.332 29.265 -7.670
87 HB2 SER 14 1HB SER 14 22.462 28.988 -6.439
88 HB3 SER 14 2HB SER 14 21.136 29.586 -5.426
89 HG SER 14 HG SER 14 21.679 26.823 -5.575
90 HA PRO 15 HA PRO 15 21.183 25.068 -9.452
91 HB2 PRO 15 1HB PRO 15 20.484 25.553 -12.070
92 HB3 PRO 15 2HB PRO 15 19.327 24.988 -10.824
93 HG2 PRO 15 1HG PRO 15 19.850 27.807 -11.758
94 HG3 PRO 15 2HG PRO 15 18.284 26.942 -11.604
95 HD2 PRO 15 1HD PRO 15 19.121 28.601 -9.669
96 HD3 PRO 15 2HD PRO 15 18.336 27.039 -9.246
97 H GLN 16 H GLN 16 21.798 28.266 -11.057
98 HA GLN 16 HA GLN 16 24.262 27.306 -12.235
99 HB2 GLN 16 1HB GLN 16 24.671 29.543 -12.916
100 HB3 GLN 16 2HB GLN 16 22.939 29.262 -13.107
101 HG2 GLN 16 1HG GLN 16 22.482 30.537 -11.056
102 HG3 GLN 16 2HG GLN 16 24.220 30.735 -10.772
103 HE21 GLN 16 1HE2 GLN 16 24.395 33.656 -12.595
104 HE22 GLN 16 2HE2 GLN 16 25.008 32.626 -11.325
105 H GLY 17 H GLY 17 23.380 28.184 -9.045
106 HA2 GLY 17 1HA GLY 17 25.891 29.372 -8.249
107 HA3 GLY 17 2HA GLY 17 24.608 28.778 -7.181
108 H LEU 18 H LEU 18 24.751 26.136 -8.733
109 HA LEU 18 HA LEU 18 26.561 24.789 -6.942
110 HB2 LEU 18 1HB LEU 18 25.386 23.845 -9.581
111 HB3 LEU 18 2HB LEU 18 26.097 22.818 -8.345
112 HG LEU 18 HG LEU 18 23.568 24.460 -8.036
113 HD11 LEU 18 1HD1 LEU 18 23.978 21.474 -8.439
114 HD12 LEU 18 2HD1 LEU 18 23.317 22.618 -9.632
115 HD13 LEU 18 3HD1 LEU 18 22.418 22.281 -8.139
116 HD21 LEU 18 1HD2 LEU 18 24.827 22.389 -6.187
117 HD22 LEU 18 2HD2 LEU 18 23.216 23.116 -5.972
118 HD23 LEU 18 3HD2 LEU 18 24.665 24.133 -5.864
119 H ASP 19 H ASP 19 26.729 25.769 -10.341
120 HA ASP 19 HA ASP 19 29.419 24.670 -10.729
121 HB2 ASP 19 1HB ASP 19 27.582 24.810 -12.477
122 HB3 ASP 19 2HB ASP 19 27.812 26.565 -12.477
123 H ASN 20 H ASN 20 27.880 27.720 -9.921
124 HA ASN 20 HA ASN 20 30.544 29.062 -9.977
125 HB2 ASN 20 1HB ASN 20 27.724 30.212 -10.128
126 HB3 ASN 20 2HB ASN 20 29.205 31.150 -10.033
127 HD21 ASN 20 1HD2 ASN 20 30.233 30.201 -13.367
128 HD22 ASN 20 2HD2 ASN 20 30.904 30.062 -11.767
129 HA PRO 21 HA PRO 21 29.516 28.997 -5.485
130 HB2 PRO 21 1HB PRO 21 32.196 29.056 -4.741
131 HB3 PRO 21 2HB PRO 21 31.274 27.552 -4.951
132 HG2 PRO 21 1HG PRO 21 33.095 28.921 -6.829
133 HG3 PRO 21 2HG PRO 21 32.982 27.194 -6.444
134 HD2 PRO 21 1HD PRO 21 31.964 28.178 -8.673
135 HD3 PRO 21 2HD PRO 21 31.120 26.879 -7.753
136 H ALA 22 H ALA 22 31.807 30.739 -7.580
137 HA ALA 22 HA ALA 22 32.270 32.937 -5.848
138 HB1 ALA 22 1HB ALA 22 33.667 32.453 -7.803
139 HB2 ALA 22 2HB ALA 22 32.299 32.808 -8.889
140 HB3 ALA 22 3HB ALA 22 33.010 34.104 -7.897
141 H LEU 23 H LEU 23 29.747 32.411 -8.323
142 HA LEU 23 HA LEU 23 28.683 35.095 -7.927
143 HB2 LEU 23 1HB LEU 23 27.393 32.712 -9.291
144 HB3 LEU 23 2HB LEU 23 26.886 34.391 -9.410
145 HG LEU 23 HG LEU 23 29.402 33.156 -10.564
146 HD11 LEU 23 1HD1 LEU 23 26.979 34.433 -11.880
147 HD12 LEU 23 2HD1 LEU 23 27.275 32.682 -11.741
148 HD13 LEU 23 3HD1 LEU 23 28.367 33.688 -12.708
149 HD21 LEU 23 1HD2 LEU 23 29.966 35.412 -9.875
150 HD22 LEU 23 2HD2 LEU 23 28.528 36.047 -10.714
151 HD23 LEU 23 3HD2 LEU 23 29.850 35.288 -11.641
152 H LEU 24 H LEU 24 27.975 31.804 -6.738
153 HA LEU 24 HA LEU 24 25.486 32.556 -5.516
154 HB2 LEU 24 1HB LEU 24 26.137 30.225 -6.002
155 HB3 LEU 24 2HB LEU 24 27.416 30.320 -4.799
156 HG LEU 24 HG LEU 24 25.818 30.507 -3.009
157 HD11 LEU 24 1HD1 LEU 24 23.345 30.302 -3.461
158 HD12 LEU 24 2HD1 LEU 24 23.699 30.646 -5.170
159 HD13 LEU 24 3HD1 LEU 24 24.066 31.856 -3.915
160 HD21 LEU 24 1HD2 LEU 24 26.351 28.266 -3.886
161 HD22 LEU 24 2HD2 LEU 24 24.912 28.343 -4.922
162 HD23 LEU 24 3HD2 LEU 24 24.735 28.349 -3.153
163 H ARG 25 H ARG 25 28.861 32.406 -4.338
164 HA ARG 25 HA ARG 25 28.402 33.178 -1.651
165 HB2 ARG 25 1HB ARG 25 30.556 32.402 -2.515
166 HB3 ARG 25 2HB ARG 25 30.671 33.782 -3.588
167 HG2 ARG 25 1HG ARG 25 30.483 34.338 -0.659
168 HG3 ARG 25 2HG ARG 25 31.984 33.620 -1.264
169 HD2 ARG 25 1HD ARG 25 30.706 36.194 -2.240
170 HD3 ARG 25 2HD ARG 25 32.133 36.074 -1.204
171 HE ARG 25 HE ARG 25 33.023 34.717 -3.307
172 HH11 ARG 25 1HH1 ARG 25 31.154 37.716 -3.330
173 HH12 ARG 25 2HH1 ARG 25 31.830 38.245 -4.840
174 HH21 ARG 25 1HH2 ARG 25 33.860 35.470 -5.240
175 HH22 ARG 25 2HH2 ARG 25 33.335 36.995 -5.894
176 H ASP 26 H ASP 26 28.800 35.148 -4.612
177 HA ASP 26 HA ASP 26 28.691 37.672 -3.299
178 HB2 ASP 26 1HB ASP 26 29.286 36.926 -5.775
179 HB3 ASP 26 2HB ASP 26 27.582 37.295 -6.071
180 H MET 27 H MET 27 26.118 35.706 -4.833
181 HA MET 27 HA MET 27 23.967 37.531 -4.423
182 HB2 MET 27 1HB MET 27 23.981 35.431 -5.823
183 HB3 MET 27 2HB MET 27 23.865 34.491 -4.338
184 HG2 MET 27 1HG MET 27 21.834 36.583 -5.113
185 HG3 MET 27 2HG MET 27 21.726 34.910 -5.660
186 HE1 MET 27 1HE MET 27 20.778 32.911 -2.439
187 HE2 MET 27 2HE MET 27 20.965 32.876 -4.206
188 HE3 MET 27 3HE MET 27 22.395 33.043 -3.160
189 H LEU 28 H LEU 28 25.117 34.809 -2.448
190 HA LEU 28 HA LEU 28 23.160 34.995 -0.425
191 HB2 LEU 28 1HB LEU 28 25.969 33.974 -0.466
192 HB3 LEU 28 2HB LEU 28 24.954 33.886 0.972
193 HG LEU 28 HG LEU 28 24.101 32.709 -1.675
194 HD11 LEU 28 1HD1 LEU 28 25.624 31.518 0.619
195 HD12 LEU 28 2HD1 LEU 28 26.179 31.746 -1.049
196 HD13 LEU 28 3HD1 LEU 28 24.882 30.586 -0.703
197 HD21 LEU 28 1HD2 LEU 28 22.300 33.064 -0.090
198 HD22 LEU 28 2HD2 LEU 28 23.217 32.270 1.201
199 HD23 LEU 28 3HD2 LEU 28 22.642 31.336 -0.203
200 H LEU 29 H LEU 29 26.390 36.524 -0.638
201 HA LEU 29 HA LEU 29 26.266 37.703 1.984
202 HB2 LEU 29 1HB LEU 29 27.750 38.476 -0.537
203 HB3 LEU 29 2HB LEU 29 27.928 39.360 0.976
204 HG LEU 29 HG LEU 29 28.534 36.407 0.700
205 HD11 LEU 29 1HD1 LEU 29 29.948 37.708 -0.796
206 HD12 LEU 29 2HD1 LEU 29 30.887 37.074 0.575
207 HD13 LEU 29 3HD1 LEU 29 30.402 38.789 0.546
208 HD21 LEU 29 1HD2 LEU 29 29.286 38.438 2.832
209 HD22 LEU 29 2HD2 LEU 29 29.839 36.745 2.770
210 HD23 LEU 29 3HD2 LEU 29 28.120 37.104 3.011
211 H ALA 30 H ALA 30 25.110 38.748 -1.182
212 HA ALA 30 HA ALA 30 24.333 41.385 -0.220
213 HB1 ALA 30 1HB ALA 30 23.586 39.888 -2.771
214 HB2 ALA 30 2HB ALA 30 23.347 41.625 -2.464
215 HB3 ALA 30 3HB ALA 30 24.994 40.958 -2.575
216 H ASN 31 H ASN 31 22.942 38.256 0.136
217 HA ASN 31 HA ASN 31 20.204 39.465 0.300
218 HB2 ASN 31 1HB ASN 31 20.694 37.674 -1.435
219 HB3 ASN 31 2HB ASN 31 20.882 36.554 -0.101
220 HD21 ASN 31 1HD2 ASN 31 17.342 36.869 -1.556
221 HD22 ASN 31 2HD2 ASN 31 18.900 36.922 -2.351
222 HA PRO 32 HA PRO 32 21.147 38.489 4.590
223 HB2 PRO 32 1HB PRO 32 19.091 39.889 5.757
224 HB3 PRO 32 2HB PRO 32 20.612 40.648 5.180
225 HG2 PRO 32 1HG PRO 32 17.976 40.402 3.735
226 HG3 PRO 32 2HG PRO 32 18.978 41.864 4.009
227 HD2 PRO 32 1HD PRO 32 19.122 40.550 1.706
228 HD3 PRO 32 2HD PRO 32 20.619 41.173 2.488
229 H HIS 33 H HIS 33 18.040 37.976 2.933
230 HA HIS 33 HA HIS 33 16.976 36.293 5.072
231 HB2 HIS 33 1HB HIS 33 15.521 37.514 3.480
232 HB3 HIS 33 2HB HIS 33 16.172 36.543 2.152
233 HD1 HIS 33 HD1 HIS 33 14.025 36.164 5.287
234 HD2 HIS 33 HD2 HIS 33 15.038 34.073 1.827
235 HE1 HIS 33 HE1 HIS 33 12.511 34.143 5.179
236 H GLU 34 H GLU 34 18.632 35.807 1.966
237 HA GLU 34 HA GLU 34 18.279 32.931 1.980
238 HB2 GLU 34 1HB GLU 34 19.573 34.986 0.337
239 HB3 GLU 34 2HB GLU 34 20.362 33.447 0.260
240 HG2 GLU 34 1HG GLU 34 17.387 33.760 -0.179
241 HG3 GLU 34 2HG GLU 34 18.561 33.976 -1.486
242 H LEU 35 H LEU 35 20.889 35.193 2.906
243 HA LEU 35 HA LEU 35 22.758 33.142 3.563
244 HB2 LEU 35 1HB LEU 35 24.090 34.771 4.268
245 HB3 LEU 35 2HB LEU 35 23.023 35.597 3.195
246 HG LEU 35 HG LEU 35 21.859 36.622 5.092
247 HD11 LEU 35 1HD1 LEU 35 22.312 35.249 6.987
248 HD12 LEU 35 2HD1 LEU 35 23.170 36.776 7.236
249 HD13 LEU 35 3HD1 LEU 35 24.068 35.331 6.704
250 HD21 LEU 35 1HD2 LEU 35 24.851 36.930 4.772
251 HD22 LEU 35 2HD2 LEU 35 23.757 38.185 5.414
252 HD23 LEU 35 3HD2 LEU 35 23.598 37.634 3.731
253 H SER 36 H SER 36 19.981 34.450 5.224
254 HA SER 36 HA SER 36 20.628 33.381 7.825
255 HB2 SER 36 1HB SER 36 19.134 35.342 7.478
256 HB3 SER 36 2HB SER 36 17.925 34.254 6.767
257 HG SER 36 HG SER 36 17.843 33.144 8.746
258 H LEU 37 H LEU 37 18.545 32.297 5.082
259 HA LEU 37 HA LEU 37 17.598 29.984 6.534
260 HB2 LEU 37 1HB LEU 37 16.663 29.257 4.587
261 HB3 LEU 37 2HB LEU 37 16.612 30.970 4.568
262 HG LEU 37 HG LEU 37 18.391 30.967 2.832
263 HD11 LEU 37 1HD1 LEU 37 19.181 28.684 3.027
264 HD12 LEU 37 2HD1 LEU 37 18.493 28.965 1.425
265 HD13 LEU 37 3HD1 LEU 37 17.558 28.071 2.653
266 HD21 LEU 37 1HD2 LEU 37 16.719 30.567 1.073
267 HD22 LEU 37 2HD2 LEU 37 16.039 31.490 2.427
268 HD23 LEU 37 3HD2 LEU 37 15.672 29.757 2.263
269 H LEU 38 H LEU 38 20.370 30.777 4.627
270 HA LEU 38 HA LEU 38 21.280 28.119 4.295
271 HB2 LEU 38 1HB LEU 38 21.935 30.145 3.081
272 HB3 LEU 38 2HB LEU 38 22.859 30.679 4.497
273 HG LEU 38 HG LEU 38 24.219 28.597 4.390
274 HD11 LEU 38 1HD1 LEU 38 22.766 28.243 1.755
275 HD12 LEU 38 2HD1 LEU 38 22.738 27.152 3.161
276 HD13 LEU 38 3HD1 LEU 38 24.232 27.359 2.235
277 HD21 LEU 38 1HD2 LEU 38 24.284 30.306 1.908
278 HD22 LEU 38 2HD2 LEU 38 25.627 29.329 2.545
279 HD23 LEU 38 3HD2 LEU 38 25.021 30.717 3.471
280 H LYS 39 H LYS 39 22.049 30.534 6.853
281 HA LYS 39 HA LYS 39 23.649 28.579 8.308
282 HB2 LYS 39 1HB LYS 39 23.446 30.126 10.251
283 HB3 LYS 39 2HB LYS 39 24.166 30.814 8.796
284 HG2 LYS 39 1HG LYS 39 22.178 32.041 8.298
285 HG3 LYS 39 2HG LYS 39 21.262 31.241 9.552
286 HD2 LYS 39 1HD LYS 39 21.826 33.388 10.390
287 HD3 LYS 39 2HD LYS 39 22.895 32.245 11.225
288 HE2 LYS 39 1HE LYS 39 24.720 32.799 9.646
289 HE3 LYS 39 2HE LYS 39 23.637 33.902 8.774
290 HZ1 LYS 39 1HZ LYS 39 24.476 34.200 11.600
291 HZ2 LYS 39 2HZ LYS 39 23.468 35.227 10.790
292 HZ3 LYS 39 3HZ LYS 39 25.047 35.086 10.331
293 H GLU 40 H GLU 40 20.219 29.234 8.185
294 HA GLU 40 HA GLU 40 19.540 27.752 10.578
295 HB2 GLU 40 1HB GLU 40 17.998 29.350 9.516
296 HB3 GLU 40 2HB GLU 40 18.019 28.414 8.032
297 HG2 GLU 40 1HG GLU 40 16.953 26.508 9.292
298 HG3 GLU 40 2HG GLU 40 16.731 27.632 10.646
299 H ARG 41 H ARG 41 19.520 26.945 7.070
300 HA ARG 41 HA ARG 41 18.899 24.133 7.765
301 HB2 ARG 41 1HB ARG 41 19.188 25.512 5.075
302 HB3 ARG 41 2HB ARG 41 18.495 23.900 5.362
303 HG2 ARG 41 1HG ARG 41 16.797 24.914 6.805
304 HG3 ARG 41 2HG ARG 41 17.447 26.510 6.485
305 HD2 ARG 41 1HD ARG 41 16.985 26.143 4.050
306 HD3 ARG 41 2HD ARG 41 16.063 24.691 4.535
307 HE ARG 41 HE ARG 41 15.249 26.819 6.218
308 HH11 ARG 41 1HH1 ARG 41 14.991 26.067 2.759
309 HH12 ARG 41 2HH1 ARG 41 13.543 27.019 2.581
310 HH21 ARG 41 1HH2 ARG 41 13.463 27.979 5.920
311 HH22 ARG 41 2HH2 ARG 41 12.681 28.096 4.358
312 H ASN 42 H ASN 42 21.686 25.852 6.525
313 HA ASN 42 HA ASN 42 23.137 23.235 6.432
314 HB2 ASN 42 1HB ASN 42 22.433 24.174 4.137
315 HB3 ASN 42 2HB ASN 42 23.646 25.402 4.380
316 HD21 ASN 42 1HD2 ASN 42 25.233 22.674 2.510
317 HD22 ASN 42 2HD2 ASN 42 24.061 23.945 2.263
318 HA PRO 43 HA PRO 43 25.324 26.570 8.792
319 HB2 PRO 43 1HB PRO 43 26.403 24.859 10.732
320 HB3 PRO 43 2HB PRO 43 24.917 25.848 10.886
321 HG2 PRO 43 1HG PRO 43 25.199 22.959 10.130
322 HG3 PRO 43 2HG PRO 43 24.028 23.738 11.236
323 HD2 PRO 43 1HD PRO 43 23.338 23.056 8.739
324 HD3 PRO 43 2HD PRO 43 22.752 24.592 9.472
325 HA PRO 44 HA PRO 44 29.420 24.494 8.063
326 HB2 PRO 44 1HB PRO 44 29.735 22.490 6.233
327 HB3 PRO 44 2HB PRO 44 29.452 22.182 7.974
328 HG2 PRO 44 1HG PRO 44 27.465 22.240 5.736
329 HG3 PRO 44 2HG PRO 44 27.754 20.962 6.960
330 HD2 PRO 44 1HD PRO 44 25.793 22.757 7.302
331 HD3 PRO 44 2HD PRO 44 26.811 22.249 8.692
332 H LEU 45 H LEU 45 27.091 24.545 5.284
333 HA LEU 45 HA LEU 45 29.125 25.715 3.530
334 HB2 LEU 45 1HB LEU 45 27.210 24.461 2.616
335 HB3 LEU 45 2HB LEU 45 26.106 25.661 3.285
336 HG LEU 45 HG LEU 45 26.905 27.358 1.750
337 HD11 LEU 45 1HD1 LEU 45 28.518 26.868 -0.050
338 HD12 LEU 45 2HD1 LEU 45 28.822 25.263 0.646
339 HD13 LEU 45 3HD1 LEU 45 29.286 26.729 1.534
340 HD21 LEU 45 1HD2 LEU 45 26.407 24.741 0.277
341 HD22 LEU 45 2HD2 LEU 45 26.108 26.382 -0.339
342 HD23 LEU 45 3HD2 LEU 45 25.148 25.760 1.015
343 H ALA 46 H ALA 46 26.636 26.788 5.757
344 HA ALA 46 HA ALA 46 26.707 29.537 5.019
345 HB1 ALA 46 1HB ALA 46 25.597 29.949 7.085
346 HB2 ALA 46 2HB ALA 46 24.988 28.410 6.438
347 HB3 ALA 46 3HB ALA 46 26.164 28.408 7.769
348 H GLU 47 H GLU 47 28.551 27.775 7.607
349 HA GLU 47 HA GLU 47 29.754 30.136 8.622
350 HB2 GLU 47 1HB GLU 47 31.289 28.742 9.789
351 HB3 GLU 47 2HB GLU 47 29.706 27.957 9.792
352 HG2 GLU 47 1HG GLU 47 30.468 26.490 7.958
353 HG3 GLU 47 2HG GLU 47 32.066 27.244 8.032
354 H ALA 48 H ALA 48 30.677 28.104 5.873
355 HA ALA 48 HA ALA 48 33.194 29.242 5.392
356 HB1 ALA 48 1HB ALA 48 32.810 28.428 3.124
357 HB2 ALA 48 2HB ALA 48 32.326 27.216 4.321
358 HB3 ALA 48 3HB ALA 48 31.097 28.189 3.476
359 H LEU 49 H LEU 49 29.923 30.225 4.364
360 HA LEU 49 HA LEU 49 30.766 32.460 2.774
361 HB2 LEU 49 1HB LEU 49 28.502 31.351 2.723
362 HB3 LEU 49 2HB LEU 49 28.179 32.034 4.310
363 HG LEU 49 HG LEU 49 28.683 34.331 3.133
364 HD11 LEU 49 1HD1 LEU 49 27.859 32.547 0.822
365 HD12 LEU 49 2HD1 LEU 49 29.427 33.356 1.020
366 HD13 LEU 49 3HD1 LEU 49 27.959 34.319 0.782
367 HD21 LEU 49 1HD2 LEU 49 26.122 32.775 2.681
368 HD22 LEU 49 2HD2 LEU 49 26.304 34.547 2.661
369 HD23 LEU 49 3HD2 LEU 49 26.566 33.648 4.166
370 H LEU 50 H LEU 50 29.865 32.064 6.212
371 HA LEU 50 HA LEU 50 29.735 34.857 6.814
372 HB2 LEU 50 1HB LEU 50 30.580 32.680 8.745
373 HB3 LEU 50 2HB LEU 50 29.872 34.233 9.136
374 HG LEU 50 HG LEU 50 28.553 31.767 8.096
375 HD11 LEU 50 1HD1 LEU 50 27.985 33.527 10.452
376 HD12 LEU 50 2HD1 LEU 50 28.849 31.967 10.457
377 HD13 LEU 50 3HD1 LEU 50 27.136 32.017 10.015
378 HD21 LEU 50 1HD2 LEU 50 27.586 33.397 6.667
379 HD22 LEU 50 2HD2 LEU 50 27.329 34.519 8.033
380 HD23 LEU 50 3HD2 LEU 50 26.412 32.990 7.923
381 H SER 51 H SER 51 32.402 32.589 6.617
382 HA SER 51 HA SER 51 34.325 34.253 7.975
383 HB2 SER 51 1HB SER 51 34.620 32.000 6.000
384 HB3 SER 51 2HB SER 51 35.905 32.648 7.019
385 HG SER 51 HG SER 51 33.502 31.393 7.906
386 H GLY 52 H GLY 52 33.090 33.996 4.680
387 HA2 GLY 52 1HA GLY 52 33.253 35.752 3.128
388 HA3 GLY 52 2HA GLY 52 34.661 36.391 3.981
389 H ASP 53 H ASP 53 35.797 33.542 3.972
390 HA ASP 53 HA ASP 53 37.426 33.859 1.647
391 HB2 ASP 53 1HB ASP 53 38.009 32.566 3.785
392 HB3 ASP 53 2HB ASP 53 36.979 31.332 3.184
393 H LEU 54 H LEU 54 36.936 33.433 -0.416
394 HA LEU 54 HA LEU 54 34.582 31.967 -1.196
395 HB2 LEU 54 1HB LEU 54 35.650 33.616 -2.694
396 HB3 LEU 54 2HB LEU 54 37.122 32.634 -2.718
397 HG LEU 54 HG LEU 54 35.668 30.740 -3.684
398 HD11 LEU 54 1HD1 LEU 54 33.687 31.366 -4.893
399 HD12 LEU 54 2HD1 LEU 54 33.822 33.042 -4.303
400 HD13 LEU 54 3HD1 LEU 54 33.475 31.714 -3.170
401 HD21 LEU 54 1HD2 LEU 54 37.343 31.864 -4.842
402 HD22 LEU 54 2HD2 LEU 54 36.236 33.210 -5.243
403 HD23 LEU 54 3HD2 LEU 54 35.943 31.570 -5.899
404 H GLU 55 H GLU 55 38.046 31.117 -0.776
405 HA GLU 55 HA GLU 55 37.826 28.701 -2.285
406 HB2 GLU 55 1HB GLU 55 39.830 29.271 -0.083
407 HB3 GLU 55 2HB GLU 55 40.014 28.208 -1.493
408 HG2 GLU 55 1HG GLU 55 39.439 30.465 -2.784
409 HG3 GLU 55 2HG GLU 55 40.062 31.213 -1.319
410 H LYS 56 H LYS 56 37.175 29.502 1.032
411 HA LYS 56 HA LYS 56 36.912 26.655 1.772
412 HB2 LYS 56 1HB LYS 56 36.287 27.220 3.956
413 HB3 LYS 56 2HB LYS 56 37.556 28.412 3.496
414 HG2 LYS 56 1HG LYS 56 35.622 29.934 3.070
415 HG3 LYS 56 2HG LYS 56 34.673 28.747 3.931
416 HD2 LYS 56 1HD LYS 56 37.270 29.762 5.082
417 HD3 LYS 56 2HD LYS 56 35.772 30.646 5.292
418 HE2 LYS 56 1HE LYS 56 34.726 28.689 6.382
419 HE3 LYS 56 2HE LYS 56 36.227 27.772 6.164
420 HZ1 LYS 56 1HZ LYS 56 36.104 28.653 8.376
421 HZ2 LYS 56 2HZ LYS 56 35.871 30.193 7.832
422 HZ3 LYS 56 3HZ LYS 56 37.319 29.439 7.582
423 H PHE 57 H PHE 57 34.826 29.324 0.785
424 HA PHE 57 HA PHE 57 32.343 27.966 1.210
425 HB2 PHE 57 1HB PHE 57 32.550 30.401 0.847
426 HB3 PHE 57 2HB PHE 57 33.081 30.106 -0.814
427 HD1 PHE 57 HD1 PHE 57 31.524 29.664 -2.576
428 HD2 PHE 57 HD2 PHE 57 30.197 29.801 1.519
429 HE1 PHE 57 HE1 PHE 57 29.157 29.639 -3.341
430 HE2 PHE 57 HE2 PHE 57 27.827 29.797 0.754
431 HZ PHE 57 HZ PHE 57 27.311 29.712 -1.687
432 H SER 58 H SER 58 34.463 28.187 -1.661
433 HA SER 58 HA SER 58 32.846 26.545 -3.343
434 HB2 SER 58 1HB SER 58 34.701 28.057 -4.080
435 HB3 SER 58 2HB SER 58 35.868 26.925 -3.368
436 HG SER 58 HG SER 58 35.063 25.327 -4.810
437 H ARG 59 H ARG 59 35.442 25.779 -1.015
438 HA ARG 59 HA ARG 59 35.765 23.043 -1.833
439 HB2 ARG 59 1HB ARG 59 37.424 24.201 -0.432
440 HB3 ARG 59 2HB ARG 59 36.232 24.394 0.852
441 HG2 ARG 59 1HG ARG 59 36.267 21.631 0.398
442 HG3 ARG 59 2HG ARG 59 37.963 22.112 0.250
443 HD2 ARG 59 1HD ARG 59 38.037 22.956 2.439
444 HD3 ARG 59 2HD ARG 59 36.270 23.136 2.527
445 HE ARG 59 HE ARG 59 36.699 20.401 2.207
446 HH11 ARG 59 1HH1 ARG 59 37.558 22.802 4.661
447 HH12 ARG 59 2HH1 ARG 59 37.492 21.624 5.944
448 HH21 ARG 59 1HH2 ARG 59 36.622 19.008 3.835
449 HH22 ARG 59 2HH2 ARG 59 36.997 19.486 5.481
450 H VAL 60 H VAL 60 33.809 24.542 0.801
451 HA VAL 60 HA VAL 60 32.747 21.962 1.531
452 HB VAL 60 HB VAL 60 32.906 23.891 3.115
453 HG11 VAL 60 1HG1 VAL 60 31.175 25.568 3.132
454 HG12 VAL 60 2HG1 VAL 60 32.241 25.686 1.731
455 HG13 VAL 60 3HG1 VAL 60 30.643 24.980 1.553
456 HG21 VAL 60 1HG2 VAL 60 30.849 23.434 4.298
457 HG22 VAL 60 2HG2 VAL 60 30.092 22.817 2.810
458 HG23 VAL 60 3HG2 VAL 60 31.449 21.936 3.555
459 H LEU 61 H LEU 61 31.839 24.454 -0.816
460 HA LEU 61 HA LEU 61 29.176 23.598 -1.287
461 HB2 LEU 61 1HB LEU 61 30.404 25.660 -2.177
462 HB3 LEU 61 2HB LEU 61 31.096 24.615 -3.402
463 HG LEU 61 HG LEU 61 28.406 24.092 -3.683
464 HD11 LEU 61 1HD1 LEU 61 28.760 27.038 -3.016
465 HD12 LEU 61 2HD1 LEU 61 27.884 25.843 -2.020
466 HD13 LEU 61 3HD1 LEU 61 27.277 26.265 -3.635
467 HD21 LEU 61 1HD2 LEU 61 29.608 26.478 -5.085
468 HD22 LEU 61 2HD2 LEU 61 28.514 25.248 -5.715
469 HD23 LEU 61 3HD2 LEU 61 30.214 24.837 -5.418
470 H VAL 62 H VAL 62 32.264 22.542 -2.861
471 HA VAL 62 HA VAL 62 30.814 20.661 -4.518
472 HB VAL 62 HB VAL 62 32.989 21.669 -5.207
473 HG11 VAL 62 1HG1 VAL 62 35.112 20.702 -4.406
474 HG12 VAL 62 2HG1 VAL 62 34.254 21.568 -3.128
475 HG13 VAL 62 3HG1 VAL 62 34.234 19.789 -3.162
476 HG21 VAL 62 1HG2 VAL 62 32.967 18.641 -5.104
477 HG22 VAL 62 2HG2 VAL 62 32.108 19.651 -6.289
478 HG23 VAL 62 3HG2 VAL 62 33.886 19.641 -6.253
479 H GLU 63 H GLU 63 32.470 20.429 -1.380
480 HA GLU 63 HA GLU 63 32.324 17.578 -1.147
481 HB2 GLU 63 1HB GLU 63 32.294 19.813 0.894
482 HB3 GLU 63 2HB GLU 63 32.245 18.106 1.359
483 HG2 GLU 63 1HG GLU 63 34.380 17.712 0.206
484 HG3 GLU 63 2HG GLU 63 34.448 19.417 -0.266
485 H GLN 64 H GLN 64 29.979 20.154 -0.275
486 HA GLN 64 HA GLN 64 28.001 18.429 0.858
487 HB2 GLN 64 1HB GLN 64 27.863 21.089 -0.600
488 HB3 GLN 64 2HB GLN 64 26.408 20.289 -0.010
489 HG2 GLN 64 1HG GLN 64 28.716 20.870 1.852
490 HG3 GLN 64 2HG GLN 64 27.517 22.110 1.455
491 HE21 GLN 64 1HE2 GLN 64 26.711 19.639 4.392
492 HE22 GLN 64 2HE2 GLN 64 28.300 20.015 3.770
493 H GLN 65 H GLN 65 28.632 19.438 -2.527
494 HA GLN 65 HA GLN 65 26.285 18.113 -3.554
495 HB2 GLN 65 1HB GLN 65 28.871 18.975 -4.887
496 HB3 GLN 65 2HB GLN 65 27.492 18.281 -5.754
497 HG2 GLN 65 1HG GLN 65 26.055 20.120 -4.913
498 HG3 GLN 65 2HG GLN 65 27.459 20.844 -4.134
499 HE21 GLN 65 1HE2 GLN 65 28.602 22.426 -7.025
500 HE22 GLN 65 2HE2 GLN 65 28.795 22.135 -5.307
501 H GLN 66 H GLN 66 29.666 17.028 -3.029
502 HA GLN 66 HA GLN 66 29.267 14.508 -4.373
503 HB2 GLN 66 1HB GLN 66 31.262 15.423 -2.284
504 HB3 GLN 66 2HB GLN 66 31.277 13.807 -3.001
505 HG2 GLN 66 1HG GLN 66 31.513 14.815 -5.252
506 HG3 GLN 66 2HG GLN 66 31.584 16.415 -4.515
507 HE21 GLN 66 1HE2 GLN 66 34.966 16.227 -3.783
508 HE22 GLN 66 2HE2 GLN 66 33.507 17.183 -3.903
509 H ASP 67 H ASP 67 28.827 15.501 -0.927
510 HA ASP 67 HA ASP 67 28.291 12.803 -0.030
511 HB2 ASP 67 1HB ASP 67 28.742 14.785 1.469
512 HB3 ASP 67 2HB ASP 67 27.126 15.358 1.075
513 H ARG 68 H ARG 68 26.280 15.420 -1.360
514 HA ARG 68 HA ARG 68 23.767 14.040 -1.030
515 HB2 ARG 68 1HB ARG 68 24.690 16.059 -3.105
516 HB3 ARG 68 2HB ARG 68 23.054 15.400 -3.063
517 HG2 ARG 68 1HG ARG 68 22.667 16.360 -0.872
518 HG3 ARG 68 2HG ARG 68 24.339 16.936 -0.794
519 HD2 ARG 68 1HD ARG 68 23.915 18.246 -2.895
520 HD3 ARG 68 2HD ARG 68 22.205 17.783 -2.773
521 HE ARG 68 HE ARG 68 23.152 18.976 -0.325
522 HH11 ARG 68 1HH1 ARG 68 22.122 19.852 -3.589
523 HH12 ARG 68 2HH1 ARG 68 21.636 21.456 -3.108
524 HH21 ARG 68 1HH2 ARG 68 22.519 21.037 0.215
525 HH22 ARG 68 2HH2 ARG 68 21.856 22.110 -0.989
526 H ALA 69 H ALA 69 26.135 14.150 -3.757
527 HA ALA 69 HA ALA 69 24.722 12.371 -5.414
528 HB1 ALA 69 1HB ALA 69 26.869 11.977 -6.533
529 HB2 ALA 69 2HB ALA 69 26.704 13.698 -6.117
530 HB3 ALA 69 3HB ALA 69 27.748 12.640 -5.136
531 H ARG 70 H ARG 70 26.962 11.597 -2.691
532 HA ARG 70 HA ARG 70 27.046 8.818 -3.328
533 HB2 ARG 70 1HB ARG 70 28.524 8.723 -1.659
534 HB3 ARG 70 2HB ARG 70 28.427 10.487 -1.673
535 HG2 ARG 70 1HG ARG 70 26.963 10.495 0.204
536 HG3 ARG 70 2HG ARG 70 26.737 8.761 0.102
537 HD2 ARG 70 1HD ARG 70 29.172 8.465 0.570
538 HD3 ARG 70 2HD ARG 70 29.275 10.219 0.824
539 HE ARG 70 HE ARG 70 28.124 10.021 2.833
540 HH11 ARG 70 1HH1 ARG 70 27.988 6.897 1.159
541 HH12 ARG 70 2HH1 ARG 70 27.342 6.073 2.549
542 HH21 ARG 70 1HH2 ARG 70 27.315 8.879 4.563
543 HH22 ARG 70 2HH2 ARG 70 26.973 7.175 4.437
544 H ARG 71 H ARG 71 24.853 10.708 -1.196
545 HA ARG 71 HA ARG 71 23.510 8.235 -0.345
546 HB2 ARG 71 1HB ARG 71 22.201 9.569 1.046
547 HB3 ARG 71 2HB ARG 71 23.782 10.358 1.025
548 HG2 ARG 71 1HG ARG 71 22.855 11.881 -0.736
549 HG3 ARG 71 2HG ARG 71 21.270 11.189 -0.407
550 HD2 ARG 71 1HD ARG 71 21.521 11.919 1.946
551 HD3 ARG 71 2HD ARG 71 23.052 12.717 1.482
552 HE ARG 71 HE ARG 71 20.972 13.429 -0.364
553 HH11 ARG 71 1HH1 ARG 71 22.033 14.178 2.933
554 HH12 ARG 71 2HH1 ARG 71 21.268 15.744 2.919
555 HH21 ARG 71 1HH2 ARG 71 20.050 15.392 -0.321
556 HH22 ARG 71 2HH2 ARG 71 20.141 16.426 1.089
557 H GLU 72 H GLU 72 23.002 10.696 -2.821
558 HA GLU 72 HA GLU 72 20.260 10.006 -3.390
559 HB2 GLU 72 1HB GLU 72 22.392 11.160 -5.225
560 HB3 GLU 72 2HB GLU 72 20.707 10.943 -5.667
561 HG2 GLU 72 1HG GLU 72 21.959 13.094 -4.049
562 HG3 GLU 72 2HG GLU 72 20.616 13.142 -5.153
563 H GLN 73 H GLN 73 23.392 8.650 -4.357
564 HA GLN 73 HA GLN 73 22.526 6.891 -6.414
565 HB2 GLN 73 1HB GLN 73 24.671 6.684 -4.302
566 HB3 GLN 73 2HB GLN 73 24.377 5.359 -5.425
567 HG2 GLN 73 1HG GLN 73 24.929 6.709 -7.310
568 HG3 GLN 73 2HG GLN 73 24.982 8.174 -6.328
569 HE21 GLN 73 1HE2 GLN 73 28.364 7.829 -5.690
570 HE22 GLN 73 2HE2 GLN 73 26.957 8.851 -5.901
571 H GLU 74 H GLU 74 22.245 6.566 -2.873
572 HA GLU 74 HA GLU 74 21.275 3.822 -3.041
573 HB2 GLU 74 1HB GLU 74 20.960 5.871 -0.806
574 HB3 GLU 74 2HB GLU 74 20.781 4.124 -0.649
575 HG2 GLU 74 1HG GLU 74 23.177 3.816 -1.100
576 HG3 GLU 74 2HG GLU 74 23.372 5.553 -1.377
577 H ARG 75 H ARG 75 19.890 7.063 -2.932
578 HA ARG 75 HA ARG 75 17.180 6.173 -2.502
579 HB2 ARG 75 1HB ARG 75 18.386 8.747 -3.522
580 HB3 ARG 75 2HB ARG 75 16.647 8.519 -3.315
581 HG2 ARG 75 1HG ARG 75 16.860 8.230 -0.964
582 HG3 ARG 75 2HG ARG 75 18.635 8.123 -1.059
583 HD2 ARG 75 1HD ARG 75 18.837 10.376 -1.720
584 HD3 ARG 75 2HD ARG 75 17.101 10.514 -2.048
585 HE ARG 75 HE ARG 75 17.480 9.881 0.696
586 HH11 ARG 75 1HH1 ARG 75 17.986 12.562 -1.548
587 HH12 ARG 75 2HH1 ARG 75 17.694 13.765 -0.313
588 HH21 ARG 75 1HH2 ARG 75 17.174 11.469 2.229
589 HH22 ARG 75 2HH2 ARG 75 17.266 13.153 1.796
590 H ILE 76 H ILE 76 19.000 6.958 -5.515
591 HA ILE 76 HA ILE 76 16.662 6.854 -7.171
592 HB ILE 76 HB ILE 76 18.188 6.542 -9.090
593 HG12 ILE 76 1HG1 ILE 76 20.412 6.396 -7.027
594 HG13 ILE 76 2HG1 ILE 76 19.793 5.008 -7.915
595 HG21 ILE 76 1HG2 ILE 76 17.774 8.785 -8.098
596 HG22 ILE 76 2HG2 ILE 76 19.227 8.605 -7.102
597 HG23 ILE 76 3HG2 ILE 76 19.358 8.677 -8.872
598 HD11 ILE 76 1HD1 ILE 76 21.836 5.729 -8.962
599 HD12 ILE 76 2HD1 ILE 76 20.493 6.134 -10.056
600 HD13 ILE 76 3HD1 ILE 76 21.261 7.405 -9.071
601 H ARG 77 H ARG 77 18.429 4.321 -5.609
602 HA ARG 77 HA ARG 77 17.630 2.205 -7.436
603 HB2 ARG 77 1HB ARG 77 18.430 2.202 -4.515
604 HB3 ARG 77 2HB ARG 77 18.096 0.738 -5.438
605 HG2 ARG 77 1HG ARG 77 19.889 1.218 -6.972
606 HG3 ARG 77 2HG ARG 77 20.215 2.768 -6.183
607 HD2 ARG 77 1HD ARG 77 20.971 1.720 -4.195
608 HD3 ARG 77 2HD ARG 77 20.305 0.149 -4.676
609 HE ARG 77 HE ARG 77 22.817 1.375 -5.581
610 HH11 ARG 77 1HH1 ARG 77 20.466 -1.202 -6.151
611 HH12 ARG 77 2HH1 ARG 77 21.596 -2.159 -7.072
612 HH21 ARG 77 1HH2 ARG 77 24.199 0.100 -6.770
613 HH22 ARG 77 2HH2 ARG 77 23.671 -1.432 -7.413
614 H LEU 78 H LEU 78 15.776 4.146 -5.374
615 HA LEU 78 HA LEU 78 13.603 2.092 -5.326
616 HB2 LEU 78 1HB LEU 78 14.939 2.463 -3.156
617 HB3 LEU 78 2HB LEU 78 14.153 4.023 -3.060
618 HG LEU 78 HG LEU 78 12.682 1.364 -3.090
619 HD11 LEU 78 1HD1 LEU 78 14.205 1.545 -1.166
620 HD12 LEU 78 2HD1 LEU 78 12.512 1.657 -0.648
621 HD13 LEU 78 3HD1 LEU 78 13.505 3.129 -0.749
622 HD21 LEU 78 1HD2 LEU 78 10.854 2.724 -1.993
623 HD22 LEU 78 2HD2 LEU 78 11.145 3.117 -3.693
624 HD23 LEU 78 3HD2 LEU 78 11.770 4.187 -2.420
625 H PHE 79 H PHE 79 14.420 5.570 -4.984
626 HA PHE 79 HA PHE 79 11.611 6.274 -5.658
627 HB2 PHE 79 1HB PHE 79 13.909 8.017 -4.689
628 HB3 PHE 79 2HB PHE 79 12.210 8.487 -4.813
629 HD1 PHE 79 HD1 PHE 79 10.518 7.424 -3.251
630 HD2 PHE 79 HD2 PHE 79 14.756 6.862 -2.780
631 HE1 PHE 79 HE1 PHE 79 10.153 6.668 -0.904
632 HE2 PHE 79 HE2 PHE 79 14.406 6.098 -0.438
633 HZ PHE 79 HZ PHE 79 12.099 6.005 0.508
634 H SER 80 H SER 80 11.123 7.724 -7.340
635 HA SER 80 HA SER 80 12.963 7.764 -9.594
636 HB2 SER 80 1HB SER 80 11.151 9.253 -10.565
637 HB3 SER 80 2HB SER 80 10.602 7.640 -10.053
638 HG SER 80 HG SER 80 10.395 10.046 -8.550
639 H ALA 81 H ALA 81 14.763 8.899 -9.202
640 HA ALA 81 HA ALA 81 14.514 11.826 -8.839
641 HB1 ALA 81 1HB ALA 81 14.887 11.017 -6.533
642 HB2 ALA 81 2HB ALA 81 16.256 10.022 -7.077
643 HB3 ALA 81 3HB ALA 81 16.368 11.795 -7.138
644 H ASP 82 H ASP 82 14.853 10.170 -11.055
645 HA ASP 82 HA ASP 82 17.609 9.670 -11.688
646 HB2 ASP 82 1HB ASP 82 16.587 9.475 -14.061
647 HB3 ASP 82 2HB ASP 82 16.065 8.323 -12.824
648 HA PRO 83 HA PRO 83 18.595 13.752 -12.986
649 HB2 PRO 83 1HB PRO 83 20.925 13.393 -14.315
650 HB3 PRO 83 2HB PRO 83 20.806 13.049 -12.558
651 HG2 PRO 83 1HG PRO 83 20.593 11.153 -14.881
652 HG3 PRO 83 2HG PRO 83 21.637 11.035 -13.428
653 HD2 PRO 83 1HD PRO 83 19.233 9.748 -13.613
654 HD3 PRO 83 2HD PRO 83 19.848 10.402 -12.054
655 H PHE 84 H PHE 84 18.780 15.129 -14.854
656 HA PHE 84 HA PHE 84 17.733 13.881 -17.359
657 HB2 PHE 84 1HB PHE 84 17.344 16.732 -16.399
658 HB3 PHE 84 2HB PHE 84 16.557 15.943 -17.773
659 HD1 PHE 84 HD1 PHE 84 15.852 17.155 -14.674
660 HD2 PHE 84 HD2 PHE 84 15.518 13.444 -16.830
661 HE1 PHE 84 HE1 PHE 84 14.016 16.436 -13.149
662 HE2 PHE 84 HE2 PHE 84 13.691 12.717 -15.310
663 HZ PHE 84 HZ PHE 84 12.935 14.208 -13.466
664 H ASP 85 H ASP 85 20.546 14.428 -16.307
665 HA ASP 85 HA ASP 85 21.600 15.717 -18.735
666 HB2 ASP 85 1HB ASP 85 21.417 17.526 -16.980
667 HB3 ASP 85 2HB ASP 85 22.469 16.547 -15.943
668 H LEU 86 H LEU 86 22.766 14.101 -19.463
669 HA LEU 86 HA LEU 86 23.611 11.951 -17.709
670 HB2 LEU 86 1HB LEU 86 24.075 12.491 -20.642
671 HB3 LEU 86 2HB LEU 86 24.492 10.992 -19.815
672 HG LEU 86 HG LEU 86 21.681 12.092 -20.170
673 HD11 LEU 86 1HD1 LEU 86 22.698 11.326 -22.277
674 HD12 LEU 86 2HD1 LEU 86 21.398 10.236 -21.755
675 HD13 LEU 86 3HD1 LEU 86 23.099 9.763 -21.523
676 HD21 LEU 86 1HD2 LEU 86 21.818 10.770 -18.130
677 HD22 LEU 86 2HD2 LEU 86 22.673 9.466 -18.986
678 HD23 LEU 86 3HD2 LEU 86 20.974 9.835 -19.376
679 H GLU 87 H GLU 87 25.234 14.677 -19.323
680 HA GLU 87 HA GLU 87 27.864 13.572 -18.567
681 HB2 GLU 87 1HB GLU 87 28.838 15.463 -19.685
682 HB3 GLU 87 2HB GLU 87 27.676 14.640 -20.724
683 HG2 GLU 87 1HG GLU 87 26.031 16.440 -20.294
684 HG3 GLU 87 2HG GLU 87 27.234 17.279 -19.296
685 H ALA 88 H ALA 88 25.715 16.213 -17.690
686 HA ALA 88 HA ALA 88 25.446 17.417 -15.818
687 HB1 ALA 88 1HB ALA 88 25.987 16.445 -13.663
688 HB2 ALA 88 2HB ALA 88 25.371 15.190 -14.768
689 HB3 ALA 88 3HB ALA 88 27.118 15.301 -14.425
690 H GLN 89 H GLN 89 28.294 17.458 -17.299
691 HA GLN 89 HA GLN 89 30.131 18.793 -17.249
692 HB2 GLN 89 1HB GLN 89 27.759 20.135 -17.146
693 HB3 GLN 89 2HB GLN 89 28.663 20.936 -15.894
694 HG2 GLN 89 1HG GLN 89 29.753 20.451 -18.673
695 HG3 GLN 89 2HG GLN 89 28.779 21.875 -18.279
696 HE21 GLN 89 1HE2 GLN 89 31.301 23.410 -16.236
697 HE22 GLN 89 2HE2 GLN 89 29.575 23.197 -16.379
698 H ALA 90 H ALA 90 30.402 20.991 -15.234
699 HA ALA 90 HA ALA 90 31.762 21.447 -13.499
700 HB1 ALA 90 1HB ALA 90 30.285 19.189 -12.194
701 HB2 ALA 90 2HB ALA 90 31.237 20.461 -11.393
702 HB3 ALA 90 3HB ALA 90 29.768 20.893 -12.297
703 H LYS 91 H LYS 91 33.687 21.149 -14.152
704 HA LYS 91 HA LYS 91 35.062 18.541 -13.803
705 HB2 LYS 91 1HB LYS 91 36.942 19.652 -14.977
706 HB3 LYS 91 2HB LYS 91 35.449 19.625 -15.921
707 HG2 LYS 91 1HG LYS 91 35.170 21.906 -15.840
708 HG3 LYS 91 2HG LYS 91 35.960 22.063 -14.262
709 HD2 LYS 91 1HD LYS 91 37.367 23.071 -15.932
710 HD3 LYS 91 2HD LYS 91 38.142 21.604 -15.310
711 HE2 LYS 91 1HE LYS 91 37.385 20.348 -17.305
712 HE3 LYS 91 2HE LYS 91 36.617 21.824 -17.939
713 HZ1 LYS 91 1HZ LYS 91 38.744 22.854 -18.081
714 HZ2 LYS 91 2HZ LYS 91 38.917 21.367 -18.776
715 HZ3 LYS 91 3HZ LYS 91 39.499 21.650 -17.249
716 H ILE 92 H ILE 92 37.337 18.665 -12.935
717 HA ILE 92 HA ILE 92 37.576 20.582 -10.682
718 HB ILE 92 HB ILE 92 38.327 17.606 -10.679
719 HG12 ILE 92 1HG1 ILE 92 36.253 19.059 -8.982
720 HG13 ILE 92 2HG1 ILE 92 35.862 18.118 -10.422
721 HG21 ILE 92 1HG2 ILE 92 39.043 17.981 -8.329
722 HG22 ILE 92 2HG2 ILE 92 39.955 19.038 -9.416
723 HG23 ILE 92 3HG2 ILE 92 38.615 19.704 -8.456
724 HD11 ILE 92 1HD1 ILE 92 35.418 16.746 -8.491
725 HD12 ILE 92 2HD1 ILE 92 36.847 16.081 -9.313
726 HD13 ILE 92 3HD1 ILE 92 37.038 17.044 -7.826
727 H GLU 93 H GLU 93 39.324 21.720 -10.941
728 HA GLU 93 HA GLU 93 41.508 20.831 -12.778
729 HB2 GLU 93 1HB GLU 93 40.687 23.527 -11.642
730 HB3 GLU 93 2HB GLU 93 42.207 23.275 -12.499
731 HG2 GLU 93 1HG GLU 93 39.466 22.772 -13.697
732 HG3 GLU 93 2HG GLU 93 40.384 24.272 -13.881
733 H GLU 94 H GLU 94 43.750 21.324 -11.965
734 HA GLU 94 HA GLU 94 43.882 21.070 -8.986
735 HB2 GLU 94 1HB GLU 94 45.659 19.809 -11.103
736 HB3 GLU 94 2HB GLU 94 46.010 19.826 -9.370
737 HG2 GLU 94 1HG GLU 94 43.489 18.812 -9.348
738 HG3 GLU 94 2HG GLU 94 44.093 18.171 -10.889
739 H ASP 95 H ASP 95 45.883 21.811 -8.035
740 HA ASP 95 HA ASP 95 47.173 23.585 -7.460
741 HB2 ASP 95 1HB ASP 95 48.560 22.353 -9.216
742 HB3 ASP 95 2HB ASP 95 48.151 23.683 -10.311
743 H ILE 96 H ILE 96 44.571 24.345 -8.123
744 HA ILE 96 HA ILE 96 44.726 26.733 -9.753
745 HB ILE 96 HB ILE 96 42.331 27.041 -8.881
746 HG12 ILE 96 1HG1 ILE 96 42.634 24.046 -8.352
747 HG13 ILE 96 2HG1 ILE 96 42.656 25.257 -7.062
748 HG21 ILE 96 1HG2 ILE 96 42.989 26.400 -11.189
749 HG22 ILE 96 2HG2 ILE 96 43.062 24.692 -10.696
750 HG23 ILE 96 3HG2 ILE 96 41.508 25.562 -10.691
751 HD11 ILE 96 1HD1 ILE 96 40.351 25.975 -7.741
752 HD12 ILE 96 2HD1 ILE 96 40.331 24.652 -8.936
753 HD13 ILE 96 3HD1 ILE 96 40.441 24.282 -7.203
754 H ARG 97 H ARG 97 46.403 27.447 -8.436
755 HA ARG 97 HA ARG 97 47.177 29.212 -7.228
756 HB2 ARG 97 1HB ARG 97 45.027 30.232 -8.249
757 HB3 ARG 97 2HB ARG 97 44.367 30.096 -6.619
758 HG2 ARG 97 1HG ARG 97 46.291 31.511 -5.812
759 HG3 ARG 97 2HG ARG 97 46.734 31.769 -7.510
760 HD2 ARG 97 1HD ARG 97 44.865 33.054 -7.937
761 HD3 ARG 97 2HD ARG 97 43.877 32.210 -6.734
762 HE ARG 97 HE ARG 97 45.626 34.516 -6.284
763 HH11 ARG 97 1HH1 ARG 97 43.796 31.910 -4.719
764 HH12 ARG 97 2HH1 ARG 97 43.714 32.754 -3.211
765 HH21 ARG 97 1HH2 ARG 97 45.488 35.519 -4.303
766 HH22 ARG 97 2HH2 ARG 97 44.665 34.747 -2.975
767 H GLN 98 H GLN 98 46.264 26.655 -6.012
768 HA GLN 98 HA GLN 98 45.442 27.157 -3.307
769 HB2 GLN 98 1HB GLN 98 46.004 24.789 -2.876
770 HB3 GLN 98 2HB GLN 98 45.073 24.976 -4.353
771 HG2 GLN 98 1HG GLN 98 46.761 23.399 -4.918
772 HG3 GLN 98 2HG GLN 98 47.313 24.895 -5.656
773 HE21 GLN 98 1HE2 GLN 98 50.421 24.352 -4.226
774 HE22 GLN 98 2HE2 GLN 98 49.473 24.616 -5.679
775 HXT GLN 98 HO GLN 98 48.279 27.233 -1.474
Start of MODEL 18
1 H1 SER 1 1H SER 1 23.077 0.241 -5.892
2 H2 SER 1 2H SER 1 22.121 -0.191 -7.028
3 H3 SER 1 3H SER 1 21.685 1.019 -6.018
4 HA SER 1 HA SER 1 22.168 1.563 -8.473
5 HB2 SER 1 1HB SER 1 23.401 3.389 -6.402
6 HB3 SER 1 2HB SER 1 22.282 3.785 -7.732
7 HG SER 1 HG SER 1 21.394 3.691 -5.452
8 H GLN 2 H GLN 2 24.648 1.015 -6.171
9 HA GLN 2 HA GLN 2 26.889 2.137 -7.605
10 HB2 GLN 2 1HB GLN 2 26.744 -0.051 -5.488
11 HB3 GLN 2 2HB GLN 2 28.243 0.673 -6.074
12 HG2 GLN 2 1HG GLN 2 27.755 1.745 -4.015
13 HG3 GLN 2 2HG GLN 2 27.384 2.918 -5.284
14 HE21 GLN 2 1HE2 GLN 2 24.302 3.516 -3.818
15 HE22 GLN 2 2HE2 GLN 2 25.801 4.131 -4.496
16 H GLN 3 H GLN 3 25.196 -0.915 -7.743
17 HA GLN 3 HA GLN 3 27.284 -2.131 -9.459
18 HB2 GLN 3 1HB GLN 3 24.655 -3.210 -8.374
19 HB3 GLN 3 2HB GLN 3 25.858 -4.150 -9.266
20 HG2 GLN 3 1HG GLN 3 27.496 -3.787 -7.465
21 HG3 GLN 3 2HG GLN 3 26.311 -2.824 -6.568
22 HE21 GLN 3 1HE2 GLN 3 26.426 -6.675 -5.868
23 HE22 GLN 3 2HE2 GLN 3 27.731 -5.692 -6.488
24 H SER 4 H SER 4 24.966 0.082 -10.035
25 HA SER 4 HA SER 4 24.218 -1.140 -12.653
26 HB2 SER 4 1HB SER 4 22.423 -1.456 -10.904
27 HB3 SER 4 2HB SER 4 22.269 0.312 -10.834
28 HG SER 4 HG SER 4 21.846 0.228 -13.121
29 H HIS 5 H HIS 5 26.141 1.089 -11.811
30 HA HIS 5 HA HIS 5 24.994 3.070 -13.721
31 HB2 HIS 5 1HB HIS 5 24.686 4.003 -11.473
32 HB3 HIS 5 2HB HIS 5 26.397 3.729 -11.113
33 HD1 HIS 5 HD1 HIS 5 24.132 6.006 -13.144
34 HD2 HIS 5 HD2 HIS 5 28.168 5.557 -12.197
35 HE1 HIS 5 HE1 HIS 5 25.318 8.096 -13.950
36 H SER 6 H SER 6 26.297 3.655 -15.280
37 HA SER 6 HA SER 6 29.207 3.777 -14.910
38 HB2 SER 6 1HB SER 6 28.773 1.383 -15.541
39 HB3 SER 6 2HB SER 6 27.970 1.957 -17.015
40 HG SER 6 HG SER 6 29.959 2.962 -17.586
41 H SER 7 H SER 7 27.062 5.642 -15.303
42 HA SER 7 HA SER 7 27.689 6.662 -18.023
43 HB2 SER 7 1HB SER 7 24.853 6.318 -17.000
44 HB3 SER 7 2HB SER 7 25.361 6.905 -18.599
45 HG SER 7 HG SER 7 26.501 4.749 -18.677
46 HA PRO 8 HA PRO 8 27.244 10.206 -15.103
47 HB2 PRO 8 1HB PRO 8 29.596 11.458 -15.611
48 HB3 PRO 8 2HB PRO 8 29.513 10.079 -14.467
49 HG2 PRO 8 1HG PRO 8 30.276 10.088 -17.374
50 HG3 PRO 8 2HG PRO 8 31.170 9.406 -15.977
51 HD2 PRO 8 1HD PRO 8 29.582 7.875 -17.547
52 HD3 PRO 8 2HD PRO 8 29.700 7.606 -15.773
53 H GLY 9 H GLY 9 27.214 12.520 -15.782
54 HA2 GLY 9 1HA GLY 9 27.509 13.271 -18.541
55 HA3 GLY 9 2HA GLY 9 25.832 12.803 -18.245
56 H GLU 10 H GLU 10 28.128 14.535 -16.105
57 HA GLU 10 HA GLU 10 26.011 16.443 -15.529
58 HB2 GLU 10 1HB GLU 10 28.861 16.290 -14.484
59 HB3 GLU 10 2HB GLU 10 27.556 17.256 -13.788
60 HG2 GLU 10 1HG GLU 10 27.731 15.335 -12.410
61 HG3 GLU 10 2HG GLU 10 26.286 15.096 -13.409
62 H ILE 11 H ILE 11 27.365 16.485 -18.156
63 HA ILE 11 HA ILE 11 28.812 18.874 -18.363
64 HB ILE 11 HB ILE 11 27.629 17.829 -20.755
65 HG12 ILE 11 1HG1 ILE 11 28.942 15.679 -19.109
66 HG13 ILE 11 2HG1 ILE 11 27.225 15.753 -19.558
67 HG21 ILE 11 1HG2 ILE 11 29.810 19.012 -20.441
68 HG22 ILE 11 2HG2 ILE 11 30.382 17.533 -19.631
69 HG23 ILE 11 3HG2 ILE 11 29.971 17.508 -21.367
70 HD11 ILE 11 1HD1 ILE 11 28.258 14.172 -21.009
71 HD12 ILE 11 2HD1 ILE 11 27.911 15.620 -21.981
72 HD13 ILE 11 3HD1 ILE 11 29.572 15.290 -21.425
73 H THR 12 H THR 12 25.854 18.625 -17.463
74 HA THR 12 HA THR 12 24.377 20.234 -19.407
75 HB THR 12 HB THR 12 22.641 20.242 -17.598
76 HG1 THR 12 HG1 THR 12 23.916 20.212 -15.771
77 HG21 THR 12 1HG2 THR 12 22.164 17.855 -17.607
78 HG22 THR 12 2HG2 THR 12 23.851 17.472 -17.999
79 HG23 THR 12 3HG2 THR 12 22.825 18.303 -19.194
80 H SER 13 H SER 13 26.537 20.788 -16.860
81 HA SER 13 HA SER 13 27.306 22.590 -15.722
82 HB2 SER 13 1HB SER 13 27.253 24.745 -16.621
83 HB3 SER 13 2HB SER 13 27.137 23.696 -18.044
84 HG SER 13 HG SER 13 24.788 23.986 -17.808
85 H SER 14 H SER 14 26.574 24.562 -14.360
86 HA SER 14 HA SER 14 23.734 24.211 -13.510
87 HB2 SER 14 1HB SER 14 25.111 22.721 -12.120
88 HB3 SER 14 2HB SER 14 26.034 24.127 -11.555
89 HG SER 14 HG SER 14 24.108 23.354 -10.290
90 HA PRO 15 HA PRO 15 24.779 28.715 -13.695
91 HB2 PRO 15 1HB PRO 15 22.319 29.498 -14.577
92 HB3 PRO 15 2HB PRO 15 23.573 28.831 -15.650
93 HG2 PRO 15 1HG PRO 15 21.289 27.385 -14.385
94 HG3 PRO 15 2HG PRO 15 21.742 27.470 -16.118
95 HD2 PRO 15 1HD PRO 15 22.522 25.402 -14.623
96 HD3 PRO 15 2HD PRO 15 23.662 26.144 -15.800
97 H GLN 16 H GLN 16 22.648 26.728 -12.089
98 HA GLN 16 HA GLN 16 21.256 28.531 -10.337
99 HB2 GLN 16 1HB GLN 16 22.140 25.658 -9.877
100 HB3 GLN 16 2HB GLN 16 20.927 26.530 -8.934
101 HG2 GLN 16 1HG GLN 16 20.714 25.799 -11.881
102 HG3 GLN 16 2HG GLN 16 19.878 25.004 -10.542
103 HE21 GLN 16 1HE2 GLN 16 18.071 27.999 -12.338
104 HE22 GLN 16 2HE2 GLN 16 19.311 26.974 -13.016
105 H GLY 17 H GLY 17 24.567 28.066 -10.622
106 HA2 GLY 17 1HA GLY 17 26.001 29.418 -9.296
107 HA3 GLY 17 2HA GLY 17 24.921 29.227 -7.917
108 H LEU 18 H LEU 18 25.185 26.171 -9.144
109 HA LEU 18 HA LEU 18 27.106 25.440 -7.072
110 HB2 LEU 18 1HB LEU 18 25.944 23.698 -9.254
111 HB3 LEU 18 2HB LEU 18 26.761 23.153 -7.803
112 HG LEU 18 HG LEU 18 24.088 24.579 -7.916
113 HD11 LEU 18 1HD1 LEU 18 24.793 21.680 -7.293
114 HD12 LEU 18 2HD1 LEU 18 24.020 22.267 -8.777
115 HD13 LEU 18 3HD1 LEU 18 23.164 22.396 -7.229
116 HD21 LEU 18 1HD2 LEU 18 25.622 23.408 -5.547
117 HD22 LEU 18 2HD2 LEU 18 23.924 23.941 -5.492
118 HD23 LEU 18 3HD2 LEU 18 25.209 25.120 -5.808
119 H ASP 19 H ASP 19 27.038 25.920 -10.526
120 HA ASP 19 HA ASP 19 29.708 24.857 -11.065
121 HB2 ASP 19 1HB ASP 19 27.460 25.488 -12.504
122 HB3 ASP 19 2HB ASP 19 28.474 26.891 -12.851
123 H ASN 20 H ASN 20 28.206 27.790 -9.989
124 HA ASN 20 HA ASN 20 30.795 29.240 -10.160
125 HB2 ASN 20 1HB ASN 20 27.926 30.209 -10.526
126 HB3 ASN 20 2HB ASN 20 29.306 31.272 -10.324
127 HD21 ASN 20 1HD2 ASN 20 30.667 30.632 -13.537
128 HD22 ASN 20 2HD2 ASN 20 31.164 30.847 -11.883
129 HA PRO 21 HA PRO 21 29.485 29.058 -5.714
130 HB2 PRO 21 1HB PRO 21 32.124 28.933 -4.836
131 HB3 PRO 21 2HB PRO 21 31.121 27.497 -5.153
132 HG2 PRO 21 1HG PRO 21 33.086 28.844 -6.915
133 HG3 PRO 21 2HG PRO 21 32.900 27.113 -6.585
134 HD2 PRO 21 1HD PRO 21 31.988 28.118 -8.809
135 HD3 PRO 21 2HD PRO 21 31.010 26.921 -7.887
136 H ALA 22 H ALA 22 31.973 30.813 -7.573
137 HA ALA 22 HA ALA 22 32.417 32.893 -5.694
138 HB1 ALA 22 1HB ALA 22 32.534 32.970 -8.744
139 HB2 ALA 22 2HB ALA 22 33.232 34.184 -7.646
140 HB3 ALA 22 3HB ALA 22 33.869 32.524 -7.651
141 H LEU 23 H LEU 23 30.025 32.592 -8.341
142 HA LEU 23 HA LEU 23 28.930 35.230 -7.864
143 HB2 LEU 23 1HB LEU 23 27.650 32.866 -9.278
144 HB3 LEU 23 2HB LEU 23 27.144 34.545 -9.383
145 HG LEU 23 HG LEU 23 29.702 33.356 -10.502
146 HD11 LEU 23 1HD1 LEU 23 28.665 33.803 -12.673
147 HD12 LEU 23 2HD1 LEU 23 27.240 34.509 -11.876
148 HD13 LEU 23 3HD1 LEU 23 27.595 32.778 -11.698
149 HD21 LEU 23 1HD2 LEU 23 28.694 36.206 -10.692
150 HD22 LEU 23 2HD2 LEU 23 30.061 35.511 -11.601
151 HD23 LEU 23 3HD2 LEU 23 30.152 35.651 -9.834
152 H LEU 24 H LEU 24 28.092 31.903 -6.875
153 HA LEU 24 HA LEU 24 25.593 32.635 -5.679
154 HB2 LEU 24 1HB LEU 24 26.239 30.339 -6.312
155 HB3 LEU 24 2HB LEU 24 27.456 30.320 -5.052
156 HG LEU 24 HG LEU 24 25.844 30.225 -3.331
157 HD11 LEU 24 1HD1 LEU 24 24.199 31.859 -3.973
158 HD12 LEU 24 2HD1 LEU 24 23.371 30.306 -3.762
159 HD13 LEU 24 3HD1 LEU 24 23.728 30.898 -5.402
160 HD21 LEU 24 1HD2 LEU 24 26.208 28.153 -4.687
161 HD22 LEU 24 2HD2 LEU 24 24.720 28.537 -5.583
162 HD23 LEU 24 3HD2 LEU 24 24.648 28.201 -3.837
163 H ARG 25 H ARG 25 28.928 32.410 -4.409
164 HA ARG 25 HA ARG 25 28.329 32.942 -1.653
165 HB2 ARG 25 1HB ARG 25 30.576 32.263 -2.588
166 HB3 ARG 25 2HB ARG 25 30.706 33.839 -3.347
167 HG2 ARG 25 1HG ARG 25 30.328 34.620 -0.789
168 HG3 ARG 25 2HG ARG 25 31.084 33.044 -0.509
169 HD2 ARG 25 1HD ARG 25 32.839 34.648 -0.600
170 HD3 ARG 25 2HD ARG 25 32.896 33.755 -2.133
171 HE ARG 25 HE ARG 25 31.380 35.830 -2.883
172 HH11 ARG 25 1HH1 ARG 25 34.316 35.923 -0.901
173 HH12 ARG 25 2HH1 ARG 25 34.728 37.522 -1.461
174 HH21 ARG 25 1HH2 ARG 25 31.950 37.903 -3.498
175 HH22 ARG 25 2HH2 ARG 25 33.427 38.605 -2.888
176 H ASP 26 H ASP 26 28.942 35.046 -4.463
177 HA ASP 26 HA ASP 26 28.862 37.483 -3.015
178 HB2 ASP 26 1HB ASP 26 29.444 36.671 -5.544
179 HB3 ASP 26 2HB ASP 26 27.909 37.473 -5.815
180 H MET 27 H MET 27 26.275 35.742 -4.811
181 HA MET 27 HA MET 27 24.179 37.639 -4.311
182 HB2 MET 27 1HB MET 27 24.113 35.688 -5.913
183 HB3 MET 27 2HB MET 27 23.948 34.621 -4.512
184 HG2 MET 27 1HG MET 27 21.860 35.848 -3.883
185 HG3 MET 27 2HG MET 27 22.019 36.791 -5.370
186 HE1 MET 27 1HE MET 27 20.811 32.340 -4.989
187 HE2 MET 27 2HE MET 27 22.236 33.008 -4.165
188 HE3 MET 27 3HE MET 27 20.610 33.584 -3.732
189 H LEU 28 H LEU 28 25.283 34.778 -2.466
190 HA LEU 28 HA LEU 28 23.246 34.907 -0.498
191 HB2 LEU 28 1HB LEU 28 25.922 33.679 -0.726
192 HB3 LEU 28 2HB LEU 28 25.128 33.729 0.857
193 HG LEU 28 HG LEU 28 23.642 32.736 -1.571
194 HD11 LEU 28 1HD1 LEU 28 24.360 30.498 -0.940
195 HD12 LEU 28 2HD1 LEU 28 25.477 31.212 0.249
196 HD13 LEU 28 3HD1 LEU 28 25.692 31.533 -1.480
197 HD21 LEU 28 1HD2 LEU 28 22.432 33.252 0.537
198 HD22 LEU 28 2HD2 LEU 28 23.451 32.097 1.397
199 HD23 LEU 28 3HD2 LEU 28 22.353 31.534 0.117
200 H LEU 29 H LEU 29 26.522 36.309 -0.634
201 HA LEU 29 HA LEU 29 26.518 37.374 2.035
202 HB2 LEU 29 1HB LEU 29 27.938 38.126 -0.524
203 HB3 LEU 29 2HB LEU 29 28.135 39.099 0.927
204 HG LEU 29 HG LEU 29 28.764 36.144 0.865
205 HD11 LEU 29 1HD1 LEU 29 30.615 38.495 0.350
206 HD12 LEU 29 2HD1 LEU 29 30.112 37.262 -0.834
207 HD13 LEU 29 3HD1 LEU 29 31.118 36.800 0.556
208 HD21 LEU 29 1HD2 LEU 29 28.458 37.116 3.105
209 HD22 LEU 29 2HD2 LEU 29 29.636 38.392 2.721
210 HD23 LEU 29 3HD2 LEU 29 30.155 36.692 2.825
211 H ALA 30 H ALA 30 25.340 38.602 -1.049
212 HA ALA 30 HA ALA 30 24.676 41.219 0.033
213 HB1 ALA 30 1HB ALA 30 23.842 39.861 -2.568
214 HB2 ALA 30 2HB ALA 30 23.674 41.593 -2.186
215 HB3 ALA 30 3HB ALA 30 25.293 40.868 -2.342
216 H ASN 31 H ASN 31 23.108 38.130 0.148
217 HA ASN 31 HA ASN 31 20.444 39.466 0.363
218 HB2 ASN 31 1HB ASN 31 20.867 37.699 -1.385
219 HB3 ASN 31 2HB ASN 31 20.976 36.518 -0.075
220 HD21 ASN 31 1HD2 ASN 31 17.506 36.980 -1.539
221 HD22 ASN 31 2HD2 ASN 31 19.080 37.003 -2.327
222 HA PRO 32 HA PRO 32 21.203 38.441 4.649
223 HB2 PRO 32 1HB PRO 32 19.122 39.830 5.776
224 HB3 PRO 32 2HB PRO 32 20.645 40.600 5.224
225 HG2 PRO 32 1HG PRO 32 18.034 40.331 3.737
226 HG3 PRO 32 2HG PRO 32 19.019 41.802 4.028
227 HD2 PRO 32 1HD PRO 32 19.214 40.485 1.727
228 HD3 PRO 32 2HD PRO 32 20.687 41.132 2.532
229 H HIS 33 H HIS 33 18.103 37.927 2.947
230 HA HIS 33 HA HIS 33 17.025 36.257 5.089
231 HB2 HIS 33 1HB HIS 33 15.599 37.475 3.441
232 HB3 HIS 33 2HB HIS 33 16.235 36.439 2.158
233 HD1 HIS 33 HD1 HIS 33 14.024 36.289 5.251
234 HD2 HIS 33 HD2 HIS 33 15.098 33.933 1.983
235 HE1 HIS 33 HE1 HIS 33 12.480 34.289 5.253
236 H GLU 34 H GLU 34 18.678 35.777 1.995
237 HA GLU 34 HA GLU 34 18.341 32.919 1.984
238 HB2 GLU 34 1HB GLU 34 19.591 35.022 0.374
239 HB3 GLU 34 2HB GLU 34 20.429 33.494 0.280
240 HG2 GLU 34 1HG GLU 34 18.722 33.840 -1.487
241 HG3 GLU 34 2HG GLU 34 18.526 32.392 -0.508
242 H LEU 35 H LEU 35 20.914 35.165 2.997
243 HA LEU 35 HA LEU 35 22.814 33.116 3.606
244 HB2 LEU 35 1HB LEU 35 24.131 34.698 4.332
245 HB3 LEU 35 2HB LEU 35 23.075 35.541 3.255
246 HG LEU 35 HG LEU 35 21.955 36.635 5.084
247 HD11 LEU 35 1HD1 LEU 35 23.245 36.706 7.286
248 HD12 LEU 35 2HD1 LEU 35 23.905 35.117 6.810
249 HD13 LEU 35 3HD1 LEU 35 22.152 35.341 7.021
250 HD21 LEU 35 1HD2 LEU 35 23.825 37.477 3.800
251 HD22 LEU 35 2HD2 LEU 35 24.968 36.678 4.897
252 HD23 LEU 35 3HD2 LEU 35 23.967 38.038 5.480
253 H SER 36 H SER 36 20.028 34.415 5.256
254 HA SER 36 HA SER 36 20.692 33.351 7.850
255 HB2 SER 36 1HB SER 36 19.180 35.312 7.496
256 HB3 SER 36 2HB SER 36 17.965 34.199 6.837
257 HG SER 36 HG SER 36 18.114 33.065 8.881
258 H LEU 37 H LEU 37 18.590 32.283 5.115
259 HA LEU 37 HA LEU 37 17.659 29.972 6.553
260 HB2 LEU 37 1HB LEU 37 16.785 29.200 4.615
261 HB3 LEU 37 2HB LEU 37 16.723 30.907 4.550
262 HG LEU 37 HG LEU 37 18.472 30.920 2.826
263 HD11 LEU 37 1HD1 LEU 37 17.926 27.949 2.966
264 HD12 LEU 37 2HD1 LEU 37 19.486 28.785 2.998
265 HD13 LEU 37 3HD1 LEU 37 18.556 28.747 1.501
266 HD21 LEU 37 1HD2 LEU 37 15.860 29.472 2.286
267 HD22 LEU 37 2HD2 LEU 37 16.844 30.342 1.085
268 HD23 LEU 37 3HD2 LEU 37 16.077 31.237 2.404
269 H LEU 38 H LEU 38 20.459 30.745 4.680
270 HA LEU 38 HA LEU 38 21.358 28.089 4.383
271 HB2 LEU 38 1HB LEU 38 22.009 30.094 3.163
272 HB3 LEU 38 2HB LEU 38 22.931 30.654 4.561
273 HG LEU 38 HG LEU 38 24.348 28.645 4.480
274 HD11 LEU 38 1HD1 LEU 38 24.348 27.272 2.422
275 HD12 LEU 38 2HD1 LEU 38 22.842 28.081 1.925
276 HD13 LEU 38 3HD1 LEU 38 22.885 27.092 3.403
277 HD21 LEU 38 1HD2 LEU 38 25.022 30.759 3.367
278 HD22 LEU 38 2HD2 LEU 38 24.345 30.122 1.850
279 HD23 LEU 38 3HD2 LEU 38 25.722 29.307 2.620
280 H LYS 39 H LYS 39 22.106 30.500 6.930
281 HA LYS 39 HA LYS 39 23.777 28.612 8.374
282 HB2 LYS 39 1HB LYS 39 23.483 30.137 10.338
283 HB3 LYS 39 2HB LYS 39 24.219 30.846 8.902
284 HG2 LYS 39 1HG LYS 39 22.246 32.052 8.369
285 HG3 LYS 39 2HG LYS 39 21.281 31.183 9.540
286 HD2 LYS 39 1HD LYS 39 21.707 33.292 10.485
287 HD3 LYS 39 2HD LYS 39 22.783 32.166 11.335
288 HE2 LYS 39 1HE LYS 39 24.661 32.863 9.886
289 HE3 LYS 39 2HE LYS 39 23.574 33.942 8.986
290 HZ1 LYS 39 1HZ LYS 39 24.213 34.178 11.868
291 HZ2 LYS 39 2HZ LYS 39 23.210 35.179 11.027
292 HZ3 LYS 39 3HZ LYS 39 24.820 35.140 10.671
293 H GLU 40 H GLU 40 20.330 29.188 8.326
294 HA GLU 40 HA GLU 40 19.848 27.598 10.714
295 HB2 GLU 40 1HB GLU 40 18.123 28.512 8.390
296 HB3 GLU 40 2HB GLU 40 17.487 27.531 9.719
297 HG2 GLU 40 1HG GLU 40 18.715 30.297 9.968
298 HG3 GLU 40 2HG GLU 40 16.994 29.907 10.059
299 H ARG 41 H ARG 41 19.553 26.959 7.172
300 HA ARG 41 HA ARG 41 18.906 24.143 7.788
301 HB2 ARG 41 1HB ARG 41 19.203 25.558 5.122
302 HB3 ARG 41 2HB ARG 41 18.478 23.966 5.402
303 HG2 ARG 41 1HG ARG 41 16.862 25.125 6.973
304 HG3 ARG 41 2HG ARG 41 17.470 26.657 6.361
305 HD2 ARG 41 1HD ARG 41 16.885 25.842 4.032
306 HD3 ARG 41 2HD ARG 41 16.004 24.513 4.814
307 HE ARG 41 HE ARG 41 15.246 27.334 4.670
308 HH11 ARG 41 1HH1 ARG 41 14.710 24.357 6.502
309 HH12 ARG 41 2HH1 ARG 41 13.178 24.911 7.120
310 HH21 ARG 41 1HH2 ARG 41 13.289 27.962 5.498
311 HH22 ARG 41 2HH2 ARG 41 12.393 26.913 6.562
312 H ASN 42 H ASN 42 21.757 25.824 6.625
313 HA ASN 42 HA ASN 42 23.142 23.173 6.515
314 HB2 ASN 42 1HB ASN 42 22.500 24.092 4.201
315 HB3 ASN 42 2HB ASN 42 23.710 25.321 4.457
316 HD21 ASN 42 1HD2 ASN 42 25.328 22.575 2.638
317 HD22 ASN 42 2HD2 ASN 42 24.168 23.849 2.356
318 HA PRO 43 HA PRO 43 25.325 26.501 8.903
319 HB2 PRO 43 1HB PRO 43 26.425 24.766 10.819
320 HB3 PRO 43 2HB PRO 43 24.943 25.758 10.987
321 HG2 PRO 43 1HG PRO 43 25.214 22.875 10.198
322 HG3 PRO 43 2HG PRO 43 24.042 23.647 11.310
323 HD2 PRO 43 1HD PRO 43 23.352 22.991 8.810
324 HD3 PRO 43 2HD PRO 43 22.781 24.530 9.548
325 HA PRO 44 HA PRO 44 29.479 24.546 8.192
326 HB2 PRO 44 1HB PRO 44 29.870 22.547 6.372
327 HB3 PRO 44 2HB PRO 44 29.578 22.235 8.113
328 HG2 PRO 44 1HG PRO 44 27.608 22.222 5.850
329 HG3 PRO 44 2HG PRO 44 27.913 20.961 7.089
330 HD2 PRO 44 1HD PRO 44 25.904 22.714 7.386
331 HD3 PRO 44 2HD PRO 44 26.905 22.228 8.794
332 H LEU 45 H LEU 45 27.197 24.444 5.368
333 HA LEU 45 HA LEU 45 29.199 25.686 3.632
334 HB2 LEU 45 1HB LEU 45 27.337 24.324 2.730
335 HB3 LEU 45 2HB LEU 45 26.197 25.543 3.306
336 HG LEU 45 HG LEU 45 27.100 27.195 1.756
337 HD11 LEU 45 1HD1 LEU 45 28.765 26.569 0.010
338 HD12 LEU 45 2HD1 LEU 45 29.033 25.019 0.835
339 HD13 LEU 45 3HD1 LEU 45 29.469 26.548 1.630
340 HD21 LEU 45 1HD2 LEU 45 25.323 25.645 1.015
341 HD22 LEU 45 2HD2 LEU 45 26.563 24.542 0.368
342 HD23 LEU 45 3HD2 LEU 45 26.355 26.167 -0.328
343 H ALA 46 H ALA 46 26.680 26.658 5.873
344 HA ALA 46 HA ALA 46 26.565 29.375 5.045
345 HB1 ALA 46 1HB ALA 46 24.993 28.192 6.550
346 HB2 ALA 46 2HB ALA 46 26.206 28.328 7.838
347 HB3 ALA 46 3HB ALA 46 25.515 29.796 7.109
348 H GLU 47 H GLU 47 28.604 27.850 7.656
349 HA GLU 47 HA GLU 47 29.659 30.350 8.462
350 HB2 GLU 47 1HB GLU 47 31.416 29.188 9.588
351 HB3 GLU 47 2HB GLU 47 29.828 28.486 9.896
352 HG2 GLU 47 1HG GLU 47 30.459 26.569 9.210
353 HG3 GLU 47 2HG GLU 47 30.997 27.176 7.660
354 H ALA 48 H ALA 48 30.624 28.164 5.935
355 HA ALA 48 HA ALA 48 32.974 29.341 5.109
356 HB1 ALA 48 1HB ALA 48 32.637 28.097 3.110
357 HB2 ALA 48 2HB ALA 48 31.842 27.144 4.366
358 HB3 ALA 48 3HB ALA 48 30.883 28.159 3.265
359 H LEU 49 H LEU 49 29.633 30.076 4.242
360 HA LEU 49 HA LEU 49 30.296 32.176 2.411
361 HB2 LEU 49 1HB LEU 49 28.140 30.895 2.595
362 HB3 LEU 49 2HB LEU 49 27.783 31.750 4.075
363 HG LEU 49 HG LEU 49 26.626 32.448 1.951
364 HD11 LEU 49 1HD1 LEU 49 26.524 33.773 3.978
365 HD12 LEU 49 2HD1 LEU 49 26.497 34.754 2.499
366 HD13 LEU 49 3HD1 LEU 49 27.982 34.651 3.460
367 HD21 LEU 49 1HD2 LEU 49 27.726 34.027 0.512
368 HD22 LEU 49 2HD2 LEU 49 28.633 32.508 0.528
369 HD23 LEU 49 3HD2 LEU 49 29.217 33.913 1.453
370 H LEU 50 H LEU 50 29.479 32.086 5.893
371 HA LEU 50 HA LEU 50 29.185 34.888 6.176
372 HB2 LEU 50 1HB LEU 50 30.288 33.074 8.343
373 HB3 LEU 50 2HB LEU 50 29.410 34.572 8.556
374 HG LEU 50 HG LEU 50 28.372 31.865 7.881
375 HD11 LEU 50 1HD1 LEU 50 28.776 32.312 10.169
376 HD12 LEU 50 2HD1 LEU 50 27.045 32.126 9.846
377 HD13 LEU 50 3HD1 LEU 50 27.730 33.758 10.093
378 HD21 LEU 50 1HD2 LEU 50 27.141 33.206 6.370
379 HD22 LEU 50 2HD2 LEU 50 26.812 34.421 7.637
380 HD23 LEU 50 3HD2 LEU 50 26.093 32.787 7.730
381 H SER 51 H SER 51 32.015 32.802 6.223
382 HA SER 51 HA SER 51 33.845 34.640 7.410
383 HB2 SER 51 1HB SER 51 34.242 32.307 5.541
384 HB3 SER 51 2HB SER 51 35.502 33.092 6.493
385 HG SER 51 HG SER 51 33.225 31.693 7.470
386 H GLY 52 H GLY 52 32.549 34.268 4.175
387 HA2 GLY 52 1HA GLY 52 32.774 35.771 2.408
388 HA3 GLY 52 2HA GLY 52 34.077 36.602 3.274
389 H ASP 53 H ASP 53 35.203 33.702 3.653
390 HA ASP 53 HA ASP 53 37.146 33.837 1.560
391 HB2 ASP 53 1HB ASP 53 37.447 32.618 3.803
392 HB3 ASP 53 2HB ASP 53 36.369 31.440 3.187
393 H LEU 54 H LEU 54 36.776 33.402 -0.552
394 HA LEU 54 HA LEU 54 34.513 31.842 -1.415
395 HB2 LEU 54 1HB LEU 54 35.618 33.576 -2.796
396 HB3 LEU 54 2HB LEU 54 37.061 32.580 -2.896
397 HG LEU 54 HG LEU 54 35.393 32.691 -4.851
398 HD11 LEU 54 1HD1 LEU 54 37.393 31.227 -4.746
399 HD12 LEU 54 2HD1 LEU 54 36.049 30.554 -5.692
400 HD13 LEU 54 3HD1 LEU 54 36.369 29.954 -4.054
401 HD21 LEU 54 1HD2 LEU 54 33.337 32.119 -3.635
402 HD22 LEU 54 2HD2 LEU 54 33.992 30.500 -3.321
403 HD23 LEU 54 3HD2 LEU 54 33.670 31.009 -4.979
404 H GLU 55 H GLU 55 37.948 31.131 -0.750
405 HA GLU 55 HA GLU 55 38.023 28.621 -2.053
406 HB2 GLU 55 1HB GLU 55 39.450 29.309 0.528
407 HB3 GLU 55 2HB GLU 55 39.939 28.127 -0.685
408 HG2 GLU 55 1HG GLU 55 39.830 31.131 -0.997
409 HG3 GLU 55 2HG GLU 55 41.253 30.123 -0.814
410 H LYS 56 H LYS 56 37.399 29.312 1.418
411 HA LYS 56 HA LYS 56 36.663 26.605 1.971
412 HB2 LYS 56 1HB LYS 56 36.088 27.243 4.124
413 HB3 LYS 56 2HB LYS 56 37.278 28.511 3.650
414 HG2 LYS 56 1HG LYS 56 35.255 29.865 3.136
415 HG3 LYS 56 2HG LYS 56 34.403 28.625 4.023
416 HD2 LYS 56 1HD LYS 56 36.897 29.706 5.280
417 HD3 LYS 56 2HD LYS 56 35.468 30.725 5.284
418 HE2 LYS 56 1HE LYS 56 34.169 28.974 6.402
419 HE3 LYS 56 2HE LYS 56 35.557 27.888 6.359
420 HZ1 LYS 56 1HZ LYS 56 35.403 30.428 7.849
421 HZ2 LYS 56 2HZ LYS 56 36.663 29.354 7.887
422 HZ3 LYS 56 3HZ LYS 56 35.181 28.922 8.492
423 H PHE 57 H PHE 57 34.736 29.408 0.839
424 HA PHE 57 HA PHE 57 32.215 28.110 1.137
425 HB2 PHE 57 1HB PHE 57 32.485 30.512 0.665
426 HB3 PHE 57 2HB PHE 57 33.049 30.121 -0.962
427 HD1 PHE 57 HD1 PHE 57 30.132 30.030 1.334
428 HD2 PHE 57 HD2 PHE 57 31.484 29.531 -2.712
429 HE1 PHE 57 HE1 PHE 57 27.766 30.041 0.556
430 HE2 PHE 57 HE2 PHE 57 29.123 29.517 -3.500
431 HZ PHE 57 HZ PHE 57 27.265 29.765 -1.873
432 H SER 58 H SER 58 34.364 28.251 -1.754
433 HA SER 58 HA SER 58 32.733 26.499 -3.306
434 HB2 SER 58 1HB SER 58 34.508 28.016 -4.192
435 HB3 SER 58 2HB SER 58 35.739 26.987 -3.433
436 HG SER 58 HG SER 58 35.561 26.298 -5.511
437 H ARG 59 H ARG 59 35.435 25.844 -1.077
438 HA ARG 59 HA ARG 59 35.781 23.091 -1.771
439 HB2 ARG 59 1HB ARG 59 37.392 24.345 -0.401
440 HB3 ARG 59 2HB ARG 59 36.184 24.560 0.865
441 HG2 ARG 59 1HG ARG 59 36.474 21.747 0.312
442 HG3 ARG 59 2HG ARG 59 38.070 22.467 0.600
443 HD2 ARG 59 1HD ARG 59 37.402 23.315 2.744
444 HD3 ARG 59 2HD ARG 59 35.690 23.004 2.401
445 HE ARG 59 HE ARG 59 35.963 20.711 2.779
446 HH11 ARG 59 1HH1 ARG 59 39.054 22.384 3.270
447 HH12 ARG 59 2HH1 ARG 59 39.758 21.009 4.077
448 HH21 ARG 59 1HH2 ARG 59 36.931 19.023 3.721
449 HH22 ARG 59 2HH2 ARG 59 38.566 19.131 4.352
450 H VAL 60 H VAL 60 33.702 24.674 0.701
451 HA VAL 60 HA VAL 60 32.614 22.120 1.515
452 HB VAL 60 HB VAL 60 31.518 24.926 1.973
453 HG11 VAL 60 1HG1 VAL 60 29.779 23.280 2.320
454 HG12 VAL 60 2HG1 VAL 60 30.886 22.224 3.227
455 HG13 VAL 60 3HG1 VAL 60 30.379 23.783 3.915
456 HG21 VAL 60 1HG2 VAL 60 33.819 24.606 2.908
457 HG22 VAL 60 2HG2 VAL 60 32.608 24.748 4.188
458 HG23 VAL 60 3HG2 VAL 60 33.262 23.150 3.755
459 H LEU 61 H LEU 61 31.718 24.618 -0.869
460 HA LEU 61 HA LEU 61 29.096 23.726 -1.420
461 HB2 LEU 61 1HB LEU 61 30.341 25.785 -2.303
462 HB3 LEU 61 2HB LEU 61 31.064 24.724 -3.498
463 HG LEU 61 HG LEU 61 28.380 24.194 -3.826
464 HD11 LEU 61 1HD1 LEU 61 27.211 26.323 -3.788
465 HD12 LEU 61 2HD1 LEU 61 28.685 27.157 -3.239
466 HD13 LEU 61 3HD1 LEU 61 27.867 25.985 -2.171
467 HD21 LEU 61 1HD2 LEU 61 30.399 25.232 -5.417
468 HD22 LEU 61 2HD2 LEU 61 29.232 26.580 -5.368
469 HD23 LEU 61 3HD2 LEU 61 28.727 24.968 -5.913
470 H VAL 62 H VAL 62 32.230 22.611 -2.834
471 HA VAL 62 HA VAL 62 30.831 20.686 -4.503
472 HB VAL 62 HB VAL 62 33.017 21.663 -5.159
473 HG11 VAL 62 1HG1 VAL 62 35.118 20.755 -4.253
474 HG12 VAL 62 2HG1 VAL 62 34.211 21.662 -3.039
475 HG13 VAL 62 3HG1 VAL 62 34.212 19.886 -2.998
476 HG21 VAL 62 1HG2 VAL 62 32.175 19.575 -6.159
477 HG22 VAL 62 2HG2 VAL 62 33.949 19.607 -6.095
478 HG23 VAL 62 3HG2 VAL 62 33.035 18.641 -4.913
479 H GLU 63 H GLU 63 32.424 20.515 -1.317
480 HA GLU 63 HA GLU 63 32.262 17.669 -1.023
481 HB2 GLU 63 1HB GLU 63 32.222 19.962 0.935
482 HB3 GLU 63 2HB GLU 63 32.055 18.289 1.478
483 HG2 GLU 63 1HG GLU 63 34.202 17.708 0.491
484 HG3 GLU 63 2HG GLU 63 34.389 19.355 -0.126
485 H GLN 64 H GLN 64 29.897 20.252 -0.265
486 HA GLN 64 HA GLN 64 27.915 18.539 0.881
487 HB2 GLN 64 1HB GLN 64 27.759 21.163 -0.641
488 HB3 GLN 64 2HB GLN 64 26.326 20.378 0.026
489 HG2 GLN 64 1HG GLN 64 28.726 21.132 1.717
490 HG3 GLN 64 2HG GLN 64 27.352 22.210 1.444
491 HE21 GLN 64 1HE2 GLN 64 27.148 19.642 4.412
492 HE22 GLN 64 2HE2 GLN 64 28.615 20.203 3.644
493 H GLN 65 H GLN 65 28.652 19.434 -2.494
494 HA GLN 65 HA GLN 65 26.332 18.074 -3.579
495 HB2 GLN 65 1HB GLN 65 28.951 18.944 -4.824
496 HB3 GLN 65 2HB GLN 65 27.640 18.185 -5.737
497 HG2 GLN 65 1HG GLN 65 26.124 20.002 -5.155
498 HG3 GLN 65 2HG GLN 65 27.363 20.750 -4.148
499 HE21 GLN 65 1HE2 GLN 65 28.958 22.387 -6.773
500 HE22 GLN 65 2HE2 GLN 65 28.879 22.045 -5.054
501 H GLN 66 H GLN 66 29.705 17.039 -2.930
502 HA GLN 66 HA GLN 66 29.438 14.474 -4.205
503 HB2 GLN 66 1HB GLN 66 31.201 15.441 -1.927
504 HB3 GLN 66 2HB GLN 66 31.337 13.839 -2.658
505 HG2 GLN 66 1HG GLN 66 31.894 14.816 -4.810
506 HG3 GLN 66 2HG GLN 66 31.657 16.441 -4.171
507 HE21 GLN 66 1HE2 GLN 66 34.831 16.711 -2.790
508 HE22 GLN 66 2HE2 GLN 66 33.289 17.455 -3.150
509 H ASP 67 H ASP 67 28.874 15.578 -0.818
510 HA ASP 67 HA ASP 67 28.191 12.932 0.115
511 HB2 ASP 67 1HB ASP 67 28.824 14.945 1.525
512 HB3 ASP 67 2HB ASP 67 27.200 15.553 1.221
513 H ARG 68 H ARG 68 26.365 15.628 -1.282
514 HA ARG 68 HA ARG 68 23.728 14.608 -0.890
515 HB2 ARG 68 1HB ARG 68 25.075 16.510 -2.702
516 HB3 ARG 68 2HB ARG 68 23.682 15.728 -3.433
517 HG2 ARG 68 1HG ARG 68 23.433 16.961 -0.705
518 HG3 ARG 68 2HG ARG 68 23.397 17.977 -2.167
519 HD2 ARG 68 1HD ARG 68 21.657 16.480 -3.111
520 HD3 ARG 68 2HD ARG 68 21.597 15.613 -1.568
521 HE ARG 68 HE ARG 68 21.188 18.251 -0.877
522 HH11 ARG 68 1HH1 ARG 68 19.596 16.058 -3.160
523 HH12 ARG 68 2HH1 ARG 68 18.053 16.858 -2.975
524 HH21 ARG 68 1HH2 ARG 68 19.188 19.215 -0.706
525 HH22 ARG 68 2HH2 ARG 68 17.832 18.614 -1.621
526 H ALA 69 H ALA 69 26.047 14.137 -3.584
527 HA ALA 69 HA ALA 69 24.419 12.322 -5.025
528 HB1 ALA 69 1HB ALA 69 26.426 13.453 -5.952
529 HB2 ALA 69 2HB ALA 69 27.467 12.468 -4.896
530 HB3 ALA 69 3HB ALA 69 26.503 11.691 -6.174
531 H ARG 70 H ARG 70 26.773 11.713 -2.350
532 HA ARG 70 HA ARG 70 26.711 8.887 -2.739
533 HB2 ARG 70 1HB ARG 70 28.278 8.846 -1.134
534 HB3 ARG 70 2HB ARG 70 28.310 10.589 -1.410
535 HG2 ARG 70 1HG ARG 70 26.981 10.984 0.534
536 HG3 ARG 70 2HG ARG 70 26.724 9.268 0.768
537 HD2 ARG 70 1HD ARG 70 29.092 8.932 1.207
538 HD3 ARG 70 2HD ARG 70 29.424 10.624 0.791
539 HE ARG 70 HE ARG 70 28.522 11.357 2.825
540 HH11 ARG 70 1HH1 ARG 70 28.078 7.840 2.577
541 HH12 ARG 70 2HH1 ARG 70 27.759 7.686 4.292
542 HH21 ARG 70 1HH2 ARG 70 28.081 11.059 4.944
543 HH22 ARG 70 2HH2 ARG 70 27.753 9.463 5.592
544 H ARG 71 H ARG 71 24.800 11.048 -0.615
545 HA ARG 71 HA ARG 71 23.491 8.729 0.613
546 HB2 ARG 71 1HB ARG 71 22.181 10.270 1.846
547 HB3 ARG 71 2HB ARG 71 23.846 10.845 1.826
548 HG2 ARG 71 1HG ARG 71 23.252 12.590 0.216
549 HG3 ARG 71 2HG ARG 71 21.603 11.958 0.111
550 HD2 ARG 71 1HD ARG 71 21.558 13.841 1.586
551 HD3 ARG 71 2HD ARG 71 21.326 12.372 2.549
552 HE ARG 71 HE ARG 71 24.118 13.272 2.408
553 HH11 ARG 71 1HH1 ARG 71 21.087 13.599 4.218
554 HH12 ARG 71 2HH1 ARG 71 21.905 14.181 5.642
555 HH21 ARG 71 1HH2 ARG 71 25.064 14.015 4.221
556 HH22 ARG 71 2HH2 ARG 71 24.125 14.399 5.657
557 H GLU 72 H GLU 72 22.727 10.959 -2.000
558 HA GLU 72 HA GLU 72 20.020 9.954 -2.241
559 HB2 GLU 72 1HB GLU 72 21.677 11.653 -4.107
560 HB3 GLU 72 2HB GLU 72 20.008 11.138 -4.438
561 HG2 GLU 72 1HG GLU 72 19.369 12.084 -2.165
562 HG3 GLU 72 2HG GLU 72 20.968 12.820 -2.084
563 H GLN 73 H GLN 73 23.149 8.958 -3.561
564 HA GLN 73 HA GLN 73 22.229 7.083 -5.483
565 HB2 GLN 73 1HB GLN 73 24.606 7.383 -3.728
566 HB3 GLN 73 2HB GLN 73 24.273 5.758 -4.310
567 HG2 GLN 73 1HG GLN 73 24.276 6.583 -6.630
568 HG3 GLN 73 2HG GLN 73 24.674 8.205 -6.034
569 HE21 GLN 73 1HE2 GLN 73 28.074 7.537 -6.067
570 HE22 GLN 73 2HE2 GLN 73 26.755 8.668 -6.250
571 H GLU 74 H GLU 74 22.283 6.879 -1.908
572 HA GLU 74 HA GLU 74 21.632 4.061 -1.822
573 HB2 GLU 74 1HB GLU 74 21.130 6.235 0.234
574 HB3 GLU 74 2HB GLU 74 21.091 4.498 0.536
575 HG2 GLU 74 1HG GLU 74 23.479 4.321 0.081
576 HG3 GLU 74 2HG GLU 74 23.546 6.024 -0.393
577 H ARG 75 H ARG 75 19.779 7.086 -1.972
578 HA ARG 75 HA ARG 75 17.229 5.907 -1.337
579 HB2 ARG 75 1HB ARG 75 17.942 8.442 -2.824
580 HB3 ARG 75 2HB ARG 75 16.303 7.980 -2.362
581 HG2 ARG 75 1HG ARG 75 16.868 8.069 -0.013
582 HG3 ARG 75 2HG ARG 75 18.580 8.354 -0.393
583 HD2 ARG 75 1HD ARG 75 17.506 10.456 0.160
584 HD3 ARG 75 2HD ARG 75 17.977 10.425 -1.548
585 HE ARG 75 HE ARG 75 15.202 9.668 -0.836
586 HH11 ARG 75 1HH1 ARG 75 17.343 12.056 -2.344
587 HH12 ARG 75 2HH1 ARG 75 16.032 12.849 -3.154
588 HH21 ARG 75 1HH2 ARG 75 13.583 10.750 -1.903
589 HH22 ARG 75 2HH2 ARG 75 13.946 12.129 -2.906
590 H ILE 76 H ILE 76 18.941 6.445 -4.389
591 HA ILE 76 HA ILE 76 16.705 5.806 -6.030
592 HB ILE 76 HB ILE 76 18.019 5.903 -7.934
593 HG12 ILE 76 1HG1 ILE 76 20.340 6.274 -6.048
594 HG13 ILE 76 2HG1 ILE 76 20.016 4.802 -6.958
595 HG21 ILE 76 1HG2 ILE 76 18.688 8.087 -5.923
596 HG22 ILE 76 2HG2 ILE 76 18.583 8.263 -7.685
597 HG23 ILE 76 3HG2 ILE 76 17.121 7.915 -6.740
598 HD11 ILE 76 1HD1 ILE 76 20.732 7.522 -8.075
599 HD12 ILE 76 2HD1 ILE 76 21.733 6.063 -8.078
600 HD13 ILE 76 3HD1 ILE 76 20.261 6.125 -9.072
601 H ARG 77 H ARG 77 18.669 3.846 -4.187
602 HA ARG 77 HA ARG 77 18.645 1.398 -5.708
603 HB2 ARG 77 1HB ARG 77 18.335 1.859 -2.716
604 HB3 ARG 77 2HB ARG 77 18.455 0.268 -3.459
605 HG2 ARG 77 1HG ARG 77 20.672 0.846 -4.357
606 HG3 ARG 77 2HG ARG 77 20.593 2.411 -3.516
607 HD2 ARG 77 1HD ARG 77 20.451 1.307 -1.367
608 HD3 ARG 77 2HD ARG 77 20.286 -0.276 -2.147
609 HE ARG 77 HE ARG 77 22.742 0.948 -2.968
610 HH11 ARG 77 1HH1 ARG 77 21.300 -0.681 -0.180
611 HH12 ARG 77 2HH1 ARG 77 22.850 -1.298 0.351
612 HH21 ARG 77 1HH2 ARG 77 24.660 0.157 -2.190
613 HH22 ARG 77 2HH2 ARG 77 24.704 -0.828 -0.729
614 H LEU 78 H LEU 78 16.077 3.241 -4.318
615 HA LEU 78 HA LEU 78 13.858 2.967 -4.062
616 HB2 LEU 78 1HB LEU 78 14.256 2.727 -6.528
617 HB3 LEU 78 2HB LEU 78 14.233 1.008 -6.310
618 HG LEU 78 HG LEU 78 11.809 1.184 -5.623
619 HD11 LEU 78 1HD1 LEU 78 12.188 4.089 -6.455
620 HD12 LEU 78 2HD1 LEU 78 11.787 3.500 -4.823
621 HD13 LEU 78 3HD1 LEU 78 10.623 3.297 -6.146
622 HD21 LEU 78 1HD2 LEU 78 12.542 2.358 -8.328
623 HD22 LEU 78 2HD2 LEU 78 10.985 1.607 -7.897
624 HD23 LEU 78 3HD2 LEU 78 12.466 0.626 -7.917
625 H PHE 79 H PHE 79 12.894 -0.050 -4.914
626 HA PHE 79 HA PHE 79 13.875 -1.556 -2.647
627 HB2 PHE 79 1HB PHE 79 11.629 -1.835 -1.690
628 HB3 PHE 79 2HB PHE 79 12.170 -0.163 -1.583
629 HD1 PHE 79 HD1 PHE 79 11.101 1.609 -2.878
630 HD2 PHE 79 HD2 PHE 79 9.758 -2.468 -3.158
631 HE1 PHE 79 HE1 PHE 79 9.030 2.377 -4.031
632 HE2 PHE 79 HE2 PHE 79 7.688 -1.714 -4.320
633 HZ PHE 79 HZ PHE 79 7.321 0.713 -4.765
634 H SER 80 H SER 80 12.912 -3.690 -2.705
635 HA SER 80 HA SER 80 11.843 -5.546 -3.648
636 HB2 SER 80 1HB SER 80 11.756 -4.222 -6.371
637 HB3 SER 80 2HB SER 80 10.974 -5.728 -5.862
638 HG SER 80 HG SER 80 10.372 -3.064 -5.151
639 H ALA 81 H ALA 81 13.533 -6.778 -3.327
640 HA ALA 81 HA ALA 81 15.424 -7.971 -3.640
641 HB1 ALA 81 1HB ALA 81 16.127 -8.580 -5.860
642 HB2 ALA 81 2HB ALA 81 14.348 -8.499 -5.843
643 HB3 ALA 81 3HB ALA 81 15.295 -7.180 -6.569
644 H ASP 82 H ASP 82 15.369 -4.999 -3.218
645 HA ASP 82 HA ASP 82 17.890 -3.979 -4.179
646 HB2 ASP 82 1HB ASP 82 17.422 -2.183 -2.504
647 HB3 ASP 82 2HB ASP 82 16.069 -2.453 -3.613
648 HA PRO 83 HA PRO 83 20.142 -6.050 -1.016
649 HB2 PRO 83 1HB PRO 83 22.522 -4.785 -1.020
650 HB3 PRO 83 2HB PRO 83 21.975 -5.707 -2.459
651 HG2 PRO 83 1HG PRO 83 21.760 -2.787 -1.882
652 HG3 PRO 83 2HG PRO 83 22.449 -3.587 -3.326
653 HD2 PRO 83 1HD PRO 83 19.878 -2.639 -3.263
654 HD3 PRO 83 2HD PRO 83 20.312 -4.132 -4.170
655 H PHE 84 H PHE 84 20.874 -5.811 1.139
656 HA PHE 84 HA PHE 84 19.790 -3.357 2.426
657 HB2 PHE 84 1HB PHE 84 19.947 -6.161 3.563
658 HB3 PHE 84 2HB PHE 84 19.143 -4.762 4.287
659 HD1 PHE 84 HD1 PHE 84 18.546 -7.717 2.553
660 HD2 PHE 84 HD2 PHE 84 17.408 -3.564 2.501
661 HE1 PHE 84 HE1 PHE 84 16.452 -8.306 1.340
662 HE2 PHE 84 HE2 PHE 84 15.317 -4.147 1.290
663 HZ PHE 84 HZ PHE 84 14.833 -6.516 0.707
664 H ASP 85 H ASP 85 22.599 -3.695 1.580
665 HA ASP 85 HA ASP 85 24.135 -3.952 4.073
666 HB2 ASP 85 1HB ASP 85 26.044 -3.202 2.671
667 HB3 ASP 85 2HB ASP 85 25.197 -4.591 1.969
668 H LEU 86 H LEU 86 22.060 -2.163 4.434
669 HA LEU 86 HA LEU 86 22.848 0.583 3.967
670 HB2 LEU 86 1HB LEU 86 20.978 -0.601 6.053
671 HB3 LEU 86 2HB LEU 86 21.063 1.098 5.590
672 HG LEU 86 HG LEU 86 20.219 -1.171 3.744
673 HD11 LEU 86 1HD1 LEU 86 18.546 0.910 5.200
674 HD12 LEU 86 2HD1 LEU 86 18.625 -0.827 5.583
675 HD13 LEU 86 3HD1 LEU 86 17.944 -0.292 4.033
676 HD21 LEU 86 1HD2 LEU 86 20.112 1.855 3.382
677 HD22 LEU 86 2HD2 LEU 86 19.380 0.658 2.284
678 HD23 LEU 86 3HD2 LEU 86 21.141 0.717 2.481
679 H GLU 87 H GLU 87 23.647 -1.866 6.288
680 HA GLU 87 HA GLU 87 24.667 -0.153 8.374
681 HB2 GLU 87 1HB GLU 87 25.337 -3.009 7.573
682 HB3 GLU 87 2HB GLU 87 25.869 -2.223 9.063
683 HG2 GLU 87 1HG GLU 87 23.479 -1.919 9.714
684 HG3 GLU 87 2HG GLU 87 23.003 -2.823 8.265
685 H ALA 88 H ALA 88 25.875 -1.180 5.261
686 HA ALA 88 HA ALA 88 28.659 -0.821 5.953
687 HB1 ALA 88 1HB ALA 88 29.102 -1.382 3.624
688 HB2 ALA 88 2HB ALA 88 27.899 -2.508 4.292
689 HB3 ALA 88 3HB ALA 88 27.380 -1.179 3.223
690 H GLN 89 H GLN 89 26.302 1.397 5.507
691 HA GLN 89 HA GLN 89 27.506 3.183 3.623
692 HB2 GLN 89 1HB GLN 89 25.916 4.801 4.317
693 HB3 GLN 89 2HB GLN 89 25.121 3.223 4.336
694 HG2 GLN 89 1HG GLN 89 25.503 3.153 6.832
695 HG3 GLN 89 2HG GLN 89 26.106 4.807 6.727
696 HE21 GLN 89 1HE2 GLN 89 22.407 5.222 5.375
697 HE22 GLN 89 2HE2 GLN 89 23.755 4.687 4.400
698 H ALA 90 H ALA 90 28.900 4.866 3.828
699 HA ALA 90 HA ALA 90 30.742 4.803 6.026
700 HB1 ALA 90 1HB ALA 90 31.763 6.782 4.942
701 HB2 ALA 90 2HB ALA 90 31.406 5.515 3.746
702 HB3 ALA 90 3HB ALA 90 30.348 6.940 3.877
703 H LYS 91 H LYS 91 30.957 6.105 7.806
704 HA LYS 91 HA LYS 91 28.837 8.159 8.294
705 HB2 LYS 91 1HB LYS 91 29.234 5.644 9.639
706 HB3 LYS 91 2HB LYS 91 29.725 6.941 10.732
707 HG2 LYS 91 1HG LYS 91 27.430 6.384 11.147
708 HG3 LYS 91 2HG LYS 91 27.513 8.013 10.456
709 HD2 LYS 91 1HD LYS 91 26.753 7.240 8.319
710 HD3 LYS 91 2HD LYS 91 26.968 5.539 8.779
711 HE2 LYS 91 1HE LYS 91 25.144 7.239 10.449
712 HE3 LYS 91 2HE LYS 91 24.580 6.722 8.842
713 HZ1 LYS 91 1HZ LYS 91 25.619 4.850 10.888
714 HZ2 LYS 91 2HZ LYS 91 24.913 4.456 9.444
715 HZ3 LYS 91 3HZ LYS 91 24.014 5.149 10.636
716 H ILE 92 H ILE 92 29.473 9.918 9.416
717 HA ILE 92 HA ILE 92 32.163 10.049 10.625
718 HB ILE 92 HB ILE 92 31.126 12.148 8.624
719 HG12 ILE 92 1HG1 ILE 92 33.613 10.399 8.420
720 HG13 ILE 92 2HG1 ILE 92 32.107 10.091 7.553
721 HG21 ILE 92 1HG2 ILE 92 32.313 13.127 10.611
722 HG22 ILE 92 2HG2 ILE 92 33.725 12.104 10.261
723 HG23 ILE 92 3HG2 ILE 92 33.232 13.376 9.119
724 HD11 ILE 92 1HD1 ILE 92 33.962 12.473 7.170
725 HD12 ILE 92 2HD1 ILE 92 33.631 11.156 6.026
726 HD13 ILE 92 3HD1 ILE 92 32.354 12.331 6.416
727 H GLU 93 H GLU 93 31.633 10.734 12.678
728 HA GLU 93 HA GLU 93 29.448 12.658 13.033
729 HB2 GLU 93 1HB GLU 93 28.602 11.226 14.839
730 HB3 GLU 93 2HB GLU 93 28.439 10.486 13.256
731 HG2 GLU 93 1HG GLU 93 30.564 9.166 13.804
732 HG3 GLU 93 2HG GLU 93 30.389 9.756 15.465
733 H GLU 94 H GLU 94 29.730 13.860 15.002
734 HA GLU 94 HA GLU 94 32.330 13.482 16.399
735 HB2 GLU 94 1HB GLU 94 31.326 16.067 15.131
736 HB3 GLU 94 2HB GLU 94 32.721 15.941 16.205
737 HG2 GLU 94 1HG GLU 94 33.868 14.512 14.551
738 HG3 GLU 94 2HG GLU 94 32.476 14.667 13.460
739 H ASP 95 H ASP 95 32.314 14.314 18.523
740 HA ASP 95 HA ASP 95 30.046 15.950 19.380
741 HB2 ASP 95 1HB ASP 95 29.301 13.589 19.808
742 HB3 ASP 95 2HB ASP 95 30.698 13.390 20.877
743 H ILE 96 H ILE 96 31.271 17.598 19.892
744 HA ILE 96 HA ILE 96 33.567 17.175 21.748
745 HB ILE 96 HB ILE 96 34.438 19.359 20.926
746 HG12 ILE 96 1HG1 ILE 96 32.213 19.237 18.843
747 HG13 ILE 96 2HG1 ILE 96 32.140 20.256 20.282
748 HG21 ILE 96 1HG2 ILE 96 33.857 17.460 18.590
749 HG22 ILE 96 2HG2 ILE 96 35.245 18.556 18.764
750 HG23 ILE 96 3HG2 ILE 96 35.084 17.154 19.839
751 HD11 ILE 96 1HD1 ILE 96 34.158 20.477 18.011
752 HD12 ILE 96 2HD1 ILE 96 32.847 21.610 18.405
753 HD13 ILE 96 3HD1 ILE 96 34.224 21.430 19.516
754 H ARG 97 H ARG 97 30.640 17.349 22.304
755 HA ARG 97 HA ARG 97 30.270 20.002 23.524
756 HB2 ARG 97 1HB ARG 97 28.531 18.499 22.356
757 HB3 ARG 97 2HB ARG 97 28.506 17.556 23.843
758 HG2 ARG 97 1HG ARG 97 27.824 19.633 25.073
759 HG3 ARG 97 2HG ARG 97 27.768 20.477 23.508
760 HD2 ARG 97 1HD ARG 97 26.173 18.674 22.711
761 HD3 ARG 97 2HD ARG 97 26.125 18.074 24.375
762 HE ARG 97 HE ARG 97 24.878 19.944 25.032
763 HH11 ARG 97 1HH1 ARG 97 25.801 20.282 21.638
764 HH12 ARG 97 2HH1 ARG 97 24.687 21.597 21.369
765 HH21 ARG 97 1HH2 ARG 97 23.480 21.623 24.612
766 HH22 ARG 97 2HH2 ARG 97 23.390 22.330 23.022
767 H GLN 98 H GLN 98 32.376 19.372 24.739
768 HA GLN 98 HA GLN 98 33.431 19.170 26.739
769 HB2 GLN 98 1HB GLN 98 31.533 20.653 27.524
770 HB3 GLN 98 2HB GLN 98 30.697 19.210 28.097
771 HG2 GLN 98 1HG GLN 98 32.689 18.671 29.559
772 HG3 GLN 98 2HG GLN 98 33.451 20.174 29.033
773 HE21 GLN 98 1HE2 GLN 98 31.021 20.218 32.136
774 HE22 GLN 98 2HE2 GLN 98 31.873 18.828 31.510
775 HXT GLN 98 HO GLN 98 30.776 17.154 26.832
Start of MODEL 19
1 H1 SER 1 1H SER 1 25.439 34.952 18.887
2 H2 SER 1 2H SER 1 25.771 33.897 17.763
3 H3 SER 1 3H SER 1 24.740 33.551 18.974
4 HA SER 1 HA SER 1 24.050 35.380 16.770
5 HB2 SER 1 1HB SER 1 23.410 32.408 17.014
6 HB3 SER 1 2HB SER 1 23.006 33.487 15.652
7 HG SER 1 HG SER 1 25.289 33.805 15.345
8 H GLN 2 H GLN 2 22.999 36.722 18.214
9 HA GLN 2 HA GLN 2 20.829 35.757 19.884
10 HB2 GLN 2 1HB GLN 2 21.454 38.541 18.836
11 HB3 GLN 2 2HB GLN 2 20.259 38.167 20.084
12 HG2 GLN 2 1HG GLN 2 22.058 37.273 21.530
13 HG3 GLN 2 2HG GLN 2 23.253 37.693 20.291
14 HE21 GLN 2 1HE2 GLN 2 22.579 40.382 22.998
15 HE22 GLN 2 2HE2 GLN 2 22.517 38.643 23.160
16 H GLN 3 H GLN 3 21.164 36.379 16.534
17 HA GLN 3 HA GLN 3 18.249 35.974 16.166
18 HB2 GLN 3 1HB GLN 3 19.948 38.050 14.723
19 HB3 GLN 3 2HB GLN 3 18.333 37.544 14.224
20 HG2 GLN 3 1HG GLN 3 17.445 38.349 16.412
21 HG3 GLN 3 2HG GLN 3 19.055 38.986 16.787
22 HE21 GLN 3 1HE2 GLN 3 16.926 41.671 15.293
23 HE22 GLN 3 2HE2 GLN 3 16.765 40.594 16.659
24 H SER 4 H SER 4 17.776 34.941 14.183
25 HA SER 4 HA SER 4 20.026 34.070 12.491
26 HB2 SER 4 1HB SER 4 19.787 32.337 14.322
27 HB3 SER 4 2HB SER 4 18.134 32.038 13.744
28 HG SER 4 HG SER 4 19.096 30.679 12.452
29 H HIS 5 H HIS 5 16.602 33.518 13.238
30 HA HIS 5 HA HIS 5 14.668 33.648 12.061
31 HB2 HIS 5 1HB HIS 5 16.109 34.965 9.751
32 HB3 HIS 5 2HB HIS 5 14.393 35.026 10.148
33 HD1 HIS 5 HD1 HIS 5 17.549 36.838 10.650
34 HD2 HIS 5 HD2 HIS 5 13.879 36.546 12.601
35 HE1 HIS 5 HE1 HIS 5 17.387 38.829 12.218
36 H SER 6 H SER 6 13.595 32.539 10.121
37 HA SER 6 HA SER 6 15.390 30.577 8.839
38 HB2 SER 6 1HB SER 6 14.580 29.822 11.215
39 HB3 SER 6 2HB SER 6 13.021 29.554 10.409
40 HG SER 6 HG SER 6 15.241 28.046 10.416
41 H SER 7 H SER 7 14.496 29.496 7.101
42 HA SER 7 HA SER 7 11.693 29.882 6.352
43 HB2 SER 7 1HB SER 7 13.931 31.156 4.739
44 HB3 SER 7 2HB SER 7 12.269 30.914 4.154
45 HG SER 7 HG SER 7 12.353 32.093 6.622
46 HA PRO 8 HA PRO 8 13.709 26.032 4.792
47 HB2 PRO 8 1HB PRO 8 11.814 24.258 5.566
48 HB3 PRO 8 2HB PRO 8 12.966 24.936 6.753
49 HG2 PRO 8 1HG PRO 8 10.167 25.838 6.109
50 HG3 PRO 8 2HG PRO 8 10.874 25.430 7.703
51 HD2 PRO 8 1HD PRO 8 10.711 27.974 6.839
52 HD3 PRO 8 2HD PRO 8 12.119 27.392 7.797
53 H GLY 9 H GLY 9 12.794 24.352 3.258
54 HA2 GLY 9 1HA GLY 9 11.013 23.656 1.785
55 HA3 GLY 9 2HA GLY 9 10.336 25.287 1.842
56 H GLU 10 H GLU 10 13.748 24.485 1.352
57 HA GLU 10 HA GLU 10 13.906 26.111 -1.024
58 HB2 GLU 10 1HB GLU 10 16.013 24.098 -0.278
59 HB3 GLU 10 2HB GLU 10 16.204 25.708 -0.970
60 HG2 GLU 10 1HG GLU 10 16.912 26.160 1.130
61 HG3 GLU 10 2HG GLU 10 15.185 26.412 1.423
62 H ILE 11 H ILE 11 11.982 24.058 -1.477
63 HA ILE 11 HA ILE 11 13.201 21.979 -3.006
64 HB ILE 11 HB ILE 11 10.647 22.710 -1.828
65 HG12 ILE 11 1HG1 ILE 11 11.729 20.004 -2.628
66 HG13 ILE 11 2HG1 ILE 11 12.214 20.906 -1.183
67 HG21 ILE 11 1HG2 ILE 11 9.157 21.522 -3.360
68 HG22 ILE 11 2HG2 ILE 11 9.878 22.974 -4.072
69 HG23 ILE 11 3HG2 ILE 11 10.487 21.359 -4.527
70 HD11 ILE 11 1HD1 ILE 11 10.549 19.235 -0.562
71 HD12 ILE 11 2HD1 ILE 11 9.836 20.851 -0.380
72 HD13 ILE 11 3HD1 ILE 11 9.413 19.839 -1.787
73 H THR 12 H THR 12 12.545 25.026 -3.474
74 HA THR 12 HA THR 12 11.819 25.237 -6.255
75 HB THR 12 HB THR 12 12.883 27.548 -6.012
76 HG1 THR 12 HG1 THR 12 13.770 28.064 -4.066
77 HG21 THR 12 1HG2 THR 12 10.966 26.782 -3.764
78 HG22 THR 12 2HG2 THR 12 10.477 27.113 -5.445
79 HG23 THR 12 3HG2 THR 12 11.205 28.399 -4.458
80 H SER 13 H SER 13 14.774 24.586 -4.505
81 HA SER 13 HA SER 13 16.916 24.158 -5.179
82 HB2 SER 13 1HB SER 13 15.567 23.233 -7.742
83 HB3 SER 13 2HB SER 13 17.126 22.680 -7.086
84 HG SER 13 HG SER 13 14.524 22.303 -5.993
85 H SER 14 H SER 14 17.703 24.146 -8.118
86 HA SER 14 HA SER 14 19.005 25.596 -9.362
87 HB2 SER 14 1HB SER 14 16.699 25.522 -10.327
88 HB3 SER 14 2HB SER 14 16.346 27.052 -9.499
89 HG SER 14 HG SER 14 17.746 28.088 -10.775
90 HA PRO 15 HA PRO 15 19.633 29.152 -6.421
91 HB2 PRO 15 1HB PRO 15 22.187 28.652 -5.712
92 HB3 PRO 15 2HB PRO 15 20.804 27.865 -4.903
93 HG2 PRO 15 1HG PRO 15 22.510 26.822 -7.103
94 HG3 PRO 15 2HG PRO 15 22.126 26.060 -5.527
95 HD2 PRO 15 1HD PRO 15 20.749 25.431 -7.756
96 HD3 PRO 15 2HD PRO 15 19.917 25.588 -6.168
97 H GLN 16 H GLN 16 20.833 27.809 -9.149
98 HA GLN 16 HA GLN 16 21.719 28.530 -11.093
99 HB2 GLN 16 1HB GLN 16 20.388 30.682 -10.303
100 HB3 GLN 16 2HB GLN 16 22.019 31.362 -10.188
101 HG2 GLN 16 1HG GLN 16 22.428 30.759 -12.527
102 HG3 GLN 16 2HG GLN 16 20.827 30.005 -12.612
103 HE21 GLN 16 1HE2 GLN 16 20.960 34.116 -12.282
104 HE22 GLN 16 2HE2 GLN 16 22.118 33.140 -11.413
105 H GLY 17 H GLY 17 23.306 30.056 -8.277
106 HA2 GLY 17 1HA GLY 17 25.913 29.943 -9.586
107 HA3 GLY 17 2HA GLY 17 25.575 30.400 -7.917
108 H LEU 18 H LEU 18 24.206 27.368 -8.936
109 HA LEU 18 HA LEU 18 25.750 25.825 -7.106
110 HB2 LEU 18 1HB LEU 18 24.789 23.901 -8.070
111 HB3 LEU 18 2HB LEU 18 23.575 25.155 -7.931
112 HG LEU 18 HG LEU 18 24.426 25.533 -10.514
113 HD11 LEU 18 1HD1 LEU 18 24.398 22.547 -9.951
114 HD12 LEU 18 2HD1 LEU 18 25.866 23.511 -10.221
115 HD13 LEU 18 3HD1 LEU 18 24.662 23.347 -11.522
116 HD21 LEU 18 1HD2 LEU 18 22.332 24.383 -11.116
117 HD22 LEU 18 2HD2 LEU 18 22.125 25.459 -9.720
118 HD23 LEU 18 3HD2 LEU 18 22.242 23.701 -9.473
119 H ASP 19 H ASP 19 26.322 26.657 -10.481
120 HA ASP 19 HA ASP 19 28.711 24.917 -10.649
121 HB2 ASP 19 1HB ASP 19 27.108 25.323 -12.570
122 HB3 ASP 19 2HB ASP 19 27.659 27.007 -12.589
123 H ASN 20 H ASN 20 27.787 28.192 -9.964
124 HA ASN 20 HA ASN 20 30.627 29.095 -10.077
125 HB2 ASN 20 1HB ASN 20 28.003 30.625 -10.260
126 HB3 ASN 20 2HB ASN 20 29.594 31.376 -10.131
127 HD21 ASN 20 1HD2 ASN 20 30.567 30.591 -13.436
128 HD22 ASN 20 2HD2 ASN 20 31.211 30.620 -11.818
129 HA PRO 21 HA PRO 21 29.588 29.121 -5.572
130 HB2 PRO 21 1HB PRO 21 32.266 29.009 -4.809
131 HB3 PRO 21 2HB PRO 21 31.244 27.571 -5.050
132 HG2 PRO 21 1HG PRO 21 33.134 28.869 -6.932
133 HG3 PRO 21 2HG PRO 21 32.958 27.143 -6.542
134 HD2 PRO 21 1HD PRO 21 31.927 28.103 -8.763
135 HD3 PRO 21 2HD PRO 21 30.986 26.940 -7.761
136 H ALA 22 H ALA 22 32.019 30.869 -7.523
137 HA ALA 22 HA ALA 22 32.506 32.954 -5.654
138 HB1 ALA 22 1HB ALA 22 33.926 32.569 -7.631
139 HB2 ALA 22 2HB ALA 22 32.577 33.019 -8.706
140 HB3 ALA 22 3HB ALA 22 33.298 34.233 -7.622
141 H LEU 23 H LEU 23 30.077 32.660 -8.268
142 HA LEU 23 HA LEU 23 28.995 35.301 -7.764
143 HB2 LEU 23 1HB LEU 23 27.683 32.959 -9.181
144 HB3 LEU 23 2HB LEU 23 27.195 34.643 -9.266
145 HG LEU 23 HG LEU 23 29.700 33.415 -10.449
146 HD11 LEU 23 1HD1 LEU 23 27.245 34.664 -11.746
147 HD12 LEU 23 2HD1 LEU 23 27.556 32.918 -11.606
148 HD13 LEU 23 3HD1 LEU 23 28.631 33.932 -12.589
149 HD21 LEU 23 1HD2 LEU 23 30.239 35.679 -9.760
150 HD22 LEU 23 2HD2 LEU 23 28.794 36.294 -10.597
151 HD23 LEU 23 3HD2 LEU 23 30.122 35.548 -11.525
152 H LEU 24 H LEU 24 28.185 31.968 -6.760
153 HA LEU 24 HA LEU 24 25.680 32.681 -5.573
154 HB2 LEU 24 1HB LEU 24 26.440 30.372 -6.160
155 HB3 LEU 24 2HB LEU 24 27.550 30.413 -4.815
156 HG LEU 24 HG LEU 24 25.849 30.222 -3.231
157 HD11 LEU 24 1HD1 LEU 24 23.824 31.007 -5.365
158 HD12 LEU 24 2HD1 LEU 24 24.259 31.921 -3.896
159 HD13 LEU 24 3HD1 LEU 24 23.400 30.381 -3.754
160 HD21 LEU 24 1HD2 LEU 24 24.674 28.239 -3.861
161 HD22 LEU 24 2HD2 LEU 24 26.234 28.219 -4.711
162 HD23 LEU 24 3HD2 LEU 24 24.756 28.663 -5.586
163 H ARG 25 H ARG 25 29.015 32.479 -4.273
164 HA ARG 25 HA ARG 25 28.387 33.034 -1.555
165 HB2 ARG 25 1HB ARG 25 30.632 32.349 -2.458
166 HB3 ARG 25 2HB ARG 25 30.772 33.921 -3.224
167 HG2 ARG 25 1HG ARG 25 30.427 34.789 -0.730
168 HG3 ARG 25 2HG ARG 25 31.028 33.168 -0.338
169 HD2 ARG 25 1HD ARG 25 32.902 34.674 -0.431
170 HD3 ARG 25 2HD ARG 25 32.980 33.618 -1.859
171 HE ARG 25 HE ARG 25 31.581 35.760 -2.799
172 HH11 ARG 25 1HH1 ARG 25 34.669 35.603 -1.077
173 HH12 ARG 25 2HH1 ARG 25 35.267 37.040 -1.865
174 HH21 ARG 25 1HH2 ARG 25 32.373 37.624 -3.700
175 HH22 ARG 25 2HH2 ARG 25 33.988 38.161 -3.317
176 H ASP 26 H ASP 26 29.062 35.162 -4.343
177 HA ASP 26 HA ASP 26 28.927 37.594 -2.885
178 HB2 ASP 26 1HB ASP 26 29.640 36.850 -5.372
179 HB3 ASP 26 2HB ASP 26 28.063 37.543 -5.730
180 H MET 27 H MET 27 26.408 35.828 -4.743
181 HA MET 27 HA MET 27 24.316 37.735 -4.330
182 HB2 MET 27 1HB MET 27 24.304 35.782 -5.934
183 HB3 MET 27 2HB MET 27 24.052 34.720 -4.543
184 HG2 MET 27 1HG MET 27 21.941 35.925 -4.032
185 HG3 MET 27 2HG MET 27 22.202 36.938 -5.461
186 HE1 MET 27 1HE MET 27 20.918 32.478 -5.395
187 HE2 MET 27 2HE MET 27 22.271 33.087 -4.418
188 HE3 MET 27 3HE MET 27 20.618 33.654 -4.095
189 H LEU 28 H LEU 28 25.337 34.870 -2.450
190 HA LEU 28 HA LEU 28 23.235 34.952 -0.555
191 HB2 LEU 28 1HB LEU 28 25.950 33.787 -0.729
192 HB3 LEU 28 2HB LEU 28 25.165 33.849 0.846
193 HG LEU 28 HG LEU 28 23.702 32.724 -1.525
194 HD11 LEU 28 1HD1 LEU 28 25.817 31.594 -1.409
195 HD12 LEU 28 2HD1 LEU 28 24.520 30.530 -0.832
196 HD13 LEU 28 3HD1 LEU 28 25.613 31.319 0.331
197 HD21 LEU 28 1HD2 LEU 28 22.463 31.571 0.204
198 HD22 LEU 28 2HD2 LEU 28 22.545 33.293 0.615
199 HD23 LEU 28 3HD2 LEU 28 23.592 32.150 1.456
200 H LEU 29 H LEU 29 26.452 36.487 -0.597
201 HA LEU 29 HA LEU 29 26.338 37.534 2.079
202 HB2 LEU 29 1HB LEU 29 27.772 38.425 -0.437
203 HB3 LEU 29 2HB LEU 29 27.941 39.294 1.084
204 HG LEU 29 HG LEU 29 28.619 36.361 0.820
205 HD11 LEU 29 1HD1 LEU 29 29.968 37.578 -0.800
206 HD12 LEU 29 2HD1 LEU 29 30.972 37.057 0.569
207 HD13 LEU 29 3HD1 LEU 29 30.447 38.755 0.448
208 HD21 LEU 29 1HD2 LEU 29 29.999 36.783 2.811
209 HD22 LEU 29 2HD2 LEU 29 28.296 37.168 3.115
210 HD23 LEU 29 3HD2 LEU 29 29.463 38.479 2.826
211 H ALA 30 H ALA 30 25.118 38.680 -1.025
212 HA ALA 30 HA ALA 30 24.238 41.234 0.100
213 HB1 ALA 30 1HB ALA 30 23.696 39.943 -2.608
214 HB2 ALA 30 2HB ALA 30 23.379 41.639 -2.170
215 HB3 ALA 30 3HB ALA 30 25.053 41.033 -2.235
216 H ASN 31 H ASN 31 22.931 38.061 0.183
217 HA ASN 31 HA ASN 31 20.143 39.157 0.128
218 HB2 ASN 31 1HB ASN 31 20.867 37.399 -1.557
219 HB3 ASN 31 2HB ASN 31 20.974 36.278 -0.217
220 HD21 ASN 31 1HD2 ASN 31 17.579 36.465 -2.003
221 HD22 ASN 31 2HD2 ASN 31 19.202 36.582 -2.648
222 HA PRO 32 HA PRO 32 20.663 38.167 4.485
223 HB2 PRO 32 1HB PRO 32 18.434 39.448 5.442
224 HB3 PRO 32 2HB PRO 32 19.957 40.297 5.015
225 HG2 PRO 32 1HG PRO 32 17.491 39.909 3.322
226 HG3 PRO 32 2HG PRO 32 18.375 41.424 3.693
227 HD2 PRO 32 1HD PRO 32 18.815 40.130 1.414
228 HD3 PRO 32 2HD PRO 32 20.186 40.846 2.332
229 H HIS 33 H HIS 33 17.805 37.522 2.496
230 HA HIS 33 HA HIS 33 16.512 35.800 4.469
231 HB2 HIS 33 1HB HIS 33 15.270 37.002 2.704
232 HB3 HIS 33 2HB HIS 33 16.159 36.117 1.462
233 HD1 HIS 33 HD1 HIS 33 13.435 35.617 4.055
234 HD2 HIS 33 HD2 HIS 33 15.285 33.549 0.946
235 HE1 HIS 33 HE1 HIS 33 12.030 33.572 3.594
236 H GLU 34 H GLU 34 18.576 35.387 1.624
237 HA GLU 34 HA GLU 34 18.336 32.495 1.559
238 HB2 GLU 34 1HB GLU 34 19.713 34.660 0.116
239 HB3 GLU 34 2HB GLU 34 20.570 33.159 0.087
240 HG2 GLU 34 1HG GLU 34 17.679 33.427 -0.725
241 HG3 GLU 34 2HG GLU 34 19.034 33.608 -1.851
242 H LEU 35 H LEU 35 20.673 34.882 2.812
243 HA LEU 35 HA LEU 35 22.606 32.935 3.611
244 HB2 LEU 35 1HB LEU 35 23.802 34.613 4.399
245 HB3 LEU 35 2HB LEU 35 22.795 35.386 3.230
246 HG LEU 35 HG LEU 35 21.439 36.372 5.024
247 HD11 LEU 35 1HD1 LEU 35 22.589 36.605 7.254
248 HD12 LEU 35 2HD1 LEU 35 23.534 35.155 6.821
249 HD13 LEU 35 3HD1 LEU 35 21.761 35.071 6.963
250 HD21 LEU 35 1HD2 LEU 35 23.241 37.421 3.781
251 HD22 LEU 35 2HD2 LEU 35 24.431 36.775 4.925
252 HD23 LEU 35 3HD2 LEU 35 23.252 38.004 5.461
253 H SER 36 H SER 36 19.661 34.132 5.020
254 HA SER 36 HA SER 36 20.098 33.209 7.715
255 HB2 SER 36 1HB SER 36 18.484 34.961 7.316
256 HB3 SER 36 2HB SER 36 17.602 33.954 6.159
257 HG SER 36 HG SER 36 17.875 33.425 8.944
258 H LEU 37 H LEU 37 18.307 31.853 4.877
259 HA LEU 37 HA LEU 37 17.537 29.499 6.335
260 HB2 LEU 37 1HB LEU 37 16.787 28.638 4.361
261 HB3 LEU 37 2HB LEU 37 16.591 30.341 4.290
262 HG LEU 37 HG LEU 37 18.438 30.486 2.658
263 HD11 LEU 37 1HD1 LEU 37 17.999 27.498 2.685
264 HD12 LEU 37 2HD1 LEU 37 19.524 28.379 2.866
265 HD13 LEU 37 3HD1 LEU 37 18.703 28.378 1.303
266 HD21 LEU 37 1HD2 LEU 37 16.887 29.803 0.849
267 HD22 LEU 37 2HD2 LEU 37 16.097 30.755 2.120
268 HD23 LEU 37 3HD2 LEU 37 15.872 28.989 2.067
269 H LEU 38 H LEU 38 20.337 30.459 4.520
270 HA LEU 38 HA LEU 38 21.449 27.884 4.288
271 HB2 LEU 38 1HB LEU 38 21.995 29.922 3.059
272 HB3 LEU 38 2HB LEU 38 22.828 30.560 4.490
273 HG LEU 38 HG LEU 38 24.344 28.567 4.473
274 HD11 LEU 38 1HD1 LEU 38 22.980 27.047 3.195
275 HD12 LEU 38 2HD1 LEU 38 24.518 27.307 2.361
276 HD13 LEU 38 3HD1 LEU 38 23.047 28.118 1.777
277 HD21 LEU 38 1HD2 LEU 38 24.452 30.198 1.938
278 HD22 LEU 38 2HD2 LEU 38 25.806 29.379 2.744
279 HD23 LEU 38 3HD2 LEU 38 25.009 30.758 3.531
280 H LYS 39 H LYS 39 21.958 30.351 6.843
281 HA LYS 39 HA LYS 39 23.766 28.597 8.296
282 HB2 LYS 39 1HB LYS 39 23.363 30.112 10.239
283 HB3 LYS 39 2HB LYS 39 24.000 30.890 8.788
284 HG2 LYS 39 1HG LYS 39 21.990 31.998 8.343
285 HG3 LYS 39 2HG LYS 39 21.027 30.856 9.247
286 HD2 LYS 39 1HD LYS 39 20.964 32.778 10.505
287 HD3 LYS 39 2HD LYS 39 22.156 31.763 11.335
288 HE2 LYS 39 1HE LYS 39 23.978 33.026 10.284
289 HE3 LYS 39 2HE LYS 39 22.796 33.982 9.347
290 HZ1 LYS 39 1HZ LYS 39 22.938 33.887 12.313
291 HZ2 LYS 39 2HZ LYS 39 21.879 34.786 11.429
292 HZ3 LYS 39 3HZ LYS 39 23.492 35.131 11.378
293 H GLU 40 H GLU 40 20.286 28.823 8.156
294 HA GLU 40 HA GLU 40 19.871 27.255 10.578
295 HB2 GLU 40 1HB GLU 40 18.158 28.029 8.192
296 HB3 GLU 40 2HB GLU 40 17.551 27.020 9.507
297 HG2 GLU 40 1HG GLU 40 18.793 29.705 10.057
298 HG3 GLU 40 2HG GLU 40 17.111 29.544 9.540
299 H ARG 41 H ARG 41 19.559 26.569 7.047
300 HA ARG 41 HA ARG 41 19.108 23.722 7.624
301 HB2 ARG 41 1HB ARG 41 19.557 25.148 4.988
302 HB3 ARG 41 2HB ARG 41 18.905 23.523 5.189
303 HG2 ARG 41 1HG ARG 41 17.532 26.012 6.287
304 HG3 ARG 41 2HG ARG 41 17.259 25.374 4.675
305 HD2 ARG 41 1HD ARG 41 15.490 24.446 5.885
306 HD3 ARG 41 2HD ARG 41 16.673 23.134 5.852
307 HE ARG 41 HE ARG 41 16.957 23.325 8.150
308 HH11 ARG 41 1HH1 ARG 41 15.044 26.083 7.067
309 HH12 ARG 41 2HH1 ARG 41 14.626 26.542 8.699
310 HH21 ARG 41 1HH2 ARG 41 16.393 23.994 10.189
311 HH22 ARG 41 2HH2 ARG 41 15.371 25.384 10.415
312 H ASN 42 H ASN 42 21.833 25.690 6.575
313 HA ASN 42 HA ASN 42 23.503 23.203 6.486
314 HB2 ASN 42 1HB ASN 42 22.763 24.152 4.215
315 HB3 ASN 42 2HB ASN 42 23.840 25.489 4.533
316 HD21 ASN 42 1HD2 ASN 42 25.637 22.959 2.576
317 HD22 ASN 42 2HD2 ASN 42 24.295 24.044 2.376
318 HA PRO 43 HA PRO 43 25.401 26.662 8.948
319 HB2 PRO 43 1HB PRO 43 26.521 25.017 10.917
320 HB3 PRO 43 2HB PRO 43 24.972 25.911 11.030
321 HG2 PRO 43 1HG PRO 43 25.449 23.045 10.280
322 HG3 PRO 43 2HG PRO 43 24.210 23.747 11.361
323 HD2 PRO 43 1HD PRO 43 23.618 23.035 8.843
324 HD3 PRO 43 2HD PRO 43 22.923 24.527 9.569
325 HA PRO 44 HA PRO 44 29.598 24.812 8.252
326 HB2 PRO 44 1HB PRO 44 30.049 22.815 6.448
327 HB3 PRO 44 2HB PRO 44 29.766 22.507 8.191
328 HG2 PRO 44 1HG PRO 44 27.822 22.411 5.927
329 HG3 PRO 44 2HG PRO 44 28.161 21.179 7.180
330 HD2 PRO 44 1HD PRO 44 26.087 22.876 7.431
331 HD3 PRO 44 2HD PRO 44 27.076 22.414 8.857
332 H LEU 45 H LEU 45 27.271 24.720 5.439
333 HA LEU 45 HA LEU 45 29.283 25.969 3.715
334 HB2 LEU 45 1HB LEU 45 27.408 24.638 2.819
335 HB3 LEU 45 2HB LEU 45 26.286 25.870 3.389
336 HG LEU 45 HG LEU 45 27.151 27.488 1.812
337 HD11 LEU 45 1HD1 LEU 45 29.177 25.367 0.993
338 HD12 LEU 45 2HD1 LEU 45 29.531 26.938 1.748
339 HD13 LEU 45 3HD1 LEU 45 28.867 26.879 0.111
340 HD21 LEU 45 1HD2 LEU 45 26.780 24.813 0.405
341 HD22 LEU 45 2HD2 LEU 45 26.464 26.433 -0.261
342 HD23 LEU 45 3HD2 LEU 45 25.458 25.809 1.056
343 H ALA 46 H ALA 46 26.760 26.965 5.970
344 HA ALA 46 HA ALA 46 26.734 29.709 5.180
345 HB1 ALA 46 1HB ALA 46 25.086 28.599 6.630
346 HB2 ALA 46 2HB ALA 46 26.289 28.577 7.938
347 HB3 ALA 46 3HB ALA 46 25.707 30.130 7.289
348 H GLU 47 H GLU 47 28.679 28.093 7.803
349 HA GLU 47 HA GLU 47 29.967 30.500 8.566
350 HB2 GLU 47 1HB GLU 47 31.674 29.214 9.632
351 HB3 GLU 47 2HB GLU 47 30.065 28.588 9.980
352 HG2 GLU 47 1HG GLU 47 30.515 26.635 9.141
353 HG3 GLU 47 2HG GLU 47 31.243 27.284 7.684
354 H ALA 48 H ALA 48 30.745 28.300 5.952
355 HA ALA 48 HA ALA 48 33.160 29.368 5.123
356 HB1 ALA 48 1HB ALA 48 31.930 27.253 4.341
357 HB2 ALA 48 2HB ALA 48 30.979 28.331 3.297
358 HB3 ALA 48 3HB ALA 48 32.725 28.214 3.091
359 H LEU 49 H LEU 49 29.842 30.337 4.345
360 HA LEU 49 HA LEU 49 30.588 32.433 2.533
361 HB2 LEU 49 1HB LEU 49 28.303 31.425 2.721
362 HB3 LEU 49 2HB LEU 49 28.154 32.098 4.334
363 HG LEU 49 HG LEU 49 28.456 34.404 3.229
364 HD11 LEU 49 1HD1 LEU 49 29.201 33.625 1.065
365 HD12 LEU 49 2HD1 LEU 49 27.648 34.448 0.894
366 HD13 LEU 49 3HD1 LEU 49 27.716 32.676 0.849
367 HD21 LEU 49 1HD2 LEU 49 26.058 34.534 2.818
368 HD22 LEU 49 2HD2 LEU 49 26.387 33.552 4.259
369 HD23 LEU 49 3HD2 LEU 49 25.957 32.759 2.726
370 H LEU 50 H LEU 50 29.913 32.311 6.055
371 HA LEU 50 HA LEU 50 29.922 35.127 6.486
372 HB2 LEU 50 1HB LEU 50 30.891 33.081 8.497
373 HB3 LEU 50 2HB LEU 50 30.200 34.656 8.821
374 HG LEU 50 HG LEU 50 28.831 32.124 8.048
375 HD11 LEU 50 1HD1 LEU 50 29.308 32.452 10.362
376 HD12 LEU 50 2HD1 LEU 50 27.562 32.489 10.056
377 HD13 LEU 50 3HD1 LEU 50 28.444 34.015 10.336
378 HD21 LEU 50 1HD2 LEU 50 26.675 33.332 7.997
379 HD22 LEU 50 2HD2 LEU 50 27.735 33.650 6.616
380 HD23 LEU 50 3HD2 LEU 50 27.594 34.861 7.922
381 H SER 51 H SER 51 32.532 32.784 6.279
382 HA SER 51 HA SER 51 34.559 34.431 7.451
383 HB2 SER 51 1HB SER 51 34.705 32.132 5.508
384 HB3 SER 51 2HB SER 51 36.046 32.777 6.461
385 HG SER 51 HG SER 51 33.659 31.589 7.470
386 H GLY 52 H GLY 52 33.085 34.267 4.282
387 HA2 GLY 52 1HA GLY 52 33.358 35.792 2.539
388 HA3 GLY 52 2HA GLY 52 34.776 36.475 3.351
389 H ASP 53 H ASP 53 35.739 33.580 3.666
390 HA ASP 53 HA ASP 53 37.559 33.558 1.489
391 HB2 ASP 53 1HB ASP 53 37.873 32.354 3.721
392 HB3 ASP 53 2HB ASP 53 36.701 31.222 3.176
393 H LEU 54 H LEU 54 37.076 33.190 -0.590
394 HA LEU 54 HA LEU 54 34.729 31.747 -1.414
395 HB2 LEU 54 1HB LEU 54 35.887 33.454 -2.789
396 HB3 LEU 54 2HB LEU 54 37.270 32.382 -2.950
397 HG LEU 54 HG LEU 54 35.561 32.627 -4.851
398 HD11 LEU 54 1HD1 LEU 54 36.055 30.462 -5.749
399 HD12 LEU 54 2HD1 LEU 54 36.404 29.822 -4.132
400 HD13 LEU 54 3HD1 LEU 54 37.469 31.046 -4.849
401 HD21 LEU 54 1HD2 LEU 54 34.075 30.491 -3.330
402 HD22 LEU 54 2HD2 LEU 54 33.740 31.059 -4.966
403 HD23 LEU 54 3HD2 LEU 54 33.512 32.155 -3.590
404 H GLU 55 H GLU 55 38.143 30.869 -0.839
405 HA GLU 55 HA GLU 55 38.071 28.366 -2.170
406 HB2 GLU 55 1HB GLU 55 39.608 29.065 0.349
407 HB3 GLU 55 2HB GLU 55 39.963 27.736 -0.749
408 HG2 GLU 55 1HG GLU 55 40.017 30.653 -1.558
409 HG3 GLU 55 2HG GLU 55 41.401 29.765 -0.933
410 H LYS 56 H LYS 56 37.529 29.093 1.325
411 HA LYS 56 HA LYS 56 36.687 26.402 1.850
412 HB2 LYS 56 1HB LYS 56 36.188 26.998 4.019
413 HB3 LYS 56 2HB LYS 56 37.425 28.217 3.557
414 HG2 LYS 56 1HG LYS 56 35.487 29.713 3.160
415 HG3 LYS 56 2HG LYS 56 34.550 28.481 3.985
416 HD2 LYS 56 1HD LYS 56 37.116 29.290 5.285
417 HD3 LYS 56 2HD LYS 56 35.790 30.435 5.332
418 HE2 LYS 56 1HE LYS 56 34.319 28.749 6.359
419 HE3 LYS 56 2HE LYS 56 35.624 27.563 6.301
420 HZ1 LYS 56 1HZ LYS 56 35.295 28.573 8.466
421 HZ2 LYS 56 2HZ LYS 56 35.649 30.070 7.859
422 HZ3 LYS 56 3HZ LYS 56 36.816 28.898 7.888
423 H PHE 57 H PHE 57 34.819 29.322 0.863
424 HA PHE 57 HA PHE 57 32.281 28.091 1.132
425 HB2 PHE 57 1HB PHE 57 32.654 30.488 0.685
426 HB3 PHE 57 2HB PHE 57 33.164 30.089 -0.960
427 HD1 PHE 57 HD1 PHE 57 31.539 29.580 -2.674
428 HD2 PHE 57 HD2 PHE 57 30.300 30.083 1.412
429 HE1 PHE 57 HE1 PHE 57 29.163 29.648 -3.403
430 HE2 PHE 57 HE2 PHE 57 27.919 30.133 0.691
431 HZ PHE 57 HZ PHE 57 27.351 29.907 -1.725
432 H SER 58 H SER 58 34.395 28.172 -1.802
433 HA SER 58 HA SER 58 32.683 26.492 -3.340
434 HB2 SER 58 1HB SER 58 34.529 27.909 -4.238
435 HB3 SER 58 2HB SER 58 35.710 26.818 -3.487
436 HG SER 58 HG SER 58 34.928 25.150 -4.811
437 H ARG 59 H ARG 59 35.410 25.690 -1.167
438 HA ARG 59 HA ARG 59 35.554 22.921 -1.869
439 HB2 ARG 59 1HB ARG 59 37.286 24.092 -0.578
440 HB3 ARG 59 2HB ARG 59 36.152 24.358 0.747
441 HG2 ARG 59 1HG ARG 59 36.324 21.533 0.100
442 HG3 ARG 59 2HG ARG 59 37.928 22.211 0.436
443 HD2 ARG 59 1HD ARG 59 37.262 22.977 2.600
444 HD3 ARG 59 2HD ARG 59 35.543 22.753 2.223
445 HE ARG 59 HE ARG 59 35.692 20.464 2.582
446 HH11 ARG 59 1HH1 ARG 59 38.926 21.889 2.913
447 HH12 ARG 59 2HH1 ARG 59 39.582 20.436 3.612
448 HH21 ARG 59 1HH2 ARG 59 36.595 18.674 3.400
449 HH22 ARG 59 2HH2 ARG 59 38.274 18.641 3.915
450 H VAL 60 H VAL 60 33.626 24.632 0.641
451 HA VAL 60 HA VAL 60 32.442 22.132 1.524
452 HB VAL 60 HB VAL 60 31.556 25.008 2.035
453 HG11 VAL 60 1HG1 VAL 60 29.701 23.504 2.434
454 HG12 VAL 60 2HG1 VAL 60 30.751 22.361 3.308
455 HG13 VAL 60 3HG1 VAL 60 30.390 23.956 4.006
456 HG21 VAL 60 1HG2 VAL 60 33.841 24.494 2.904
457 HG22 VAL 60 2HG2 VAL 60 32.679 24.714 4.221
458 HG23 VAL 60 3HG2 VAL 60 33.195 23.074 3.749
459 H LEU 61 H LEU 61 31.603 24.661 -0.848
460 HA LEU 61 HA LEU 61 28.916 23.947 -1.292
461 HB2 LEU 61 1HB LEU 61 30.251 25.888 -2.289
462 HB3 LEU 61 2HB LEU 61 30.878 24.747 -3.467
463 HG LEU 61 HG LEU 61 28.163 24.363 -3.720
464 HD11 LEU 61 1HD1 LEU 61 27.822 26.258 -2.110
465 HD12 LEU 61 2HD1 LEU 61 27.106 26.532 -3.711
466 HD13 LEU 61 3HD1 LEU 61 28.638 27.329 -3.279
467 HD21 LEU 61 1HD2 LEU 61 28.320 25.449 -5.808
468 HD22 LEU 61 2HD2 LEU 61 29.983 24.906 -5.502
469 HD23 LEU 61 3HD2 LEU 61 29.523 26.604 -5.227
470 H VAL 62 H VAL 62 31.887 22.581 -2.839
471 HA VAL 62 HA VAL 62 30.283 20.758 -4.413
472 HB VAL 62 HB VAL 62 32.529 21.531 -5.133
473 HG11 VAL 62 1HG1 VAL 62 33.764 21.445 -3.036
474 HG12 VAL 62 2HG1 VAL 62 33.620 19.673 -2.988
475 HG13 VAL 62 3HG1 VAL 62 34.565 20.462 -4.266
476 HG21 VAL 62 1HG2 VAL 62 31.480 19.513 -6.095
477 HG22 VAL 62 2HG2 VAL 62 33.253 19.395 -6.079
478 HG23 VAL 62 3HG2 VAL 62 32.291 18.516 -4.867
479 H GLU 63 H GLU 63 31.923 20.475 -1.262
480 HA GLU 63 HA GLU 63 31.515 17.650 -0.951
481 HB2 GLU 63 1HB GLU 63 31.741 19.929 1.022
482 HB3 GLU 63 2HB GLU 63 31.518 18.254 1.542
483 HG2 GLU 63 1HG GLU 63 33.582 17.589 0.423
484 HG3 GLU 63 2HG GLU 63 33.812 19.234 -0.180
485 H GLN 64 H GLN 64 29.441 20.463 -0.197
486 HA GLN 64 HA GLN 64 27.339 18.894 1.001
487 HB2 GLN 64 1HB GLN 64 27.421 21.638 -0.287
488 HB3 GLN 64 2HB GLN 64 25.954 20.963 0.433
489 HG2 GLN 64 1HG GLN 64 28.568 21.334 1.932
490 HG3 GLN 64 2HG GLN 64 27.234 22.488 1.949
491 HE21 GLN 64 1HE2 GLN 64 27.223 19.694 4.673
492 HE22 GLN 64 2HE2 GLN 64 28.614 20.368 3.857
493 H GLN 65 H GLN 65 28.021 19.919 -2.368
494 HA GLN 65 HA GLN 65 25.519 18.927 -3.406
495 HB2 GLN 65 1HB GLN 65 28.230 19.383 -4.683
496 HB3 GLN 65 2HB GLN 65 26.848 18.737 -5.576
497 HG2 GLN 65 1HG GLN 65 25.534 20.754 -4.981
498 HG3 GLN 65 2HG GLN 65 26.955 21.429 -4.183
499 HE21 GLN 65 1HE2 GLN 65 28.039 22.907 -7.131
500 HE22 GLN 65 2HE2 GLN 65 27.915 22.923 -5.384
501 H GLN 66 H GLN 66 28.700 17.385 -2.791
502 HA GLN 66 HA GLN 66 28.008 14.891 -4.010
503 HB2 GLN 66 1HB GLN 66 29.964 15.596 -1.805
504 HB3 GLN 66 2HB GLN 66 29.810 13.973 -2.487
505 HG2 GLN 66 1HG GLN 66 30.416 14.783 -4.683
506 HG3 GLN 66 2HG GLN 66 30.461 16.442 -4.107
507 HE21 GLN 66 1HE2 GLN 66 33.688 16.278 -2.835
508 HE22 GLN 66 2HE2 GLN 66 32.241 17.224 -3.119
509 H ASP 67 H ASP 67 27.545 16.080 -0.618
510 HA ASP 67 HA ASP 67 26.486 13.534 0.269
511 HB2 ASP 67 1HB ASP 67 27.246 15.341 1.810
512 HB3 ASP 67 2HB ASP 67 25.828 16.269 1.349
513 H ARG 68 H ARG 68 24.997 16.497 -1.039
514 HA ARG 68 HA ARG 68 22.290 15.594 -0.688
515 HB2 ARG 68 1HB ARG 68 23.538 17.499 -2.689
516 HB3 ARG 68 2HB ARG 68 21.824 17.066 -2.741
517 HG2 ARG 68 1HG ARG 68 21.709 17.788 -0.286
518 HG3 ARG 68 2HG ARG 68 23.290 18.546 -0.544
519 HD2 ARG 68 1HD ARG 68 22.354 19.901 -2.372
520 HD3 ARG 68 2HD ARG 68 20.791 19.079 -2.190
521 HE ARG 68 HE ARG 68 21.768 20.393 0.241
522 HH11 ARG 68 1HH1 ARG 68 19.776 20.825 -2.650
523 HH12 ARG 68 2HH1 ARG 68 18.858 22.121 -1.930
524 HH21 ARG 68 1HH2 ARG 68 20.547 22.064 1.081
525 HH22 ARG 68 2HH2 ARG 68 19.280 22.800 0.140
526 H ALA 69 H ALA 69 24.653 15.082 -3.324
527 HA ALA 69 HA ALA 69 22.877 13.484 -4.905
528 HB1 ALA 69 1HB ALA 69 24.910 12.761 -6.073
529 HB2 ALA 69 2HB ALA 69 24.945 14.516 -5.778
530 HB3 ALA 69 3HB ALA 69 25.919 13.423 -4.765
531 H ARG 70 H ARG 70 25.017 12.591 -2.143
532 HA ARG 70 HA ARG 70 24.819 9.779 -2.705
533 HB2 ARG 70 1HB ARG 70 26.294 9.530 -0.992
534 HB3 ARG 70 2HB ARG 70 26.542 11.234 -1.335
535 HG2 ARG 70 1HG ARG 70 26.532 11.192 0.965
536 HG3 ARG 70 2HG ARG 70 24.878 11.662 0.590
537 HD2 ARG 70 1HD ARG 70 24.505 9.086 0.601
538 HD3 ARG 70 2HD ARG 70 25.920 9.119 1.665
539 HE ARG 70 HE ARG 70 24.472 11.009 2.849
540 HH11 ARG 70 1HH1 ARG 70 23.252 7.964 1.523
541 HH12 ARG 70 2HH1 ARG 70 21.890 7.902 2.624
542 HH21 ARG 70 1HH2 ARG 70 22.719 10.845 4.240
543 HH22 ARG 70 2HH2 ARG 70 21.604 9.500 4.115
544 H ARG 71 H ARG 71 23.019 12.064 -0.682
545 HA ARG 71 HA ARG 71 21.342 9.925 0.420
546 HB2 ARG 71 1HB ARG 71 20.213 11.538 1.609
547 HB3 ARG 71 2HB ARG 71 21.856 12.168 1.503
548 HG2 ARG 71 1HG ARG 71 21.130 13.683 -0.287
549 HG3 ARG 71 2HG ARG 71 19.474 13.070 -0.128
550 HD2 ARG 71 1HD ARG 71 19.542 13.753 2.274
551 HD3 ARG 71 2HD ARG 71 21.127 14.494 1.960
552 HE ARG 71 HE ARG 71 18.996 15.362 0.153
553 HH11 ARG 71 1HH1 ARG 71 20.682 16.067 3.175
554 HH12 ARG 71 2HH1 ARG 71 20.130 17.719 3.208
555 HH21 ARG 71 1HH2 ARG 71 18.330 17.479 0.257
556 HH22 ARG 71 2HH2 ARG 71 18.824 18.505 1.577
557 H GLU 72 H GLU 72 21.276 12.005 -2.365
558 HA GLU 72 HA GLU 72 18.585 11.819 -3.124
559 HB2 GLU 72 1HB GLU 72 20.810 12.787 -4.326
560 HB3 GLU 72 2HB GLU 72 20.612 11.305 -5.248
561 HG2 GLU 72 1HG GLU 72 19.382 12.700 -6.531
562 HG3 GLU 72 2HG GLU 72 18.113 12.168 -5.416
563 H GLN 73 H GLN 73 21.170 9.384 -3.341
564 HA GLN 73 HA GLN 73 19.890 7.559 -5.053
565 HB2 GLN 73 1HB GLN 73 21.689 6.867 -2.704
566 HB3 GLN 73 2HB GLN 73 21.394 5.884 -4.142
567 HG2 GLN 73 1HG GLN 73 22.859 8.538 -3.998
568 HG3 GLN 73 2HG GLN 73 23.559 6.952 -4.329
569 HE21 GLN 73 1HE2 GLN 73 22.431 9.203 -7.359
570 HE22 GLN 73 2HE2 GLN 73 22.822 9.760 -5.744
571 H GLU 74 H GLU 74 19.612 7.786 -1.466
572 HA GLU 74 HA GLU 74 17.834 5.467 -1.384
573 HB2 GLU 74 1HB GLU 74 17.446 6.210 1.005
574 HB3 GLU 74 2HB GLU 74 19.102 5.781 0.573
575 HG2 GLU 74 1HG GLU 74 19.657 8.168 0.336
576 HG3 GLU 74 2HG GLU 74 18.016 8.596 0.852
577 H ARG 75 H ARG 75 17.472 8.977 -1.690
578 HA ARG 75 HA ARG 75 14.648 8.968 -1.070
579 HB2 ARG 75 1HB ARG 75 16.318 10.988 -2.606
580 HB3 ARG 75 2HB ARG 75 14.668 11.245 -2.031
581 HG2 ARG 75 1HG ARG 75 16.021 10.369 0.251
582 HG3 ARG 75 2HG ARG 75 17.215 11.378 -0.569
583 HD2 ARG 75 1HD ARG 75 15.913 12.673 1.038
584 HD3 ARG 75 2HD ARG 75 15.662 13.251 -0.617
585 HE ARG 75 HE ARG 75 13.438 12.672 -0.482
586 HH11 ARG 75 1HH1 ARG 75 15.059 10.992 2.202
587 HH12 ARG 75 2HH1 ARG 75 13.525 10.504 2.900
588 HH21 ARG 75 1HH2 ARG 75 11.587 11.978 0.480
589 HH22 ARG 75 2HH2 ARG 75 11.640 11.019 1.938
590 H ILE 76 H ILE 76 16.407 8.889 -4.210
591 HA ILE 76 HA ILE 76 13.956 8.966 -5.747
592 HB ILE 76 HB ILE 76 15.299 8.319 -7.687
593 HG12 ILE 76 1HG1 ILE 76 17.577 7.844 -5.732
594 HG13 ILE 76 2HG1 ILE 76 16.698 6.595 -6.597
595 HG21 ILE 76 1HG2 ILE 76 16.853 10.315 -5.979
596 HG22 ILE 76 2HG2 ILE 76 16.775 10.252 -7.750
597 HG23 ILE 76 3HG2 ILE 76 15.330 10.679 -6.816
598 HD11 ILE 76 1HD1 ILE 76 18.808 6.951 -7.706
599 HD12 ILE 76 2HD1 ILE 76 17.523 7.584 -8.761
600 HD13 ILE 76 3HD1 ILE 76 18.531 8.702 -7.805
601 H ARG 77 H ARG 77 15.484 6.504 -3.926
602 HA ARG 77 HA ARG 77 14.796 4.221 -5.469
603 HB2 ARG 77 1HB ARG 77 16.248 4.717 -3.229
604 HB3 ARG 77 2HB ARG 77 14.800 4.024 -2.498
605 HG2 ARG 77 1HG ARG 77 16.321 2.254 -2.818
606 HG3 ARG 77 2HG ARG 77 15.085 2.069 -4.075
607 HD2 ARG 77 1HD ARG 77 16.575 3.143 -5.718
608 HD3 ARG 77 2HD ARG 77 17.802 3.395 -4.465
609 HE ARG 77 HE ARG 77 17.088 0.869 -5.801
610 HH11 ARG 77 1HH1 ARG 77 18.947 2.387 -3.213
611 HH12 ARG 77 2HH1 ARG 77 19.980 0.998 -3.012
612 HH21 ARG 77 1HH2 ARG 77 18.444 -0.862 -5.493
613 HH22 ARG 77 2HH2 ARG 77 19.708 -0.803 -4.296
614 H LEU 78 H LEU 78 12.785 6.276 -3.624
615 HA LEU 78 HA LEU 78 10.610 6.243 -3.005
616 HB2 LEU 78 1HB LEU 78 10.569 5.791 -5.463
617 HB3 LEU 78 2HB LEU 78 10.428 4.104 -5.105
618 HG LEU 78 HG LEU 78 8.155 4.489 -4.182
619 HD11 LEU 78 1HD1 LEU 78 7.076 6.693 -4.550
620 HD12 LEU 78 2HD1 LEU 78 8.645 7.364 -5.058
621 HD13 LEU 78 3HD1 LEU 78 8.411 6.798 -3.386
622 HD21 LEU 78 1HD2 LEU 78 7.085 4.989 -6.330
623 HD22 LEU 78 2HD2 LEU 78 8.479 3.907 -6.541
624 HD23 LEU 78 3HD2 LEU 78 8.623 5.633 -6.956
625 H PHE 79 H PHE 79 8.723 4.276 -2.660
626 HA PHE 79 HA PHE 79 7.898 2.850 -1.250
627 HB2 PHE 79 1HB PHE 79 10.469 1.410 -1.596
628 HB3 PHE 79 2HB PHE 79 8.930 0.711 -1.092
629 HD1 PHE 79 HD1 PHE 79 6.934 0.955 -2.767
630 HD2 PHE 79 HD2 PHE 79 11.067 1.448 -3.851
631 HE1 PHE 79 HE1 PHE 79 6.346 0.582 -5.160
632 HE2 PHE 79 HE2 PHE 79 10.492 1.095 -6.245
633 HZ PHE 79 HZ PHE 79 8.124 0.669 -6.908
634 H SER 80 H SER 80 10.986 3.790 -0.137
635 HA SER 80 HA SER 80 9.904 3.840 2.640
636 HB2 SER 80 1HB SER 80 12.694 2.840 1.927
637 HB3 SER 80 2HB SER 80 11.978 2.938 3.553
638 HG SER 80 HG SER 80 10.271 1.516 2.515
639 H ALA 81 H ALA 81 10.337 5.660 0.397
640 HA ALA 81 HA ALA 81 12.578 7.385 1.226
641 HB1 ALA 81 1HB ALA 81 12.185 6.991 -1.178
642 HB2 ALA 81 2HB ALA 81 10.543 7.671 -1.028
643 HB3 ALA 81 3HB ALA 81 11.965 8.704 -0.769
644 H ASP 82 H ASP 82 10.870 7.192 3.301
645 HA ASP 82 HA ASP 82 8.733 9.098 3.334
646 HB2 ASP 82 1HB ASP 82 10.442 7.805 5.484
647 HB3 ASP 82 2HB ASP 82 9.109 8.908 5.856
648 HA PRO 83 HA PRO 83 11.094 12.773 3.617
649 HB2 PRO 83 1HB PRO 83 9.593 14.454 5.143
650 HB3 PRO 83 2HB PRO 83 9.046 13.919 3.521
651 HG2 PRO 83 1HG PRO 83 8.365 12.787 6.213
652 HG3 PRO 83 2HG PRO 83 7.254 13.329 4.911
653 HD2 PRO 83 1HD PRO 83 7.905 10.717 5.187
654 HD3 PRO 83 2HD PRO 83 7.760 11.455 3.554
655 H PHE 84 H PHE 84 12.386 14.094 5.031
656 HA PHE 84 HA PHE 84 12.871 12.845 7.692
657 HB2 PHE 84 1HB PHE 84 15.273 13.166 7.303
658 HB3 PHE 84 2HB PHE 84 14.574 12.164 6.025
659 HD1 PHE 84 HD1 PHE 84 16.167 15.381 6.826
660 HD2 PHE 84 HD2 PHE 84 14.255 13.087 3.732
661 HE1 PHE 84 HE1 PHE 84 17.038 16.969 5.120
662 HE2 PHE 84 HE2 PHE 84 15.118 14.674 2.014
663 HZ PHE 84 HZ PHE 84 16.515 16.618 2.707
664 H ASP 85 H ASP 85 11.504 15.339 6.499
665 HA ASP 85 HA ASP 85 12.374 17.202 8.545
666 HB2 ASP 85 1HB ASP 85 13.896 17.594 6.466
667 HB3 ASP 85 2HB ASP 85 12.414 18.154 5.658
668 H LEU 86 H LEU 86 10.489 17.941 9.264
669 HA LEU 86 HA LEU 86 8.067 17.375 7.742
670 HB2 LEU 86 1HB LEU 86 8.607 18.584 10.435
671 HB3 LEU 86 2HB LEU 86 6.987 18.351 9.776
672 HG LEU 86 HG LEU 86 8.989 16.148 10.387
673 HD11 LEU 86 1HD1 LEU 86 8.070 17.235 12.399
674 HD12 LEU 86 2HD1 LEU 86 7.455 15.579 12.221
675 HD13 LEU 86 3HD1 LEU 86 6.416 16.963 11.798
676 HD21 LEU 86 1HD2 LEU 86 7.574 15.447 8.548
677 HD22 LEU 86 2HD2 LEU 86 6.115 16.033 9.382
678 HD23 LEU 86 3HD2 LEU 86 7.015 14.636 10.019
679 H GLU 87 H GLU 87 9.955 20.233 8.671
680 HA GLU 87 HA GLU 87 7.829 22.035 7.778
681 HB2 GLU 87 1HB GLU 87 9.355 23.813 8.374
682 HB3 GLU 87 2HB GLU 87 9.161 22.635 9.658
683 HG2 GLU 87 1HG GLU 87 11.351 21.726 9.280
684 HG3 GLU 87 2HG GLU 87 11.579 22.770 7.863
685 H ALA 88 H ALA 88 10.858 20.850 6.557
686 HA ALA 88 HA ALA 88 10.930 22.626 4.278
687 HB1 ALA 88 1HB ALA 88 12.866 21.454 3.568
688 HB2 ALA 88 2HB ALA 88 12.936 21.562 5.342
689 HB3 ALA 88 3HB ALA 88 12.445 20.042 4.556
690 H GLN 89 H GLN 89 8.397 21.263 4.386
691 HA GLN 89 HA GLN 89 8.542 19.547 1.932
692 HB2 GLN 89 1HB GLN 89 6.383 19.777 4.055
693 HB3 GLN 89 2HB GLN 89 6.285 18.780 2.595
694 HG2 GLN 89 1HG GLN 89 8.312 17.545 3.350
695 HG3 GLN 89 2HG GLN 89 8.285 18.481 4.850
696 HE21 GLN 89 1HE2 GLN 89 6.581 15.654 6.064
697 HE22 GLN 89 2HE2 GLN 89 8.128 16.480 5.948
698 H ALA 90 H ALA 90 6.997 19.837 0.269
699 HA ALA 90 HA ALA 90 5.369 22.287 0.267
700 HB1 ALA 90 1HB ALA 90 6.383 23.128 -1.823
701 HB2 ALA 90 2HB ALA 90 7.624 23.036 -0.550
702 HB3 ALA 90 3HB ALA 90 7.551 21.788 -1.816
703 H LYS 91 H LYS 91 4.189 22.308 -1.975
704 HA LYS 91 HA LYS 91 2.900 19.737 -2.346
705 HB2 LYS 91 1HB LYS 91 2.882 22.321 -3.947
706 HB3 LYS 91 2HB LYS 91 1.894 20.920 -4.362
707 HG2 LYS 91 1HG LYS 91 0.660 21.084 -2.292
708 HG3 LYS 91 2HG LYS 91 1.708 22.394 -1.712
709 HD2 LYS 91 1HD LYS 91 0.241 22.671 -4.338
710 HD3 LYS 91 2HD LYS 91 -0.611 22.977 -2.810
711 HE2 LYS 91 1HE LYS 91 0.657 24.856 -2.309
712 HE3 LYS 91 2HE LYS 91 2.064 24.282 -3.226
713 HZ1 LYS 91 1HZ LYS 91 0.949 24.781 -5.263
714 HZ2 LYS 91 2HZ LYS 91 0.957 26.130 -4.321
715 HZ3 LYS 91 3HZ LYS 91 -0.433 25.251 -4.480
716 H ILE 92 H ILE 92 2.961 18.425 -4.228
717 HA ILE 92 HA ILE 92 5.525 18.536 -5.711
718 HB ILE 92 HB ILE 92 3.270 16.503 -5.928
719 HG12 ILE 92 1HG1 ILE 92 5.903 16.233 -4.427
720 HG13 ILE 92 2HG1 ILE 92 4.354 16.570 -3.651
721 HG21 ILE 92 1HG2 ILE 92 4.759 16.667 -7.945
722 HG22 ILE 92 2HG2 ILE 92 6.175 16.374 -6.908
723 HG23 ILE 92 3HG2 ILE 92 4.944 15.107 -7.128
724 HD11 ILE 92 1HD1 ILE 92 4.812 14.218 -3.395
725 HD12 ILE 92 2HD1 ILE 92 3.472 14.383 -4.553
726 HD13 ILE 92 3HD1 ILE 92 5.118 14.022 -5.134
727 H GLU 93 H GLU 93 5.192 20.380 -6.912
728 HA GLU 93 HA GLU 93 3.221 20.195 -9.091
729 HB2 GLU 93 1HB GLU 93 2.721 22.554 -8.757
730 HB3 GLU 93 2HB GLU 93 2.222 21.600 -7.372
731 HG2 GLU 93 1HG GLU 93 4.365 22.357 -6.233
732 HG3 GLU 93 2HG GLU 93 4.595 23.484 -7.580
733 H GLU 94 H GLU 94 3.934 21.565 -10.927
734 HA GLU 94 HA GLU 94 6.757 22.368 -10.897
735 HB2 GLU 94 1HB GLU 94 7.294 20.832 -12.717
736 HB3 GLU 94 2HB GLU 94 6.705 19.952 -11.303
737 HG2 GLU 94 1HG GLU 94 5.351 18.845 -12.668
738 HG3 GLU 94 2HG GLU 94 4.383 20.320 -12.771
739 H ASP 95 H ASP 95 7.375 23.289 -13.045
740 HA ASP 95 HA ASP 95 5.165 24.143 -14.787
741 HB2 ASP 95 1HB ASP 95 5.318 25.853 -12.926
742 HB3 ASP 95 2HB ASP 95 6.974 26.198 -13.444
743 H ILE 96 H ILE 96 6.711 22.419 -15.827
744 HA ILE 96 HA ILE 96 9.345 23.429 -16.602
745 HB ILE 96 HB ILE 96 9.618 21.319 -17.841
746 HG12 ILE 96 1HG1 ILE 96 6.768 20.631 -17.028
747 HG13 ILE 96 2HG1 ILE 96 7.222 21.128 -18.643
748 HG21 ILE 96 1HG2 ILE 96 8.320 20.789 -15.121
749 HG22 ILE 96 2HG2 ILE 96 9.597 19.839 -15.908
750 HG23 ILE 96 3HG2 ILE 96 9.949 21.477 -15.324
751 HD11 ILE 96 1HD1 ILE 96 8.098 18.601 -17.198
752 HD12 ILE 96 2HD1 ILE 96 7.046 18.731 -18.621
753 HD13 ILE 96 3HD1 ILE 96 8.772 19.138 -18.760
754 H ARG 97 H ARG 97 7.562 25.284 -17.441
755 HA ARG 97 HA ARG 97 6.683 25.005 -20.148
756 HB2 ARG 97 1HB ARG 97 6.124 27.335 -19.977
757 HB3 ARG 97 2HB ARG 97 5.830 26.583 -18.405
758 HG2 ARG 97 1HG ARG 97 8.255 27.425 -17.823
759 HG3 ARG 97 2HG ARG 97 8.026 28.504 -19.210
760 HD2 ARG 97 1HD ARG 97 6.306 28.305 -16.738
761 HD3 ARG 97 2HD ARG 97 7.392 29.630 -17.151
762 HE ARG 97 HE ARG 97 5.840 29.875 -19.211
763 HH11 ARG 97 1HH1 ARG 97 4.661 28.796 -16.039
764 HH12 ARG 97 2HH1 ARG 97 3.067 29.443 -16.338
765 HH21 ARG 97 1HH2 ARG 97 3.786 30.661 -19.486
766 HH22 ARG 97 2HH2 ARG 97 2.583 30.463 -18.241
767 H GLN 98 H GLN 98 9.694 24.752 -19.531
768 HA GLN 98 HA GLN 98 10.601 26.034 -22.038
769 HB2 GLN 98 1HB GLN 98 12.150 26.349 -19.408
770 HB3 GLN 98 2HB GLN 98 12.765 26.752 -21.011
771 HG2 GLN 98 1HG GLN 98 10.796 28.362 -21.278
772 HG3 GLN 98 2HG GLN 98 10.414 28.081 -19.578
773 HE21 GLN 98 1HE2 GLN 98 12.938 30.927 -20.427
774 HE22 GLN 98 2HE2 GLN 98 11.640 30.327 -21.429
775 HXT GLN 98 HO GLN 98 12.132 22.769 -20.618
Start of MODEL 20
1 H1 SER 1 1H SER 1 6.146 37.564 10.981
2 H2 SER 1 2H SER 1 6.441 38.252 9.666
3 H3 SER 1 3H SER 1 7.646 37.877 10.743
4 HA SER 1 HA SER 1 7.856 36.676 8.598
5 HB2 SER 1 1HB SER 1 7.513 34.952 11.107
6 HB3 SER 1 2HB SER 1 8.536 34.614 9.701
7 HG SER 1 HG SER 1 9.833 35.579 11.239
8 H GLN 2 H GLN 2 5.385 37.296 8.122
9 HA GLN 2 HA GLN 2 3.522 35.110 8.210
10 HB2 GLN 2 1HB GLN 2 3.618 37.494 6.341
11 HB3 GLN 2 2HB GLN 2 2.233 36.442 6.596
12 HG2 GLN 2 1HG GLN 2 1.583 38.023 8.078
13 HG3 GLN 2 2HG GLN 2 2.737 37.234 9.171
14 HE21 GLN 2 1HE2 GLN 2 3.209 41.072 8.279
15 HE22 GLN 2 2HE2 GLN 2 1.752 40.146 8.073
16 H GLN 3 H GLN 3 3.096 33.499 6.769
17 HA GLN 3 HA GLN 3 5.221 32.805 4.923
18 HB2 GLN 3 1HB GLN 3 3.860 30.827 4.467
19 HB3 GLN 3 2HB GLN 3 4.084 31.066 6.200
20 HG2 GLN 3 1HG GLN 3 1.853 31.577 6.561
21 HG3 GLN 3 2HG GLN 3 1.603 32.166 4.918
22 HE21 GLN 3 1HE2 GLN 3 0.489 28.479 5.791
23 HE22 GLN 3 2HE2 GLN 3 0.746 29.765 6.948
24 H SER 4 H SER 4 4.811 32.135 2.685
25 HA SER 4 HA SER 4 3.428 34.277 1.249
26 HB2 SER 4 1HB SER 4 4.999 31.962 0.092
27 HB3 SER 4 2HB SER 4 4.712 33.561 -0.631
28 HG SER 4 HG SER 4 5.976 34.456 1.059
29 H HIS 5 H HIS 5 2.133 31.563 2.433
30 HA HIS 5 HA HIS 5 0.408 30.167 1.866
31 HB2 HIS 5 1HB HIS 5 -0.307 32.187 -0.277
32 HB3 HIS 5 2HB HIS 5 -1.380 31.076 0.584
33 HD1 HIS 5 HD1 HIS 5 0.189 34.455 0.821
34 HD2 HIS 5 HD2 HIS 5 -1.890 31.833 3.306
35 HE1 HIS 5 HE1 HIS 5 -0.518 35.779 2.860
36 H SER 6 H SER 6 2.816 29.450 0.832
37 HA SER 6 HA SER 6 2.129 28.188 -1.778
38 HB2 SER 6 1HB SER 6 4.720 29.663 -1.136
39 HB3 SER 6 2HB SER 6 4.403 28.719 -2.599
40 HG SER 6 HG SER 6 2.773 30.912 -1.820
41 H SER 7 H SER 7 3.919 26.486 -2.234
42 HA SER 7 HA SER 7 4.716 25.204 0.356
43 HB2 SER 7 1HB SER 7 4.234 23.932 -2.357
44 HB3 SER 7 2HB SER 7 4.657 23.071 -0.863
45 HG SER 7 HG SER 7 2.468 24.771 -0.690
46 HA PRO 8 HA PRO 8 8.598 26.288 -1.892
47 HB2 PRO 8 1HB PRO 8 10.011 27.431 0.102
48 HB3 PRO 8 2HB PRO 8 8.708 28.327 -0.756
49 HG2 PRO 8 1HG PRO 8 8.587 26.859 1.886
50 HG3 PRO 8 2HG PRO 8 8.039 28.520 1.490
51 HD2 PRO 8 1HD PRO 8 6.349 26.361 1.543
52 HD3 PRO 8 2HD PRO 8 6.128 27.747 0.418
53 H GLY 9 H GLY 9 8.772 23.931 -1.992
54 HA2 GLY 9 1HA GLY 9 10.620 22.842 0.102
55 HA3 GLY 9 2HA GLY 9 9.403 21.881 -0.750
56 H GLU 10 H GLU 10 9.658 22.017 -3.263
57 HA GLU 10 HA GLU 10 12.322 20.935 -3.687
58 HB2 GLU 10 1HB GLU 10 9.909 21.127 -5.521
59 HB3 GLU 10 2HB GLU 10 11.372 20.194 -5.849
60 HG2 GLU 10 1HG GLU 10 10.953 18.849 -3.815
61 HG3 GLU 10 2HG GLU 10 9.421 19.703 -3.589
62 H ILE 11 H ILE 11 12.166 23.921 -3.491
63 HA ILE 11 HA ILE 11 12.636 24.878 -6.138
64 HB ILE 11 HB ILE 11 13.664 26.542 -4.023
65 HG12 ILE 11 1HG1 ILE 11 11.255 27.028 -3.096
66 HG13 ILE 11 2HG1 ILE 11 11.010 25.320 -3.363
67 HG21 ILE 11 1HG2 ILE 11 12.853 27.290 -6.223
68 HG22 ILE 11 2HG2 ILE 11 11.210 26.812 -5.735
69 HG23 ILE 11 3HG2 ILE 11 12.041 28.146 -4.891
70 HD11 ILE 11 1HD1 ILE 11 13.048 24.852 -1.916
71 HD12 ILE 11 2HD1 ILE 11 13.224 26.606 -1.678
72 HD13 ILE 11 3HD1 ILE 11 11.791 25.775 -1.053
73 H THR 12 H THR 12 14.355 22.948 -4.261
74 HA THR 12 HA THR 12 16.965 24.293 -4.577
75 HB THR 12 HB THR 12 17.830 22.464 -3.238
76 HG1 THR 12 HG1 THR 12 16.131 20.960 -3.923
77 HG21 THR 12 1HG2 THR 12 15.343 23.670 -1.971
78 HG22 THR 12 2HG2 THR 12 16.867 24.557 -2.204
79 HG23 THR 12 3HG2 THR 12 16.825 23.133 -1.141
80 H SER 13 H SER 13 16.892 24.104 -6.853
81 HA SER 13 HA SER 13 18.403 21.740 -7.716
82 HB2 SER 13 1HB SER 13 16.023 21.098 -8.179
83 HB3 SER 13 2HB SER 13 15.848 22.591 -9.137
84 HG SER 13 HG SER 13 16.343 20.709 -10.414
85 H SER 14 H SER 14 19.559 22.192 -9.653
86 HA SER 14 HA SER 14 21.062 23.680 -10.678
87 HB2 SER 14 1HB SER 14 18.349 24.430 -11.818
88 HB3 SER 14 2HB SER 14 19.938 24.633 -12.623
89 HG SER 14 HG SER 14 18.729 22.642 -13.118
90 HA PRO 15 HA PRO 15 20.209 27.612 -8.308
91 HB2 PRO 15 1HB PRO 15 22.599 27.836 -7.057
92 HB3 PRO 15 2HB PRO 15 21.300 26.779 -6.456
93 HG2 PRO 15 1HG PRO 15 23.634 26.060 -8.162
94 HG3 PRO 15 2HG PRO 15 23.123 25.335 -6.600
95 HD2 PRO 15 1HD PRO 15 22.399 24.193 -8.931
96 HD3 PRO 15 2HD PRO 15 21.220 24.306 -7.573
97 H GLN 16 H GLN 16 22.207 26.576 -10.652
98 HA GLN 16 HA GLN 16 23.364 27.456 -12.366
99 HB2 GLN 16 1HB GLN 16 21.438 29.204 -12.146
100 HB3 GLN 16 2HB GLN 16 22.724 30.277 -11.609
101 HG2 GLN 16 1HG GLN 16 23.947 29.861 -13.679
102 HG3 GLN 16 2HG GLN 16 22.716 28.706 -14.178
103 HE21 GLN 16 1HE2 GLN 16 20.605 31.103 -15.538
104 HE22 GLN 16 2HE2 GLN 16 21.006 29.429 -15.307
105 H GLY 17 H GLY 17 23.909 29.187 -9.283
106 HA2 GLY 17 1HA GLY 17 26.693 29.713 -9.966
107 HA3 GLY 17 2HA GLY 17 25.935 29.908 -8.389
108 H LEU 18 H LEU 18 25.483 26.833 -9.900
109 HA LEU 18 HA LEU 18 26.888 25.446 -7.836
110 HB2 LEU 18 1HB LEU 18 26.402 23.425 -9.100
111 HB3 LEU 18 2HB LEU 18 24.993 24.454 -8.954
112 HG LEU 18 HG LEU 18 26.059 25.222 -11.406
113 HD11 LEU 18 1HD1 LEU 18 27.600 23.287 -11.275
114 HD12 LEU 18 2HD1 LEU 18 26.445 23.130 -12.615
115 HD13 LEU 18 3HD1 LEU 18 26.210 22.197 -11.109
116 HD21 LEU 18 1HD2 LEU 18 23.901 23.180 -10.770
117 HD22 LEU 18 2HD2 LEU 18 24.105 24.027 -12.324
118 HD23 LEU 18 3HD2 LEU 18 23.693 24.944 -10.862
119 H ASP 19 H ASP 19 27.773 26.475 -11.108
120 HA ASP 19 HA ASP 19 30.376 25.069 -10.923
121 HB2 ASP 19 1HB ASP 19 30.660 25.664 -13.210
122 HB3 ASP 19 2HB ASP 19 28.979 25.132 -13.055
123 H ASN 20 H ASN 20 28.820 28.096 -10.476
124 HA ASN 20 HA ASN 20 31.434 29.498 -10.186
125 HB2 ASN 20 1HB ASN 20 28.845 30.196 -11.416
126 HB3 ASN 20 2HB ASN 20 29.467 31.446 -10.357
127 HD21 ASN 20 1HD2 ASN 20 30.713 31.793 -13.878
128 HD22 ASN 20 2HD2 ASN 20 29.145 31.314 -13.268
129 HA PRO 21 HA PRO 21 29.646 29.297 -5.959
130 HB2 PRO 21 1HB PRO 21 32.094 29.128 -4.706
131 HB3 PRO 21 2HB PRO 21 31.212 27.695 -5.276
132 HG2 PRO 21 1HG PRO 21 33.384 29.215 -6.573
133 HG3 PRO 21 2HG PRO 21 33.227 27.454 -6.365
134 HD2 PRO 21 1HD PRO 21 32.640 28.603 -8.672
135 HD3 PRO 21 2HD PRO 21 31.635 27.254 -8.028
136 H ALA 22 H ALA 22 32.153 31.095 -7.628
137 HA ALA 22 HA ALA 22 32.609 33.183 -5.780
138 HB1 ALA 22 1HB ALA 22 33.238 34.480 -7.845
139 HB2 ALA 22 2HB ALA 22 33.985 32.868 -7.771
140 HB3 ALA 22 3HB ALA 22 32.587 33.151 -8.842
141 H LEU 23 H LEU 23 30.184 32.795 -8.326
142 HA LEU 23 HA LEU 23 28.939 35.373 -7.964
143 HB2 LEU 23 1HB LEU 23 28.233 32.790 -9.380
144 HB3 LEU 23 2HB LEU 23 27.077 34.097 -9.283
145 HG LEU 23 HG LEU 23 28.272 33.924 -11.454
146 HD11 LEU 23 1HD1 LEU 23 28.719 36.508 -9.933
147 HD12 LEU 23 2HD1 LEU 23 27.175 35.965 -10.628
148 HD13 LEU 23 3HD1 LEU 23 28.554 36.303 -11.698
149 HD21 LEU 23 1HD2 LEU 23 30.591 33.399 -10.610
150 HD22 LEU 23 2HD2 LEU 23 30.707 35.071 -10.021
151 HD23 LEU 23 3HD2 LEU 23 30.520 34.750 -11.755
152 H LEU 24 H LEU 24 28.208 32.022 -6.937
153 HA LEU 24 HA LEU 24 25.685 32.697 -5.768
154 HB2 LEU 24 1HB LEU 24 26.423 30.429 -6.404
155 HB3 LEU 24 2HB LEU 24 27.601 30.418 -5.117
156 HG LEU 24 HG LEU 24 25.922 30.230 -3.453
157 HD11 LEU 24 1HD1 LEU 24 23.468 30.251 -3.953
158 HD12 LEU 24 2HD1 LEU 24 23.839 30.846 -5.591
159 HD13 LEU 24 3HD1 LEU 24 24.236 31.833 -4.160
160 HD21 LEU 24 1HD2 LEU 24 26.411 28.221 -4.866
161 HD22 LEU 24 2HD2 LEU 24 24.975 28.583 -5.849
162 HD23 LEU 24 3HD2 LEU 24 24.803 28.170 -4.134
163 H ARG 25 H ARG 25 29.003 32.549 -4.456
164 HA ARG 25 HA ARG 25 28.409 33.059 -1.731
165 HB2 ARG 25 1HB ARG 25 30.619 32.417 -2.552
166 HB3 ARG 25 2HB ARG 25 30.740 33.870 -3.506
167 HG2 ARG 25 1HG ARG 25 30.424 34.168 -0.548
168 HG3 ARG 25 2HG ARG 25 31.970 33.562 -1.147
169 HD2 ARG 25 1HD ARG 25 30.625 36.167 -1.952
170 HD3 ARG 25 2HD ARG 25 31.983 36.022 -0.850
171 HE ARG 25 HE ARG 25 32.001 35.625 -3.787
172 HH11 ARG 25 1HH1 ARG 25 33.894 35.808 -0.789
173 HH12 ARG 25 2HH1 ARG 25 35.400 36.002 -1.640
174 HH21 ARG 25 1HH2 ARG 25 33.955 35.854 -4.790
175 HH22 ARG 25 2HH2 ARG 25 35.431 36.030 -3.865
176 H ASP 26 H ASP 26 28.886 35.243 -4.511
177 HA ASP 26 HA ASP 26 28.756 37.659 -2.976
178 HB2 ASP 26 1HB ASP 26 29.644 37.243 -5.332
179 HB3 ASP 26 2HB ASP 26 27.969 37.354 -5.890
180 H MET 27 H MET 27 26.285 35.883 -4.899
181 HA MET 27 HA MET 27 24.102 37.673 -4.399
182 HB2 MET 27 1HB MET 27 24.199 35.766 -6.065
183 HB3 MET 27 2HB MET 27 23.978 34.653 -4.704
184 HG2 MET 27 1HG MET 27 21.838 35.765 -4.161
185 HG3 MET 27 2HG MET 27 22.055 36.831 -5.550
186 HE1 MET 27 1HE MET 27 22.224 32.981 -4.633
187 HE2 MET 27 2HE MET 27 20.563 33.513 -4.291
188 HE3 MET 27 3HE MET 27 20.870 32.369 -5.615
189 H LEU 28 H LEU 28 25.280 34.842 -2.578
190 HA LEU 28 HA LEU 28 23.120 34.836 -0.716
191 HB2 LEU 28 1HB LEU 28 25.889 33.742 -0.782
192 HB3 LEU 28 2HB LEU 28 25.002 33.718 0.739
193 HG LEU 28 HG LEU 28 23.843 32.552 -1.802
194 HD11 LEU 28 1HD1 LEU 28 24.640 30.392 -0.976
195 HD12 LEU 28 2HD1 LEU 28 25.522 31.216 0.327
196 HD13 LEU 28 3HD1 LEU 28 25.976 31.496 -1.376
197 HD21 LEU 28 1HD2 LEU 28 23.285 32.034 1.146
198 HD22 LEU 28 2HD2 LEU 28 22.422 31.331 -0.244
199 HD23 LEU 28 3HD2 LEU 28 22.311 33.068 0.088
200 H LEU 29 H LEU 29 26.349 36.388 -0.590
201 HA LEU 29 HA LEU 29 26.056 37.387 2.098
202 HB2 LEU 29 1HB LEU 29 27.657 38.315 -0.295
203 HB3 LEU 29 2HB LEU 29 27.726 39.145 1.257
204 HG LEU 29 HG LEU 29 28.456 36.233 0.870
205 HD11 LEU 29 1HD1 LEU 29 30.218 38.707 1.008
206 HD12 LEU 29 2HD1 LEU 29 29.907 37.694 -0.422
207 HD13 LEU 29 3HD1 LEU 29 30.781 37.015 0.963
208 HD21 LEU 29 1HD2 LEU 29 27.858 36.755 3.187
209 HD22 LEU 29 2HD2 LEU 29 28.955 38.149 3.188
210 HD23 LEU 29 3HD2 LEU 29 29.601 36.500 3.040
211 H ALA 30 H ALA 30 25.095 38.622 -1.075
212 HA ALA 30 HA ALA 30 24.265 41.208 -0.042
213 HB1 ALA 30 1HB ALA 30 24.999 40.857 -2.393
214 HB2 ALA 30 2HB ALA 30 23.597 39.799 -2.666
215 HB3 ALA 30 3HB ALA 30 23.350 41.526 -2.308
216 H ASN 31 H ASN 31 22.822 38.046 0.021
217 HA ASN 31 HA ASN 31 20.091 39.249 0.142
218 HB2 ASN 31 1HB ASN 31 20.681 37.421 -1.523
219 HB3 ASN 31 2HB ASN 31 20.818 36.349 -0.167
220 HD21 ASN 31 1HD2 ASN 31 17.340 36.790 -1.836
221 HD22 ASN 31 2HD2 ASN 31 18.943 36.921 -2.550
222 HA PRO 32 HA PRO 32 20.866 38.308 4.462
223 HB2 PRO 32 1HB PRO 32 18.728 39.633 5.565
224 HB3 PRO 32 2HB PRO 32 20.221 40.453 5.015
225 HG2 PRO 32 1HG PRO 32 17.640 40.060 3.511
226 HG3 PRO 32 2HG PRO 32 18.552 41.579 3.802
227 HD2 PRO 32 1HD PRO 32 18.838 40.269 1.504
228 HD3 PRO 32 2HD PRO 32 20.278 40.965 2.342
229 H HIS 33 H HIS 33 17.831 37.629 2.728
230 HA HIS 33 HA HIS 33 16.808 35.950 4.905
231 HB2 HIS 33 1HB HIS 33 15.336 37.123 3.235
232 HB3 HIS 33 2HB HIS 33 15.982 36.055 1.973
233 HD1 HIS 33 HD1 HIS 33 13.854 35.911 5.138
234 HD2 HIS 33 HD2 HIS 33 14.867 33.548 1.866
235 HE1 HIS 33 HE1 HIS 33 12.342 33.882 5.196
236 H GLU 34 H GLU 34 18.470 35.506 1.816
237 HA GLU 34 HA GLU 34 18.249 32.638 1.779
238 HB2 GLU 34 1HB GLU 34 19.743 34.763 0.316
239 HB3 GLU 34 2HB GLU 34 20.273 33.139 0.093
240 HG2 GLU 34 1HG GLU 34 17.503 34.208 -0.459
241 HG3 GLU 34 2HG GLU 34 18.738 33.796 -1.665
242 H LEU 35 H LEU 35 20.706 34.980 2.886
243 HA LEU 35 HA LEU 35 22.641 32.953 3.541
244 HB2 LEU 35 1HB LEU 35 23.940 34.648 4.240
245 HB3 LEU 35 2HB LEU 35 22.845 35.431 3.141
246 HG LEU 35 HG LEU 35 21.629 36.424 5.042
247 HD11 LEU 35 1HD1 LEU 35 23.919 35.245 6.643
248 HD12 LEU 35 2HD1 LEU 35 22.177 35.118 6.954
249 HD13 LEU 35 3HD1 LEU 35 22.989 36.674 7.169
250 HD21 LEU 35 1HD2 LEU 35 23.427 38.111 5.296
251 HD22 LEU 35 2HD2 LEU 35 23.315 37.513 3.631
252 HD23 LEU 35 3HD2 LEU 35 24.613 36.923 4.697
253 H SER 36 H SER 36 19.819 34.290 5.185
254 HA SER 36 HA SER 36 20.541 33.267 7.796
255 HB2 SER 36 1HB SER 36 17.886 34.237 6.682
256 HB3 SER 36 2HB SER 36 18.153 33.757 8.374
257 HG SER 36 HG SER 36 19.215 35.947 6.923
258 H LEU 37 H LEU 37 18.387 32.085 5.132
259 HA LEU 37 HA LEU 37 17.551 29.806 6.698
260 HB2 LEU 37 1HB LEU 37 16.623 28.946 4.764
261 HB3 LEU 37 2HB LEU 37 16.456 30.666 4.719
262 HG LEU 37 HG LEU 37 18.291 30.704 2.977
263 HD11 LEU 37 1HD1 LEU 37 17.479 27.790 2.788
264 HD12 LEU 37 2HD1 LEU 37 19.094 28.403 3.197
265 HD13 LEU 37 3HD1 LEU 37 18.435 28.691 1.594
266 HD21 LEU 37 1HD2 LEU 37 15.557 29.486 2.461
267 HD22 LEU 37 2HD2 LEU 37 16.590 30.263 1.238
268 HD23 LEU 37 3HD2 LEU 37 15.945 31.216 2.588
269 H LEU 38 H LEU 38 20.286 30.604 4.708
270 HA LEU 38 HA LEU 38 21.229 27.939 4.447
271 HB2 LEU 38 1HB LEU 38 21.806 29.880 3.097
272 HB3 LEU 38 2HB LEU 38 22.742 30.529 4.444
273 HG LEU 38 HG LEU 38 24.184 28.507 4.421
274 HD11 LEU 38 1HD1 LEU 38 22.664 27.916 1.854
275 HD12 LEU 38 2HD1 LEU 38 22.712 26.930 3.332
276 HD13 LEU 38 3HD1 LEU 38 24.178 27.120 2.364
277 HD21 LEU 38 1HD2 LEU 38 24.148 29.993 1.795
278 HD22 LEU 38 2HD2 LEU 38 25.526 29.164 2.551
279 HD23 LEU 38 3HD2 LEU 38 24.844 30.606 3.317
280 H LYS 39 H LYS 39 22.022 30.471 6.889
281 HA LYS 39 HA LYS 39 23.835 28.675 8.268
282 HB2 LYS 39 1HB LYS 39 23.652 30.225 10.177
283 HB3 LYS 39 2HB LYS 39 24.161 30.984 8.668
284 HG2 LYS 39 1HG LYS 39 22.151 32.127 8.412
285 HG3 LYS 39 2HG LYS 39 21.264 31.060 9.475
286 HD2 LYS 39 1HD LYS 39 21.526 33.070 10.674
287 HD3 LYS 39 2HD LYS 39 22.701 31.935 11.377
288 HE2 LYS 39 1HE LYS 39 24.492 32.940 9.998
289 HE3 LYS 39 2HE LYS 39 23.302 34.049 9.267
290 HZ1 LYS 39 1HZ LYS 39 22.885 34.918 11.500
291 HZ2 LYS 39 2HZ LYS 39 24.473 35.101 11.086
292 HZ3 LYS 39 3HZ LYS 39 24.035 33.927 12.139
293 H GLU 40 H GLU 40 20.373 29.137 8.383
294 HA GLU 40 HA GLU 40 20.015 27.599 10.807
295 HB2 GLU 40 1HB GLU 40 18.261 28.430 8.489
296 HB3 GLU 40 2HB GLU 40 17.668 27.349 9.742
297 HG2 GLU 40 1HG GLU 40 18.133 29.038 11.456
298 HG3 GLU 40 2HG GLU 40 18.725 30.156 10.194
299 H ARG 41 H ARG 41 19.583 26.815 7.317
300 HA ARG 41 HA ARG 41 19.037 24.013 8.041
301 HB2 ARG 41 1HB ARG 41 19.305 25.346 5.325
302 HB3 ARG 41 2HB ARG 41 18.651 23.729 5.634
303 HG2 ARG 41 1HG ARG 41 16.895 24.786 7.065
304 HG3 ARG 41 2HG ARG 41 17.495 26.362 6.586
305 HD2 ARG 41 1HD ARG 41 17.158 25.605 4.169
306 HD3 ARG 41 2HD ARG 41 16.205 24.263 4.847
307 HE ARG 41 HE ARG 41 15.329 26.754 5.951
308 HH11 ARG 41 1HH1 ARG 41 15.153 24.950 2.929
309 HH12 ARG 41 2HH1 ARG 41 13.679 25.718 2.439
310 HH21 ARG 41 1HH2 ARG 41 13.451 27.721 5.262
311 HH22 ARG 41 2HH2 ARG 41 12.730 27.258 3.742
312 H ASN 42 H ASN 42 21.796 25.780 6.804
313 HA ASN 42 HA ASN 42 23.303 23.190 6.766
314 HB2 ASN 42 1HB ASN 42 22.546 23.983 4.448
315 HB3 ASN 42 2HB ASN 42 23.692 25.312 4.624
316 HD21 ASN 42 1HD2 ASN 42 25.355 22.562 2.852
317 HD22 ASN 42 2HD2 ASN 42 24.075 23.715 2.581
318 HA PRO 43 HA PRO 43 25.426 26.670 9.001
319 HB2 PRO 43 1HB PRO 43 26.542 25.060 10.994
320 HB3 PRO 43 2HB PRO 43 25.023 25.995 11.107
321 HG2 PRO 43 1HG PRO 43 25.401 23.105 10.444
322 HG3 PRO 43 2HG PRO 43 24.220 23.896 11.537
323 HD2 PRO 43 1HD PRO 43 23.536 23.095 9.072
324 HD3 PRO 43 2HD PRO 43 22.902 24.634 9.768
325 HA PRO 44 HA PRO 44 29.542 24.645 8.274
326 HB2 PRO 44 1HB PRO 44 29.868 22.596 6.496
327 HB3 PRO 44 2HB PRO 44 29.643 22.347 8.257
328 HG2 PRO 44 1HG PRO 44 27.614 22.264 6.077
329 HG3 PRO 44 2HG PRO 44 27.971 21.047 7.339
330 HD2 PRO 44 1HD PRO 44 25.949 22.784 7.658
331 HD3 PRO 44 2HD PRO 44 27.026 22.367 9.041
332 H LEU 45 H LEU 45 27.140 24.573 5.550
333 HA LEU 45 HA LEU 45 29.144 25.658 3.712
334 HB2 LEU 45 1HB LEU 45 27.188 24.387 2.902
335 HB3 LEU 45 2HB LEU 45 26.131 25.670 3.492
336 HG LEU 45 HG LEU 45 26.962 27.235 1.858
337 HD11 LEU 45 1HD1 LEU 45 28.945 25.077 1.014
338 HD12 LEU 45 2HD1 LEU 45 29.334 26.655 1.726
339 HD13 LEU 45 3HD1 LEU 45 28.620 26.573 0.104
340 HD21 LEU 45 1HD2 LEU 45 26.220 26.137 -0.191
341 HD22 LEU 45 2HD2 LEU 45 25.225 25.581 1.170
342 HD23 LEU 45 3HD2 LEU 45 26.507 24.532 0.519
343 H ALA 46 H ALA 46 26.657 26.851 5.892
344 HA ALA 46 HA ALA 46 26.784 29.566 5.046
345 HB1 ALA 46 1HB ALA 46 25.042 28.581 6.447
346 HB2 ALA 46 2HB ALA 46 26.195 28.493 7.797
347 HB3 ALA 46 3HB ALA 46 25.731 30.074 7.118
348 H GLU 47 H GLU 47 28.649 27.902 7.708
349 HA GLU 47 HA GLU 47 29.870 30.315 8.595
350 HB2 GLU 47 1HB GLU 47 31.514 28.976 9.689
351 HB3 GLU 47 2HB GLU 47 29.935 28.204 9.875
352 HG2 GLU 47 1HG GLU 47 30.509 26.541 8.204
353 HG3 GLU 47 2HG GLU 47 32.012 27.386 7.817
354 H ALA 48 H ALA 48 30.601 28.204 5.913
355 HA ALA 48 HA ALA 48 33.198 29.209 5.339
356 HB1 ALA 48 1HB ALA 48 31.185 28.046 3.396
357 HB2 ALA 48 2HB ALA 48 32.943 28.029 3.267
358 HB3 ALA 48 3HB ALA 48 32.147 27.061 4.512
359 H LEU 49 H LEU 49 29.913 30.160 4.378
360 HA LEU 49 HA LEU 49 30.686 32.204 2.506
361 HB2 LEU 49 1HB LEU 49 28.397 31.176 2.702
362 HB3 LEU 49 2HB LEU 49 28.223 31.942 4.270
363 HG LEU 49 HG LEU 49 28.578 34.177 3.007
364 HD11 LEU 49 1HD1 LEU 49 29.260 33.120 0.893
365 HD12 LEU 49 2HD1 LEU 49 27.826 34.145 0.696
366 HD13 LEU 49 3HD1 LEU 49 27.653 32.381 0.760
367 HD21 LEU 49 1HD2 LEU 49 26.028 32.586 2.620
368 HD22 LEU 49 2HD2 LEU 49 26.177 34.357 2.637
369 HD23 LEU 49 3HD2 LEU 49 26.495 33.423 4.119
370 H LEU 50 H LEU 50 29.906 32.183 6.006
371 HA LEU 50 HA LEU 50 29.935 35.013 6.354
372 HB2 LEU 50 1HB LEU 50 30.724 32.957 8.427
373 HB3 LEU 50 2HB LEU 50 30.114 34.575 8.719
374 HG LEU 50 HG LEU 50 28.633 32.114 7.908
375 HD11 LEU 50 1HD1 LEU 50 27.279 32.633 9.850
376 HD12 LEU 50 2HD1 LEU 50 28.228 34.117 10.105
377 HD13 LEU 50 3HD1 LEU 50 29.005 32.511 10.253
378 HD21 LEU 50 1HD2 LEU 50 26.562 33.485 7.683
379 HD22 LEU 50 2HD2 LEU 50 27.723 33.692 6.360
380 HD23 LEU 50 3HD2 LEU 50 27.594 34.939 7.636
381 H SER 51 H SER 51 32.514 32.660 6.273
382 HA SER 51 HA SER 51 34.507 34.292 7.544
383 HB2 SER 51 1HB SER 51 34.732 31.959 5.640
384 HB3 SER 51 2HB SER 51 36.038 32.616 6.641
385 HG SER 51 HG SER 51 33.598 31.490 7.606
386 H GLY 52 H GLY 52 33.105 34.264 4.368
387 HA2 GLY 52 1HA GLY 52 33.527 35.823 2.686
388 HA3 GLY 52 2HA GLY 52 34.984 36.359 3.537
389 H ASP 53 H ASP 53 36.074 33.618 3.755
390 HA ASP 53 HA ASP 53 37.659 33.529 1.444
391 HB2 ASP 53 1HB ASP 53 37.220 31.856 3.781
392 HB3 ASP 53 2HB ASP 53 37.725 30.953 2.340
393 H LEU 54 H LEU 54 36.984 33.302 -0.559
394 HA LEU 54 HA LEU 54 34.690 31.789 -1.328
395 HB2 LEU 54 1HB LEU 54 35.821 33.534 -2.719
396 HB3 LEU 54 2HB LEU 54 37.163 32.433 -2.974
397 HG LEU 54 HG LEU 54 35.351 32.764 -4.775
398 HD11 LEU 54 1HD1 LEU 54 35.689 30.555 -5.701
399 HD12 LEU 54 2HD1 LEU 54 36.230 29.937 -4.120
400 HD13 LEU 54 3HD1 LEU 54 37.194 31.162 -4.980
401 HD21 LEU 54 1HD2 LEU 54 33.461 31.280 -4.776
402 HD22 LEU 54 2HD2 LEU 54 33.402 32.306 -3.330
403 HD23 LEU 54 3HD2 LEU 54 33.921 30.608 -3.207
404 H GLU 55 H GLU 55 38.077 31.069 -0.810
405 HA GLU 55 HA GLU 55 38.371 28.580 -2.033
406 HB2 GLU 55 1HB GLU 55 39.401 29.342 0.730
407 HB3 GLU 55 2HB GLU 55 40.074 28.133 -0.367
408 HG2 GLU 55 1HG GLU 55 40.397 30.055 -1.980
409 HG3 GLU 55 2HG GLU 55 40.056 31.138 -0.640
410 H LYS 56 H LYS 56 37.361 29.214 1.340
411 HA LYS 56 HA LYS 56 36.704 26.423 1.712
412 HB2 LYS 56 1HB LYS 56 36.013 26.991 3.930
413 HB3 LYS 56 2HB LYS 56 37.501 27.871 3.521
414 HG2 LYS 56 1HG LYS 56 36.057 29.817 3.073
415 HG3 LYS 56 2HG LYS 56 34.763 28.953 3.852
416 HD2 LYS 56 1HD LYS 56 37.495 29.383 5.122
417 HD3 LYS 56 2HD LYS 56 36.148 30.500 5.315
418 HE2 LYS 56 1HE LYS 56 34.756 28.630 6.251
419 HE3 LYS 56 2HE LYS 56 36.200 27.611 6.222
420 HZ1 LYS 56 1HZ LYS 56 35.916 28.588 8.387
421 HZ2 LYS 56 2HZ LYS 56 35.833 30.114 7.762
422 HZ3 LYS 56 3HZ LYS 56 37.249 29.274 7.687
423 H PHE 57 H PHE 57 34.807 29.307 0.848
424 HA PHE 57 HA PHE 57 32.251 28.081 1.192
425 HB2 PHE 57 1HB PHE 57 32.536 30.483 0.747
426 HB3 PHE 57 2HB PHE 57 33.124 30.119 -0.879
427 HD1 PHE 57 HD1 PHE 57 31.639 29.818 -2.683
428 HD2 PHE 57 HD2 PHE 57 30.145 29.803 1.355
429 HE1 PHE 57 HE1 PHE 57 29.312 29.813 -3.552
430 HE2 PHE 57 HE2 PHE 57 27.812 29.805 0.485
431 HZ PHE 57 HZ PHE 57 27.400 29.821 -1.973
432 H SER 58 H SER 58 34.352 28.218 -1.738
433 HA SER 58 HA SER 58 32.714 26.543 -3.359
434 HB2 SER 58 1HB SER 58 34.603 27.941 -4.176
435 HB3 SER 58 2HB SER 58 35.753 26.894 -3.330
436 HG SER 58 HG SER 58 35.600 26.211 -5.458
437 H ARG 59 H ARG 59 35.350 25.738 -1.063
438 HA ARG 59 HA ARG 59 35.506 22.978 -1.767
439 HB2 ARG 59 1HB ARG 59 37.203 24.172 -0.436
440 HB3 ARG 59 2HB ARG 59 36.042 24.385 0.876
441 HG2 ARG 59 1HG ARG 59 36.337 21.569 0.090
442 HG3 ARG 59 2HG ARG 59 37.890 22.287 0.568
443 HD2 ARG 59 1HD ARG 59 35.349 22.486 2.230
444 HD3 ARG 59 2HD ARG 59 36.576 21.227 2.440
445 HE ARG 59 HE ARG 59 37.952 23.657 2.527
446 HH11 ARG 59 1HH1 ARG 59 35.413 22.149 4.456
447 HH12 ARG 59 2HH1 ARG 59 35.898 22.981 5.920
448 HH21 ARG 59 1HH2 ARG 59 38.515 24.670 4.419
449 HH22 ARG 59 2HH2 ARG 59 37.636 24.378 5.885
450 H VAL 60 H VAL 60 33.527 24.688 0.722
451 HA VAL 60 HA VAL 60 32.366 22.147 1.547
452 HB VAL 60 HB VAL 60 31.321 24.957 2.107
453 HG11 VAL 60 1HG1 VAL 60 30.689 22.205 3.272
454 HG12 VAL 60 2HG1 VAL 60 30.271 23.731 4.078
455 HG13 VAL 60 3HG1 VAL 60 29.562 23.347 2.498
456 HG21 VAL 60 1HG2 VAL 60 32.447 24.692 4.287
457 HG22 VAL 60 2HG2 VAL 60 33.089 23.107 3.781
458 HG23 VAL 60 3HG2 VAL 60 33.622 24.602 2.973
459 H LEU 61 H LEU 61 31.565 24.656 -0.843
460 HA LEU 61 HA LEU 61 28.916 23.843 -1.402
461 HB2 LEU 61 1HB LEU 61 30.247 25.849 -2.318
462 HB3 LEU 61 2HB LEU 61 30.923 24.728 -3.500
463 HG LEU 61 HG LEU 61 28.209 24.276 -3.793
464 HD11 LEU 61 1HD1 LEU 61 27.802 26.148 -2.174
465 HD12 LEU 61 2HD1 LEU 61 27.111 26.433 -3.786
466 HD13 LEU 61 3HD1 LEU 61 28.626 27.253 -3.295
467 HD21 LEU 61 1HD2 LEU 61 29.993 24.846 -5.563
468 HD22 LEU 61 2HD2 LEU 61 29.590 26.544 -5.257
469 HD23 LEU 61 3HD2 LEU 61 28.348 25.438 -5.860
470 H VAL 62 H VAL 62 32.031 22.605 -2.752
471 HA VAL 62 HA VAL 62 30.595 20.682 -4.383
472 HB VAL 62 HB VAL 62 32.832 21.567 -5.012
473 HG11 VAL 62 1HG1 VAL 62 34.872 20.544 -4.071
474 HG12 VAL 62 2HG1 VAL 62 33.993 21.522 -2.895
475 HG13 VAL 62 3HG1 VAL 62 33.893 19.748 -2.816
476 HG21 VAL 62 1HG2 VAL 62 33.654 19.467 -5.936
477 HG22 VAL 62 2HG2 VAL 62 32.701 18.540 -4.744
478 HG23 VAL 62 3HG2 VAL 62 31.887 19.508 -5.999
479 H GLU 63 H GLU 63 32.069 20.552 -1.134
480 HA GLU 63 HA GLU 63 31.815 17.710 -0.803
481 HB2 GLU 63 1HB GLU 63 31.742 20.019 1.160
482 HB3 GLU 63 2HB GLU 63 31.561 18.341 1.685
483 HG2 GLU 63 1HG GLU 63 33.953 19.440 0.158
484 HG3 GLU 63 2HG GLU 63 33.889 19.183 1.913
485 H GLN 64 H GLN 64 29.493 20.379 -0.225
486 HA GLN 64 HA GLN 64 27.437 18.664 0.855
487 HB2 GLN 64 1HB GLN 64 27.350 21.368 -0.511
488 HB3 GLN 64 2HB GLN 64 25.922 20.593 0.190
489 HG2 GLN 64 1HG GLN 64 28.449 21.262 1.772
490 HG3 GLN 64 2HG GLN 64 27.038 22.298 1.677
491 HE21 GLN 64 1HE2 GLN 64 27.131 19.714 4.577
492 HE22 GLN 64 2HE2 GLN 64 28.512 20.406 3.755
493 H GLN 65 H GLN 65 28.305 19.694 -2.458
494 HA GLN 65 HA GLN 65 25.990 18.428 -3.676
495 HB2 GLN 65 1HB GLN 65 28.696 19.273 -4.763
496 HB3 GLN 65 2HB GLN 65 27.450 18.527 -5.766
497 HG2 GLN 65 1HG GLN 65 25.878 20.330 -5.214
498 HG3 GLN 65 2HG GLN 65 27.094 21.111 -4.182
499 HE21 GLN 65 1HE2 GLN 65 28.860 22.566 -6.850
500 HE22 GLN 65 2HE2 GLN 65 28.857 22.150 -5.142
501 H GLN 66 H GLN 66 29.265 17.257 -2.776
502 HA GLN 66 HA GLN 66 28.986 14.713 -4.079
503 HB2 GLN 66 1HB GLN 66 30.603 15.594 -1.669
504 HB3 GLN 66 2HB GLN 66 30.621 13.954 -2.296
505 HG2 GLN 66 1HG GLN 66 31.376 14.808 -4.483
506 HG3 GLN 66 2HG GLN 66 31.475 16.428 -3.795
507 HE21 GLN 66 1HE2 GLN 66 34.561 15.925 -2.282
508 HE22 GLN 66 2HE2 GLN 66 33.298 17.012 -2.803
509 H ASP 67 H ASP 67 28.130 15.817 -0.743
510 HA ASP 67 HA ASP 67 27.304 13.176 0.048
511 HB2 ASP 67 1HB ASP 67 27.721 15.098 1.622
512 HB3 ASP 67 2HB ASP 67 26.168 15.775 1.104
513 H ARG 68 H ARG 68 25.633 15.905 -1.466
514 HA ARG 68 HA ARG 68 23.013 14.745 -1.512
515 HB2 ARG 68 1HB ARG 68 24.495 16.819 -3.079
516 HB3 ARG 68 2HB ARG 68 23.063 16.126 -3.818
517 HG2 ARG 68 1HG ARG 68 21.706 16.803 -1.901
518 HG3 ARG 68 2HG ARG 68 23.155 17.483 -1.104
519 HD2 ARG 68 1HD ARG 68 23.283 19.254 -2.548
520 HD3 ARG 68 2HD ARG 68 22.641 18.332 -3.919
521 HE ARG 68 HE ARG 68 21.123 19.881 -1.949
522 HH11 ARG 68 1HH1 ARG 68 20.879 17.399 -4.483
523 HH12 ARG 68 2HH1 ARG 68 19.239 17.831 -4.846
524 HH21 ARG 68 1HH2 ARG 68 18.986 20.313 -2.454
525 HH22 ARG 68 2HH2 ARG 68 18.178 19.414 -3.699
526 H ALA 69 H ALA 69 25.786 14.497 -3.777
527 HA ALA 69 HA ALA 69 24.447 12.908 -5.705
528 HB1 ALA 69 1HB ALA 69 26.680 12.325 -6.498
529 HB2 ALA 69 2HB ALA 69 26.618 14.052 -6.071
530 HB3 ALA 69 3HB ALA 69 27.399 12.882 -4.978
531 H ARG 70 H ARG 70 25.994 11.953 -2.643
532 HA ARG 70 HA ARG 70 26.037 9.125 -3.205
533 HB2 ARG 70 1HB ARG 70 25.748 10.591 -0.558
534 HB3 ARG 70 2HB ARG 70 26.088 8.865 -0.724
535 HG2 ARG 70 1HG ARG 70 28.233 9.292 -1.679
536 HG3 ARG 70 2HG ARG 70 27.857 11.003 -1.892
537 HD2 ARG 70 1HD ARG 70 27.629 11.194 0.617
538 HD3 ARG 70 2HD ARG 70 28.265 9.543 0.730
539 HE ARG 70 HE ARG 70 30.096 10.949 -0.833
540 HH11 ARG 70 1HH1 ARG 70 28.854 11.312 2.456
541 HH12 ARG 70 2HH1 ARG 70 30.329 12.033 3.029
542 HH21 ARG 70 1HH2 ARG 70 31.949 11.878 -0.032
543 HH22 ARG 70 2HH2 ARG 70 32.037 12.383 1.636
544 H ARG 71 H ARG 71 23.632 11.186 -1.494
545 HA ARG 71 HA ARG 71 21.826 8.923 -1.216
546 HB2 ARG 71 1HB ARG 71 20.230 10.572 -0.371
547 HB3 ARG 71 2HB ARG 71 21.803 10.710 0.402
548 HG2 ARG 71 1HG ARG 71 22.288 12.652 -1.074
549 HG3 ARG 71 2HG ARG 71 20.628 12.555 -1.688
550 HD2 ARG 71 1HD ARG 71 20.642 14.210 0.032
551 HD3 ARG 71 2HD ARG 71 19.865 12.792 0.722
552 HE ARG 71 HE ARG 71 22.757 13.446 1.234
553 HH11 ARG 71 1HH1 ARG 71 19.564 12.608 2.539
554 HH12 ARG 71 2HH1 ARG 71 20.185 12.484 4.167
555 HH21 ARG 71 1HH2 ARG 71 23.435 13.334 3.303
556 HH22 ARG 71 2HH2 ARG 71 22.329 12.895 4.589
557 H GLU 72 H GLU 72 22.327 11.399 -3.639
558 HA GLU 72 HA GLU 72 19.810 11.107 -4.966
559 HB2 GLU 72 1HB GLU 72 22.382 12.337 -5.569
560 HB3 GLU 72 2HB GLU 72 21.669 11.591 -6.988
561 HG2 GLU 72 1HG GLU 72 20.889 13.813 -7.028
562 HG3 GLU 72 2HG GLU 72 19.517 12.862 -6.439
563 H GLN 73 H GLN 73 22.812 9.213 -5.172
564 HA GLN 73 HA GLN 73 22.104 7.670 -7.466
565 HB2 GLN 73 1HB GLN 73 23.831 7.087 -5.056
566 HB3 GLN 73 2HB GLN 73 23.624 5.924 -6.377
567 HG2 GLN 73 1HG GLN 73 24.642 7.389 -7.950
568 HG3 GLN 73 2HG GLN 73 24.581 8.757 -6.836
569 HE21 GLN 73 1HE2 GLN 73 27.592 8.060 -5.281
570 HE22 GLN 73 2HE2 GLN 73 26.191 9.114 -5.441
571 H GLU 74 H GLU 74 21.343 7.281 -4.009
572 HA GLU 74 HA GLU 74 19.982 4.753 -4.426
573 HB2 GLU 74 1HB GLU 74 19.839 6.709 -2.121
574 HB3 GLU 74 2HB GLU 74 19.226 5.051 -2.111
575 HG2 GLU 74 1HG GLU 74 22.131 5.942 -2.386
576 HG3 GLU 74 2HG GLU 74 21.394 5.114 -1.000
577 H ARG 75 H ARG 75 19.008 8.177 -4.404
578 HA ARG 75 HA ARG 75 16.175 7.671 -4.332
579 HB2 ARG 75 1HB ARG 75 17.777 9.952 -5.501
580 HB3 ARG 75 2HB ARG 75 16.014 9.922 -5.462
581 HG2 ARG 75 1HG ARG 75 15.994 9.898 -3.044
582 HG3 ARG 75 2HG ARG 75 17.737 9.689 -2.989
583 HD2 ARG 75 1HD ARG 75 17.327 11.982 -2.536
584 HD3 ARG 75 2HD ARG 75 17.972 11.875 -4.185
585 HE ARG 75 HE ARG 75 15.092 11.784 -4.152
586 HH11 ARG 75 1HH1 ARG 75 17.803 14.060 -4.000
587 HH12 ARG 75 2HH1 ARG 75 16.815 15.385 -4.569
588 HH21 ARG 75 1HH2 ARG 75 13.923 13.521 -4.880
589 HH22 ARG 75 2HH2 ARG 75 14.659 15.087 -5.061
590 H ILE 76 H ILE 76 18.470 7.957 -7.108
591 HA ILE 76 HA ILE 76 16.291 7.536 -9.007
592 HB ILE 76 HB ILE 76 18.002 7.408 -10.738
593 HG12 ILE 76 1HG1 ILE 76 20.060 7.507 -8.504
594 HG13 ILE 76 2HG1 ILE 76 19.660 6.076 -9.440
595 HG21 ILE 76 1HG2 ILE 76 18.738 9.621 -8.758
596 HG22 ILE 76 2HG2 ILE 76 18.884 9.675 -10.528
597 HG23 ILE 76 3HG2 ILE 76 17.282 9.638 -9.770
598 HD11 ILE 76 1HD1 ILE 76 20.955 8.611 -10.477
599 HD12 ILE 76 2HD1 ILE 76 21.696 7.016 -10.305
600 HD13 ILE 76 3HD1 ILE 76 20.423 7.260 -11.510
601 H ARG 77 H ARG 77 18.152 5.476 -7.005
602 HA ARG 77 HA ARG 77 18.208 3.111 -8.627
603 HB2 ARG 77 1HB ARG 77 19.446 3.674 -6.450
604 HB3 ARG 77 2HB ARG 77 17.970 3.224 -5.609
605 HG2 ARG 77 1HG ARG 77 18.139 0.951 -6.405
606 HG3 ARG 77 2HG ARG 77 19.537 1.390 -7.433
607 HD2 ARG 77 1HD ARG 77 20.688 2.212 -5.344
608 HD3 ARG 77 2HD ARG 77 19.369 1.509 -4.404
609 HE ARG 77 HE ARG 77 20.289 -0.556 -6.011
610 HH11 ARG 77 1HH1 ARG 77 21.735 1.546 -3.546
611 HH12 ARG 77 2HH1 ARG 77 22.916 0.337 -3.108
612 HH21 ARG 77 1HH2 ARG 77 21.821 -2.046 -5.358
613 HH22 ARG 77 2HH2 ARG 77 22.950 -1.660 -4.102
614 H LEU 78 H LEU 78 15.747 4.668 -6.770
615 HA LEU 78 HA LEU 78 13.570 4.357 -6.379
616 HB2 LEU 78 1HB LEU 78 13.469 4.119 -8.773
617 HB3 LEU 78 2HB LEU 78 13.806 2.410 -8.665
618 HG LEU 78 HG LEU 78 11.628 2.044 -7.533
619 HD11 LEU 78 1HD1 LEU 78 11.199 5.006 -8.103
620 HD12 LEU 78 2HD1 LEU 78 11.262 4.240 -6.502
621 HD13 LEU 78 3HD1 LEU 78 9.929 3.865 -7.613
622 HD21 LEU 78 1HD2 LEU 78 10.254 2.397 -9.556
623 HD22 LEU 78 2HD2 LEU 78 11.879 1.798 -9.971
624 HD23 LEU 78 3HD2 LEU 78 11.494 3.512 -10.191
625 H PHE 79 H PHE 79 15.045 1.125 -6.803
626 HA PHE 79 HA PHE 79 13.268 0.079 -4.667
627 HB2 PHE 79 1HB PHE 79 15.345 -1.283 -6.387
628 HB3 PHE 79 2HB PHE 79 14.246 -2.091 -5.266
629 HD1 PHE 79 HD1 PHE 79 11.807 -2.193 -5.775
630 HD2 PHE 79 HD2 PHE 79 14.622 -0.518 -8.585
631 HE1 PHE 79 HE1 PHE 79 10.094 -2.340 -7.582
632 HE2 PHE 79 HE2 PHE 79 12.916 -0.676 -10.388
633 HZ PHE 79 HZ PHE 79 10.649 -1.591 -9.891
634 H SER 80 H SER 80 14.177 1.369 -3.053
635 HA SER 80 HA SER 80 16.818 0.393 -2.041
636 HB2 SER 80 1HB SER 80 17.063 2.720 -1.094
637 HB3 SER 80 2HB SER 80 17.101 2.668 -2.870
638 HG SER 80 HG SER 80 14.758 3.155 -1.342
639 H ALA 81 H ALA 81 16.491 -0.752 -0.243
640 HA ALA 81 HA ALA 81 14.059 -0.228 1.382
641 HB1 ALA 81 1HB ALA 81 16.077 -2.518 1.536
642 HB2 ALA 81 2HB ALA 81 14.527 -2.412 2.386
643 HB3 ALA 81 3HB ALA 81 14.549 -2.574 0.622
644 H ASP 82 H ASP 82 16.248 1.638 1.356
645 HA ASP 82 HA ASP 82 17.369 1.358 4.104
646 HB2 ASP 82 1HB ASP 82 18.621 1.864 1.574
647 HB3 ASP 82 2HB ASP 82 18.641 3.383 2.483
648 HA PRO 83 HA PRO 83 14.811 4.828 4.815
649 HB2 PRO 83 1HB PRO 83 15.904 6.081 6.954
650 HB3 PRO 83 2HB PRO 83 15.244 4.435 7.089
651 HG2 PRO 83 1HG PRO 83 18.083 5.303 6.634
652 HG3 PRO 83 2HG PRO 83 17.440 4.200 7.894
653 HD2 PRO 83 1HD PRO 83 18.526 3.271 5.578
654 HD3 PRO 83 2HD PRO 83 17.116 2.453 6.345
655 H PHE 84 H PHE 84 14.576 7.095 4.622
656 HA PHE 84 HA PHE 84 16.954 8.619 3.634
657 HB2 PHE 84 1HB PHE 84 14.117 8.609 2.544
658 HB3 PHE 84 2HB PHE 84 15.334 9.821 2.110
659 HD1 PHE 84 HD1 PHE 84 14.391 6.244 1.806
660 HD2 PHE 84 HD2 PHE 84 17.089 9.343 0.547
661 HE1 PHE 84 HE1 PHE 84 15.195 4.777 -0.031
662 HE2 PHE 84 HE2 PHE 84 17.910 7.887 -1.297
663 HZ PHE 84 HZ PHE 84 16.959 5.583 -1.596
664 H ASP 85 H ASP 85 15.863 8.288 6.229
665 HA ASP 85 HA ASP 85 15.221 9.347 8.096
666 HB2 ASP 85 1HB ASP 85 16.706 11.171 7.166
667 HB3 ASP 85 2HB ASP 85 15.215 11.986 6.644
668 H LEU 86 H LEU 86 13.323 8.694 8.672
669 HA LEU 86 HA LEU 86 10.930 9.285 7.141
670 HB2 LEU 86 1HB LEU 86 9.794 7.961 8.853
671 HB3 LEU 86 2HB LEU 86 11.191 7.133 8.174
672 HG LEU 86 HG LEU 86 12.279 8.285 10.415
673 HD11 LEU 86 1HD1 LEU 86 10.031 9.013 11.189
674 HD12 LEU 86 2HD1 LEU 86 10.758 7.832 12.283
675 HD13 LEU 86 3HD1 LEU 86 9.482 7.317 11.150
676 HD21 LEU 86 1HD2 LEU 86 12.157 6.006 11.376
677 HD22 LEU 86 2HD2 LEU 86 12.639 5.990 9.663
678 HD23 LEU 86 3HD2 LEU 86 10.968 5.553 10.127
679 H GLU 87 H GLU 87 12.569 10.688 9.871
680 HA GLU 87 HA GLU 87 10.195 12.209 10.756
681 HB2 GLU 87 1HB GLU 87 13.108 12.042 11.567
682 HB3 GLU 87 2HB GLU 87 12.092 13.374 12.138
683 HG2 GLU 87 1HG GLU 87 11.196 10.529 12.518
684 HG3 GLU 87 2HG GLU 87 12.395 11.246 13.600
685 H ALA 88 H ALA 88 13.451 12.820 9.442
686 HA ALA 88 HA ALA 88 14.350 14.565 8.317
687 HB1 ALA 88 1HB ALA 88 13.246 14.985 6.138
688 HB2 ALA 88 2HB ALA 88 13.267 13.253 6.574
689 HB3 ALA 88 3HB ALA 88 11.775 14.198 6.756
690 H GLN 89 H GLN 89 13.128 15.613 10.617
691 HA GLN 89 HA GLN 89 12.237 18.269 9.621
692 HB2 GLN 89 1HB GLN 89 10.714 18.415 11.439
693 HB3 GLN 89 2HB GLN 89 10.351 16.960 10.538
694 HG2 GLN 89 1HG GLN 89 11.295 15.555 12.268
695 HG3 GLN 89 2HG GLN 89 11.959 16.955 13.129
696 HE21 GLN 89 1HE2 GLN 89 8.584 15.711 14.472
697 HE22 GLN 89 2HE2 GLN 89 9.948 14.790 13.868
698 H ALA 90 H ALA 90 12.291 19.860 11.535
699 HA ALA 90 HA ALA 90 13.529 21.198 12.889
700 HB1 ALA 90 1HB ALA 90 13.206 19.218 14.440
701 HB2 ALA 90 2HB ALA 90 14.841 18.659 13.987
702 HB3 ALA 90 3HB ALA 90 14.619 20.222 14.805
703 H LYS 91 H LYS 91 16.046 21.312 13.825
704 HA LYS 91 HA LYS 91 17.936 20.966 11.558
705 HB2 LYS 91 1HB LYS 91 17.228 23.585 12.942
706 HB3 LYS 91 2HB LYS 91 18.646 23.353 11.929
707 HG2 LYS 91 1HG LYS 91 17.327 23.093 9.954
708 HG3 LYS 91 2HG LYS 91 15.820 23.001 10.878
709 HD2 LYS 91 1HD LYS 91 17.628 25.414 11.020
710 HD3 LYS 91 2HD LYS 91 16.411 25.246 9.736
711 HE2 LYS 91 1HE LYS 91 14.615 25.362 11.271
712 HE3 LYS 91 2HE LYS 91 15.652 24.970 12.652
713 HZ1 LYS 91 1HZ LYS 91 16.733 27.089 12.440
714 HZ2 LYS 91 2HZ LYS 91 15.100 27.328 12.576
715 HZ3 LYS 91 3HZ LYS 91 15.828 27.492 11.098
716 H ILE 92 H ILE 92 20.131 21.360 12.429
717 HA ILE 92 HA ILE 92 20.287 21.352 15.407
718 HB ILE 92 HB ILE 92 22.064 19.726 13.516
719 HG12 ILE 92 1HG1 ILE 92 20.105 18.708 15.610
720 HG13 ILE 92 2HG1 ILE 92 19.740 18.792 13.890
721 HG21 ILE 92 1HG2 ILE 92 23.159 18.891 15.588
722 HG22 ILE 92 2HG2 ILE 92 23.286 20.651 15.496
723 HG23 ILE 92 3HG2 ILE 92 22.090 19.908 16.582
724 HD11 ILE 92 1HD1 ILE 92 21.837 17.042 15.197
725 HD12 ILE 92 2HD1 ILE 92 20.340 16.538 14.401
726 HD13 ILE 92 3HD1 ILE 92 21.663 17.236 13.445
727 H GLU 93 H GLU 93 21.012 23.330 15.829
728 HA GLU 93 HA GLU 93 22.970 24.569 13.951
729 HB2 GLU 93 1HB GLU 93 20.735 25.856 15.589
730 HB3 GLU 93 2HB GLU 93 21.952 26.747 14.660
731 HG2 GLU 93 1HG GLU 93 21.105 25.753 12.573
732 HG3 GLU 93 2HG GLU 93 19.929 24.795 13.490
733 H GLU 94 H GLU 94 24.838 25.272 14.884
734 HA GLU 94 HA GLU 94 25.247 24.539 17.666
735 HB2 GLU 94 1HB GLU 94 27.074 25.891 15.638
736 HB3 GLU 94 2HB GLU 94 27.542 25.331 17.252
737 HG2 GLU 94 1HG GLU 94 28.274 23.605 15.891
738 HG3 GLU 94 2HG GLU 94 26.742 23.002 16.533
739 H ASP 95 H ASP 95 25.044 25.729 19.390
740 HA ASP 95 HA ASP 95 24.456 28.562 19.271
741 HB2 ASP 95 1HB ASP 95 24.368 26.363 21.213
742 HB3 ASP 95 2HB ASP 95 24.827 27.900 21.954
743 H ILE 96 H ILE 96 27.177 27.782 18.331
744 HA ILE 96 HA ILE 96 29.001 28.905 20.365
745 HB ILE 96 HB ILE 96 29.669 28.169 17.457
746 HG12 ILE 96 1HG1 ILE 96 30.058 26.443 19.939
747 HG13 ILE 96 2HG1 ILE 96 28.715 26.236 18.827
748 HG21 ILE 96 1HG2 ILE 96 31.479 28.390 19.939
749 HG22 ILE 96 2HG2 ILE 96 32.009 28.038 18.274
750 HG23 ILE 96 3HG2 ILE 96 31.361 29.633 18.671
751 HD11 ILE 96 1HD1 ILE 96 30.367 25.802 16.971
752 HD12 ILE 96 2HD1 ILE 96 31.658 25.815 18.185
753 HD13 ILE 96 3HD1 ILE 96 30.373 24.599 18.272
754 H ARG 97 H ARG 97 27.183 30.676 20.141
755 HA ARG 97 HA ARG 97 27.604 32.552 17.894
756 HB2 ARG 97 1HB ARG 97 25.712 32.530 20.281
757 HB3 ARG 97 2HB ARG 97 25.702 33.776 19.025
758 HG2 ARG 97 1HG ARG 97 24.696 32.429 17.489
759 HG3 ARG 97 2HG ARG 97 25.509 30.972 18.054
760 HD2 ARG 97 1HD ARG 97 23.177 30.747 18.537
761 HD3 ARG 97 2HD ARG 97 24.052 30.966 20.066
762 HE ARG 97 HE ARG 97 23.206 33.513 19.219
763 HH11 ARG 97 1HH1 ARG 97 21.715 30.502 20.331
764 HH12 ARG 97 2HH1 ARG 97 20.294 31.333 20.914
765 HH21 ARG 97 1HH2 ARG 97 21.388 34.484 20.061
766 HH22 ARG 97 2HH2 ARG 97 20.126 33.527 20.787
767 H GLN 98 H GLN 98 29.882 32.325 19.307
768 HA GLN 98 HA GLN 98 31.574 33.469 20.310
769 HB2 GLN 98 1HB GLN 98 29.932 35.993 19.816
770 HB3 GLN 98 2HB GLN 98 31.632 35.928 20.250
771 HG2 GLN 98 1HG GLN 98 32.070 34.560 18.152
772 HG3 GLN 98 2HG GLN 98 30.392 34.797 17.691
773 HE21 GLN 98 1HE2 GLN 98 31.110 37.844 16.190
774 HE22 GLN 98 2HE2 GLN 98 30.157 36.376 16.230
775 HXT GLN 98 HO GLN 98 28.749 34.786 21.510
Start of MODEL 21
1 H1 SER 1 1H SER 1 27.536 41.298 -5.457
2 H2 SER 1 2H SER 1 26.858 42.051 -4.114
3 H3 SER 1 3H SER 1 27.983 42.849 -5.050
4 HA SER 1 HA SER 1 25.886 43.792 -5.629
5 HB2 SER 1 1HB SER 1 26.949 41.784 -7.632
6 HB3 SER 1 2HB SER 1 25.695 42.937 -8.047
7 HG SER 1 HG SER 1 28.345 43.323 -7.871
8 H GLN 2 H GLN 2 23.929 43.686 -5.140
9 HA GLN 2 HA GLN 2 22.430 41.218 -4.809
10 HB2 GLN 2 1HB GLN 2 22.360 43.506 -3.510
11 HB3 GLN 2 2HB GLN 2 21.219 43.987 -4.763
12 HG2 GLN 2 1HG GLN 2 19.774 42.057 -4.151
13 HG3 GLN 2 2HG GLN 2 20.940 41.600 -2.899
14 HE21 GLN 2 1HE2 GLN 2 19.550 43.716 -0.533
15 HE22 GLN 2 2HE2 GLN 2 20.545 42.322 -0.915
16 H GLN 3 H GLN 3 23.222 41.398 -7.500
17 HA GLN 3 HA GLN 3 21.160 42.536 -9.176
18 HB2 GLN 3 1HB GLN 3 22.275 41.370 -10.987
19 HB3 GLN 3 2HB GLN 3 23.472 42.121 -9.927
20 HG2 GLN 3 1HG GLN 3 23.788 39.863 -8.821
21 HG3 GLN 3 2HG GLN 3 22.767 39.173 -10.096
22 HE21 GLN 3 1HE2 GLN 3 26.605 39.406 -10.768
23 HE22 GLN 3 2HE2 GLN 3 25.803 39.243 -9.225
24 H SER 4 H SER 4 21.504 39.553 -7.463
25 HA SER 4 HA SER 4 20.135 37.797 -7.064
26 HB2 SER 4 1HB SER 4 17.957 39.303 -8.534
27 HB3 SER 4 2HB SER 4 17.756 37.984 -7.363
28 HG SER 4 HG SER 4 18.733 40.616 -6.921
29 H HIS 5 H HIS 5 19.722 35.785 -7.886
30 HA HIS 5 HA HIS 5 20.479 35.407 -10.682
31 HB2 HIS 5 1HB HIS 5 19.589 33.437 -8.546
32 HB3 HIS 5 2HB HIS 5 20.182 32.995 -10.153
33 HD1 HIS 5 HD1 HIS 5 21.824 31.827 -7.951
34 HD2 HIS 5 HD2 HIS 5 22.506 35.672 -9.425
35 HE1 HIS 5 HE1 HIS 5 24.201 32.442 -7.345
36 H SER 6 H SER 6 17.517 35.089 -8.753
37 HA SER 6 HA SER 6 15.322 34.791 -9.321
38 HB2 SER 6 1HB SER 6 16.158 36.446 -11.719
39 HB3 SER 6 2HB SER 6 14.541 36.364 -10.981
40 HG SER 6 HG SER 6 16.112 38.149 -10.370
41 H SER 7 H SER 7 16.859 32.530 -10.354
42 HA SER 7 HA SER 7 15.191 31.880 -12.750
43 HB2 SER 7 1HB SER 7 17.478 32.409 -13.430
44 HB3 SER 7 2HB SER 7 18.114 31.211 -12.288
45 HG SER 7 HG SER 7 17.124 29.593 -13.465
46 HA PRO 8 HA PRO 8 14.709 28.377 -9.831
47 HB2 PRO 8 1HB PRO 8 12.015 28.059 -9.977
48 HB3 PRO 8 2HB PRO 8 12.763 29.317 -8.942
49 HG2 PRO 8 1HG PRO 8 11.569 29.603 -11.695
50 HG3 PRO 8 2HG PRO 8 11.313 30.615 -10.239
51 HD2 PRO 8 1HD PRO 8 13.069 31.259 -12.251
52 HD3 PRO 8 2HD PRO 8 13.310 31.751 -10.539
53 H GLY 9 H GLY 9 15.861 27.070 -11.401
54 HA2 GLY 9 1HA GLY 9 14.065 25.454 -13.099
55 HA3 GLY 9 2HA GLY 9 15.256 26.436 -13.944
56 H GLU 10 H GLU 10 15.494 24.406 -10.975
57 HA GLU 10 HA GLU 10 18.026 23.281 -11.878
58 HB2 GLU 10 1HB GLU 10 17.161 23.805 -9.460
59 HB3 GLU 10 2HB GLU 10 16.364 22.237 -9.593
60 HG2 GLU 10 1HG GLU 10 18.814 21.414 -10.265
61 HG3 GLU 10 2HG GLU 10 19.313 22.898 -9.448
62 H ILE 11 H ILE 11 15.784 22.688 -13.696
63 HA ILE 11 HA ILE 11 14.921 20.039 -13.202
64 HB ILE 11 HB ILE 11 14.688 22.035 -15.454
65 HG12 ILE 11 1HG1 ILE 11 12.534 20.994 -13.572
66 HG13 ILE 11 2HG1 ILE 11 13.490 22.437 -13.241
67 HG21 ILE 11 1HG2 ILE 11 14.603 19.907 -16.446
68 HG22 ILE 11 2HG2 ILE 11 13.426 19.327 -15.249
69 HG23 ILE 11 3HG2 ILE 11 12.976 20.587 -16.426
70 HD11 ILE 11 1HD1 ILE 11 12.627 23.457 -15.382
71 HD12 ILE 11 2HD1 ILE 11 11.539 22.057 -15.548
72 HD13 ILE 11 3HD1 ILE 11 11.376 23.148 -14.158
73 H THR 12 H THR 12 17.421 21.533 -14.606
74 HA THR 12 HA THR 12 18.918 19.140 -15.201
75 HB THR 12 HB THR 12 17.697 18.938 -17.243
76 HG1 THR 12 HG1 THR 12 20.098 19.030 -17.350
77 HG21 THR 12 1HG2 THR 12 16.641 21.199 -17.324
78 HG22 THR 12 2HG2 THR 12 17.343 20.716 -18.877
79 HG23 THR 12 3HG2 THR 12 18.201 21.877 -17.858
80 H SER 13 H SER 13 18.537 22.606 -15.825
81 HA SER 13 HA SER 13 21.374 23.140 -16.028
82 HB2 SER 13 1HB SER 13 19.070 25.014 -15.351
83 HB3 SER 13 2HB SER 13 20.670 25.479 -15.972
84 HG SER 13 HG SER 13 19.139 25.396 -17.651
85 H SER 14 H SER 14 22.497 24.604 -14.433
86 HA SER 14 HA SER 14 21.620 24.010 -11.631
87 HB2 SER 14 1HB SER 14 23.764 22.962 -12.339
88 HB3 SER 14 2HB SER 14 24.426 24.584 -12.638
89 HG SER 14 HG SER 14 24.743 23.474 -10.486
90 HA PRO 15 HA PRO 15 21.618 28.600 -12.372
91 HB2 PRO 15 1HB PRO 15 19.110 29.238 -11.608
92 HB3 PRO 15 2HB PRO 15 19.450 28.532 -13.213
93 HG2 PRO 15 1HG PRO 15 18.532 27.149 -10.722
94 HG3 PRO 15 2HG PRO 15 17.818 27.098 -12.366
95 HD2 PRO 15 1HD PRO 15 19.503 25.189 -11.479
96 HD3 PRO 15 2HD PRO 15 19.509 25.746 -13.189
97 H GLN 16 H GLN 16 20.980 26.543 -9.774
98 HA GLN 16 HA GLN 16 20.743 28.450 -7.625
99 HB2 GLN 16 1HB GLN 16 21.680 25.565 -7.710
100 HB3 GLN 16 2HB GLN 16 21.452 26.486 -6.216
101 HG2 GLN 16 1HG GLN 16 19.065 26.776 -6.754
102 HG3 GLN 16 2HG GLN 16 19.290 25.856 -8.250
103 HE21 GLN 16 1HE2 GLN 16 17.977 23.362 -6.012
104 HE22 GLN 16 2HE2 GLN 16 17.442 24.764 -6.903
105 H GLY 17 H GLY 17 23.362 27.643 -9.685
106 HA2 GLY 17 1HA GLY 17 25.467 28.638 -9.633
107 HA3 GLY 17 2HA GLY 17 25.126 29.269 -8.012
108 H LEU 18 H LEU 18 24.640 25.858 -8.673
109 HA LEU 18 HA LEU 18 26.560 25.118 -6.642
110 HB2 LEU 18 1HB LEU 18 25.341 23.349 -8.775
111 HB3 LEU 18 2HB LEU 18 26.081 22.824 -7.279
112 HG LEU 18 HG LEU 18 23.521 24.433 -7.487
113 HD11 LEU 18 1HD1 LEU 18 23.958 21.479 -6.922
114 HD12 LEU 18 2HD1 LEU 18 23.268 22.174 -8.408
115 HD13 LEU 18 3HD1 LEU 18 22.395 22.331 -6.872
116 HD21 LEU 18 1HD2 LEU 18 24.840 23.084 -5.096
117 HD22 LEU 18 2HD2 LEU 18 23.213 23.808 -5.102
118 HD23 LEU 18 3HD2 LEU 18 24.640 24.835 -5.347
119 H ASP 19 H ASP 19 26.586 25.598 -10.071
120 HA ASP 19 HA ASP 19 29.236 24.377 -10.487
121 HB2 ASP 19 1HB ASP 19 27.233 24.374 -12.116
122 HB3 ASP 19 2HB ASP 19 27.588 26.088 -12.384
123 H ASN 20 H ASN 20 27.935 27.338 -9.401
124 HA ASN 20 HA ASN 20 30.451 28.784 -10.052
125 HB2 ASN 20 1HB ASN 20 27.561 29.709 -10.267
126 HB3 ASN 20 2HB ASN 20 28.925 30.809 -10.197
127 HD21 ASN 20 1HD2 ASN 20 30.190 29.833 -13.423
128 HD22 ASN 20 2HD2 ASN 20 30.792 30.012 -11.799
129 HA PRO 21 HA PRO 21 29.593 29.023 -5.480
130 HB2 PRO 21 1HB PRO 21 32.315 29.029 -4.852
131 HB3 PRO 21 2HB PRO 21 31.320 27.557 -4.934
132 HG2 PRO 21 1HG PRO 21 33.079 28.749 -7.029
133 HG3 PRO 21 2HG PRO 21 32.965 27.054 -6.502
134 HD2 PRO 21 1HD PRO 21 31.794 27.825 -8.715
135 HD3 PRO 21 2HD PRO 21 30.943 26.716 -7.583
136 H ALA 22 H ALA 22 31.928 30.633 -7.645
137 HA ALA 22 HA ALA 22 32.469 32.854 -5.971
138 HB1 ALA 22 1HB ALA 22 33.226 33.959 -8.050
139 HB2 ALA 22 2HB ALA 22 33.828 32.290 -7.940
140 HB3 ALA 22 3HB ALA 22 32.459 32.677 -9.015
141 H LEU 23 H LEU 23 29.865 32.306 -8.358
142 HA LEU 23 HA LEU 23 28.870 35.036 -8.098
143 HB2 LEU 23 1HB LEU 23 27.478 32.591 -9.240
144 HB3 LEU 23 2HB LEU 23 27.009 34.268 -9.472
145 HG LEU 23 HG LEU 23 29.473 32.906 -10.599
146 HD11 LEU 23 1HD1 LEU 23 28.345 33.203 -12.748
147 HD12 LEU 23 2HD1 LEU 23 26.981 34.021 -11.949
148 HD13 LEU 23 3HD1 LEU 23 27.295 32.298 -11.640
149 HD21 LEU 23 1HD2 LEU 23 29.839 34.952 -11.904
150 HD22 LEU 23 2HD2 LEU 23 30.027 35.236 -10.160
151 HD23 LEU 23 3HD2 LEU 23 28.543 35.767 -10.990
152 H LEU 24 H LEU 24 27.991 31.794 -6.846
153 HA LEU 24 HA LEU 24 25.569 32.668 -5.630
154 HB2 LEU 24 1HB LEU 24 26.150 30.304 -6.068
155 HB3 LEU 24 2HB LEU 24 27.406 30.385 -4.836
156 HG LEU 24 HG LEU 24 25.744 30.762 -3.100
157 HD11 LEU 24 1HD1 LEU 24 24.017 32.009 -4.227
158 HD12 LEU 24 2HD1 LEU 24 23.300 30.515 -3.602
159 HD13 LEU 24 3HD1 LEU 24 23.689 30.644 -5.332
160 HD21 LEU 24 1HD2 LEU 24 24.626 28.586 -3.166
161 HD22 LEU 24 2HD2 LEU 24 26.326 28.486 -3.658
162 HD23 LEU 24 3HD2 LEU 24 25.044 28.428 -4.887
163 H ARG 25 H ARG 25 28.924 32.471 -4.381
164 HA ARG 25 HA ARG 25 28.372 33.202 -1.688
165 HB2 ARG 25 1HB ARG 25 30.588 32.494 -2.326
166 HB3 ARG 25 2HB ARG 25 30.661 33.699 -3.594
167 HG2 ARG 25 1HG ARG 25 30.504 35.395 -1.537
168 HG3 ARG 25 2HG ARG 25 31.142 34.013 -0.645
169 HD2 ARG 25 1HD ARG 25 32.937 35.507 -1.493
170 HD3 ARG 25 2HD ARG 25 33.037 33.882 -2.182
171 HE ARG 25 HE ARG 25 32.548 34.720 -4.278
172 HH11 ARG 25 1HH1 ARG 25 31.953 37.304 -1.943
173 HH12 ARG 25 2HH1 ARG 25 31.675 38.504 -3.221
174 HH21 ARG 25 1HH2 ARG 25 32.183 36.297 -5.800
175 HH22 ARG 25 2HH2 ARG 25 31.792 37.938 -5.322
176 H ASP 26 H ASP 26 28.880 35.184 -4.622
177 HA ASP 26 HA ASP 26 28.852 37.696 -3.301
178 HB2 ASP 26 1HB ASP 26 29.405 36.876 -5.786
179 HB3 ASP 26 2HB ASP 26 27.751 37.416 -6.072
180 H MET 27 H MET 27 26.231 35.807 -4.830
181 HA MET 27 HA MET 27 24.140 37.708 -4.414
182 HB2 MET 27 1HB MET 27 24.162 35.614 -5.853
183 HB3 MET 27 2HB MET 27 23.908 34.684 -4.381
184 HG2 MET 27 1HG MET 27 22.037 36.878 -5.252
185 HG3 MET 27 2HG MET 27 21.885 35.219 -5.830
186 HE1 MET 27 1HE MET 27 22.423 33.327 -3.275
187 HE2 MET 27 2HE MET 27 20.751 33.203 -2.686
188 HE3 MET 27 3HE MET 27 21.083 33.166 -4.433
189 H LEU 28 H LEU 28 25.175 34.883 -2.510
190 HA LEU 28 HA LEU 28 23.217 35.075 -0.476
191 HB2 LEU 28 1HB LEU 28 25.996 33.960 -0.517
192 HB3 LEU 28 2HB LEU 28 24.934 33.847 0.883
193 HG LEU 28 HG LEU 28 24.245 32.713 -1.832
194 HD11 LEU 28 1HD1 LEU 28 25.475 31.507 0.635
195 HD12 LEU 28 2HD1 LEU 28 26.218 31.694 -0.965
196 HD13 LEU 28 3HD1 LEU 28 24.857 30.575 -0.752
197 HD21 LEU 28 1HD2 LEU 28 22.618 31.383 -0.494
198 HD22 LEU 28 2HD2 LEU 28 22.287 33.116 -0.481
199 HD23 LEU 28 3HD2 LEU 28 23.040 32.356 0.936
200 H LEU 29 H LEU 29 26.491 36.497 -0.667
201 HA LEU 29 HA LEU 29 26.471 37.611 1.992
202 HB2 LEU 29 1HB LEU 29 27.893 38.391 -0.569
203 HB3 LEU 29 2HB LEU 29 28.111 39.289 0.929
204 HG LEU 29 HG LEU 29 28.727 36.337 0.672
205 HD11 LEU 29 1HD1 LEU 29 30.587 38.721 0.411
206 HD12 LEU 29 2HD1 LEU 29 30.092 37.613 -0.895
207 HD13 LEU 29 3HD1 LEU 29 31.078 37.008 0.454
208 HD21 LEU 29 1HD2 LEU 29 29.544 38.413 2.740
209 HD22 LEU 29 2HD2 LEU 29 30.086 36.720 2.695
210 HD23 LEU 29 3HD2 LEU 29 28.378 37.090 2.984
211 H ALA 30 H ALA 30 25.179 38.684 -1.108
212 HA ALA 30 HA ALA 30 24.445 41.307 -0.027
213 HB1 ALA 30 1HB ALA 30 25.207 40.998 -2.379
214 HB2 ALA 30 2HB ALA 30 23.768 40.000 -2.694
215 HB3 ALA 30 3HB ALA 30 23.585 41.717 -2.271
216 H ASN 31 H ASN 31 23.081 38.207 0.325
217 HA ASN 31 HA ASN 31 20.330 39.413 0.403
218 HB2 ASN 31 1HB ASN 31 20.850 37.690 -1.407
219 HB3 ASN 31 2HB ASN 31 20.980 36.520 -0.122
220 HD21 ASN 31 1HD2 ASN 31 17.489 36.947 -1.657
221 HD22 ASN 31 2HD2 ASN 31 19.071 36.970 -2.398
222 HA PRO 32 HA PRO 32 21.173 38.188 4.646
223 HB2 PRO 32 1HB PRO 32 19.157 39.598 5.866
224 HB3 PRO 32 2HB PRO 32 20.709 40.336 5.335
225 HG2 PRO 32 1HG PRO 32 18.073 40.249 3.870
226 HG3 PRO 32 2HG PRO 32 19.123 41.661 4.218
227 HD2 PRO 32 1HD PRO 32 19.232 40.452 1.852
228 HD3 PRO 32 2HD PRO 32 20.741 41.002 2.666
229 H HIS 33 H HIS 33 18.076 37.846 2.927
230 HA HIS 33 HA HIS 33 16.911 36.133 4.985
231 HB2 HIS 33 1HB HIS 33 15.531 37.437 3.404
232 HB3 HIS 33 2HB HIS 33 16.211 36.524 2.053
233 HD1 HIS 33 HD1 HIS 33 13.957 36.017 5.100
234 HD2 HIS 33 HD2 HIS 33 15.025 34.105 1.547
235 HE1 HIS 33 HE1 HIS 33 12.390 34.056 4.817
236 H GLU 34 H GLU 34 18.704 35.732 1.976
237 HA GLU 34 HA GLU 34 18.266 32.859 1.781
238 HB2 GLU 34 1HB GLU 34 19.738 34.996 0.372
239 HB3 GLU 34 2HB GLU 34 20.387 33.411 0.160
240 HG2 GLU 34 1HG GLU 34 17.481 34.070 -0.351
241 HG3 GLU 34 2HG GLU 34 18.738 34.240 -1.586
242 H LEU 35 H LEU 35 20.748 35.055 3.051
243 HA LEU 35 HA LEU 35 22.594 32.928 3.679
244 HB2 LEU 35 1HB LEU 35 23.959 34.520 4.359
245 HB3 LEU 35 2HB LEU 35 22.892 35.459 3.377
246 HG LEU 35 HG LEU 35 21.786 36.328 5.409
247 HD11 LEU 35 1HD1 LEU 35 23.201 36.265 7.516
248 HD12 LEU 35 2HD1 LEU 35 23.961 34.802 6.841
249 HD13 LEU 35 3HD1 LEU 35 22.214 34.840 7.185
250 HD21 LEU 35 1HD2 LEU 35 23.702 37.833 5.813
251 HD22 LEU 35 2HD2 LEU 35 23.533 37.420 4.092
252 HD23 LEU 35 3HD2 LEU 35 24.779 36.619 5.072
253 H SER 36 H SER 36 19.753 34.318 5.225
254 HA SER 36 HA SER 36 20.309 33.272 7.852
255 HB2 SER 36 1HB SER 36 18.732 35.165 7.353
256 HB3 SER 36 2HB SER 36 17.583 33.970 6.718
257 HG SER 36 HG SER 36 17.542 33.011 8.778
258 H LEU 37 H LEU 37 18.308 32.072 5.090
259 HA LEU 37 HA LEU 37 17.460 29.728 6.554
260 HB2 LEU 37 1HB LEU 37 16.704 28.857 4.526
261 HB3 LEU 37 2HB LEU 37 16.409 30.547 4.600
262 HG LEU 37 HG LEU 37 18.367 30.826 2.997
263 HD11 LEU 37 1HD1 LEU 37 18.610 28.965 1.439
264 HD12 LEU 37 2HD1 LEU 37 17.527 27.970 2.443
265 HD13 LEU 37 3HD1 LEU 37 19.107 28.475 3.067
266 HD21 LEU 37 1HD2 LEU 37 16.050 31.392 2.514
267 HD22 LEU 37 2HD2 LEU 37 15.671 29.680 2.206
268 HD23 LEU 37 3HD2 LEU 37 16.772 30.564 1.122
269 H LEU 38 H LEU 38 20.284 30.615 4.780
270 HA LEU 38 HA LEU 38 21.260 27.962 4.452
271 HB2 LEU 38 1HB LEU 38 21.804 29.989 3.186
272 HB3 LEU 38 2HB LEU 38 22.728 30.589 4.574
273 HG LEU 38 HG LEU 38 24.198 28.588 4.458
274 HD11 LEU 38 1HD1 LEU 38 24.236 27.314 2.344
275 HD12 LEU 38 2HD1 LEU 38 22.749 28.146 1.829
276 HD13 LEU 38 3HD1 LEU 38 22.734 27.072 3.246
277 HD21 LEU 38 1HD2 LEU 38 24.079 30.334 1.989
278 HD22 LEU 38 2HD2 LEU 38 25.496 29.399 2.528
279 HD23 LEU 38 3HD2 LEU 38 24.881 30.730 3.527
280 H LYS 39 H LYS 39 21.985 30.482 6.925
281 HA LYS 39 HA LYS 39 23.703 28.696 8.434
282 HB2 LYS 39 1HB LYS 39 23.483 30.261 10.310
283 HB3 LYS 39 2HB LYS 39 23.941 31.066 8.809
284 HG2 LYS 39 1HG LYS 39 21.972 32.240 8.671
285 HG3 LYS 39 2HG LYS 39 21.034 30.946 9.391
286 HD2 LYS 39 1HD LYS 39 20.829 32.609 10.926
287 HD3 LYS 39 2HD LYS 39 22.094 31.590 11.625
288 HE2 LYS 39 1HE LYS 39 23.806 33.170 10.947
289 HE3 LYS 39 2HE LYS 39 22.637 34.095 9.966
290 HZ1 LYS 39 1HZ LYS 39 23.016 35.109 12.186
291 HZ2 LYS 39 2HZ LYS 39 22.455 33.748 12.929
292 HZ3 LYS 39 3HZ LYS 39 21.443 34.659 12.003
293 H GLU 40 H GLU 40 20.212 29.064 8.274
294 HA GLU 40 HA GLU 40 19.708 27.528 10.676
295 HB2 GLU 40 1HB GLU 40 18.100 28.224 8.224
296 HB3 GLU 40 2HB GLU 40 17.493 27.067 9.402
297 HG2 GLU 40 1HG GLU 40 17.682 28.793 11.157
298 HG3 GLU 40 2HG GLU 40 18.134 29.967 9.904
299 H ARG 41 H ARG 41 19.554 26.740 7.163
300 HA ARG 41 HA ARG 41 19.093 23.923 7.917
301 HB2 ARG 41 1HB ARG 41 19.124 25.287 5.216
302 HB3 ARG 41 2HB ARG 41 18.543 23.652 5.559
303 HG2 ARG 41 1HG ARG 41 16.938 24.679 7.208
304 HG3 ARG 41 2HG ARG 41 17.417 26.263 6.605
305 HD2 ARG 41 1HD ARG 41 16.729 25.549 4.318
306 HD3 ARG 41 2HD ARG 41 16.070 24.062 5.048
307 HE ARG 41 HE ARG 41 15.112 26.376 6.454
308 HH11 ARG 41 1HH1 ARG 41 14.602 24.690 3.394
309 HH12 ARG 41 2HH1 ARG 41 12.970 25.277 3.234
310 HH21 ARG 41 1HH2 ARG 41 13.041 27.089 6.189
311 HH22 ARG 41 2HH2 ARG 41 12.098 26.617 4.801
312 H ASN 42 H ASN 42 21.771 25.707 6.644
313 HA ASN 42 HA ASN 42 23.276 23.129 6.434
314 HB2 ASN 42 1HB ASN 42 22.577 24.060 4.162
315 HB3 ASN 42 2HB ASN 42 23.667 25.399 4.462
316 HD21 ASN 42 1HD2 ASN 42 25.465 22.797 2.545
317 HD22 ASN 42 2HD2 ASN 42 24.123 23.877 2.307
318 HA PRO 43 HA PRO 43 25.305 26.424 8.961
319 HB2 PRO 43 1HB PRO 43 26.470 24.658 10.806
320 HB3 PRO 43 2HB PRO 43 24.940 25.567 11.012
321 HG2 PRO 43 1HG PRO 43 25.351 22.731 10.126
322 HG3 PRO 43 2HG PRO 43 24.131 23.409 11.242
323 HD2 PRO 43 1HD PRO 43 23.529 22.798 8.694
324 HD3 PRO 43 2HD PRO 43 22.827 24.245 9.499
325 HA PRO 44 HA PRO 44 29.496 24.595 8.131
326 HB2 PRO 44 1HB PRO 44 29.906 22.645 6.256
327 HB3 PRO 44 2HB PRO 44 29.676 22.296 8.001
328 HG2 PRO 44 1HG PRO 44 27.662 22.247 5.793
329 HG3 PRO 44 2HG PRO 44 28.039 20.989 7.010
330 HD2 PRO 44 1HD PRO 44 25.975 22.661 7.369
331 HD3 PRO 44 2HD PRO 44 27.026 22.199 8.748
332 H LEU 45 H LEU 45 27.164 24.531 5.326
333 HA LEU 45 HA LEU 45 29.136 25.810 3.604
334 HB2 LEU 45 1HB LEU 45 27.237 24.504 2.725
335 HB3 LEU 45 2HB LEU 45 26.136 25.751 3.315
336 HG LEU 45 HG LEU 45 27.057 27.381 1.757
337 HD11 LEU 45 1HD1 LEU 45 29.415 26.713 1.642
338 HD12 LEU 45 2HD1 LEU 45 28.723 26.716 0.016
339 HD13 LEU 45 3HD1 LEU 45 28.973 25.175 0.864
340 HD21 LEU 45 1HD2 LEU 45 26.292 26.381 -0.323
341 HD22 LEU 45 2HD2 LEU 45 25.269 25.821 1.011
342 HD23 LEU 45 3HD2 LEU 45 26.513 24.743 0.338
343 H ALA 46 H ALA 46 26.638 26.826 5.873
344 HA ALA 46 HA ALA 46 26.604 29.570 5.085
345 HB1 ALA 46 1HB ALA 46 26.154 28.416 7.842
346 HB2 ALA 46 2HB ALA 46 25.576 29.977 7.214
347 HB3 ALA 46 3HB ALA 46 24.947 28.459 6.542
348 H GLU 47 H GLU 47 28.508 27.941 7.715
349 HA GLU 47 HA GLU 47 29.779 30.342 8.536
350 HB2 GLU 47 1HB GLU 47 31.398 29.035 9.680
351 HB3 GLU 47 2HB GLU 47 29.817 28.276 9.868
352 HG2 GLU 47 1HG GLU 47 30.385 26.486 8.446
353 HG3 GLU 47 2HG GLU 47 31.779 27.343 7.775
354 H ALA 48 H ALA 48 30.610 28.177 5.885
355 HA ALA 48 HA ALA 48 33.103 29.211 5.225
356 HB1 ALA 48 1HB ALA 48 32.722 28.170 3.100
357 HB2 ALA 48 2HB ALA 48 31.924 27.150 4.304
358 HB3 ALA 48 3HB ALA 48 30.968 28.256 3.293
359 H LEU 49 H LEU 49 29.849 30.316 4.418
360 HA LEU 49 HA LEU 49 30.719 32.455 2.673
361 HB2 LEU 49 1HB LEU 49 28.434 31.403 2.674
362 HB3 LEU 49 2HB LEU 49 28.149 32.117 4.257
363 HG LEU 49 HG LEU 49 28.661 34.386 3.068
364 HD11 LEU 49 1HD1 LEU 49 27.926 34.358 0.703
365 HD12 LEU 49 2HD1 LEU 49 27.891 32.587 0.748
366 HD13 LEU 49 3HD1 LEU 49 29.428 33.456 0.959
367 HD21 LEU 49 1HD2 LEU 49 26.531 33.728 4.076
368 HD22 LEU 49 2HD2 LEU 49 26.099 32.832 2.603
369 HD23 LEU 49 3HD2 LEU 49 26.283 34.604 2.557
370 H LEU 50 H LEU 50 29.798 32.190 6.127
371 HA LEU 50 HA LEU 50 29.774 34.996 6.673
372 HB2 LEU 50 1HB LEU 50 30.617 32.850 8.641
373 HB3 LEU 50 2HB LEU 50 29.928 34.418 9.003
374 HG LEU 50 HG LEU 50 28.562 31.942 8.040
375 HD11 LEU 50 1HD1 LEU 50 27.232 32.213 10.027
376 HD12 LEU 50 2HD1 LEU 50 28.095 33.728 10.404
377 HD13 LEU 50 3HD1 LEU 50 28.964 32.170 10.402
378 HD21 LEU 50 1HD2 LEU 50 26.422 33.207 7.993
379 HD22 LEU 50 2HD2 LEU 50 27.534 33.539 6.652
380 HD23 LEU 50 3HD2 LEU 50 27.386 34.707 7.996
381 H SER 51 H SER 51 32.302 32.586 6.574
382 HA SER 51 HA SER 51 34.364 34.142 7.825
383 HB2 SER 51 1HB SER 51 34.222 31.641 7.505
384 HB3 SER 51 2HB SER 51 34.637 31.924 5.808
385 HG SER 51 HG SER 51 36.491 33.181 6.839
386 H GLY 52 H GLY 52 33.016 34.067 4.597
387 HA2 GLY 52 1HA GLY 52 33.351 35.657 2.943
388 HA3 GLY 52 2HA GLY 52 34.752 36.286 3.818
389 H ASP 53 H ASP 53 35.675 33.302 3.901
390 HA ASP 53 HA ASP 53 37.501 33.591 1.710
391 HB2 ASP 53 1HB ASP 53 37.868 32.331 3.933
392 HB3 ASP 53 2HB ASP 53 36.948 31.058 3.219
393 H LEU 54 H LEU 54 36.974 33.305 -0.378
394 HA LEU 54 HA LEU 54 34.713 31.751 -1.230
395 HB2 LEU 54 1HB LEU 54 35.762 33.617 -2.500
396 HB3 LEU 54 2HB LEU 54 37.167 32.603 -2.791
397 HG LEU 54 HG LEU 54 35.357 32.947 -4.589
398 HD11 LEU 54 1HD1 LEU 54 37.327 31.544 -4.843
399 HD12 LEU 54 2HD1 LEU 54 35.923 30.896 -5.680
400 HD13 LEU 54 3HD1 LEU 54 36.441 30.193 -4.151
401 HD21 LEU 54 1HD2 LEU 54 33.623 31.302 -4.824
402 HD22 LEU 54 2HD2 LEU 54 33.390 32.152 -3.285
403 HD23 LEU 54 3HD2 LEU 54 34.098 30.528 -3.310
404 H GLU 55 H GLU 55 38.150 31.060 -0.739
405 HA GLU 55 HA GLU 55 38.270 28.570 -2.088
406 HB2 GLU 55 1HB GLU 55 39.631 29.313 0.523
407 HB3 GLU 55 2HB GLU 55 40.104 28.002 -0.549
408 HG2 GLU 55 1HG GLU 55 40.106 30.919 -1.369
409 HG3 GLU 55 2HG GLU 55 41.484 30.089 -0.647
410 H LYS 56 H LYS 56 37.525 29.211 1.399
411 HA LYS 56 HA LYS 56 36.775 26.464 1.803
412 HB2 LYS 56 1HB LYS 56 36.201 26.949 3.985
413 HB3 LYS 56 2HB LYS 56 37.464 28.167 3.604
414 HG2 LYS 56 1HG LYS 56 35.526 29.713 3.235
415 HG3 LYS 56 2HG LYS 56 34.569 28.464 4.003
416 HD2 LYS 56 1HD LYS 56 37.134 29.271 5.335
417 HD3 LYS 56 2HD LYS 56 35.765 30.354 5.433
418 HE2 LYS 56 1HE LYS 56 34.366 28.513 6.381
419 HE3 LYS 56 2HE LYS 56 35.778 27.450 6.338
420 HZ1 LYS 56 1HZ LYS 56 35.362 28.429 8.521
421 HZ2 LYS 56 2HZ LYS 56 35.576 29.952 7.912
422 HZ3 LYS 56 3HZ LYS 56 36.839 28.890 7.937
423 H PHE 57 H PHE 57 34.878 29.342 0.855
424 HA PHE 57 HA PHE 57 32.336 28.084 1.139
425 HB2 PHE 57 1HB PHE 57 32.645 30.500 0.731
426 HB3 PHE 57 2HB PHE 57 33.168 30.144 -0.919
427 HD1 PHE 57 HD1 PHE 57 31.573 29.752 -2.664
428 HD2 PHE 57 HD2 PHE 57 30.280 29.897 1.441
429 HE1 PHE 57 HE1 PHE 57 29.199 29.773 -3.411
430 HE2 PHE 57 HE2 PHE 57 27.906 29.902 0.695
431 HZ PHE 57 HZ PHE 57 27.365 29.836 -1.739
432 H SER 58 H SER 58 34.448 28.264 -1.771
433 HA SER 58 HA SER 58 32.791 26.590 -3.368
434 HB2 SER 58 1HB SER 58 34.648 28.037 -4.206
435 HB3 SER 58 2HB SER 58 35.818 26.938 -3.447
436 HG SER 58 HG SER 58 34.988 25.271 -4.800
437 H ARG 59 H ARG 59 35.426 25.819 -1.095
438 HA ARG 59 HA ARG 59 35.659 23.060 -1.805
439 HB2 ARG 59 1HB ARG 59 37.367 24.123 -0.497
440 HB3 ARG 59 2HB ARG 59 36.217 24.613 0.734
441 HG2 ARG 59 1HG ARG 59 36.285 21.704 0.387
442 HG3 ARG 59 2HG ARG 59 37.861 22.385 0.819
443 HD2 ARG 59 1HD ARG 59 35.708 23.600 2.389
444 HD3 ARG 59 2HD ARG 59 35.719 21.849 2.563
445 HE ARG 59 HE ARG 59 37.870 23.721 3.340
446 HH11 ARG 59 1HH1 ARG 59 36.742 20.355 3.212
447 HH12 ARG 59 2HH1 ARG 59 37.920 19.848 4.400
448 HH21 ARG 59 1HH2 ARG 59 39.350 22.962 4.806
449 HH22 ARG 59 2HH2 ARG 59 39.358 21.282 5.273
450 H VAL 60 H VAL 60 33.657 24.674 0.739
451 HA VAL 60 HA VAL 60 32.509 22.145 1.534
452 HB VAL 60 HB VAL 60 31.433 24.965 1.985
453 HG11 VAL 60 1HG1 VAL 60 30.752 22.266 3.237
454 HG12 VAL 60 2HG1 VAL 60 30.259 23.830 3.917
455 HG13 VAL 60 3HG1 VAL 60 29.661 23.337 2.322
456 HG21 VAL 60 1HG2 VAL 60 32.463 24.711 4.242
457 HG22 VAL 60 2HG2 VAL 60 33.158 23.151 3.740
458 HG23 VAL 60 3HG2 VAL 60 33.682 24.658 2.963
459 H LEU 61 H LEU 61 31.651 24.640 -0.856
460 HA LEU 61 HA LEU 61 29.021 23.787 -1.402
461 HB2 LEU 61 1HB LEU 61 30.319 25.819 -2.285
462 HB3 LEU 61 2HB LEU 61 30.977 24.739 -3.507
463 HG LEU 61 HG LEU 61 28.270 24.273 -3.740
464 HD11 LEU 61 1HD1 LEU 61 27.836 26.066 -2.090
465 HD12 LEU 61 2HD1 LEU 61 27.191 26.460 -3.694
466 HD13 LEU 61 3HD1 LEU 61 28.705 27.219 -3.138
467 HD21 LEU 61 1HD2 LEU 61 28.372 25.513 -5.754
468 HD22 LEU 61 2HD2 LEU 61 29.991 24.830 -5.525
469 HD23 LEU 61 3HD2 LEU 61 29.662 26.538 -5.153
470 H VAL 62 H VAL 62 32.124 22.602 -2.833
471 HA VAL 62 HA VAL 62 30.657 20.703 -4.487
472 HB VAL 62 HB VAL 62 32.836 21.671 -5.202
473 HG11 VAL 62 1HG1 VAL 62 34.950 20.734 -4.350
474 HG12 VAL 62 2HG1 VAL 62 34.082 21.650 -3.114
475 HG13 VAL 62 3HG1 VAL 62 34.062 19.875 -3.076
476 HG21 VAL 62 1HG2 VAL 62 33.713 19.615 -6.182
477 HG22 VAL 62 2HG2 VAL 62 32.839 18.645 -4.977
478 HG23 VAL 62 3HG2 VAL 62 31.938 19.589 -6.186
479 H GLU 63 H GLU 63 32.269 20.584 -1.328
480 HA GLU 63 HA GLU 63 32.186 17.744 -0.998
481 HB2 GLU 63 1HB GLU 63 32.132 20.073 0.911
482 HB3 GLU 63 2HB GLU 63 32.028 18.409 1.497
483 HG2 GLU 63 1HG GLU 63 34.170 17.850 0.569
484 HG3 GLU 63 2HG GLU 63 34.267 19.388 -0.294
485 H GLN 64 H GLN 64 29.755 20.275 -0.238
486 HA GLN 64 HA GLN 64 27.823 18.503 0.908
487 HB2 GLN 64 1HB GLN 64 27.614 21.145 -0.567
488 HB3 GLN 64 2HB GLN 64 26.195 20.321 0.089
489 HG2 GLN 64 1HG GLN 64 28.595 21.085 1.788
490 HG3 GLN 64 2HG GLN 64 27.189 22.130 1.559
491 HE21 GLN 64 1HE2 GLN 64 27.072 19.520 4.492
492 HE22 GLN 64 2HE2 GLN 64 28.510 20.157 3.736
493 H GLN 65 H GLN 65 28.536 19.351 -2.484
494 HA GLN 65 HA GLN 65 26.192 17.992 -3.528
495 HB2 GLN 65 1HB GLN 65 28.827 18.780 -4.812
496 HB3 GLN 65 2HB GLN 65 27.477 18.061 -5.696
497 HG2 GLN 65 1HG GLN 65 26.042 19.946 -5.136
498 HG3 GLN 65 2HG GLN 65 27.308 20.655 -4.132
499 HE21 GLN 65 1HE2 GLN 65 28.742 22.397 -6.760
500 HE22 GLN 65 2HE2 GLN 65 28.551 22.147 -5.031
501 H GLN 66 H GLN 66 29.572 16.999 -2.881
502 HA GLN 66 HA GLN 66 29.277 14.370 -4.032
503 HB2 GLN 66 1HB GLN 66 31.131 15.442 -1.881
504 HB3 GLN 66 2HB GLN 66 31.259 13.823 -2.572
505 HG2 GLN 66 1HG GLN 66 31.727 14.742 -4.767
506 HG3 GLN 66 2HG GLN 66 31.475 16.383 -4.171
507 HE21 GLN 66 1HE2 GLN 66 34.649 16.737 -2.771
508 HE22 GLN 66 2HE2 GLN 66 33.051 17.411 -3.000
509 H ASP 67 H ASP 67 28.743 15.713 -0.761
510 HA ASP 67 HA ASP 67 28.228 13.201 0.500
511 HB2 ASP 67 1HB ASP 67 28.653 15.422 1.579
512 HB3 ASP 67 2HB ASP 67 26.974 15.872 1.238
513 H ARG 68 H ARG 68 26.133 15.633 -1.015
514 HA ARG 68 HA ARG 68 23.638 14.330 -0.562
515 HB2 ARG 68 1HB ARG 68 24.682 16.214 -2.649
516 HB3 ARG 68 2HB ARG 68 23.227 15.301 -3.035
517 HG2 ARG 68 1HG ARG 68 22.386 16.141 -0.699
518 HG3 ARG 68 2HG ARG 68 23.629 17.393 -0.921
519 HD2 ARG 68 1HD ARG 68 21.589 18.264 -1.842
520 HD3 ARG 68 2HD ARG 68 22.617 17.808 -3.221
521 HE ARG 68 HE ARG 68 20.934 15.593 -2.473
522 HH11 ARG 68 1HH1 ARG 68 20.725 18.710 -4.167
523 HH12 ARG 68 2HH1 ARG 68 19.369 18.191 -5.124
524 HH21 ARG 68 1HH2 ARG 68 19.255 15.021 -3.686
525 HH22 ARG 68 2HH2 ARG 68 18.539 16.119 -4.855
526 H ALA 69 H ALA 69 25.991 13.925 -3.221
527 HA ALA 69 HA ALA 69 24.450 11.973 -4.606
528 HB1 ALA 69 1HB ALA 69 27.485 12.308 -4.519
529 HB2 ALA 69 2HB ALA 69 26.553 11.454 -5.771
530 HB3 ALA 69 3HB ALA 69 26.382 13.215 -5.580
531 H ARG 70 H ARG 70 26.962 11.593 -2.011
532 HA ARG 70 HA ARG 70 26.976 8.725 -2.276
533 HB2 ARG 70 1HB ARG 70 28.525 8.699 -0.606
534 HB3 ARG 70 2HB ARG 70 28.653 10.398 -1.099
535 HG2 ARG 70 1HG ARG 70 27.283 11.054 0.789
536 HG3 ARG 70 2HG ARG 70 27.081 9.378 1.280
537 HD2 ARG 70 1HD ARG 70 29.486 9.227 1.750
538 HD3 ARG 70 2HD ARG 70 29.717 10.870 1.108
539 HE ARG 70 HE ARG 70 28.634 11.828 2.976
540 HH11 ARG 70 1HH1 ARG 70 28.718 8.279 3.329
541 HH12 ARG 70 2HH1 ARG 70 28.329 8.349 5.023
542 HH21 ARG 70 1HH2 ARG 70 28.124 11.835 5.083
543 HH22 ARG 70 2HH2 ARG 70 27.984 10.342 5.992
544 H ARG 71 H ARG 71 25.139 10.939 -0.099
545 HA ARG 71 HA ARG 71 24.034 8.676 1.307
546 HB2 ARG 71 1HB ARG 71 22.778 10.245 2.565
547 HB3 ARG 71 2HB ARG 71 24.368 10.938 2.274
548 HG2 ARG 71 1HG ARG 71 23.192 12.169 0.304
549 HG3 ARG 71 2HG ARG 71 21.710 11.776 1.182
550 HD2 ARG 71 1HD ARG 71 22.863 12.765 3.248
551 HD3 ARG 71 2HD ARG 71 24.111 13.353 2.136
552 HE ARG 71 HE ARG 71 21.423 14.116 1.346
553 HH11 ARG 71 1HH1 ARG 71 24.207 15.078 3.332
554 HH12 ARG 71 2HH1 ARG 71 23.636 16.726 3.462
555 HH21 ARG 71 1HH2 ARG 71 20.806 16.250 1.548
556 HH22 ARG 71 2HH2 ARG 71 21.783 17.375 2.453
557 H GLU 72 H GLU 72 22.782 10.707 -1.371
558 HA GLU 72 HA GLU 72 20.172 9.608 -1.396
559 HB2 GLU 72 1HB GLU 72 21.878 11.072 -3.276
560 HB3 GLU 72 2HB GLU 72 20.820 9.933 -4.084
561 HG2 GLU 72 1HG GLU 72 19.665 12.011 -4.022
562 HG3 GLU 72 2HG GLU 72 18.873 10.946 -2.858
563 H GLN 73 H GLN 73 23.207 8.320 -2.798
564 HA GLN 73 HA GLN 73 21.970 6.154 -4.216
565 HB2 GLN 73 1HB GLN 73 24.733 6.523 -3.029
566 HB3 GLN 73 2HB GLN 73 24.262 5.075 -3.924
567 HG2 GLN 73 1HG GLN 73 23.804 6.385 -5.915
568 HG3 GLN 73 2HG GLN 73 24.142 7.882 -5.043
569 HE21 GLN 73 1HE2 GLN 73 27.616 7.652 -5.304
570 HE22 GLN 73 2HE2 GLN 73 26.239 8.479 -4.600
571 H GLU 74 H GLU 74 23.076 6.499 -0.832
572 HA GLU 74 HA GLU 74 22.556 3.718 -0.206
573 HB2 GLU 74 1HB GLU 74 22.902 6.179 1.512
574 HB3 GLU 74 2HB GLU 74 22.693 4.543 2.147
575 HG2 GLU 74 1HG GLU 74 24.715 3.823 0.914
576 HG3 GLU 74 2HG GLU 74 24.937 5.482 0.337
577 H ARG 75 H ARG 75 20.645 6.731 -0.086
578 HA ARG 75 HA ARG 75 18.485 5.582 1.437
579 HB2 ARG 75 1HB ARG 75 18.433 7.912 -0.526
580 HB3 ARG 75 2HB ARG 75 17.121 7.469 0.580
581 HG2 ARG 75 1HG ARG 75 18.921 7.672 2.446
582 HG3 ARG 75 2HG ARG 75 19.842 8.570 1.257
583 HD2 ARG 75 1HD ARG 75 17.115 9.293 2.296
584 HD3 ARG 75 2HD ARG 75 18.650 10.039 2.743
585 HE ARG 75 HE ARG 75 18.838 10.932 0.460
586 HH11 ARG 75 1HH1 ARG 75 15.603 9.889 1.477
587 HH12 ARG 75 2HH1 ARG 75 14.818 10.978 0.366
588 HH21 ARG 75 1HH2 ARG 75 17.789 12.270 -0.877
589 HH22 ARG 75 2HH2 ARG 75 16.034 12.305 -0.958
590 H ILE 76 H ILE 76 19.072 5.749 -2.118
591 HA ILE 76 HA ILE 76 16.544 4.382 -2.636
592 HB ILE 76 HB ILE 76 17.257 4.203 -4.960
593 HG12 ILE 76 1HG1 ILE 76 19.924 5.342 -4.067
594 HG13 ILE 76 2HG1 ILE 76 19.653 3.656 -4.497
595 HG21 ILE 76 1HG2 ILE 76 17.364 6.582 -5.473
596 HG22 ILE 76 2HG2 ILE 76 16.363 6.387 -4.024
597 HG23 ILE 76 3HG2 ILE 76 18.041 6.957 -3.873
598 HD11 ILE 76 1HD1 ILE 76 19.472 6.061 -6.338
599 HD12 ILE 76 2HD1 ILE 76 20.673 4.753 -6.367
600 HD13 ILE 76 3HD1 ILE 76 18.982 4.413 -6.801
601 H ARG 77 H ARG 77 19.690 3.362 -1.655
602 HA ARG 77 HA ARG 77 19.513 0.637 -2.672
603 HB2 ARG 77 1HB ARG 77 21.348 2.277 -1.129
604 HB3 ARG 77 2HB ARG 77 21.140 0.718 -0.349
605 HG2 ARG 77 1HG ARG 77 21.835 1.025 -3.277
606 HG3 ARG 77 2HG ARG 77 23.049 0.908 -1.989
607 HD2 ARG 77 1HD ARG 77 22.080 -1.254 -1.276
608 HD3 ARG 77 2HD ARG 77 20.905 -1.156 -2.605
609 HE ARG 77 HE ARG 77 23.534 -0.864 -3.656
610 HH11 ARG 77 1HH1 ARG 77 21.494 -3.365 -2.241
611 HH12 ARG 77 2HH1 ARG 77 22.298 -4.650 -3.105
612 HH21 ARG 77 1HH2 ARG 77 24.520 -2.551 -4.730
613 HH22 ARG 77 2HH2 ARG 77 23.986 -4.192 -4.486
614 H LEU 78 H LEU 78 18.026 2.348 -0.156
615 HA LEU 78 HA LEU 78 16.718 1.906 1.584
616 HB2 LEU 78 1HB LEU 78 15.550 0.487 0.069
617 HB3 LEU 78 2HB LEU 78 16.642 -0.843 0.382
618 HG LEU 78 HG LEU 78 15.817 -0.990 2.717
619 HD11 LEU 78 1HD1 LEU 78 13.822 1.120 1.793
620 HD12 LEU 78 2HD1 LEU 78 15.040 1.298 3.081
621 HD13 LEU 78 3HD1 LEU 78 13.687 0.169 3.292
622 HD21 LEU 78 1HD2 LEU 78 14.888 -2.397 0.924
623 HD22 LEU 78 2HD2 LEU 78 13.667 -1.151 0.570
624 HD23 LEU 78 3HD2 LEU 78 13.656 -1.997 2.136
625 H PHE 79 H PHE 79 19.197 -0.659 1.265
626 HA PHE 79 HA PHE 79 19.369 -0.715 4.238
627 HB2 PHE 79 1HB PHE 79 20.791 -2.451 2.201
628 HB3 PHE 79 2HB PHE 79 20.733 -2.690 3.950
629 HD1 PHE 79 HD1 PHE 79 18.559 -3.422 5.018
630 HD2 PHE 79 HD2 PHE 79 18.971 -3.119 0.745
631 HE1 PHE 79 HE1 PHE 79 16.491 -4.792 4.721
632 HE2 PHE 79 HE2 PHE 79 16.913 -4.483 0.439
633 HZ PHE 79 HZ PHE 79 15.667 -5.323 2.431
634 H SER 80 H SER 80 20.895 0.402 5.230
635 HA SER 80 HA SER 80 23.569 0.557 4.028
636 HB2 SER 80 1HB SER 80 22.579 2.712 3.324
637 HB3 SER 80 2HB SER 80 22.065 3.030 4.997
638 HG SER 80 HG SER 80 24.146 4.010 4.325
639 H ALA 81 H ALA 81 25.100 0.892 5.651
640 HA ALA 81 HA ALA 81 24.107 0.638 8.448
641 HB1 ALA 81 1HB ALA 81 26.023 -0.836 8.931
642 HB2 ALA 81 2HB ALA 81 25.044 -1.527 7.616
643 HB3 ALA 81 3HB ALA 81 26.578 -0.697 7.249
644 H ASP 82 H ASP 82 25.030 2.896 6.639
645 HA ASP 82 HA ASP 82 27.237 3.950 8.364
646 HB2 ASP 82 1HB ASP 82 27.483 3.540 5.733
647 HB3 ASP 82 2HB ASP 82 26.603 5.075 5.641
648 HA PRO 83 HA PRO 83 24.116 6.857 9.459
649 HB2 PRO 83 1HB PRO 83 25.473 9.067 10.271
650 HB3 PRO 83 2HB PRO 83 25.559 7.522 11.180
651 HG2 PRO 83 1HG PRO 83 27.452 8.601 9.107
652 HG3 PRO 83 2HG PRO 83 27.813 8.017 10.765
653 HD2 PRO 83 1HD PRO 83 28.103 6.416 8.615
654 HD3 PRO 83 2HD PRO 83 27.481 5.765 10.166
655 H PHE 84 H PHE 84 23.080 8.879 8.894
656 HA PHE 84 HA PHE 84 23.766 9.803 6.154
657 HB2 PHE 84 1HB PHE 84 21.110 9.619 7.628
658 HB3 PHE 84 2HB PHE 84 21.327 10.457 6.087
659 HD1 PHE 84 HD1 PHE 84 21.279 7.115 7.713
660 HD2 PHE 84 HD2 PHE 84 21.655 9.270 4.017
661 HE1 PHE 84 HE1 PHE 84 20.960 4.994 6.450
662 HE2 PHE 84 HE2 PHE 84 21.344 7.158 2.745
663 HZ PHE 84 HZ PHE 84 20.992 5.012 3.956
664 H ASP 85 H ASP 85 24.992 10.615 8.541
665 HA ASP 85 HA ASP 85 25.884 12.419 9.432
666 HB2 ASP 85 1HB ASP 85 25.867 13.037 7.049
667 HB3 ASP 85 2HB ASP 85 24.430 14.019 7.362
668 H LEU 86 H LEU 86 25.563 13.007 11.316
669 HA LEU 86 HA LEU 86 23.023 13.986 12.343
670 HB2 LEU 86 1HB LEU 86 24.299 14.216 14.428
671 HB3 LEU 86 2HB LEU 86 24.422 12.617 13.709
672 HG LEU 86 HG LEU 86 26.695 13.782 12.725
673 HD11 LEU 86 1HD1 LEU 86 27.794 14.974 14.558
674 HD12 LEU 86 2HD1 LEU 86 26.337 14.827 15.574
675 HD13 LEU 86 3HD1 LEU 86 26.309 15.831 14.108
676 HD21 LEU 86 1HD2 LEU 86 26.493 11.566 13.774
677 HD22 LEU 86 2HD2 LEU 86 26.346 12.326 15.379
678 HD23 LEU 86 3HD2 LEU 86 27.860 12.472 14.455
679 H GLU 87 H GLU 87 25.877 15.422 10.953
680 HA GLU 87 HA GLU 87 25.457 18.034 12.227
681 HB2 GLU 87 1HB GLU 87 27.235 17.150 9.933
682 HB3 GLU 87 2HB GLU 87 27.209 18.772 10.625
683 HG2 GLU 87 1HG GLU 87 27.811 17.795 12.848
684 HG3 GLU 87 2HG GLU 87 27.935 16.205 12.083
685 H ALA 88 H ALA 88 24.307 16.355 9.451
686 HA ALA 88 HA ALA 88 23.523 18.672 7.907
687 HB1 ALA 88 1HB ALA 88 22.667 15.742 7.732
688 HB2 ALA 88 2HB ALA 88 22.354 16.987 6.497
689 HB3 ALA 88 3HB ALA 88 24.023 16.493 6.859
690 H GLN 89 H GLN 89 22.475 18.625 10.714
691 HA GLN 89 HA GLN 89 19.551 18.315 10.226
692 HB2 GLN 89 1HB GLN 89 21.113 18.716 12.795
693 HB3 GLN 89 2HB GLN 89 19.352 18.550 12.682
694 HG2 GLN 89 1HG GLN 89 21.395 16.454 11.882
695 HG3 GLN 89 2HG GLN 89 20.408 16.433 13.347
696 HE21 GLN 89 1HE2 GLN 89 19.070 14.648 10.112
697 HE22 GLN 89 2HE2 GLN 89 20.740 15.005 10.481
698 H ALA 90 H ALA 90 18.190 19.964 10.160
699 HA ALA 90 HA ALA 90 19.299 22.664 10.033
700 HB1 ALA 90 1HB ALA 90 16.441 21.640 9.691
701 HB2 ALA 90 2HB ALA 90 17.011 23.285 9.315
702 HB3 ALA 90 3HB ALA 90 17.622 21.897 8.383
703 H LYS 91 H LYS 91 18.610 24.429 11.264
704 HA LYS 91 HA LYS 91 17.273 23.787 13.880
705 HB2 LYS 91 1HB LYS 91 18.595 25.568 14.867
706 HB3 LYS 91 2HB LYS 91 19.695 24.441 14.063
707 HG2 LYS 91 1HG LYS 91 19.679 25.998 12.087
708 HG3 LYS 91 2HG LYS 91 18.745 27.137 13.049
709 HD2 LYS 91 1HD LYS 91 20.889 27.911 13.250
710 HD3 LYS 91 2HD LYS 91 20.686 26.956 14.731
711 HE2 LYS 91 1HE LYS 91 21.919 25.104 13.740
712 HE3 LYS 91 2HE LYS 91 21.993 25.962 12.174
713 HZ1 LYS 91 1HZ LYS 91 23.236 27.706 13.226
714 HZ2 LYS 91 2HZ LYS 91 24.007 26.277 13.511
715 HZ3 LYS 91 3HZ LYS 91 23.119 26.996 14.707
716 H ILE 92 H ILE 92 16.237 25.974 14.720
717 HA ILE 92 HA ILE 92 15.080 27.470 12.403
718 HB ILE 92 HB ILE 92 13.610 26.678 14.973
719 HG12 ILE 92 1HG1 ILE 92 13.088 25.735 12.122
720 HG13 ILE 92 2HG1 ILE 92 13.997 24.800 13.308
721 HG21 ILE 92 1HG2 ILE 92 12.919 28.904 14.069
722 HG22 ILE 92 2HG2 ILE 92 12.639 28.176 12.473
723 HG23 ILE 92 3HG2 ILE 92 11.623 27.716 13.862
724 HD11 ILE 92 1HD1 ILE 92 11.055 25.564 13.487
725 HD12 ILE 92 2HD1 ILE 92 11.739 23.947 13.237
726 HD13 ILE 92 3HD1 ILE 92 11.966 24.772 14.796
727 H GLU 93 H GLU 93 16.063 29.398 12.494
728 HA GLU 93 HA GLU 93 16.209 30.852 15.083
729 HB2 GLU 93 1HB GLU 93 18.476 30.321 13.126
730 HB3 GLU 93 2HB GLU 93 18.503 31.585 14.352
731 HG2 GLU 93 1HG GLU 93 18.182 29.825 16.081
732 HG3 GLU 93 2HG GLU 93 18.374 28.610 14.819
733 H GLU 94 H GLU 94 15.266 32.838 14.734
734 HA GLU 94 HA GLU 94 15.774 34.094 12.069
735 HB2 GLU 94 1HB GLU 94 13.675 34.752 14.148
736 HB3 GLU 94 2HB GLU 94 14.101 35.774 12.767
737 HG2 GLU 94 1HG GLU 94 13.520 33.823 11.266
738 HG3 GLU 94 2HG GLU 94 12.846 33.020 12.697
739 H ASP 95 H ASP 95 17.398 35.398 12.058
740 HA ASP 95 HA ASP 95 17.728 37.368 14.219
741 HB2 ASP 95 1HB ASP 95 19.161 35.443 14.912
742 HB3 ASP 95 2HB ASP 95 20.059 35.608 13.395
743 H ILE 96 H ILE 96 16.763 38.305 12.176
744 HA ILE 96 HA ILE 96 18.994 39.350 10.476
745 HB ILE 96 HB ILE 96 17.301 39.726 8.685
746 HG12 ILE 96 1HG1 ILE 96 15.417 38.071 10.419
747 HG13 ILE 96 2HG1 ILE 96 15.336 39.829 10.293
748 HG21 ILE 96 1HG2 ILE 96 18.699 37.610 8.799
749 HG22 ILE 96 2HG2 ILE 96 17.322 36.794 9.574
750 HG23 ILE 96 3HG2 ILE 96 17.174 37.416 7.914
751 HD11 ILE 96 1HD1 ILE 96 14.928 39.607 7.833
752 HD12 ILE 96 2HD1 ILE 96 14.884 37.838 8.033
753 HD13 ILE 96 3HD1 ILE 96 13.665 38.853 8.834
754 H ARG 97 H ARG 97 17.649 40.005 13.087
755 HA ARG 97 HA ARG 97 16.289 42.565 12.602
756 HB2 ARG 97 1HB ARG 97 16.107 42.580 15.089
757 HB3 ARG 97 2HB ARG 97 15.433 41.140 14.337
758 HG2 ARG 97 1HG ARG 97 16.972 39.720 15.270
759 HG3 ARG 97 2HG ARG 97 18.286 40.913 15.212
760 HD2 ARG 97 1HD ARG 97 15.959 41.006 17.153
761 HD3 ARG 97 2HD ARG 97 17.577 40.365 17.525
762 HE ARG 97 HE ARG 97 17.956 42.940 16.460
763 HH11 ARG 97 1HH1 ARG 97 16.418 41.569 19.333
764 HH12 ARG 97 2HH1 ARG 97 16.686 43.009 20.280
765 HH21 ARG 97 1HH2 ARG 97 18.282 44.721 17.719
766 HH22 ARG 97 2HH2 ARG 97 17.730 44.774 19.374
767 H GLN 98 H GLN 98 18.741 42.737 11.555
768 HA GLN 98 HA GLN 98 20.739 43.801 11.487
769 HB2 GLN 98 1HB GLN 98 19.015 45.689 11.543
770 HB3 GLN 98 2HB GLN 98 19.466 45.958 13.227
771 HG2 GLN 98 1HG GLN 98 21.845 46.349 12.524
772 HG3 GLN 98 2HG GLN 98 21.417 45.985 10.851
773 HE21 GLN 98 1HE2 GLN 98 20.441 49.212 10.124
774 HE22 GLN 98 2HE2 GLN 98 20.939 47.636 9.568
775 HXT GLN 98 HO GLN 98 22.199 42.454 14.239
Start of MODEL 22
1 H1 SER 1 1H SER 1 3.042 24.136 -10.931
2 H2 SER 1 2H SER 1 3.459 22.814 -10.211
3 H3 SER 1 3H SER 1 2.291 23.787 -9.604
4 HA SER 1 HA SER 1 1.260 21.696 -10.234
5 HB2 SER 1 1HB SER 1 0.014 23.037 -12.376
6 HB3 SER 1 2HB SER 1 -0.405 23.226 -10.638
7 HG SER 1 HG SER 1 1.902 24.420 -11.084
8 H GLN 2 H GLN 2 3.602 22.831 -12.311
9 HA GLN 2 HA GLN 2 3.220 20.526 -14.191
10 HB2 GLN 2 1HB GLN 2 4.270 23.312 -14.839
11 HB3 GLN 2 2HB GLN 2 4.207 21.950 -15.963
12 HG2 GLN 2 1HG GLN 2 1.738 21.945 -15.811
13 HG3 GLN 2 2HG GLN 2 1.808 23.319 -14.695
14 HE21 GLN 2 1HE2 GLN 2 1.822 25.647 -17.248
15 HE22 GLN 2 2HE2 GLN 2 1.446 25.220 -15.595
16 H GLN 3 H GLN 3 5.240 19.674 -15.021
17 HA GLN 3 HA GLN 3 7.719 20.631 -13.729
18 HB2 GLN 3 1HB GLN 3 8.371 18.405 -13.000
19 HB3 GLN 3 2HB GLN 3 6.856 18.859 -12.216
20 HG2 GLN 3 1HG GLN 3 5.609 17.469 -13.869
21 HG3 GLN 3 2HG GLN 3 7.154 16.970 -14.577
22 HE21 GLN 3 1HE2 GLN 3 7.802 14.515 -12.190
23 HE22 GLN 3 2HE2 GLN 3 8.244 15.307 -13.686
24 H SER 4 H SER 4 9.607 19.832 -14.897
25 HA SER 4 HA SER 4 9.253 18.426 -17.437
26 HB2 SER 4 1HB SER 4 9.882 21.415 -17.364
27 HB3 SER 4 2HB SER 4 10.183 20.370 -18.768
28 HG SER 4 HG SER 4 7.630 20.190 -17.725
29 H HIS 5 H HIS 5 11.572 18.636 -18.532
30 HA HIS 5 HA HIS 5 13.815 18.344 -18.441
31 HB2 HIS 5 1HB HIS 5 13.849 19.772 -15.764
32 HB3 HIS 5 2HB HIS 5 15.212 19.497 -16.842
33 HD1 HIS 5 HD1 HIS 5 15.210 20.858 -19.193
34 HD2 HIS 5 HD2 HIS 5 12.400 22.073 -16.300
35 HE1 HIS 5 HE1 HIS 5 14.361 23.156 -19.886
36 H SER 6 H SER 6 12.142 17.362 -15.445
37 HA SER 6 HA SER 6 14.301 15.631 -14.605
38 HB2 SER 6 1HB SER 6 12.618 14.768 -13.018
39 HB3 SER 6 2HB SER 6 12.796 16.529 -12.998
40 HG SER 6 HG SER 6 10.721 14.981 -14.116
41 H SER 7 H SER 7 14.454 14.627 -16.830
42 HA SER 7 HA SER 7 13.384 11.931 -16.475
43 HB2 SER 7 1HB SER 7 12.828 13.214 -19.163
44 HB3 SER 7 2HB SER 7 12.348 11.612 -18.596
45 HG SER 7 HG SER 7 11.332 13.085 -16.816
46 HA PRO 8 HA PRO 8 16.811 11.334 -19.429
47 HB2 PRO 8 1HB PRO 8 17.920 13.102 -21.098
48 HB3 PRO 8 2HB PRO 8 16.261 12.505 -21.400
49 HG2 PRO 8 1HG PRO 8 17.162 15.041 -20.085
50 HG3 PRO 8 2HG PRO 8 15.976 14.824 -21.406
51 HD2 PRO 8 1HD PRO 8 15.295 15.059 -18.743
52 HD3 PRO 8 2HD PRO 8 14.308 14.174 -19.950
53 H GLY 9 H GLY 9 16.985 13.125 -16.912
54 HA2 GLY 9 1HA GLY 9 18.805 13.536 -15.424
55 HA3 GLY 9 2HA GLY 9 19.944 13.374 -16.773
56 H GLU 10 H GLU 10 18.841 15.026 -18.612
57 HA GLU 10 HA GLU 10 19.283 17.128 -19.340
58 HB2 GLU 10 1HB GLU 10 17.431 17.299 -17.097
59 HB3 GLU 10 2HB GLU 10 18.231 18.838 -17.485
60 HG2 GLU 10 1HG GLU 10 16.946 17.146 -19.613
61 HG3 GLU 10 2HG GLU 10 15.983 18.233 -18.621
62 H ILE 11 H ILE 11 21.490 16.542 -19.037
63 HA ILE 11 HA ILE 11 22.967 17.013 -16.736
64 HB ILE 11 HB ILE 11 24.392 16.950 -19.298
65 HG12 ILE 11 1HG1 ILE 11 22.402 14.718 -18.864
66 HG13 ILE 11 2HG1 ILE 11 22.344 15.914 -20.174
67 HG21 ILE 11 1HG2 ILE 11 25.431 15.028 -18.249
68 HG22 ILE 11 2HG2 ILE 11 25.193 16.288 -17.023
69 HG23 ILE 11 3HG2 ILE 11 24.055 14.922 -17.117
70 HD11 ILE 11 1HD1 ILE 11 23.226 13.904 -21.103
71 HD12 ILE 11 2HD1 ILE 11 24.576 15.055 -20.981
72 HD13 ILE 11 3HD1 ILE 11 24.420 13.729 -19.800
73 H THR 12 H THR 12 21.840 19.177 -16.597
74 HA THR 12 HA THR 12 22.832 21.378 -18.232
75 HB THR 12 HB THR 12 21.860 22.864 -16.471
76 HG1 THR 12 HG1 THR 12 21.158 20.455 -15.131
77 HG21 THR 12 1HG2 THR 12 19.547 22.183 -16.677
78 HG22 THR 12 2HG2 THR 12 20.019 20.525 -17.084
79 HG23 THR 12 3HG2 THR 12 20.381 21.847 -18.211
80 H SER 13 H SER 13 24.069 23.208 -17.483
81 HA SER 13 HA SER 13 26.580 22.482 -16.244
82 HB2 SER 13 1HB SER 13 25.847 24.307 -18.033
83 HB3 SER 13 2HB SER 13 25.667 25.300 -16.575
84 HG SER 13 HG SER 13 27.844 24.949 -16.106
85 H SER 14 H SER 14 23.877 22.635 -14.707
86 HA SER 14 HA SER 14 23.084 23.226 -12.638
87 HB2 SER 14 1HB SER 14 26.032 23.251 -11.936
88 HB3 SER 14 2HB SER 14 24.671 23.091 -10.805
89 HG SER 14 HG SER 14 25.406 21.306 -12.893
90 HA PRO 15 HA PRO 15 23.949 27.836 -13.186
91 HB2 PRO 15 1HB PRO 15 21.382 28.520 -13.726
92 HB3 PRO 15 2HB PRO 15 22.499 27.892 -14.962
93 HG2 PRO 15 1HG PRO 15 20.463 26.409 -13.391
94 HG3 PRO 15 2HG PRO 15 20.670 26.501 -15.168
95 HD2 PRO 15 1HD PRO 15 21.681 24.460 -13.795
96 HD3 PRO 15 2HD PRO 15 22.625 25.214 -15.129
97 H GLN 16 H GLN 16 22.281 25.782 -11.284
98 HA GLN 16 HA GLN 16 20.961 27.385 -9.318
99 HB2 GLN 16 1HB GLN 16 22.465 24.756 -9.066
100 HB3 GLN 16 2HB GLN 16 21.400 25.421 -7.825
101 HG2 GLN 16 1HG GLN 16 19.469 25.157 -9.277
102 HG3 GLN 16 2HG GLN 16 20.503 24.653 -10.624
103 HE21 GLN 16 1HE2 GLN 16 19.725 21.371 -9.689
104 HE22 GLN 16 2HE2 GLN 16 19.461 22.662 -10.832
105 H GLY 17 H GLY 17 24.158 27.668 -10.220
106 HA2 GLY 17 1HA GLY 17 25.721 29.068 -9.194
107 HA3 GLY 17 2HA GLY 17 24.833 28.952 -7.666
108 H LEU 18 H LEU 18 25.289 25.905 -9.084
109 HA LEU 18 HA LEU 18 27.143 25.184 -6.957
110 HB2 LEU 18 1HB LEU 18 26.147 23.521 -9.282
111 HB3 LEU 18 2HB LEU 18 26.944 22.921 -7.840
112 HG LEU 18 HG LEU 18 24.223 24.223 -7.971
113 HD11 LEU 18 1HD1 LEU 18 24.314 21.951 -8.930
114 HD12 LEU 18 2HD1 LEU 18 23.367 21.989 -7.431
115 HD13 LEU 18 3HD1 LEU 18 25.025 21.342 -7.421
116 HD21 LEU 18 1HD2 LEU 18 23.996 23.473 -5.586
117 HD22 LEU 18 2HD2 LEU 18 25.210 24.744 -5.806
118 HD23 LEU 18 3HD2 LEU 18 25.723 23.054 -5.590
119 H ASP 19 H ASP 19 27.195 25.557 -10.469
120 HA ASP 19 HA ASP 19 29.984 24.758 -10.744
121 HB2 ASP 19 1HB ASP 19 28.102 24.616 -12.460
122 HB3 ASP 19 2HB ASP 19 28.263 26.369 -12.653
123 H ASN 20 H ASN 20 28.172 27.610 -9.971
124 HA ASN 20 HA ASN 20 30.659 29.236 -10.080
125 HB2 ASN 20 1HB ASN 20 27.725 30.039 -10.353
126 HB3 ASN 20 2HB ASN 20 29.067 31.164 -10.243
127 HD21 ASN 20 1HD2 ASN 20 30.199 30.655 -13.533
128 HD22 ASN 20 2HD2 ASN 20 30.750 31.025 -11.924
129 HA PRO 21 HA PRO 21 29.387 28.969 -5.627
130 HB2 PRO 21 1HB PRO 21 32.008 28.857 -4.734
131 HB3 PRO 21 2HB PRO 21 31.046 27.407 -5.120
132 HG2 PRO 21 1HG PRO 21 32.991 28.870 -6.805
133 HG3 PRO 21 2HG PRO 21 32.858 27.127 -6.534
134 HD2 PRO 21 1HD PRO 21 31.943 28.175 -8.729
135 HD3 PRO 21 2HD PRO 21 31.013 26.900 -7.864
136 H ALA 22 H ALA 22 31.823 30.765 -7.503
137 HA ALA 22 HA ALA 22 32.276 32.832 -5.599
138 HB1 ALA 22 1HB ALA 22 33.733 32.466 -7.545
139 HB2 ALA 22 2HB ALA 22 32.404 32.907 -8.648
140 HB3 ALA 22 3HB ALA 22 33.094 34.127 -7.551
141 H LEU 23 H LEU 23 29.872 32.504 -8.228
142 HA LEU 23 HA LEU 23 28.732 35.133 -7.777
143 HB2 LEU 23 1HB LEU 23 27.512 32.703 -9.135
144 HB3 LEU 23 2HB LEU 23 26.893 34.344 -9.206
145 HG LEU 23 HG LEU 23 29.467 33.341 -10.450
146 HD11 LEU 23 1HD1 LEU 23 27.353 32.620 -11.556
147 HD12 LEU 23 2HD1 LEU 23 28.291 33.738 -12.566
148 HD13 LEU 23 3HD1 LEU 23 26.859 34.322 -11.689
149 HD21 LEU 23 1HD2 LEU 23 29.559 35.554 -11.553
150 HD22 LEU 23 2HD2 LEU 23 29.801 35.651 -9.797
151 HD23 LEU 23 3HD2 LEU 23 28.234 36.114 -10.504
152 H LEU 24 H LEU 24 27.916 31.787 -6.799
153 HA LEU 24 HA LEU 24 25.447 32.492 -5.554
154 HB2 LEU 24 1HB LEU 24 26.116 30.192 -6.145
155 HB3 LEU 24 2HB LEU 24 27.371 30.227 -4.917
156 HG LEU 24 HG LEU 24 25.809 30.134 -3.151
157 HD11 LEU 24 1HD1 LEU 24 24.114 31.719 -3.792
158 HD12 LEU 24 2HD1 LEU 24 23.324 30.157 -3.516
159 HD13 LEU 24 3HD1 LEU 24 23.623 30.710 -5.181
160 HD21 LEU 24 1HD2 LEU 24 24.639 28.078 -3.585
161 HD22 LEU 24 2HD2 LEU 24 26.184 28.041 -4.465
162 HD23 LEU 24 3HD2 LEU 24 24.669 28.372 -5.339
163 H ARG 25 H ARG 25 28.792 32.283 -4.285
164 HA ARG 25 HA ARG 25 28.208 32.942 -1.580
165 HB2 ARG 25 1HB ARG 25 30.391 32.142 -2.303
166 HB3 ARG 25 2HB ARG 25 30.571 33.490 -3.395
167 HG2 ARG 25 1HG ARG 25 30.347 34.823 -1.019
168 HG3 ARG 25 2HG ARG 25 31.096 33.314 -0.480
169 HD2 ARG 25 1HD ARG 25 32.793 34.998 -1.060
170 HD3 ARG 25 2HD ARG 25 32.880 33.608 -2.162
171 HE ARG 25 HE ARG 25 31.338 35.123 -3.647
172 HH11 ARG 25 1HH1 ARG 25 34.079 36.289 -1.747
173 HH12 ARG 25 2HH1 ARG 25 34.322 37.659 -2.796
174 HH21 ARG 25 1HH2 ARG 25 31.691 36.889 -4.907
175 HH22 ARG 25 2HH2 ARG 25 32.991 37.989 -4.559
176 H ASP 26 H ASP 26 28.818 35.014 -4.458
177 HA ASP 26 HA ASP 26 28.791 37.458 -2.982
178 HB2 ASP 26 1HB ASP 26 29.534 36.858 -5.433
179 HB3 ASP 26 2HB ASP 26 27.876 37.310 -5.841
180 H MET 27 H MET 27 26.213 35.709 -4.758
181 HA MET 27 HA MET 27 24.135 37.623 -4.302
182 HB2 MET 27 1HB MET 27 24.022 35.663 -5.877
183 HB3 MET 27 2HB MET 27 23.907 34.598 -4.470
184 HG2 MET 27 1HG MET 27 21.820 35.842 -3.794
185 HG3 MET 27 2HG MET 27 21.913 36.707 -5.335
186 HE1 MET 27 1HE MET 27 20.654 33.537 -3.466
187 HE2 MET 27 2HE MET 27 20.828 32.243 -4.674
188 HE3 MET 27 3HE MET 27 22.272 32.981 -3.950
189 H LEU 28 H LEU 28 25.231 34.794 -2.422
190 HA LEU 28 HA LEU 28 23.186 34.928 -0.450
191 HB2 LEU 28 1HB LEU 28 25.878 33.713 -0.664
192 HB3 LEU 28 2HB LEU 28 25.073 33.758 0.905
193 HG LEU 28 HG LEU 28 23.641 32.704 -1.527
194 HD11 LEU 28 1HD1 LEU 28 25.699 31.527 -1.388
195 HD12 LEU 28 2HD1 LEU 28 24.397 30.482 -0.791
196 HD13 LEU 28 3HD1 LEU 28 25.505 31.281 0.353
197 HD21 LEU 28 1HD2 LEU 28 22.327 31.517 0.156
198 HD22 LEU 28 2HD2 LEU 28 22.374 33.242 0.551
199 HD23 LEU 28 3HD2 LEU 28 23.391 32.119 1.450
200 H LEU 29 H LEU 29 26.440 36.362 -0.635
201 HA LEU 29 HA LEU 29 26.466 37.455 2.025
202 HB2 LEU 29 1HB LEU 29 27.819 38.236 -0.567
203 HB3 LEU 29 2HB LEU 29 28.040 39.188 0.895
204 HG LEU 29 HG LEU 29 28.709 36.244 0.774
205 HD11 LEU 29 1HD1 LEU 29 30.511 38.622 0.207
206 HD12 LEU 29 2HD1 LEU 29 30.004 37.369 -0.953
207 HD13 LEU 29 3HD1 LEU 29 31.054 36.939 0.413
208 HD21 LEU 29 1HD2 LEU 29 28.458 37.181 3.031
209 HD22 LEU 29 2HD2 LEU 29 29.610 38.475 2.630
210 HD23 LEU 29 3HD2 LEU 29 30.150 36.780 2.697
211 H ALA 30 H ALA 30 25.208 38.619 -1.055
212 HA ALA 30 HA ALA 30 24.464 41.220 0.029
213 HB1 ALA 30 1HB ALA 30 23.487 41.577 -2.200
214 HB2 ALA 30 2HB ALA 30 25.125 40.893 -2.339
215 HB3 ALA 30 3HB ALA 30 23.704 39.852 -2.588
216 H ASN 31 H ASN 31 22.996 38.098 0.191
217 HA ASN 31 HA ASN 31 20.278 39.344 0.338
218 HB2 ASN 31 1HB ASN 31 20.801 37.540 -1.374
219 HB3 ASN 31 2HB ASN 31 20.920 36.417 -0.031
220 HD21 ASN 31 1HD2 ASN 31 17.439 36.878 -1.632
221 HD22 ASN 31 2HD2 ASN 31 19.023 36.937 -2.376
222 HA PRO 32 HA PRO 32 21.056 38.364 4.661
223 HB2 PRO 32 1HB PRO 32 18.963 39.773 5.747
224 HB3 PRO 32 2HB PRO 32 20.505 40.526 5.228
225 HG2 PRO 32 1HG PRO 32 17.925 40.287 3.686
226 HG3 PRO 32 2HG PRO 32 18.922 41.744 3.992
227 HD2 PRO 32 1HD PRO 32 19.147 40.430 1.701
228 HD3 PRO 32 2HD PRO 32 20.615 41.048 2.539
229 H HIS 33 H HIS 33 18.017 37.872 2.888
230 HA HIS 33 HA HIS 33 16.843 36.197 4.970
231 HB2 HIS 33 1HB HIS 33 15.482 37.439 3.304
232 HB3 HIS 33 2HB HIS 33 16.187 36.461 2.011
233 HD1 HIS 33 HD1 HIS 33 13.726 36.235 4.882
234 HD2 HIS 33 HD2 HIS 33 15.180 33.886 1.761
235 HE1 HIS 33 HE1 HIS 33 12.223 34.208 4.726
236 H GLU 34 H GLU 34 18.613 35.682 1.927
237 HA GLU 34 HA GLU 34 18.219 32.806 1.964
238 HB2 GLU 34 1HB GLU 34 19.499 34.826 0.278
239 HB3 GLU 34 2HB GLU 34 20.368 33.324 0.287
240 HG2 GLU 34 1HG GLU 34 17.410 33.560 -0.307
241 HG3 GLU 34 2HG GLU 34 18.672 33.590 -1.549
242 H LEU 35 H LEU 35 20.831 35.058 2.909
243 HA LEU 35 HA LEU 35 22.693 33.036 3.622
244 HB2 LEU 35 1HB LEU 35 23.984 34.643 4.369
245 HB3 LEU 35 2HB LEU 35 22.938 35.469 3.272
246 HG LEU 35 HG LEU 35 21.760 36.531 5.111
247 HD11 LEU 35 1HD1 LEU 35 23.008 36.646 7.309
248 HD12 LEU 35 2HD1 LEU 35 23.821 35.133 6.821
249 HD13 LEU 35 3HD1 LEU 35 22.054 35.184 7.031
250 HD21 LEU 35 1HD2 LEU 35 24.770 36.707 4.914
251 HD22 LEU 35 2HD2 LEU 35 23.708 38.015 5.506
252 HD23 LEU 35 3HD2 LEU 35 23.591 37.458 3.821
253 H SER 36 H SER 36 19.877 34.278 5.231
254 HA SER 36 HA SER 36 20.487 33.252 7.855
255 HB2 SER 36 1HB SER 36 18.978 35.194 7.432
256 HB3 SER 36 2HB SER 36 17.798 34.075 6.722
257 HG SER 36 HG SER 36 17.286 34.345 8.866
258 H LEU 37 H LEU 37 18.518 32.121 5.063
259 HA LEU 37 HA LEU 37 17.588 29.779 6.493
260 HB2 LEU 37 1HB LEU 37 16.683 29.062 4.551
261 HB3 LEU 37 2HB LEU 37 16.642 30.773 4.504
262 HG LEU 37 HG LEU 37 18.347 30.800 2.759
263 HD11 LEU 37 1HD1 LEU 37 17.690 27.859 2.615
264 HD12 LEU 37 2HD1 LEU 37 19.264 28.546 3.036
265 HD13 LEU 37 3HD1 LEU 37 18.615 28.793 1.412
266 HD21 LEU 37 1HD2 LEU 37 15.987 31.165 2.352
267 HD22 LEU 37 2HD2 LEU 37 15.686 29.411 2.328
268 HD23 LEU 37 3HD2 LEU 37 16.657 30.170 1.046
269 H LEU 38 H LEU 38 20.340 30.667 4.585
270 HA LEU 38 HA LEU 38 21.341 28.065 4.228
271 HB2 LEU 38 1HB LEU 38 21.962 30.138 3.073
272 HB3 LEU 38 2HB LEU 38 22.847 30.663 4.518
273 HG LEU 38 HG LEU 38 24.254 28.598 4.409
274 HD11 LEU 38 1HD1 LEU 38 22.904 28.313 1.721
275 HD12 LEU 38 2HD1 LEU 38 22.801 27.199 3.105
276 HD13 LEU 38 3HD1 LEU 38 24.335 27.408 2.261
277 HD21 LEU 38 1HD2 LEU 38 24.430 30.305 1.942
278 HD22 LEU 38 2HD2 LEU 38 25.743 29.387 2.702
279 HD23 LEU 38 3HD2 LEU 38 25.028 30.780 3.543
280 H LYS 39 H LYS 39 21.984 30.402 6.872
281 HA LYS 39 HA LYS 39 23.732 28.527 8.231
282 HB2 LYS 39 1HB LYS 39 23.297 29.946 10.277
283 HB3 LYS 39 2HB LYS 39 24.087 30.709 8.899
284 HG2 LYS 39 1HG LYS 39 22.049 31.819 8.275
285 HG3 LYS 39 2HG LYS 39 21.124 30.975 9.482
286 HD2 LYS 39 1HD LYS 39 21.532 33.141 10.344
287 HD3 LYS 39 2HD LYS 39 22.644 32.069 11.219
288 HE2 LYS 39 1HE LYS 39 24.483 32.732 9.699
289 HE3 LYS 39 2HE LYS 39 23.359 33.747 8.772
290 HZ1 LYS 39 1HZ LYS 39 24.077 34.146 11.619
291 HZ2 LYS 39 2HZ LYS 39 23.035 35.089 10.756
292 HZ3 LYS 39 3HZ LYS 39 24.634 35.047 10.353
293 H GLU 40 H GLU 40 20.253 28.814 8.129
294 HA GLU 40 HA GLU 40 19.906 27.113 10.479
295 HB2 GLU 40 1HB GLU 40 18.265 28.828 9.643
296 HB3 GLU 40 2HB GLU 40 17.929 27.792 8.261
297 HG2 GLU 40 1HG GLU 40 17.646 26.681 11.058
298 HG3 GLU 40 2HG GLU 40 16.409 27.786 10.444
299 H ARG 41 H ARG 41 19.481 26.692 6.924
300 HA ARG 41 HA ARG 41 19.037 23.813 7.256
301 HB2 ARG 41 1HB ARG 41 19.534 25.486 4.768
302 HB3 ARG 41 2HB ARG 41 18.959 23.808 4.789
303 HG2 ARG 41 1HG ARG 41 17.015 24.529 6.103
304 HG3 ARG 41 2HG ARG 41 17.556 26.203 5.972
305 HD2 ARG 41 1HD ARG 41 17.468 25.988 3.501
306 HD3 ARG 41 2HD ARG 41 16.723 24.388 3.709
307 HE ARG 41 HE ARG 41 15.244 26.116 5.318
308 HH11 ARG 41 1HH1 ARG 41 15.972 25.992 1.859
309 HH12 ARG 41 2HH1 ARG 41 14.482 26.780 1.419
310 HH21 ARG 41 1HH2 ARG 41 13.368 27.107 4.680
311 HH22 ARG 41 2HH2 ARG 41 13.031 27.402 2.994
312 H ASN 42 H ASN 42 21.821 25.747 6.315
313 HA ASN 42 HA ASN 42 23.418 23.230 6.158
314 HB2 ASN 42 1HB ASN 42 22.691 24.283 3.881
315 HB3 ASN 42 2HB ASN 42 23.909 25.473 4.194
316 HD21 ASN 42 1HD2 ASN 42 25.548 22.891 2.230
317 HD22 ASN 42 2HD2 ASN 42 24.358 24.133 2.023
318 HA PRO 43 HA PRO 43 25.293 26.683 8.652
319 HB2 PRO 43 1HB PRO 43 26.372 25.003 10.623
320 HB3 PRO 43 2HB PRO 43 24.840 25.926 10.723
321 HG2 PRO 43 1HG PRO 43 25.276 23.058 9.954
322 HG3 PRO 43 2HG PRO 43 24.031 23.774 11.023
323 HD2 PRO 43 1HD PRO 43 23.456 23.093 8.503
324 HD3 PRO 43 2HD PRO 43 22.797 24.608 9.217
325 HA PRO 44 HA PRO 44 29.487 24.805 8.010
326 HB2 PRO 44 1HB PRO 44 29.940 22.862 6.147
327 HB3 PRO 44 2HB PRO 44 29.644 22.515 7.880
328 HG2 PRO 44 1HG PRO 44 27.703 22.491 5.609
329 HG3 PRO 44 2HG PRO 44 28.021 21.224 6.829
330 HD2 PRO 44 1HD PRO 44 25.972 22.931 7.089
331 HD3 PRO 44 2HD PRO 44 26.939 22.432 8.516
332 H LEU 45 H LEU 45 27.206 24.893 5.173
333 HA LEU 45 HA LEU 45 29.263 26.147 3.501
334 HB2 LEU 45 1HB LEU 45 27.258 24.945 2.577
335 HB3 LEU 45 2HB LEU 45 26.254 26.260 3.157
336 HG LEU 45 HG LEU 45 27.387 27.825 1.652
337 HD11 LEU 45 1HD1 LEU 45 29.061 25.430 0.768
338 HD12 LEU 45 2HD1 LEU 45 29.656 26.913 1.552
339 HD13 LEU 45 3HD1 LEU 45 28.990 26.987 -0.084
340 HD21 LEU 45 1HD2 LEU 45 25.462 26.417 0.862
341 HD22 LEU 45 2HD2 LEU 45 26.636 25.309 0.132
342 HD23 LEU 45 3HD2 LEU 45 26.524 26.992 -0.432
343 H ALA 46 H ALA 46 26.685 27.059 5.720
344 HA ALA 46 HA ALA 46 26.711 29.838 5.135
345 HB1 ALA 46 1HB ALA 46 25.054 28.608 6.514
346 HB2 ALA 46 2HB ALA 46 26.242 28.595 7.835
347 HB3 ALA 46 3HB ALA 46 25.623 30.141 7.209
348 H GLU 47 H GLU 47 28.657 28.040 7.642
349 HA GLU 47 HA GLU 47 29.885 30.426 8.626
350 HB2 GLU 47 1HB GLU 47 31.551 29.036 9.653
351 HB3 GLU 47 2HB GLU 47 29.955 28.312 9.858
352 HG2 GLU 47 1HG GLU 47 30.415 26.649 8.206
353 HG3 GLU 47 2HG GLU 47 31.911 27.452 7.718
354 H ALA 48 H ALA 48 30.710 28.342 5.908
355 HA ALA 48 HA ALA 48 33.152 29.451 5.221
356 HB1 ALA 48 1HB ALA 48 31.978 27.379 4.306
357 HB2 ALA 48 2HB ALA 48 31.020 28.491 3.301
358 HB3 ALA 48 3HB ALA 48 32.766 28.421 3.119
359 H LEU 49 H LEU 49 29.856 30.440 4.385
360 HA LEU 49 HA LEU 49 30.639 32.576 2.650
361 HB2 LEU 49 1HB LEU 49 28.352 31.503 2.831
362 HB3 LEU 49 2HB LEU 49 28.160 32.282 4.396
363 HG LEU 49 HG LEU 49 28.589 34.497 3.059
364 HD11 LEU 49 1HD1 LEU 49 27.605 32.578 0.926
365 HD12 LEU 49 2HD1 LEU 49 29.186 33.392 0.969
366 HD13 LEU 49 3HD1 LEU 49 27.705 34.343 0.773
367 HD21 LEU 49 1HD2 LEU 49 26.174 34.696 2.716
368 HD22 LEU 49 2HD2 LEU 49 26.535 33.906 4.263
369 HD23 LEU 49 3HD2 LEU 49 25.994 32.931 2.876
370 H LEU 50 H LEU 50 29.951 32.364 6.164
371 HA LEU 50 HA LEU 50 29.922 35.177 6.663
372 HB2 LEU 50 1HB LEU 50 30.931 33.104 8.624
373 HB3 LEU 50 2HB LEU 50 30.208 34.657 8.983
374 HG LEU 50 HG LEU 50 28.891 32.117 8.147
375 HD11 LEU 50 1HD1 LEU 50 28.484 33.910 10.509
376 HD12 LEU 50 2HD1 LEU 50 29.403 32.381 10.469
377 HD13 LEU 50 3HD1 LEU 50 27.654 32.363 10.186
378 HD21 LEU 50 1HD2 LEU 50 26.709 33.277 8.164
379 HD22 LEU 50 2HD2 LEU 50 27.744 33.669 6.784
380 HD23 LEU 50 3HD2 LEU 50 27.593 34.828 8.136
381 H SER 51 H SER 51 32.528 32.844 6.383
382 HA SER 51 HA SER 51 34.562 34.489 7.559
383 HB2 SER 51 1HB SER 51 34.717 32.184 5.622
384 HB3 SER 51 2HB SER 51 36.039 32.818 6.602
385 HG SER 51 HG SER 51 33.623 31.669 7.586
386 H GLY 52 H GLY 52 33.064 34.278 4.393
387 HA2 GLY 52 1HA GLY 52 33.319 35.761 2.621
388 HA3 GLY 52 2HA GLY 52 34.700 36.511 3.439
389 H ASP 53 H ASP 53 35.569 33.477 3.721
390 HA ASP 53 HA ASP 53 37.498 33.590 1.596
391 HB2 ASP 53 1HB ASP 53 37.848 32.378 3.816
392 HB3 ASP 53 2HB ASP 53 36.694 31.222 3.277
393 H LEU 54 H LEU 54 36.980 33.271 -0.495
394 HA LEU 54 HA LEU 54 34.714 31.751 -1.366
395 HB2 LEU 54 1HB LEU 54 35.856 33.469 -2.721
396 HB3 LEU 54 2HB LEU 54 37.267 32.434 -2.857
397 HG LEU 54 HG LEU 54 35.591 32.623 -4.786
398 HD11 LEU 54 1HD1 LEU 54 36.130 30.471 -5.664
399 HD12 LEU 54 2HD1 LEU 54 36.485 29.855 -4.038
400 HD13 LEU 54 3HD1 LEU 54 37.518 31.106 -4.761
401 HD21 LEU 54 1HD2 LEU 54 33.795 31.025 -4.940
402 HD22 LEU 54 2HD2 LEU 54 33.521 32.108 -3.564
403 HD23 LEU 54 3HD2 LEU 54 34.114 30.458 -3.296
404 H GLU 55 H GLU 55 38.157 30.900 -0.750
405 HA GLU 55 HA GLU 55 38.130 28.348 -2.011
406 HB2 GLU 55 1HB GLU 55 39.574 29.397 0.418
407 HB3 GLU 55 2HB GLU 55 39.759 27.733 -0.097
408 HG2 GLU 55 1HG GLU 55 40.201 29.959 -2.029
409 HG3 GLU 55 2HG GLU 55 41.408 29.549 -0.804
410 H LYS 56 H LYS 56 37.496 29.144 1.450
411 HA LYS 56 HA LYS 56 36.677 26.447 1.971
412 HB2 LYS 56 1HB LYS 56 36.179 27.027 4.137
413 HB3 LYS 56 2HB LYS 56 37.402 28.260 3.674
414 HG2 LYS 56 1HG LYS 56 35.432 29.734 3.305
415 HG3 LYS 56 2HG LYS 56 34.540 28.479 4.148
416 HD2 LYS 56 1HD LYS 56 37.104 29.301 5.416
417 HD3 LYS 56 2HD LYS 56 35.793 30.465 5.463
418 HE2 LYS 56 1HE LYS 56 34.306 28.817 6.519
419 HE3 LYS 56 2HE LYS 56 35.584 27.595 6.434
420 HZ1 LYS 56 1HZ LYS 56 35.418 28.553 8.620
421 HZ2 LYS 56 2HZ LYS 56 35.640 30.083 8.036
422 HZ3 LYS 56 3HZ LYS 56 36.870 28.981 7.960
423 H PHE 57 H PHE 57 34.772 29.332 0.981
424 HA PHE 57 HA PHE 57 32.250 28.045 1.203
425 HB2 PHE 57 1HB PHE 57 32.581 30.461 0.784
426 HB3 PHE 57 2HB PHE 57 33.130 30.082 -0.855
427 HD1 PHE 57 HD1 PHE 57 30.229 30.212 1.431
428 HD2 PHE 57 HD2 PHE 57 31.527 29.360 -2.582
429 HE1 PHE 57 HE1 PHE 57 27.860 30.220 0.667
430 HE2 PHE 57 HE2 PHE 57 29.157 29.357 -3.348
431 HZ PHE 57 HZ PHE 57 27.324 29.786 -1.730
432 H SER 58 H SER 58 34.398 28.208 -1.695
433 HA SER 58 HA SER 58 32.709 26.572 -3.299
434 HB2 SER 58 1HB SER 58 34.528 28.030 -4.158
435 HB3 SER 58 2HB SER 58 35.729 26.963 -3.403
436 HG SER 58 HG SER 58 35.498 26.372 -5.543
437 H ARG 59 H ARG 59 35.486 25.714 -1.193
438 HA ARG 59 HA ARG 59 35.645 22.989 -2.010
439 HB2 ARG 59 1HB ARG 59 37.292 24.304 -0.708
440 HB3 ARG 59 2HB ARG 59 36.193 24.291 0.673
441 HG2 ARG 59 1HG ARG 59 36.375 21.740 0.603
442 HG3 ARG 59 2HG ARG 59 37.716 21.985 -0.541
443 HD2 ARG 59 1HD ARG 59 37.445 22.994 2.298
444 HD3 ARG 59 2HD ARG 59 38.655 21.849 1.676
445 HE ARG 59 HE ARG 59 38.692 24.772 1.522
446 HH11 ARG 59 1HH1 ARG 59 40.033 21.869 0.008
447 HH12 ARG 59 2HH1 ARG 59 41.351 22.761 -0.708
448 HH21 ARG 59 1HH2 ARG 59 40.383 25.817 0.573
449 HH22 ARG 59 2HH2 ARG 59 41.529 24.967 -0.412
450 H VAL 60 H VAL 60 33.815 24.531 0.648
451 HA VAL 60 HA VAL 60 32.700 22.053 1.596
452 HB VAL 60 HB VAL 60 31.877 24.965 1.966
453 HG11 VAL 60 1HG1 VAL 60 29.964 23.618 2.285
454 HG12 VAL 60 2HG1 VAL 60 30.875 22.443 3.262
455 HG13 VAL 60 3HG1 VAL 60 30.587 24.093 3.880
456 HG21 VAL 60 1HG2 VAL 60 32.899 24.707 4.187
457 HG22 VAL 60 2HG2 VAL 60 33.279 23.000 3.841
458 HG23 VAL 60 3HG2 VAL 60 34.090 24.296 2.940
459 H LEU 61 H LEU 61 31.755 24.497 -0.810
460 HA LEU 61 HA LEU 61 29.125 23.560 -1.307
461 HB2 LEU 61 1HB LEU 61 30.377 25.630 -2.212
462 HB3 LEU 61 2HB LEU 61 31.029 24.554 -3.427
463 HG LEU 61 HG LEU 61 28.352 24.062 -3.680
464 HD11 LEU 61 1HD1 LEU 61 27.882 25.807 -1.985
465 HD12 LEU 61 2HD1 LEU 61 27.212 26.213 -3.580
466 HD13 LEU 61 3HD1 LEU 61 28.707 27.004 -3.021
467 HD21 LEU 61 1HD2 LEU 61 30.363 25.150 -5.269
468 HD22 LEU 61 2HD2 LEU 61 29.161 26.456 -5.202
469 HD23 LEU 61 3HD2 LEU 61 28.694 24.843 -5.751
470 H VAL 62 H VAL 62 32.310 22.462 -2.612
471 HA VAL 62 HA VAL 62 31.216 20.515 -4.425
472 HB VAL 62 HB VAL 62 33.896 20.471 -2.942
473 HG11 VAL 62 1HG1 VAL 62 33.414 18.219 -3.717
474 HG12 VAL 62 2HG1 VAL 62 32.908 18.820 -5.314
475 HG13 VAL 62 3HG1 VAL 62 34.613 18.930 -4.808
476 HG21 VAL 62 1HG2 VAL 62 34.828 21.320 -5.033
477 HG22 VAL 62 2HG2 VAL 62 33.199 21.379 -5.750
478 HG23 VAL 62 3HG2 VAL 62 33.617 22.425 -4.384
479 H GLU 63 H GLU 63 32.280 20.301 -1.022
480 HA GLU 63 HA GLU 63 31.873 17.507 -0.690
481 HB2 GLU 63 1HB GLU 63 31.597 19.826 1.262
482 HB3 GLU 63 2HB GLU 63 31.495 18.129 1.751
483 HG2 GLU 63 1HG GLU 63 33.894 19.382 0.374
484 HG3 GLU 63 2HG GLU 63 33.728 19.187 2.123
485 H GLN 64 H GLN 64 29.578 20.241 -0.239
486 HA GLN 64 HA GLN 64 27.351 18.515 0.378
487 HB2 GLN 64 1HB GLN 64 27.651 21.356 -0.565
488 HB3 GLN 64 2HB GLN 64 26.063 20.626 -0.264
489 HG2 GLN 64 1HG GLN 64 26.324 20.600 1.958
490 HG3 GLN 64 2HG GLN 64 28.041 20.217 1.883
491 HE21 GLN 64 1HE2 GLN 64 28.046 23.431 3.348
492 HE22 GLN 64 2HE2 GLN 64 27.795 21.744 3.729
493 H GLN 65 H GLN 65 28.662 19.800 -2.681
494 HA GLN 65 HA GLN 65 26.381 19.088 -4.288
495 HB2 GLN 65 1HB GLN 65 29.313 19.419 -4.893
496 HB3 GLN 65 2HB GLN 65 28.209 18.782 -6.111
497 HG2 GLN 65 1HG GLN 65 26.829 20.791 -5.943
498 HG3 GLN 65 2HG GLN 65 27.938 21.461 -4.745
499 HE21 GLN 65 1HE2 GLN 65 30.080 22.760 -7.138
500 HE22 GLN 65 2HE2 GLN 65 29.527 22.714 -5.475
501 H GLN 66 H GLN 66 29.215 17.200 -3.185
502 HA GLN 66 HA GLN 66 28.668 14.887 -4.773
503 HB2 GLN 66 1HB GLN 66 29.928 15.174 -2.025
504 HB3 GLN 66 2HB GLN 66 29.862 13.655 -2.919
505 HG2 GLN 66 1HG GLN 66 31.190 14.646 -4.728
506 HG3 GLN 66 2HG GLN 66 31.265 16.171 -3.836
507 HE21 GLN 66 1HE2 GLN 66 33.952 15.209 -1.872
508 HE22 GLN 66 2HE2 GLN 66 32.954 16.470 -2.541
509 H ASP 67 H ASP 67 27.444 15.986 -1.608
510 HA ASP 67 HA ASP 67 25.957 13.526 -1.180
511 HB2 ASP 67 1HB ASP 67 26.907 15.189 0.564
512 HB3 ASP 67 2HB ASP 67 25.447 16.138 0.242
513 H ARG 68 H ARG 68 25.256 16.736 -2.478
514 HA ARG 68 HA ARG 68 22.388 16.503 -2.615
515 HB2 ARG 68 1HB ARG 68 24.536 18.122 -3.953
516 HB3 ARG 68 2HB ARG 68 22.979 18.066 -4.750
517 HG2 ARG 68 1HG ARG 68 22.986 18.714 -1.841
518 HG3 ARG 68 2HG ARG 68 23.626 19.934 -2.960
519 HD2 ARG 68 1HD ARG 68 21.164 18.853 -4.038
520 HD3 ARG 68 2HD ARG 68 20.901 19.362 -2.365
521 HE ARG 68 HE ARG 68 21.570 21.597 -2.940
522 HH11 ARG 68 1HH1 ARG 68 21.236 19.532 -5.831
523 HH12 ARG 68 2HH1 ARG 68 21.086 20.943 -6.867
524 HH21 ARG 68 1HH2 ARG 68 21.380 23.277 -4.384
525 HH22 ARG 68 2HH2 ARG 68 21.154 22.956 -6.093
526 H ALA 69 H ALA 69 25.015 15.536 -4.840
527 HA ALA 69 HA ALA 69 23.403 14.804 -7.034
528 HB1 ALA 69 1HB ALA 69 25.957 13.470 -6.023
529 HB2 ALA 69 2HB ALA 69 25.278 13.322 -7.661
530 HB3 ALA 69 3HB ALA 69 25.875 14.897 -7.084
531 H ARG 70 H ARG 70 23.955 13.146 -3.973
532 HA ARG 70 HA ARG 70 22.809 10.613 -4.832
533 HB2 ARG 70 1HB ARG 70 23.200 11.723 -2.032
534 HB3 ARG 70 2HB ARG 70 22.908 10.034 -2.446
535 HG2 ARG 70 1HG ARG 70 25.060 9.800 -3.445
536 HG3 ARG 70 2HG ARG 70 25.290 11.545 -3.548
537 HD2 ARG 70 1HD ARG 70 25.261 11.607 -1.016
538 HD3 ARG 70 2HD ARG 70 25.392 9.837 -1.053
539 HE ARG 70 HE ARG 70 27.423 10.607 -2.703
540 HH11 ARG 70 1HH1 ARG 70 26.611 11.776 0.546
541 HH12 ARG 70 2HH1 ARG 70 28.286 12.110 0.917
542 HH21 ARG 70 1HH2 ARG 70 29.512 11.106 -2.145
543 HH22 ARG 70 2HH2 ARG 70 29.880 11.767 -0.579
544 H ARG 71 H ARG 71 21.545 13.612 -3.429
545 HA ARG 71 HA ARG 71 18.898 12.486 -2.816
546 HB2 ARG 71 1HB ARG 71 19.627 15.403 -3.342
547 HB3 ARG 71 2HB ARG 71 18.211 14.797 -2.490
548 HG2 ARG 71 1HG ARG 71 21.085 14.738 -1.542
549 HG3 ARG 71 2HG ARG 71 19.763 15.732 -0.913
550 HD2 ARG 71 1HD ARG 71 18.568 13.570 -0.353
551 HD3 ARG 71 2HD ARG 71 20.082 12.736 -0.744
552 HE ARG 71 HE ARG 71 19.516 14.402 1.607
553 HH11 ARG 71 1HH1 ARG 71 22.054 12.876 -0.304
554 HH12 ARG 71 2HH1 ARG 71 23.225 12.980 0.993
555 HH21 ARG 71 1HH2 ARG 71 21.071 14.494 3.213
556 HH22 ARG 71 2HH2 ARG 71 22.694 13.919 2.898
557 H GLU 72 H GLU 72 20.550 14.092 -5.421
558 HA GLU 72 HA GLU 72 18.285 14.833 -6.969
559 HB2 GLU 72 1HB GLU 72 21.187 14.699 -7.281
560 HB3 GLU 72 2HB GLU 72 20.303 14.463 -8.793
561 HG2 GLU 72 1HG GLU 72 20.777 16.770 -8.538
562 HG3 GLU 72 2HG GLU 72 19.037 16.545 -8.346
563 H GLN 73 H GLN 73 20.012 11.817 -6.701
564 HA GLN 73 HA GLN 73 19.054 10.472 -9.008
565 HB2 GLN 73 1HB GLN 73 19.318 9.325 -6.195
566 HB3 GLN 73 2HB GLN 73 19.236 8.400 -7.697
567 HG2 GLN 73 1HG GLN 73 21.456 10.248 -6.819
568 HG3 GLN 73 2HG GLN 73 21.517 8.490 -6.913
569 HE21 GLN 73 1HE2 GLN 73 22.646 10.616 -10.043
570 HE22 GLN 73 2HE2 GLN 73 22.535 11.201 -8.394
571 H GLU 74 H GLU 74 17.453 11.121 -5.865
572 HA GLU 74 HA GLU 74 15.079 9.633 -6.621
573 HB2 GLU 74 1HB GLU 74 15.319 11.740 -4.459
574 HB3 GLU 74 2HB GLU 74 14.115 10.456 -4.595
575 HG2 GLU 74 1HG GLU 74 17.064 10.199 -3.924
576 HG3 GLU 74 2HG GLU 74 15.678 9.793 -2.904
577 H ARG 75 H ARG 75 16.155 12.998 -6.954
578 HA ARG 75 HA ARG 75 13.564 14.135 -7.478
579 HB2 ARG 75 1HB ARG 75 16.318 14.957 -8.456
580 HB3 ARG 75 2HB ARG 75 14.845 15.853 -8.799
581 HG2 ARG 75 1HG ARG 75 14.495 16.087 -6.332
582 HG3 ARG 75 2HG ARG 75 16.137 15.424 -6.119
583 HD2 ARG 75 1HD ARG 75 16.973 17.167 -7.705
584 HD3 ARG 75 2HD ARG 75 15.351 17.874 -7.746
585 HE ARG 75 HE ARG 75 17.334 17.970 -5.570
586 HH11 ARG 75 1HH1 ARG 75 13.998 18.684 -6.540
587 HH12 ARG 75 2HH1 ARG 75 13.761 19.820 -5.239
588 HH21 ARG 75 1HH2 ARG 75 16.946 19.427 -3.945
589 HH22 ARG 75 2HH2 ARG 75 15.408 20.231 -3.792
590 H ILE 76 H ILE 76 16.007 12.681 -9.701
591 HA ILE 76 HA ILE 76 14.425 13.423 -12.005
592 HB ILE 76 HB ILE 76 15.909 11.952 -13.305
593 HG12 ILE 76 1HG1 ILE 76 17.167 11.177 -10.648
594 HG13 ILE 76 2HG1 ILE 76 16.068 10.136 -11.557
595 HG21 ILE 76 1HG2 ILE 76 17.979 13.186 -12.902
596 HG22 ILE 76 2HG2 ILE 76 16.622 14.276 -12.568
597 HG23 ILE 76 3HG2 ILE 76 17.512 13.528 -11.222
598 HD11 ILE 76 1HD1 ILE 76 18.821 11.077 -12.437
599 HD12 ILE 76 2HD1 ILE 76 18.334 9.434 -11.981
600 HD13 ILE 76 3HD1 ILE 76 17.692 10.164 -13.469
601 H ARG 77 H ARG 77 14.142 10.892 -9.692
602 HA ARG 77 HA ARG 77 12.454 9.190 -11.406
603 HB2 ARG 77 1HB ARG 77 13.027 9.164 -8.422
604 HB3 ARG 77 2HB ARG 77 12.069 7.947 -9.273
605 HG2 ARG 77 1HG ARG 77 13.962 7.177 -10.504
606 HG3 ARG 77 2HG ARG 77 14.931 8.575 -10.020
607 HD2 ARG 77 1HD ARG 77 14.720 7.810 -7.635
608 HD3 ARG 77 2HD ARG 77 13.995 6.307 -8.248
609 HE ARG 77 HE ARG 77 16.369 6.684 -9.683
610 HH11 ARG 77 1HH1 ARG 77 15.581 6.293 -6.261
611 HH12 ARG 77 2HH1 ARG 77 17.112 5.549 -5.908
612 HH21 ARG 77 1HH2 ARG 77 18.308 5.744 -9.142
613 HH22 ARG 77 2HH2 ARG 77 18.623 5.248 -7.501
614 H LEU 78 H LEU 78 12.068 11.995 -9.428
615 HA LEU 78 HA LEU 78 9.124 11.574 -9.294
616 HB2 LEU 78 1HB LEU 78 11.169 12.778 -7.454
617 HB3 LEU 78 2HB LEU 78 9.547 13.435 -7.448
618 HG LEU 78 HG LEU 78 10.141 10.515 -6.955
619 HD11 LEU 78 1HD1 LEU 78 11.196 11.921 -5.244
620 HD12 LEU 78 2HD1 LEU 78 9.787 11.073 -4.571
621 HD13 LEU 78 3HD1 LEU 78 9.666 12.800 -4.996
622 HD21 LEU 78 1HD2 LEU 78 7.829 10.577 -5.982
623 HD22 LEU 78 2HD2 LEU 78 7.852 10.933 -7.720
624 HD23 LEU 78 3HD2 LEU 78 7.666 12.259 -6.549
625 H PHE 79 H PHE 79 10.892 14.579 -8.643
626 HA PHE 79 HA PHE 79 10.180 15.669 -11.228
627 HB2 PHE 79 1HB PHE 79 8.968 17.566 -10.255
628 HB3 PHE 79 2HB PHE 79 8.124 16.032 -9.993
629 HD1 PHE 79 HD1 PHE 79 7.876 15.092 -7.756
630 HD2 PHE 79 HD2 PHE 79 9.970 18.799 -8.382
631 HE1 PHE 79 HE1 PHE 79 7.758 15.563 -5.313
632 HE2 PHE 79 HE2 PHE 79 9.858 19.281 -5.942
633 HZ PHE 79 HZ PHE 79 8.752 17.661 -4.399
634 H SER 80 H SER 80 11.043 17.688 -11.660
635 HA SER 80 HA SER 80 12.639 19.172 -9.744
636 HB2 SER 80 1HB SER 80 14.377 17.536 -10.485
637 HB3 SER 80 2HB SER 80 13.965 17.868 -12.178
638 HG SER 80 HG SER 80 15.810 19.052 -11.320
639 H ALA 81 H ALA 81 13.008 21.288 -10.877
640 HA ALA 81 HA ALA 81 11.731 21.575 -13.518
641 HB1 ALA 81 1HB ALA 81 10.180 23.349 -12.746
642 HB2 ALA 81 2HB ALA 81 9.826 21.814 -11.920
643 HB3 ALA 81 3HB ALA 81 10.718 23.100 -11.070
644 H ASP 82 H ASP 82 14.314 21.852 -11.996
645 HA ASP 82 HA ASP 82 14.959 24.591 -11.675
646 HB2 ASP 82 1HB ASP 82 16.662 22.112 -12.092
647 HB3 ASP 82 2HB ASP 82 17.333 23.704 -11.704
648 HA PRO 83 HA PRO 83 15.706 25.817 -15.818
649 HB2 PRO 83 1HB PRO 83 17.338 27.964 -15.542
650 HB3 PRO 83 2HB PRO 83 15.672 27.973 -14.882
651 HG2 PRO 83 1HG PRO 83 18.255 27.352 -13.472
652 HG3 PRO 83 2HG PRO 83 16.978 28.523 -13.015
653 HD2 PRO 83 1HD PRO 83 17.088 26.026 -11.955
654 HD3 PRO 83 2HD PRO 83 15.521 26.835 -12.308
655 H PHE 84 H PHE 84 17.437 26.356 -17.440
656 HA PHE 84 HA PHE 84 19.927 24.762 -16.992
657 HB2 PHE 84 1HB PHE 84 19.768 24.299 -19.462
658 HB3 PHE 84 2HB PHE 84 18.458 23.588 -18.515
659 HD1 PHE 84 HD1 PHE 84 19.319 26.232 -20.966
660 HD2 PHE 84 HD2 PHE 84 16.163 24.353 -18.725
661 HE1 PHE 84 HE1 PHE 84 17.638 27.389 -22.382
662 HE2 PHE 84 HE2 PHE 84 14.464 25.511 -20.146
663 HZ PHE 84 HZ PHE 84 15.203 27.034 -21.977
664 H ASP 85 H ASP 85 18.989 27.674 -16.822
665 HA ASP 85 HA ASP 85 19.722 29.762 -17.105
666 HB2 ASP 85 1HB ASP 85 22.037 28.766 -16.951
667 HB3 ASP 85 2HB ASP 85 22.076 28.799 -18.714
668 H LEU 86 H LEU 86 18.698 31.112 -18.280
669 HA LEU 86 HA LEU 86 17.459 30.199 -20.723
670 HB2 LEU 86 1HB LEU 86 16.547 32.590 -20.723
671 HB3 LEU 86 2HB LEU 86 16.087 31.531 -19.401
672 HG LEU 86 HG LEU 86 18.339 32.906 -18.420
673 HD11 LEU 86 1HD1 LEU 86 17.803 35.264 -18.730
674 HD12 LEU 86 2HD1 LEU 86 16.420 34.851 -19.774
675 HD13 LEU 86 3HD1 LEU 86 18.081 34.519 -20.314
676 HD21 LEU 86 1HD2 LEU 86 15.374 33.436 -17.988
677 HD22 LEU 86 2HD2 LEU 86 16.699 33.929 -16.908
678 HD23 LEU 86 3HD2 LEU 86 16.352 32.205 -17.152
679 H GLU 87 H GLU 87 19.879 32.763 -19.967
680 HA GLU 87 HA GLU 87 20.288 33.130 -22.863
681 HB2 GLU 87 1HB GLU 87 21.816 34.919 -22.263
682 HB3 GLU 87 2HB GLU 87 20.229 35.125 -21.535
683 HG2 GLU 87 1HG GLU 87 21.145 34.290 -19.370
684 HG3 GLU 87 2HG GLU 87 22.755 34.250 -20.121
685 H ALA 88 H ALA 88 22.070 31.992 -20.004
686 HA ALA 88 HA ALA 88 24.022 30.842 -19.772
687 HB1 ALA 88 1HB ALA 88 23.183 29.495 -22.362
688 HB2 ALA 88 2HB ALA 88 24.262 28.838 -21.111
689 HB3 ALA 88 3HB ALA 88 22.534 29.091 -20.751
690 H GLN 89 H GLN 89 24.607 33.260 -20.586
691 HA GLN 89 HA GLN 89 26.629 33.011 -22.776
692 HB2 GLN 89 1HB GLN 89 24.943 35.400 -21.930
693 HB3 GLN 89 2HB GLN 89 26.228 35.450 -23.128
694 HG2 GLN 89 1HG GLN 89 23.659 33.915 -23.349
695 HG3 GLN 89 2HG GLN 89 24.083 35.381 -24.219
696 HE21 GLN 89 1HE2 GLN 89 24.946 31.879 -25.827
697 HE22 GLN 89 2HE2 GLN 89 23.777 32.155 -24.549
698 H ALA 90 H ALA 90 28.195 34.862 -22.701
699 HA ALA 90 HA ALA 90 29.894 36.023 -21.805
700 HB1 ALA 90 1HB ALA 90 28.229 36.337 -19.282
701 HB2 ALA 90 2HB ALA 90 29.459 37.449 -19.932
702 HB3 ALA 90 3HB ALA 90 27.913 37.235 -20.782
703 H LYS 91 H LYS 91 31.065 36.390 -19.409
704 HA LYS 91 HA LYS 91 31.723 33.819 -18.168
705 HB2 LYS 91 1HB LYS 91 33.017 34.267 -20.502
706 HB3 LYS 91 2HB LYS 91 34.021 35.267 -19.459
707 HG2 LYS 91 1HG LYS 91 33.486 32.345 -18.794
708 HG3 LYS 91 2HG LYS 91 34.752 32.825 -19.939
709 HD2 LYS 91 1HD LYS 91 35.294 34.513 -17.886
710 HD3 LYS 91 2HD LYS 91 34.661 33.131 -16.985
711 HE2 LYS 91 1HE LYS 91 36.400 31.729 -17.704
712 HE3 LYS 91 2HE LYS 91 36.786 32.777 -19.100
713 HZ1 LYS 91 1HZ LYS 91 37.070 33.776 -16.326
714 HZ2 LYS 91 2HZ LYS 91 37.725 34.393 -17.708
715 HZ3 LYS 91 3HZ LYS 91 38.307 32.981 -17.083
716 H ILE 92 H ILE 92 33.235 34.268 -16.397
717 HA ILE 92 HA ILE 92 32.980 36.995 -15.304
718 HB ILE 92 HB ILE 92 34.034 34.432 -13.985
719 HG12 ILE 92 1HG1 ILE 92 31.344 35.746 -13.475
720 HG13 ILE 92 2HG1 ILE 92 31.555 34.418 -14.620
721 HG21 ILE 92 1HG2 ILE 92 33.832 35.721 -11.856
722 HG22 ILE 92 2HG2 ILE 92 34.937 36.528 -12.979
723 HG23 ILE 92 3HG2 ILE 92 33.279 37.146 -12.766
724 HD11 ILE 92 1HD1 ILE 92 30.787 33.471 -12.558
725 HD12 ILE 92 2HD1 ILE 92 32.492 33.010 -12.747
726 HD13 ILE 92 3HD1 ILE 92 32.038 34.315 -11.621
727 H GLU 93 H GLU 93 34.550 38.189 -16.144
728 HA GLU 93 HA GLU 93 37.352 37.147 -16.128
729 HB2 GLU 93 1HB GLU 93 36.141 39.311 -17.891
730 HB3 GLU 93 2HB GLU 93 37.795 38.725 -17.948
731 HG2 GLU 93 1HG GLU 93 35.357 37.042 -18.596
732 HG3 GLU 93 2HG GLU 93 36.303 37.926 -19.794
733 H GLU 94 H GLU 94 38.890 38.524 -15.184
734 HA GLU 94 HA GLU 94 37.926 41.150 -14.224
735 HB2 GLU 94 1HB GLU 94 38.651 40.775 -11.994
736 HB3 GLU 94 2HB GLU 94 37.562 39.464 -12.447
737 HG2 GLU 94 1HG GLU 94 40.588 39.202 -12.460
738 HG3 GLU 94 2HG GLU 94 39.575 38.802 -11.070
739 H ASP 95 H ASP 95 39.563 42.664 -13.686
740 HA ASP 95 HA ASP 95 42.301 41.928 -14.598
741 HB2 ASP 95 1HB ASP 95 41.059 43.137 -16.408
742 HB3 ASP 95 2HB ASP 95 40.884 44.518 -15.315
743 H ILE 96 H ILE 96 42.696 41.725 -12.307
744 HA ILE 96 HA ILE 96 42.387 44.098 -10.629
745 HB ILE 96 HB ILE 96 43.976 41.607 -9.860
746 HG12 ILE 96 1HG1 ILE 96 41.863 40.765 -10.772
747 HG13 ILE 96 2HG1 ILE 96 41.923 40.570 -9.029
748 HG21 ILE 96 1HG2 ILE 96 42.324 43.655 -8.266
749 HG22 ILE 96 2HG2 ILE 96 43.005 42.168 -7.564
750 HG23 ILE 96 3HG2 ILE 96 44.083 43.420 -8.207
751 HD11 ILE 96 1HD1 ILE 96 40.377 42.498 -8.720
752 HD12 ILE 96 2HD1 ILE 96 40.335 42.755 -10.481
753 HD13 ILE 96 3HD1 ILE 96 39.666 41.268 -9.781
754 H ARG 97 H ARG 97 43.846 44.869 -12.781
755 HA ARG 97 HA ARG 97 46.725 44.831 -11.995
756 HB2 ARG 97 1HB ARG 97 45.254 44.914 -14.455
757 HB3 ARG 97 2HB ARG 97 46.199 46.384 -14.369
758 HG2 ARG 97 1HG ARG 97 47.490 44.719 -15.522
759 HG3 ARG 97 2HG ARG 97 48.250 45.029 -13.954
760 HD2 ARG 97 1HD ARG 97 48.227 42.619 -14.472
761 HD3 ARG 97 2HD ARG 97 47.253 42.967 -13.034
762 HE ARG 97 HE ARG 97 45.510 43.035 -15.271
763 HH11 ARG 97 1HH1 ARG 97 47.420 40.607 -13.528
764 HH12 ARG 97 2HH1 ARG 97 46.319 39.325 -13.955
765 HH21 ARG 97 1HH2 ARG 97 44.193 41.393 -15.757
766 HH22 ARG 97 2HH2 ARG 97 44.505 39.757 -15.204
767 H GLN 98 H GLN 98 45.466 45.940 -10.111
768 HA GLN 98 HA GLN 98 45.326 47.711 -8.701
769 HB2 GLN 98 1HB GLN 98 47.545 48.506 -9.564
770 HB3 GLN 98 2HB GLN 98 46.707 49.452 -10.792
771 HG2 GLN 98 1HG GLN 98 45.484 50.701 -8.963
772 HG3 GLN 98 2HG GLN 98 46.427 49.812 -7.763
773 HE21 GLN 98 1HE2 GLN 98 48.209 52.662 -10.141
774 HE22 GLN 98 2HE2 GLN 98 46.739 51.877 -10.666
775 HXT GLN 98 HO GLN 98 43.006 49.481 -11.260
Start of MODEL 23
1 H1 SER 1 1H SER 1 -10.085 34.432 10.418
2 H2 SER 1 2H SER 1 -9.911 34.163 8.892
3 H3 SER 1 3H SER 1 -8.626 34.229 9.913
4 HA SER 1 HA SER 1 -9.109 31.991 10.759
5 HB2 SER 1 1HB SER 1 -11.262 31.678 8.683
6 HB3 SER 1 2HB SER 1 -11.152 30.998 10.342
7 HG SER 1 HG SER 1 -10.965 33.700 10.284
8 H GLN 2 H GLN 2 -7.173 32.921 9.281
9 HA GLN 2 HA GLN 2 -6.908 31.698 6.674
10 HB2 GLN 2 1HB GLN 2 -4.765 32.627 8.633
11 HB3 GLN 2 2HB GLN 2 -4.520 32.268 6.921
12 HG2 GLN 2 1HG GLN 2 -4.740 34.511 6.704
13 HG3 GLN 2 2HG GLN 2 -6.469 34.140 6.699
14 HE21 GLN 2 1HE2 GLN 2 -4.930 36.522 9.517
15 HE22 GLN 2 2HE2 GLN 2 -4.083 36.027 8.072
16 H GLN 3 H GLN 3 -6.716 29.593 6.285
17 HA GLN 3 HA GLN 3 -5.304 27.846 8.232
18 HB2 GLN 3 1HB GLN 3 -7.209 26.303 8.286
19 HB3 GLN 3 2HB GLN 3 -7.658 27.900 8.891
20 HG2 GLN 3 1HG GLN 3 -8.600 28.390 6.567
21 HG3 GLN 3 2HG GLN 3 -8.393 26.667 6.220
22 HE21 GLN 3 1HE2 GLN 3 -11.397 28.014 8.619
23 HE22 GLN 3 2HE2 GLN 3 -10.112 29.078 8.078
24 H SER 4 H SER 4 -5.064 28.869 5.274
25 HA SER 4 HA SER 4 -4.335 26.238 4.173
26 HB2 SER 4 1HB SER 4 -5.589 26.678 2.075
27 HB3 SER 4 2HB SER 4 -6.666 26.486 3.473
28 HG SER 4 HG SER 4 -7.136 28.316 2.077
29 H HIS 5 H HIS 5 -3.148 26.457 2.129
30 HA HIS 5 HA HIS 5 -1.855 29.110 1.724
31 HB2 HIS 5 1HB HIS 5 -0.419 26.434 1.935
32 HB3 HIS 5 2HB HIS 5 0.328 27.991 1.550
33 HD1 HIS 5 HD1 HIS 5 0.004 29.873 3.618
34 HD2 HIS 5 HD2 HIS 5 -0.348 25.829 4.558
35 HE1 HIS 5 HE1 HIS 5 0.300 29.671 6.121
36 H SER 6 H SER 6 -0.366 28.689 -0.410
37 HA SER 6 HA SER 6 -2.283 28.043 -2.459
38 HB2 SER 6 1HB SER 6 0.675 28.695 -2.701
39 HB3 SER 6 2HB SER 6 -0.545 28.787 -3.994
40 HG SER 6 HG SER 6 -1.558 30.435 -2.867
41 H SER 7 H SER 7 0.978 26.986 -3.227
42 HA SER 7 HA SER 7 0.207 24.133 -3.133
43 HB2 SER 7 1HB SER 7 0.814 25.619 -5.728
44 HB3 SER 7 2HB SER 7 0.541 23.872 -5.567
45 HG SER 7 HG SER 7 -1.512 24.997 -4.408
46 HA PRO 8 HA PRO 8 4.624 23.900 -2.800
47 HB2 PRO 8 1HB PRO 8 5.253 21.419 -3.698
48 HB3 PRO 8 2HB PRO 8 4.270 21.647 -2.214
49 HG2 PRO 8 1HG PRO 8 3.351 21.122 -5.027
50 HG3 PRO 8 2HG PRO 8 2.931 20.241 -3.523
51 HD2 PRO 8 1HD PRO 8 1.332 22.172 -4.537
52 HD3 PRO 8 2HD PRO 8 1.546 21.965 -2.765
53 H GLY 9 H GLY 9 6.673 23.432 -4.125
54 HA2 GLY 9 1HA GLY 9 6.372 23.538 -7.025
55 HA3 GLY 9 2HA GLY 9 6.874 25.067 -6.303
56 H GLU 10 H GLU 10 8.657 24.157 -4.329
57 HA GLU 10 HA GLU 10 10.910 23.902 -4.165
58 HB2 GLU 10 1HB GLU 10 10.017 21.472 -4.553
59 HB3 GLU 10 2HB GLU 10 10.891 21.601 -6.087
60 HG2 GLU 10 1HG GLU 10 12.942 22.297 -4.710
61 HG3 GLU 10 2HG GLU 10 12.021 21.860 -3.267
62 H ILE 11 H ILE 11 9.995 25.761 -6.223
63 HA ILE 11 HA ILE 11 11.552 25.568 -8.504
64 HB ILE 11 HB ILE 11 10.758 28.207 -7.658
65 HG12 ILE 11 1HG1 ILE 11 8.528 26.183 -7.525
66 HG13 ILE 11 2HG1 ILE 11 9.183 27.088 -6.145
67 HG21 ILE 11 1HG2 ILE 11 9.477 28.112 -9.734
68 HG22 ILE 11 2HG2 ILE 11 11.043 27.314 -9.977
69 HG23 ILE 11 3HG2 ILE 11 9.587 26.332 -9.681
70 HD11 ILE 11 1HD1 ILE 11 8.458 29.224 -7.279
71 HD12 ILE 11 2HD1 ILE 11 7.606 28.220 -8.481
72 HD13 ILE 11 3HD1 ILE 11 7.138 28.144 -6.771
73 H THR 12 H THR 12 12.632 25.723 -5.596
74 HA THR 12 HA THR 12 14.684 27.850 -5.842
75 HB THR 12 HB THR 12 15.393 26.772 -3.614
76 HG1 THR 12 HG1 THR 12 13.514 25.598 -2.701
77 HG21 THR 12 1HG2 THR 12 13.598 27.861 -2.353
78 HG22 THR 12 2HG2 THR 12 12.546 27.845 -3.786
79 HG23 THR 12 3HG2 THR 12 14.011 28.855 -3.765
80 H SER 13 H SER 13 14.183 24.685 -6.815
81 HA SER 13 HA SER 13 16.828 23.582 -6.481
82 HB2 SER 13 1HB SER 13 16.041 21.935 -8.187
83 HB3 SER 13 2HB SER 13 14.905 22.131 -6.836
84 HG SER 13 HG SER 13 13.506 23.139 -8.103
85 H SER 14 H SER 14 18.285 23.083 -8.278
86 HA SER 14 HA SER 14 19.818 23.875 -9.788
87 HB2 SER 14 1HB SER 14 17.300 24.565 -11.335
88 HB3 SER 14 2HB SER 14 18.918 24.279 -12.014
89 HG SER 14 HG SER 14 17.209 22.476 -11.810
90 HA PRO 15 HA PRO 15 19.240 28.434 -8.929
91 HB2 PRO 15 1HB PRO 15 21.255 28.866 -7.205
92 HB3 PRO 15 2HB PRO 15 19.676 28.223 -6.699
93 HG2 PRO 15 1HG PRO 15 22.163 26.729 -7.303
94 HG3 PRO 15 2HG PRO 15 21.152 26.675 -5.825
95 HD2 PRO 15 1HD PRO 15 20.842 24.852 -7.787
96 HD3 PRO 15 2HD PRO 15 19.421 25.515 -6.905
97 H GLN 16 H GLN 16 21.579 26.423 -10.034
98 HA GLN 16 HA GLN 16 23.295 26.521 -11.511
99 HB2 GLN 16 1HB GLN 16 21.600 28.288 -12.532
100 HB3 GLN 16 2HB GLN 16 22.926 29.405 -12.161
101 HG2 GLN 16 1HG GLN 16 24.466 27.912 -13.415
102 HG3 GLN 16 2HG GLN 16 23.086 26.881 -13.823
103 HE21 GLN 16 1HE2 GLN 16 23.981 29.949 -16.165
104 HE22 GLN 16 2HE2 GLN 16 25.056 29.226 -14.990
105 H GLY 17 H GLY 17 23.166 28.875 -8.969
106 HA2 GLY 17 1HA GLY 17 25.925 29.648 -9.000
107 HA3 GLY 17 2HA GLY 17 24.854 29.618 -7.584
108 H LEU 18 H LEU 18 24.437 26.608 -8.576
109 HA LEU 18 HA LEU 18 26.323 25.353 -6.791
110 HB2 LEU 18 1HB LEU 18 25.008 24.152 -9.252
111 HB3 LEU 18 2HB LEU 18 25.735 23.261 -7.921
112 HG LEU 18 HG LEU 18 23.236 24.950 -7.796
113 HD11 LEU 18 1HD1 LEU 18 22.083 22.787 -7.522
114 HD12 LEU 18 2HD1 LEU 18 23.636 21.940 -7.710
115 HD13 LEU 18 3HD1 LEU 18 22.958 22.871 -9.065
116 HD21 LEU 18 1HD2 LEU 18 24.545 23.222 -5.653
117 HD22 LEU 18 2HD2 LEU 18 22.924 23.945 -5.531
118 HD23 LEU 18 3HD2 LEU 18 24.353 24.992 -5.614
119 H ASP 19 H ASP 19 26.407 26.154 -10.241
120 HA ASP 19 HA ASP 19 28.941 24.738 -10.706
121 HB2 ASP 19 1HB ASP 19 27.019 25.012 -12.361
122 HB3 ASP 19 2HB ASP 19 27.462 26.722 -12.468
123 H ASN 20 H ASN 20 27.749 27.909 -9.897
124 HA ASN 20 HA ASN 20 30.513 29.023 -10.110
125 HB2 ASN 20 1HB ASN 20 27.768 30.324 -10.383
126 HB3 ASN 20 2HB ASN 20 29.264 31.232 -10.191
127 HD21 ASN 20 1HD2 ASN 20 30.506 30.434 -13.431
128 HD22 ASN 20 2HD2 ASN 20 31.058 30.482 -11.781
129 HA PRO 21 HA PRO 21 29.486 29.074 -5.600
130 HB2 PRO 21 1HB PRO 21 32.186 28.921 -4.880
131 HB3 PRO 21 2HB PRO 21 31.124 27.509 -5.052
132 HG2 PRO 21 1HG PRO 21 33.014 28.679 -6.976
133 HG3 PRO 21 2HG PRO 21 32.755 26.976 -6.571
134 HD2 PRO 21 1HD PRO 21 31.783 27.974 -8.794
135 HD3 PRO 21 2HD PRO 21 30.809 26.831 -7.801
136 H ALA 22 H ALA 22 31.942 30.710 -7.614
137 HA ALA 22 HA ALA 22 32.541 32.804 -5.801
138 HB1 ALA 22 1HB ALA 22 33.329 34.022 -7.803
139 HB2 ALA 22 2HB ALA 22 33.892 32.334 -7.797
140 HB3 ALA 22 3HB ALA 22 32.536 32.821 -8.849
141 H LEU 23 H LEU 23 30.029 32.585 -8.339
142 HA LEU 23 HA LEU 23 29.059 35.267 -7.820
143 HB2 LEU 23 1HB LEU 23 27.635 32.966 -9.178
144 HB3 LEU 23 2HB LEU 23 27.229 34.669 -9.303
145 HG LEU 23 HG LEU 23 29.672 33.298 -10.469
146 HD11 LEU 23 1HD1 LEU 23 27.246 34.575 -11.794
147 HD12 LEU 23 2HD1 LEU 23 27.507 32.828 -11.595
148 HD13 LEU 23 3HD1 LEU 23 28.603 33.774 -12.620
149 HD21 LEU 23 1HD2 LEU 23 30.281 35.578 -9.862
150 HD22 LEU 23 2HD2 LEU 23 28.848 36.202 -10.712
151 HD23 LEU 23 3HD2 LEU 23 30.150 35.390 -11.622
152 H LEU 24 H LEU 24 28.204 31.972 -6.765
153 HA LEU 24 HA LEU 24 25.709 32.733 -5.578
154 HB2 LEU 24 1HB LEU 24 26.353 30.428 -6.193
155 HB3 LEU 24 2HB LEU 24 27.562 30.417 -4.925
156 HG LEU 24 HG LEU 24 25.901 30.454 -3.212
157 HD11 LEU 24 1HD1 LEU 24 24.236 31.956 -4.053
158 HD12 LEU 24 2HD1 LEU 24 23.450 30.405 -3.726
159 HD13 LEU 24 3HD1 LEU 24 23.845 30.859 -5.404
160 HD21 LEU 24 1HD2 LEU 24 24.940 28.529 -5.333
161 HD22 LEU 24 2HD2 LEU 24 24.787 28.362 -3.571
162 HD23 LEU 24 3HD2 LEU 24 26.391 28.291 -4.335
163 H ARG 25 H ARG 25 29.027 32.600 -4.378
164 HA ARG 25 HA ARG 25 28.523 32.953 -1.583
165 HB2 ARG 25 1HB ARG 25 30.669 32.239 -2.616
166 HB3 ARG 25 2HB ARG 25 30.826 33.773 -3.429
167 HG2 ARG 25 1HG ARG 25 30.769 33.625 -0.425
168 HG3 ARG 25 2HG ARG 25 32.237 33.246 -1.326
169 HD2 ARG 25 1HD ARG 25 30.717 35.850 -1.389
170 HD3 ARG 25 2HD ARG 25 32.265 35.572 -0.598
171 HE ARG 25 HE ARG 25 31.731 35.812 -3.504
172 HH11 ARG 25 1HH1 ARG 25 34.179 35.472 -0.953
173 HH12 ARG 25 2HH1 ARG 25 35.457 35.947 -2.035
174 HH21 ARG 25 1HH2 ARG 25 33.386 36.404 -4.771
175 HH22 ARG 25 2HH2 ARG 25 35.024 36.443 -4.168
176 H ASP 26 H ASP 26 29.116 35.080 -4.318
177 HA ASP 26 HA ASP 26 29.002 37.557 -2.961
178 HB2 ASP 26 1HB ASP 26 29.239 36.470 -5.584
179 HB3 ASP 26 2HB ASP 26 28.021 37.710 -5.648
180 H MET 27 H MET 27 26.439 35.800 -4.747
181 HA MET 27 HA MET 27 24.342 37.684 -4.389
182 HB2 MET 27 1HB MET 27 24.384 35.709 -5.941
183 HB3 MET 27 2HB MET 27 24.159 34.650 -4.552
184 HG2 MET 27 1HG MET 27 22.217 36.837 -5.284
185 HG3 MET 27 2HG MET 27 22.122 35.214 -5.960
186 HE1 MET 27 1HE MET 27 20.964 33.012 -2.935
187 HE2 MET 27 2HE MET 27 21.330 33.070 -4.676
188 HE3 MET 27 3HE MET 27 22.641 33.202 -3.482
189 H LEU 28 H LEU 28 25.218 34.781 -2.537
190 HA LEU 28 HA LEU 28 23.172 34.874 -0.641
191 HB2 LEU 28 1HB LEU 28 25.871 33.723 -0.832
192 HB3 LEU 28 2HB LEU 28 25.168 33.853 0.770
193 HG LEU 28 HG LEU 28 23.580 32.651 -1.474
194 HD11 LEU 28 1HD1 LEU 28 25.711 31.520 -1.362
195 HD12 LEU 28 2HD1 LEU 28 24.396 30.492 -0.762
196 HD13 LEU 28 3HD1 LEU 28 25.511 31.282 0.383
197 HD21 LEU 28 1HD2 LEU 28 22.439 31.596 0.408
198 HD22 LEU 28 2HD2 LEU 28 22.505 33.349 0.643
199 HD23 LEU 28 3HD2 LEU 28 23.608 32.308 1.544
200 H LEU 29 H LEU 29 26.374 36.451 -0.596
201 HA LEU 29 HA LEU 29 26.141 37.450 2.088
202 HB2 LEU 29 1HB LEU 29 27.681 38.382 -0.338
203 HB3 LEU 29 2HB LEU 29 27.774 39.230 1.202
204 HG LEU 29 HG LEU 29 28.463 36.303 0.933
205 HD11 LEU 29 1HD1 LEU 29 30.272 38.718 0.678
206 HD12 LEU 29 2HD1 LEU 29 29.843 37.559 -0.610
207 HD13 LEU 29 3HD1 LEU 29 30.806 37.022 0.784
208 HD21 LEU 29 1HD2 LEU 29 29.761 36.703 2.985
209 HD22 LEU 29 2HD2 LEU 29 28.042 37.066 3.224
210 HD23 LEU 29 3HD2 LEU 29 29.205 38.394 3.007
211 H ALA 30 H ALA 30 25.107 38.677 -1.052
212 HA ALA 30 HA ALA 30 24.221 41.228 0.075
213 HB1 ALA 30 1HB ALA 30 23.599 39.982 -2.628
214 HB2 ALA 30 2HB ALA 30 23.453 41.696 -2.168
215 HB3 ALA 30 3HB ALA 30 25.058 40.938 -2.266
216 H ASN 31 H ASN 31 22.898 38.081 0.069
217 HA ASN 31 HA ASN 31 20.101 39.132 0.054
218 HB2 ASN 31 1HB ASN 31 20.896 37.356 -1.584
219 HB3 ASN 31 2HB ASN 31 20.984 36.240 -0.215
220 HD21 ASN 31 1HD2 ASN 31 17.717 36.080 -2.017
221 HD22 ASN 31 2HD2 ASN 31 19.379 36.151 -2.574
222 HA PRO 32 HA PRO 32 20.846 38.331 4.429
223 HB2 PRO 32 1HB PRO 32 18.623 39.641 5.409
224 HB3 PRO 32 2HB PRO 32 20.153 40.458 4.951
225 HG2 PRO 32 1HG PRO 32 17.663 40.082 3.286
226 HG3 PRO 32 2HG PRO 32 18.585 41.583 3.609
227 HD2 PRO 32 1HD PRO 32 18.977 40.261 1.363
228 HD3 PRO 32 2HD PRO 32 20.382 40.919 2.275
229 H HIS 33 H HIS 33 17.820 37.704 2.670
230 HA HIS 33 HA HIS 33 16.741 35.971 4.764
231 HB2 HIS 33 1HB HIS 33 15.354 37.235 3.062
232 HB3 HIS 33 2HB HIS 33 16.029 36.197 1.794
233 HD1 HIS 33 HD1 HIS 33 13.627 36.108 4.763
234 HD2 HIS 33 HD2 HIS 33 14.866 33.668 1.588
235 HE1 HIS 33 HE1 HIS 33 11.993 34.152 4.647
236 H GLU 34 H GLU 34 18.595 35.488 1.756
237 HA GLU 34 HA GLU 34 18.184 32.608 1.833
238 HB2 GLU 34 1HB GLU 34 19.353 34.539 0.067
239 HB3 GLU 34 2HB GLU 34 20.506 33.263 0.347
240 HG2 GLU 34 1HG GLU 34 17.665 32.759 -0.470
241 HG3 GLU 34 2HG GLU 34 18.966 33.004 -1.627
242 H LEU 35 H LEU 35 20.656 34.968 2.864
243 HA LEU 35 HA LEU 35 22.524 32.978 3.672
244 HB2 LEU 35 1HB LEU 35 23.829 34.602 4.236
245 HB3 LEU 35 2HB LEU 35 22.731 35.406 3.173
246 HG LEU 35 HG LEU 35 21.719 36.611 4.983
247 HD11 LEU 35 1HD1 LEU 35 23.074 36.674 7.169
248 HD12 LEU 35 2HD1 LEU 35 23.598 35.025 6.722
249 HD13 LEU 35 3HD1 LEU 35 21.874 35.391 6.957
250 HD21 LEU 35 1HD2 LEU 35 23.610 37.358 3.668
251 HD22 LEU 35 2HD2 LEU 35 24.732 36.550 4.781
252 HD23 LEU 35 3HD2 LEU 35 23.775 37.953 5.334
253 H SER 36 H SER 36 19.741 34.380 5.319
254 HA SER 36 HA SER 36 20.484 33.442 7.921
255 HB2 SER 36 1HB SER 36 18.253 34.085 8.634
256 HB3 SER 36 2HB SER 36 18.997 35.365 7.657
257 HG SER 36 HG SER 36 16.959 33.541 6.936
258 H LEU 37 H LEU 37 18.388 32.247 5.322
259 HA LEU 37 HA LEU 37 17.510 29.968 6.855
260 HB2 LEU 37 1HB LEU 37 16.418 29.320 4.983
261 HB3 LEU 37 2HB LEU 37 16.515 31.019 4.958
262 HG LEU 37 HG LEU 37 18.116 30.923 3.114
263 HD11 LEU 37 1HD1 LEU 37 16.994 28.154 3.029
264 HD12 LEU 37 2HD1 LEU 37 18.696 28.626 3.252
265 HD13 LEU 37 3HD1 LEU 37 17.882 28.971 1.719
266 HD21 LEU 37 1HD2 LEU 37 16.269 30.704 1.493
267 HD22 LEU 37 2HD2 LEU 37 15.792 31.660 2.911
268 HD23 LEU 37 3HD2 LEU 37 15.254 29.971 2.760
269 H LEU 38 H LEU 38 20.145 30.725 4.721
270 HA LEU 38 HA LEU 38 21.049 28.090 4.349
271 HB2 LEU 38 1HB LEU 38 21.643 30.033 3.091
272 HB3 LEU 38 2HB LEU 38 22.595 30.656 4.454
273 HG LEU 38 HG LEU 38 24.056 28.645 4.417
274 HD11 LEU 38 1HD1 LEU 38 24.085 27.230 2.404
275 HD12 LEU 38 2HD1 LEU 38 22.584 28.013 1.857
276 HD13 LEU 38 3HD1 LEU 38 22.604 27.054 3.362
277 HD21 LEU 38 1HD2 LEU 38 24.693 30.734 3.280
278 HD22 LEU 38 2HD2 LEU 38 24.034 30.064 1.771
279 HD23 LEU 38 3HD2 LEU 38 25.414 29.277 2.567
280 H LYS 39 H LYS 39 21.935 30.433 6.929
281 HA LYS 39 HA LYS 39 23.746 28.523 8.165
282 HB2 LYS 39 1HB LYS 39 23.397 29.948 10.256
283 HB3 LYS 39 2HB LYS 39 24.179 30.688 8.860
284 HG2 LYS 39 1HG LYS 39 22.201 31.887 8.290
285 HG3 LYS 39 2HG LYS 39 21.230 31.020 9.437
286 HD2 LYS 39 1HD LYS 39 21.635 33.115 10.414
287 HD3 LYS 39 2HD LYS 39 22.758 32.016 11.243
288 HE2 LYS 39 1HE LYS 39 24.589 32.759 9.760
289 HE3 LYS 39 2HE LYS 39 23.457 33.796 8.864
290 HZ1 LYS 39 1HZ LYS 39 24.704 35.055 10.500
291 HZ2 LYS 39 2HZ LYS 39 24.153 34.099 11.728
292 HZ3 LYS 39 3HZ LYS 39 23.101 35.058 10.894
293 H GLU 40 H GLU 40 20.289 28.917 8.263
294 HA GLU 40 HA GLU 40 19.965 27.182 10.579
295 HB2 GLU 40 1HB GLU 40 18.118 28.258 8.431
296 HB3 GLU 40 2HB GLU 40 17.550 27.191 9.729
297 HG2 GLU 40 1HG GLU 40 18.041 28.803 11.410
298 HG3 GLU 40 2HG GLU 40 19.044 29.761 10.314
299 H ARG 41 H ARG 41 19.405 26.778 7.010
300 HA ARG 41 HA ARG 41 18.931 23.925 7.342
301 HB2 ARG 41 1HB ARG 41 18.747 23.768 5.038
302 HB3 ARG 41 2HB ARG 41 18.067 25.321 5.501
303 HG2 ARG 41 1HG ARG 41 20.093 26.416 4.702
304 HG3 ARG 41 2HG ARG 41 20.735 24.858 4.193
305 HD2 ARG 41 1HD ARG 41 18.991 24.569 2.568
306 HD3 ARG 41 2HD ARG 41 18.114 25.978 3.194
307 HE ARG 41 HE ARG 41 20.726 26.786 2.374
308 HH11 ARG 41 1HH1 ARG 41 17.626 25.875 0.936
309 HH12 ARG 41 2HH1 ARG 41 17.861 26.932 -0.431
310 HH21 ARG 41 1HH2 ARG 41 20.930 28.109 0.587
311 HH22 ARG 41 2HH2 ARG 41 19.671 28.182 -0.608
312 H ASN 42 H ASN 42 21.754 25.712 6.451
313 HA ASN 42 HA ASN 42 23.384 23.191 6.470
314 HB2 ASN 42 1HB ASN 42 22.730 24.087 4.158
315 HB3 ASN 42 2HB ASN 42 23.813 25.421 4.461
316 HD21 ASN 42 1HD2 ASN 42 25.575 22.749 2.621
317 HD22 ASN 42 2HD2 ASN 42 24.250 23.839 2.347
318 HA PRO 43 HA PRO 43 25.376 26.576 8.919
319 HB2 PRO 43 1HB PRO 43 26.500 24.884 10.846
320 HB3 PRO 43 2HB PRO 43 24.965 25.798 10.992
321 HG2 PRO 43 1HG PRO 43 25.395 22.935 10.209
322 HG3 PRO 43 2HG PRO 43 24.168 23.647 11.296
323 HD2 PRO 43 1HD PRO 43 23.577 22.955 8.766
324 HD3 PRO 43 2HD PRO 43 22.875 24.430 9.517
325 HA PRO 44 HA PRO 44 29.551 24.701 8.185
326 HB2 PRO 44 1HB PRO 44 29.993 22.695 6.391
327 HB3 PRO 44 2HB PRO 44 29.722 22.403 8.140
328 HG2 PRO 44 1HG PRO 44 27.759 22.284 5.890
329 HG3 PRO 44 2HG PRO 44 28.105 21.064 7.154
330 HD2 PRO 44 1HD PRO 44 26.035 22.763 7.410
331 HD3 PRO 44 2HD PRO 44 27.041 22.325 8.829
332 H LEU 45 H LEU 45 27.244 24.574 5.364
333 HA LEU 45 HA LEU 45 29.237 25.803 3.619
334 HB2 LEU 45 1HB LEU 45 27.331 24.512 2.738
335 HB3 LEU 45 2HB LEU 45 26.236 25.760 3.332
336 HG LEU 45 HG LEU 45 27.179 27.392 1.784
337 HD11 LEU 45 1HD1 LEU 45 29.018 25.158 0.808
338 HD12 LEU 45 2HD1 LEU 45 29.527 26.642 1.646
339 HD13 LEU 45 3HD1 LEU 45 28.813 26.745 0.035
340 HD21 LEU 45 1HD2 LEU 45 25.345 25.890 1.055
341 HD22 LEU 45 2HD2 LEU 45 26.550 24.773 0.373
342 HD23 LEU 45 3HD2 LEU 45 26.372 26.414 -0.293
343 H ALA 46 H ALA 46 26.767 26.835 5.894
344 HA ALA 46 HA ALA 46 26.749 29.572 5.081
345 HB1 ALA 46 1HB ALA 46 25.064 28.504 6.502
346 HB2 ALA 46 2HB ALA 46 26.249 28.440 7.828
347 HB3 ALA 46 3HB ALA 46 25.714 30.012 7.187
348 H GLU 47 H GLU 47 28.724 27.927 7.680
349 HA GLU 47 HA GLU 47 29.924 30.356 8.534
350 HB2 GLU 47 1HB GLU 47 31.694 29.055 9.532
351 HB3 GLU 47 2HB GLU 47 30.103 28.390 9.891
352 HG2 GLU 47 1HG GLU 47 30.489 26.479 8.805
353 HG3 GLU 47 2HG GLU 47 31.463 27.221 7.545
354 H ALA 48 H ALA 48 30.746 28.242 5.871
355 HA ALA 48 HA ALA 48 33.117 29.375 5.051
356 HB1 ALA 48 1HB ALA 48 30.978 28.406 3.163
357 HB2 ALA 48 2HB ALA 48 32.725 28.212 3.057
358 HB3 ALA 48 3HB ALA 48 31.824 27.273 4.245
359 H LEU 49 H LEU 49 29.797 30.298 4.277
360 HA LEU 49 HA LEU 49 30.519 32.458 2.542
361 HB2 LEU 49 1HB LEU 49 28.261 31.356 2.710
362 HB3 LEU 49 2HB LEU 49 28.069 32.074 4.304
363 HG LEU 49 HG LEU 49 28.386 34.347 3.121
364 HD11 LEU 49 1HD1 LEU 49 29.169 33.483 0.991
365 HD12 LEU 49 2HD1 LEU 49 27.626 34.310 0.772
366 HD13 LEU 49 3HD1 LEU 49 27.678 32.537 0.787
367 HD21 LEU 49 1HD2 LEU 49 26.311 33.496 4.147
368 HD22 LEU 49 2HD2 LEU 49 25.909 32.683 2.615
369 HD23 LEU 49 3HD2 LEU 49 26.010 34.458 2.688
370 H LEU 50 H LEU 50 29.828 32.223 6.053
371 HA LEU 50 HA LEU 50 29.751 35.029 6.555
372 HB2 LEU 50 1HB LEU 50 30.777 32.974 8.525
373 HB3 LEU 50 2HB LEU 50 30.024 34.514 8.878
374 HG LEU 50 HG LEU 50 28.758 31.946 8.043
375 HD11 LEU 50 1HD1 LEU 50 28.294 33.758 10.381
376 HD12 LEU 50 2HD1 LEU 50 29.238 32.244 10.366
377 HD13 LEU 50 3HD1 LEU 50 27.494 32.193 10.065
378 HD21 LEU 50 1HD2 LEU 50 26.558 33.055 8.015
379 HD22 LEU 50 2HD2 LEU 50 27.604 33.472 6.653
380 HD23 LEU 50 3HD2 LEU 50 27.403 34.628 8.000
381 H SER 51 H SER 51 32.417 32.759 6.294
382 HA SER 51 HA SER 51 34.398 34.429 7.508
383 HB2 SER 51 1HB SER 51 34.608 32.160 5.534
384 HB3 SER 51 2HB SER 51 35.923 32.821 6.507
385 HG SER 51 HG SER 51 33.556 31.580 7.490
386 H GLY 52 H GLY 52 32.922 34.287 4.338
387 HA2 GLY 52 1HA GLY 52 33.173 35.839 2.616
388 HA3 GLY 52 2HA GLY 52 34.583 36.531 3.437
389 H ASP 53 H ASP 53 35.595 33.653 3.722
390 HA ASP 53 HA ASP 53 37.412 33.681 1.546
391 HB2 ASP 53 1HB ASP 53 37.728 32.438 3.770
392 HB3 ASP 53 2HB ASP 53 36.587 31.295 3.189
393 H LEU 54 H LEU 54 36.915 33.347 -0.551
394 HA LEU 54 HA LEU 54 34.596 31.888 -1.411
395 HB2 LEU 54 1HB LEU 54 35.801 33.555 -2.805
396 HB3 LEU 54 2HB LEU 54 37.169 32.461 -2.927
397 HG LEU 54 HG LEU 54 35.450 32.667 -4.847
398 HD11 LEU 54 1HD1 LEU 54 35.944 30.499 -5.697
399 HD12 LEU 54 2HD1 LEU 54 36.274 29.880 -4.069
400 HD13 LEU 54 3HD1 LEU 54 37.358 31.082 -4.794
401 HD21 LEU 54 1HD2 LEU 54 33.963 30.591 -3.240
402 HD22 LEU 54 2HD2 LEU 54 33.618 31.098 -4.892
403 HD23 LEU 54 3HD2 LEU 54 33.405 32.246 -3.557
404 H GLU 55 H GLU 55 38.022 31.032 -0.791
405 HA GLU 55 HA GLU 55 37.998 28.538 -2.128
406 HB2 GLU 55 1HB GLU 55 39.497 29.207 0.416
407 HB3 GLU 55 2HB GLU 55 39.904 27.951 -0.747
408 HG2 GLU 55 1HG GLU 55 39.918 30.933 -1.230
409 HG3 GLU 55 2HG GLU 55 41.302 29.894 -0.944
410 H LYS 56 H LYS 56 37.471 29.209 1.374
411 HA LYS 56 HA LYS 56 36.691 26.504 1.873
412 HB2 LYS 56 1HB LYS 56 36.192 27.071 4.045
413 HB3 LYS 56 2HB LYS 56 37.380 28.341 3.585
414 HG2 LYS 56 1HG LYS 56 35.401 29.771 3.240
415 HG3 LYS 56 2HG LYS 56 34.509 28.477 4.018
416 HD2 LYS 56 1HD LYS 56 37.027 29.256 5.395
417 HD3 LYS 56 2HD LYS 56 35.735 30.444 5.425
418 HE2 LYS 56 1HE LYS 56 34.186 28.786 6.361
419 HE3 LYS 56 2HE LYS 56 35.439 27.551 6.285
420 HZ1 LYS 56 1HZ LYS 56 35.114 28.428 8.492
421 HZ2 LYS 56 2HZ LYS 56 35.474 29.964 7.987
422 HZ3 LYS 56 3HZ LYS 56 36.641 28.792 7.962
423 H PHE 57 H PHE 57 34.762 29.367 0.882
424 HA PHE 57 HA PHE 57 32.243 28.076 1.124
425 HB2 PHE 57 1HB PHE 57 32.551 30.482 0.708
426 HB3 PHE 57 2HB PHE 57 33.100 30.116 -0.931
427 HD1 PHE 57 HD1 PHE 57 31.517 29.590 -2.689
428 HD2 PHE 57 HD2 PHE 57 30.198 29.998 1.387
429 HE1 PHE 57 HE1 PHE 57 29.148 29.597 -3.452
430 HE2 PHE 57 HE2 PHE 57 27.830 29.993 0.628
431 HZ PHE 57 HZ PHE 57 27.305 29.784 -1.798
432 H SER 58 H SER 58 34.382 28.211 -1.781
433 HA SER 58 HA SER 58 32.718 26.489 -3.337
434 HB2 SER 58 1HB SER 58 34.505 27.982 -4.227
435 HB3 SER 58 2HB SER 58 35.727 26.947 -3.464
436 HG SER 58 HG SER 58 35.522 26.295 -5.569
437 H ARG 59 H ARG 59 35.445 25.798 -1.147
438 HA ARG 59 HA ARG 59 35.781 23.057 -1.870
439 HB2 ARG 59 1HB ARG 59 37.359 24.423 -0.518
440 HB3 ARG 59 2HB ARG 59 36.206 24.456 0.809
441 HG2 ARG 59 1HG ARG 59 37.239 21.820 -0.240
442 HG3 ARG 59 2HG ARG 59 38.236 22.808 0.842
443 HD2 ARG 59 1HD ARG 59 36.271 22.860 2.454
444 HD3 ARG 59 2HD ARG 59 35.493 21.642 1.436
445 HE ARG 59 HE ARG 59 37.632 21.237 3.329
446 HH11 ARG 59 1HH1 ARG 59 36.242 19.922 0.364
447 HH12 ARG 59 2HH1 ARG 59 36.828 18.314 0.700
448 HH21 ARG 59 1HH2 ARG 59 38.333 19.165 3.684
449 HH22 ARG 59 2HH2 ARG 59 37.982 17.899 2.545
450 H VAL 60 H VAL 60 33.768 24.625 0.636
451 HA VAL 60 HA VAL 60 32.639 22.112 1.512
452 HB VAL 60 HB VAL 60 31.658 24.969 1.939
453 HG11 VAL 60 1HG1 VAL 60 30.860 22.322 3.218
454 HG12 VAL 60 2HG1 VAL 60 30.453 23.917 3.893
455 HG13 VAL 60 3HG1 VAL 60 29.819 23.443 2.305
456 HG21 VAL 60 1HG2 VAL 60 32.723 24.749 4.159
457 HG22 VAL 60 2HG2 VAL 60 33.265 23.099 3.756
458 HG23 VAL 60 3HG2 VAL 60 33.932 24.497 2.891
459 H LEU 61 H LEU 61 31.750 24.559 -0.942
460 HA LEU 61 HA LEU 61 29.112 23.715 -1.447
461 HB2 LEU 61 1HB LEU 61 30.648 25.591 -2.548
462 HB3 LEU 61 2HB LEU 61 30.953 24.341 -3.741
463 HG LEU 61 HG LEU 61 28.293 24.220 -3.796
464 HD11 LEU 61 1HD1 LEU 61 28.055 25.824 -1.926
465 HD12 LEU 61 2HD1 LEU 61 27.311 26.433 -3.418
466 HD13 LEU 61 3HD1 LEU 61 28.897 27.060 -2.901
467 HD21 LEU 61 1HD2 LEU 61 29.299 26.718 -5.101
468 HD22 LEU 61 2HD2 LEU 61 28.356 25.379 -5.764
469 HD23 LEU 61 3HD2 LEU 61 30.104 25.186 -5.541
470 H VAL 62 H VAL 62 32.189 22.406 -2.771
471 HA VAL 62 HA VAL 62 30.941 20.378 -4.374
472 HB VAL 62 HB VAL 62 33.702 20.309 -3.059
473 HG11 VAL 62 1HG1 VAL 62 34.263 18.746 -4.942
474 HG12 VAL 62 2HG1 VAL 62 33.032 18.078 -3.851
475 HG13 VAL 62 3HG1 VAL 62 32.548 18.749 -5.426
476 HG21 VAL 62 1HG2 VAL 62 33.449 22.289 -4.431
477 HG22 VAL 62 2HG2 VAL 62 34.499 21.133 -5.257
478 HG23 VAL 62 3HG2 VAL 62 32.806 21.327 -5.777
479 H GLU 63 H GLU 63 32.143 20.346 -0.993
480 HA GLU 63 HA GLU 63 31.657 17.550 -0.549
481 HB2 GLU 63 1HB GLU 63 31.637 19.904 1.364
482 HB3 GLU 63 2HB GLU 63 31.490 18.219 1.877
483 HG2 GLU 63 1HG GLU 63 33.666 17.714 0.858
484 HG3 GLU 63 2HG GLU 63 33.828 19.407 0.373
485 H GLN 64 H GLN 64 29.544 20.404 -0.277
486 HA GLN 64 HA GLN 64 27.311 18.903 0.813
487 HB2 GLN 64 1HB GLN 64 27.475 21.583 -0.606
488 HB3 GLN 64 2HB GLN 64 26.004 20.936 0.134
489 HG2 GLN 64 1HG GLN 64 28.593 21.532 1.602
490 HG3 GLN 64 2HG GLN 64 27.150 22.541 1.611
491 HE21 GLN 64 1HE2 GLN 64 27.510 19.812 4.396
492 HE22 GLN 64 2HE2 GLN 64 28.808 20.570 3.505
493 H GLN 65 H GLN 65 28.433 19.688 -2.481
494 HA GLN 65 HA GLN 65 26.050 18.692 -3.799
495 HB2 GLN 65 1HB GLN 65 28.935 18.968 -4.684
496 HB3 GLN 65 2HB GLN 65 27.668 18.345 -5.741
497 HG2 GLN 65 1HG GLN 65 26.492 20.417 -5.725
498 HG3 GLN 65 2HG GLN 65 27.482 21.055 -4.412
499 HE21 GLN 65 1HE2 GLN 65 29.071 22.743 -7.098
500 HE22 GLN 65 2HE2 GLN 65 27.852 22.868 -5.856
501 H GLN 66 H GLN 66 29.105 17.185 -2.682
502 HA GLN 66 HA GLN 66 28.557 14.593 -3.773
503 HB2 GLN 66 1HB GLN 66 30.179 15.467 -1.361
504 HB3 GLN 66 2HB GLN 66 30.076 13.794 -1.914
505 HG2 GLN 66 1HG GLN 66 31.035 14.431 -4.078
506 HG3 GLN 66 2HG GLN 66 31.147 16.110 -3.547
507 HE21 GLN 66 1HE2 GLN 66 34.470 15.205 -2.768
508 HE22 GLN 66 2HE2 GLN 66 33.428 15.974 -3.942
509 H ASP 67 H ASP 67 27.639 16.183 -0.688
510 HA ASP 67 HA ASP 67 26.455 13.752 0.349
511 HB2 ASP 67 1HB ASP 67 27.217 15.801 1.685
512 HB3 ASP 67 2HB ASP 67 25.681 16.536 1.206
513 H ARG 68 H ARG 68 25.237 16.550 -1.461
514 HA ARG 68 HA ARG 68 22.465 15.898 -1.301
515 HB2 ARG 68 1HB ARG 68 24.194 17.398 -3.233
516 HB3 ARG 68 2HB ARG 68 22.618 16.856 -3.799
517 HG2 ARG 68 1HG ARG 68 21.884 17.971 -1.444
518 HG3 ARG 68 2HG ARG 68 23.303 18.967 -1.846
519 HD2 ARG 68 1HD ARG 68 21.535 20.072 -2.926
520 HD3 ARG 68 2HD ARG 68 22.269 19.095 -4.213
521 HE ARG 68 HE ARG 68 20.453 17.449 -3.946
522 HH11 ARG 68 1HH1 ARG 68 19.831 20.636 -2.499
523 HH12 ARG 68 2HH1 ARG 68 18.105 20.394 -2.518
524 HH21 ARG 68 1HH2 ARG 68 18.268 17.217 -3.883
525 HH22 ARG 68 2HH2 ARG 68 17.239 18.517 -3.295
526 H ALA 69 H ALA 69 25.012 14.797 -3.555
527 HA ALA 69 HA ALA 69 23.364 13.216 -5.199
528 HB1 ALA 69 1HB ALA 69 25.764 13.695 -5.634
529 HB2 ALA 69 2HB ALA 69 26.215 12.599 -4.304
530 HB3 ALA 69 3HB ALA 69 25.399 11.956 -5.747
531 H ARG 70 H ARG 70 24.708 12.412 -1.968
532 HA ARG 70 HA ARG 70 23.783 9.662 -2.045
533 HB2 ARG 70 1HB ARG 70 24.453 11.455 0.321
534 HB3 ARG 70 2HB ARG 70 24.263 9.696 0.365
535 HG2 ARG 70 1HG ARG 70 26.125 9.499 -1.252
536 HG3 ARG 70 2HG ARG 70 26.367 11.247 -1.158
537 HD2 ARG 70 1HD ARG 70 26.349 9.549 1.326
538 HD3 ARG 70 2HD ARG 70 27.802 9.659 0.330
539 HE ARG 70 HE ARG 70 26.584 11.833 1.954
540 HH11 ARG 70 1HH1 ARG 70 29.208 10.872 -0.235
541 HH12 ARG 70 2HH1 ARG 70 30.204 12.220 0.240
542 HH21 ARG 70 1HH2 ARG 70 27.894 13.493 2.485
543 HH22 ARG 70 2HH2 ARG 70 29.479 13.680 1.752
544 H ARG 71 H ARG 71 22.463 12.715 -0.765
545 HA ARG 71 HA ARG 71 20.152 11.490 0.499
546 HB2 ARG 71 1HB ARG 71 20.598 14.308 -0.553
547 HB3 ARG 71 2HB ARG 71 19.281 13.818 0.519
548 HG2 ARG 71 1HG ARG 71 20.800 13.389 2.322
549 HG3 ARG 71 2HG ARG 71 22.207 13.534 1.263
550 HD2 ARG 71 1HD ARG 71 22.296 15.669 1.923
551 HD3 ARG 71 2HD ARG 71 20.944 15.914 0.808
552 HE ARG 71 HE ARG 71 19.431 15.925 2.633
553 HH11 ARG 71 1HH1 ARG 71 22.769 15.511 3.789
554 HH12 ARG 71 2HH1 ARG 71 22.307 15.871 5.436
555 HH21 ARG 71 1HH2 ARG 71 18.959 16.362 4.748
556 HH22 ARG 71 2HH2 ARG 71 20.208 16.352 5.962
557 H GLU 72 H GLU 72 20.927 12.655 -2.715
558 HA GLU 72 HA GLU 72 18.281 12.880 -3.731
559 HB2 GLU 72 1HB GLU 72 20.963 12.894 -4.762
560 HB3 GLU 72 2HB GLU 72 19.968 11.865 -5.789
561 HG2 GLU 72 1HG GLU 72 19.925 14.105 -6.646
562 HG3 GLU 72 2HG GLU 72 18.326 13.702 -6.006
563 H GLN 73 H GLN 73 20.329 10.072 -3.193
564 HA GLN 73 HA GLN 73 18.953 8.201 -4.807
565 HB2 GLN 73 1HB GLN 73 20.199 7.675 -2.086
566 HB3 GLN 73 2HB GLN 73 19.871 6.483 -3.347
567 HG2 GLN 73 1HG GLN 73 21.893 8.741 -3.455
568 HG3 GLN 73 2HG GLN 73 22.239 7.019 -3.317
569 HE21 GLN 73 1HE2 GLN 73 22.107 8.656 -6.898
570 HE22 GLN 73 2HE2 GLN 73 22.358 9.506 -5.384
571 H GLU 74 H GLU 74 18.193 9.369 -1.480
572 HA GLU 74 HA GLU 74 15.808 7.662 -1.498
573 HB2 GLU 74 1HB GLU 74 15.218 8.721 0.614
574 HB3 GLU 74 2HB GLU 74 16.739 7.836 0.600
575 HG2 GLU 74 1HG GLU 74 17.967 9.942 0.528
576 HG3 GLU 74 2HG GLU 74 16.429 10.833 0.574
577 H ARG 75 H ARG 75 16.499 11.053 -2.291
578 HA ARG 75 HA ARG 75 13.781 11.936 -2.037
579 HB2 ARG 75 1HB ARG 75 16.037 12.957 -3.772
580 HB3 ARG 75 2HB ARG 75 14.457 13.743 -3.648
581 HG2 ARG 75 1HG ARG 75 14.933 13.681 -1.049
582 HG3 ARG 75 2HG ARG 75 16.619 13.536 -1.573
583 HD2 ARG 75 1HD ARG 75 16.468 15.819 -1.482
584 HD3 ARG 75 2HD ARG 75 15.936 15.574 -3.148
585 HE ARG 75 HE ARG 75 13.992 15.868 -0.874
586 HH11 ARG 75 1HH1 ARG 75 15.037 16.878 -4.100
587 HH12 ARG 75 2HH1 ARG 75 13.702 18.006 -4.265
588 HH21 ARG 75 1HH2 ARG 75 12.308 17.308 -1.190
589 HH22 ARG 75 2HH2 ARG 75 12.188 18.181 -2.716
590 H ILE 76 H ILE 76 15.342 10.217 -4.691
591 HA ILE 76 HA ILE 76 13.382 10.786 -6.683
592 HB ILE 76 HB ILE 76 14.084 8.749 -7.842
593 HG12 ILE 76 1HG1 ILE 76 15.719 8.175 -5.360
594 HG13 ILE 76 2HG1 ILE 76 14.261 7.301 -5.814
595 HG21 ILE 76 1HG2 ILE 76 16.376 9.407 -8.208
596 HG22 ILE 76 2HG2 ILE 76 15.443 10.873 -7.855
597 HG23 ILE 76 3HG2 ILE 76 16.473 10.154 -6.604
598 HD11 ILE 76 1HD1 ILE 76 16.916 7.325 -7.290
599 HD12 ILE 76 2HD1 ILE 76 16.166 5.969 -6.426
600 HD13 ILE 76 3HD1 ILE 76 15.427 6.579 -7.926
601 H ARG 77 H ARG 77 13.045 8.915 -3.820
602 HA ARG 77 HA ARG 77 10.928 7.121 -4.613
603 HB2 ARG 77 1HB ARG 77 11.361 8.580 -1.980
604 HB3 ARG 77 2HB ARG 77 10.218 7.262 -2.217
605 HG2 ARG 77 1HG ARG 77 11.982 5.657 -2.516
606 HG3 ARG 77 2HG ARG 77 13.208 6.944 -2.616
607 HD2 ARG 77 1HD ARG 77 12.468 7.676 -0.296
608 HD3 ARG 77 2HD ARG 77 11.537 6.171 -0.191
609 HE ARG 77 HE ARG 77 14.047 5.291 -0.834
610 HH11 ARG 77 1HH1 ARG 77 12.932 7.491 1.698
611 HH12 ARG 77 2HH1 ARG 77 14.278 7.121 2.744
612 HH21 ARG 77 1HH2 ARG 77 15.703 4.827 0.596
613 HH22 ARG 77 2HH2 ARG 77 15.789 5.635 2.141
614 H LEU 78 H LEU 78 11.043 10.536 -4.349
615 HA LEU 78 HA LEU 78 9.582 12.212 -4.609
616 HB2 LEU 78 1HB LEU 78 9.210 10.787 -6.614
617 HB3 LEU 78 2HB LEU 78 7.873 10.050 -5.799
618 HG LEU 78 HG LEU 78 6.602 12.170 -5.950
619 HD11 LEU 78 1HD1 LEU 78 8.459 13.779 -5.877
620 HD12 LEU 78 2HD1 LEU 78 7.497 14.014 -7.348
621 HD13 LEU 78 3HD1 LEU 78 9.063 13.174 -7.436
622 HD21 LEU 78 1HD2 LEU 78 6.288 12.131 -8.381
623 HD22 LEU 78 2HD2 LEU 78 6.440 10.489 -7.724
624 HD23 LEU 78 3HD2 LEU 78 7.816 11.237 -8.571
625 H PHE 79 H PHE 79 6.849 12.477 -4.345
626 HA PHE 79 HA PHE 79 5.288 12.949 -2.822
627 HB2 PHE 79 1HB PHE 79 5.975 10.196 -1.884
628 HB3 PHE 79 2HB PHE 79 4.480 11.071 -1.595
629 HD1 PHE 79 HD1 PHE 79 6.264 8.858 -3.790
630 HD2 PHE 79 HD2 PHE 79 3.072 11.744 -3.679
631 HE1 PHE 79 HE1 PHE 79 5.399 7.972 -5.948
632 HE2 PHE 79 HE2 PHE 79 2.191 10.857 -5.837
633 HZ PHE 79 HZ PHE 79 3.366 8.980 -6.986
634 H SER 80 H SER 80 8.112 13.463 -2.063
635 HA SER 80 HA SER 80 8.017 13.502 0.872
636 HB2 SER 80 1HB SER 80 10.153 12.889 -0.258
637 HB3 SER 80 2HB SER 80 10.153 14.461 -1.087
638 HG SER 80 HG SER 80 10.712 15.445 0.714
639 H ALA 81 H ALA 81 6.939 15.092 1.698
640 HA ALA 81 HA ALA 81 6.472 17.576 0.162
641 HB1 ALA 81 1HB ALA 81 4.681 17.981 1.783
642 HB2 ALA 81 2HB ALA 81 4.542 16.332 1.126
643 HB3 ALA 81 3HB ALA 81 5.210 16.590 2.757
644 H ASP 82 H ASP 82 9.131 17.261 1.151
645 HA ASP 82 HA ASP 82 9.371 18.700 3.654
646 HB2 ASP 82 1HB ASP 82 11.801 18.757 3.122
647 HB3 ASP 82 2HB ASP 82 11.114 17.128 3.092
648 HA PRO 83 HA PRO 83 8.695 22.566 1.920
649 HB2 PRO 83 1HB PRO 83 9.722 24.299 3.732
650 HB3 PRO 83 2HB PRO 83 8.369 23.197 4.153
651 HG2 PRO 83 1HG PRO 83 11.308 22.834 4.599
652 HG3 PRO 83 2HG PRO 83 9.973 22.740 5.796
653 HD2 PRO 83 1HD PRO 83 10.977 20.504 4.623
654 HD3 PRO 83 2HD PRO 83 9.215 20.666 4.949
655 H PHE 84 H PHE 84 9.497 24.416 0.936
656 HA PHE 84 HA PHE 84 12.415 24.452 0.302
657 HB2 PHE 84 1HB PHE 84 11.754 24.892 -2.053
658 HB3 PHE 84 2HB PHE 84 11.202 23.310 -1.493
659 HD1 PHE 84 HD1 PHE 84 8.817 22.855 -1.099
660 HD2 PHE 84 HD2 PHE 84 10.147 26.695 -2.532
661 HE1 PHE 84 HE1 PHE 84 6.472 23.454 -1.664
662 HE2 PHE 84 HE2 PHE 84 7.809 27.296 -3.116
663 HZ PHE 84 HZ PHE 84 5.959 25.689 -2.675
664 H ASP 85 H ASP 85 10.308 25.963 1.932
665 HA ASP 85 HA ASP 85 9.870 28.037 2.676
666 HB2 ASP 85 1HB ASP 85 12.268 28.579 2.167
667 HB3 ASP 85 2HB ASP 85 11.730 29.198 0.598
668 H LEU 86 H LEU 86 7.947 28.772 2.410
669 HA LEU 86 HA LEU 86 6.633 28.648 -0.184
670 HB2 LEU 86 1HB LEU 86 4.695 29.535 1.082
671 HB3 LEU 86 2HB LEU 86 5.362 28.041 1.711
672 HG LEU 86 HG LEU 86 6.620 29.800 3.342
673 HD11 LEU 86 1HD1 LEU 86 5.420 31.760 2.344
674 HD12 LEU 86 2HD1 LEU 86 5.023 31.523 4.055
675 HD13 LEU 86 3HD1 LEU 86 3.871 31.019 2.796
676 HD21 LEU 86 1HD2 LEU 86 4.880 29.216 4.997
677 HD22 LEU 86 2HD2 LEU 86 5.337 27.814 4.012
678 HD23 LEU 86 3HD2 LEU 86 3.809 28.667 3.686
679 H GLU 87 H GLU 87 8.193 31.097 1.763
680 HA GLU 87 HA GLU 87 7.122 33.324 0.135
681 HB2 GLU 87 1HB GLU 87 9.475 33.175 2.076
682 HB3 GLU 87 2HB GLU 87 8.927 34.642 1.262
683 HG2 GLU 87 1HG GLU 87 6.744 34.423 2.429
684 HG3 GLU 87 2HG GLU 87 7.403 33.037 3.323
685 H ALA 88 H ALA 88 10.162 31.623 0.709
686 HA ALA 88 HA ALA 88 12.148 31.515 -0.387
687 HB1 ALA 88 1HB ALA 88 12.007 30.824 -2.768
688 HB2 ALA 88 2HB ALA 88 10.867 29.938 -1.723
689 HB3 ALA 88 3HB ALA 88 10.279 31.259 -2.775
690 H GLN 89 H GLN 89 11.130 34.198 0.103
691 HA GLN 89 HA GLN 89 11.550 35.882 -2.148
692 HB2 GLN 89 1HB GLN 89 11.672 37.723 -0.534
693 HB3 GLN 89 2HB GLN 89 10.303 36.659 -0.206
694 HG2 GLN 89 1HG GLN 89 11.375 35.701 1.705
695 HG3 GLN 89 2HG GLN 89 12.926 36.437 1.284
696 HE21 GLN 89 1HE2 GLN 89 10.407 38.409 3.651
697 HE22 GLN 89 2HE2 GLN 89 10.206 36.722 3.215
698 H ALA 90 H ALA 90 13.246 37.154 -2.794
699 HA ALA 90 HA ALA 90 15.893 36.657 -1.546
700 HB1 ALA 90 1HB ALA 90 15.178 36.373 -4.511
701 HB2 ALA 90 2HB ALA 90 16.839 36.412 -3.880
702 HB3 ALA 90 3HB ALA 90 15.746 35.076 -3.432
703 H LYS 91 H LYS 91 17.227 38.456 -1.619
704 HA LYS 91 HA LYS 91 16.340 40.821 -3.185
705 HB2 LYS 91 1HB LYS 91 16.952 40.718 -0.208
706 HB3 LYS 91 2HB LYS 91 16.971 42.196 -1.163
707 HG2 LYS 91 1HG LYS 91 14.569 41.702 -1.798
708 HG3 LYS 91 2HG LYS 91 14.593 40.459 -0.539
709 HD2 LYS 91 1HD LYS 91 15.272 43.392 -0.097
710 HD3 LYS 91 2HD LYS 91 13.677 42.686 0.214
711 HE2 LYS 91 1HE LYS 91 14.607 41.217 1.934
712 HE3 LYS 91 2HE LYS 91 16.255 41.778 1.558
713 HZ1 LYS 91 1HZ LYS 91 15.654 43.983 2.246
714 HZ2 LYS 91 2HZ LYS 91 15.346 42.927 3.473
715 HZ3 LYS 91 3HZ LYS 91 14.097 43.524 2.573
716 H ILE 92 H ILE 92 18.038 42.359 -3.402
717 HA ILE 92 HA ILE 92 20.769 41.549 -2.556
718 HB ILE 92 HB ILE 92 19.968 42.499 -5.371
719 HG12 ILE 92 1HG1 ILE 92 21.479 40.001 -4.487
720 HG13 ILE 92 2HG1 ILE 92 19.766 40.035 -4.910
721 HG21 ILE 92 1HG2 ILE 92 22.363 42.667 -5.894
722 HG22 ILE 92 2HG2 ILE 92 22.021 43.686 -4.489
723 HG23 ILE 92 3HG2 ILE 92 22.801 42.104 -4.270
724 HD11 ILE 92 1HD1 ILE 92 22.108 40.553 -6.786
725 HD12 ILE 92 2HD1 ILE 92 20.984 39.178 -6.803
726 HD13 ILE 92 3HD1 ILE 92 20.400 40.803 -7.228
727 H GLU 93 H GLU 93 21.380 43.284 -1.304
728 HA GLU 93 HA GLU 93 20.083 45.913 -1.857
729 HB2 GLU 93 1HB GLU 93 20.417 44.456 0.794
730 HB3 GLU 93 2HB GLU 93 19.938 46.147 0.638
731 HG2 GLU 93 1HG GLU 93 17.927 45.487 -0.629
732 HG3 GLU 93 2HG GLU 93 18.407 43.791 -0.523
733 H GLU 94 H GLU 94 21.399 47.691 -1.570
734 HA GLU 94 HA GLU 94 24.237 47.145 -0.803
735 HB2 GLU 94 1HB GLU 94 23.191 48.787 -3.140
736 HB3 GLU 94 2HB GLU 94 24.876 48.725 -2.619
737 HG2 GLU 94 1HG GLU 94 24.962 46.326 -3.143
738 HG3 GLU 94 2HG GLU 94 23.278 46.390 -3.700
739 H ASP 95 H ASP 95 25.425 48.965 -0.089
740 HA ASP 95 HA ASP 95 23.896 51.468 0.452
741 HB2 ASP 95 1HB ASP 95 24.068 50.139 2.573
742 HB3 ASP 95 2HB ASP 95 25.829 50.149 2.404
743 H ILE 96 H ILE 96 24.917 52.074 -1.548
744 HA ILE 96 HA ILE 96 27.834 52.062 -1.722
745 HB ILE 96 HB ILE 96 25.877 53.420 -3.648
746 HG12 ILE 96 1HG1 ILE 96 26.968 50.571 -3.750
747 HG13 ILE 96 2HG1 ILE 96 25.315 50.997 -3.307
748 HG21 ILE 96 1HG2 ILE 96 28.717 52.309 -4.088
749 HG22 ILE 96 2HG2 ILE 96 27.728 53.179 -5.285
750 HG23 ILE 96 3HG2 ILE 96 28.332 54.032 -3.859
751 HD11 ILE 96 1HD1 ILE 96 25.286 50.250 -5.584
752 HD12 ILE 96 2HD1 ILE 96 25.005 52.006 -5.596
753 HD13 ILE 96 3HD1 ILE 96 26.602 51.350 -6.036
754 H ARG 97 H ARG 97 27.685 53.194 0.415
755 HA ARG 97 HA ARG 97 26.965 55.988 0.493
756 HB2 ARG 97 1HB ARG 97 27.422 53.887 2.265
757 HB3 ARG 97 2HB ARG 97 28.744 55.001 2.613
758 HG2 ARG 97 1HG ARG 97 27.137 56.796 3.051
759 HG3 ARG 97 2HG ARG 97 25.792 55.708 2.620
760 HD2 ARG 97 1HD ARG 97 26.493 54.162 4.424
761 HD3 ARG 97 2HD ARG 97 27.789 55.278 4.870
762 HE ARG 97 HE ARG 97 26.089 56.910 5.521
763 HH11 ARG 97 1HH1 ARG 97 24.889 53.584 5.118
764 HH12 ARG 97 2HH1 ARG 97 23.542 53.880 6.189
765 HH21 ARG 97 1HH2 ARG 97 24.329 57.175 6.831
766 HH22 ARG 97 2HH2 ARG 97 23.223 55.861 7.117
767 H GLN 98 H GLN 98 29.303 54.946 -1.219
768 HA GLN 98 HA GLN 98 31.056 57.261 -0.784
769 HB2 GLN 98 1HB GLN 98 31.935 55.367 0.708
770 HB3 GLN 98 2HB GLN 98 32.318 54.473 -0.764
771 HG2 GLN 98 1HG GLN 98 33.834 56.312 -1.500
772 HG3 GLN 98 2HG GLN 98 33.344 57.289 -0.113
773 HE21 GLN 98 1HE2 GLN 98 35.669 55.913 2.036
774 HE22 GLN 98 2HE2 GLN 98 34.543 57.194 1.663
775 HXT GLN 98 HO GLN 98 30.996 55.246 -4.108
Start of MODEL 24
1 H1 SER 1 1H SER 1 26.135 46.330 -3.046
2 H2 SER 1 2H SER 1 26.810 45.909 -4.391
3 H3 SER 1 3H SER 1 27.395 45.321 -2.994
4 HA SER 1 HA SER 1 25.972 43.931 -4.774
5 HB2 SER 1 1HB SER 1 26.237 43.215 -1.837
6 HB3 SER 1 2HB SER 1 26.408 42.159 -3.269
7 HG SER 1 HG SER 1 28.458 42.645 -3.203
8 H GLN 2 H GLN 2 24.681 46.008 -2.581
9 HA GLN 2 HA GLN 2 22.282 44.754 -1.736
10 HB2 GLN 2 1HB GLN 2 21.375 47.085 -1.530
11 HB3 GLN 2 2HB GLN 2 22.929 46.817 -0.731
12 HG2 GLN 2 1HG GLN 2 24.107 47.949 -2.576
13 HG3 GLN 2 2HG GLN 2 22.572 48.162 -3.429
14 HE21 GLN 2 1HE2 GLN 2 21.458 50.850 -1.461
15 HE22 GLN 2 2HE2 GLN 2 20.960 49.547 -2.525
16 H GLN 3 H GLN 3 23.019 46.295 -4.861
17 HA GLN 3 HA GLN 3 20.222 45.789 -5.712
18 HB2 GLN 3 1HB GLN 3 22.451 47.164 -7.239
19 HB3 GLN 3 2HB GLN 3 20.752 47.084 -7.693
20 HG2 GLN 3 1HG GLN 3 22.028 48.669 -5.456
21 HG3 GLN 3 2HG GLN 3 21.096 49.265 -6.823
22 HE21 GLN 3 1HE2 GLN 3 17.940 48.160 -5.303
23 HE22 GLN 3 2HE2 GLN 3 18.773 47.992 -6.829
24 H SER 4 H SER 4 23.072 44.049 -5.602
25 HA SER 4 HA SER 4 23.019 42.960 -8.297
26 HB2 SER 4 1HB SER 4 24.291 41.826 -5.773
27 HB3 SER 4 2HB SER 4 24.625 41.323 -7.441
28 HG SER 4 HG SER 4 26.197 42.756 -6.914
29 H HIS 5 H HIS 5 21.638 42.124 -5.145
30 HA HIS 5 HA HIS 5 20.413 39.704 -6.355
31 HB2 HIS 5 1HB HIS 5 19.908 38.953 -4.192
32 HB3 HIS 5 2HB HIS 5 21.529 39.629 -4.048
33 HD1 HIS 5 HD1 HIS 5 21.637 42.092 -2.830
34 HD2 HIS 5 HD2 HIS 5 18.024 40.018 -2.561
35 HE1 HIS 5 HE1 HIS 5 20.280 43.198 -1.006
36 H SER 6 H SER 6 19.641 42.809 -4.856
37 HA SER 6 HA SER 6 17.901 44.189 -4.907
38 HB2 SER 6 1HB SER 6 18.130 43.300 -7.469
39 HB3 SER 6 2HB SER 6 16.408 42.990 -7.132
40 HG SER 6 HG SER 6 16.207 45.152 -6.486
41 H SER 7 H SER 7 16.771 40.798 -5.060
42 HA SER 7 HA SER 7 14.756 41.491 -3.005
43 HB2 SER 7 1HB SER 7 12.955 40.337 -4.297
44 HB3 SER 7 2HB SER 7 13.513 41.827 -5.091
45 HG SER 7 HG SER 7 14.482 39.221 -5.720
46 HA PRO 8 HA PRO 8 15.954 37.349 -1.880
47 HB2 PRO 8 1HB PRO 8 14.062 36.622 -0.118
48 HB3 PRO 8 2HB PRO 8 15.146 38.012 0.233
49 HG2 PRO 8 1HG PRO 8 12.362 38.029 -0.924
50 HG3 PRO 8 2HG PRO 8 13.001 38.935 0.490
51 HD2 PRO 8 1HD PRO 8 12.847 40.043 -2.001
52 HD3 PRO 8 2HD PRO 8 14.183 40.424 -0.856
53 H GLY 9 H GLY 9 15.060 35.035 -1.744
54 HA2 GLY 9 1HA GLY 9 13.066 33.697 -2.174
55 HA3 GLY 9 2HA GLY 9 12.702 34.710 -3.549
56 H GLU 10 H GLU 10 15.938 33.336 -3.048
57 HA GLU 10 HA GLU 10 15.391 31.603 -5.424
58 HB2 GLU 10 1HB GLU 10 17.323 33.275 -5.445
59 HB3 GLU 10 2HB GLU 10 18.155 32.182 -4.325
60 HG2 GLU 10 1HG GLU 10 18.264 30.431 -5.970
61 HG3 GLU 10 2HG GLU 10 16.990 31.158 -6.948
62 H ILE 11 H ILE 11 14.427 31.075 -2.728
63 HA ILE 11 HA ILE 11 15.869 29.120 -1.415
64 HB ILE 11 HB ILE 11 12.840 29.097 -1.470
65 HG12 ILE 11 1HG1 ILE 11 14.444 31.298 -0.088
66 HG13 ILE 11 2HG1 ILE 11 13.490 31.538 -1.554
67 HG21 ILE 11 1HG2 ILE 11 13.137 28.842 0.958
68 HG22 ILE 11 2HG2 ILE 11 14.024 27.618 0.040
69 HG23 ILE 11 3HG2 ILE 11 14.892 28.997 0.717
70 HD11 ILE 11 1HD1 ILE 11 12.434 30.898 1.209
71 HD12 ILE 11 2HD1 ILE 11 12.181 32.363 0.237
72 HD13 ILE 11 3HD1 ILE 11 11.434 30.831 -0.270
73 H THR 12 H THR 12 14.509 28.948 -4.343
74 HA THR 12 HA THR 12 13.481 26.214 -4.253
75 HB THR 12 HB THR 12 13.334 26.588 -6.803
76 HG1 THR 12 HG1 THR 12 13.453 28.936 -7.255
77 HG21 THR 12 1HG2 THR 12 11.405 28.081 -6.591
78 HG22 THR 12 2HG2 THR 12 11.965 28.625 -4.997
79 HG23 THR 12 3HG2 THR 12 11.427 26.946 -5.227
80 H SER 13 H SER 13 16.074 27.766 -6.212
81 HA SER 13 HA SER 13 18.001 25.697 -5.646
82 HB2 SER 13 1HB SER 13 18.071 24.666 -7.887
83 HB3 SER 13 2HB SER 13 16.480 24.386 -7.153
84 HG SER 13 HG SER 13 16.542 26.729 -8.529
85 H SER 14 H SER 14 20.017 26.226 -6.563
86 HA SER 14 HA SER 14 20.074 28.571 -8.410
87 HB2 SER 14 1HB SER 14 20.727 29.159 -6.021
88 HB3 SER 14 2HB SER 14 22.128 28.092 -6.224
89 HG SER 14 HG SER 14 21.474 30.533 -7.487
90 HA PRO 15 HA PRO 15 22.286 24.784 -9.813
91 HB2 PRO 15 1HB PRO 15 21.609 24.810 -12.469
92 HB3 PRO 15 2HB PRO 15 20.555 24.113 -11.195
93 HG2 PRO 15 1HG PRO 15 20.431 26.853 -12.445
94 HG3 PRO 15 2HG PRO 15 19.116 25.659 -12.215
95 HD2 PRO 15 1HD PRO 15 19.469 27.693 -10.481
96 HD3 PRO 15 2HD PRO 15 18.999 26.061 -9.905
97 H GLN 16 H GLN 16 22.121 27.997 -11.319
98 HA GLN 16 HA GLN 16 24.648 27.791 -12.686
99 HB2 GLN 16 1HB GLN 16 24.433 30.211 -12.949
100 HB3 GLN 16 2HB GLN 16 22.925 29.384 -13.344
101 HG2 GLN 16 1HG GLN 16 22.069 29.997 -11.032
102 HG3 GLN 16 2HG GLN 16 23.517 30.985 -10.820
103 HE21 GLN 16 1HE2 GLN 16 20.803 33.196 -12.009
104 HE22 GLN 16 2HE2 GLN 16 21.109 32.213 -10.598
105 H GLY 17 H GLY 17 23.694 28.470 -9.359
106 HA2 GLY 17 1HA GLY 17 26.190 29.752 -8.641
107 HA3 GLY 17 2HA GLY 17 24.944 29.130 -7.541
108 H LEU 18 H LEU 18 25.117 26.439 -9.024
109 HA LEU 18 HA LEU 18 27.022 25.241 -7.232
110 HB2 LEU 18 1HB LEU 18 25.827 24.084 -9.767
111 HB3 LEU 18 2HB LEU 18 26.639 23.177 -8.495
112 HG LEU 18 HG LEU 18 24.014 24.647 -8.221
113 HD11 LEU 18 1HD1 LEU 18 23.030 22.407 -8.111
114 HD12 LEU 18 2HD1 LEU 18 24.637 21.681 -8.352
115 HD13 LEU 18 3HD1 LEU 18 23.890 22.649 -9.647
116 HD21 LEU 18 1HD2 LEU 18 25.493 22.869 -6.238
117 HD22 LEU 18 2HD2 LEU 18 23.829 23.464 -6.031
118 HD23 LEU 18 3HD2 LEU 18 25.177 24.610 -6.066
119 H ASP 19 H ASP 19 27.055 26.106 -10.658
120 HA ASP 19 HA ASP 19 29.723 25.022 -11.093
121 HB2 ASP 19 1HB ASP 19 27.790 25.218 -12.774
122 HB3 ASP 19 2HB ASP 19 28.179 26.941 -12.857
123 H ASN 20 H ASN 20 28.239 28.127 -10.367
124 HA ASN 20 HA ASN 20 30.961 29.347 -10.269
125 HB2 ASN 20 1HB ASN 20 28.240 30.582 -10.825
126 HB3 ASN 20 2HB ASN 20 29.680 31.519 -10.457
127 HD21 ASN 20 1HD2 ASN 20 30.807 31.547 -13.697
128 HD22 ASN 20 2HD2 ASN 20 30.825 32.227 -12.094
129 HA PRO 21 HA PRO 21 29.433 29.236 -5.919
130 HB2 PRO 21 1HB PRO 21 31.955 28.899 -4.832
131 HB3 PRO 21 2HB PRO 21 30.933 27.549 -5.350
132 HG2 PRO 21 1HG PRO 21 33.103 28.884 -6.767
133 HG3 PRO 21 2HG PRO 21 32.800 27.147 -6.558
134 HD2 PRO 21 1HD PRO 21 32.171 28.355 -8.818
135 HD3 PRO 21 2HD PRO 21 31.092 27.106 -8.104
136 H ALA 22 H ALA 22 31.927 30.973 -7.688
137 HA ALA 22 HA ALA 22 32.504 32.968 -5.730
138 HB1 ALA 22 1HB ALA 22 33.260 34.326 -7.678
139 HB2 ALA 22 2HB ALA 22 33.882 32.662 -7.754
140 HB3 ALA 22 3HB ALA 22 32.518 33.147 -8.783
141 H LEU 23 H LEU 23 29.989 32.706 -8.236
142 HA LEU 23 HA LEU 23 28.870 35.326 -7.637
143 HB2 LEU 23 1HB LEU 23 27.724 32.996 -9.212
144 HB3 LEU 23 2HB LEU 23 27.066 34.624 -9.159
145 HG LEU 23 HG LEU 23 29.742 33.825 -10.368
146 HD11 LEU 23 1HD1 LEU 23 28.665 34.361 -12.506
147 HD12 LEU 23 2HD1 LEU 23 27.149 34.761 -11.661
148 HD13 LEU 23 3HD1 LEU 23 27.762 33.089 -11.653
149 HD21 LEU 23 1HD2 LEU 23 29.759 36.149 -11.263
150 HD22 LEU 23 2HD2 LEU 23 29.918 36.085 -9.495
151 HD23 LEU 23 3HD2 LEU 23 28.363 36.530 -10.233
152 H LEU 24 H LEU 24 28.199 31.932 -6.779
153 HA LEU 24 HA LEU 24 25.683 32.410 -5.524
154 HB2 LEU 24 1HB LEU 24 27.120 30.194 -6.032
155 HB3 LEU 24 2HB LEU 24 27.588 30.424 -4.363
156 HG LEU 24 HG LEU 24 24.848 30.040 -5.394
157 HD11 LEU 24 1HD1 LEU 24 26.330 28.227 -3.547
158 HD12 LEU 24 2HD1 LEU 24 26.295 28.014 -5.304
159 HD13 LEU 24 3HD1 LEU 24 24.793 27.906 -4.375
160 HD21 LEU 24 1HD2 LEU 24 25.587 30.543 -2.617
161 HD22 LEU 24 2HD2 LEU 24 24.046 29.831 -3.115
162 HD23 LEU 24 3HD2 LEU 24 24.482 31.462 -3.643
163 H ARG 25 H ARG 25 29.038 32.428 -4.270
164 HA ARG 25 HA ARG 25 28.439 33.078 -1.581
165 HB2 ARG 25 1HB ARG 25 30.673 32.398 -2.486
166 HB3 ARG 25 2HB ARG 25 30.773 33.946 -3.321
167 HG2 ARG 25 1HG ARG 25 30.527 34.991 -0.957
168 HG3 ARG 25 2HG ARG 25 30.940 33.375 -0.367
169 HD2 ARG 25 1HD ARG 25 32.929 34.713 -0.520
170 HD3 ARG 25 2HD ARG 25 32.994 33.441 -1.751
171 HE ARG 25 HE ARG 25 31.935 35.482 -3.167
172 HH11 ARG 25 1HH1 ARG 25 34.734 35.483 -0.993
173 HH12 ARG 25 2HH1 ARG 25 35.547 36.722 -1.920
174 HH21 ARG 25 1HH2 ARG 25 33.020 37.064 -4.265
175 HH22 ARG 25 2HH2 ARG 25 34.585 37.610 -3.725
176 H ASP 26 H ASP 26 29.049 35.227 -4.408
177 HA ASP 26 HA ASP 26 28.819 37.644 -2.933
178 HB2 ASP 26 1HB ASP 26 29.729 37.344 -5.273
179 HB3 ASP 26 2HB ASP 26 28.049 37.270 -5.842
180 H MET 27 H MET 27 26.348 35.767 -4.752
181 HA MET 27 HA MET 27 24.196 37.589 -4.329
182 HB2 MET 27 1HB MET 27 24.147 35.672 -5.928
183 HB3 MET 27 2HB MET 27 24.128 34.551 -4.559
184 HG2 MET 27 1HG MET 27 21.966 35.533 -3.817
185 HG3 MET 27 2HG MET 27 21.981 36.587 -5.241
186 HE1 MET 27 1HE MET 27 21.133 33.076 -3.782
187 HE2 MET 27 2HE MET 27 21.249 32.002 -5.195
188 HE3 MET 27 3HE MET 27 22.722 32.689 -4.485
189 H LEU 28 H LEU 28 25.247 34.686 -2.456
190 HA LEU 28 HA LEU 28 23.254 34.931 -0.440
191 HB2 LEU 28 1HB LEU 28 26.013 33.812 -0.524
192 HB3 LEU 28 2HB LEU 28 25.103 33.855 0.973
193 HG LEU 28 HG LEU 28 24.097 32.471 -1.500
194 HD11 LEU 28 1HD1 LEU 28 24.905 30.452 -0.363
195 HD12 LEU 28 2HD1 LEU 28 25.611 31.468 0.909
196 HD13 LEU 28 3HD1 LEU 28 26.219 31.581 -0.751
197 HD21 LEU 28 1HD2 LEU 28 22.391 33.095 0.208
198 HD22 LEU 28 2HD2 LEU 28 23.321 32.226 1.437
199 HD23 LEU 28 3HD2 LEU 28 22.599 31.344 0.067
200 H LEU 29 H LEU 29 26.548 36.387 -0.565
201 HA LEU 29 HA LEU 29 26.439 37.472 2.096
202 HB2 LEU 29 1HB LEU 29 27.940 38.285 -0.414
203 HB3 LEU 29 2HB LEU 29 28.113 39.163 1.100
204 HG LEU 29 HG LEU 29 28.748 36.227 0.814
205 HD11 LEU 29 1HD1 LEU 29 30.601 38.626 0.664
206 HD12 LEU 29 2HD1 LEU 29 30.174 37.538 -0.679
207 HD13 LEU 29 3HD1 LEU 29 31.107 36.923 0.700
208 HD21 LEU 29 1HD2 LEU 29 28.323 36.918 3.122
209 HD22 LEU 29 2HD2 LEU 29 29.470 38.261 2.952
210 HD23 LEU 29 3HD2 LEU 29 30.046 36.577 2.888
211 H ALA 30 H ALA 30 25.298 38.602 -1.048
212 HA ALA 30 HA ALA 30 24.632 41.253 -0.129
213 HB1 ALA 30 1HB ALA 30 23.550 41.442 -2.299
214 HB2 ALA 30 2HB ALA 30 25.114 40.620 -2.497
215 HB3 ALA 30 3HB ALA 30 23.606 39.685 -2.529
216 H ASN 31 H ASN 31 22.963 38.144 -0.072
217 HA ASN 31 HA ASN 31 20.359 39.552 0.193
218 HB2 ASN 31 1HB ASN 31 20.815 37.830 -1.615
219 HB3 ASN 31 2HB ASN 31 20.835 36.610 -0.349
220 HD21 ASN 31 1HD2 ASN 31 17.440 37.236 -1.956
221 HD22 ASN 31 2HD2 ASN 31 19.029 37.221 -2.665
222 HA PRO 32 HA PRO 32 20.928 38.321 4.442
223 HB2 PRO 32 1HB PRO 32 18.833 39.662 5.578
224 HB3 PRO 32 2HB PRO 32 20.362 40.458 5.078
225 HG2 PRO 32 1HG PRO 32 17.783 40.244 3.538
226 HG3 PRO 32 2HG PRO 32 18.757 41.704 3.912
227 HD2 PRO 32 1HD PRO 32 19.005 40.474 1.556
228 HD3 PRO 32 2HD PRO 32 20.456 41.104 2.414
229 H HIS 33 H HIS 33 17.947 37.827 2.582
230 HA HIS 33 HA HIS 33 16.715 36.136 4.633
231 HB2 HIS 33 1HB HIS 33 15.419 37.382 2.895
232 HB3 HIS 33 2HB HIS 33 16.175 36.389 1.645
233 HD1 HIS 33 HD1 HIS 33 13.445 36.317 4.233
234 HD2 HIS 33 HD2 HIS 33 15.286 33.709 1.532
235 HE1 HIS 33 HE1 HIS 33 11.970 34.272 4.059
236 H GLU 34 H GLU 34 18.497 35.702 1.605
237 HA GLU 34 HA GLU 34 18.229 32.850 1.502
238 HB2 GLU 34 1HB GLU 34 19.481 35.051 0.053
239 HB3 GLU 34 2HB GLU 34 20.434 33.584 -0.022
240 HG2 GLU 34 1HG GLU 34 18.928 33.792 -1.930
241 HG3 GLU 34 2HG GLU 34 18.569 32.369 -0.951
242 H LEU 35 H LEU 35 20.640 35.095 2.821
243 HA LEU 35 HA LEU 35 22.546 32.995 3.397
244 HB2 LEU 35 1HB LEU 35 23.896 34.627 4.100
245 HB3 LEU 35 2HB LEU 35 22.842 35.462 3.025
246 HG LEU 35 HG LEU 35 21.668 36.486 4.932
247 HD11 LEU 35 1HD1 LEU 35 22.072 35.139 6.822
248 HD12 LEU 35 2HD1 LEU 35 22.993 36.620 7.077
249 HD13 LEU 35 3HD1 LEU 35 23.832 35.137 6.546
250 HD21 LEU 35 1HD2 LEU 35 23.582 38.035 5.298
251 HD22 LEU 35 2HD2 LEU 35 23.420 37.529 3.604
252 HD23 LEU 35 3HD2 LEU 35 24.666 36.795 4.627
253 H SER 36 H SER 36 19.747 34.322 4.993
254 HA SER 36 HA SER 36 20.431 33.423 7.637
255 HB2 SER 36 1HB SER 36 18.832 35.277 7.199
256 HB3 SER 36 2HB SER 36 17.681 34.096 6.556
257 HG SER 36 HG SER 36 17.938 33.022 8.682
258 H LEU 37 H LEU 37 18.336 32.106 5.010
259 HA LEU 37 HA LEU 37 17.483 29.870 6.629
260 HB2 LEU 37 1HB LEU 37 16.677 28.906 4.635
261 HB3 LEU 37 2HB LEU 37 16.426 30.609 4.625
262 HG LEU 37 HG LEU 37 18.570 30.649 3.125
263 HD11 LEU 37 1HD1 LEU 37 18.573 28.774 1.593
264 HD12 LEU 37 2HD1 LEU 37 17.245 27.997 2.503
265 HD13 LEU 37 3HD1 LEU 37 18.846 28.196 3.250
266 HD21 LEU 37 1HD2 LEU 37 15.707 30.072 2.333
267 HD22 LEU 37 2HD2 LEU 37 16.962 30.625 1.195
268 HD23 LEU 37 3HD2 LEU 37 16.470 31.658 2.550
269 H LEU 38 H LEU 38 20.290 30.597 4.731
270 HA LEU 38 HA LEU 38 21.187 27.913 4.494
271 HB2 LEU 38 1HB LEU 38 21.787 29.874 3.141
272 HB3 LEU 38 2HB LEU 38 22.746 30.498 4.498
273 HG LEU 38 HG LEU 38 24.092 28.384 4.501
274 HD11 LEU 38 1HD1 LEU 38 22.589 26.896 3.329
275 HD12 LEU 38 2HD1 LEU 38 24.084 27.051 2.393
276 HD13 LEU 38 3HD1 LEU 38 22.623 27.930 1.883
277 HD21 LEU 38 1HD2 LEU 38 24.898 30.461 3.479
278 HD22 LEU 38 2HD2 LEU 38 24.153 29.975 1.939
279 HD23 LEU 38 3HD2 LEU 38 25.490 29.022 2.623
280 H LYS 39 H LYS 39 21.961 30.490 6.877
281 HA LYS 39 HA LYS 39 23.720 28.709 8.362
282 HB2 LYS 39 1HB LYS 39 23.514 30.357 10.221
283 HB3 LYS 39 2HB LYS 39 24.108 31.017 8.701
284 HG2 LYS 39 1HG LYS 39 22.154 32.242 8.308
285 HG3 LYS 39 2HG LYS 39 21.178 31.233 9.361
286 HD2 LYS 39 1HD LYS 39 21.437 33.298 10.464
287 HD3 LYS 39 2HD LYS 39 22.482 32.144 11.312
288 HE2 LYS 39 1HE LYS 39 24.436 33.005 10.041
289 HE3 LYS 39 2HE LYS 39 23.373 34.153 9.186
290 HZ1 LYS 39 1HZ LYS 39 23.825 34.082 12.120
291 HZ2 LYS 39 2HZ LYS 39 22.840 35.146 11.330
292 HZ3 LYS 39 3HZ LYS 39 24.476 35.187 11.083
293 H GLU 40 H GLU 40 20.251 29.193 8.352
294 HA GLU 40 HA GLU 40 19.828 27.755 10.835
295 HB2 GLU 40 1HB GLU 40 18.061 28.404 8.455
296 HB3 GLU 40 2HB GLU 40 17.480 27.499 9.852
297 HG2 GLU 40 1HG GLU 40 18.616 30.315 9.954
298 HG3 GLU 40 2HG GLU 40 16.892 29.909 9.933
299 H ARG 41 H ARG 41 19.501 26.819 7.335
300 HA ARG 41 HA ARG 41 19.086 24.028 8.228
301 HB2 ARG 41 1HB ARG 41 19.154 25.250 5.456
302 HB3 ARG 41 2HB ARG 41 18.696 23.576 5.848
303 HG2 ARG 41 1HG ARG 41 17.001 24.596 7.445
304 HG3 ARG 41 2HG ARG 41 17.288 26.132 6.611
305 HD2 ARG 41 1HD ARG 41 16.535 25.206 4.509
306 HD3 ARG 41 2HD ARG 41 16.494 23.565 5.178
307 HE ARG 41 HE ARG 41 14.509 25.684 5.550
308 HH11 ARG 41 1HH1 ARG 41 15.660 22.567 6.732
309 HH12 ARG 41 2HH1 ARG 41 14.139 22.184 7.505
310 HH21 ARG 41 1HH2 ARG 41 12.598 25.133 6.562
311 HH22 ARG 41 2HH2 ARG 41 12.459 23.626 7.418
312 H ASN 42 H ASN 42 21.787 25.766 6.815
313 HA ASN 42 HA ASN 42 23.281 23.170 6.775
314 HB2 ASN 42 1HB ASN 42 22.505 23.965 4.467
315 HB3 ASN 42 2HB ASN 42 23.646 25.282 4.639
316 HD21 ASN 42 1HD2 ASN 42 25.350 22.583 2.823
317 HD22 ASN 42 2HD2 ASN 42 24.085 23.748 2.562
318 HA PRO 43 HA PRO 43 25.455 26.594 9.002
319 HB2 PRO 43 1HB PRO 43 26.612 24.970 10.959
320 HB3 PRO 43 2HB PRO 43 25.090 25.902 11.121
321 HG2 PRO 43 1HG PRO 43 25.471 23.014 10.416
322 HG3 PRO 43 2HG PRO 43 24.293 23.771 11.531
323 HD2 PRO 43 1HD PRO 43 23.579 23.014 9.063
324 HD3 PRO 43 2HD PRO 43 22.943 24.535 9.777
325 HA PRO 44 HA PRO 44 29.576 24.590 8.209
326 HB2 PRO 44 1HB PRO 44 29.887 22.566 6.413
327 HB3 PRO 44 2HB PRO 44 29.676 22.284 8.169
328 HG2 PRO 44 1HG PRO 44 27.612 22.220 5.992
329 HG3 PRO 44 2HG PRO 44 27.966 20.993 7.250
330 HD2 PRO 44 1HD PRO 44 25.972 22.749 7.588
331 HD3 PRO 44 2HD PRO 44 27.034 22.303 8.962
332 H LEU 45 H LEU 45 27.166 24.534 5.494
333 HA LEU 45 HA LEU 45 29.146 25.694 3.666
334 HB2 LEU 45 1HB LEU 45 27.224 24.380 2.856
335 HB3 LEU 45 2HB LEU 45 26.137 25.644 3.443
336 HG LEU 45 HG LEU 45 27.024 27.233 1.832
337 HD11 LEU 45 1HD1 LEU 45 28.678 26.582 0.090
338 HD12 LEU 45 2HD1 LEU 45 28.947 25.045 0.936
339 HD13 LEU 45 3HD1 LEU 45 29.390 26.582 1.711
340 HD21 LEU 45 1HD2 LEU 45 26.247 26.173 -0.222
341 HD22 LEU 45 2HD2 LEU 45 25.239 25.649 1.137
342 HD23 LEU 45 3HD2 LEU 45 26.485 24.557 0.487
343 H ALA 46 H ALA 46 26.638 26.790 5.919
344 HA ALA 46 HA ALA 46 26.690 29.524 5.132
345 HB1 ALA 46 1HB ALA 46 26.183 28.398 7.885
346 HB2 ALA 46 2HB ALA 46 25.647 29.968 7.232
347 HB3 ALA 46 3HB ALA 46 24.999 28.451 6.560
348 H GLU 47 H GLU 47 28.602 27.879 7.760
349 HA GLU 47 HA GLU 47 29.886 30.277 8.601
350 HB2 GLU 47 1HB GLU 47 31.518 28.921 9.700
351 HB3 GLU 47 2HB GLU 47 29.940 28.145 9.879
352 HG2 GLU 47 1HG GLU 47 30.506 26.531 8.155
353 HG3 GLU 47 2HG GLU 47 32.044 27.349 7.845
354 H ALA 48 H ALA 48 30.545 28.139 5.906
355 HA ALA 48 HA ALA 48 33.094 29.105 5.229
356 HB1 ALA 48 1HB ALA 48 31.830 27.018 4.382
357 HB2 ALA 48 2HB ALA 48 31.030 28.130 3.245
358 HB3 ALA 48 3HB ALA 48 32.789 27.922 3.201
359 H LEU 49 H LEU 49 29.831 30.147 4.362
360 HA LEU 49 HA LEU 49 30.607 32.274 2.594
361 HB2 LEU 49 1HB LEU 49 28.331 31.273 2.702
362 HB3 LEU 49 2HB LEU 49 28.144 31.910 4.328
363 HG LEU 49 HG LEU 49 28.507 34.235 3.295
364 HD11 LEU 49 1HD1 LEU 49 29.306 33.571 1.135
365 HD12 LEU 49 2HD1 LEU 49 27.729 34.344 0.927
366 HD13 LEU 49 3HD1 LEU 49 27.859 32.578 0.842
367 HD21 LEU 49 1HD2 LEU 49 26.424 33.433 4.263
368 HD22 LEU 49 2HD2 LEU 49 26.008 32.638 2.734
369 HD23 LEU 49 3HD2 LEU 49 26.129 34.412 2.815
370 H LEU 50 H LEU 50 29.954 32.095 6.119
371 HA LEU 50 HA LEU 50 29.809 34.904 6.524
372 HB2 LEU 50 1HB LEU 50 30.792 32.863 8.539
373 HB3 LEU 50 2HB LEU 50 30.131 34.450 8.879
374 HG LEU 50 HG LEU 50 28.704 31.966 8.047
375 HD11 LEU 50 1HD1 LEU 50 28.276 33.878 10.322
376 HD12 LEU 50 2HD1 LEU 50 29.121 32.319 10.389
377 HD13 LEU 50 3HD1 LEU 50 27.393 32.359 10.026
378 HD21 LEU 50 1HD2 LEU 50 27.561 34.758 7.900
379 HD22 LEU 50 2HD2 LEU 50 26.588 33.256 7.915
380 HD23 LEU 50 3HD2 LEU 50 27.710 33.562 6.581
381 H SER 51 H SER 51 32.584 32.734 6.477
382 HA SER 51 HA SER 51 34.466 34.694 7.490
383 HB2 SER 51 1HB SER 51 34.736 32.165 5.861
384 HB3 SER 51 2HB SER 51 36.096 33.057 6.564
385 HG SER 51 HG SER 51 34.363 32.737 8.500
386 H GLY 52 H GLY 52 32.905 34.177 4.427
387 HA2 GLY 52 1HA GLY 52 32.999 35.581 2.592
388 HA3 GLY 52 2HA GLY 52 34.386 36.429 3.297
389 H ASP 53 H ASP 53 35.558 33.540 3.649
390 HA ASP 53 HA ASP 53 37.267 33.729 1.402
391 HB2 ASP 53 1HB ASP 53 37.268 32.319 3.800
392 HB3 ASP 53 2HB ASP 53 37.241 31.091 2.535
393 H LEU 54 H LEU 54 36.844 33.323 -0.648
394 HA LEU 54 HA LEU 54 34.597 31.714 -1.451
395 HB2 LEU 54 1HB LEU 54 35.607 33.488 -2.857
396 HB3 LEU 54 2HB LEU 54 37.065 32.525 -3.030
397 HG LEU 54 HG LEU 54 35.349 32.624 -4.928
398 HD11 LEU 54 1HD1 LEU 54 35.949 30.469 -5.789
399 HD12 LEU 54 2HD1 LEU 54 36.349 29.891 -4.159
400 HD13 LEU 54 3HD1 LEU 54 37.329 31.164 -4.918
401 HD21 LEU 54 1HD2 LEU 54 33.320 32.057 -3.655
402 HD22 LEU 54 2HD2 LEU 54 33.975 30.434 -3.358
403 HD23 LEU 54 3HD2 LEU 54 33.609 30.944 -5.010
404 H GLU 55 H GLU 55 38.039 31.125 -0.865
405 HA GLU 55 HA GLU 55 38.263 28.604 -2.082
406 HB2 GLU 55 1HB GLU 55 39.504 29.412 0.577
407 HB3 GLU 55 2HB GLU 55 40.086 28.175 -0.553
408 HG2 GLU 55 1HG GLU 55 40.115 30.179 -2.222
409 HG3 GLU 55 2HG GLU 55 40.167 31.160 -0.764
410 H LYS 56 H LYS 56 37.250 29.402 1.243
411 HA LYS 56 HA LYS 56 36.668 26.600 1.760
412 HB2 LYS 56 1HB LYS 56 36.006 27.181 3.935
413 HB3 LYS 56 2HB LYS 56 37.400 28.207 3.508
414 HG2 LYS 56 1HG LYS 56 35.685 29.980 3.023
415 HG3 LYS 56 2HG LYS 56 34.563 28.959 3.874
416 HD2 LYS 56 1HD LYS 56 37.252 29.628 5.080
417 HD3 LYS 56 2HD LYS 56 35.922 30.761 5.195
418 HE2 LYS 56 1HE LYS 56 34.536 29.042 6.341
419 HE3 LYS 56 2HE LYS 56 35.883 27.902 6.236
420 HZ1 LYS 56 1HZ LYS 56 35.842 30.454 7.741
421 HZ2 LYS 56 2HZ LYS 56 37.159 29.454 7.624
422 HZ3 LYS 56 3HZ LYS 56 35.790 28.944 8.392
423 H PHE 57 H PHE 57 34.656 29.417 0.818
424 HA PHE 57 HA PHE 57 32.157 28.077 1.134
425 HB2 PHE 57 1HB PHE 57 32.306 30.489 0.696
426 HB3 PHE 57 2HB PHE 57 32.963 30.160 -0.913
427 HD1 PHE 57 HD1 PHE 57 29.891 29.887 1.185
428 HD2 PHE 57 HD2 PHE 57 31.561 29.567 -2.765
429 HE1 PHE 57 HE1 PHE 57 27.592 29.785 0.221
430 HE2 PHE 57 HE2 PHE 57 29.271 29.452 -3.735
431 HZ PHE 57 HZ PHE 57 27.272 29.582 -2.299
432 H SER 58 H SER 58 34.346 28.224 -1.707
433 HA SER 58 HA SER 58 32.672 26.619 -3.378
434 HB2 SER 58 1HB SER 58 34.475 28.114 -4.203
435 HB3 SER 58 2HB SER 58 35.686 27.071 -3.434
436 HG SER 58 HG SER 58 35.493 26.491 -5.585
437 H ARG 59 H ARG 59 35.431 25.829 -1.217
438 HA ARG 59 HA ARG 59 35.580 23.101 -2.065
439 HB2 ARG 59 1HB ARG 59 37.337 24.293 -0.791
440 HB3 ARG 59 2HB ARG 59 36.286 24.299 0.632
441 HG2 ARG 59 1HG ARG 59 36.511 21.601 -0.453
442 HG3 ARG 59 2HG ARG 59 38.130 22.278 -0.240
443 HD2 ARG 59 1HD ARG 59 36.065 22.409 1.960
444 HD3 ARG 59 2HD ARG 59 37.069 20.967 1.705
445 HE ARG 59 HE ARG 59 38.636 23.402 1.803
446 HH11 ARG 59 1HH1 ARG 59 37.133 20.944 3.840
447 HH12 ARG 59 2HH1 ARG 59 38.234 21.225 5.162
448 HH21 ARG 59 1HH2 ARG 59 40.007 23.712 3.526
449 HH22 ARG 59 2HH2 ARG 59 39.836 22.763 4.978
450 H VAL 60 H VAL 60 33.757 24.647 0.636
451 HA VAL 60 HA VAL 60 32.692 22.123 1.528
452 HB VAL 60 HB VAL 60 31.624 24.952 1.968
453 HG11 VAL 60 1HG1 VAL 60 30.463 23.852 3.939
454 HG12 VAL 60 2HG1 VAL 60 29.824 23.376 2.355
455 HG13 VAL 60 3HG1 VAL 60 30.898 22.274 3.245
456 HG21 VAL 60 1HG2 VAL 60 32.682 24.720 4.201
457 HG22 VAL 60 2HG2 VAL 60 33.296 23.114 3.759
458 HG23 VAL 60 3HG2 VAL 60 33.901 24.560 2.924
459 H LEU 61 H LEU 61 31.694 24.529 -0.919
460 HA LEU 61 HA LEU 61 29.104 23.515 -1.435
461 HB2 LEU 61 1HB LEU 61 30.517 25.512 -2.489
462 HB3 LEU 61 2HB LEU 61 30.905 24.307 -3.705
463 HG LEU 61 HG LEU 61 28.256 23.999 -3.725
464 HD11 LEU 61 1HD1 LEU 61 27.150 26.142 -3.349
465 HD12 LEU 61 2HD1 LEU 61 28.706 26.881 -2.871
466 HD13 LEU 61 3HD1 LEU 61 27.956 25.610 -1.861
467 HD21 LEU 61 1HD2 LEU 61 29.386 26.479 -4.997
468 HD22 LEU 61 2HD2 LEU 61 28.148 25.393 -5.611
469 HD23 LEU 61 3HD2 LEU 61 29.840 24.858 -5.573
470 H VAL 62 H VAL 62 32.292 22.467 -2.742
471 HA VAL 62 HA VAL 62 31.193 20.430 -4.445
472 HB VAL 62 HB VAL 62 33.965 20.627 -3.159
473 HG11 VAL 62 1HG1 VAL 62 32.955 18.849 -5.423
474 HG12 VAL 62 2HG1 VAL 62 34.673 19.102 -5.025
475 HG13 VAL 62 3HG1 VAL 62 33.601 18.321 -3.849
476 HG21 VAL 62 1HG2 VAL 62 34.656 21.479 -5.351
477 HG22 VAL 62 2HG2 VAL 62 32.977 21.384 -5.924
478 HG23 VAL 62 3HG2 VAL 62 33.418 22.513 -4.630
479 H GLU 63 H GLU 63 32.448 20.358 -1.084
480 HA GLU 63 HA GLU 63 32.118 17.531 -0.750
481 HB2 GLU 63 1HB GLU 63 31.992 19.765 1.311
482 HB3 GLU 63 2HB GLU 63 32.055 18.039 1.694
483 HG2 GLU 63 1HG GLU 63 34.185 19.684 0.294
484 HG3 GLU 63 2HG GLU 63 34.275 18.986 1.914
485 H GLN 64 H GLN 64 29.826 20.240 -0.245
486 HA GLN 64 HA GLN 64 27.726 18.582 0.843
487 HB2 GLN 64 1HB GLN 64 27.701 21.256 -0.595
488 HB3 GLN 64 2HB GLN 64 26.257 20.510 0.096
489 HG2 GLN 64 1HG GLN 64 28.740 21.189 1.714
490 HG3 GLN 64 2HG GLN 64 27.355 22.267 1.540
491 HE21 GLN 64 1HE2 GLN 64 27.317 19.661 4.480
492 HE22 GLN 64 2HE2 GLN 64 28.733 20.247 3.643
493 H GLN 65 H GLN 65 28.592 19.608 -2.489
494 HA GLN 65 HA GLN 65 26.310 18.391 -3.743
495 HB2 GLN 65 1HB GLN 65 29.129 18.967 -4.727
496 HB3 GLN 65 2HB GLN 65 27.885 18.248 -5.761
497 HG2 GLN 65 1HG GLN 65 26.517 20.226 -5.611
498 HG3 GLN 65 2HG GLN 65 27.577 20.934 -4.390
499 HE21 GLN 65 1HE2 GLN 65 29.031 22.697 -7.058
500 HE22 GLN 65 2HE2 GLN 65 28.032 22.764 -5.622
501 H GLN 66 H GLN 66 29.557 17.157 -2.865
502 HA GLN 66 HA GLN 66 29.190 14.601 -4.088
503 HB2 GLN 66 1HB GLN 66 30.960 15.587 -1.837
504 HB3 GLN 66 2HB GLN 66 30.930 13.893 -2.333
505 HG2 GLN 66 1HG GLN 66 31.382 14.819 -4.722
506 HG3 GLN 66 2HG GLN 66 31.923 16.272 -3.870
507 HE21 GLN 66 1HE2 GLN 66 34.967 14.897 -2.887
508 HE22 GLN 66 2HE2 GLN 66 33.943 16.304 -3.014
509 H ASP 67 H ASP 67 28.576 15.726 -0.711
510 HA ASP 67 HA ASP 67 27.819 13.117 0.228
511 HB2 ASP 67 1HB ASP 67 28.374 15.079 1.694
512 HB3 ASP 67 2HB ASP 67 26.830 15.805 1.221
513 H ARG 68 H ARG 68 25.888 15.876 -1.060
514 HA ARG 68 HA ARG 68 23.412 14.535 -0.579
515 HB2 ARG 68 1HB ARG 68 22.429 16.331 -1.422
516 HB3 ARG 68 2HB ARG 68 24.026 17.013 -1.197
517 HG2 ARG 68 1HG ARG 68 24.493 16.823 -3.569
518 HG3 ARG 68 2HG ARG 68 22.952 15.982 -3.831
519 HD2 ARG 68 1HD ARG 68 21.778 17.935 -2.860
520 HD3 ARG 68 2HD ARG 68 23.320 18.799 -2.785
521 HE ARG 68 HE ARG 68 23.137 18.025 -5.419
522 HH11 ARG 68 1HH1 ARG 68 20.917 19.750 -3.276
523 HH12 ARG 68 2HH1 ARG 68 20.232 20.683 -4.585
524 HH21 ARG 68 1HH2 ARG 68 22.213 19.233 -7.037
525 HH22 ARG 68 2HH2 ARG 68 20.959 20.384 -6.681
526 H ALA 69 H ALA 69 25.653 14.486 -3.256
527 HA ALA 69 HA ALA 69 24.073 12.996 -5.099
528 HB1 ALA 69 1HB ALA 69 26.207 14.037 -5.714
529 HB2 ALA 69 2HB ALA 69 27.081 12.885 -4.689
530 HB3 ALA 69 3HB ALA 69 26.196 12.301 -6.115
531 H ARG 70 H ARG 70 25.661 11.946 -2.117
532 HA ARG 70 HA ARG 70 25.494 9.095 -2.775
533 HB2 ARG 70 1HB ARG 70 25.562 10.350 -0.005
534 HB3 ARG 70 2HB ARG 70 26.010 8.699 -0.448
535 HG2 ARG 70 1HG ARG 70 27.465 11.222 -1.237
536 HG3 ARG 70 2HG ARG 70 27.964 10.112 0.034
537 HD2 ARG 70 1HD ARG 70 28.998 8.749 -1.432
538 HD3 ARG 70 2HD ARG 70 27.600 8.723 -2.514
539 HE ARG 70 HE ARG 70 28.507 10.463 -3.778
540 HH11 ARG 70 1HH1 ARG 70 30.534 10.022 -0.914
541 HH12 ARG 70 2HH1 ARG 70 31.818 11.005 -1.568
542 HH21 ARG 70 1HH2 ARG 70 30.198 11.685 -4.535
543 HH22 ARG 70 2HH2 ARG 70 31.639 11.930 -3.575
544 H ARG 71 H ARG 71 23.513 11.502 -1.057
545 HA ARG 71 HA ARG 71 21.477 9.616 -0.204
546 HB2 ARG 71 1HB ARG 71 20.919 12.536 -0.749
547 HB3 ARG 71 2HB ARG 71 20.230 11.496 0.494
548 HG2 ARG 71 1HG ARG 71 23.051 12.628 0.441
549 HG3 ARG 71 2HG ARG 71 21.726 13.208 1.449
550 HD2 ARG 71 1HD ARG 71 21.684 11.142 2.679
551 HD3 ARG 71 2HD ARG 71 22.844 10.397 1.557
552 HE ARG 71 HE ARG 71 24.154 12.671 2.495
553 HH11 ARG 71 1HH1 ARG 71 22.755 9.817 4.063
554 HH12 ARG 71 2HH1 ARG 71 23.917 9.862 5.362
555 HH21 ARG 71 1HH2 ARG 71 25.602 12.644 4.128
556 HH22 ARG 71 2HH2 ARG 71 25.493 11.453 5.406
557 H GLU 72 H GLU 72 22.088 11.506 -3.084
558 HA GLU 72 HA GLU 72 19.478 11.497 -4.195
559 HB2 GLU 72 1HB GLU 72 22.225 11.473 -5.453
560 HB3 GLU 72 2HB GLU 72 20.768 11.467 -6.446
561 HG2 GLU 72 1HG GLU 72 21.061 13.556 -4.310
562 HG3 GLU 72 2HG GLU 72 21.967 13.723 -5.824
563 H GLN 73 H GLN 73 21.975 8.974 -4.199
564 HA GLN 73 HA GLN 73 20.834 7.291 -6.153
565 HB2 GLN 73 1HB GLN 73 22.456 6.638 -3.673
566 HB3 GLN 73 2HB GLN 73 22.095 5.475 -4.958
567 HG2 GLN 73 1HG GLN 73 23.373 6.669 -6.557
568 HG3 GLN 73 2HG GLN 73 23.447 8.119 -5.545
569 HE21 GLN 73 1HE2 GLN 73 26.561 7.268 -4.390
570 HE22 GLN 73 2HE2 GLN 73 25.423 8.480 -4.944
571 H GLU 74 H GLU 74 20.138 7.422 -2.613
572 HA GLU 74 HA GLU 74 18.170 5.266 -2.897
573 HB2 GLU 74 1HB GLU 74 17.621 5.806 -0.512
574 HB3 GLU 74 2HB GLU 74 19.288 5.323 -0.818
575 HG2 GLU 74 1HG GLU 74 19.995 7.668 -0.731
576 HG3 GLU 74 2HG GLU 74 18.331 8.168 -0.424
577 H ARG 75 H ARG 75 18.116 8.830 -2.886
578 HA ARG 75 HA ARG 75 15.262 9.010 -2.508
579 HB2 ARG 75 1HB ARG 75 17.201 10.959 -3.796
580 HB3 ARG 75 2HB ARG 75 15.499 11.303 -3.469
581 HG2 ARG 75 1HG ARG 75 15.994 10.755 -1.013
582 HG3 ARG 75 2HG ARG 75 17.696 10.833 -1.455
583 HD2 ARG 75 1HD ARG 75 17.003 13.135 -2.538
584 HD3 ARG 75 2HD ARG 75 15.644 13.023 -1.410
585 HE ARG 75 HE ARG 75 18.402 13.670 -0.823
586 HH11 ARG 75 1HH1 ARG 75 15.573 12.162 0.690
587 HH12 ARG 75 2HH1 ARG 75 16.103 12.576 2.297
588 HH21 ARG 75 1HH2 ARG 75 18.981 14.170 1.241
589 HH22 ARG 75 2HH2 ARG 75 17.989 13.699 2.605
590 H ILE 76 H ILE 76 17.257 8.932 -5.522
591 HA ILE 76 HA ILE 76 14.888 9.203 -7.167
592 HB ILE 76 HB ILE 76 16.277 8.696 -9.081
593 HG12 ILE 76 1HG1 ILE 76 18.441 7.869 -7.111
594 HG13 ILE 76 2HG1 ILE 76 17.520 6.790 -8.149
595 HG21 ILE 76 1HG2 ILE 76 17.921 10.415 -7.156
596 HG22 ILE 76 2HG2 ILE 76 17.838 10.547 -8.922
597 HG23 ILE 76 3HG2 ILE 76 16.425 10.963 -7.939
598 HD11 ILE 76 1HD1 ILE 76 18.491 7.971 -10.149
599 HD12 ILE 76 2HD1 ILE 76 19.543 8.881 -9.032
600 HD13 ILE 76 3HD1 ILE 76 19.682 7.114 -9.140
601 H ARG 77 H ARG 77 16.276 6.537 -5.476
602 HA ARG 77 HA ARG 77 15.283 4.406 -7.158
603 HB2 ARG 77 1HB ARG 77 16.985 4.333 -5.209
604 HB3 ARG 77 2HB ARG 77 15.590 4.312 -4.133
605 HG2 ARG 77 1HG ARG 77 15.758 2.272 -6.350
606 HG3 ARG 77 2HG ARG 77 16.812 2.083 -4.937
607 HD2 ARG 77 1HD ARG 77 13.783 2.304 -4.842
608 HD3 ARG 77 2HD ARG 77 14.704 0.802 -4.726
609 HE ARG 77 HE ARG 77 15.727 2.451 -2.724
610 HH11 ARG 77 1HH1 ARG 77 12.518 1.188 -3.474
611 HH12 ARG 77 2HH1 ARG 77 12.040 1.170 -1.801
612 HH21 ARG 77 1HH2 ARG 77 15.024 2.409 -0.619
613 HH22 ARG 77 2HH2 ARG 77 13.426 1.840 -0.227
614 H LEU 78 H LEU 78 13.898 6.637 -4.927
615 HA LEU 78 HA LEU 78 11.838 7.109 -4.196
616 HB2 LEU 78 1HB LEU 78 11.590 7.007 -6.696
617 HB3 LEU 78 2HB LEU 78 10.951 5.408 -6.503
618 HG LEU 78 HG LEU 78 8.970 6.347 -5.325
619 HD11 LEU 78 1HD1 LEU 78 10.281 9.020 -5.965
620 HD12 LEU 78 2HD1 LEU 78 9.969 8.363 -4.346
621 HD13 LEU 78 3HD1 LEU 78 8.611 8.813 -5.389
622 HD21 LEU 78 1HD2 LEU 78 9.580 7.625 -8.011
623 HD22 LEU 78 2HD2 LEU 78 7.966 7.386 -7.301
624 HD23 LEU 78 3HD2 LEU 78 8.955 5.981 -7.759
625 H PHE 79 H PHE 79 9.546 5.927 -3.737
626 HA PHE 79 HA PHE 79 8.484 4.664 -2.210
627 HB2 PHE 79 1HB PHE 79 10.223 2.439 -3.218
628 HB3 PHE 79 2HB PHE 79 8.632 2.341 -2.473
629 HD1 PHE 79 HD1 PHE 79 10.499 2.783 -5.544
630 HD2 PHE 79 HD2 PHE 79 6.611 3.267 -3.760
631 HE1 PHE 79 HE1 PHE 79 9.484 2.956 -7.813
632 HE2 PHE 79 HE2 PHE 79 5.587 3.435 -6.021
633 HZ PHE 79 HZ PHE 79 7.028 3.286 -8.054
634 H SER 80 H SER 80 10.936 5.945 -1.396
635 HA SER 80 HA SER 80 11.584 4.304 1.005
636 HB2 SER 80 1HB SER 80 13.375 5.145 -1.015
637 HB3 SER 80 2HB SER 80 13.622 6.283 0.325
638 HG SER 80 HG SER 80 13.988 4.547 1.712
639 H ALA 81 H ALA 81 10.227 5.231 2.407
640 HA ALA 81 HA ALA 81 9.836 8.159 2.473
641 HB1 ALA 81 1HB ALA 81 8.724 5.946 4.260
642 HB2 ALA 81 2HB ALA 81 8.194 7.646 4.233
643 HB3 ALA 81 3HB ALA 81 7.912 6.614 2.817
644 H ASP 82 H ASP 82 12.464 7.466 2.851
645 HA ASP 82 HA ASP 82 13.100 7.001 5.630
646 HB2 ASP 82 1HB ASP 82 14.670 7.524 3.100
647 HB3 ASP 82 2HB ASP 82 15.468 7.433 4.675
648 HA PRO 83 HA PRO 83 13.553 11.163 7.013
649 HB2 PRO 83 1HB PRO 83 15.406 10.935 8.982
650 HB3 PRO 83 2HB PRO 83 13.841 10.091 9.092
651 HG2 PRO 83 1HG PRO 83 16.473 9.041 8.100
652 HG3 PRO 83 2HG PRO 83 15.409 8.382 9.383
653 HD2 PRO 83 1HD PRO 83 15.319 7.456 6.853
654 HD3 PRO 83 2HD PRO 83 13.823 7.624 7.837
655 H PHE 84 H PHE 84 15.771 12.522 7.953
656 HA PHE 84 HA PHE 84 17.498 13.857 7.299
657 HB2 PHE 84 1HB PHE 84 18.509 11.428 6.883
658 HB3 PHE 84 2HB PHE 84 18.463 11.937 5.197
659 HD1 PHE 84 HD1 PHE 84 20.219 13.258 4.325
660 HD2 PHE 84 HD2 PHE 84 19.657 13.015 8.579
661 HE1 PHE 84 HE1 PHE 84 22.369 14.479 4.666
662 HE2 PHE 84 HE2 PHE 84 21.809 14.228 8.941
663 HZ PHE 84 HZ PHE 84 23.161 14.965 6.985
664 H ASP 85 H ASP 85 14.911 13.953 6.217
665 HA ASP 85 HA ASP 85 15.141 14.758 3.405
666 HB2 ASP 85 1HB ASP 85 12.717 15.157 3.631
667 HB3 ASP 85 2HB ASP 85 13.131 13.545 4.243
668 H LEU 86 H LEU 86 16.697 16.207 5.344
669 HA LEU 86 HA LEU 86 15.437 18.701 6.002
670 HB2 LEU 86 1HB LEU 86 17.680 19.551 6.354
671 HB3 LEU 86 2HB LEU 86 17.476 17.968 7.090
672 HG LEU 86 HG LEU 86 18.591 17.344 4.619
673 HD11 LEU 86 1HD1 LEU 86 19.936 19.854 5.717
674 HD12 LEU 86 2HD1 LEU 86 19.022 19.747 4.185
675 HD13 LEU 86 3HD1 LEU 86 20.531 18.837 4.381
676 HD21 LEU 86 1HD2 LEU 86 20.613 16.879 5.949
677 HD22 LEU 86 2HD2 LEU 86 19.146 16.340 6.791
678 HD23 LEU 86 3HD2 LEU 86 19.964 17.849 7.291
679 H GLU 87 H GLU 87 16.832 17.397 3.123
680 HA GLU 87 HA GLU 87 17.119 19.816 1.582
681 HB2 GLU 87 1HB GLU 87 16.661 16.906 0.811
682 HB3 GLU 87 2HB GLU 87 17.034 18.183 -0.347
683 HG2 GLU 87 1HG GLU 87 18.936 17.829 1.943
684 HG3 GLU 87 2HG GLU 87 18.881 16.553 0.722
685 H ALA 88 H ALA 88 14.376 17.823 2.494
686 HA ALA 88 HA ALA 88 12.736 18.739 0.269
687 HB1 ALA 88 1HB ALA 88 11.976 16.987 2.621
688 HB2 ALA 88 2HB ALA 88 11.060 17.204 1.110
689 HB3 ALA 88 3HB ALA 88 12.633 16.380 1.079
690 H GLN 89 H GLN 89 13.695 20.027 3.132
691 HA GLN 89 HA GLN 89 11.028 21.178 3.791
692 HB2 GLN 89 1HB GLN 89 13.554 20.938 5.418
693 HB3 GLN 89 2HB GLN 89 12.056 21.679 5.980
694 HG2 GLN 89 1HG GLN 89 10.902 19.567 5.901
695 HG3 GLN 89 2HG GLN 89 12.276 18.783 5.119
696 HE21 GLN 89 1HE2 GLN 89 12.955 17.664 8.399
697 HE22 GLN 89 2HE2 GLN 89 12.192 17.242 6.879
698 H ALA 90 H ALA 90 10.630 23.228 3.508
699 HA ALA 90 HA ALA 90 12.730 25.271 3.679
700 HB1 ALA 90 1HB ALA 90 11.089 24.851 1.126
701 HB2 ALA 90 2HB ALA 90 12.158 26.239 1.452
702 HB3 ALA 90 3HB ALA 90 12.849 24.611 1.266
703 H LYS 91 H LYS 91 11.464 27.478 3.370
704 HA LYS 91 HA LYS 91 8.599 27.145 4.041
705 HB2 LYS 91 1HB LYS 91 8.742 28.957 5.607
706 HB3 LYS 91 2HB LYS 91 9.851 27.701 6.134
707 HG2 LYS 91 1HG LYS 91 11.759 29.033 5.295
708 HG3 LYS 91 2HG LYS 91 10.628 30.258 4.673
709 HD2 LYS 91 1HD LYS 91 9.765 30.550 7.012
710 HD3 LYS 91 2HD LYS 91 11.083 29.512 7.583
711 HE2 LYS 91 1HE LYS 91 12.751 31.088 6.815
712 HE3 LYS 91 2HE LYS 91 11.529 32.020 5.912
713 HZ1 LYS 91 1HZ LYS 91 11.590 31.760 8.869
714 HZ2 LYS 91 2HZ LYS 91 10.471 32.609 7.988
715 HZ3 LYS 91 3HZ LYS 91 12.051 33.092 8.007
716 H ILE 92 H ILE 92 7.377 28.943 3.187
717 HA ILE 92 HA ILE 92 8.877 30.621 1.226
718 HB ILE 92 HB ILE 92 6.144 29.281 0.783
719 HG12 ILE 92 1HG1 ILE 92 8.748 28.857 -0.741
720 HG13 ILE 92 2HG1 ILE 92 8.182 27.775 0.533
721 HG21 ILE 92 1HG2 ILE 92 6.290 31.585 -0.185
722 HG22 ILE 92 2HG2 ILE 92 7.768 31.127 -1.060
723 HG23 ILE 92 3HG2 ILE 92 6.208 30.363 -1.458
724 HD11 ILE 92 1HD1 ILE 92 6.824 28.274 -2.144
725 HD12 ILE 92 2HD1 ILE 92 7.603 26.783 -1.576
726 HD13 ILE 92 3HD1 ILE 92 6.096 27.336 -0.813
727 H GLU 93 H GLU 93 8.643 32.646 1.889
728 HA GLU 93 HA GLU 93 6.150 33.421 3.322
729 HB2 GLU 93 1HB GLU 93 9.032 34.134 3.975
730 HB3 GLU 93 2HB GLU 93 7.623 34.920 4.695
731 HG2 GLU 93 1HG GLU 93 6.906 32.786 5.672
732 HG3 GLU 93 2HG GLU 93 8.300 31.975 4.950
733 H GLU 94 H GLU 94 5.297 35.296 2.572
734 HA GLU 94 HA GLU 94 6.951 36.829 0.631
735 HB2 GLU 94 1HB GLU 94 4.895 37.535 -0.446
736 HB3 GLU 94 2HB GLU 94 5.032 35.776 -0.463
737 HG2 GLU 94 1HG GLU 94 3.432 35.651 1.445
738 HG3 GLU 94 2HG GLU 94 3.265 37.412 1.389
739 H ASP 95 H ASP 95 7.097 38.997 0.966
740 HA ASP 95 HA ASP 95 5.658 40.205 3.259
741 HB2 ASP 95 1HB ASP 95 7.798 39.188 4.122
742 HB3 ASP 95 2HB ASP 95 8.687 40.225 3.006
743 H ILE 96 H ILE 96 4.956 40.613 0.884
744 HA ILE 96 HA ILE 96 4.815 41.915 -0.974
745 HB ILE 96 HB ILE 96 3.972 44.147 -0.350
746 HG12 ILE 96 1HG1 ILE 96 4.837 43.517 2.497
747 HG13 ILE 96 2HG1 ILE 96 5.792 44.534 1.420
748 HG21 ILE 96 1HG2 ILE 96 2.643 41.998 0.006
749 HG22 ILE 96 2HG2 ILE 96 3.142 42.034 1.713
750 HG23 ILE 96 3HG2 ILE 96 2.140 43.346 1.040
751 HD11 ILE 96 1HD1 ILE 96 2.951 45.099 2.365
752 HD12 ILE 96 2HD1 ILE 96 4.431 45.937 2.884
753 HD13 ILE 96 3HD1 ILE 96 3.855 46.103 1.208
754 H ARG 97 H ARG 97 7.765 41.725 -0.575
755 HA ARG 97 HA ARG 97 8.723 44.349 -1.527
756 HB2 ARG 97 1HB ARG 97 10.059 41.642 -1.195
757 HB3 ARG 97 2HB ARG 97 10.884 43.047 -1.889
758 HG2 ARG 97 1HG ARG 97 10.606 44.307 0.152
759 HG3 ARG 97 2HG ARG 97 9.676 42.985 0.882
760 HD2 ARG 97 1HD ARG 97 11.633 41.500 0.720
761 HD3 ARG 97 2HD ARG 97 12.566 42.800 -0.049
762 HE ARG 97 HE ARG 97 12.921 43.752 2.019
763 HH11 ARG 97 1HH1 ARG 97 10.268 41.477 2.373
764 HH12 ARG 97 2HH1 ARG 97 10.204 41.657 4.114
765 HH21 ARG 97 1HH2 ARG 97 12.793 43.915 4.264
766 HH22 ARG 97 2HH2 ARG 97 11.597 42.988 5.134
767 H GLN 98 H GLN 98 6.838 43.929 -3.096
768 HA GLN 98 HA GLN 98 6.008 43.278 -5.181
769 HB2 GLN 98 1HB GLN 98 7.084 45.602 -5.101
770 HB3 GLN 98 2HB GLN 98 8.438 44.936 -6.017
771 HG2 GLN 98 1HG GLN 98 6.902 44.327 -7.879
772 HG3 GLN 98 2HG GLN 98 5.505 44.799 -6.914
773 HE21 GLN 98 1HE2 GLN 98 5.759 47.757 -8.812
774 HE22 GLN 98 2HE2 GLN 98 5.007 46.182 -8.742
775 HXT GLN 98 HO GLN 98 7.848 40.464 -5.989
Start of MODEL 25
1 H1 SER 1 1H SER 1 13.601 34.792 -3.957
2 H2 SER 1 2H SER 1 13.776 34.746 -2.402
3 H3 SER 1 3H SER 1 14.220 36.044 -3.285
4 HA SER 1 HA SER 1 11.483 35.335 -2.394
5 HB2 SER 1 1HB SER 1 13.010 36.531 -0.781
6 HB3 SER 1 2HB SER 1 13.168 37.856 -1.959
7 HG SER 1 HG SER 1 10.762 37.903 -1.904
8 H GLN 2 H GLN 2 12.780 35.799 -5.127
9 HA GLN 2 HA GLN 2 10.524 37.423 -6.198
10 HB2 GLN 2 1HB GLN 2 11.990 38.609 -7.746
11 HB3 GLN 2 2HB GLN 2 12.439 38.967 -6.076
12 HG2 GLN 2 1HG GLN 2 14.357 37.459 -6.219
13 HG3 GLN 2 2HG GLN 2 13.874 36.952 -7.844
14 HE21 GLN 2 1HE2 GLN 2 16.005 39.336 -9.176
15 HE22 GLN 2 2HE2 GLN 2 15.508 37.663 -9.077
16 H GLN 3 H GLN 3 10.090 36.977 -8.440
17 HA GLN 3 HA GLN 3 9.627 35.553 -10.129
18 HB2 GLN 3 1HB GLN 3 12.511 34.667 -9.878
19 HB3 GLN 3 2HB GLN 3 11.472 34.543 -11.301
20 HG2 GLN 3 1HG GLN 3 12.531 37.098 -10.021
21 HG3 GLN 3 2HG GLN 3 12.985 36.428 -11.585
22 HE21 GLN 3 1HE2 GLN 3 10.328 37.907 -13.320
23 HE22 GLN 3 2HE2 GLN 3 11.734 36.867 -13.391
24 H SER 4 H SER 4 9.536 34.454 -7.249
25 HA SER 4 HA SER 4 9.791 31.588 -7.564
26 HB2 SER 4 1HB SER 4 8.194 32.976 -5.415
27 HB3 SER 4 2HB SER 4 9.197 31.509 -5.304
28 HG SER 4 HG SER 4 11.024 32.929 -5.724
29 H HIS 5 H HIS 5 8.260 32.382 -9.661
30 HA HIS 5 HA HIS 5 5.413 31.819 -8.921
31 HB2 HIS 5 1HB HIS 5 5.018 32.698 -11.281
32 HB3 HIS 5 2HB HIS 5 5.594 33.868 -10.091
33 HD1 HIS 5 HD1 HIS 5 7.590 31.458 -12.378
34 HD2 HIS 5 HD2 HIS 5 7.271 35.496 -11.362
35 HE1 HIS 5 HE1 HIS 5 9.410 32.689 -13.632
36 H SER 6 H SER 6 7.938 30.002 -9.532
37 HA SER 6 HA SER 6 6.519 28.231 -11.481
38 HB2 SER 6 1HB SER 6 9.511 28.464 -10.994
39 HB3 SER 6 2HB SER 6 8.711 27.429 -12.195
40 HG SER 6 HG SER 6 9.495 29.396 -13.092
41 H SER 7 H SER 7 6.904 25.927 -11.119
42 HA SER 7 HA SER 7 8.007 25.143 -8.528
43 HB2 SER 7 1HB SER 7 5.105 24.472 -9.155
44 HB3 SER 7 2HB SER 7 6.044 23.927 -7.752
45 HG SER 7 HG SER 7 6.304 26.522 -7.781
46 HA PRO 8 HA PRO 8 8.009 21.590 -11.448
47 HB2 PRO 8 1HB PRO 8 6.708 21.463 -13.796
48 HB3 PRO 8 2HB PRO 8 5.844 21.049 -12.277
49 HG2 PRO 8 1HG PRO 8 5.869 23.637 -13.814
50 HG3 PRO 8 2HG PRO 8 4.465 22.692 -13.224
51 HD2 PRO 8 1HD PRO 8 5.496 24.822 -11.849
52 HD3 PRO 8 2HD PRO 8 4.766 23.395 -11.045
53 H GLY 9 H GLY 9 9.267 21.330 -13.464
54 HA2 GLY 9 1HA GLY 9 9.977 22.899 -15.500
55 HA3 GLY 9 2HA GLY 9 10.587 23.902 -14.167
56 H GLU 10 H GLU 10 10.478 20.377 -14.453
57 HA GLU 10 HA GLU 10 13.122 20.048 -13.439
58 HB2 GLU 10 1HB GLU 10 11.253 18.066 -14.801
59 HB3 GLU 10 2HB GLU 10 12.666 17.646 -13.833
60 HG2 GLU 10 1HG GLU 10 11.085 17.351 -12.230
61 HG3 GLU 10 2HG GLU 10 11.397 19.063 -11.960
62 H ILE 11 H ILE 11 12.960 21.496 -16.002
63 HA ILE 11 HA ILE 11 14.670 19.852 -17.728
64 HB ILE 11 HB ILE 11 12.455 21.770 -17.993
65 HG12 ILE 11 1HG1 ILE 11 13.629 19.806 -19.957
66 HG13 ILE 11 2HG1 ILE 11 12.505 19.423 -18.642
67 HG21 ILE 11 1HG2 ILE 11 13.128 22.899 -20.023
68 HG22 ILE 11 2HG2 ILE 11 14.145 23.321 -18.635
69 HG23 ILE 11 3HG2 ILE 11 14.762 22.201 -19.881
70 HD11 ILE 11 1HD1 ILE 11 11.259 19.582 -20.731
71 HD12 ILE 11 2HD1 ILE 11 10.806 20.947 -19.684
72 HD13 ILE 11 3HD1 ILE 11 11.919 21.201 -21.055
73 H THR 12 H THR 12 14.843 21.669 -15.215
74 HA THR 12 HA THR 12 16.465 23.900 -15.711
75 HB THR 12 HB THR 12 15.264 23.451 -13.569
76 HG1 THR 12 HG1 THR 12 18.028 23.698 -12.982
77 HG21 THR 12 1HG2 THR 12 17.549 21.522 -12.959
78 HG22 THR 12 2HG2 THR 12 15.883 21.028 -13.341
79 HG23 THR 12 3HG2 THR 12 16.215 21.976 -11.882
80 H SER 13 H SER 13 18.566 24.413 -15.398
81 HA SER 13 HA SER 13 20.577 22.215 -15.673
82 HB2 SER 13 1HB SER 13 20.869 25.190 -16.281
83 HB3 SER 13 2HB SER 13 22.041 23.904 -16.648
84 HG SER 13 HG SER 13 20.769 24.476 -18.469
85 H SER 14 H SER 14 22.663 24.237 -14.844
86 HA SER 14 HA SER 14 22.066 24.301 -11.923
87 HB2 SER 14 1HB SER 14 24.729 24.478 -13.373
88 HB3 SER 14 2HB SER 14 24.482 24.303 -11.625
89 HG SER 14 HG SER 14 24.964 22.339 -12.831
90 HA PRO 15 HA PRO 15 22.747 28.688 -13.457
91 HB2 PRO 15 1HB PRO 15 20.420 29.953 -12.823
92 HB3 PRO 15 2HB PRO 15 20.628 29.034 -14.342
93 HG2 PRO 15 1HG PRO 15 19.391 28.124 -11.769
94 HG3 PRO 15 2HG PRO 15 18.714 28.064 -13.428
95 HD2 PRO 15 1HD PRO 15 19.919 25.930 -12.327
96 HD3 PRO 15 2HD PRO 15 20.132 26.324 -14.069
97 H GLN 16 H GLN 16 21.439 27.311 -10.567
98 HA GLN 16 HA GLN 16 21.568 29.475 -8.774
99 HB2 GLN 16 1HB GLN 16 22.014 26.514 -8.276
100 HB3 GLN 16 2HB GLN 16 21.714 27.720 -7.021
101 HG2 GLN 16 1HG GLN 16 19.524 28.230 -8.112
102 HG3 GLN 16 2HG GLN 16 19.802 26.857 -9.198
103 HE21 GLN 16 1HE2 GLN 16 18.142 26.201 -5.679
104 HE22 GLN 16 2HE2 GLN 16 18.152 27.725 -6.551
105 H GLY 17 H GLY 17 24.296 28.418 -10.381
106 HA2 GLY 17 1HA GLY 17 26.468 29.154 -9.946
107 HA3 GLY 17 2HA GLY 17 25.963 29.681 -8.336
108 H LEU 18 H LEU 18 25.274 26.433 -9.427
109 HA LEU 18 HA LEU 18 26.756 25.242 -7.256
110 HB2 LEU 18 1HB LEU 18 25.894 23.889 -9.834
111 HB3 LEU 18 2HB LEU 18 26.177 23.129 -8.274
112 HG LEU 18 HG LEU 18 23.895 24.988 -9.019
113 HD11 LEU 18 1HD1 LEU 18 23.750 22.713 -9.971
114 HD12 LEU 18 2HD1 LEU 18 22.494 22.990 -8.748
115 HD13 LEU 18 3HD1 LEU 18 23.929 22.018 -8.345
116 HD21 LEU 18 1HD2 LEU 18 22.929 24.383 -6.788
117 HD22 LEU 18 2HD2 LEU 18 24.420 25.336 -6.648
118 HD23 LEU 18 3HD2 LEU 18 24.459 23.577 -6.369
119 H ASP 19 H ASP 19 27.252 25.863 -10.659
120 HA ASP 19 HA ASP 19 29.929 24.686 -10.796
121 HB2 ASP 19 1HB ASP 19 28.134 26.300 -12.630
122 HB3 ASP 19 2HB ASP 19 29.788 25.837 -13.092
123 H ASN 20 H ASN 20 28.473 27.730 -9.986
124 HA ASN 20 HA ASN 20 31.126 29.083 -10.084
125 HB2 ASN 20 1HB ASN 20 28.334 30.116 -10.694
126 HB3 ASN 20 2HB ASN 20 29.689 31.174 -10.330
127 HD21 ASN 20 1HD2 ASN 20 31.210 30.909 -13.427
128 HD22 ASN 20 2HD2 ASN 20 31.411 31.383 -11.763
129 HA PRO 21 HA PRO 21 29.648 29.071 -5.680
130 HB2 PRO 21 1HB PRO 21 32.262 29.083 -4.691
131 HB3 PRO 21 2HB PRO 21 31.328 27.603 -4.994
132 HG2 PRO 21 1HG PRO 21 33.302 28.959 -6.711
133 HG3 PRO 21 2HG PRO 21 33.160 27.234 -6.325
134 HD2 PRO 21 1HD PRO 21 32.310 28.137 -8.635
135 HD3 PRO 21 2HD PRO 21 31.329 26.937 -7.719
136 H ALA 22 H ALA 22 32.052 30.918 -7.528
137 HA ALA 22 HA ALA 22 32.460 33.019 -5.681
138 HB1 ALA 22 1HB ALA 22 32.423 33.152 -8.720
139 HB2 ALA 22 2HB ALA 22 33.236 34.280 -7.612
140 HB3 ALA 22 3HB ALA 22 33.790 32.596 -7.727
141 H LEU 23 H LEU 23 29.997 32.609 -8.224
142 HA LEU 23 HA LEU 23 28.849 35.238 -7.774
143 HB2 LEU 23 1HB LEU 23 27.703 32.822 -9.219
144 HB3 LEU 23 2HB LEU 23 27.127 34.482 -9.344
145 HG LEU 23 HG LEU 23 29.825 33.458 -10.297
146 HD11 LEU 23 1HD1 LEU 23 28.923 33.708 -12.514
147 HD12 LEU 23 2HD1 LEU 23 27.385 34.342 -11.868
148 HD13 LEU 23 3HD1 LEU 23 27.854 32.649 -11.573
149 HD21 LEU 23 1HD2 LEU 23 30.018 35.800 -9.686
150 HD22 LEU 23 2HD2 LEU 23 28.538 36.193 -10.590
151 HD23 LEU 23 3HD2 LEU 23 29.994 35.638 -11.447
152 H LEU 24 H LEU 24 28.122 31.883 -6.800
153 HA LEU 24 HA LEU 24 25.588 32.533 -5.628
154 HB2 LEU 24 1HB LEU 24 26.296 30.245 -6.207
155 HB3 LEU 24 2HB LEU 24 27.541 30.302 -4.967
156 HG LEU 24 HG LEU 24 25.922 30.314 -3.211
157 HD11 LEU 24 1HD1 LEU 24 23.466 30.163 -3.667
158 HD12 LEU 24 2HD1 LEU 24 23.799 30.590 -5.360
159 HD13 LEU 24 3HD1 LEU 24 24.177 31.738 -4.053
160 HD21 LEU 24 1HD2 LEU 24 25.011 28.338 -5.308
161 HD22 LEU 24 2HD2 LEU 24 24.883 28.172 -3.543
162 HD23 LEU 24 3HD2 LEU 24 26.477 28.176 -4.329
163 H ARG 25 H ARG 25 28.929 32.464 -4.397
164 HA ARG 25 HA ARG 25 28.393 33.082 -1.680
165 HB2 ARG 25 1HB ARG 25 30.580 32.404 -2.356
166 HB3 ARG 25 2HB ARG 25 30.680 33.650 -3.576
167 HG2 ARG 25 1HG ARG 25 30.469 34.584 -0.743
168 HG3 ARG 25 2HG ARG 25 31.963 33.760 -1.212
169 HD2 ARG 25 1HD ARG 25 30.781 36.237 -2.536
170 HD3 ARG 25 2HD ARG 25 32.218 36.181 -1.514
171 HE ARG 25 HE ARG 25 31.965 35.003 -4.253
172 HH11 ARG 25 1HH1 ARG 25 34.071 36.316 -1.713
173 HH12 ARG 25 2HH1 ARG 25 35.465 36.286 -2.759
174 HH21 ARG 25 1HH2 ARG 25 33.805 34.960 -5.460
175 HH22 ARG 25 2HH2 ARG 25 35.329 35.526 -4.816
176 H ASP 26 H ASP 26 28.803 35.211 -4.541
177 HA ASP 26 HA ASP 26 28.592 37.656 -3.089
178 HB2 ASP 26 1HB ASP 26 29.425 37.330 -5.458
179 HB3 ASP 26 2HB ASP 26 27.742 37.132 -5.957
180 H MET 27 H MET 27 26.125 35.713 -4.831
181 HA MET 27 HA MET 27 23.914 37.461 -4.374
182 HB2 MET 27 1HB MET 27 23.989 35.485 -5.917
183 HB3 MET 27 2HB MET 27 23.891 34.418 -4.516
184 HG2 MET 27 1HG MET 27 21.818 36.530 -5.078
185 HG3 MET 27 2HG MET 27 21.747 34.939 -5.832
186 HE1 MET 27 1HE MET 27 20.748 32.537 -2.979
187 HE2 MET 27 2HE MET 27 20.944 32.784 -4.729
188 HE3 MET 27 3HE MET 27 22.372 32.750 -3.667
189 H LEU 28 H LEU 28 25.045 34.643 -2.537
190 HA LEU 28 HA LEU 28 23.070 34.720 -0.525
191 HB2 LEU 28 1HB LEU 28 25.845 33.685 -0.624
192 HB3 LEU 28 2HB LEU 28 24.838 33.546 0.822
193 HG LEU 28 HG LEU 28 23.988 32.529 -1.902
194 HD11 LEU 28 1HD1 LEU 28 25.966 31.468 -1.213
195 HD12 LEU 28 2HD1 LEU 28 24.610 30.355 -0.956
196 HD13 LEU 28 3HD1 LEU 28 25.331 31.223 0.419
197 HD21 LEU 28 1HD2 LEU 28 22.442 31.121 -0.473
198 HD22 LEU 28 2HD2 LEU 28 22.079 32.852 -0.506
199 HD23 LEU 28 3HD2 LEU 28 22.894 32.153 0.909
200 H LEU 29 H LEU 29 26.296 36.255 -0.638
201 HA LEU 29 HA LEU 29 26.209 37.265 2.055
202 HB2 LEU 29 1HB LEU 29 27.667 38.114 -0.452
203 HB3 LEU 29 2HB LEU 29 27.805 39.048 1.034
204 HG LEU 29 HG LEU 29 28.520 36.116 0.878
205 HD11 LEU 29 1HD1 LEU 29 29.866 37.374 -0.717
206 HD12 LEU 29 2HD1 LEU 29 30.847 36.842 0.666
207 HD13 LEU 29 3HD1 LEU 29 30.314 38.539 0.554
208 HD21 LEU 29 1HD2 LEU 29 29.841 36.626 2.906
209 HD22 LEU 29 2HD2 LEU 29 28.116 36.948 3.152
210 HD23 LEU 29 3HD2 LEU 29 29.237 38.300 2.872
211 H ALA 30 H ALA 30 25.078 38.526 -1.034
212 HA ALA 30 HA ALA 30 24.379 41.126 0.066
213 HB1 ALA 30 1HB ALA 30 23.580 39.783 -2.553
214 HB2 ALA 30 2HB ALA 30 23.397 41.511 -2.162
215 HB3 ALA 30 3HB ALA 30 25.021 40.797 -2.305
216 H ASN 31 H ASN 31 22.810 38.026 0.032
217 HA ASN 31 HA ASN 31 20.135 39.315 0.232
218 HB2 ASN 31 1HB ASN 31 20.623 37.493 -1.449
219 HB3 ASN 31 2HB ASN 31 20.758 36.368 -0.097
220 HD21 ASN 31 1HD2 ASN 31 17.285 36.600 -1.577
221 HD22 ASN 31 2HD2 ASN 31 18.860 36.629 -2.358
222 HA PRO 32 HA PRO 32 20.866 38.462 4.557
223 HB2 PRO 32 1HB PRO 32 18.740 39.830 5.625
224 HB3 PRO 32 2HB PRO 32 20.239 40.628 5.041
225 HG2 PRO 32 1HG PRO 32 17.641 40.212 3.566
226 HG3 PRO 32 2HG PRO 32 18.576 41.725 3.794
227 HD2 PRO 32 1HD PRO 32 18.818 40.320 1.552
228 HD3 PRO 32 2HD PRO 32 20.265 41.055 2.329
229 H HIS 33 H HIS 33 17.800 37.800 2.860
230 HA HIS 33 HA HIS 33 16.743 36.179 5.053
231 HB2 HIS 33 1HB HIS 33 15.292 37.296 3.357
232 HB3 HIS 33 2HB HIS 33 15.988 36.267 2.102
233 HD1 HIS 33 HD1 HIS 33 13.681 36.106 5.113
234 HD2 HIS 33 HD2 HIS 33 14.983 33.696 1.972
235 HE1 HIS 33 HE1 HIS 33 12.226 34.039 5.124
236 H GLU 34 H GLU 34 18.394 35.638 1.965
237 HA GLU 34 HA GLU 34 18.141 32.781 2.046
238 HB2 GLU 34 1HB GLU 34 19.386 34.859 0.404
239 HB3 GLU 34 2HB GLU 34 20.267 33.354 0.388
240 HG2 GLU 34 1HG GLU 34 18.594 33.599 -1.447
241 HG3 GLU 34 2HG GLU 34 18.411 32.174 -0.431
242 H LEU 35 H LEU 35 20.670 35.111 2.993
243 HA LEU 35 HA LEU 35 22.607 33.131 3.658
244 HB2 LEU 35 1HB LEU 35 23.882 34.765 4.337
245 HB3 LEU 35 2HB LEU 35 22.789 35.552 3.256
246 HG LEU 35 HG LEU 35 21.683 36.692 5.047
247 HD11 LEU 35 1HD1 LEU 35 22.974 36.802 7.255
248 HD12 LEU 35 2HD1 LEU 35 23.604 35.191 6.809
249 HD13 LEU 35 3HD1 LEU 35 21.856 35.453 7.012
250 HD21 LEU 35 1HD2 LEU 35 23.677 38.114 5.426
251 HD22 LEU 35 2HD2 LEU 35 23.572 37.504 3.759
252 HD23 LEU 35 3HD2 LEU 35 24.700 36.747 4.900
253 H SER 36 H SER 36 19.809 34.358 5.320
254 HA SER 36 HA SER 36 20.513 33.411 7.950
255 HB2 SER 36 1HB SER 36 18.962 35.325 7.510
256 HB3 SER 36 2HB SER 36 17.778 34.163 6.881
257 HG SER 36 HG SER 36 17.322 34.472 9.022
258 H LEU 37 H LEU 37 18.481 32.223 5.238
259 HA LEU 37 HA LEU 37 17.582 29.921 6.729
260 HB2 LEU 37 1HB LEU 37 16.596 29.233 4.831
261 HB3 LEU 37 2HB LEU 37 16.629 30.946 4.705
262 HG LEU 37 HG LEU 37 18.280 30.823 2.927
263 HD11 LEU 37 1HD1 LEU 37 19.294 28.684 3.144
264 HD12 LEU 37 2HD1 LEU 37 18.318 28.615 1.679
265 HD13 LEU 37 3HD1 LEU 37 17.726 27.858 3.181
266 HD21 LEU 37 1HD2 LEU 37 15.644 29.366 2.586
267 HD22 LEU 37 2HD2 LEU 37 16.572 30.160 1.287
268 HD23 LEU 37 3HD2 LEU 37 15.879 31.132 2.594
269 H LEU 38 H LEU 38 20.283 30.760 4.727
270 HA LEU 38 HA LEU 38 21.293 28.161 4.357
271 HB2 LEU 38 1HB LEU 38 21.900 30.243 3.209
272 HB3 LEU 38 2HB LEU 38 22.798 30.759 4.639
273 HG LEU 38 HG LEU 38 24.258 28.741 4.442
274 HD11 LEU 38 1HD1 LEU 38 24.292 27.601 2.265
275 HD12 LEU 38 2HD1 LEU 38 22.805 28.467 1.813
276 HD13 LEU 38 3HD1 LEU 38 22.800 27.327 3.179
277 HD21 LEU 38 1HD2 LEU 38 25.567 29.632 2.546
278 HD22 LEU 38 2HD2 LEU 38 25.012 30.895 3.666
279 HD23 LEU 38 3HD2 LEU 38 24.177 30.659 2.117
280 H LYS 39 H LYS 39 22.046 30.517 6.957
281 HA LYS 39 HA LYS 39 23.796 28.637 8.307
282 HB2 LYS 39 1HB LYS 39 23.384 30.099 10.350
283 HB3 LYS 39 2HB LYS 39 24.191 30.810 8.951
284 HG2 LYS 39 1HG LYS 39 22.114 31.891 8.283
285 HG3 LYS 39 2HG LYS 39 21.242 31.174 9.594
286 HD2 LYS 39 1HD LYS 39 21.724 33.387 10.257
287 HD3 LYS 39 2HD LYS 39 22.894 32.387 11.146
288 HE2 LYS 39 1HE LYS 39 24.638 32.918 9.506
289 HE3 LYS 39 2HE LYS 39 23.461 33.773 8.491
290 HZ1 LYS 39 1HZ LYS 39 23.180 35.385 10.266
291 HZ2 LYS 39 2HZ LYS 39 24.764 35.306 9.815
292 HZ3 LYS 39 3HZ LYS 39 24.271 34.594 11.220
293 H GLU 40 H GLU 40 20.321 28.952 8.295
294 HA GLU 40 HA GLU 40 20.049 27.270 10.672
295 HB2 GLU 40 1HB GLU 40 18.477 29.096 9.921
296 HB3 GLU 40 2HB GLU 40 17.958 28.054 8.601
297 HG2 GLU 40 1HG GLU 40 17.854 27.046 11.454
298 HG3 GLU 40 2HG GLU 40 16.625 28.189 10.890
299 H ARG 41 H ARG 41 19.417 26.867 7.151
300 HA ARG 41 HA ARG 41 18.834 24.010 7.435
301 HB2 ARG 41 1HB ARG 41 19.432 25.739 5.006
302 HB3 ARG 41 2HB ARG 41 18.875 24.070 4.922
303 HG2 ARG 41 1HG ARG 41 17.268 26.225 6.315
304 HG3 ARG 41 2HG ARG 41 17.164 25.930 4.576
305 HD2 ARG 41 1HD ARG 41 15.493 24.516 5.184
306 HD3 ARG 41 2HD ARG 41 16.838 23.391 5.448
307 HE ARG 41 HE ARG 41 16.332 24.976 7.810
308 HH11 ARG 41 1HH1 ARG 41 14.940 22.247 6.036
309 HH12 ARG 41 2HH1 ARG 41 14.182 21.599 7.465
310 HH21 ARG 41 1HH2 ARG 41 15.398 24.086 9.566
311 HH22 ARG 41 2HH2 ARG 41 14.427 22.629 9.432
312 H ASN 42 H ASN 42 21.717 25.854 6.521
313 HA ASN 42 HA ASN 42 23.216 23.276 6.298
314 HB2 ASN 42 1HB ASN 42 22.460 24.330 4.048
315 HB3 ASN 42 2HB ASN 42 23.674 25.541 4.338
316 HD21 ASN 42 1HD2 ASN 42 25.311 23.018 2.302
317 HD22 ASN 42 2HD2 ASN 42 24.158 24.321 2.164
318 HA PRO 43 HA PRO 43 25.309 26.664 8.720
319 HB2 PRO 43 1HB PRO 43 26.369 24.987 10.697
320 HB3 PRO 43 2HB PRO 43 24.865 25.953 10.810
321 HG2 PRO 43 1HG PRO 43 25.206 23.065 10.070
322 HG3 PRO 43 2HG PRO 43 24.014 23.824 11.168
323 HD2 PRO 43 1HD PRO 43 23.340 23.140 8.672
324 HD3 PRO 43 2HD PRO 43 22.752 24.684 9.387
325 HA PRO 44 HA PRO 44 29.429 24.590 8.070
326 HB2 PRO 44 1HB PRO 44 29.765 22.640 6.177
327 HB3 PRO 44 2HB PRO 44 29.460 22.283 7.908
328 HG2 PRO 44 1HG PRO 44 27.507 22.407 5.639
329 HG3 PRO 44 2HG PRO 44 27.767 21.100 6.837
330 HD2 PRO 44 1HD PRO 44 25.812 22.894 7.172
331 HD3 PRO 44 2HD PRO 44 26.787 22.340 8.573
332 H LEU 45 H LEU 45 27.163 24.693 5.234
333 HA LEU 45 HA LEU 45 29.235 25.914 3.563
334 HB2 LEU 45 1HB LEU 45 27.309 24.648 2.615
335 HB3 LEU 45 2HB LEU 45 26.227 25.916 3.196
336 HG LEU 45 HG LEU 45 27.284 27.549 1.700
337 HD11 LEU 45 1HD1 LEU 45 29.588 26.710 1.576
338 HD12 LEU 45 2HD1 LEU 45 28.903 26.807 -0.049
339 HD13 LEU 45 3HD1 LEU 45 29.035 25.230 0.759
340 HD21 LEU 45 1HD2 LEU 45 25.390 26.157 0.914
341 HD22 LEU 45 2HD2 LEU 45 26.547 24.982 0.244
342 HD23 LEU 45 3HD2 LEU 45 26.469 26.636 -0.407
343 H ALA 46 H ALA 46 26.625 26.921 5.725
344 HA ALA 46 HA ALA 46 26.693 29.674 5.058
345 HB1 ALA 46 1HB ALA 46 25.611 30.052 7.120
346 HB2 ALA 46 2HB ALA 46 25.032 28.496 6.484
347 HB3 ALA 46 3HB ALA 46 26.226 28.528 7.799
348 H GLU 47 H GLU 47 28.620 27.951 7.627
349 HA GLU 47 HA GLU 47 29.848 30.354 8.560
350 HB2 GLU 47 1HB GLU 47 31.524 28.967 9.607
351 HB3 GLU 47 2HB GLU 47 29.920 28.263 9.834
352 HG2 GLU 47 1HG GLU 47 30.357 26.570 8.187
353 HG3 GLU 47 2HG GLU 47 31.877 27.336 7.714
354 H ALA 48 H ALA 48 30.625 28.264 5.860
355 HA ALA 48 HA ALA 48 33.141 29.318 5.219
356 HB1 ALA 48 1HB ALA 48 32.002 27.192 4.358
357 HB2 ALA 48 2HB ALA 48 31.079 28.252 3.268
358 HB3 ALA 48 3HB ALA 48 32.838 28.174 3.152
359 H LEU 49 H LEU 49 29.844 30.292 4.335
360 HA LEU 49 HA LEU 49 30.618 32.388 2.532
361 HB2 LEU 49 1HB LEU 49 28.326 31.332 2.756
362 HB3 LEU 49 2HB LEU 49 28.148 32.177 4.289
363 HG LEU 49 HG LEU 49 28.627 34.326 2.872
364 HD11 LEU 49 1HD1 LEU 49 27.773 34.121 0.578
365 HD12 LEU 49 2HD1 LEU 49 27.622 32.367 0.787
366 HD13 LEU 49 3HD1 LEU 49 29.225 33.136 0.821
367 HD21 LEU 49 1HD2 LEU 49 25.998 32.826 2.696
368 HD22 LEU 49 2HD2 LEU 49 26.228 34.577 2.488
369 HD23 LEU 49 3HD2 LEU 49 26.540 33.825 4.064
370 H LEU 50 H LEU 50 29.923 32.263 6.039
371 HA LEU 50 HA LEU 50 29.895 35.080 6.460
372 HB2 LEU 50 1HB LEU 50 30.867 33.054 8.489
373 HB3 LEU 50 2HB LEU 50 30.144 34.619 8.799
374 HG LEU 50 HG LEU 50 28.826 32.067 7.989
375 HD11 LEU 50 1HD1 LEU 50 28.388 33.913 10.309
376 HD12 LEU 50 2HD1 LEU 50 29.293 32.377 10.317
377 HD13 LEU 50 3HD1 LEU 50 27.550 32.365 10.002
378 HD21 LEU 50 1HD2 LEU 50 27.545 34.792 7.915
379 HD22 LEU 50 2HD2 LEU 50 26.652 33.246 7.937
380 HD23 LEU 50 3HD2 LEU 50 27.716 33.621 6.577
381 H SER 51 H SER 51 32.536 32.813 6.155
382 HA SER 51 HA SER 51 34.506 34.446 7.456
383 HB2 SER 51 1HB SER 51 34.749 32.154 5.505
384 HB3 SER 51 2HB SER 51 36.025 32.786 6.547
385 HG SER 51 HG SER 51 33.569 31.631 7.423
386 H GLY 52 H GLY 52 33.143 34.360 4.224
387 HA2 GLY 52 1HA GLY 52 33.575 35.889 2.498
388 HA3 GLY 52 2HA GLY 52 34.991 36.487 3.377
389 H ASP 53 H ASP 53 35.958 33.689 3.772
390 HA ASP 53 HA ASP 53 37.779 33.370 1.689
391 HB2 ASP 53 1HB ASP 53 36.614 31.592 3.750
392 HB3 ASP 53 2HB ASP 53 37.894 31.063 2.672
393 H LEU 54 H LEU 54 37.021 33.278 -0.416
394 HA LEU 54 HA LEU 54 34.781 31.710 -1.231
395 HB2 LEU 54 1HB LEU 54 35.886 33.479 -2.591
396 HB3 LEU 54 2HB LEU 54 37.272 32.426 -2.820
397 HG LEU 54 HG LEU 54 35.559 32.688 -4.686
398 HD11 LEU 54 1HD1 LEU 54 37.386 30.988 -4.661
399 HD12 LEU 54 2HD1 LEU 54 35.970 30.581 -5.642
400 HD13 LEU 54 3HD1 LEU 54 36.195 29.822 -4.051
401 HD21 LEU 54 1HD2 LEU 54 33.646 31.242 -4.767
402 HD22 LEU 54 2HD2 LEU 54 33.518 32.299 -3.347
403 HD23 LEU 54 3HD2 LEU 54 34.007 30.600 -3.157
404 H GLU 55 H GLU 55 38.191 30.982 -0.695
405 HA GLU 55 HA GLU 55 38.369 28.473 -1.928
406 HB2 GLU 55 1HB GLU 55 39.589 29.102 0.781
407 HB3 GLU 55 2HB GLU 55 40.202 28.015 -0.475
408 HG2 GLU 55 1HG GLU 55 40.236 30.187 -1.906
409 HG3 GLU 55 2HG GLU 55 40.219 31.009 -0.344
410 H LYS 56 H LYS 56 37.368 29.191 1.444
411 HA LYS 56 HA LYS 56 36.718 26.399 1.876
412 HB2 LYS 56 1HB LYS 56 35.959 26.969 4.050
413 HB3 LYS 56 2HB LYS 56 37.428 27.933 3.689
414 HG2 LYS 56 1HG LYS 56 35.886 29.779 3.209
415 HG3 LYS 56 2HG LYS 56 34.638 28.816 3.946
416 HD2 LYS 56 1HD LYS 56 37.279 29.255 5.363
417 HD3 LYS 56 2HD LYS 56 36.013 30.462 5.441
418 HE2 LYS 56 1HE LYS 56 34.455 28.786 6.401
419 HE3 LYS 56 2HE LYS 56 35.778 27.602 6.416
420 HZ1 LYS 56 1HZ LYS 56 35.555 28.684 8.546
421 HZ2 LYS 56 2HZ LYS 56 35.694 30.186 7.868
422 HZ3 LYS 56 3HZ LYS 56 36.987 29.158 7.867
423 H PHE 57 H PHE 57 34.865 29.287 0.923
424 HA PHE 57 HA PHE 57 32.311 28.049 1.153
425 HB2 PHE 57 1HB PHE 57 32.646 30.460 0.731
426 HB3 PHE 57 2HB PHE 57 33.176 30.085 -0.912
427 HD1 PHE 57 HD1 PHE 57 30.275 29.901 1.426
428 HD2 PHE 57 HD2 PHE 57 31.601 29.657 -2.657
429 HE1 PHE 57 HE1 PHE 57 27.907 29.896 0.661
430 HE2 PHE 57 HE2 PHE 57 29.235 29.657 -3.427
431 HZ PHE 57 HZ PHE 57 27.389 29.767 -1.775
432 H SER 58 H SER 58 34.495 28.173 -1.713
433 HA SER 58 HA SER 58 32.852 26.501 -3.321
434 HB2 SER 58 1HB SER 58 34.672 27.951 -4.181
435 HB3 SER 58 2HB SER 58 35.870 26.937 -3.349
436 HG SER 58 HG SER 58 35.651 26.362 -5.545
437 H ARG 59 H ARG 59 35.513 25.699 -1.064
438 HA ARG 59 HA ARG 59 35.686 22.933 -1.789
439 HB2 ARG 59 1HB ARG 59 37.342 24.022 -0.315
440 HB3 ARG 59 2HB ARG 59 36.084 24.316 0.890
441 HG2 ARG 59 1HG ARG 59 35.816 21.668 0.803
442 HG3 ARG 59 2HG ARG 59 37.463 21.725 0.166
443 HD2 ARG 59 1HD ARG 59 38.309 22.598 2.155
444 HD3 ARG 59 2HD ARG 59 36.729 23.253 2.645
445 HE ARG 59 HE ARG 59 36.419 20.466 2.505
446 HH11 ARG 59 1HH1 ARG 59 38.244 22.742 4.507
447 HH12 ARG 59 2HH1 ARG 59 38.184 21.686 5.893
448 HH21 ARG 59 1HH2 ARG 59 36.383 19.213 4.237
449 HH22 ARG 59 2HH2 ARG 59 37.151 19.692 5.744
450 H VAL 60 H VAL 60 33.726 24.616 0.719
451 HA VAL 60 HA VAL 60 32.486 22.158 1.536
452 HB VAL 60 HB VAL 60 31.560 25.027 1.974
453 HG11 VAL 60 1HG1 VAL 60 29.698 23.532 2.311
454 HG12 VAL 60 2HG1 VAL 60 30.715 22.377 3.209
455 HG13 VAL 60 3HG1 VAL 60 30.335 23.964 3.908
456 HG21 VAL 60 1HG2 VAL 60 33.815 24.510 2.935
457 HG22 VAL 60 2HG2 VAL 60 32.603 24.759 4.199
458 HG23 VAL 60 3HG2 VAL 60 33.125 23.109 3.775
459 H LEU 61 H LEU 61 31.733 24.632 -0.910
460 HA LEU 61 HA LEU 61 29.098 23.821 -1.494
461 HB2 LEU 61 1HB LEU 61 30.522 25.777 -2.435
462 HB3 LEU 61 2HB LEU 61 31.112 24.614 -3.612
463 HG LEU 61 HG LEU 61 28.446 24.233 -3.905
464 HD11 LEU 61 1HD1 LEU 61 28.018 25.978 -2.160
465 HD12 LEU 61 2HD1 LEU 61 27.293 26.339 -3.739
466 HD13 LEU 61 3HD1 LEU 61 28.787 27.174 -3.241
467 HD21 LEU 61 1HD2 LEU 61 28.580 25.401 -5.908
468 HD22 LEU 61 2HD2 LEU 61 30.288 25.033 -5.594
469 HD23 LEU 61 3HD2 LEU 61 29.633 26.647 -5.244
470 H VAL 62 H VAL 62 32.207 22.551 -2.874
471 HA VAL 62 HA VAL 62 30.724 20.612 -4.454
472 HB VAL 62 HB VAL 62 32.908 21.505 -5.200
473 HG11 VAL 62 1HG1 VAL 62 34.116 19.813 -2.981
474 HG12 VAL 62 2HG1 VAL 62 35.015 20.586 -4.304
475 HG13 VAL 62 3HG1 VAL 62 34.162 21.585 -3.123
476 HG21 VAL 62 1HG2 VAL 62 33.773 19.405 -6.085
477 HG22 VAL 62 2HG2 VAL 62 32.904 18.495 -4.824
478 HG23 VAL 62 3HG2 VAL 62 31.996 19.377 -6.074
479 H GLU 63 H GLU 63 32.352 20.529 -1.303
480 HA GLU 63 HA GLU 63 32.147 17.700 -0.864
481 HB2 GLU 63 1HB GLU 63 32.062 20.071 1.020
482 HB3 GLU 63 2HB GLU 63 31.958 18.407 1.597
483 HG2 GLU 63 1HG GLU 63 34.163 17.912 0.601
484 HG3 GLU 63 2HG GLU 63 34.293 19.585 0.043
485 H GLN 64 H GLN 64 29.851 20.390 -0.318
486 HA GLN 64 HA GLN 64 27.762 18.715 0.759
487 HB2 GLN 64 1HB GLN 64 27.778 21.434 -0.602
488 HB3 GLN 64 2HB GLN 64 26.278 20.658 -0.093
489 HG2 GLN 64 1HG GLN 64 28.570 21.268 1.793
490 HG3 GLN 64 2HG GLN 64 27.200 22.349 1.515
491 HE21 GLN 64 1HE2 GLN 64 26.875 19.626 4.317
492 HE22 GLN 64 2HE2 GLN 64 28.361 20.265 3.661
493 H GLN 65 H GLN 65 28.471 19.908 -2.599
494 HA GLN 65 HA GLN 65 26.125 18.817 -3.748
495 HB2 GLN 65 1HB GLN 65 28.879 19.372 -4.845
496 HB3 GLN 65 2HB GLN 65 27.638 18.610 -5.846
497 HG2 GLN 65 1HG GLN 65 26.135 20.521 -5.470
498 HG3 GLN 65 2HG GLN 65 27.361 21.300 -4.467
499 HE21 GLN 65 1HE2 GLN 65 28.855 22.845 -7.192
500 HE22 GLN 65 2HE2 GLN 65 28.509 22.805 -5.475
501 H GLN 66 H GLN 66 29.235 17.190 -3.031
502 HA GLN 66 HA GLN 66 28.606 14.750 -4.375
503 HB2 GLN 66 1HB GLN 66 30.300 15.352 -1.934
504 HB3 GLN 66 2HB GLN 66 30.217 13.757 -2.686
505 HG2 GLN 66 1HG GLN 66 31.137 14.601 -4.745
506 HG3 GLN 66 2HG GLN 66 31.047 16.264 -4.166
507 HE21 GLN 66 1HE2 GLN 66 34.111 16.206 -2.560
508 HE22 GLN 66 2HE2 GLN 66 32.707 17.112 -3.089
509 H ASP 67 H ASP 67 27.764 15.908 -1.095
510 HA ASP 67 HA ASP 67 26.504 13.376 -0.337
511 HB2 ASP 67 1HB ASP 67 27.339 15.022 1.353
512 HB3 ASP 67 2HB ASP 67 26.134 16.167 0.765
513 H ARG 68 H ARG 68 25.418 16.549 -1.530
514 HA ARG 68 HA ARG 68 22.630 16.069 -1.158
515 HB2 ARG 68 1HB ARG 68 24.046 17.876 -3.154
516 HB3 ARG 68 2HB ARG 68 22.323 17.933 -2.789
517 HG2 ARG 68 1HG ARG 68 24.439 18.375 -0.683
518 HG3 ARG 68 2HG ARG 68 23.775 19.686 -1.652
519 HD2 ARG 68 1HD ARG 68 21.606 19.334 -0.740
520 HD3 ARG 68 2HD ARG 68 22.109 17.804 0.016
521 HE ARG 68 HE ARG 68 23.875 19.569 1.116
522 HH11 ARG 68 1HH1 ARG 68 20.352 19.705 0.901
523 HH12 ARG 68 2HH1 ARG 68 20.211 20.606 2.390
524 HH21 ARG 68 1HH2 ARG 68 23.635 20.698 2.970
525 HH22 ARG 68 2HH2 ARG 68 22.046 21.157 3.553
526 H ALA 69 H ALA 69 24.791 15.522 -3.927
527 HA ALA 69 HA ALA 69 22.881 14.700 -5.804
528 HB1 ALA 69 1HB ALA 69 24.742 13.416 -6.840
529 HB2 ALA 69 2HB ALA 69 25.236 15.053 -6.352
530 HB3 ALA 69 3HB ALA 69 25.711 13.650 -5.363
531 H ARG 70 H ARG 70 24.272 12.821 -3.119
532 HA ARG 70 HA ARG 70 23.211 10.273 -3.970
533 HB2 ARG 70 1HB ARG 70 23.933 11.297 -1.189
534 HB3 ARG 70 2HB ARG 70 23.657 9.598 -1.625
535 HG2 ARG 70 1HG ARG 70 25.532 9.794 -3.267
536 HG3 ARG 70 2HG ARG 70 25.842 11.412 -2.639
537 HD2 ARG 70 1HD ARG 70 25.944 8.843 -1.034
538 HD3 ARG 70 2HD ARG 70 27.342 9.737 -1.653
539 HE ARG 70 HE ARG 70 25.702 11.436 -0.002
540 HH11 ARG 70 1HH1 ARG 70 28.102 8.852 0.224
541 HH12 ARG 70 2HH1 ARG 70 28.606 9.335 1.820
542 HH21 ARG 70 1HH2 ARG 70 26.382 11.985 2.041
543 HH22 ARG 70 2HH2 ARG 70 27.663 11.076 2.819
544 H ARG 71 H ARG 71 22.003 12.885 -1.939
545 HA ARG 71 HA ARG 71 19.635 11.382 -1.066
546 HB2 ARG 71 1HB ARG 71 20.443 14.310 -0.831
547 HB3 ARG 71 2HB ARG 71 19.091 13.558 0.034
548 HG2 ARG 71 1HG ARG 71 20.536 12.267 1.393
549 HG3 ARG 71 2HG ARG 71 21.899 12.439 0.293
550 HD2 ARG 71 1HD ARG 71 22.419 13.777 2.131
551 HD3 ARG 71 2HD ARG 71 21.956 14.886 0.830
552 HE ARG 71 HE ARG 71 19.623 14.430 2.275
553 HH11 ARG 71 1HH1 ARG 71 22.839 15.693 3.077
554 HH12 ARG 71 2HH1 ARG 71 22.204 16.692 4.367
555 HH21 ARG 71 1HH2 ARG 71 18.911 15.732 3.934
556 HH22 ARG 71 2HH2 ARG 71 20.033 16.710 4.840
557 H GLU 72 H GLU 72 20.565 13.636 -3.514
558 HA GLU 72 HA GLU 72 17.990 14.498 -4.371
559 HB2 GLU 72 1HB GLU 72 20.744 14.615 -5.401
560 HB3 GLU 72 2HB GLU 72 19.455 14.778 -6.605
561 HG2 GLU 72 1HG GLU 72 18.655 16.712 -5.728
562 HG3 GLU 72 2HG GLU 72 19.096 16.286 -4.075
563 H GLN 73 H GLN 73 19.714 11.548 -4.967
564 HA GLN 73 HA GLN 73 18.422 10.645 -7.308
565 HB2 GLN 73 1HB GLN 73 19.050 9.048 -4.795
566 HB3 GLN 73 2HB GLN 73 18.706 8.374 -6.391
567 HG2 GLN 73 1HG GLN 73 21.082 10.085 -5.642
568 HG3 GLN 73 2HG GLN 73 21.095 8.350 -5.952
569 HE21 GLN 73 1HE2 GLN 73 21.707 10.843 -8.957
570 HE22 GLN 73 2HE2 GLN 73 21.883 11.231 -7.256
571 H GLU 74 H GLU 74 17.180 10.790 -3.938
572 HA GLU 74 HA GLU 74 14.669 9.537 -4.705
573 HB2 GLU 74 1HB GLU 74 15.227 11.189 -2.233
574 HB3 GLU 74 2HB GLU 74 13.905 10.047 -2.497
575 HG2 GLU 74 1HG GLU 74 16.844 9.476 -2.071
576 HG3 GLU 74 2HG GLU 74 15.466 8.905 -1.125
577 H ARG 75 H ARG 75 15.877 12.842 -4.609
578 HA ARG 75 HA ARG 75 13.278 14.111 -4.734
579 HB2 ARG 75 1HB ARG 75 15.999 15.129 -5.584
580 HB3 ARG 75 2HB ARG 75 14.522 16.092 -5.508
581 HG2 ARG 75 1HG ARG 75 14.349 15.590 -3.076
582 HG3 ARG 75 2HG ARG 75 15.892 14.721 -3.179
583 HD2 ARG 75 1HD ARG 75 16.416 16.882 -2.390
584 HD3 ARG 75 2HD ARG 75 16.908 16.848 -4.084
585 HE ARG 75 HE ARG 75 14.548 18.268 -2.955
586 HH11 ARG 75 1HH1 ARG 75 16.736 17.820 -5.715
587 HH12 ARG 75 2HH1 ARG 75 16.043 19.183 -6.567
588 HH21 ARG 75 1HH2 ARG 75 13.783 19.997 -4.111
589 HH22 ARG 75 2HH2 ARG 75 14.452 20.374 -5.683
590 H ILE 76 H ILE 76 15.628 13.028 -7.223
591 HA ILE 76 HA ILE 76 14.024 14.064 -9.404
592 HB ILE 76 HB ILE 76 15.477 12.797 -10.903
593 HG12 ILE 76 1HG1 ILE 76 16.737 11.620 -8.410
594 HG13 ILE 76 2HG1 ILE 76 15.646 10.741 -9.477
595 HG21 ILE 76 1HG2 ILE 76 17.561 13.946 -10.390
596 HG22 ILE 76 2HG2 ILE 76 16.229 14.984 -9.851
597 HG23 ILE 76 3HG2 ILE 76 17.155 14.038 -8.661
598 HD11 ILE 76 1HD1 ILE 76 18.414 11.791 -10.152
599 HD12 ILE 76 2HD1 ILE 76 17.904 10.098 -9.990
600 HD13 ILE 76 3HD1 ILE 76 17.296 11.079 -11.343
601 H ARG 77 H ARG 77 13.775 11.305 -7.377
602 HA ARG 77 HA ARG 77 12.178 9.649 -9.152
603 HB2 ARG 77 1HB ARG 77 13.289 9.454 -6.550
604 HB3 ARG 77 2HB ARG 77 11.542 9.390 -6.321
605 HG2 ARG 77 1HG ARG 77 12.061 7.161 -6.576
606 HG3 ARG 77 2HG ARG 77 11.621 7.614 -8.234
607 HD2 ARG 77 1HD ARG 77 13.618 6.399 -8.477
608 HD3 ARG 77 2HD ARG 77 14.132 8.094 -8.574
609 HE ARG 77 HE ARG 77 14.279 7.153 -5.852
610 HH11 ARG 77 1HH1 ARG 77 16.006 6.947 -8.927
611 HH12 ARG 77 2HH1 ARG 77 17.526 6.595 -8.153
612 HH21 ARG 77 1HH2 ARG 77 16.244 6.696 -4.934
613 HH22 ARG 77 2HH2 ARG 77 17.648 6.445 -5.940
614 H LEU 78 H LEU 78 11.672 12.649 -7.701
615 HA LEU 78 HA LEU 78 8.707 12.311 -7.674
616 HB2 LEU 78 1HB LEU 78 10.341 13.026 -5.571
617 HB3 LEU 78 2HB LEU 78 9.939 14.597 -6.251
618 HG LEU 78 HG LEU 78 7.491 13.953 -6.040
619 HD11 LEU 78 1HD1 LEU 78 6.950 12.154 -4.419
620 HD12 LEU 78 2HD1 LEU 78 8.670 11.700 -4.354
621 HD13 LEU 78 3HD1 LEU 78 7.752 11.506 -5.864
622 HD21 LEU 78 1HD2 LEU 78 7.442 14.444 -3.622
623 HD22 LEU 78 2HD2 LEU 78 8.623 15.463 -4.471
624 HD23 LEU 78 3HD2 LEU 78 9.180 14.069 -3.511
625 H PHE 79 H PHE 79 8.011 14.963 -7.628
626 HA PHE 79 HA PHE 79 9.124 16.059 -10.176
627 HB2 PHE 79 1HB PHE 79 6.221 15.948 -9.271
628 HB3 PHE 79 2HB PHE 79 6.817 16.697 -10.757
629 HD1 PHE 79 HD1 PHE 79 7.472 15.360 -12.676
630 HD2 PHE 79 HD2 PHE 79 6.193 13.477 -9.023
631 HE1 PHE 79 HE1 PHE 79 7.262 13.185 -13.875
632 HE2 PHE 79 HE2 PHE 79 5.978 11.296 -10.211
633 HZ PHE 79 HZ PHE 79 6.514 11.147 -12.644
634 H SER 80 H SER 80 8.526 18.402 -10.418
635 HA SER 80 HA SER 80 8.853 20.543 -9.650
636 HB2 SER 80 1HB SER 80 7.131 19.653 -7.307
637 HB3 SER 80 2HB SER 80 7.429 21.323 -7.837
638 HG SER 80 HG SER 80 6.607 20.344 -9.974
639 H ALA 81 H ALA 81 10.951 18.964 -9.218
640 HA ALA 81 HA ALA 81 11.898 19.584 -6.467
641 HB1 ALA 81 1HB ALA 81 13.504 17.725 -6.812
642 HB2 ALA 81 2HB ALA 81 11.837 17.158 -7.059
643 HB3 ALA 81 3HB ALA 81 12.884 17.487 -8.459
644 H ASP 82 H ASP 82 11.761 21.165 -9.024
645 HA ASP 82 HA ASP 82 14.643 21.727 -9.503
646 HB2 ASP 82 1HB ASP 82 13.745 22.831 -11.564
647 HB3 ASP 82 2HB ASP 82 13.387 21.100 -11.468
648 HA PRO 83 HA PRO 83 13.945 25.695 -7.660
649 HB2 PRO 83 1HB PRO 83 16.029 27.145 -8.547
650 HB3 PRO 83 2HB PRO 83 16.298 25.689 -7.537
651 HG2 PRO 83 1HG PRO 83 16.435 25.983 -10.527
652 HG3 PRO 83 2HG PRO 83 17.625 25.237 -9.415
653 HD2 PRO 83 1HD PRO 83 15.731 23.805 -10.813
654 HD3 PRO 83 2HD PRO 83 16.387 23.277 -9.226
655 H PHE 84 H PHE 84 13.388 27.959 -8.125
656 HA PHE 84 HA PHE 84 12.291 28.303 -10.848
657 HB2 PHE 84 1HB PHE 84 11.127 30.271 -9.848
658 HB3 PHE 84 2HB PHE 84 10.746 28.754 -9.029
659 HD1 PHE 84 HD1 PHE 84 12.783 31.881 -8.754
660 HD2 PHE 84 HD2 PHE 84 11.202 28.431 -6.718
661 HE1 PHE 84 HE1 PHE 84 13.502 32.843 -6.580
662 HE2 PHE 84 HE2 PHE 84 11.913 29.396 -4.532
663 HZ PHE 84 HZ PHE 84 13.071 31.604 -4.463
664 H ASP 85 H ASP 85 15.132 28.576 -9.712
665 HA ASP 85 HA ASP 85 15.779 31.374 -10.205
666 HB2 ASP 85 1HB ASP 85 17.602 29.001 -9.674
667 HB3 ASP 85 2HB ASP 85 18.094 30.707 -9.667
668 H LEU 86 H LEU 86 14.680 30.004 -12.422
669 HA LEU 86 HA LEU 86 16.721 29.324 -14.360
670 HB2 LEU 86 1HB LEU 86 14.914 29.551 -15.992
671 HB3 LEU 86 2HB LEU 86 14.425 28.587 -14.607
672 HG LEU 86 HG LEU 86 13.555 31.168 -13.962
673 HD11 LEU 86 1HD1 LEU 86 12.941 30.559 -16.882
674 HD12 LEU 86 2HD1 LEU 86 13.974 31.886 -16.289
675 HD13 LEU 86 3HD1 LEU 86 12.242 31.877 -15.910
676 HD21 LEU 86 1HD2 LEU 86 12.015 28.866 -15.221
677 HD22 LEU 86 2HD2 LEU 86 11.318 30.218 -14.294
678 HD23 LEU 86 3HD2 LEU 86 12.391 29.052 -13.491
679 H GLU 87 H GLU 87 15.392 32.219 -13.107
680 HA GLU 87 HA GLU 87 16.268 34.012 -15.235
681 HB2 GLU 87 1HB GLU 87 15.371 34.459 -12.364
682 HB3 GLU 87 2HB GLU 87 15.641 35.745 -13.540
683 HG2 GLU 87 1HG GLU 87 13.679 33.527 -14.141
684 HG3 GLU 87 2HG GLU 87 13.226 34.858 -13.086
685 H ALA 88 H ALA 88 17.695 32.574 -12.411
686 HA ALA 88 HA ALA 88 19.648 34.665 -11.971
687 HB1 ALA 88 1HB ALA 88 18.597 33.358 -10.108
688 HB2 ALA 88 2HB ALA 88 19.483 31.930 -10.699
689 HB3 ALA 88 3HB ALA 88 20.376 33.339 -10.099
690 H GLN 89 H GLN 89 19.904 33.807 -14.538
691 HA GLN 89 HA GLN 89 21.561 31.551 -14.955
692 HB2 GLN 89 1HB GLN 89 21.331 34.082 -16.604
693 HB3 GLN 89 2HB GLN 89 22.057 32.564 -17.157
694 HG2 GLN 89 1HG GLN 89 19.900 31.409 -16.831
695 HG3 GLN 89 2HG GLN 89 19.175 32.913 -16.253
696 HE21 GLN 89 1HE2 GLN 89 17.969 33.286 -19.490
697 HE22 GLN 89 2HE2 GLN 89 17.605 32.902 -17.821
698 H ALA 90 H ALA 90 23.612 31.111 -14.814
699 HA ALA 90 HA ALA 90 25.315 32.851 -13.304
700 HB1 ALA 90 1HB ALA 90 26.930 30.982 -13.458
701 HB2 ALA 90 2HB ALA 90 25.305 30.388 -13.043
702 HB3 ALA 90 3HB ALA 90 25.927 30.207 -14.703
703 H LYS 91 H LYS 91 27.568 33.285 -13.862
704 HA LYS 91 HA LYS 91 27.939 34.079 -16.734
705 HB2 LYS 91 1HB LYS 91 29.100 35.391 -14.258
706 HB3 LYS 91 2HB LYS 91 29.267 35.949 -15.919
707 HG2 LYS 91 1HG LYS 91 26.882 36.543 -15.964
708 HG3 LYS 91 2HG LYS 91 26.733 35.959 -14.280
709 HD2 LYS 91 1HD LYS 91 28.627 37.437 -13.660
710 HD3 LYS 91 2HD LYS 91 28.620 38.088 -15.302
711 HE2 LYS 91 1HE LYS 91 26.400 39.035 -14.926
712 HE3 LYS 91 2HE LYS 91 26.393 38.342 -13.271
713 HZ1 LYS 91 1HZ LYS 91 28.441 40.224 -14.353
714 HZ2 LYS 91 2HZ LYS 91 28.496 39.548 -12.860
715 HZ3 LYS 91 3HZ LYS 91 27.285 40.613 -13.234
716 H ILE 92 H ILE 92 30.350 34.423 -17.146
717 HA ILE 92 HA ILE 92 31.949 32.331 -15.740
718 HB ILE 92 HB ILE 92 32.681 33.756 -18.316
719 HG12 ILE 92 1HG1 ILE 92 31.396 31.009 -18.012
720 HG13 ILE 92 2HG1 ILE 92 30.550 32.450 -18.576
721 HG21 ILE 92 1HG2 ILE 92 33.711 31.121 -17.111
722 HG22 ILE 92 2HG2 ILE 92 34.331 31.920 -18.576
723 HG23 ILE 92 3HG2 ILE 92 34.561 32.680 -16.994
724 HD11 ILE 92 1HD1 ILE 92 32.807 30.998 -20.006
725 HD12 ILE 92 2HD1 ILE 92 31.108 31.141 -20.507
726 HD13 ILE 92 3HD1 ILE 92 32.158 32.577 -20.521
727 H GLU 93 H GLU 93 31.834 33.972 -13.972
728 HA GLU 93 HA GLU 93 34.080 35.912 -14.175
729 HB2 GLU 93 1HB GLU 93 31.358 36.292 -12.889
730 HB3 GLU 93 2HB GLU 93 32.747 37.328 -12.580
731 HG2 GLU 93 1HG GLU 93 32.829 37.875 -15.002
732 HG3 GLU 93 2HG GLU 93 31.361 36.923 -15.242
733 H GLU 94 H GLU 94 35.096 36.348 -12.092
734 HA GLU 94 HA GLU 94 34.506 34.550 -9.848
735 HB2 GLU 94 1HB GLU 94 36.442 33.832 -11.832
736 HB3 GLU 94 2HB GLU 94 37.332 34.331 -10.391
737 HG2 GLU 94 1HG GLU 94 35.038 32.380 -10.159
738 HG3 GLU 94 2HG GLU 94 36.630 31.829 -10.704
739 H ASP 95 H ASP 95 35.775 35.122 -7.955
740 HA ASP 95 HA ASP 95 37.269 37.682 -8.103
741 HB2 ASP 95 1HB ASP 95 34.975 38.396 -7.645
742 HB3 ASP 95 2HB ASP 95 34.884 37.272 -6.284
743 H ILE 96 H ILE 96 38.999 36.303 -7.743
744 HA ILE 96 HA ILE 96 39.385 35.620 -4.863
745 HB ILE 96 HB ILE 96 41.074 33.877 -5.762
746 HG12 ILE 96 1HG1 ILE 96 39.339 34.044 -8.266
747 HG13 ILE 96 2HG1 ILE 96 40.931 34.802 -8.147
748 HG21 ILE 96 1HG2 ILE 96 38.102 33.370 -6.237
749 HG22 ILE 96 2HG2 ILE 96 39.341 32.137 -5.932
750 HG23 ILE 96 3HG2 ILE 96 38.924 33.302 -4.662
751 HD11 ILE 96 1HD1 ILE 96 40.316 31.825 -7.990
752 HD12 ILE 96 2HD1 ILE 96 41.166 32.687 -9.290
753 HD13 ILE 96 3HD1 ILE 96 41.923 32.535 -7.688
754 H ARG 97 H ARG 97 39.703 38.136 -5.833
755 HA ARG 97 HA ARG 97 42.395 38.480 -6.967
756 HB2 ARG 97 1HB ARG 97 40.497 40.630 -5.975
757 HB3 ARG 97 2HB ARG 97 41.813 40.814 -7.138
758 HG2 ARG 97 1HG ARG 97 39.231 39.262 -7.567
759 HG3 ARG 97 2HG ARG 97 39.584 40.858 -8.215
760 HD2 ARG 97 1HD ARG 97 41.183 39.994 -9.732
761 HD3 ARG 97 2HD ARG 97 41.283 38.441 -8.872
762 HE ARG 97 HE ARG 97 38.592 38.808 -9.670
763 HH11 ARG 97 1HH1 ARG 97 41.712 38.239 -11.224
764 HH12 ARG 97 2HH1 ARG 97 40.989 37.403 -12.571
765 HH21 ARG 97 1HH2 ARG 97 37.744 37.708 -11.384
766 HH22 ARG 97 2HH2 ARG 97 38.780 37.128 -12.672
767 H GLN 98 H GLN 98 42.976 37.242 -4.822
768 HA GLN 98 HA GLN 98 44.087 37.180 -2.840
769 HB2 GLN 98 1HB GLN 98 45.674 38.622 -4.272
770 HB3 GLN 98 2HB GLN 98 45.040 40.023 -3.410
771 HG2 GLN 98 1HG GLN 98 45.707 38.856 -1.221
772 HG3 GLN 98 2HG GLN 98 46.506 37.618 -2.189
773 HE21 GLN 98 1HE2 GLN 98 48.272 41.133 -1.396
774 HE22 GLN 98 2HE2 GLN 98 46.767 40.615 -0.677
775 HXT GLN 98 HO GLN 98 41.506 38.566 -1.021
Start of MODEL 26
1 H1 SER 1 1H SER 1 25.061 36.362 -10.111
2 H2 SER 1 2H SER 1 23.778 35.926 -9.145
3 H3 SER 1 3H SER 1 24.314 37.540 -9.188
4 HA SER 1 HA SER 1 23.617 37.797 -11.503
5 HB2 SER 1 1HB SER 1 22.618 34.943 -11.265
6 HB3 SER 1 2HB SER 1 22.553 35.933 -12.686
7 HG SER 1 HG SER 1 24.900 35.047 -11.374
8 H GLN 2 H GLN 2 22.455 37.218 -8.650
9 HA GLN 2 HA GLN 2 20.544 37.640 -7.453
10 HB2 GLN 2 1HB GLN 2 20.814 39.734 -9.080
11 HB3 GLN 2 2HB GLN 2 19.282 39.142 -9.727
12 HG2 GLN 2 1HG GLN 2 18.247 39.344 -7.510
13 HG3 GLN 2 2HG GLN 2 19.803 39.767 -6.789
14 HE21 GLN 2 1HE2 GLN 2 18.302 42.997 -7.078
15 HE22 GLN 2 2HE2 GLN 2 18.361 41.585 -6.049
16 H GLN 3 H GLN 3 17.780 37.924 -8.599
17 HA GLN 3 HA GLN 3 17.385 35.001 -9.030
18 HB2 GLN 3 1HB GLN 3 15.547 37.184 -7.974
19 HB3 GLN 3 2HB GLN 3 15.035 35.526 -8.300
20 HG2 GLN 3 1HG GLN 3 15.430 35.641 -5.961
21 HG3 GLN 3 2HG GLN 3 16.784 34.736 -6.650
22 HE21 GLN 3 1HE2 GLN 3 19.095 36.787 -5.086
23 HE22 GLN 3 2HE2 GLN 3 18.612 35.200 -5.635
24 H SER 4 H SER 4 16.110 34.228 -10.691
25 HA SER 4 HA SER 4 15.777 35.979 -13.005
26 HB2 SER 4 1HB SER 4 16.361 33.568 -13.253
27 HB3 SER 4 2HB SER 4 14.808 33.128 -12.509
28 HG SER 4 HG SER 4 14.716 33.089 -14.791
29 H HIS 5 H HIS 5 13.885 36.882 -13.707
30 HA HIS 5 HA HIS 5 11.458 36.520 -11.979
31 HB2 HIS 5 1HB HIS 5 12.597 39.024 -13.280
32 HB3 HIS 5 2HB HIS 5 10.946 38.917 -12.657
33 HD1 HIS 5 HD1 HIS 5 14.536 38.550 -11.286
34 HD2 HIS 5 HD2 HIS 5 10.656 39.488 -10.061
35 HE1 HIS 5 HE1 HIS 5 14.682 39.309 -8.886
36 H SER 6 H SER 6 12.419 35.134 -14.456
37 HA SER 6 HA SER 6 9.971 35.466 -16.065
38 HB2 SER 6 1HB SER 6 12.762 35.858 -17.236
39 HB3 SER 6 2HB SER 6 11.254 35.741 -18.168
40 HG SER 6 HG SER 6 10.937 37.589 -16.265
41 H SER 7 H SER 7 10.224 33.726 -17.952
42 HA SER 7 HA SER 7 11.719 31.382 -16.844
43 HB2 SER 7 1HB SER 7 9.105 31.348 -18.390
44 HB3 SER 7 2HB SER 7 9.963 29.947 -17.708
45 HG SER 7 HG SER 7 9.732 31.114 -15.632
46 HA PRO 8 HA PRO 8 13.118 32.178 -21.178
47 HB2 PRO 8 1HB PRO 8 15.802 32.286 -20.792
48 HB3 PRO 8 2HB PRO 8 14.758 33.697 -20.429
49 HG2 PRO 8 1HG PRO 8 15.818 31.599 -18.570
50 HG3 PRO 8 2HG PRO 8 15.900 33.379 -18.417
51 HD2 PRO 8 1HD PRO 8 13.991 31.882 -17.173
52 HD3 PRO 8 2HD PRO 8 13.667 33.542 -17.780
53 H GLY 9 H GLY 9 14.994 30.770 -22.341
54 HA2 GLY 9 1HA GLY 9 14.340 27.999 -21.784
55 HA3 GLY 9 2HA GLY 9 15.398 28.608 -23.064
56 H GLU 10 H GLU 10 15.637 29.017 -19.520
57 HA GLU 10 HA GLU 10 18.466 28.250 -19.619
58 HB2 GLU 10 1HB GLU 10 18.494 29.007 -17.293
59 HB3 GLU 10 2HB GLU 10 17.726 30.194 -18.345
60 HG2 GLU 10 1HG GLU 10 15.474 29.299 -17.591
61 HG3 GLU 10 2HG GLU 10 16.330 28.318 -16.394
62 H ILE 11 H ILE 11 16.456 26.167 -20.187
63 HA ILE 11 HA ILE 11 16.060 24.507 -18.063
64 HB ILE 11 HB ILE 11 16.228 23.958 -21.040
65 HG12 ILE 11 1HG1 ILE 11 14.789 25.895 -20.742
66 HG13 ILE 11 2HG1 ILE 11 13.821 24.502 -21.174
67 HG21 ILE 11 1HG2 ILE 11 14.738 22.664 -18.842
68 HG22 ILE 11 2HG2 ILE 11 14.451 22.370 -20.573
69 HG23 ILE 11 3HG2 ILE 11 16.026 21.999 -19.860
70 HD11 ILE 11 1HD1 ILE 11 14.054 25.679 -18.353
71 HD12 ILE 11 2HD1 ILE 11 12.682 25.867 -19.464
72 HD13 ILE 11 3HD1 ILE 11 13.067 24.265 -18.801
73 H THR 12 H THR 12 18.637 25.142 -19.821
74 HA THR 12 HA THR 12 20.219 22.911 -18.627
75 HB THR 12 HB THR 12 21.741 23.022 -20.555
76 HG1 THR 12 HG1 THR 12 21.047 25.052 -21.373
77 HG21 THR 12 1HG2 THR 12 20.372 21.659 -22.054
78 HG22 THR 12 2HG2 THR 12 18.885 22.292 -21.316
79 HG23 THR 12 3HG2 THR 12 19.980 21.258 -20.367
80 H SER 13 H SER 13 20.530 24.360 -16.949
81 HA SER 13 HA SER 13 22.903 26.022 -17.259
82 HB2 SER 13 1HB SER 13 21.944 28.090 -16.471
83 HB3 SER 13 2HB SER 13 20.992 27.586 -17.882
84 HG SER 13 HG SER 13 19.345 26.962 -16.558
85 H SER 14 H SER 14 23.362 26.997 -14.974
86 HA SER 14 HA SER 14 22.398 25.085 -12.885
87 HB2 SER 14 1HB SER 14 25.120 26.388 -13.212
88 HB3 SER 14 2HB SER 14 24.609 25.400 -11.828
89 HG SER 14 HG SER 14 25.790 24.370 -13.716
90 HA PRO 15 HA PRO 15 21.416 29.463 -11.794
91 HB2 PRO 15 1HB PRO 15 18.870 29.141 -10.877
92 HB3 PRO 15 2HB PRO 15 19.258 29.206 -12.616
93 HG2 PRO 15 1HG PRO 15 18.877 26.780 -10.904
94 HG3 PRO 15 2HG PRO 15 18.066 27.204 -12.448
95 HD2 PRO 15 1HD PRO 15 20.217 25.582 -12.409
96 HD3 PRO 15 2HD PRO 15 20.001 26.801 -13.709
97 H GLN 16 H GLN 16 21.415 26.529 -10.116
98 HA GLN 16 HA GLN 16 21.131 27.543 -7.419
99 HB2 GLN 16 1HB GLN 16 22.570 25.068 -8.453
100 HB3 GLN 16 2HB GLN 16 22.198 25.412 -6.757
101 HG2 GLN 16 1HG GLN 16 19.754 25.484 -7.411
102 HG3 GLN 16 2HG GLN 16 20.232 24.856 -8.996
103 HE21 GLN 16 1HE2 GLN 16 19.423 22.256 -6.202
104 HE22 GLN 16 2HE2 GLN 16 18.767 23.862 -6.401
105 H GLY 17 H GLY 17 23.494 28.154 -9.763
106 HA2 GLY 17 1HA GLY 17 25.516 29.241 -9.590
107 HA3 GLY 17 2HA GLY 17 25.221 29.435 -7.851
108 H LEU 18 H LEU 18 25.075 26.251 -9.202
109 HA LEU 18 HA LEU 18 27.062 25.339 -7.366
110 HB2 LEU 18 1HB LEU 18 26.592 23.197 -8.031
111 HB3 LEU 18 2HB LEU 18 25.083 24.079 -8.149
112 HG LEU 18 HG LEU 18 25.899 24.268 -10.713
113 HD11 LEU 18 1HD1 LEU 18 26.963 22.239 -11.426
114 HD12 LEU 18 2HD1 LEU 18 26.905 21.567 -9.774
115 HD13 LEU 18 3HD1 LEU 18 27.955 22.950 -10.139
116 HD21 LEU 18 1HD2 LEU 18 24.499 21.890 -9.447
117 HD22 LEU 18 2HD2 LEU 18 24.389 22.387 -11.154
118 HD23 LEU 18 3HD2 LEU 18 23.736 23.437 -9.880
119 H ASP 19 H ASP 19 27.262 26.106 -10.809
120 HA ASP 19 HA ASP 19 30.013 25.094 -10.996
121 HB2 ASP 19 1HB ASP 19 28.229 26.693 -12.868
122 HB3 ASP 19 2HB ASP 19 29.887 26.212 -13.267
123 H ASN 20 H ASN 20 28.438 27.900 -9.880
124 HA ASN 20 HA ASN 20 30.959 29.460 -10.092
125 HB2 ASN 20 1HB ASN 20 28.064 30.309 -10.529
126 HB3 ASN 20 2HB ASN 20 29.373 31.443 -10.251
127 HD21 ASN 20 1HD2 ASN 20 30.854 31.053 -13.420
128 HD22 ASN 20 2HD2 ASN 20 31.220 31.381 -11.750
129 HA PRO 21 HA PRO 21 29.580 29.197 -5.679
130 HB2 PRO 21 1HB PRO 21 32.193 29.021 -4.729
131 HB3 PRO 21 2HB PRO 21 31.189 27.607 -5.126
132 HG2 PRO 21 1HG PRO 21 33.202 28.998 -6.772
133 HG3 PRO 21 2HG PRO 21 33.003 27.261 -6.501
134 HD2 PRO 21 1HD PRO 21 32.164 28.340 -8.725
135 HD3 PRO 21 2HD PRO 21 31.164 27.106 -7.876
136 H ALA 22 H ALA 22 32.043 31.019 -7.482
137 HA ALA 22 HA ALA 22 32.460 33.074 -5.556
138 HB1 ALA 22 1HB ALA 22 33.262 34.404 -7.480
139 HB2 ALA 22 2HB ALA 22 33.918 32.752 -7.514
140 HB3 ALA 22 3HB ALA 22 32.580 33.202 -8.601
141 H LEU 23 H LEU 23 30.039 32.711 -8.162
142 HA LEU 23 HA LEU 23 28.854 35.319 -7.636
143 HB2 LEU 23 1HB LEU 23 27.714 32.952 -9.162
144 HB3 LEU 23 2HB LEU 23 27.117 34.603 -9.199
145 HG LEU 23 HG LEU 23 29.750 33.610 -10.336
146 HD11 LEU 23 1HD1 LEU 23 27.233 34.686 -11.681
147 HD12 LEU 23 2HD1 LEU 23 27.704 32.975 -11.597
148 HD13 LEU 23 3HD1 LEU 23 28.710 34.125 -12.498
149 HD21 LEU 23 1HD2 LEU 23 29.984 35.854 -11.314
150 HD22 LEU 23 2HD2 LEU 23 30.060 35.889 -9.542
151 HD23 LEU 23 3HD2 LEU 23 28.576 36.408 -10.375
152 H LEU 24 H LEU 24 28.269 31.952 -6.656
153 HA LEU 24 HA LEU 24 25.686 32.391 -5.519
154 HB2 LEU 24 1HB LEU 24 27.144 30.211 -5.969
155 HB3 LEU 24 2HB LEU 24 27.650 30.472 -4.313
156 HG LEU 24 HG LEU 24 24.897 30.052 -5.285
157 HD11 LEU 24 1HD1 LEU 24 24.904 27.932 -4.233
158 HD12 LEU 24 2HD1 LEU 24 26.499 28.272 -3.530
159 HD13 LEU 24 3HD1 LEU 24 26.323 28.065 -5.287
160 HD21 LEU 24 1HD2 LEU 24 24.479 31.436 -3.545
161 HD22 LEU 24 2HD2 LEU 24 25.683 30.628 -2.544
162 HD23 LEU 24 3HD2 LEU 24 24.175 29.793 -2.953
163 H ARG 25 H ARG 25 28.983 32.421 -4.131
164 HA ARG 25 HA ARG 25 28.295 33.153 -1.481
165 HB2 ARG 25 1HB ARG 25 30.515 32.369 -2.174
166 HB3 ARG 25 2HB ARG 25 30.704 33.755 -3.225
167 HG2 ARG 25 1HG ARG 25 30.361 35.021 -0.828
168 HG3 ARG 25 2HG ARG 25 31.120 33.513 -0.293
169 HD2 ARG 25 1HD ARG 25 32.813 35.230 -0.755
170 HD3 ARG 25 2HD ARG 25 32.962 33.891 -1.915
171 HE ARG 25 HE ARG 25 31.400 35.465 -3.345
172 HH11 ARG 25 1HH1 ARG 25 34.177 36.486 -1.426
173 HH12 ARG 25 2HH1 ARG 25 34.441 37.904 -2.409
174 HH21 ARG 25 1HH2 ARG 25 31.763 37.303 -4.523
175 HH22 ARG 25 2HH2 ARG 25 33.100 38.347 -4.142
176 H ASP 26 H ASP 26 28.876 35.138 -4.412
177 HA ASP 26 HA ASP 26 28.681 37.655 -3.073
178 HB2 ASP 26 1HB ASP 26 29.461 36.938 -5.497
179 HB3 ASP 26 2HB ASP 26 27.788 37.311 -5.920
180 H MET 27 H MET 27 26.227 35.674 -4.793
181 HA MET 27 HA MET 27 24.038 37.501 -4.453
182 HB2 MET 27 1HB MET 27 24.056 35.549 -5.995
183 HB3 MET 27 2HB MET 27 24.006 34.473 -4.593
184 HG2 MET 27 1HG MET 27 21.823 35.347 -3.951
185 HG3 MET 27 2HG MET 27 21.876 36.512 -5.287
186 HE1 MET 27 1HE MET 27 21.262 32.805 -4.159
187 HE2 MET 27 2HE MET 27 21.257 31.910 -5.697
188 HE3 MET 27 3HE MET 27 22.782 32.556 -5.052
189 H LEU 28 H LEU 28 25.207 34.749 -2.463
190 HA LEU 28 HA LEU 28 23.178 34.912 -0.490
191 HB2 LEU 28 1HB LEU 28 26.004 34.009 -0.513
192 HB3 LEU 28 2HB LEU 28 25.101 34.081 0.995
193 HG LEU 28 HG LEU 28 24.108 32.559 -1.409
194 HD11 LEU 28 1HD1 LEU 28 25.056 30.620 -0.245
195 HD12 LEU 28 2HD1 LEU 28 25.789 31.725 0.940
196 HD13 LEU 28 3HD1 LEU 28 26.284 31.795 -0.760
197 HD21 LEU 28 1HD2 LEU 28 22.452 33.135 0.378
198 HD22 LEU 28 2HD2 LEU 28 23.466 32.294 1.555
199 HD23 LEU 28 3HD2 LEU 28 22.719 31.395 0.213
200 H LEU 29 H LEU 29 26.340 36.619 -0.660
201 HA LEU 29 HA LEU 29 26.077 37.876 1.907
202 HB2 LEU 29 1HB LEU 29 27.593 38.631 -0.609
203 HB3 LEU 29 2HB LEU 29 27.717 39.556 0.886
204 HG LEU 29 HG LEU 29 28.372 36.609 0.768
205 HD11 LEU 29 1HD1 LEU 29 30.742 37.259 0.548
206 HD12 LEU 29 2HD1 LEU 29 30.244 38.953 0.321
207 HD13 LEU 29 3HD1 LEU 29 29.782 37.715 -0.874
208 HD21 LEU 29 1HD2 LEU 29 28.004 37.529 3.014
209 HD22 LEU 29 2HD2 LEU 29 29.201 38.805 2.694
210 HD23 LEU 29 3HD2 LEU 29 29.706 37.100 2.772
211 H ALA 30 H ALA 30 24.956 38.709 -1.328
212 HA ALA 30 HA ALA 30 23.975 41.332 -0.515
213 HB1 ALA 30 1HB ALA 30 23.070 41.413 -2.801
214 HB2 ALA 30 2HB ALA 30 24.760 40.855 -2.822
215 HB3 ALA 30 3HB ALA 30 23.434 39.686 -3.025
216 H ASN 31 H ASN 31 22.783 38.136 -0.060
217 HA ASN 31 HA ASN 31 19.969 39.175 -0.001
218 HB2 ASN 31 1HB ASN 31 20.623 37.360 -1.677
219 HB3 ASN 31 2HB ASN 31 20.814 36.298 -0.306
220 HD21 ASN 31 1HD2 ASN 31 17.318 36.472 -1.924
221 HD22 ASN 31 2HD2 ASN 31 18.901 36.606 -2.660
222 HA PRO 32 HA PRO 32 20.906 38.334 4.327
223 HB2 PRO 32 1HB PRO 32 18.772 39.663 5.431
224 HB3 PRO 32 2HB PRO 32 20.266 40.478 4.864
225 HG2 PRO 32 1HG PRO 32 17.667 40.086 3.382
226 HG3 PRO 32 2HG PRO 32 18.599 41.595 3.640
227 HD2 PRO 32 1HD PRO 32 18.842 40.249 1.369
228 HD3 PRO 32 2HD PRO 32 20.297 40.948 2.166
229 H HIS 33 H HIS 33 17.847 37.651 2.642
230 HA HIS 33 HA HIS 33 16.813 35.979 4.802
231 HB2 HIS 33 1HB HIS 33 15.367 37.113 3.121
232 HB3 HIS 33 2HB HIS 33 16.068 36.099 1.854
233 HD1 HIS 33 HD1 HIS 33 13.821 35.847 4.925
234 HD2 HIS 33 HD2 HIS 33 15.029 33.565 1.653
235 HE1 HIS 33 HE1 HIS 33 12.357 33.786 4.885
236 H GLU 34 H GLU 34 18.594 35.508 1.777
237 HA GLU 34 HA GLU 34 18.365 32.612 1.818
238 HB2 GLU 34 1HB GLU 34 19.652 34.707 0.191
239 HB3 GLU 34 2HB GLU 34 20.431 33.167 0.113
240 HG2 GLU 34 1HG GLU 34 17.489 33.623 -0.438
241 HG3 GLU 34 2HG GLU 34 18.745 33.600 -1.686
242 H LEU 35 H LEU 35 20.799 35.037 2.783
243 HA LEU 35 HA LEU 35 22.780 33.110 3.506
244 HB2 LEU 35 1HB LEU 35 24.011 34.806 4.164
245 HB3 LEU 35 2HB LEU 35 22.907 35.573 3.085
246 HG LEU 35 HG LEU 35 21.714 36.576 4.974
247 HD11 LEU 35 1HD1 LEU 35 23.036 36.759 7.125
248 HD12 LEU 35 2HD1 LEU 35 23.920 35.300 6.599
249 HD13 LEU 35 3HD1 LEU 35 22.165 35.242 6.875
250 HD21 LEU 35 1HD2 LEU 35 24.699 36.940 4.670
251 HD22 LEU 35 2HD2 LEU 35 23.578 38.176 5.303
252 HD23 LEU 35 3HD2 LEU 35 23.438 37.618 3.622
253 H SER 36 H SER 36 19.917 34.317 5.102
254 HA SER 36 HA SER 36 20.616 33.356 7.732
255 HB2 SER 36 1HB SER 36 19.011 35.221 7.321
256 HB3 SER 36 2HB SER 36 17.868 34.047 6.637
257 HG SER 36 HG SER 36 17.846 32.992 8.652
258 H LEU 37 H LEU 37 18.564 32.111 5.033
259 HA LEU 37 HA LEU 37 17.712 29.801 6.512
260 HB2 LEU 37 1HB LEU 37 16.857 28.992 4.577
261 HB3 LEU 37 2HB LEU 37 16.747 30.698 4.514
262 HG LEU 37 HG LEU 37 18.529 30.725 2.798
263 HD11 LEU 37 1HD1 LEU 37 17.874 27.779 2.761
264 HD12 LEU 37 2HD1 LEU 37 19.457 28.523 3.033
265 HD13 LEU 37 3HD1 LEU 37 18.696 28.660 1.445
266 HD21 LEU 37 1HD2 LEU 37 16.165 31.122 2.353
267 HD22 LEU 37 2HD2 LEU 37 15.876 29.372 2.251
268 HD23 LEU 37 3HD2 LEU 37 16.892 30.176 1.041
269 H LEU 38 H LEU 38 20.497 30.644 4.686
270 HA LEU 38 HA LEU 38 21.483 28.016 4.369
271 HB2 LEU 38 1HB LEU 38 22.108 30.058 3.177
272 HB3 LEU 38 2HB LEU 38 22.985 30.619 4.614
273 HG LEU 38 HG LEU 38 24.379 28.540 4.544
274 HD11 LEU 38 1HD1 LEU 38 22.915 27.144 3.221
275 HD12 LEU 38 2HD1 LEU 38 24.473 27.326 2.402
276 HD13 LEU 38 3HD1 LEU 38 23.059 28.248 1.835
277 HD21 LEU 38 1HD2 LEU 38 25.847 29.320 2.774
278 HD22 LEU 38 2HD2 LEU 38 25.189 30.687 3.696
279 HD23 LEU 38 3HD2 LEU 38 24.519 30.290 2.101
280 H LYS 39 H LYS 39 22.119 30.457 6.935
281 HA LYS 39 HA LYS 39 23.692 28.502 8.442
282 HB2 LYS 39 1HB LYS 39 23.389 30.099 10.375
283 HB3 LYS 39 2HB LYS 39 24.280 30.675 8.970
284 HG2 LYS 39 1HG LYS 39 22.352 31.956 8.224
285 HG3 LYS 39 2HG LYS 39 21.363 31.337 9.525
286 HD2 LYS 39 1HD LYS 39 22.078 33.527 10.168
287 HD3 LYS 39 2HD LYS 39 23.033 32.390 11.141
288 HE2 LYS 39 1HE LYS 39 24.920 32.621 9.555
289 HE3 LYS 39 2HE LYS 39 23.955 33.723 8.555
290 HZ1 LYS 39 1HZ LYS 39 23.955 35.295 10.356
291 HZ2 LYS 39 2HZ LYS 39 25.512 34.863 10.042
292 HZ3 LYS 39 3HZ LYS 39 24.738 34.265 11.369
293 H GLU 40 H GLU 40 20.292 29.231 8.214
294 HA GLU 40 HA GLU 40 19.489 27.883 10.634
295 HB2 GLU 40 1HB GLU 40 18.099 29.481 9.281
296 HB3 GLU 40 2HB GLU 40 18.039 28.282 7.995
297 HG2 GLU 40 1HG GLU 40 16.906 26.732 9.630
298 HG3 GLU 40 2HG GLU 40 16.743 28.127 10.708
299 H ARG 41 H ARG 41 19.731 26.870 7.193
300 HA ARG 41 HA ARG 41 19.148 24.069 8.086
301 HB2 ARG 41 1HB ARG 41 19.137 25.287 5.314
302 HB3 ARG 41 2HB ARG 41 18.597 23.668 5.764
303 HG2 ARG 41 1HG ARG 41 17.031 24.920 7.425
304 HG3 ARG 41 2HG ARG 41 17.365 26.337 6.429
305 HD2 ARG 41 1HD ARG 41 16.660 24.026 4.795
306 HD3 ARG 41 2HD ARG 41 15.416 24.362 6.011
307 HE ARG 41 HE ARG 41 16.090 25.976 3.689
308 HH11 ARG 41 1HH1 ARG 41 14.669 26.152 6.922
309 HH12 ARG 41 2HH1 ARG 41 13.765 27.586 6.546
310 HH21 ARG 41 1HH2 ARG 41 14.864 27.789 3.277
311 HH22 ARG 41 2HH2 ARG 41 13.857 28.477 4.522
312 H ASN 42 H ASN 42 21.818 25.815 6.677
313 HA ASN 42 HA ASN 42 23.281 23.209 6.416
314 HB2 ASN 42 1HB ASN 42 22.477 24.266 4.204
315 HB3 ASN 42 2HB ASN 42 23.660 25.510 4.483
316 HD21 ASN 42 1HD2 ASN 42 25.324 23.103 2.347
317 HD22 ASN 42 2HD2 ASN 42 24.112 24.352 2.277
318 HA PRO 43 HA PRO 43 25.478 26.522 8.844
319 HB2 PRO 43 1HB PRO 43 26.590 24.822 10.755
320 HB3 PRO 43 2HB PRO 43 25.061 25.740 10.920
321 HG2 PRO 43 1HG PRO 43 25.465 22.895 10.060
322 HG3 PRO 43 2HG PRO 43 24.307 23.573 11.237
323 HD2 PRO 43 1HD PRO 43 23.522 22.991 8.757
324 HD3 PRO 43 2HD PRO 43 22.957 24.506 9.551
325 HA PRO 44 HA PRO 44 29.578 24.450 8.017
326 HB2 PRO 44 1HB PRO 44 29.828 22.577 6.033
327 HB3 PRO 44 2HB PRO 44 29.579 22.143 7.750
328 HG2 PRO 44 1HG PRO 44 27.559 22.393 5.582
329 HG3 PRO 44 2HG PRO 44 27.858 21.028 6.704
330 HD2 PRO 44 1HD PRO 44 25.926 22.794 7.205
331 HD3 PRO 44 2HD PRO 44 26.969 22.194 8.538
332 H LEU 45 H LEU 45 27.230 24.612 5.249
333 HA LEU 45 HA LEU 45 29.237 25.915 3.571
334 HB2 LEU 45 1HB LEU 45 27.322 24.617 2.649
335 HB3 LEU 45 2HB LEU 45 26.237 25.881 3.229
336 HG LEU 45 HG LEU 45 27.239 27.504 1.703
337 HD11 LEU 45 1HD1 LEU 45 29.573 26.762 1.613
338 HD12 LEU 45 2HD1 LEU 45 28.902 26.798 -0.022
339 HD13 LEU 45 3HD1 LEU 45 29.092 25.245 0.820
340 HD21 LEU 45 1HD2 LEU 45 26.493 26.530 -0.406
341 HD22 LEU 45 2HD2 LEU 45 25.413 26.021 0.903
342 HD23 LEU 45 3HD2 LEU 45 26.630 24.888 0.270
343 H ALA 46 H ALA 46 26.701 26.819 5.854
344 HA ALA 46 HA ALA 46 26.684 29.592 5.243
345 HB1 ALA 46 1HB ALA 46 26.331 28.372 7.975
346 HB2 ALA 46 2HB ALA 46 25.665 29.898 7.353
347 HB3 ALA 46 3HB ALA 46 25.093 28.346 6.702
348 H GLU 47 H GLU 47 28.721 27.845 7.704
349 HA GLU 47 HA GLU 47 29.963 30.225 8.646
350 HB2 GLU 47 1HB GLU 47 31.759 28.838 9.520
351 HB3 GLU 47 2HB GLU 47 30.168 28.183 9.908
352 HG2 GLU 47 1HG GLU 47 30.457 26.325 8.642
353 HG3 GLU 47 2HG GLU 47 31.495 27.118 7.466
354 H ALA 48 H ALA 48 30.625 28.245 5.861
355 HA ALA 48 HA ALA 48 33.090 29.324 5.120
356 HB1 ALA 48 1HB ALA 48 30.984 28.390 3.178
357 HB2 ALA 48 2HB ALA 48 32.736 28.185 3.107
358 HB3 ALA 48 3HB ALA 48 31.798 27.243 4.266
359 H LEU 49 H LEU 49 29.777 30.344 4.386
360 HA LEU 49 HA LEU 49 30.551 32.528 2.683
361 HB2 LEU 49 1HB LEU 49 28.249 31.536 2.828
362 HB3 LEU 49 2HB LEU 49 28.107 32.186 4.460
363 HG LEU 49 HG LEU 49 28.511 34.499 3.413
364 HD11 LEU 49 1HD1 LEU 49 27.918 32.833 0.946
365 HD12 LEU 49 2HD1 LEU 49 29.328 33.869 1.258
366 HD13 LEU 49 3HD1 LEU 49 27.734 34.596 1.016
367 HD21 LEU 49 1HD2 LEU 49 26.141 34.716 2.864
368 HD22 LEU 49 2HD2 LEU 49 26.390 33.755 4.334
369 HD23 LEU 49 3HD2 LEU 49 25.989 32.942 2.804
370 H LEU 50 H LEU 50 29.901 32.205 6.194
371 HA LEU 50 HA LEU 50 29.932 35.002 6.763
372 HB2 LEU 50 1HB LEU 50 30.841 32.833 8.673
373 HB3 LEU 50 2HB LEU 50 30.189 34.409 9.076
374 HG LEU 50 HG LEU 50 28.761 31.956 8.150
375 HD11 LEU 50 1HD1 LEU 50 27.483 32.244 10.161
376 HD12 LEU 50 2HD1 LEU 50 28.374 33.747 10.524
377 HD13 LEU 50 3HD1 LEU 50 29.220 32.178 10.494
378 HD21 LEU 50 1HD2 LEU 50 27.758 33.647 6.784
379 HD22 LEU 50 2HD2 LEU 50 27.573 34.727 8.192
380 HD23 LEU 50 3HD2 LEU 50 26.649 33.205 8.082
381 H SER 51 H SER 51 32.498 32.605 6.515
382 HA SER 51 HA SER 51 34.552 34.211 7.703
383 HB2 SER 51 1HB SER 51 34.678 31.927 5.726
384 HB3 SER 51 2HB SER 51 36.015 32.539 6.702
385 HG SER 51 HG SER 51 33.602 31.383 7.682
386 H GLY 52 H GLY 52 33.064 34.084 4.524
387 HA2 GLY 52 1HA GLY 52 33.346 35.652 2.823
388 HA3 GLY 52 2HA GLY 52 34.765 36.307 3.653
389 H ASP 53 H ASP 53 35.803 33.449 3.897
390 HA ASP 53 HA ASP 53 37.524 33.502 1.654
391 HB2 ASP 53 1HB ASP 53 37.449 32.113 4.050
392 HB3 ASP 53 2HB ASP 53 37.265 30.873 2.814
393 H LEU 54 H LEU 54 36.874 33.308 -0.373
394 HA LEU 54 HA LEU 54 34.582 31.808 -1.205
395 HB2 LEU 54 1HB LEU 54 35.643 33.585 -2.551
396 HB3 LEU 54 2HB LEU 54 37.069 32.584 -2.773
397 HG LEU 54 HG LEU 54 35.314 32.803 -4.643
398 HD11 LEU 54 1HD1 LEU 54 37.290 31.326 -4.710
399 HD12 LEU 54 2HD1 LEU 54 35.893 30.693 -5.603
400 HD13 LEU 54 3HD1 LEU 54 36.301 30.032 -4.010
401 HD21 LEU 54 1HD2 LEU 54 33.305 32.201 -3.370
402 HD22 LEU 54 2HD2 LEU 54 33.949 30.561 -3.158
403 HD23 LEU 54 3HD2 LEU 54 33.567 31.153 -4.774
404 H GLU 55 H GLU 55 38.025 31.068 -0.713
405 HA GLU 55 HA GLU 55 38.163 28.587 -2.028
406 HB2 GLU 55 1HB GLU 55 39.459 29.350 0.614
407 HB3 GLU 55 2HB GLU 55 39.997 28.073 -0.481
408 HG2 GLU 55 1HG GLU 55 39.917 31.026 -1.153
409 HG3 GLU 55 2HG GLU 55 41.324 30.140 -0.577
410 H LYS 56 H LYS 56 37.353 29.240 1.423
411 HA LYS 56 HA LYS 56 36.663 26.469 1.810
412 HB2 LYS 56 1HB LYS 56 36.034 26.937 3.993
413 HB3 LYS 56 2HB LYS 56 37.397 28.030 3.620
414 HG2 LYS 56 1HG LYS 56 35.730 29.819 3.396
415 HG3 LYS 56 2HG LYS 56 34.545 28.678 3.978
416 HD2 LYS 56 1HD LYS 56 37.099 28.914 5.535
417 HD3 LYS 56 2HD LYS 56 35.950 30.232 5.659
418 HE2 LYS 56 1HE LYS 56 34.179 28.616 6.357
419 HE3 LYS 56 2HE LYS 56 35.366 27.314 6.294
420 HZ1 LYS 56 1HZ LYS 56 35.436 29.660 8.095
421 HZ2 LYS 56 2HZ LYS 56 36.565 28.451 8.067
422 HZ3 LYS 56 3HZ LYS 56 35.008 28.118 8.523
423 H PHE 57 H PHE 57 34.689 29.329 0.963
424 HA PHE 57 HA PHE 57 32.172 27.994 1.139
425 HB2 PHE 57 1HB PHE 57 32.369 30.423 0.782
426 HB3 PHE 57 2HB PHE 57 33.031 30.128 -0.834
427 HD1 PHE 57 HD1 PHE 57 29.935 29.957 1.237
428 HD2 PHE 57 HD2 PHE 57 31.617 29.479 -2.693
429 HE1 PHE 57 HE1 PHE 57 27.633 29.913 0.248
430 HE2 PHE 57 HE2 PHE 57 29.320 29.416 -3.668
431 HZ PHE 57 HZ PHE 57 27.329 29.654 -2.257
432 H SER 58 H SER 58 34.400 28.223 -1.684
433 HA SER 58 HA SER 58 32.803 26.590 -3.378
434 HB2 SER 58 1HB SER 58 34.643 28.094 -4.123
435 HB3 SER 58 2HB SER 58 35.819 27.014 -3.348
436 HG SER 58 HG SER 58 35.730 26.406 -5.454
437 H ARG 59 H ARG 59 35.502 25.724 -1.165
438 HA ARG 59 HA ARG 59 35.632 22.991 -2.007
439 HB2 ARG 59 1HB ARG 59 37.380 24.014 -0.647
440 HB3 ARG 59 2HB ARG 59 36.239 24.305 0.668
441 HG2 ARG 59 1HG ARG 59 36.357 21.462 -0.124
442 HG3 ARG 59 2HG ARG 59 37.933 22.086 0.390
443 HD2 ARG 59 1HD ARG 59 37.161 22.644 2.540
444 HD3 ARG 59 2HD ARG 59 35.460 22.631 2.035
445 HE ARG 59 HE ARG 59 36.290 20.016 1.649
446 HH11 ARG 59 1HH1 ARG 59 36.216 22.175 4.446
447 HH12 ARG 59 2HH1 ARG 59 35.976 20.861 5.564
448 HH21 ARG 59 1HH2 ARG 59 35.944 18.405 3.112
449 HH22 ARG 59 2HH2 ARG 59 35.853 18.765 4.828
450 H VAL 60 H VAL 60 33.768 24.556 0.637
451 HA VAL 60 HA VAL 60 32.568 22.084 1.477
452 HB VAL 60 HB VAL 60 31.677 24.971 1.934
453 HG11 VAL 60 1HG1 VAL 60 30.734 22.337 3.136
454 HG12 VAL 60 2HG1 VAL 60 30.476 23.913 3.918
455 HG13 VAL 60 3HG1 VAL 60 29.770 23.596 2.329
456 HG21 VAL 60 1HG2 VAL 60 33.193 23.029 3.747
457 HG22 VAL 60 2HG2 VAL 60 33.931 24.388 2.873
458 HG23 VAL 60 3HG2 VAL 60 32.735 24.704 4.139
459 H LEU 61 H LEU 61 31.722 24.554 -0.946
460 HA LEU 61 HA LEU 61 29.080 23.785 -1.485
461 HB2 LEU 61 1HB LEU 61 30.568 25.639 -2.551
462 HB3 LEU 61 2HB LEU 61 31.086 24.387 -3.668
463 HG LEU 61 HG LEU 61 28.477 24.077 -4.023
464 HD11 LEU 61 1HD1 LEU 61 27.981 25.710 -2.203
465 HD12 LEU 61 2HD1 LEU 61 27.284 26.154 -3.772
466 HD13 LEU 61 3HD1 LEU 61 28.755 26.978 -3.195
467 HD21 LEU 61 1HD2 LEU 61 30.411 25.138 -5.588
468 HD22 LEU 61 2HD2 LEU 61 29.449 26.608 -5.294
469 HD23 LEU 61 3HD2 LEU 61 28.693 25.182 -6.014
470 H VAL 62 H VAL 62 32.129 22.332 -2.746
471 HA VAL 62 HA VAL 62 30.739 20.407 -4.394
472 HB VAL 62 HB VAL 62 33.556 20.252 -3.187
473 HG11 VAL 62 1HG1 VAL 62 34.021 18.709 -5.105
474 HG12 VAL 62 2HG1 VAL 62 32.819 18.048 -3.982
475 HG13 VAL 62 3HG1 VAL 62 32.292 18.748 -5.530
476 HG21 VAL 62 1HG2 VAL 62 32.595 21.328 -5.860
477 HG22 VAL 62 2HG2 VAL 62 33.306 22.263 -4.526
478 HG23 VAL 62 3HG2 VAL 62 34.296 21.086 -5.401
479 H GLU 63 H GLU 63 32.094 20.319 -1.082
480 HA GLU 63 HA GLU 63 31.669 17.538 -0.647
481 HB2 GLU 63 1HB GLU 63 31.618 19.834 1.347
482 HB3 GLU 63 2HB GLU 63 31.798 18.122 1.760
483 HG2 GLU 63 1HG GLU 63 33.750 19.531 -0.076
484 HG3 GLU 63 2HG GLU 63 33.896 19.631 1.675
485 H GLN 64 H GLN 64 29.537 20.363 0.026
486 HA GLN 64 HA GLN 64 27.440 18.711 1.096
487 HB2 GLN 64 1HB GLN 64 27.210 21.468 -0.163
488 HB3 GLN 64 2HB GLN 64 26.006 20.670 0.852
489 HG2 GLN 64 1HG GLN 64 28.590 21.960 1.628
490 HG3 GLN 64 2HG GLN 64 27.006 22.136 2.350
491 HE21 GLN 64 1HE2 GLN 64 27.469 19.562 4.672
492 HE22 GLN 64 2HE2 GLN 64 26.366 20.702 3.947
493 H GLN 65 H GLN 65 28.271 19.750 -2.229
494 HA GLN 65 HA GLN 65 25.784 18.831 -3.381
495 HB2 GLN 65 1HB GLN 65 28.568 19.212 -4.505
496 HB3 GLN 65 2HB GLN 65 27.263 18.515 -5.465
497 HG2 GLN 65 1HG GLN 65 25.916 20.537 -5.106
498 HG3 GLN 65 2HG GLN 65 27.234 21.264 -4.206
499 HE21 GLN 65 1HE2 GLN 65 28.968 22.306 -7.046
500 HE22 GLN 65 2HE2 GLN 65 28.865 22.258 -5.298
501 H GLN 66 H GLN 66 28.893 17.229 -2.594
502 HA GLN 66 HA GLN 66 28.191 14.740 -3.840
503 HB2 GLN 66 1HB GLN 66 30.076 15.376 -1.545
504 HB3 GLN 66 2HB GLN 66 29.864 13.762 -2.222
505 HG2 GLN 66 1HG GLN 66 30.521 14.694 -4.462
506 HG3 GLN 66 2HG GLN 66 30.969 16.190 -3.632
507 HE21 GLN 66 1HE2 GLN 66 34.004 14.955 -2.436
508 HE22 GLN 66 2HE2 GLN 66 32.913 16.307 -2.598
509 H ASP 67 H ASP 67 27.627 16.030 -0.518
510 HA ASP 67 HA ASP 67 26.498 13.502 0.365
511 HB2 ASP 67 1HB ASP 67 27.408 15.263 1.898
512 HB3 ASP 67 2HB ASP 67 25.980 16.235 1.539
513 H ARG 68 H ARG 68 25.105 16.567 -0.840
514 HA ARG 68 HA ARG 68 22.407 15.880 -0.267
515 HB2 ARG 68 1HB ARG 68 21.816 17.752 -1.347
516 HB3 ARG 68 2HB ARG 68 23.528 18.082 -1.190
517 HG2 ARG 68 1HG ARG 68 23.921 17.527 -3.502
518 HG3 ARG 68 2HG ARG 68 22.245 16.985 -3.698
519 HD2 ARG 68 1HD ARG 68 21.408 19.216 -3.289
520 HD3 ARG 68 2HD ARG 68 23.027 19.791 -2.864
521 HE ARG 68 HE ARG 68 23.583 19.960 -5.100
522 HH11 ARG 68 1HH1 ARG 68 20.475 18.224 -4.915
523 HH12 ARG 68 2HH1 ARG 68 20.190 18.449 -6.618
524 HH21 ARG 68 1HH2 ARG 68 23.117 20.162 -7.243
525 HH22 ARG 68 2HH2 ARG 68 21.652 19.498 -7.904
526 H ALA 69 H ALA 69 24.474 15.139 -2.979
527 HA ALA 69 HA ALA 69 22.562 13.888 -4.661
528 HB1 ALA 69 1HB ALA 69 25.472 13.096 -4.232
529 HB2 ALA 69 2HB ALA 69 24.460 12.654 -5.626
530 HB3 ALA 69 3HB ALA 69 24.889 14.360 -5.339
531 H ARG 70 H ARG 70 24.069 12.653 -1.688
532 HA ARG 70 HA ARG 70 23.175 9.900 -2.130
533 HB2 ARG 70 1HB ARG 70 23.705 11.086 0.595
534 HB3 ARG 70 2HB ARG 70 23.965 9.432 0.047
535 HG2 ARG 70 1HG ARG 70 25.596 11.852 -0.762
536 HG3 ARG 70 2HG ARG 70 26.056 10.699 0.478
537 HD2 ARG 70 1HD ARG 70 26.397 8.963 -1.126
538 HD3 ARG 70 2HD ARG 70 25.597 9.901 -2.414
539 HE ARG 70 HE ARG 70 27.640 11.547 -1.541
540 HH11 ARG 70 1HH1 ARG 70 27.552 8.302 -2.938
541 HH12 ARG 70 2HH1 ARG 70 29.124 8.480 -3.669
542 HH21 ARG 70 1HH2 ARG 70 29.635 11.687 -2.476
543 HH22 ARG 70 2HH2 ARG 70 30.290 10.368 -3.403
544 H ARG 71 H ARG 71 22.031 12.782 -0.366
545 HA ARG 71 HA ARG 71 19.776 11.417 0.844
546 HB2 ARG 71 1HB ARG 71 19.762 14.384 0.288
547 HB3 ARG 71 2HB ARG 71 19.089 13.512 1.657
548 HG2 ARG 71 1HG ARG 71 21.992 14.216 1.142
549 HG3 ARG 71 2HG ARG 71 20.952 14.836 2.413
550 HD2 ARG 71 1HD ARG 71 21.977 11.992 2.160
551 HD3 ARG 71 2HD ARG 71 22.572 13.229 3.279
552 HE ARG 71 HE ARG 71 19.773 12.907 3.675
553 HH11 ARG 71 1HH1 ARG 71 22.783 11.175 4.268
554 HH12 ARG 71 2HH1 ARG 71 22.121 10.290 5.618
555 HH21 ARG 71 1HH2 ARG 71 18.987 11.751 5.404
556 HH22 ARG 71 2HH2 ARG 71 20.004 10.618 6.251
557 H GLU 72 H GLU 72 20.323 13.147 -2.153
558 HA GLU 72 HA GLU 72 17.710 13.853 -2.838
559 HB2 GLU 72 1HB GLU 72 20.099 14.195 -3.993
560 HB3 GLU 72 2HB GLU 72 19.541 12.858 -4.991
561 HG2 GLU 72 1HG GLU 72 18.932 14.833 -6.128
562 HG3 GLU 72 2HG GLU 72 17.440 14.218 -5.397
563 H GLN 73 H GLN 73 19.308 10.724 -3.185
564 HA GLN 73 HA GLN 73 17.474 9.502 -4.964
565 HB2 GLN 73 1HB GLN 73 19.147 8.370 -2.695
566 HB3 GLN 73 2HB GLN 73 18.309 7.377 -3.902
567 HG2 GLN 73 1HG GLN 73 19.670 8.191 -5.680
568 HG3 GLN 73 2HG GLN 73 20.267 9.545 -4.719
569 HE21 GLN 73 1HE2 GLN 73 23.115 7.888 -3.790
570 HE22 GLN 73 2HE2 GLN 73 22.276 9.383 -4.155
571 H GLU 74 H GLU 74 17.310 9.999 -1.434
572 HA GLU 74 HA GLU 74 14.725 8.623 -1.265
573 HB2 GLU 74 1HB GLU 74 16.199 10.404 0.709
574 HB3 GLU 74 2HB GLU 74 14.698 9.535 1.045
575 HG2 GLU 74 1HG GLU 74 17.385 8.289 0.362
576 HG3 GLU 74 2HG GLU 74 16.613 8.329 1.955
577 H ARG 75 H ARG 75 15.892 12.005 -1.488
578 HA ARG 75 HA ARG 75 13.351 13.142 -0.799
579 HB2 ARG 75 1HB ARG 75 15.594 14.394 -2.407
580 HB3 ARG 75 2HB ARG 75 14.254 15.252 -1.636
581 HG2 ARG 75 1HG ARG 75 15.285 13.836 0.495
582 HG3 ARG 75 2HG ARG 75 16.738 14.164 -0.459
583 HD2 ARG 75 1HD ARG 75 16.702 16.027 0.869
584 HD3 ARG 75 2HD ARG 75 15.788 16.624 -0.521
585 HE ARG 75 HE ARG 75 14.630 15.699 2.104
586 HH11 ARG 75 1HH1 ARG 75 14.291 17.668 -0.828
587 HH12 ARG 75 2HH1 ARG 75 12.816 18.400 -0.256
588 HH21 ARG 75 1HH2 ARG 75 12.742 16.605 2.704
589 HH22 ARG 75 2HH2 ARG 75 11.954 17.816 1.715
590 H ILE 76 H ILE 76 14.603 12.082 -3.942
591 HA ILE 76 HA ILE 76 12.613 13.442 -5.513
592 HB ILE 76 HB ILE 76 13.071 11.776 -7.288
593 HG12 ILE 76 1HG1 ILE 76 14.950 10.484 -5.282
594 HG13 ILE 76 2HG1 ILE 76 13.384 9.821 -5.737
595 HG21 ILE 76 1HG2 ILE 76 15.569 12.849 -5.929
596 HG22 ILE 76 2HG2 ILE 76 15.406 12.432 -7.645
597 HG23 ILE 76 3HG2 ILE 76 14.480 13.784 -6.965
598 HD11 ILE 76 1HD1 ILE 76 14.191 9.656 -8.107
599 HD12 ILE 76 2HD1 ILE 76 15.802 10.172 -7.543
600 HD13 ILE 76 3HD1 ILE 76 15.099 8.652 -6.953
601 H ARG 77 H ARG 77 12.340 10.750 -3.385
602 HA ARG 77 HA ARG 77 10.028 9.482 -4.592
603 HB2 ARG 77 1HB ARG 77 10.840 9.689 -1.669
604 HB3 ARG 77 2HB ARG 77 9.619 8.597 -2.312
605 HG2 ARG 77 1HG ARG 77 11.269 7.315 -3.515
606 HG3 ARG 77 2HG ARG 77 12.534 8.514 -3.189
607 HD2 ARG 77 1HD ARG 77 12.788 6.588 -1.695
608 HD3 ARG 77 2HD ARG 77 12.383 8.052 -0.777
609 HE ARG 77 HE ARG 77 9.976 6.698 -1.415
610 HH11 ARG 77 1HH1 ARG 77 12.791 6.275 0.704
611 HH12 ARG 77 2HH1 ARG 77 11.864 5.343 1.857
612 HH21 ARG 77 1HH2 ARG 77 8.890 5.518 0.112
613 HH22 ARG 77 2HH2 ARG 77 9.711 4.931 1.532
614 H LEU 78 H LEU 78 10.520 12.469 -3.047
615 HA LEU 78 HA LEU 78 9.254 14.215 -2.478
616 HB2 LEU 78 1HB LEU 78 8.523 13.699 -4.798
617 HB3 LEU 78 2HB LEU 78 7.179 12.822 -4.142
618 HG LEU 78 HG LEU 78 6.194 14.929 -3.303
619 HD11 LEU 78 1HD1 LEU 78 7.193 17.097 -3.995
620 HD12 LEU 78 2HD1 LEU 78 8.622 16.230 -4.609
621 HD13 LEU 78 3HD1 LEU 78 8.248 16.217 -2.871
622 HD21 LEU 78 1HD2 LEU 78 7.036 15.040 -6.221
623 HD22 LEU 78 2HD2 LEU 78 5.651 15.888 -5.491
624 HD23 LEU 78 3HD2 LEU 78 5.666 14.114 -5.564
625 H PHE 79 H PHE 79 6.892 14.823 -1.603
626 HA PHE 79 HA PHE 79 5.614 14.884 0.236
627 HB2 PHE 79 1HB PHE 79 5.504 11.920 -0.167
628 HB3 PHE 79 2HB PHE 79 4.344 12.940 0.669
629 HD1 PHE 79 HD1 PHE 79 3.116 14.754 -0.733
630 HD2 PHE 79 HD2 PHE 79 5.328 11.496 -2.476
631 HE1 PHE 79 HE1 PHE 79 1.929 15.112 -2.897
632 HE2 PHE 79 HE2 PHE 79 4.155 11.850 -4.642
633 HZ PHE 79 HZ PHE 79 2.460 13.669 -4.864
634 H SER 80 H SER 80 8.513 14.306 0.610
635 HA SER 80 HA SER 80 8.507 12.956 3.234
636 HB2 SER 80 1HB SER 80 10.140 12.162 1.543
637 HB3 SER 80 2HB SER 80 10.823 13.799 1.445
638 HG SER 80 HG SER 80 11.751 13.558 3.343
639 H ALA 81 H ALA 81 8.254 14.199 4.867
640 HA ALA 81 HA ALA 81 9.045 17.067 4.772
641 HB1 ALA 81 1HB ALA 81 7.307 15.546 6.771
642 HB2 ALA 81 2HB ALA 81 7.586 17.301 6.742
643 HB3 ALA 81 3HB ALA 81 6.700 16.522 5.409
644 H ASP 82 H ASP 82 11.207 15.396 4.838
645 HA ASP 82 HA ASP 82 11.987 14.609 7.476
646 HB2 ASP 82 1HB ASP 82 14.335 14.545 6.406
647 HB3 ASP 82 2HB ASP 82 13.099 13.445 5.783
648 HA PRO 83 HA PRO 83 13.132 18.593 9.025
649 HB2 PRO 83 1HB PRO 83 14.372 17.874 11.325
650 HB3 PRO 83 2HB PRO 83 12.626 17.553 11.072
651 HG2 PRO 83 1HG PRO 83 14.971 15.727 10.666
652 HG3 PRO 83 2HG PRO 83 13.481 15.453 11.625
653 HD2 PRO 83 1HD PRO 83 13.749 14.532 9.092
654 HD3 PRO 83 2HD PRO 83 12.172 15.133 9.718
655 H PHE 84 H PHE 84 15.017 19.899 9.790
656 HA PHE 84 HA PHE 84 17.597 18.890 8.740
657 HB2 PHE 84 1HB PHE 84 18.073 21.147 7.852
658 HB3 PHE 84 2HB PHE 84 16.624 20.460 7.107
659 HD1 PHE 84 HD1 PHE 84 17.815 22.873 9.709
660 HD2 PHE 84 HD2 PHE 84 14.479 21.504 7.351
661 HE1 PHE 84 HE1 PHE 84 16.482 24.813 10.482
662 HE2 PHE 84 HE2 PHE 84 13.140 23.466 8.111
663 HZ PHE 84 HZ PHE 84 14.142 25.126 9.683
664 H ASP 85 H ASP 85 15.962 19.948 11.196
665 HA ASP 85 HA ASP 85 17.943 21.628 12.533
666 HB2 ASP 85 1HB ASP 85 16.116 21.639 14.339
667 HB3 ASP 85 2HB ASP 85 15.718 22.371 12.784
668 H LEU 86 H LEU 86 19.012 19.196 11.988
669 HA LEU 86 HA LEU 86 18.805 17.439 14.313
670 HB2 LEU 86 1HB LEU 86 20.696 16.259 13.325
671 HB3 LEU 86 2HB LEU 86 19.439 16.550 12.135
672 HG LEU 86 HG LEU 86 21.115 18.693 11.686
673 HD11 LEU 86 1HD1 LEU 86 22.861 16.271 12.302
674 HD12 LEU 86 2HD1 LEU 86 22.808 17.771 13.257
675 HD13 LEU 86 3HD1 LEU 86 23.400 17.808 11.585
676 HD21 LEU 86 1HD2 LEU 86 21.202 15.931 10.415
677 HD22 LEU 86 2HD2 LEU 86 21.817 17.436 9.690
678 HD23 LEU 86 3HD2 LEU 86 20.079 17.250 9.998
679 H GLU 87 H GLU 87 20.743 20.187 13.277
680 HA GLU 87 HA GLU 87 22.496 19.996 15.632
681 HB2 GLU 87 1HB GLU 87 23.552 22.020 14.745
682 HB3 GLU 87 2HB GLU 87 23.489 20.709 13.572
683 HG2 GLU 87 1HG GLU 87 22.760 22.217 12.113
684 HG3 GLU 87 2HG GLU 87 21.205 22.114 12.944
685 H ALA 88 H ALA 88 19.858 22.001 14.418
686 HA ALA 88 HA ALA 88 18.543 23.597 15.358
687 HB1 ALA 88 1HB ALA 88 18.622 21.571 17.604
688 HB2 ALA 88 2HB ALA 88 17.388 22.838 17.392
689 HB3 ALA 88 3HB ALA 88 17.554 21.552 16.174
690 H GLN 89 H GLN 89 20.887 24.734 15.472
691 HA GLN 89 HA GLN 89 21.404 25.658 18.260
692 HB2 GLN 89 1HB GLN 89 22.857 26.140 15.634
693 HB3 GLN 89 2HB GLN 89 23.372 26.768 17.208
694 HG2 GLN 89 1HG GLN 89 23.122 23.831 16.484
695 HG3 GLN 89 2HG GLN 89 24.629 24.748 16.558
696 HE21 GLN 89 1HE2 GLN 89 23.199 23.043 19.856
697 HE22 GLN 89 2HE2 GLN 89 22.634 22.688 18.234
698 H ALA 90 H ALA 90 21.907 28.055 18.472
699 HA ALA 90 HA ALA 90 20.062 29.701 16.799
700 HB1 ALA 90 1HB ALA 90 18.983 29.251 18.987
701 HB2 ALA 90 2HB ALA 90 20.429 29.862 19.827
702 HB3 ALA 90 3HB ALA 90 19.441 30.965 18.840
703 H LYS 91 H LYS 91 20.866 31.701 16.230
704 HA LYS 91 HA LYS 91 23.756 32.037 16.570
705 HB2 LYS 91 1HB LYS 91 23.585 33.831 15.015
706 HB3 LYS 91 2HB LYS 91 22.548 32.536 14.412
707 HG2 LYS 91 1HG LYS 91 20.542 33.741 15.143
708 HG3 LYS 91 2HG LYS 91 21.543 34.960 15.960
709 HD2 LYS 91 1HD LYS 91 22.607 35.430 13.735
710 HD3 LYS 91 2HD LYS 91 21.317 34.474 12.989
711 HE2 LYS 91 1HE LYS 91 19.642 36.008 13.844
712 HE3 LYS 91 2HE LYS 91 20.855 36.834 14.851
713 HZ1 LYS 91 1HZ LYS 91 20.495 38.107 12.875
714 HZ2 LYS 91 2HZ LYS 91 20.782 36.814 11.893
715 HZ3 LYS 91 3HZ LYS 91 22.015 37.460 12.786
716 H ILE 92 H ILE 92 24.778 33.934 17.349
717 HA ILE 92 HA ILE 92 23.171 35.613 19.178
718 HB ILE 92 HB ILE 92 25.485 35.451 20.535
719 HG12 ILE 92 1HG1 ILE 92 25.109 32.596 19.572
720 HG13 ILE 92 2HG1 ILE 92 26.339 33.691 18.921
721 HG21 ILE 92 1HG2 ILE 92 23.172 35.159 21.439
722 HG22 ILE 92 2HG2 ILE 92 23.173 33.476 20.858
723 HG23 ILE 92 3HG2 ILE 92 24.300 33.984 22.142
724 HD11 ILE 92 1HD1 ILE 92 27.324 33.896 21.216
725 HD12 ILE 92 2HD1 ILE 92 26.152 32.682 21.788
726 HD13 ILE 92 3HD1 ILE 92 27.362 32.241 20.566
727 H GLU 93 H GLU 93 23.271 37.330 17.848
728 HA GLU 93 HA GLU 93 23.929 39.045 16.666
729 HB2 GLU 93 1HB GLU 93 25.195 38.940 19.142
730 HB3 GLU 93 2HB GLU 93 26.382 39.509 17.998
731 HG2 GLU 93 1HG GLU 93 24.722 41.186 17.193
732 HG3 GLU 93 2HG GLU 93 23.627 40.635 18.462
733 H GLU 94 H GLU 94 25.850 40.294 15.576
734 HA GLU 94 HA GLU 94 27.831 38.537 14.310
735 HB2 GLU 94 1HB GLU 94 25.367 39.531 12.878
736 HB3 GLU 94 2HB GLU 94 26.915 39.577 12.042
737 HG2 GLU 94 1HG GLU 94 26.394 37.531 11.331
738 HG3 GLU 94 2HG GLU 94 26.991 37.012 12.908
739 H ASP 95 H ASP 95 29.614 39.744 13.937
740 HA ASP 95 HA ASP 95 29.296 42.540 13.035
741 HB2 ASP 95 1HB ASP 95 29.673 42.678 15.505
742 HB3 ASP 95 2HB ASP 95 31.209 41.828 15.286
743 H ILE 96 H ILE 96 29.821 41.503 11.035
744 HA ILE 96 HA ILE 96 32.492 40.282 10.801
745 HB ILE 96 HB ILE 96 31.825 39.888 8.412
746 HG12 ILE 96 1HG1 ILE 96 29.087 40.942 9.246
747 HG13 ILE 96 2HG1 ILE 96 30.252 41.912 8.343
748 HG21 ILE 96 1HG2 ILE 96 31.371 38.238 10.269
749 HG22 ILE 96 2HG2 ILE 96 29.732 38.915 10.430
750 HG23 ILE 96 3HG2 ILE 96 30.228 38.109 8.920
751 HD11 ILE 96 1HD1 ILE 96 30.225 40.198 6.513
752 HD12 ILE 96 2HD1 ILE 96 28.954 39.321 7.399
753 HD13 ILE 96 3HD1 ILE 96 28.643 40.962 6.793
754 H ARG 97 H ARG 97 32.469 43.025 11.587
755 HA ARG 97 HA ARG 97 33.175 44.620 9.212
756 HB2 ARG 97 1HB ARG 97 32.008 45.399 11.350
757 HB3 ARG 97 2HB ARG 97 33.574 45.282 12.149
758 HG2 ARG 97 1HG ARG 97 34.441 46.963 10.469
759 HG3 ARG 97 2HG ARG 97 32.770 47.138 9.886
760 HD2 ARG 97 1HD ARG 97 32.046 47.727 12.169
761 HD3 ARG 97 2HD ARG 97 33.712 47.537 12.747
762 HE ARG 97 HE ARG 97 33.697 49.407 10.609
763 HH11 ARG 97 1HH1 ARG 97 32.645 49.175 13.965
764 HH12 ARG 97 2HH1 ARG 97 32.798 50.892 14.236
765 HH21 ARG 97 1HH2 ARG 97 33.862 51.593 11.016
766 HH22 ARG 97 2HH2 ARG 97 33.477 52.235 12.589
767 H GLN 98 H GLN 98 34.763 42.420 9.157
768 HA GLN 98 HA GLN 98 37.433 43.607 9.418
769 HB2 GLN 98 1HB GLN 98 36.791 42.294 11.664
770 HB3 GLN 98 2HB GLN 98 37.083 40.871 10.681
771 HG2 GLN 98 1HG GLN 98 39.233 41.172 11.479
772 HG3 GLN 98 2HG GLN 98 39.361 42.164 10.037
773 HE21 GLN 98 1HE2 GLN 98 38.679 45.046 12.580
774 HE22 GLN 98 2HE2 GLN 98 37.506 44.265 11.550
775 HXT GLN 98 HO GLN 98 38.198 41.666 6.827
Start of MODEL 27
1 H1 SER 1 1H SER 1 2.112 4.109 -2.382
2 H2 SER 1 2H SER 1 0.790 4.647 -1.831
3 H3 SER 1 3H SER 1 1.131 4.487 -3.456
4 HA SER 1 HA SER 1 0.782 2.016 -3.214
5 HB2 SER 1 1HB SER 1 -0.415 1.314 -1.133
6 HB3 SER 1 2HB SER 1 1.198 1.983 -0.773
7 HG SER 1 HG SER 1 -1.342 3.005 -0.193
8 H GLN 2 H GLN 2 -0.742 4.940 -3.250
9 HA GLN 2 HA GLN 2 -3.121 3.822 -4.562
10 HB2 GLN 2 1HB GLN 2 -4.705 5.050 -3.147
11 HB3 GLN 2 2HB GLN 2 -3.808 3.869 -2.191
12 HG2 GLN 2 1HG GLN 2 -2.335 5.679 -1.342
13 HG3 GLN 2 2HG GLN 2 -3.261 6.858 -2.281
14 HE21 GLN 2 1HE2 GLN 2 -5.567 7.326 0.254
15 HE22 GLN 2 2HE2 GLN 2 -4.699 7.945 -1.130
16 H GLN 3 H GLN 3 -4.389 5.563 -5.543
17 HA GLN 3 HA GLN 3 -4.667 7.358 -6.854
18 HB2 GLN 3 1HB GLN 3 -2.697 8.769 -5.029
19 HB3 GLN 3 2HB GLN 3 -3.741 9.540 -6.220
20 HG2 GLN 3 1HG GLN 3 -4.665 8.000 -3.774
21 HG3 GLN 3 2HG GLN 3 -4.668 9.757 -3.973
22 HE21 GLN 3 1HE2 GLN 3 -7.510 9.810 -6.104
23 HE22 GLN 3 2HE2 GLN 3 -6.043 10.659 -5.681
24 H SER 4 H SER 4 -1.118 6.962 -6.304
25 HA SER 4 HA SER 4 -0.757 7.193 -9.233
26 HB2 SER 4 1HB SER 4 0.613 9.075 -7.267
27 HB3 SER 4 2HB SER 4 0.900 8.998 -9.017
28 HG SER 4 HG SER 4 -1.688 9.260 -8.749
29 H HIS 5 H HIS 5 1.594 6.980 -9.782
30 HA HIS 5 HA HIS 5 3.047 5.226 -7.845
31 HB2 HIS 5 1HB HIS 5 3.225 5.277 -10.889
32 HB3 HIS 5 2HB HIS 5 4.150 4.223 -9.804
33 HD1 HIS 5 HD1 HIS 5 2.317 2.741 -8.120
34 HD2 HIS 5 HD2 HIS 5 1.137 3.956 -11.926
35 HE1 HIS 5 HE1 HIS 5 0.379 1.265 -8.794
36 H SER 6 H SER 6 5.434 5.632 -9.729
37 HA SER 6 HA SER 6 5.970 8.503 -9.082
38 HB2 SER 6 1HB SER 6 8.315 7.852 -8.747
39 HB3 SER 6 2HB SER 6 7.258 6.957 -7.639
40 HG SER 6 HG SER 6 8.714 6.060 -9.846
41 H SER 7 H SER 7 7.553 9.508 -10.545
42 HA SER 7 HA SER 7 8.035 8.139 -13.110
43 HB2 SER 7 1HB SER 7 6.662 10.858 -12.887
44 HB3 SER 7 2HB SER 7 7.259 10.120 -14.392
45 HG SER 7 HG SER 7 5.722 8.344 -13.128
46 HA PRO 8 HA PRO 8 11.573 10.204 -11.669
47 HB2 PRO 8 1HB PRO 8 13.395 9.834 -13.605
48 HB3 PRO 8 2HB PRO 8 12.721 8.448 -12.703
49 HG2 PRO 8 1HG PRO 8 11.887 9.549 -15.374
50 HG3 PRO 8 2HG PRO 8 12.321 7.863 -14.938
51 HD2 PRO 8 1HD PRO 8 9.737 8.722 -15.011
52 HD3 PRO 8 2HD PRO 8 10.301 7.518 -13.798
53 H GLY 9 H GLY 9 13.121 11.922 -12.072
54 HA2 GLY 9 1HA GLY 9 12.434 13.856 -14.202
55 HA3 GLY 9 2HA GLY 9 12.162 14.363 -12.525
56 H GLU 10 H GLU 10 14.737 12.613 -14.346
57 HA GLU 10 HA GLU 10 16.835 13.687 -12.654
58 HB2 GLU 10 1HB GLU 10 17.076 12.368 -15.385
59 HB3 GLU 10 2HB GLU 10 18.329 12.510 -14.150
60 HG2 GLU 10 1HG GLU 10 17.740 10.395 -13.668
61 HG3 GLU 10 2HG GLU 10 16.472 11.172 -12.713
62 H ILE 11 H ILE 11 15.325 15.902 -13.867
63 HA ILE 11 HA ILE 11 16.843 16.902 -16.036
64 HB ILE 11 HB ILE 11 14.525 17.821 -14.307
65 HG12 ILE 11 1HG1 ILE 11 14.520 16.905 -17.213
66 HG13 ILE 11 2HG1 ILE 11 14.169 15.846 -15.849
67 HG21 ILE 11 1HG2 ILE 11 15.651 19.705 -15.093
68 HG22 ILE 11 2HG2 ILE 11 15.608 19.107 -16.760
69 HG23 ILE 11 3HG2 ILE 11 14.105 19.546 -15.908
70 HD11 ILE 11 1HD1 ILE 11 12.247 17.393 -15.239
71 HD12 ILE 11 2HD1 ILE 11 12.518 18.217 -16.792
72 HD13 ILE 11 3HD1 ILE 11 12.062 16.500 -16.765
73 H THR 12 H THR 12 17.044 16.739 -12.867
74 HA THR 12 HA THR 12 18.104 19.252 -12.022
75 HB THR 12 HB THR 12 19.241 17.176 -10.434
76 HG1 THR 12 HG1 THR 12 16.464 16.711 -10.753
77 HG21 THR 12 1HG2 THR 12 17.623 17.951 -8.770
78 HG22 THR 12 2HG2 THR 12 16.703 18.793 -10.038
79 HG23 THR 12 3HG2 THR 12 18.349 19.331 -9.623
80 H SER 13 H SER 13 19.727 20.078 -13.162
81 HA SER 13 HA SER 13 22.371 18.768 -13.081
82 HB2 SER 13 1HB SER 13 22.635 19.144 -15.559
83 HB3 SER 13 2HB SER 13 21.453 17.882 -15.161
84 HG SER 13 HG SER 13 19.790 19.381 -15.488
85 H SER 14 H SER 14 23.841 20.471 -14.401
86 HA SER 14 HA SER 14 24.814 22.510 -13.472
87 HB2 SER 14 1HB SER 14 23.179 23.131 -15.941
88 HB3 SER 14 2HB SER 14 24.752 23.817 -15.471
89 HG SER 14 HG SER 14 24.927 22.109 -17.011
90 HA PRO 15 HA PRO 15 21.166 24.799 -11.750
91 HB2 PRO 15 1HB PRO 15 22.016 25.084 -9.205
92 HB3 PRO 15 2HB PRO 15 21.346 23.552 -9.819
93 HG2 PRO 15 1HG PRO 15 24.209 24.339 -9.542
94 HG3 PRO 15 2HG PRO 15 23.376 22.889 -8.895
95 HD2 PRO 15 1HD PRO 15 24.733 22.817 -11.225
96 HD3 PRO 15 2HD PRO 15 23.197 21.904 -11.007
97 H GLN 16 H GLN 16 24.330 25.401 -12.229
98 HA GLN 16 HA GLN 16 25.658 27.176 -12.541
99 HB2 GLN 16 1HB GLN 16 23.370 28.205 -13.312
100 HB3 GLN 16 2HB GLN 16 23.594 29.214 -11.869
101 HG2 GLN 16 1HG GLN 16 25.920 29.713 -12.722
102 HG3 GLN 16 2HG GLN 16 25.473 28.882 -14.216
103 HE21 GLN 16 1HE2 GLN 16 24.906 32.659 -14.313
104 HE22 GLN 16 2HE2 GLN 16 26.220 31.717 -13.629
105 H GLY 17 H GLY 17 23.734 27.177 -9.592
106 HA2 GLY 17 1HA GLY 17 25.387 28.954 -8.103
107 HA3 GLY 17 2HA GLY 17 24.382 27.662 -7.428
108 H LEU 18 H LEU 18 25.887 25.576 -9.031
109 HA LEU 18 HA LEU 18 28.202 25.408 -7.206
110 HB2 LEU 18 1HB LEU 18 28.255 23.170 -7.484
111 HB3 LEU 18 2HB LEU 18 26.549 23.550 -7.485
112 HG LEU 18 HG LEU 18 26.747 23.364 -10.079
113 HD11 LEU 18 1HD1 LEU 18 29.139 21.705 -9.175
114 HD12 LEU 18 2HD1 LEU 18 29.227 23.179 -10.147
115 HD13 LEU 18 3HD1 LEU 18 28.439 21.745 -10.817
116 HD21 LEU 18 1HD2 LEU 18 27.008 20.941 -8.268
117 HD22 LEU 18 2HD2 LEU 18 26.250 20.989 -9.878
118 HD23 LEU 18 3HD2 LEU 18 25.519 21.879 -8.524
119 H ASP 19 H ASP 19 27.390 25.885 -10.520
120 HA ASP 19 HA ASP 19 29.999 25.229 -11.566
121 HB2 ASP 19 1HB ASP 19 27.716 26.809 -12.780
122 HB3 ASP 19 2HB ASP 19 29.031 26.022 -13.663
123 H ASN 20 H ASN 20 28.327 28.086 -10.425
124 HA ASN 20 HA ASN 20 30.879 29.630 -10.640
125 HB2 ASN 20 1HB ASN 20 28.012 30.455 -11.239
126 HB3 ASN 20 2HB ASN 20 29.209 31.636 -10.726
127 HD21 ASN 20 1HD2 ASN 20 31.131 31.457 -13.712
128 HD22 ASN 20 2HD2 ASN 20 31.339 31.503 -11.986
129 HA PRO 21 HA PRO 21 29.235 29.152 -6.378
130 HB2 PRO 21 1HB PRO 21 31.620 28.675 -5.140
131 HB3 PRO 21 2HB PRO 21 30.703 27.415 -6.007
132 HG2 PRO 21 1HG PRO 21 32.981 29.021 -6.943
133 HG3 PRO 21 2HG PRO 21 32.728 27.264 -7.039
134 HD2 PRO 21 1HD PRO 21 32.236 28.828 -9.143
135 HD3 PRO 21 2HD PRO 21 31.228 27.394 -8.758
136 H ALA 22 H ALA 22 31.867 31.082 -7.717
137 HA ALA 22 HA ALA 22 32.134 32.862 -5.488
138 HB1 ALA 22 1HB ALA 22 33.813 32.742 -7.290
139 HB2 ALA 22 2HB ALA 22 32.611 33.352 -8.450
140 HB3 ALA 22 3HB ALA 22 33.171 34.393 -7.125
141 H LEU 23 H LEU 23 29.999 32.807 -8.359
142 HA LEU 23 HA LEU 23 28.790 35.359 -7.775
143 HB2 LEU 23 1HB LEU 23 27.672 33.020 -9.365
144 HB3 LEU 23 2HB LEU 23 27.030 34.655 -9.344
145 HG LEU 23 HG LEU 23 29.679 33.770 -10.529
146 HD11 LEU 23 1HD1 LEU 23 28.630 34.371 -12.661
147 HD12 LEU 23 2HD1 LEU 23 27.159 34.907 -11.821
148 HD13 LEU 23 3HD1 LEU 23 27.612 33.190 -11.814
149 HD21 LEU 23 1HD2 LEU 23 28.466 36.545 -10.363
150 HD22 LEU 23 2HD2 LEU 23 29.831 36.084 -11.408
151 HD23 LEU 23 3HD2 LEU 23 29.998 35.994 -9.645
152 H LEU 24 H LEU 24 27.985 31.951 -6.970
153 HA LEU 24 HA LEU 24 25.497 32.610 -5.711
154 HB2 LEU 24 1HB LEU 24 26.088 30.308 -6.332
155 HB3 LEU 24 2HB LEU 24 27.406 30.309 -5.163
156 HG LEU 24 HG LEU 24 25.856 30.447 -3.313
157 HD11 LEU 24 1HD1 LEU 24 23.383 30.267 -3.677
158 HD12 LEU 24 2HD1 LEU 24 23.658 30.615 -5.402
159 HD13 LEU 24 3HD1 LEU 24 24.074 31.823 -4.159
160 HD21 LEU 24 1HD2 LEU 24 24.865 28.359 -5.251
161 HD22 LEU 24 2HD2 LEU 24 24.818 28.300 -3.474
162 HD23 LEU 24 3HD2 LEU 24 26.379 28.247 -4.328
163 H ARG 25 H ARG 25 28.835 32.291 -4.422
164 HA ARG 25 HA ARG 25 28.257 32.841 -1.703
165 HB2 ARG 25 1HB ARG 25 30.473 32.132 -2.623
166 HB3 ARG 25 2HB ARG 25 30.629 33.686 -3.410
167 HG2 ARG 25 1HG ARG 25 30.291 34.512 -0.846
168 HG3 ARG 25 2HG ARG 25 31.057 32.939 -0.573
169 HD2 ARG 25 1HD ARG 25 32.771 34.635 -0.725
170 HD3 ARG 25 2HD ARG 25 32.858 33.612 -2.176
171 HE ARG 25 HE ARG 25 31.238 35.612 -3.019
172 HH11 ARG 25 1HH1 ARG 25 34.367 35.758 -1.397
173 HH12 ARG 25 2HH1 ARG 25 34.790 37.267 -2.168
174 HH21 ARG 25 1HH2 ARG 25 31.812 37.591 -3.912
175 HH22 ARG 25 2HH2 ARG 25 33.376 38.269 -3.561
176 H ASP 26 H ASP 26 28.871 35.039 -4.466
177 HA ASP 26 HA ASP 26 28.804 37.425 -2.905
178 HB2 ASP 26 1HB ASP 26 29.558 36.842 -5.374
179 HB3 ASP 26 2HB ASP 26 27.935 37.398 -5.769
180 H MET 27 H MET 27 26.258 35.734 -4.779
181 HA MET 27 HA MET 27 24.156 37.619 -4.349
182 HB2 MET 27 1HB MET 27 24.130 35.652 -5.910
183 HB3 MET 27 2HB MET 27 23.979 34.581 -4.521
184 HG2 MET 27 1HG MET 27 21.983 36.758 -5.157
185 HG3 MET 27 2HG MET 27 21.864 35.128 -5.814
186 HE1 MET 27 1HE MET 27 20.888 32.930 -2.720
187 HE2 MET 27 2HE MET 27 21.090 32.992 -4.487
188 HE3 MET 27 3HE MET 27 22.510 33.110 -3.422
189 H LEU 28 H LEU 28 25.143 34.732 -2.535
190 HA LEU 28 HA LEU 28 23.191 34.871 -0.501
191 HB2 LEU 28 1HB LEU 28 25.939 33.741 -0.676
192 HB3 LEU 28 2HB LEU 28 25.022 33.674 0.824
193 HG LEU 28 HG LEU 28 23.935 32.587 -1.775
194 HD11 LEU 28 1HD1 LEU 28 26.007 31.523 -1.296
195 HD12 LEU 28 2HD1 LEU 28 24.676 30.415 -0.910
196 HD13 LEU 28 3HD1 LEU 28 25.538 31.269 0.393
197 HD21 LEU 28 1HD2 LEU 28 22.520 31.258 -0.216
198 HD22 LEU 28 2HD2 LEU 28 22.276 32.997 -0.061
199 HD23 LEU 28 3HD2 LEU 28 23.236 32.145 1.152
200 H LEU 29 H LEU 29 26.457 36.318 -0.673
201 HA LEU 29 HA LEU 29 26.459 37.360 2.003
202 HB2 LEU 29 1HB LEU 29 27.863 38.163 -0.551
203 HB3 LEU 29 2HB LEU 29 28.079 39.086 0.931
204 HG LEU 29 HG LEU 29 28.690 36.130 0.766
205 HD11 LEU 29 1HD1 LEU 29 30.555 38.482 0.301
206 HD12 LEU 29 2HD1 LEU 29 30.042 37.278 -0.907
207 HD13 LEU 29 3HD1 LEU 29 31.053 36.780 0.467
208 HD21 LEU 29 1HD2 LEU 29 29.582 38.306 2.691
209 HD22 LEU 29 2HD2 LEU 29 30.106 36.606 2.729
210 HD23 LEU 29 3HD2 LEU 29 28.410 37.014 3.037
211 H ALA 30 H ALA 30 25.237 38.618 -1.058
212 HA ALA 30 HA ALA 30 24.553 41.212 0.089
213 HB1 ALA 30 1HB ALA 30 25.205 40.935 -2.287
214 HB2 ALA 30 2HB ALA 30 23.768 39.923 -2.562
215 HB3 ALA 30 3HB ALA 30 23.579 41.641 -2.133
216 H ASN 31 H ASN 31 23.029 38.113 0.123
217 HA ASN 31 HA ASN 31 20.324 39.373 0.297
218 HB2 ASN 31 1HB ASN 31 20.842 37.578 -1.411
219 HB3 ASN 31 2HB ASN 31 20.988 36.445 -0.072
220 HD21 ASN 31 1HD2 ASN 31 17.504 36.734 -1.622
221 HD22 ASN 31 2HD2 ASN 31 19.090 36.760 -2.365
222 HA PRO 32 HA PRO 32 21.135 38.413 4.618
223 HB2 PRO 32 1HB PRO 32 19.072 39.850 5.725
224 HB3 PRO 32 2HB PRO 32 20.612 40.588 5.174
225 HG2 PRO 32 1HG PRO 32 18.004 40.353 3.675
226 HG3 PRO 32 2HG PRO 32 19.015 41.807 3.954
227 HD2 PRO 32 1HD PRO 32 19.199 40.472 1.671
228 HD3 PRO 32 2HD PRO 32 20.681 41.088 2.482
229 H HIS 33 H HIS 33 18.077 37.936 2.882
230 HA HIS 33 HA HIS 33 16.902 36.301 4.999
231 HB2 HIS 33 1HB HIS 33 15.571 37.560 3.297
232 HB3 HIS 33 2HB HIS 33 16.216 36.499 2.040
233 HD1 HIS 33 HD1 HIS 33 13.688 36.592 4.825
234 HD2 HIS 33 HD2 HIS 33 15.199 33.876 2.049
235 HE1 HIS 33 HE1 HIS 33 12.127 34.603 4.817
236 H GLU 34 H GLU 34 18.644 35.729 1.947
237 HA GLU 34 HA GLU 34 18.222 32.858 2.033
238 HB2 GLU 34 1HB GLU 34 19.423 34.842 0.290
239 HB3 GLU 34 2HB GLU 34 20.409 33.418 0.376
240 HG2 GLU 34 1HG GLU 34 17.449 33.363 -0.243
241 HG3 GLU 34 2HG GLU 34 18.700 33.493 -1.487
242 H LEU 35 H LEU 35 20.887 35.092 2.887
243 HA LEU 35 HA LEU 35 22.732 33.061 3.610
244 HB2 LEU 35 1HB LEU 35 24.052 34.687 4.327
245 HB3 LEU 35 2HB LEU 35 22.996 35.502 3.231
246 HG LEU 35 HG LEU 35 21.818 36.558 5.094
247 HD11 LEU 35 1HD1 LEU 35 22.225 35.216 7.013
248 HD12 LEU 35 2HD1 LEU 35 23.103 36.732 7.253
249 HD13 LEU 35 3HD1 LEU 35 23.986 35.262 6.757
250 HD21 LEU 35 1HD2 LEU 35 23.589 37.525 3.739
251 HD22 LEU 35 2HD2 LEU 35 24.816 36.826 4.811
252 HD23 LEU 35 3HD2 LEU 35 23.727 38.105 5.412
253 H SER 36 H SER 36 19.941 34.354 5.233
254 HA SER 36 HA SER 36 20.564 33.346 7.858
255 HB2 SER 36 1HB SER 36 19.055 35.285 7.433
256 HB3 SER 36 2HB SER 36 17.870 34.161 6.736
257 HG SER 36 HG SER 36 17.357 34.420 8.872
258 H LEU 37 H LEU 37 18.503 32.202 5.118
259 HA LEU 37 HA LEU 37 17.600 29.885 6.585
260 HB2 LEU 37 1HB LEU 37 16.671 29.121 4.659
261 HB3 LEU 37 2HB LEU 37 16.600 30.829 4.619
262 HG LEU 37 HG LEU 37 18.315 30.863 2.845
263 HD11 LEU 37 1HD1 LEU 37 17.643 27.914 2.782
264 HD12 LEU 37 2HD1 LEU 37 19.241 28.637 3.047
265 HD13 LEU 37 3HD1 LEU 37 18.460 28.815 1.474
266 HD21 LEU 37 1HD2 LEU 37 15.640 29.501 2.395
267 HD22 LEU 37 2HD2 LEU 37 16.610 30.309 1.143
268 HD23 LEU 37 3HD2 LEU 37 15.935 31.255 2.483
269 H LEU 38 H LEU 38 20.342 30.705 4.647
270 HA LEU 38 HA LEU 38 21.296 28.076 4.304
271 HB2 LEU 38 1HB LEU 38 21.915 30.144 3.113
272 HB3 LEU 38 2HB LEU 38 22.848 30.655 4.534
273 HG LEU 38 HG LEU 38 24.201 28.554 4.377
274 HD11 LEU 38 1HD1 LEU 38 24.206 27.396 2.188
275 HD12 LEU 38 2HD1 LEU 38 22.760 28.324 1.727
276 HD13 LEU 38 3HD1 LEU 38 22.699 27.186 3.091
277 HD21 LEU 38 1HD2 LEU 38 24.300 30.360 1.965
278 HD22 LEU 38 2HD2 LEU 38 25.624 29.338 2.566
279 HD23 LEU 38 3HD2 LEU 38 25.034 30.694 3.548
280 H LYS 39 H LYS 39 22.062 30.482 6.871
281 HA LYS 39 HA LYS 39 23.733 28.571 8.282
282 HB2 LYS 39 1HB LYS 39 23.435 30.076 10.271
283 HB3 LYS 39 2HB LYS 39 24.169 30.795 8.840
284 HG2 LYS 39 1HG LYS 39 22.140 31.962 8.307
285 HG3 LYS 39 2HG LYS 39 21.242 31.149 9.556
286 HD2 LYS 39 1HD LYS 39 21.734 33.302 10.386
287 HD3 LYS 39 2HD LYS 39 22.852 32.207 11.225
288 HE2 LYS 39 1HE LYS 39 24.650 32.819 9.646
289 HE3 LYS 39 2HE LYS 39 23.520 33.851 8.744
290 HZ1 LYS 39 1HZ LYS 39 23.283 35.217 10.723
291 HZ2 LYS 39 2HZ LYS 39 24.869 35.139 10.272
292 HZ3 LYS 39 3HZ LYS 39 24.332 34.261 11.564
293 H GLU 40 H GLU 40 20.272 29.099 8.243
294 HA GLU 40 HA GLU 40 19.774 27.518 10.629
295 HB2 GLU 40 1HB GLU 40 18.273 28.927 8.555
296 HB3 GLU 40 2HB GLU 40 17.525 27.392 8.956
297 HG2 GLU 40 1HG GLU 40 18.343 29.231 11.183
298 HG3 GLU 40 2HG GLU 40 16.884 29.592 10.241
299 H ARG 41 H ARG 41 19.572 26.836 7.083
300 HA ARG 41 HA ARG 41 19.014 23.992 7.732
301 HB2 ARG 41 1HB ARG 41 19.241 25.391 5.060
302 HB3 ARG 41 2HB ARG 41 18.604 23.767 5.329
303 HG2 ARG 41 1HG ARG 41 17.356 26.275 6.527
304 HG3 ARG 41 2HG ARG 41 16.921 25.603 4.966
305 HD2 ARG 41 1HD ARG 41 15.284 24.754 6.494
306 HD3 ARG 41 2HD ARG 41 16.383 23.404 6.180
307 HE ARG 41 HE ARG 41 17.188 23.528 8.378
308 HH11 ARG 41 1HH1 ARG 41 14.940 26.212 7.857
309 HH12 ARG 41 2HH1 ARG 41 14.954 26.642 9.562
310 HH21 ARG 41 1HH2 ARG 41 17.127 24.155 10.495
311 HH22 ARG 41 2HH2 ARG 41 16.139 25.507 10.999
312 H ASN 42 H ASN 42 21.694 25.807 6.362
313 HA ASN 42 HA ASN 42 23.234 23.233 6.273
314 HB2 ASN 42 1HB ASN 42 22.522 24.184 3.992
315 HB3 ASN 42 2HB ASN 42 23.661 25.472 4.279
316 HD21 ASN 42 1HD2 ASN 42 25.405 22.897 2.349
317 HD22 ASN 42 2HD2 ASN 42 24.147 24.082 2.135
318 HA PRO 43 HA PRO 43 25.297 26.632 8.673
319 HB2 PRO 43 1HB PRO 43 26.327 24.991 10.685
320 HB3 PRO 43 2HB PRO 43 24.812 25.943 10.763
321 HG2 PRO 43 1HG PRO 43 25.192 23.051 10.069
322 HG3 PRO 43 2HG PRO 43 23.980 23.815 11.139
323 HD2 PRO 43 1HD PRO 43 23.355 23.086 8.636
324 HD3 PRO 43 2HD PRO 43 22.724 24.621 9.332
325 HA PRO 44 HA PRO 44 29.401 24.558 8.061
326 HB2 PRO 44 1HB PRO 44 29.771 22.540 6.265
327 HB3 PRO 44 2HB PRO 44 29.441 22.247 8.001
328 HG2 PRO 44 1HG PRO 44 27.525 22.272 5.705
329 HG3 PRO 44 2HG PRO 44 27.779 21.010 6.953
330 HD2 PRO 44 1HD PRO 44 25.802 22.808 7.201
331 HD3 PRO 44 2HD PRO 44 26.762 22.301 8.632
332 H LEU 45 H LEU 45 27.104 24.637 5.241
333 HA LEU 45 HA LEU 45 29.189 25.798 3.541
334 HB2 LEU 45 1HB LEU 45 27.291 24.605 2.546
335 HB3 LEU 45 2HB LEU 45 26.188 25.802 3.224
336 HG LEU 45 HG LEU 45 27.063 27.536 1.775
337 HD11 LEU 45 1HD1 LEU 45 29.445 26.869 1.596
338 HD12 LEU 45 2HD1 LEU 45 28.719 27.080 -0.003
339 HD13 LEU 45 3HD1 LEU 45 28.977 25.446 0.641
340 HD21 LEU 45 1HD2 LEU 45 26.276 26.668 -0.348
341 HD22 LEU 45 2HD2 LEU 45 25.298 25.972 0.955
342 HD23 LEU 45 3HD2 LEU 45 26.565 24.993 0.180
343 H ALA 46 H ALA 46 26.639 26.865 5.711
344 HA ALA 46 HA ALA 46 26.747 29.615 5.024
345 HB1 ALA 46 1HB ALA 46 25.018 28.458 6.402
346 HB2 ALA 46 2HB ALA 46 26.169 28.481 7.755
347 HB3 ALA 46 3HB ALA 46 25.595 30.010 7.052
348 H GLU 47 H GLU 47 28.592 27.840 7.610
349 HA GLU 47 HA GLU 47 29.767 30.213 8.655
350 HB2 GLU 47 1HB GLU 47 31.368 28.807 9.758
351 HB3 GLU 47 2HB GLU 47 29.783 28.027 9.812
352 HG2 GLU 47 1HG GLU 47 30.448 26.536 7.987
353 HG3 GLU 47 2HG GLU 47 32.027 27.322 7.897
354 H ALA 48 H ALA 48 30.650 28.222 5.885
355 HA ALA 48 HA ALA 48 33.192 29.393 5.424
356 HB1 ALA 48 1HB ALA 48 32.423 27.279 4.445
357 HB2 ALA 48 2HB ALA 48 31.190 28.159 3.513
358 HB3 ALA 48 3HB ALA 48 32.903 28.437 3.197
359 H LEU 49 H LEU 49 29.896 30.260 4.457
360 HA LEU 49 HA LEU 49 30.618 32.378 2.647
361 HB2 LEU 49 1HB LEU 49 28.370 31.263 2.759
362 HB3 LEU 49 2HB LEU 49 28.120 31.999 4.336
363 HG LEU 49 HG LEU 49 28.487 34.262 3.097
364 HD11 LEU 49 1HD1 LEU 49 29.233 33.285 0.990
365 HD12 LEU 49 2HD1 LEU 49 27.732 34.191 0.767
366 HD13 LEU 49 3HD1 LEU 49 27.692 32.419 0.824
367 HD21 LEU 49 1HD2 LEU 49 26.404 33.487 4.168
368 HD22 LEU 49 2HD2 LEU 49 25.973 32.628 2.670
369 HD23 LEU 49 3HD2 LEU 49 26.107 34.401 2.679
370 H LEU 50 H LEU 50 29.821 32.229 6.132
371 HA LEU 50 HA LEU 50 29.723 35.049 6.571
372 HB2 LEU 50 1HB LEU 50 30.726 33.016 8.584
373 HB3 LEU 50 2HB LEU 50 29.965 34.561 8.913
374 HG LEU 50 HG LEU 50 28.716 31.984 8.068
375 HD11 LEU 50 1HD1 LEU 50 29.150 32.291 10.402
376 HD12 LEU 50 2HD1 LEU 50 27.413 32.239 10.066
377 HD13 LEU 50 3HD1 LEU 50 28.208 33.804 10.393
378 HD21 LEU 50 1HD2 LEU 50 27.582 33.525 6.652
379 HD22 LEU 50 2HD2 LEU 50 27.361 34.675 8.000
380 HD23 LEU 50 3HD2 LEU 50 26.512 33.105 7.994
381 H SER 51 H SER 51 32.327 32.777 6.305
382 HA SER 51 HA SER 51 34.343 34.474 7.518
383 HB2 SER 51 1HB SER 51 34.240 31.930 7.405
384 HB3 SER 51 2HB SER 51 34.690 32.087 5.701
385 HG SER 51 HG SER 51 36.515 33.427 6.618
386 H GLY 52 H GLY 52 32.879 34.332 4.375
387 HA2 GLY 52 1HA GLY 52 33.261 35.827 2.639
388 HA3 GLY 52 2HA GLY 52 34.728 36.390 3.443
389 H ASP 53 H ASP 53 35.833 33.682 3.678
390 HA ASP 53 HA ASP 53 37.430 33.605 1.377
391 HB2 ASP 53 1HB ASP 53 37.148 32.110 3.780
392 HB3 ASP 53 2HB ASP 53 37.418 31.029 2.399
393 H LEU 54 H LEU 54 36.748 33.371 -0.646
394 HA LEU 54 HA LEU 54 34.502 31.759 -1.413
395 HB2 LEU 54 1HB LEU 54 35.496 33.514 -2.847
396 HB3 LEU 54 2HB LEU 54 36.958 32.557 -3.020
397 HG LEU 54 HG LEU 54 35.206 32.634 -4.905
398 HD11 LEU 54 1HD1 LEU 54 35.861 30.479 -5.758
399 HD12 LEU 54 2HD1 LEU 54 36.327 29.939 -4.133
400 HD13 LEU 54 3HD1 LEU 54 37.233 31.241 -4.931
401 HD21 LEU 54 1HD2 LEU 54 33.926 30.379 -3.341
402 HD22 LEU 54 2HD2 LEU 54 33.518 30.897 -4.978
403 HD23 LEU 54 3HD2 LEU 54 33.208 31.979 -3.609
404 H GLU 55 H GLU 55 37.961 31.183 -0.888
405 HA GLU 55 HA GLU 55 38.259 28.651 -2.039
406 HB2 GLU 55 1HB GLU 55 39.387 29.706 0.581
407 HB3 GLU 55 2HB GLU 55 39.984 28.276 -0.267
408 HG2 GLU 55 1HG GLU 55 39.924 31.005 -1.562
409 HG3 GLU 55 2HG GLU 55 41.246 30.460 -0.527
410 H LYS 56 H LYS 56 37.279 29.355 1.360
411 HA LYS 56 HA LYS 56 36.800 26.550 1.834
412 HB2 LYS 56 1HB LYS 56 36.088 27.156 4.034
413 HB3 LYS 56 2HB LYS 56 37.520 28.134 3.582
414 HG2 LYS 56 1HG LYS 56 35.855 29.937 3.069
415 HG3 LYS 56 2HG LYS 56 34.728 28.976 3.986
416 HD2 LYS 56 1HD LYS 56 37.466 29.682 5.049
417 HD3 LYS 56 2HD LYS 56 36.077 30.731 5.256
418 HE2 LYS 56 1HE LYS 56 34.856 28.858 6.397
419 HE3 LYS 56 2HE LYS 56 36.342 27.890 6.295
420 HZ1 LYS 56 1HZ LYS 56 37.461 29.533 7.635
421 HZ2 LYS 56 2HZ LYS 56 36.089 29.072 8.429
422 HZ3 LYS 56 3HZ LYS 56 36.147 30.528 7.645
423 H PHE 57 H PHE 57 34.819 29.308 0.863
424 HA PHE 57 HA PHE 57 32.286 28.027 1.235
425 HB2 PHE 57 1HB PHE 57 32.524 30.444 0.824
426 HB3 PHE 57 2HB PHE 57 33.131 30.109 -0.803
427 HD1 PHE 57 HD1 PHE 57 31.651 29.427 -2.608
428 HD2 PHE 57 HD2 PHE 57 30.131 30.073 1.366
429 HE1 PHE 57 HE1 PHE 57 29.330 29.421 -3.502
430 HE2 PHE 57 HE2 PHE 57 27.802 30.060 0.476
431 HZ PHE 57 HZ PHE 57 27.405 29.732 -1.969
432 H SER 58 H SER 58 34.397 28.226 -1.683
433 HA SER 58 HA SER 58 32.665 26.615 -3.293
434 HB2 SER 58 1HB SER 58 34.470 28.118 -4.150
435 HB3 SER 58 2HB SER 58 35.682 27.005 -3.486
436 HG SER 58 HG SER 58 35.374 26.468 -5.614
437 H ARG 59 H ARG 59 35.460 25.840 -1.174
438 HA ARG 59 HA ARG 59 35.606 23.107 -1.988
439 HB2 ARG 59 1HB ARG 59 37.378 24.292 -0.748
440 HB3 ARG 59 2HB ARG 59 36.345 24.362 0.681
441 HG2 ARG 59 1HG ARG 59 36.720 21.638 -0.456
442 HG3 ARG 59 2HG ARG 59 38.215 22.390 0.120
443 HD2 ARG 59 1HD ARG 59 37.438 22.546 2.331
444 HD3 ARG 59 2HD ARG 59 35.739 22.364 1.853
445 HE ARG 59 HE ARG 59 36.475 19.976 1.120
446 HH11 ARG 59 1HH1 ARG 59 37.798 21.628 3.968
447 HH12 ARG 59 2HH1 ARG 59 38.117 20.122 4.785
448 HH21 ARG 59 1HH2 ARG 59 36.886 18.152 2.203
449 HH22 ARG 59 2HH2 ARG 59 37.619 18.176 3.799
450 H VAL 60 H VAL 60 33.871 24.598 0.816
451 HA VAL 60 HA VAL 60 32.849 22.040 1.637
452 HB VAL 60 HB VAL 60 33.071 24.095 3.141
453 HG11 VAL 60 1HG1 VAL 60 30.503 24.852 1.905
454 HG12 VAL 60 2HG1 VAL 60 31.306 25.623 3.281
455 HG13 VAL 60 3HG1 VAL 60 32.052 25.692 1.681
456 HG21 VAL 60 1HG2 VAL 60 31.161 23.484 4.520
457 HG22 VAL 60 2HG2 VAL 60 30.376 22.697 3.126
458 HG23 VAL 60 3HG2 VAL 60 31.880 22.027 3.803
459 H LEU 61 H LEU 61 31.791 24.486 -0.675
460 HA LEU 61 HA LEU 61 29.110 23.601 -1.026
461 HB2 LEU 61 1HB LEU 61 30.302 25.635 -1.976
462 HB3 LEU 61 2HB LEU 61 31.013 24.573 -3.161
463 HG LEU 61 HG LEU 61 28.316 24.136 -3.546
464 HD11 LEU 61 1HD1 LEU 61 27.288 26.322 -3.591
465 HD12 LEU 61 2HD1 LEU 61 28.796 27.091 -3.049
466 HD13 LEU 61 3HD1 LEU 61 27.883 26.028 -1.946
467 HD21 LEU 61 1HD2 LEU 61 28.779 25.980 -5.385
468 HD22 LEU 61 2HD2 LEU 61 29.695 24.444 -5.411
469 HD23 LEU 61 3HD2 LEU 61 30.423 25.920 -4.740
470 H VAL 62 H VAL 62 32.220 22.472 -2.445
471 HA VAL 62 HA VAL 62 30.962 20.470 -4.116
472 HB VAL 62 HB VAL 62 33.832 20.668 -3.128
473 HG11 VAL 62 1HG1 VAL 62 33.379 18.371 -3.838
474 HG12 VAL 62 2HG1 VAL 62 32.563 18.943 -5.313
475 HG13 VAL 62 3HG1 VAL 62 34.317 19.180 -5.106
476 HG21 VAL 62 1HG2 VAL 62 34.244 21.594 -5.358
477 HG22 VAL 62 2HG2 VAL 62 32.505 21.473 -5.736
478 HG23 VAL 62 3HG2 VAL 62 33.068 22.569 -4.469
479 H GLU 63 H GLU 63 32.347 20.465 -0.844
480 HA GLU 63 HA GLU 63 32.102 17.640 -0.375
481 HB2 GLU 63 1HB GLU 63 31.640 19.919 1.594
482 HB3 GLU 63 2HB GLU 63 31.834 18.220 2.025
483 HG2 GLU 63 1HG GLU 63 33.923 20.019 0.777
484 HG3 GLU 63 2HG GLU 63 33.871 19.482 2.449
485 H GLN 64 H GLN 64 29.746 20.321 -0.120
486 HA GLN 64 HA GLN 64 27.562 18.624 0.718
487 HB2 GLN 64 1HB GLN 64 27.630 21.363 -0.582
488 HB3 GLN 64 2HB GLN 64 26.146 20.568 -0.061
489 HG2 GLN 64 1HG GLN 64 28.468 21.263 1.772
490 HG3 GLN 64 2HG GLN 64 27.001 22.223 1.582
491 HE21 GLN 64 1HE2 GLN 64 27.024 19.473 4.362
492 HE22 GLN 64 2HE2 GLN 64 28.408 20.301 3.691
493 H GLN 65 H GLN 65 28.819 19.573 -2.529
494 HA GLN 65 HA GLN 65 26.564 18.519 -3.969
495 HB2 GLN 65 1HB GLN 65 29.463 18.487 -4.883
496 HB3 GLN 65 2HB GLN 65 28.041 18.244 -5.889
497 HG2 GLN 65 1HG GLN 65 29.025 20.773 -4.639
498 HG3 GLN 65 2HG GLN 65 28.746 20.420 -6.321
499 HE21 GLN 65 1HE2 GLN 65 26.016 22.360 -4.337
500 HE22 GLN 65 2HE2 GLN 65 27.716 22.259 -3.965
501 H GLN 66 H GLN 66 29.549 16.999 -2.720
502 HA GLN 66 HA GLN 66 29.106 14.453 -3.960
503 HB2 GLN 66 1HB GLN 66 30.468 15.163 -1.330
504 HB3 GLN 66 2HB GLN 66 30.534 13.578 -2.092
505 HG2 GLN 66 1HG GLN 66 31.722 14.511 -4.009
506 HG3 GLN 66 2HG GLN 66 31.616 16.128 -3.303
507 HE21 GLN 66 1HE2 GLN 66 34.492 15.736 -1.407
508 HE22 GLN 66 2HE2 GLN 66 33.376 16.778 -2.259
509 H ASP 67 H ASP 67 28.005 15.877 -0.871
510 HA ASP 67 HA ASP 67 26.899 13.354 0.007
511 HB2 ASP 67 1HB ASP 67 27.756 15.263 1.454
512 HB3 ASP 67 2HB ASP 67 26.229 16.081 1.103
513 H ARG 68 H ARG 68 25.514 16.331 -1.419
514 HA ARG 68 HA ARG 68 22.804 15.496 -1.013
515 HB2 ARG 68 1HB ARG 68 22.143 17.165 -2.573
516 HB3 ARG 68 2HB ARG 68 23.403 17.796 -1.527
517 HG2 ARG 68 1HG ARG 68 24.311 18.649 -3.345
518 HG3 ARG 68 2HG ARG 68 24.813 17.018 -3.758
519 HD2 ARG 68 1HD ARG 68 22.949 16.705 -5.233
520 HD3 ARG 68 2HD ARG 68 22.121 18.140 -4.592
521 HE ARG 68 HE ARG 68 24.615 18.996 -5.609
522 HH11 ARG 68 1HH1 ARG 68 21.611 17.648 -6.972
523 HH12 ARG 68 2HH1 ARG 68 21.851 18.508 -8.472
524 HH21 ARG 68 1HH2 ARG 68 24.810 19.999 -7.520
525 HH22 ARG 68 2HH2 ARG 68 23.623 19.783 -8.787
526 H ALA 69 H ALA 69 25.031 15.064 -3.673
527 HA ALA 69 HA ALA 69 23.337 13.826 -5.522
528 HB1 ALA 69 1HB ALA 69 25.631 14.478 -6.049
529 HB2 ALA 69 2HB ALA 69 26.276 13.240 -4.944
530 HB3 ALA 69 3HB ALA 69 25.399 12.755 -6.418
531 H ARG 70 H ARG 70 24.756 12.373 -2.600
532 HA ARG 70 HA ARG 70 24.266 9.635 -3.340
533 HB2 ARG 70 1HB ARG 70 24.429 10.963 -0.606
534 HB3 ARG 70 2HB ARG 70 24.445 9.216 -0.873
535 HG2 ARG 70 1HG ARG 70 26.566 9.271 -1.890
536 HG3 ARG 70 2HG ARG 70 26.459 11.005 -2.208
537 HD2 ARG 70 1HD ARG 70 26.477 11.393 0.283
538 HD3 ARG 70 2HD ARG 70 26.857 9.671 0.487
539 HE ARG 70 HE ARG 70 28.756 10.494 -1.298
540 HH11 ARG 70 1HH1 ARG 70 27.791 11.902 1.812
541 HH12 ARG 70 2HH1 ARG 70 29.405 12.494 2.122
542 HH21 ARG 70 1HH2 ARG 70 30.763 11.316 -0.826
543 HH22 ARG 70 2HH2 ARG 70 31.038 12.197 0.650
544 H ARG 71 H ARG 71 22.343 11.939 -1.383
545 HA ARG 71 HA ARG 71 20.162 9.997 -1.083
546 HB2 ARG 71 1HB ARG 71 18.935 12.022 -0.151
547 HB3 ARG 71 2HB ARG 71 20.368 11.479 0.722
548 HG2 ARG 71 1HG ARG 71 21.689 13.293 -0.312
549 HG3 ARG 71 2HG ARG 71 20.233 13.873 -1.143
550 HD2 ARG 71 1HD ARG 71 19.220 14.541 0.865
551 HD3 ARG 71 2HD ARG 71 20.261 13.499 1.849
552 HE ARG 71 HE ARG 71 20.888 16.181 0.846
553 HH11 ARG 71 1HH1 ARG 71 22.247 13.230 2.250
554 HH12 ARG 71 2HH1 ARG 71 23.681 14.066 2.817
555 HH21 ARG 71 1HH2 ARG 71 22.763 17.150 1.631
556 HH22 ARG 71 2HH2 ARG 71 23.956 16.181 2.476
557 H GLU 72 H GLU 72 21.062 12.502 -3.283
558 HA GLU 72 HA GLU 72 18.554 13.126 -4.418
559 HB2 GLU 72 1HB GLU 72 20.799 14.221 -4.728
560 HB3 GLU 72 2HB GLU 72 21.167 12.980 -5.919
561 HG2 GLU 72 1HG GLU 72 19.595 13.825 -7.404
562 HG3 GLU 72 2HG GLU 72 18.691 14.656 -6.115
563 H GLN 73 H GLN 73 20.649 10.319 -4.961
564 HA GLN 73 HA GLN 73 19.603 9.420 -7.420
565 HB2 GLN 73 1HB GLN 73 20.365 7.716 -5.012
566 HB3 GLN 73 2HB GLN 73 20.239 7.162 -6.685
567 HG2 GLN 73 1HG GLN 73 22.252 9.125 -5.570
568 HG3 GLN 73 2HG GLN 73 22.565 7.468 -6.078
569 HE21 GLN 73 1HE2 GLN 73 22.942 10.402 -8.711
570 HE22 GLN 73 2HE2 GLN 73 22.923 10.597 -6.968
571 H GLU 74 H GLU 74 18.285 9.062 -4.121
572 HA GLU 74 HA GLU 74 16.032 7.481 -5.093
573 HB2 GLU 74 1HB GLU 74 16.445 8.838 -2.409
574 HB3 GLU 74 2HB GLU 74 15.212 7.634 -2.804
575 HG2 GLU 74 1HG GLU 74 18.217 7.235 -2.659
576 HG3 GLU 74 2HG GLU 74 16.978 6.512 -1.620
577 H ARG 75 H ARG 75 16.694 10.894 -4.485
578 HA ARG 75 HA ARG 75 13.931 11.702 -4.360
579 HB2 ARG 75 1HB ARG 75 16.402 13.267 -5.174
580 HB3 ARG 75 2HB ARG 75 14.790 13.960 -5.001
581 HG2 ARG 75 1HG ARG 75 14.801 13.174 -2.599
582 HG3 ARG 75 2HG ARG 75 16.514 12.761 -2.825
583 HD2 ARG 75 1HD ARG 75 16.457 14.968 -1.900
584 HD3 ARG 75 2HD ARG 75 16.877 15.137 -3.619
585 HE ARG 75 HE ARG 75 14.019 15.335 -3.114
586 HH11 ARG 75 1HH1 ARG 75 17.002 17.224 -3.233
587 HH12 ARG 75 2HH1 ARG 75 16.149 18.720 -3.496
588 HH21 ARG 75 1HH2 ARG 75 13.008 17.286 -3.451
589 HH22 ARG 75 2HH2 ARG 75 13.934 18.752 -3.621
590 H ILE 76 H ILE 76 16.287 11.618 -7.062
591 HA ILE 76 HA ILE 76 14.594 12.902 -8.933
592 HB ILE 76 HB ILE 76 16.091 12.014 -10.679
593 HG12 ILE 76 1HG1 ILE 76 17.293 10.400 -8.399
594 HG13 ILE 76 2HG1 ILE 76 16.428 9.746 -9.783
595 HG21 ILE 76 1HG2 ILE 76 18.083 13.175 -9.900
596 HG22 ILE 76 2HG2 ILE 76 16.646 14.013 -9.289
597 HG23 ILE 76 3HG2 ILE 76 17.588 12.964 -8.206
598 HD11 ILE 76 1HD1 ILE 76 18.773 9.391 -10.152
599 HD12 ILE 76 2HD1 ILE 76 18.276 10.687 -11.258
600 HD13 ILE 76 3HD1 ILE 76 19.165 11.081 -9.769
601 H ARG 77 H ARG 77 14.357 9.705 -7.735
602 HA ARG 77 HA ARG 77 13.129 8.459 -10.017
603 HB2 ARG 77 1HB ARG 77 12.612 7.890 -7.078
604 HB3 ARG 77 2HB ARG 77 12.352 6.801 -8.442
605 HG2 ARG 77 1HG ARG 77 14.888 7.042 -8.872
606 HG3 ARG 77 2HG ARG 77 14.951 7.754 -7.253
607 HD2 ARG 77 1HD ARG 77 13.719 5.638 -6.456
608 HD3 ARG 77 2HD ARG 77 14.139 4.944 -8.032
609 HE ARG 77 HE ARG 77 15.873 5.324 -5.736
610 HH11 ARG 77 1HH1 ARG 77 15.977 5.237 -9.284
611 HH12 ARG 77 2HH1 ARG 77 17.668 4.815 -9.304
612 HH21 ARG 77 1HH2 ARG 77 18.006 4.813 -5.853
613 HH22 ARG 77 2HH2 ARG 77 18.789 4.575 -7.404
614 H LEU 78 H LEU 78 11.949 10.880 -7.896
615 HA LEU 78 HA LEU 78 9.220 10.625 -9.044
616 HB2 LEU 78 1HB LEU 78 9.579 9.371 -6.795
617 HB3 LEU 78 2HB LEU 78 9.589 10.963 -6.068
618 HG LEU 78 HG LEU 78 7.276 9.824 -7.659
619 HD11 LEU 78 1HD1 LEU 78 7.802 8.475 -5.665
620 HD12 LEU 78 2HD1 LEU 78 6.268 9.347 -5.463
621 HD13 LEU 78 3HD1 LEU 78 7.740 9.939 -4.656
622 HD21 LEU 78 1HD2 LEU 78 7.476 12.256 -5.861
623 HD22 LEU 78 2HD2 LEU 78 5.935 11.523 -6.366
624 HD23 LEU 78 3HD2 LEU 78 7.028 12.205 -7.579
625 H PHE 79 H PHE 79 11.452 12.440 -6.974
626 HA PHE 79 HA PHE 79 9.935 14.965 -7.445
627 HB2 PHE 79 1HB PHE 79 12.171 14.451 -5.454
628 HB3 PHE 79 2HB PHE 79 10.990 15.767 -5.439
629 HD1 PHE 79 HD1 PHE 79 11.721 12.342 -4.432
630 HD2 PHE 79 HD2 PHE 79 8.582 15.258 -4.838
631 HE1 PHE 79 HE1 PHE 79 10.286 10.994 -2.908
632 HE2 PHE 79 HE2 PHE 79 7.137 13.920 -3.310
633 HZ PHE 79 HZ PHE 79 7.988 11.782 -2.341
634 H SER 80 H SER 80 11.757 16.840 -7.041
635 HA SER 80 HA SER 80 13.485 18.033 -7.847
636 HB2 SER 80 1HB SER 80 14.833 15.321 -7.892
637 HB3 SER 80 2HB SER 80 15.671 16.875 -8.084
638 HG SER 80 HG SER 80 15.060 17.476 -6.077
639 H ALA 81 H ALA 81 11.612 17.310 -9.859
640 HA ALA 81 HA ALA 81 13.170 17.052 -12.335
641 HB1 ALA 81 1HB ALA 81 10.822 16.217 -12.184
642 HB2 ALA 81 2HB ALA 81 10.264 17.874 -11.841
643 HB3 ALA 81 3HB ALA 81 10.985 17.487 -13.417
644 H ASP 82 H ASP 82 14.196 19.005 -10.633
645 HA ASP 82 HA ASP 82 13.032 21.613 -11.143
646 HB2 ASP 82 1HB ASP 82 15.672 20.811 -9.856
647 HB3 ASP 82 2HB ASP 82 14.934 22.417 -9.779
648 HA PRO 83 HA PRO 83 15.335 22.353 -14.828
649 HB2 PRO 83 1HB PRO 83 15.243 25.055 -15.063
650 HB3 PRO 83 2HB PRO 83 13.755 24.056 -15.138
651 HG2 PRO 83 1HG PRO 83 14.931 25.511 -12.778
652 HG3 PRO 83 2HG PRO 83 13.267 25.606 -13.442
653 HD2 PRO 83 1HD PRO 83 13.878 23.992 -11.354
654 HD3 PRO 83 2HD PRO 83 12.691 23.492 -12.608
655 H PHE 84 H PHE 84 17.178 23.620 -15.800
656 HA PHE 84 HA PHE 84 19.359 24.018 -13.813
657 HB2 PHE 84 1HB PHE 84 20.851 23.212 -15.629
658 HB3 PHE 84 2HB PHE 84 19.642 22.006 -15.185
659 HD1 PHE 84 HD1 PHE 84 20.605 24.502 -17.781
660 HD2 PHE 84 HD2 PHE 84 17.977 21.247 -16.757
661 HE1 PHE 84 HE1 PHE 84 19.844 24.389 -20.142
662 HE2 PHE 84 HE2 PHE 84 17.208 21.123 -19.128
663 HZ PHE 84 HZ PHE 84 18.137 22.703 -20.825
664 H ASP 85 H ASP 85 17.346 25.737 -15.404
665 HA ASP 85 HA ASP 85 17.146 27.739 -16.407
666 HB2 ASP 85 1HB ASP 85 18.614 28.445 -14.511
667 HB3 ASP 85 2HB ASP 85 19.994 28.329 -15.612
668 H LEU 86 H LEU 86 16.838 27.650 -18.460
669 HA LEU 86 HA LEU 86 18.694 26.505 -20.322
670 HB2 LEU 86 1HB LEU 86 17.117 27.477 -22.020
671 HB3 LEU 86 2HB LEU 86 16.402 26.378 -20.847
672 HG LEU 86 HG LEU 86 16.027 28.921 -19.712
673 HD11 LEU 86 1HD1 LEU 86 16.635 29.903 -21.928
674 HD12 LEU 86 2HD1 LEU 86 14.950 30.224 -21.473
675 HD13 LEU 86 3HD1 LEU 86 15.322 28.967 -22.678
676 HD21 LEU 86 1HD2 LEU 86 13.657 28.477 -20.187
677 HD22 LEU 86 2HD2 LEU 86 14.480 27.008 -19.624
678 HD23 LEU 86 3HD2 LEU 86 14.114 27.213 -21.354
679 H GLU 87 H GLU 87 18.188 29.788 -19.126
680 HA GLU 87 HA GLU 87 19.863 30.977 -21.247
681 HB2 GLU 87 1HB GLU 87 18.781 32.070 -18.617
682 HB3 GLU 87 2HB GLU 87 19.747 33.012 -19.754
683 HG2 GLU 87 1HG GLU 87 17.168 31.709 -20.639
684 HG3 GLU 87 2HG GLU 87 17.159 33.237 -19.754
685 H ALA 88 H ALA 88 20.036 30.276 -17.768
686 HA ALA 88 HA ALA 88 21.742 30.343 -16.245
687 HB1 ALA 88 1HB ALA 88 23.596 28.775 -16.775
688 HB2 ALA 88 2HB ALA 88 21.989 28.108 -17.151
689 HB3 ALA 88 3HB ALA 88 23.034 28.718 -18.466
690 H GLN 89 H GLN 89 21.612 32.695 -17.387
691 HA GLN 89 HA GLN 89 23.895 33.595 -18.835
692 HB2 GLN 89 1HB GLN 89 22.882 35.792 -18.615
693 HB3 GLN 89 2HB GLN 89 21.660 34.578 -19.001
694 HG2 GLN 89 1HG GLN 89 20.935 34.524 -16.647
695 HG3 GLN 89 2HG GLN 89 22.171 35.723 -16.231
696 HE21 GLN 89 1HE2 GLN 89 18.613 36.890 -17.652
697 HE22 GLN 89 2HE2 GLN 89 18.983 35.239 -17.222
698 H ALA 90 H ALA 90 25.080 35.564 -18.278
699 HA ALA 90 HA ALA 90 26.641 36.724 -17.178
700 HB1 ALA 90 1HB ALA 90 26.248 37.419 -14.907
701 HB2 ALA 90 2HB ALA 90 24.697 37.348 -15.778
702 HB3 ALA 90 3HB ALA 90 25.135 36.057 -14.634
703 H LYS 91 H LYS 91 28.683 36.517 -16.601
704 HA LYS 91 HA LYS 91 29.535 34.129 -15.055
705 HB2 LYS 91 1HB LYS 91 30.614 35.066 -17.746
706 HB3 LYS 91 2HB LYS 91 31.372 33.844 -16.736
707 HG2 LYS 91 1HG LYS 91 28.571 33.580 -17.893
708 HG3 LYS 91 2HG LYS 91 30.017 32.907 -18.647
709 HD2 LYS 91 1HD LYS 91 30.359 31.338 -16.887
710 HD3 LYS 91 2HD LYS 91 29.243 32.175 -15.795
711 HE2 LYS 91 1HE LYS 91 28.164 31.128 -18.399
712 HE3 LYS 91 2HE LYS 91 28.491 29.978 -17.084
713 HZ1 LYS 91 1HZ LYS 91 26.892 32.415 -16.605
714 HZ2 LYS 91 2HZ LYS 91 26.959 31.044 -15.703
715 HZ3 LYS 91 3HZ LYS 91 26.182 31.030 -17.162
716 H ILE 92 H ILE 92 32.270 34.664 -15.208
717 HA ILE 92 HA ILE 92 32.408 37.278 -13.798
718 HB ILE 92 HB ILE 92 34.246 34.842 -13.522
719 HG12 ILE 92 1HG1 ILE 92 32.241 35.839 -11.472
720 HG13 ILE 92 2HG1 ILE 92 31.852 34.567 -12.629
721 HG21 ILE 92 1HG2 ILE 92 34.080 37.432 -11.878
722 HG22 ILE 92 2HG2 ILE 92 35.190 36.075 -11.568
723 HG23 ILE 92 3HG2 ILE 92 35.358 37.033 -13.049
724 HD11 ILE 92 1HD1 ILE 92 33.818 33.250 -11.748
725 HD12 ILE 92 2HD1 ILE 92 33.943 34.462 -10.445
726 HD13 ILE 92 3HD1 ILE 92 32.468 33.485 -10.616
727 H GLU 93 H GLU 93 33.150 38.715 -15.202
728 HA GLU 93 HA GLU 93 35.506 38.024 -16.870
729 HB2 GLU 93 1HB GLU 93 34.476 39.456 -18.638
730 HB3 GLU 93 2HB GLU 93 33.627 37.943 -18.338
731 HG2 GLU 93 1HG GLU 93 31.977 39.234 -16.917
732 HG3 GLU 93 2HG GLU 93 32.758 40.723 -17.475
733 H GLU 94 H GLU 94 37.113 39.517 -16.836
734 HA GLU 94 HA GLU 94 36.621 42.272 -15.924
735 HB2 GLU 94 1HB GLU 94 37.974 40.159 -14.264
736 HB3 GLU 94 2HB GLU 94 38.751 41.738 -14.360
737 HG2 GLU 94 1HG GLU 94 36.533 42.749 -13.636
738 HG3 GLU 94 2HG GLU 94 36.021 41.095 -13.245
739 H ASP 95 H ASP 95 38.326 43.648 -16.483
740 HA ASP 95 HA ASP 95 40.907 42.478 -17.271
741 HB2 ASP 95 1HB ASP 95 39.557 42.716 -19.423
742 HB3 ASP 95 2HB ASP 95 39.568 44.464 -19.141
743 H ILE 96 H ILE 96 40.128 43.710 -14.949
744 HA ILE 96 HA ILE 96 40.725 46.584 -15.123
745 HB ILE 96 HB ILE 96 40.366 44.898 -12.595
746 HG12 ILE 96 1HG1 ILE 96 38.381 44.582 -13.972
747 HG13 ILE 96 2HG1 ILE 96 38.011 45.603 -12.592
748 HG21 ILE 96 1HG2 ILE 96 41.342 47.099 -12.120
749 HG22 ILE 96 2HG2 ILE 96 40.135 47.914 -13.140
750 HG23 ILE 96 3HG2 ILE 96 39.642 47.129 -11.621
751 HD11 ILE 96 1HD1 ILE 96 38.410 46.594 -15.468
752 HD12 ILE 96 2HD1 ILE 96 36.862 46.417 -14.619
753 HD13 ILE 96 3HD1 ILE 96 38.035 47.627 -14.065
754 H ARG 97 H ARG 97 42.697 45.739 -16.286
755 HA ARG 97 HA ARG 97 44.818 44.507 -14.745
756 HB2 ARG 97 1HB ARG 97 44.093 44.850 -17.402
757 HB3 ARG 97 2HB ARG 97 45.544 45.836 -17.275
758 HG2 ARG 97 1HG ARG 97 46.701 43.819 -16.258
759 HG3 ARG 97 2HG ARG 97 45.250 42.880 -16.677
760 HD2 ARG 97 1HD ARG 97 47.010 44.439 -18.605
761 HD3 ARG 97 2HD ARG 97 46.973 42.674 -18.422
762 HE ARG 97 HE ARG 97 44.320 43.476 -18.978
763 HH11 ARG 97 1HH1 ARG 97 47.428 43.546 -20.675
764 HH12 ARG 97 2HH1 ARG 97 46.667 43.504 -22.242
765 HH21 ARG 97 1HH2 ARG 97 43.429 43.459 -20.980
766 HH22 ARG 97 2HH2 ARG 97 44.439 43.439 -22.412
767 H GLN 98 H GLN 98 43.934 47.121 -13.683
768 HA GLN 98 HA GLN 98 46.572 48.493 -13.615
769 HB2 GLN 98 1HB GLN 98 43.922 49.963 -14.106
770 HB3 GLN 98 2HB GLN 98 45.473 50.735 -13.778
771 HG2 GLN 98 1HG GLN 98 46.416 49.658 -15.869
772 HG3 GLN 98 2HG GLN 98 44.818 48.994 -16.215
773 HE21 GLN 98 1HE2 GLN 98 43.680 51.849 -17.769
774 HE22 GLN 98 2HE2 GLN 98 43.532 50.135 -17.487
775 HXT GLN 98 HO GLN 98 45.984 48.692 -10.371
Start of MODEL 28
1 H1 SER 1 1H SER 1 4.924 43.699 3.527
2 H2 SER 1 2H SER 1 4.144 42.751 2.559
3 H3 SER 1 3H SER 1 5.782 42.841 2.615
4 HA SER 1 HA SER 1 5.865 41.443 4.603
5 HB2 SER 1 1HB SER 1 2.875 41.098 4.450
6 HB3 SER 1 2HB SER 1 3.960 41.122 5.884
7 HG SER 1 HG SER 1 4.139 43.340 4.311
8 H GLN 2 H GLN 2 6.499 40.932 2.146
9 HA GLN 2 HA GLN 2 6.866 39.322 0.560
10 HB2 GLN 2 1HB GLN 2 5.623 37.429 2.592
11 HB3 GLN 2 2HB GLN 2 6.574 36.956 1.185
12 HG2 GLN 2 1HG GLN 2 8.542 38.117 2.109
13 HG3 GLN 2 2HG GLN 2 7.601 38.579 3.536
14 HE21 GLN 2 1HE2 GLN 2 9.461 35.066 3.479
15 HE22 GLN 2 2HE2 GLN 2 9.779 36.374 2.370
16 H GLN 3 H GLN 3 5.607 37.236 -0.521
17 HA GLN 3 HA GLN 3 2.730 37.755 -0.875
18 HB2 GLN 3 1HB GLN 3 4.821 38.152 -3.060
19 HB3 GLN 3 2HB GLN 3 3.167 37.669 -3.437
20 HG2 GLN 3 1HG GLN 3 3.931 40.226 -1.999
21 HG3 GLN 3 2HG GLN 3 3.533 40.093 -3.715
22 HE21 GLN 3 1HE2 GLN 3 0.605 40.519 -1.024
23 HE22 GLN 3 2HE2 GLN 3 2.308 40.671 -0.637
24 H SER 4 H SER 4 1.791 35.874 -1.988
25 HA SER 4 HA SER 4 3.411 33.443 -1.587
26 HB2 SER 4 1HB SER 4 0.551 33.799 -2.574
27 HB3 SER 4 2HB SER 4 1.314 32.269 -2.089
28 HG SER 4 HG SER 4 1.585 33.221 0.015
29 H HIS 5 H HIS 5 4.174 32.141 -3.267
30 HA HIS 5 HA HIS 5 3.319 32.611 -6.018
31 HB2 HIS 5 1HB HIS 5 5.244 34.322 -5.237
32 HB3 HIS 5 2HB HIS 5 6.272 32.926 -5.582
33 HD1 HIS 5 HD1 HIS 5 3.726 35.211 -7.286
34 HD2 HIS 5 HD2 HIS 5 6.748 32.507 -8.260
35 HE1 HIS 5 HE1 HIS 5 4.083 35.371 -9.790
36 H SER 6 H SER 6 4.473 31.035 -7.482
37 HA SER 6 HA SER 6 5.980 28.890 -6.138
38 HB2 SER 6 1HB SER 6 3.419 28.352 -7.708
39 HB3 SER 6 2HB SER 6 4.529 27.124 -7.060
40 HG SER 6 HG SER 6 3.953 28.673 -5.038
41 H SER 7 H SER 7 7.210 27.713 -7.758
42 HA SER 7 HA SER 7 7.282 29.128 -10.391
43 HB2 SER 7 1HB SER 7 9.602 27.981 -8.805
44 HB3 SER 7 2HB SER 7 9.699 28.859 -10.348
45 HG SER 7 HG SER 7 10.111 30.188 -8.512
46 HA PRO 8 HA PRO 8 6.910 24.650 -11.277
47 HB2 PRO 8 1HB PRO 8 5.231 24.764 -13.408
48 HB3 PRO 8 2HB PRO 8 4.614 24.861 -11.726
49 HG2 PRO 8 1HG PRO 8 5.220 27.081 -13.653
50 HG3 PRO 8 2HG PRO 8 3.730 26.789 -12.698
51 HD2 PRO 8 1HD PRO 8 5.668 28.500 -11.878
52 HD3 PRO 8 2HD PRO 8 4.734 27.500 -10.712
53 H GLY 9 H GLY 9 7.714 23.536 -13.102
54 HA2 GLY 9 1HA GLY 9 8.933 23.462 -15.217
55 HA3 GLY 9 2HA GLY 9 9.270 25.206 -15.060
56 H GLU 10 H GLU 10 9.366 22.665 -12.648
57 HA GLU 10 HA GLU 10 11.793 23.560 -11.443
58 HB2 GLU 10 1HB GLU 10 10.226 20.979 -11.068
59 HB3 GLU 10 2HB GLU 10 11.376 21.692 -9.931
60 HG2 GLU 10 1HG GLU 10 9.516 22.528 -8.956
61 HG3 GLU 10 2HG GLU 10 9.663 23.782 -10.182
62 H ILE 11 H ILE 11 12.461 22.911 -14.110
63 HA ILE 11 HA ILE 11 13.843 20.355 -14.015
64 HB ILE 11 HB ILE 11 12.551 22.111 -15.932
65 HG12 ILE 11 1HG1 ILE 11 13.512 19.261 -16.184
66 HG13 ILE 11 2HG1 ILE 11 12.036 19.802 -15.368
67 HG21 ILE 11 1HG2 ILE 11 15.234 21.107 -16.911
68 HG22 ILE 11 2HG2 ILE 11 13.976 21.927 -17.869
69 HG23 ILE 11 3HG2 ILE 11 14.799 22.803 -16.567
70 HD11 ILE 11 1HD1 ILE 11 11.210 20.737 -17.550
71 HD12 ILE 11 2HD1 ILE 11 12.647 20.052 -18.349
72 HD13 ILE 11 3HD1 ILE 11 11.458 18.976 -17.585
73 H THR 12 H THR 12 14.430 23.156 -12.814
74 HA THR 12 HA THR 12 17.055 23.825 -13.811
75 HB THR 12 HB THR 12 15.553 25.505 -12.674
76 HG1 THR 12 HG1 THR 12 17.423 26.300 -11.311
77 HG21 THR 12 1HG2 THR 12 16.498 24.184 -10.093
78 HG22 THR 12 2HG2 THR 12 14.849 24.038 -10.745
79 HG23 THR 12 3HG2 THR 12 15.477 25.627 -10.252
80 H SER 13 H SER 13 19.023 23.752 -12.735
81 HA SER 13 HA SER 13 19.328 21.639 -10.635
82 HB2 SER 13 1HB SER 13 20.047 20.871 -12.928
83 HB3 SER 13 2HB SER 13 21.185 22.235 -12.959
84 HG SER 13 HG SER 13 22.030 21.300 -10.939
85 H SER 14 H SER 14 19.277 24.751 -11.210
86 HA SER 14 HA SER 14 20.380 26.658 -10.649
87 HB2 SER 14 1HB SER 14 21.320 25.013 -8.283
88 HB3 SER 14 2HB SER 14 21.176 26.785 -8.367
89 HG SER 14 HG SER 14 18.901 26.450 -8.791
90 HA PRO 15 HA PRO 15 24.541 25.016 -11.977
91 HB2 PRO 15 1HB PRO 15 24.752 26.179 -14.436
92 HB3 PRO 15 2HB PRO 15 23.934 24.615 -14.167
93 HG2 PRO 15 1HG PRO 15 22.700 27.349 -14.357
94 HG3 PRO 15 2HG PRO 15 22.272 25.858 -15.254
95 HD2 PRO 15 1HD PRO 15 20.910 26.589 -13.058
96 HD3 PRO 15 2HD PRO 15 21.312 24.861 -13.354
97 H GLN 16 H GLN 16 23.035 28.177 -12.084
98 HA GLN 16 HA GLN 16 25.383 29.774 -12.274
99 HB2 GLN 16 1HB GLN 16 24.033 31.561 -11.342
100 HB3 GLN 16 2HB GLN 16 23.094 30.656 -12.534
101 HG2 GLN 16 1HG GLN 16 21.804 29.580 -10.832
102 HG3 GLN 16 2HG GLN 16 22.884 30.141 -9.555
103 HE21 GLN 16 1HE2 GLN 16 20.878 32.847 -8.882
104 HE22 GLN 16 2HE2 GLN 16 21.903 31.551 -8.326
105 H GLY 17 H GLY 17 24.254 27.756 -9.729
106 HA2 GLY 17 1HA GLY 17 26.047 29.179 -7.827
107 HA3 GLY 17 2HA GLY 17 24.643 28.211 -7.365
108 H LEU 18 H LEU 18 25.225 26.063 -9.280
109 HA LEU 18 HA LEU 18 27.005 24.627 -7.513
110 HB2 LEU 18 1HB LEU 18 25.975 22.827 -8.285
111 HB3 LEU 18 2HB LEU 18 24.851 23.968 -8.980
112 HG LEU 18 HG LEU 18 26.338 23.778 -11.117
113 HD11 LEU 18 1HD1 LEU 18 26.944 21.136 -9.746
114 HD12 LEU 18 2HD1 LEU 18 28.098 22.473 -9.868
115 HD13 LEU 18 3HD1 LEU 18 27.509 21.693 -11.344
116 HD21 LEU 18 1HD2 LEU 18 24.032 23.009 -10.964
117 HD22 LEU 18 2HD2 LEU 18 24.555 21.517 -10.153
118 HD23 LEU 18 3HD2 LEU 18 25.019 21.828 -11.845
119 H ASP 19 H ASP 19 27.205 25.959 -10.792
120 HA ASP 19 HA ASP 19 29.904 24.823 -11.188
121 HB2 ASP 19 1HB ASP 19 28.269 26.844 -12.781
122 HB3 ASP 19 2HB ASP 19 29.912 26.370 -13.208
123 H ASN 20 H ASN 20 28.333 27.858 -10.387
124 HA ASN 20 HA ASN 20 30.947 29.147 -10.088
125 HB2 ASN 20 1HB ASN 20 28.865 29.768 -11.627
126 HB3 ASN 20 2HB ASN 20 28.392 30.669 -10.199
127 HD21 ASN 20 1HD2 ASN 20 30.904 32.188 -12.641
128 HD22 ASN 20 2HD2 ASN 20 29.660 31.044 -12.994
129 HA PRO 21 HA PRO 21 29.630 29.089 -5.684
130 HB2 PRO 21 1HB PRO 21 32.248 29.148 -4.787
131 HB3 PRO 21 2HB PRO 21 31.343 27.638 -5.047
132 HG2 PRO 21 1HG PRO 21 33.276 29.015 -6.788
133 HG3 PRO 21 2HG PRO 21 33.136 27.286 -6.425
134 HD2 PRO 21 1HD PRO 21 32.272 28.277 -8.709
135 HD3 PRO 21 2HD PRO 21 31.361 26.986 -7.847
136 H ALA 22 H ALA 22 31.891 30.943 -7.695
137 HA ALA 22 HA ALA 22 32.371 33.008 -5.762
138 HB1 ALA 22 1HB ALA 22 33.163 34.310 -7.713
139 HB2 ALA 22 2HB ALA 22 33.837 32.663 -7.699
140 HB3 ALA 22 3HB ALA 22 32.503 33.074 -8.803
141 H LEU 23 H LEU 23 29.996 32.600 -8.408
142 HA LEU 23 HA LEU 23 28.713 35.161 -7.959
143 HB2 LEU 23 1HB LEU 23 27.780 32.581 -9.248
144 HB3 LEU 23 2HB LEU 23 26.731 33.977 -9.085
145 HG LEU 23 HG LEU 23 29.302 33.927 -10.690
146 HD11 LEU 23 1HD1 LEU 23 27.440 32.523 -11.611
147 HD12 LEU 23 2HD1 LEU 23 27.816 33.925 -12.635
148 HD13 LEU 23 3HD1 LEU 23 26.386 33.955 -11.585
149 HD21 LEU 23 1HD2 LEU 23 28.455 36.088 -11.583
150 HD22 LEU 23 2HD2 LEU 23 28.819 36.175 -9.849
151 HD23 LEU 23 3HD2 LEU 23 27.130 36.040 -10.402
152 H LEU 24 H LEU 24 28.024 31.815 -6.898
153 HA LEU 24 HA LEU 24 25.625 32.504 -5.546
154 HB2 LEU 24 1HB LEU 24 26.326 30.232 -6.183
155 HB3 LEU 24 2HB LEU 24 27.574 30.255 -4.957
156 HG LEU 24 HG LEU 24 25.967 30.211 -3.196
157 HD11 LEU 24 1HD1 LEU 24 23.505 30.092 -3.645
158 HD12 LEU 24 2HD1 LEU 24 23.841 30.594 -5.320
159 HD13 LEU 24 3HD1 LEU 24 24.234 31.679 -3.956
160 HD21 LEU 24 1HD2 LEU 24 26.493 28.093 -4.543
161 HD22 LEU 24 2HD2 LEU 24 24.888 28.287 -5.268
162 HD23 LEU 24 3HD2 LEU 24 25.041 28.054 -3.515
163 H ARG 25 H ARG 25 29.008 32.409 -4.393
164 HA ARG 25 HA ARG 25 28.461 32.941 -1.630
165 HB2 ARG 25 1HB ARG 25 30.677 32.326 -2.290
166 HB3 ARG 25 2HB ARG 25 30.749 33.578 -3.511
167 HG2 ARG 25 1HG ARG 25 30.465 34.542 -0.715
168 HG3 ARG 25 2HG ARG 25 31.981 33.713 -1.092
169 HD2 ARG 25 1HD ARG 25 30.837 36.123 -2.609
170 HD3 ARG 25 2HD ARG 25 32.184 36.176 -1.458
171 HE ARG 25 HE ARG 25 33.036 34.344 -3.209
172 HH11 ARG 25 1HH1 ARG 25 31.741 37.574 -3.844
173 HH12 ARG 25 2HH1 ARG 25 32.638 37.770 -5.180
174 HH21 ARG 25 1HH2 ARG 25 34.216 34.768 -5.092
175 HH22 ARG 25 2HH2 ARG 25 33.997 36.288 -5.922
176 H ASP 26 H ASP 26 28.886 35.075 -4.471
177 HA ASP 26 HA ASP 26 28.763 37.453 -2.889
178 HB2 ASP 26 1HB ASP 26 29.556 36.881 -5.375
179 HB3 ASP 26 2HB ASP 26 27.942 37.469 -5.756
180 H MET 27 H MET 27 26.316 35.676 -4.797
181 HA MET 27 HA MET 27 24.119 37.459 -4.383
182 HB2 MET 27 1HB MET 27 24.267 35.515 -5.984
183 HB3 MET 27 2HB MET 27 24.061 34.433 -4.601
184 HG2 MET 27 1HG MET 27 21.860 35.453 -4.138
185 HG3 MET 27 2HG MET 27 22.084 36.528 -5.530
186 HE1 MET 27 1HE MET 27 20.984 32.049 -5.604
187 HE2 MET 27 2HE MET 27 22.266 32.668 -4.539
188 HE3 MET 27 3HE MET 27 20.591 33.226 -4.329
189 H LEU 28 H LEU 28 25.311 34.681 -2.476
190 HA LEU 28 HA LEU 28 23.175 34.689 -0.586
191 HB2 LEU 28 1HB LEU 28 25.963 33.677 -0.563
192 HB3 LEU 28 2HB LEU 28 24.929 33.578 0.873
193 HG LEU 28 HG LEU 28 24.108 32.518 -1.852
194 HD11 LEU 28 1HD1 LEU 28 25.398 31.209 0.494
195 HD12 LEU 28 2HD1 LEU 28 26.072 31.456 -1.122
196 HD13 LEU 28 3HD1 LEU 28 24.701 30.353 -0.899
197 HD21 LEU 28 1HD2 LEU 28 22.168 32.828 -0.519
198 HD22 LEU 28 2HD2 LEU 28 22.960 32.202 0.939
199 HD23 LEU 28 3HD2 LEU 28 22.554 31.111 -0.404
200 H LEU 29 H LEU 29 26.373 36.248 -0.629
201 HA LEU 29 HA LEU 29 26.199 37.378 2.012
202 HB2 LEU 29 1HB LEU 29 27.693 38.180 -0.494
203 HB3 LEU 29 2HB LEU 29 27.812 39.124 0.986
204 HG LEU 29 HG LEU 29 28.499 36.185 0.902
205 HD11 LEU 29 1HD1 LEU 29 29.851 37.330 -0.764
206 HD12 LEU 29 2HD1 LEU 29 30.843 36.865 0.634
207 HD13 LEU 29 3HD1 LEU 29 30.327 38.559 0.435
208 HD21 LEU 29 1HD2 LEU 29 29.334 38.427 2.782
209 HD22 LEU 29 2HD2 LEU 29 29.833 36.722 2.895
210 HD23 LEU 29 3HD2 LEU 29 28.134 37.167 3.142
211 H ALA 30 H ALA 30 25.143 38.489 -1.160
212 HA ALA 30 HA ALA 30 24.318 41.104 -0.200
213 HB1 ALA 30 1HB ALA 30 25.026 40.685 -2.539
214 HB2 ALA 30 2HB ALA 30 23.623 39.614 -2.770
215 HB3 ALA 30 3HB ALA 30 23.376 41.351 -2.465
216 H ASN 31 H ASN 31 22.885 37.964 -0.019
217 HA ASN 31 HA ASN 31 20.150 39.165 0.106
218 HB2 ASN 31 1HB ASN 31 20.730 37.329 -1.538
219 HB3 ASN 31 2HB ASN 31 20.880 36.242 -0.157
220 HD21 ASN 31 1HD2 ASN 31 17.425 36.469 -1.797
221 HD22 ASN 31 2HD2 ASN 31 19.025 36.533 -2.513
222 HA PRO 32 HA PRO 32 21.128 38.435 4.448
223 HB2 PRO 32 1HB PRO 32 19.090 39.924 5.540
224 HB3 PRO 32 2HB PRO 32 20.615 40.632 4.911
225 HG2 PRO 32 1HG PRO 32 17.969 40.322 3.494
226 HG3 PRO 32 2HG PRO 32 18.986 41.787 3.670
227 HD2 PRO 32 1HD PRO 32 19.114 40.349 1.458
228 HD3 PRO 32 2HD PRO 32 20.620 40.984 2.209
229 H HIS 33 H HIS 33 18.015 37.870 2.848
230 HA HIS 33 HA HIS 33 16.925 36.341 5.082
231 HB2 HIS 33 1HB HIS 33 15.525 37.504 3.363
232 HB3 HIS 33 2HB HIS 33 16.134 36.379 2.139
233 HD1 HIS 33 HD1 HIS 33 14.025 36.367 5.334
234 HD2 HIS 33 HD2 HIS 33 14.837 33.980 2.017
235 HE1 HIS 33 HE1 HIS 33 12.389 34.439 5.398
236 H GLU 34 H GLU 34 18.593 35.621 2.012
237 HA GLU 34 HA GLU 34 18.162 32.773 2.238
238 HB2 GLU 34 1HB GLU 34 19.277 34.631 0.366
239 HB3 GLU 34 2HB GLU 34 20.438 33.348 0.627
240 HG2 GLU 34 1HG GLU 34 17.528 32.929 -0.092
241 HG3 GLU 34 2HG GLU 34 18.849 32.980 -1.261
242 H LEU 35 H LEU 35 20.880 35.014 2.876
243 HA LEU 35 HA LEU 35 22.707 33.057 3.737
244 HB2 LEU 35 1HB LEU 35 24.023 34.691 4.259
245 HB3 LEU 35 2HB LEU 35 22.900 35.471 3.211
246 HG LEU 35 HG LEU 35 21.897 36.677 5.025
247 HD11 LEU 35 1HD1 LEU 35 23.866 35.170 6.734
248 HD12 LEU 35 2HD1 LEU 35 22.132 35.457 7.004
249 HD13 LEU 35 3HD1 LEU 35 23.275 36.798 7.178
250 HD21 LEU 35 1HD2 LEU 35 24.902 36.648 4.742
251 HD22 LEU 35 2HD2 LEU 35 23.948 38.051 5.299
252 HD23 LEU 35 3HD2 LEU 35 23.741 37.425 3.648
253 H SER 36 H SER 36 19.936 34.398 5.359
254 HA SER 36 HA SER 36 20.630 33.531 8.022
255 HB2 SER 36 1HB SER 36 19.128 35.462 7.565
256 HB3 SER 36 2HB SER 36 17.916 34.329 6.932
257 HG SER 36 HG SER 36 17.871 33.336 8.980
258 H LEU 37 H LEU 37 18.587 32.294 5.346
259 HA LEU 37 HA LEU 37 17.651 30.052 6.941
260 HB2 LEU 37 1HB LEU 37 16.587 29.312 5.104
261 HB3 LEU 37 2HB LEU 37 16.627 31.017 4.965
262 HG LEU 37 HG LEU 37 18.211 30.860 3.113
263 HD11 LEU 37 1HD1 LEU 37 17.501 27.930 3.324
264 HD12 LEU 37 2HD1 LEU 37 19.119 28.658 3.383
265 HD13 LEU 37 3HD1 LEU 37 18.202 28.706 1.878
266 HD21 LEU 37 1HD2 LEU 37 15.816 31.281 2.858
267 HD22 LEU 37 2HD2 LEU 37 15.488 29.531 2.892
268 HD23 LEU 37 3HD2 LEU 37 16.401 30.244 1.544
269 H LEU 38 H LEU 38 20.282 30.781 4.821
270 HA LEU 38 HA LEU 38 21.267 28.188 4.449
271 HB2 LEU 38 1HB LEU 38 21.850 30.305 3.327
272 HB3 LEU 38 2HB LEU 38 22.773 30.784 4.753
273 HG LEU 38 HG LEU 38 24.240 28.786 4.471
274 HD11 LEU 38 1HD1 LEU 38 22.783 28.607 1.845
275 HD12 LEU 38 2HD1 LEU 38 22.760 27.427 3.174
276 HD13 LEU 38 3HD1 LEU 38 24.266 27.712 2.276
277 HD21 LEU 38 1HD2 LEU 38 24.125 30.779 2.207
278 HD22 LEU 38 2HD2 LEU 38 25.530 29.767 2.614
279 HD23 LEU 38 3HD2 LEU 38 24.953 30.992 3.764
280 H LYS 39 H LYS 39 22.101 30.553 7.025
281 HA LYS 39 HA LYS 39 23.778 28.636 8.406
282 HB2 LYS 39 1HB LYS 39 23.394 30.117 10.445
283 HB3 LYS 39 2HB LYS 39 24.234 30.796 9.050
284 HG2 LYS 39 1HG LYS 39 22.187 31.933 8.365
285 HG3 LYS 39 2HG LYS 39 21.300 31.268 9.688
286 HD2 LYS 39 1HD LYS 39 21.846 33.425 10.390
287 HD3 LYS 39 2HD LYS 39 23.080 32.423 11.186
288 HE2 LYS 39 1HE LYS 39 24.712 32.986 9.470
289 HE3 LYS 39 2HE LYS 39 23.469 33.790 8.494
290 HZ1 LYS 39 1HZ LYS 39 24.401 34.702 11.154
291 HZ2 LYS 39 2HZ LYS 39 23.246 35.444 10.237
292 HZ3 LYS 39 3HZ LYS 39 24.806 35.384 9.706
293 H GLU 40 H GLU 40 20.299 29.011 8.399
294 HA GLU 40 HA GLU 40 20.006 27.353 10.798
295 HB2 GLU 40 1HB GLU 40 18.401 29.146 9.415
296 HB3 GLU 40 2HB GLU 40 17.696 27.583 8.997
297 HG2 GLU 40 1HG GLU 40 17.812 27.120 11.561
298 HG3 GLU 40 2HG GLU 40 17.977 28.881 11.703
299 H ARG 41 H ARG 41 19.519 26.923 7.265
300 HA ARG 41 HA ARG 41 18.809 24.077 7.645
301 HB2 ARG 41 1HB ARG 41 19.239 25.695 5.117
302 HB3 ARG 41 2HB ARG 41 18.491 24.100 5.206
303 HG2 ARG 41 1HG ARG 41 17.336 26.566 6.567
304 HG3 ARG 41 2HG ARG 41 16.950 26.073 4.927
305 HD2 ARG 41 1HD ARG 41 15.184 25.179 6.196
306 HD3 ARG 41 2HD ARG 41 16.258 23.797 5.932
307 HE ARG 41 HE ARG 41 16.750 23.740 8.205
308 HH11 ARG 41 1HH1 ARG 41 14.964 26.725 7.565
309 HH12 ARG 41 2HH1 ARG 41 14.798 27.088 9.269
310 HH21 ARG 41 1HH2 ARG 41 16.467 24.266 10.334
311 HH22 ARG 41 2HH2 ARG 41 15.602 25.725 10.788
312 H ASN 42 H ASN 42 21.628 25.880 6.551
313 HA ASN 42 HA ASN 42 23.068 23.282 6.191
314 HB2 ASN 42 1HB ASN 42 22.286 24.427 4.009
315 HB3 ASN 42 2HB ASN 42 23.486 25.646 4.340
316 HD21 ASN 42 1HD2 ASN 42 25.141 23.273 2.163
317 HD22 ASN 42 2HD2 ASN 42 24.000 24.593 2.115
318 HA PRO 43 HA PRO 43 25.233 26.572 8.692
319 HB2 PRO 43 1HB PRO 43 26.269 24.858 10.643
320 HB3 PRO 43 2HB PRO 43 24.773 25.836 10.770
321 HG2 PRO 43 1HG PRO 43 25.087 22.958 9.980
322 HG3 PRO 43 2HG PRO 43 23.910 23.709 11.102
323 HD2 PRO 43 1HD PRO 43 23.210 23.080 8.599
324 HD3 PRO 43 2HD PRO 43 22.648 24.619 9.344
325 HA PRO 44 HA PRO 44 29.311 24.433 8.010
326 HB2 PRO 44 1HB PRO 44 29.614 22.519 6.077
327 HB3 PRO 44 2HB PRO 44 29.294 22.128 7.798
328 HG2 PRO 44 1HG PRO 44 27.350 22.347 5.527
329 HG3 PRO 44 2HG PRO 44 27.579 21.004 6.693
330 HD2 PRO 44 1HD PRO 44 25.662 22.829 7.063
331 HD3 PRO 44 2HD PRO 44 26.622 22.224 8.456
332 H LEU 45 H LEU 45 27.072 24.602 5.141
333 HA LEU 45 HA LEU 45 29.175 25.831 3.521
334 HB2 LEU 45 1HB LEU 45 27.232 24.623 2.532
335 HB3 LEU 45 2HB LEU 45 26.182 25.910 3.118
336 HG LEU 45 HG LEU 45 27.299 27.535 1.661
337 HD11 LEU 45 1HD1 LEU 45 28.916 26.788 -0.083
338 HD12 LEU 45 2HD1 LEU 45 28.997 25.190 0.689
339 HD13 LEU 45 3HD1 LEU 45 29.582 26.636 1.547
340 HD21 LEU 45 1HD2 LEU 45 26.499 26.661 -0.480
341 HD22 LEU 45 2HD2 LEU 45 25.378 26.233 0.825
342 HD23 LEU 45 3HD2 LEU 45 26.494 25.005 0.175
343 H ALA 46 H ALA 46 26.567 26.810 5.684
344 HA ALA 46 HA ALA 46 26.627 29.557 5.019
345 HB1 ALA 46 1HB ALA 46 26.152 28.425 7.769
346 HB2 ALA 46 2HB ALA 46 25.513 29.927 7.064
347 HB3 ALA 46 3HB ALA 46 24.964 28.352 6.454
348 H GLU 47 H GLU 47 28.533 27.825 7.607
349 HA GLU 47 HA GLU 47 29.704 30.253 8.547
350 HB2 GLU 47 1HB GLU 47 31.381 28.893 9.641
351 HB3 GLU 47 2HB GLU 47 29.777 28.189 9.853
352 HG2 GLU 47 1HG GLU 47 30.246 26.481 8.209
353 HG3 GLU 47 2HG GLU 47 31.797 27.229 7.803
354 H ALA 48 H ALA 48 30.563 28.153 5.906
355 HA ALA 48 HA ALA 48 33.080 29.236 5.295
356 HB1 ALA 48 1HB ALA 48 32.048 27.074 4.427
357 HB2 ALA 48 2HB ALA 48 31.052 28.074 3.348
358 HB3 ALA 48 3HB ALA 48 32.811 28.087 3.191
359 H LEU 49 H LEU 49 29.779 30.069 4.304
360 HA LEU 49 HA LEU 49 30.526 32.158 2.487
361 HB2 LEU 49 1HB LEU 49 28.360 30.891 2.613
362 HB3 LEU 49 2HB LEU 49 27.973 31.736 4.088
363 HG LEU 49 HG LEU 49 26.847 32.430 1.953
364 HD11 LEU 49 1HD1 LEU 49 26.687 34.738 2.517
365 HD12 LEU 49 2HD1 LEU 49 28.137 34.621 3.533
366 HD13 LEU 49 3HD1 LEU 49 26.664 33.727 3.975
367 HD21 LEU 49 1HD2 LEU 49 29.402 33.965 1.499
368 HD22 LEU 49 2HD2 LEU 49 27.929 33.995 0.518
369 HD23 LEU 49 3HD2 LEU 49 28.906 32.523 0.581
370 H LEU 50 H LEU 50 29.615 32.071 5.945
371 HA LEU 50 HA LEU 50 29.347 34.879 6.209
372 HB2 LEU 50 1HB LEU 50 30.328 33.039 8.419
373 HB3 LEU 50 2HB LEU 50 29.486 34.563 8.604
374 HG LEU 50 HG LEU 50 28.397 31.895 7.874
375 HD11 LEU 50 1HD1 LEU 50 26.998 32.171 9.769
376 HD12 LEU 50 2HD1 LEU 50 27.737 33.770 10.079
377 HD13 LEU 50 3HD1 LEU 50 28.719 32.280 10.163
378 HD21 LEU 50 1HD2 LEU 50 26.937 34.505 7.575
379 HD22 LEU 50 2HD2 LEU 50 26.153 32.901 7.627
380 HD23 LEU 50 3HD2 LEU 50 27.275 33.284 6.316
381 H SER 51 H SER 51 32.127 32.737 6.392
382 HA SER 51 HA SER 51 33.934 34.587 7.641
383 HB2 SER 51 1HB SER 51 34.345 32.142 5.928
384 HB3 SER 51 2HB SER 51 35.594 32.937 6.884
385 HG SER 51 HG SER 51 33.245 31.639 7.824
386 H GLY 52 H GLY 52 32.794 34.117 4.371
387 HA2 GLY 52 1HA GLY 52 33.101 35.633 2.636
388 HA3 GLY 52 2HA GLY 52 34.434 36.383 3.515
389 H ASP 53 H ASP 53 35.628 33.496 3.807
390 HA ASP 53 HA ASP 53 37.348 33.799 1.561
391 HB2 ASP 53 1HB ASP 53 37.688 32.486 3.867
392 HB3 ASP 53 2HB ASP 53 37.328 31.157 2.781
393 H LEU 54 H LEU 54 37.051 33.345 -0.473
394 HA LEU 54 HA LEU 54 34.774 31.818 -1.306
395 HB2 LEU 54 1HB LEU 54 35.884 33.595 -2.638
396 HB3 LEU 54 2HB LEU 54 37.262 32.530 -2.889
397 HG LEU 54 HG LEU 54 35.470 32.825 -4.671
398 HD11 LEU 54 1HD1 LEU 54 36.372 30.047 -4.063
399 HD12 LEU 54 2HD1 LEU 54 37.327 31.373 -4.942
400 HD13 LEU 54 3HD1 LEU 54 35.790 30.720 -5.685
401 HD21 LEU 54 1HD2 LEU 54 33.550 31.416 -4.740
402 HD22 LEU 54 2HD2 LEU 54 33.497 32.286 -3.205
403 HD23 LEU 54 3HD2 LEU 54 34.011 30.589 -3.243
404 H GLU 55 H GLU 55 38.209 31.057 -0.770
405 HA GLU 55 HA GLU 55 38.176 28.533 -2.005
406 HB2 GLU 55 1HB GLU 55 40.108 28.009 -1.056
407 HB3 GLU 55 2HB GLU 55 40.121 29.755 -1.191
408 HG2 GLU 55 1HG GLU 55 40.962 29.466 0.752
409 HG3 GLU 55 2HG GLU 55 39.316 29.734 1.228
410 H LYS 56 H LYS 56 37.369 29.371 1.354
411 HA LYS 56 HA LYS 56 36.708 26.646 1.980
412 HB2 LYS 56 1HB LYS 56 35.982 27.368 4.110
413 HB3 LYS 56 2HB LYS 56 37.376 28.413 3.656
414 HG2 LYS 56 1HG LYS 56 35.684 30.092 3.041
415 HG3 LYS 56 2HG LYS 56 34.525 29.095 3.869
416 HD2 LYS 56 1HD LYS 56 37.154 29.973 5.111
417 HD3 LYS 56 2HD LYS 56 35.682 30.916 5.244
418 HE2 LYS 56 1HE LYS 56 34.552 28.998 6.373
419 HE3 LYS 56 2HE LYS 56 36.056 28.071 6.265
420 HZ1 LYS 56 1HZ LYS 56 35.626 30.568 7.797
421 HZ2 LYS 56 2HZ LYS 56 37.088 29.809 7.645
422 HZ3 LYS 56 3HZ LYS 56 35.838 29.055 8.422
423 H PHE 57 H PHE 57 34.808 29.442 0.822
424 HA PHE 57 HA PHE 57 32.285 28.144 1.110
425 HB2 PHE 57 1HB PHE 57 32.576 30.552 0.639
426 HB3 PHE 57 2HB PHE 57 33.124 30.153 -0.993
427 HD1 PHE 57 HD1 PHE 57 30.235 30.034 1.330
428 HD2 PHE 57 HD2 PHE 57 31.558 29.602 -2.737
429 HE1 PHE 57 HE1 PHE 57 27.865 30.005 0.574
430 HE2 PHE 57 HE2 PHE 57 29.194 29.538 -3.498
431 HZ PHE 57 HZ PHE 57 27.354 29.730 -1.851
432 H SER 58 H SER 58 34.507 28.263 -1.728
433 HA SER 58 HA SER 58 32.840 26.606 -3.352
434 HB2 SER 58 1HB SER 58 34.631 28.092 -4.224
435 HB3 SER 58 2HB SER 58 35.855 27.088 -3.418
436 HG SER 58 HG SER 58 35.664 26.468 -5.576
437 H ARG 59 H ARG 59 35.514 25.829 -1.129
438 HA ARG 59 HA ARG 59 35.760 23.102 -1.988
439 HB2 ARG 59 1HB ARG 59 37.422 24.412 -0.661
440 HB3 ARG 59 2HB ARG 59 36.307 24.385 0.705
441 HG2 ARG 59 1HG ARG 59 36.511 21.722 0.161
442 HG3 ARG 59 2HG ARG 59 38.099 22.288 -0.392
443 HD2 ARG 59 1HD ARG 59 36.837 22.747 2.315
444 HD3 ARG 59 2HD ARG 59 38.162 21.627 1.947
445 HE ARG 59 HE ARG 59 38.809 24.360 1.197
446 HH11 ARG 59 1HH1 ARG 59 38.706 22.184 3.977
447 HH12 ARG 59 2HH1 ARG 59 39.869 23.128 4.868
448 HH21 ARG 59 1HH2 ARG 59 40.253 25.524 2.391
449 HH22 ARG 59 2HH2 ARG 59 40.736 24.975 3.981
450 H VAL 60 H VAL 60 33.897 24.687 0.636
451 HA VAL 60 HA VAL 60 32.701 22.223 1.529
452 HB VAL 60 HB VAL 60 31.789 25.105 1.917
453 HG11 VAL 60 1HG1 VAL 60 30.522 24.096 3.853
454 HG12 VAL 60 2HG1 VAL 60 29.893 23.657 2.256
455 HG13 VAL 60 3HG1 VAL 60 30.871 22.492 3.179
456 HG21 VAL 60 1HG2 VAL 60 33.280 23.187 3.781
457 HG22 VAL 60 2HG2 VAL 60 34.032 24.533 2.901
458 HG23 VAL 60 3HG2 VAL 60 32.814 24.865 4.144
459 H LEU 61 H LEU 61 31.884 24.622 -0.979
460 HA LEU 61 HA LEU 61 29.244 23.813 -1.513
461 HB2 LEU 61 1HB LEU 61 30.723 25.673 -2.603
462 HB3 LEU 61 2HB LEU 61 31.225 24.406 -3.710
463 HG LEU 61 HG LEU 61 28.608 24.110 -4.039
464 HD11 LEU 61 1HD1 LEU 61 27.439 26.237 -3.839
465 HD12 LEU 61 2HD1 LEU 61 28.913 27.024 -3.227
466 HD13 LEU 61 3HD1 LEU 61 28.091 25.774 -2.253
467 HD21 LEU 61 1HD2 LEU 61 29.654 26.610 -5.324
468 HD22 LEU 61 2HD2 LEU 61 28.817 25.233 -6.041
469 HD23 LEU 61 3HD2 LEU 61 30.537 25.091 -5.627
470 H VAL 62 H VAL 62 32.332 22.352 -2.706
471 HA VAL 62 HA VAL 62 31.010 20.347 -4.293
472 HB VAL 62 HB VAL 62 33.736 20.113 -2.930
473 HG11 VAL 62 1HG1 VAL 62 34.206 18.494 -4.792
474 HG12 VAL 62 2HG1 VAL 62 32.886 17.935 -3.748
475 HG13 VAL 62 3HG1 VAL 62 32.512 18.647 -5.331
476 HG21 VAL 62 1HG2 VAL 62 34.642 20.861 -5.138
477 HG22 VAL 62 2HG2 VAL 62 32.981 21.253 -5.649
478 HG23 VAL 62 3HG2 VAL 62 33.736 22.116 -4.285
479 H GLU 63 H GLU 63 32.260 20.314 -0.923
480 HA GLU 63 HA GLU 63 31.655 17.577 -0.391
481 HB2 GLU 63 1HB GLU 63 31.713 20.001 1.449
482 HB3 GLU 63 2HB GLU 63 31.584 18.329 2.010
483 HG2 GLU 63 1HG GLU 63 33.894 19.545 0.466
484 HG3 GLU 63 2HG GLU 63 33.885 19.106 2.181
485 H GLN 64 H GLN 64 29.704 20.538 -0.221
486 HA GLN 64 HA GLN 64 27.379 19.194 0.834
487 HB2 GLN 64 1HB GLN 64 27.839 21.834 -0.560
488 HB3 GLN 64 2HB GLN 64 26.202 21.243 -0.247
489 HG2 GLN 64 1HG GLN 64 28.337 21.669 1.854
490 HG3 GLN 64 2HG GLN 64 26.983 22.755 1.514
491 HE21 GLN 64 1HE2 GLN 64 26.481 19.823 4.123
492 HE22 GLN 64 2HE2 GLN 64 28.012 20.472 3.594
493 H GLN 65 H GLN 65 28.436 19.993 -2.547
494 HA GLN 65 HA GLN 65 26.035 19.052 -3.754
495 HB2 GLN 65 1HB GLN 65 28.911 19.096 -4.707
496 HB3 GLN 65 2HB GLN 65 27.594 18.496 -5.720
497 HG2 GLN 65 1HG GLN 65 26.502 20.640 -5.718
498 HG3 GLN 65 2HG GLN 65 27.629 21.278 -4.521
499 HE21 GLN 65 1HE2 GLN 65 29.203 22.710 -7.340
500 HE22 GLN 65 2HE2 GLN 65 28.141 22.983 -5.978
501 H GLN 66 H GLN 66 28.968 17.241 -2.741
502 HA GLN 66 HA GLN 66 28.149 14.738 -3.831
503 HB2 GLN 66 1HB GLN 66 29.814 15.372 -1.369
504 HB3 GLN 66 2HB GLN 66 29.632 13.754 -2.051
505 HG2 GLN 66 1HG GLN 66 30.680 14.496 -4.142
506 HG3 GLN 66 2HG GLN 66 30.851 16.127 -3.487
507 HE21 GLN 66 1HE2 GLN 66 33.697 15.441 -1.579
508 HE22 GLN 66 2HE2 GLN 66 32.479 16.590 -2.061
509 H ASP 67 H ASP 67 27.470 16.324 -0.714
510 HA ASP 67 HA ASP 67 26.065 14.037 0.402
511 HB2 ASP 67 1HB ASP 67 27.312 15.877 1.633
512 HB3 ASP 67 2HB ASP 67 25.954 16.942 1.266
513 H ARG 68 H ARG 68 25.127 17.031 -1.244
514 HA ARG 68 HA ARG 68 22.298 16.863 -0.690
515 HB2 ARG 68 1HB ARG 68 23.828 18.201 -2.954
516 HB3 ARG 68 2HB ARG 68 22.089 18.376 -2.704
517 HG2 ARG 68 1HG ARG 68 24.119 19.158 -0.608
518 HG3 ARG 68 2HG ARG 68 23.526 20.274 -1.838
519 HD2 ARG 68 1HD ARG 68 21.449 20.386 -0.904
520 HD3 ARG 68 2HD ARG 68 21.555 18.754 -0.206
521 HE ARG 68 HE ARG 68 23.549 20.267 1.069
522 HH11 ARG 68 1HH1 ARG 68 20.024 20.447 0.871
523 HH12 ARG 68 2HH1 ARG 68 19.887 21.154 2.461
524 HH21 ARG 68 1HH2 ARG 68 23.311 21.151 3.052
525 HH22 ARG 68 2HH2 ARG 68 21.725 21.543 3.687
526 H ALA 69 H ALA 69 24.380 15.606 -3.255
527 HA ALA 69 HA ALA 69 22.414 14.589 -4.981
528 HB1 ALA 69 1HB ALA 69 24.150 12.904 -5.620
529 HB2 ALA 69 2HB ALA 69 24.792 14.564 -5.534
530 HB3 ALA 69 3HB ALA 69 25.130 13.414 -4.221
531 H ARG 70 H ARG 70 23.463 13.335 -1.837
532 HA ARG 70 HA ARG 70 22.134 10.768 -2.154
533 HB2 ARG 70 1HB ARG 70 22.971 12.185 0.405
534 HB3 ARG 70 2HB ARG 70 22.642 10.456 0.198
535 HG2 ARG 70 1HG ARG 70 24.516 10.472 -1.547
536 HG3 ARG 70 2HG ARG 70 24.936 12.078 -0.940
537 HD2 ARG 70 1HD ARG 70 24.793 9.587 0.786
538 HD3 ARG 70 2HD ARG 70 26.271 10.184 0.014
539 HE ARG 70 HE ARG 70 25.092 12.283 1.579
540 HH11 ARG 70 1HH1 ARG 70 26.933 9.286 1.962
541 HH12 ARG 70 2HH1 ARG 70 27.636 9.807 3.469
542 HH21 ARG 70 1HH2 ARG 70 26.015 12.871 3.482
543 HH22 ARG 70 2HH2 ARG 70 27.127 11.800 4.319
544 H ARG 71 H ARG 71 21.198 13.951 -0.978
545 HA ARG 71 HA ARG 71 18.641 13.014 0.160
546 HB2 ARG 71 1HB ARG 71 19.636 15.799 -0.551
547 HB3 ARG 71 2HB ARG 71 18.148 15.438 0.326
548 HG2 ARG 71 1HG ARG 71 19.390 14.537 2.177
549 HG3 ARG 71 2HG ARG 71 20.922 14.730 1.290
550 HD2 ARG 71 1HD ARG 71 20.520 17.140 1.123
551 HD3 ARG 71 2HD ARG 71 19.006 16.954 2.031
552 HE ARG 71 HE ARG 71 20.209 16.584 4.013
553 HH11 ARG 71 1HH1 ARG 71 22.475 16.839 1.313
554 HH12 ARG 71 2HH1 ARG 71 23.851 16.947 2.389
555 HH21 ARG 71 1HH2 ARG 71 22.050 16.725 5.284
556 HH22 ARG 71 2HH2 ARG 71 23.628 16.843 4.528
557 H GLU 72 H GLU 72 19.893 14.376 -2.817
558 HA GLU 72 HA GLU 72 17.568 15.253 -4.065
559 HB2 GLU 72 1HB GLU 72 20.222 14.432 -4.866
560 HB3 GLU 72 2HB GLU 72 19.024 13.998 -6.088
561 HG2 GLU 72 1HG GLU 72 19.824 16.159 -6.630
562 HG3 GLU 72 2HG GLU 72 18.183 16.360 -5.993
563 H GLN 73 H GLN 73 18.635 11.948 -3.598
564 HA GLN 73 HA GLN 73 16.906 10.642 -5.417
565 HB2 GLN 73 1HB GLN 73 17.701 9.671 -2.648
566 HB3 GLN 73 2HB GLN 73 17.239 8.679 -4.038
567 HG2 GLN 73 1HG GLN 73 19.769 10.365 -3.732
568 HG3 GLN 73 2HG GLN 73 19.663 8.602 -3.737
569 HE21 GLN 73 1HE2 GLN 73 20.389 10.458 -7.128
570 HE22 GLN 73 2HE2 GLN 73 20.688 11.082 -5.517
571 H GLU 74 H GLU 74 16.303 11.808 -2.081
572 HA GLU 74 HA GLU 74 13.506 10.940 -2.057
573 HB2 GLU 74 1HB GLU 74 15.123 12.843 -0.336
574 HB3 GLU 74 2HB GLU 74 13.417 12.520 -0.064
575 HG2 GLU 74 1HG GLU 74 15.414 10.264 -0.138
576 HG3 GLU 74 2HG GLU 74 15.185 11.242 1.322
577 H ARG 75 H ARG 75 15.322 13.859 -2.912
578 HA ARG 75 HA ARG 75 13.154 15.688 -2.712
579 HB2 ARG 75 1HB ARG 75 15.650 15.791 -4.408
580 HB3 ARG 75 2HB ARG 75 14.534 17.134 -4.204
581 HG2 ARG 75 1HG ARG 75 15.159 16.225 -1.586
582 HG3 ARG 75 2HG ARG 75 16.692 16.333 -2.469
583 HD2 ARG 75 1HD ARG 75 14.622 18.540 -2.416
584 HD3 ARG 75 2HD ARG 75 15.971 18.425 -1.268
585 HE ARG 75 HE ARG 75 17.322 18.317 -3.596
586 HH11 ARG 75 1HH1 ARG 75 14.757 20.569 -2.607
587 HH12 ARG 75 2HH1 ARG 75 15.431 21.880 -3.556
588 HH21 ARG 75 1HH2 ARG 75 18.059 20.025 -4.788
589 HH22 ARG 75 2HH2 ARG 75 17.230 21.579 -4.747
590 H ILE 76 H ILE 76 13.998 13.554 -5.406
591 HA ILE 76 HA ILE 76 12.413 14.948 -7.335
592 HB ILE 76 HB ILE 76 12.400 12.891 -8.661
593 HG12 ILE 76 1HG1 ILE 76 13.587 11.549 -6.210
594 HG13 ILE 76 2HG1 ILE 76 11.940 11.312 -6.781
595 HG21 ILE 76 1HG2 ILE 76 15.129 13.152 -7.302
596 HG22 ILE 76 2HG2 ILE 76 14.784 12.695 -8.985
597 HG23 ILE 76 3HG2 ILE 76 14.486 14.357 -8.443
598 HD11 ILE 76 1HD1 ILE 76 12.882 10.395 -8.932
599 HD12 ILE 76 2HD1 ILE 76 14.500 10.474 -8.189
600 HD13 ILE 76 3HD1 ILE 76 13.251 9.426 -7.487
601 H ARG 77 H ARG 77 11.507 13.041 -4.573
602 HA ARG 77 HA ARG 77 8.806 12.415 -5.560
603 HB2 ARG 77 1HB ARG 77 10.267 11.268 -3.703
604 HB3 ARG 77 2HB ARG 77 9.555 12.499 -2.646
605 HG2 ARG 77 1HG ARG 77 7.344 11.712 -3.123
606 HG3 ARG 77 2HG ARG 77 7.914 10.641 -4.408
607 HD2 ARG 77 1HD ARG 77 7.360 9.433 -2.355
608 HD3 ARG 77 2HD ARG 77 9.071 9.268 -2.782
609 HE ARG 77 HE ARG 77 8.010 11.096 -0.670
610 HH11 ARG 77 1HH1 ARG 77 10.640 9.072 -1.891
611 HH12 ARG 77 2HH1 ARG 77 11.636 9.354 -0.477
612 HH21 ARG 77 1HH2 ARG 77 9.352 11.422 1.072
613 HH22 ARG 77 2HH2 ARG 77 10.936 10.669 1.139
614 H LEU 78 H LEU 78 10.327 15.254 -4.622
615 HA LEU 78 HA LEU 78 7.785 16.556 -3.767
616 HB2 LEU 78 1HB LEU 78 9.658 16.383 -2.038
617 HB3 LEU 78 2HB LEU 78 10.649 17.344 -3.124
618 HG LEU 78 HG LEU 78 9.071 19.240 -2.863
619 HD11 LEU 78 1HD1 LEU 78 7.412 19.165 -1.017
620 HD12 LEU 78 2HD1 LEU 78 7.742 17.431 -0.804
621 HD13 LEU 78 3HD1 LEU 78 7.004 18.020 -2.309
622 HD21 LEU 78 1HD2 LEU 78 10.173 18.062 -0.291
623 HD22 LEU 78 2HD2 LEU 78 9.775 19.773 -0.573
624 HD23 LEU 78 3HD2 LEU 78 11.088 19.007 -1.490
625 H PHE 79 H PHE 79 7.882 18.919 -4.541
626 HA PHE 79 HA PHE 79 8.338 18.897 -7.344
627 HB2 PHE 79 1HB PHE 79 7.609 21.126 -5.439
628 HB3 PHE 79 2HB PHE 79 7.574 21.276 -7.200
629 HD1 PHE 79 HD1 PHE 79 6.177 19.031 -4.467
630 HD2 PHE 79 HD2 PHE 79 5.580 20.897 -8.315
631 HE1 PHE 79 HE1 PHE 79 3.829 18.198 -4.511
632 HE2 PHE 79 HE2 PHE 79 3.243 20.037 -8.371
633 HZ PHE 79 HZ PHE 79 2.356 18.699 -6.460
634 H SER 80 H SER 80 10.105 20.060 -4.701
635 HA SER 80 HA SER 80 12.093 21.246 -4.464
636 HB2 SER 80 1HB SER 80 12.771 19.640 -6.950
637 HB3 SER 80 2HB SER 80 13.927 20.358 -5.801
638 HG SER 80 HG SER 80 12.324 18.100 -5.553
639 H ALA 81 H ALA 81 10.291 22.904 -5.553
640 HA ALA 81 HA ALA 81 11.209 24.171 -7.999
641 HB1 ALA 81 1HB ALA 81 8.781 24.049 -7.384
642 HB2 ALA 81 2HB ALA 81 9.109 25.065 -5.957
643 HB3 ALA 81 3HB ALA 81 9.341 25.721 -7.595
644 H ASP 82 H ASP 82 13.345 24.137 -6.586
645 HA ASP 82 HA ASP 82 13.780 26.131 -4.604
646 HB2 ASP 82 1HB ASP 82 15.572 24.680 -6.558
647 HB3 ASP 82 2HB ASP 82 16.208 25.827 -5.360
648 HA PRO 83 HA PRO 83 13.489 29.379 -7.637
649 HB2 PRO 83 1HB PRO 83 13.064 31.496 -6.037
650 HB3 PRO 83 2HB PRO 83 11.912 30.122 -6.037
651 HG2 PRO 83 1HG PRO 83 14.199 30.677 -4.147
652 HG3 PRO 83 2HG PRO 83 12.484 30.328 -3.760
653 HD2 PRO 83 1HD PRO 83 14.467 28.407 -3.791
654 HD3 PRO 83 2HD PRO 83 12.741 28.054 -4.152
655 H PHE 84 H PHE 84 14.281 31.762 -7.829
656 HA PHE 84 HA PHE 84 15.806 33.400 -7.918
657 HB2 PHE 84 1HB PHE 84 16.051 32.466 -5.362
658 HB3 PHE 84 2HB PHE 84 17.719 32.379 -5.928
659 HD1 PHE 84 HD1 PHE 84 18.963 34.417 -6.449
660 HD2 PHE 84 HD2 PHE 84 14.849 34.611 -5.223
661 HE1 PHE 84 HE1 PHE 84 19.217 36.858 -6.032
662 HE2 PHE 84 HE2 PHE 84 15.078 37.064 -4.825
663 HZ PHE 84 HZ PHE 84 17.272 38.190 -5.217
664 H ASP 85 H ASP 85 16.276 30.842 -9.481
665 HA ASP 85 HA ASP 85 19.130 31.177 -10.129
666 HB2 ASP 85 1HB ASP 85 16.910 29.471 -11.240
667 HB3 ASP 85 2HB ASP 85 18.464 29.635 -12.059
668 H LEU 86 H LEU 86 18.420 33.521 -10.251
669 HA LEU 86 HA LEU 86 16.654 34.335 -12.379
670 HB2 LEU 86 1HB LEU 86 18.766 35.864 -10.831
671 HB3 LEU 86 2HB LEU 86 17.521 36.594 -11.843
672 HG LEU 86 HG LEU 86 17.027 35.010 -9.296
673 HD11 LEU 86 1HD1 LEU 86 16.455 37.192 -8.324
674 HD12 LEU 86 2HD1 LEU 86 16.883 37.997 -9.853
675 HD13 LEU 86 3HD1 LEU 86 18.134 37.165 -8.897
676 HD21 LEU 86 1HD2 LEU 86 14.712 35.911 -9.467
677 HD22 LEU 86 2HD2 LEU 86 15.110 34.815 -10.803
678 HD23 LEU 86 3HD2 LEU 86 15.106 36.573 -11.072
679 H GLU 87 H GLU 87 20.140 33.850 -12.088
680 HA GLU 87 HA GLU 87 20.652 35.002 -14.770
681 HB2 GLU 87 1HB GLU 87 22.433 33.482 -12.828
682 HB3 GLU 87 2HB GLU 87 22.942 34.048 -14.410
683 HG2 GLU 87 1HG GLU 87 22.422 36.374 -13.707
684 HG3 GLU 87 2HG GLU 87 22.077 35.760 -12.077
685 H ALA 88 H ALA 88 20.657 31.909 -13.087
686 HA ALA 88 HA ALA 88 20.744 29.747 -13.743
687 HB1 ALA 88 1HB ALA 88 19.012 30.734 -16.039
688 HB2 ALA 88 2HB ALA 88 19.154 29.050 -15.478
689 HB3 ALA 88 3HB ALA 88 18.440 30.284 -14.408
690 H GLN 89 H GLN 89 22.857 31.580 -14.852
691 HA GLN 89 HA GLN 89 23.628 30.418 -17.420
692 HB2 GLN 89 1HB GLN 89 25.146 32.166 -15.439
693 HB3 GLN 89 2HB GLN 89 25.738 31.690 -17.037
694 HG2 GLN 89 1HG GLN 89 23.675 32.793 -18.015
695 HG3 GLN 89 2HG GLN 89 23.372 33.473 -16.414
696 HE21 GLN 89 1HE2 GLN 89 26.113 35.755 -16.576
697 HE22 GLN 89 2HE2 GLN 89 25.115 34.850 -15.461
698 H ALA 90 H ALA 90 25.849 29.386 -17.635
699 HA ALA 90 HA ALA 90 26.462 27.641 -15.297
700 HB1 ALA 90 1HB ALA 90 26.207 26.713 -18.196
701 HB2 ALA 90 2HB ALA 90 26.617 25.702 -16.789
702 HB3 ALA 90 3HB ALA 90 24.997 26.421 -16.924
703 H LYS 91 H LYS 91 28.546 26.611 -15.445
704 HA LYS 91 HA LYS 91 30.786 26.649 -15.571
705 HB2 LYS 91 1HB LYS 91 29.886 26.271 -18.019
706 HB3 LYS 91 2HB LYS 91 30.667 27.816 -18.325
707 HG2 LYS 91 1HG LYS 91 32.509 26.157 -16.877
708 HG3 LYS 91 2HG LYS 91 31.824 25.192 -18.202
709 HD2 LYS 91 1HD LYS 91 32.453 26.854 -19.822
710 HD3 LYS 91 2HD LYS 91 32.906 27.987 -18.542
711 HE2 LYS 91 1HE LYS 91 34.595 26.136 -17.798
712 HE3 LYS 91 2HE LYS 91 34.346 25.471 -19.426
713 HZ1 LYS 91 1HZ LYS 91 35.299 28.216 -18.774
714 HZ2 LYS 91 2HZ LYS 91 35.052 27.647 -20.308
715 HZ3 LYS 91 3HZ LYS 91 36.235 26.989 -19.362
716 H ILE 92 H ILE 92 32.804 28.053 -16.372
717 HA ILE 92 HA ILE 92 32.401 30.917 -15.686
718 HB ILE 92 HB ILE 92 34.649 29.083 -14.666
719 HG12 ILE 92 1HG1 ILE 92 32.530 30.535 -13.047
720 HG13 ILE 92 2HG1 ILE 92 32.411 28.836 -13.495
721 HG21 ILE 92 1HG2 ILE 92 35.425 31.405 -15.202
722 HG22 ILE 92 2HG2 ILE 92 34.156 32.068 -14.145
723 HG23 ILE 92 3HG2 ILE 92 35.479 31.095 -13.461
724 HD11 ILE 92 1HD1 ILE 92 34.493 30.091 -11.666
725 HD12 ILE 92 2HD1 ILE 92 33.199 28.955 -11.227
726 HD13 ILE 92 3HD1 ILE 92 34.552 28.406 -12.241
727 H GLU 93 H GLU 93 33.140 32.020 -17.449
728 HA GLU 93 HA GLU 93 34.693 30.593 -19.481
729 HB2 GLU 93 1HB GLU 93 34.056 32.232 -20.943
730 HB3 GLU 93 2HB GLU 93 32.732 32.297 -19.791
731 HG2 GLU 93 1HG GLU 93 33.178 34.550 -20.097
732 HG3 GLU 93 2HG GLU 93 34.128 34.213 -18.643
733 H GLU 94 H GLU 94 36.675 31.550 -20.443
734 HA GLU 94 HA GLU 94 38.159 33.449 -18.769
735 HB2 GLU 94 1HB GLU 94 39.158 30.640 -19.375
736 HB3 GLU 94 2HB GLU 94 40.212 31.999 -18.977
737 HG2 GLU 94 1HG GLU 94 39.089 32.217 -16.785
738 HG3 GLU 94 2HG GLU 94 38.115 30.782 -17.164
739 H ASP 95 H ASP 95 39.019 34.856 -20.137
740 HA ASP 95 HA ASP 95 39.798 33.924 -22.875
741 HB2 ASP 95 1HB ASP 95 37.961 35.724 -22.634
742 HB3 ASP 95 2HB ASP 95 39.263 36.809 -22.125
743 H ILE 96 H ILE 96 41.380 33.429 -20.679
744 HA ILE 96 HA ILE 96 43.305 35.503 -20.157
745 HB ILE 96 HB ILE 96 44.538 33.705 -18.934
746 HG12 ILE 96 1HG1 ILE 96 42.309 31.858 -19.891
747 HG13 ILE 96 2HG1 ILE 96 43.925 31.885 -20.596
748 HG21 ILE 96 1HG2 ILE 96 42.657 34.964 -17.863
749 HG22 ILE 96 2HG2 ILE 96 41.520 33.706 -18.393
750 HG23 ILE 96 3HG2 ILE 96 42.797 33.314 -17.226
751 HD11 ILE 96 1HD1 ILE 96 43.210 31.117 -17.737
752 HD12 ILE 96 2HD1 ILE 96 43.785 30.047 -19.031
753 HD13 ILE 96 3HD1 ILE 96 44.875 31.276 -18.353
754 H ARG 97 H ARG 97 43.024 34.667 -23.009
755 HA ARG 97 HA ARG 97 45.646 33.547 -23.700
756 HB2 ARG 97 1HB ARG 97 44.866 33.798 -26.025
757 HB3 ARG 97 2HB ARG 97 43.611 33.028 -25.038
758 HG2 ARG 97 1HG ARG 97 42.492 35.222 -24.772
759 HG3 ARG 97 2HG ARG 97 43.717 35.970 -25.802
760 HD2 ARG 97 1HD ARG 97 42.973 34.722 -27.710
761 HD3 ARG 97 2HD ARG 97 41.915 33.715 -26.686
762 HE ARG 97 HE ARG 97 40.444 35.515 -26.335
763 HH11 ARG 97 1HH1 ARG 97 43.108 36.556 -28.434
764 HH12 ARG 97 2HH1 ARG 97 42.305 38.046 -28.844
765 HH21 ARG 97 1HH2 ARG 97 39.539 37.410 -26.855
766 HH22 ARG 97 2HH2 ARG 97 40.292 38.513 -27.986
767 H GLN 98 H GLN 98 44.818 36.297 -22.581
768 HA GLN 98 HA GLN 98 46.182 38.145 -24.437
769 HB2 GLN 98 1HB GLN 98 44.335 38.446 -22.122
770 HB3 GLN 98 2HB GLN 98 45.636 39.631 -22.156
771 HG2 GLN 98 1HG GLN 98 43.783 40.574 -23.404
772 HG3 GLN 98 2HG GLN 98 45.058 40.184 -24.554
773 HE21 GLN 98 1HE2 GLN 98 41.542 37.984 -24.488
774 HE22 GLN 98 2HE2 GLN 98 42.140 38.737 -23.044
775 HXT GLN 98 HO GLN 98 49.135 38.215 -22.975
Start of MODEL 29
1 H1 SER 1 1H SER 1 7.423 53.649 -1.875
2 H2 SER 1 2H SER 1 6.690 52.568 -1.019
3 H3 SER 1 3H SER 1 6.174 54.122 -1.062
4 HA SER 1 HA SER 1 4.440 52.842 -2.057
5 HB2 SER 1 1HB SER 1 5.369 53.753 -4.612
6 HB3 SER 1 2HB SER 1 4.341 54.658 -3.443
7 HG SER 1 HG SER 1 6.803 54.336 -2.487
8 H GLN 2 H GLN 2 7.593 51.915 -2.983
9 HA GLN 2 HA GLN 2 6.619 49.724 -4.738
10 HB2 GLN 2 1HB GLN 2 8.918 51.235 -4.776
11 HB3 GLN 2 2HB GLN 2 9.472 49.816 -3.885
12 HG2 GLN 2 1HG GLN 2 8.172 49.802 -6.641
13 HG3 GLN 2 2HG GLN 2 9.903 49.644 -6.317
14 HE21 GLN 2 1HE2 GLN 2 8.097 46.300 -6.754
15 HE22 GLN 2 2HE2 GLN 2 7.932 47.808 -7.626
16 H GLN 3 H GLN 3 6.163 47.770 -3.885
17 HA GLN 3 HA GLN 3 7.413 46.940 -1.330
18 HB2 GLN 3 1HB GLN 3 4.409 47.039 -1.831
19 HB3 GLN 3 2HB GLN 3 5.174 46.163 -0.503
20 HG2 GLN 3 1HG GLN 3 6.120 48.302 0.328
21 HG3 GLN 3 2HG GLN 3 5.231 49.161 -0.943
22 HE21 GLN 3 1HE2 GLN 3 3.386 47.990 2.456
23 HE22 GLN 3 2HE2 GLN 3 5.081 47.686 2.156
24 H SER 4 H SER 4 5.158 46.052 -3.937
25 HA SER 4 HA SER 4 4.756 44.135 -5.082
26 HB2 SER 4 1HB SER 4 7.372 44.221 -5.248
27 HB3 SER 4 2HB SER 4 7.301 42.849 -4.119
28 HG SER 4 HG SER 4 7.145 41.854 -6.027
29 H HIS 5 H HIS 5 4.699 41.590 -4.790
30 HA HIS 5 HA HIS 5 4.648 40.490 -2.166
31 HB2 HIS 5 1HB HIS 5 2.275 40.165 -1.784
32 HB3 HIS 5 2HB HIS 5 2.568 41.901 -1.911
33 HD1 HIS 5 HD1 HIS 5 1.994 42.914 -4.452
34 HD2 HIS 5 HD2 HIS 5 0.292 39.278 -3.362
35 HE1 HIS 5 HE1 HIS 5 0.033 42.528 -6.004
36 H SER 6 H SER 6 4.315 38.261 -2.324
37 HA SER 6 HA SER 6 4.247 36.201 -3.235
38 HB2 SER 6 1HB SER 6 2.532 37.422 -5.412
39 HB3 SER 6 2HB SER 6 2.651 35.704 -4.988
40 HG SER 6 HG SER 6 0.853 37.028 -4.058
41 H SER 7 H SER 7 5.833 35.099 -4.104
42 HA SER 7 HA SER 7 6.959 36.016 -6.717
43 HB2 SER 7 1HB SER 7 8.403 36.631 -4.819
44 HB3 SER 7 2HB SER 7 8.446 34.936 -4.308
45 HG SER 7 HG SER 7 10.186 35.043 -5.492
46 HA PRO 8 HA PRO 8 5.939 31.516 -6.924
47 HB2 PRO 8 1HB PRO 8 4.370 31.464 -9.125
48 HB3 PRO 8 2HB PRO 8 3.719 32.002 -7.542
49 HG2 PRO 8 1HG PRO 8 4.771 33.674 -9.818
50 HG3 PRO 8 2HG PRO 8 3.204 33.810 -8.955
51 HD2 PRO 8 1HD PRO 8 5.360 35.338 -8.311
52 HD3 PRO 8 2HD PRO 8 4.201 34.749 -7.070
53 H GLY 9 H GLY 9 6.530 29.958 -8.550
54 HA2 GLY 9 1HA GLY 9 7.520 29.491 -10.769
55 HA3 GLY 9 2HA GLY 9 8.387 31.033 -10.660
56 H GLU 10 H GLU 10 7.970 28.947 -7.915
57 HA GLU 10 HA GLU 10 10.754 28.916 -7.300
58 HB2 GLU 10 1HB GLU 10 8.633 27.120 -6.083
59 HB3 GLU 10 2HB GLU 10 10.058 27.815 -5.305
60 HG2 GLU 10 1HG GLU 10 8.522 29.247 -4.414
61 HG3 GLU 10 2HG GLU 10 8.745 30.117 -5.935
62 H ILE 11 H ILE 11 10.035 27.475 -9.812
63 HA ILE 11 HA ILE 11 10.492 24.695 -9.289
64 HB ILE 11 HB ILE 11 10.269 26.157 -11.966
65 HG12 ILE 11 1HG1 ILE 11 8.380 26.978 -10.639
66 HG13 ILE 11 2HG1 ILE 11 7.822 25.874 -11.875
67 HG21 ILE 11 1HG2 ILE 11 9.063 24.067 -12.569
68 HG22 ILE 11 2HG2 ILE 11 10.783 23.890 -12.198
69 HG23 ILE 11 3HG2 ILE 11 9.576 23.420 -10.992
70 HD11 ILE 11 1HD1 ILE 11 6.599 25.524 -9.730
71 HD12 ILE 11 2HD1 ILE 11 7.501 24.066 -10.184
72 HD13 ILE 11 3HD1 ILE 11 8.123 25.138 -8.908
73 H THR 12 H THR 12 12.495 27.125 -9.143
74 HA THR 12 HA THR 12 14.813 25.550 -9.994
75 HB THR 12 HB THR 12 14.157 26.727 -12.118
76 HG1 THR 12 HG1 THR 12 16.231 27.510 -12.500
77 HG21 THR 12 1HG2 THR 12 14.853 29.284 -10.612
78 HG22 THR 12 2HG2 THR 12 13.208 28.799 -11.075
79 HG23 THR 12 3HG2 THR 12 14.417 29.139 -12.329
80 H SER 13 H SER 13 16.801 26.333 -9.143
81 HA SER 13 HA SER 13 16.724 28.730 -7.440
82 HB2 SER 13 1HB SER 13 17.481 27.538 -5.445
83 HB3 SER 13 2HB SER 13 15.856 27.027 -5.933
84 HG SER 13 HG SER 13 18.187 25.630 -6.732
85 H SER 14 H SER 14 18.399 29.726 -8.237
86 HA SER 14 HA SER 14 20.462 30.025 -9.325
87 HB2 SER 14 1HB SER 14 20.563 30.393 -6.803
88 HB3 SER 14 2HB SER 14 21.487 28.880 -6.731
89 HG SER 14 HG SER 14 22.736 30.876 -6.982
90 HA PRO 15 HA PRO 15 21.562 25.609 -10.163
91 HB2 PRO 15 1HB PRO 15 21.218 25.487 -12.881
92 HB3 PRO 15 2HB PRO 15 19.887 25.189 -11.714
93 HG2 PRO 15 1HG PRO 15 20.566 27.737 -13.178
94 HG3 PRO 15 2HG PRO 15 18.983 26.896 -13.055
95 HD2 PRO 15 1HD PRO 15 19.589 28.972 -11.445
96 HD3 PRO 15 2HD PRO 15 18.684 27.551 -10.818
97 H GLN 16 H GLN 16 22.334 28.622 -11.913
98 HA GLN 16 HA GLN 16 24.885 27.610 -12.854
99 HB2 GLN 16 1HB GLN 16 25.295 29.813 -13.657
100 HB3 GLN 16 2HB GLN 16 23.607 29.438 -13.968
101 HG2 GLN 16 1HG GLN 16 23.348 31.565 -13.197
102 HG3 GLN 16 2HG GLN 16 23.245 30.727 -11.647
103 HE21 GLN 16 1HE2 GLN 16 26.570 32.972 -12.589
104 HE22 GLN 16 2HE2 GLN 16 25.541 32.344 -13.854
105 H GLY 17 H GLY 17 23.728 28.711 -9.792
106 HA2 GLY 17 1HA GLY 17 26.269 29.816 -8.901
107 HA3 GLY 17 2HA GLY 17 24.841 29.464 -7.912
108 H LEU 18 H LEU 18 24.861 26.676 -9.224
109 HA LEU 18 HA LEU 18 26.470 25.362 -7.185
110 HB2 LEU 18 1HB LEU 18 25.273 24.233 -9.743
111 HB3 LEU 18 2HB LEU 18 25.871 23.295 -8.379
112 HG LEU 18 HG LEU 18 23.492 25.180 -8.300
113 HD11 LEU 18 1HD1 LEU 18 22.136 23.125 -8.250
114 HD12 LEU 18 2HD1 LEU 18 23.614 22.143 -8.430
115 HD13 LEU 18 3HD1 LEU 18 23.100 23.232 -9.739
116 HD21 LEU 18 1HD2 LEU 18 22.990 24.038 -6.135
117 HD22 LEU 18 2HD2 LEU 18 24.515 24.942 -6.079
118 HD23 LEU 18 3HD2 LEU 18 24.541 23.170 -6.253
119 H ASP 19 H ASP 19 26.768 26.131 -10.604
120 HA ASP 19 HA ASP 19 29.317 24.779 -10.989
121 HB2 ASP 19 1HB ASP 19 27.551 25.209 -12.748
122 HB3 ASP 19 2HB ASP 19 27.947 26.930 -12.645
123 H ASN 20 H ASN 20 28.137 28.019 -10.295
124 HA ASN 20 HA ASN 20 30.942 29.013 -10.083
125 HB2 ASN 20 1HB ASN 20 28.383 30.250 -10.963
126 HB3 ASN 20 2HB ASN 20 29.449 31.252 -9.994
127 HD21 ASN 20 1HD2 ASN 20 30.155 31.189 -13.756
128 HD22 ASN 20 2HD2 ASN 20 28.645 30.764 -12.995
129 HA PRO 21 HA PRO 21 29.569 29.000 -5.677
130 HB2 PRO 21 1HB PRO 21 32.196 29.021 -4.760
131 HB3 PRO 21 2HB PRO 21 31.264 27.527 -5.024
132 HG2 PRO 21 1HG PRO 21 33.220 28.862 -6.808
133 HG3 PRO 21 2HG PRO 21 33.077 27.136 -6.394
134 HD2 PRO 21 1HD PRO 21 32.155 28.049 -8.712
135 HD3 PRO 21 2HD PRO 21 31.214 26.839 -7.770
136 H ALA 22 H ALA 22 31.942 30.749 -7.639
137 HA ALA 22 HA ALA 22 32.460 32.918 -5.907
138 HB1 ALA 22 1HB ALA 22 32.322 32.785 -8.955
139 HB2 ALA 22 2HB ALA 22 33.041 34.123 -8.019
140 HB3 ALA 22 3HB ALA 22 33.755 32.496 -7.935
141 H LEU 23 H LEU 23 29.932 32.488 -8.371
142 HA LEU 23 HA LEU 23 28.739 35.082 -7.985
143 HB2 LEU 23 1HB LEU 23 27.896 32.500 -9.322
144 HB3 LEU 23 2HB LEU 23 26.815 33.860 -9.228
145 HG LEU 23 HG LEU 23 28.002 33.512 -11.424
146 HD11 LEU 23 1HD1 LEU 23 28.284 36.155 -10.014
147 HD12 LEU 23 2HD1 LEU 23 26.811 35.510 -10.769
148 HD13 LEU 23 3HD1 LEU 23 28.221 35.894 -11.775
149 HD21 LEU 23 1HD2 LEU 23 30.380 34.858 -10.064
150 HD22 LEU 23 2HD2 LEU 23 30.199 34.465 -11.784
151 HD23 LEU 23 3HD2 LEU 23 30.360 33.163 -10.599
152 H LEU 24 H LEU 24 27.997 31.758 -6.860
153 HA LEU 24 HA LEU 24 25.530 32.505 -5.619
154 HB2 LEU 24 1HB LEU 24 26.207 30.193 -6.183
155 HB3 LEU 24 2HB LEU 24 27.428 30.237 -4.925
156 HG LEU 24 HG LEU 24 25.818 30.162 -3.202
157 HD11 LEU 24 1HD1 LEU 24 23.348 30.221 -3.620
158 HD12 LEU 24 2HD1 LEU 24 23.683 30.748 -5.284
159 HD13 LEU 24 3HD1 LEU 24 24.157 31.767 -3.905
160 HD21 LEU 24 1HD2 LEU 24 26.192 28.071 -4.535
161 HD22 LEU 24 2HD2 LEU 24 24.696 28.425 -5.420
162 HD23 LEU 24 3HD2 LEU 24 24.640 28.117 -3.668
163 H ARG 25 H ARG 25 28.892 32.388 -4.414
164 HA ARG 25 HA ARG 25 28.362 33.061 -1.699
165 HB2 ARG 25 1HB ARG 25 30.522 32.293 -2.458
166 HB3 ARG 25 2HB ARG 25 30.665 33.596 -3.603
167 HG2 ARG 25 1HG ARG 25 30.528 34.232 -0.663
168 HG3 ARG 25 2HG ARG 25 32.020 33.583 -1.350
169 HD2 ARG 25 1HD ARG 25 30.613 36.156 -2.102
170 HD3 ARG 25 2HD ARG 25 32.188 35.980 -1.336
171 HE ARG 25 HE ARG 25 31.603 35.124 -4.147
172 HH11 ARG 25 1HH1 ARG 25 33.783 36.699 -1.846
173 HH12 ARG 25 2HH1 ARG 25 34.951 37.064 -3.083
174 HH21 ARG 25 1HH2 ARG 25 33.110 35.639 -5.640
175 HH22 ARG 25 2HH2 ARG 25 34.584 36.464 -5.198
176 H ASP 26 H ASP 26 28.801 35.067 -4.621
177 HA ASP 26 HA ASP 26 28.783 37.570 -3.262
178 HB2 ASP 26 1HB ASP 26 29.452 36.888 -5.702
179 HB3 ASP 26 2HB ASP 26 27.751 37.186 -6.079
180 H MET 27 H MET 27 26.187 35.722 -4.887
181 HA MET 27 HA MET 27 24.046 37.564 -4.418
182 HB2 MET 27 1HB MET 27 24.045 35.564 -5.943
183 HB3 MET 27 2HB MET 27 23.948 34.521 -4.528
184 HG2 MET 27 1HG MET 27 21.905 36.661 -5.142
185 HG3 MET 27 2HG MET 27 21.791 35.027 -5.787
186 HE1 MET 27 1HE MET 27 21.020 32.923 -4.461
187 HE2 MET 27 2HE MET 27 22.474 33.019 -3.436
188 HE3 MET 27 3HE MET 27 20.872 32.851 -2.692
189 H LEU 28 H LEU 28 25.189 34.752 -2.558
190 HA LEU 28 HA LEU 28 23.248 34.904 -0.512
191 HB2 LEU 28 1HB LEU 28 25.990 33.769 -0.754
192 HB3 LEU 28 2HB LEU 28 25.219 33.824 0.828
193 HG LEU 28 HG LEU 28 23.814 32.610 -1.547
194 HD11 LEU 28 1HD1 LEU 28 25.961 31.533 -1.288
195 HD12 LEU 28 2HD1 LEU 28 24.651 30.457 -0.763
196 HD13 LEU 28 3HD1 LEU 28 25.661 31.293 0.445
197 HD21 LEU 28 1HD2 LEU 28 22.526 31.476 0.180
198 HD22 LEU 28 2HD2 LEU 28 22.526 33.217 0.512
199 HD23 LEU 28 3HD2 LEU 28 23.572 32.158 1.455
200 H LEU 29 H LEU 29 26.462 36.469 -0.706
201 HA LEU 29 HA LEU 29 26.340 37.524 1.978
202 HB2 LEU 29 1HB LEU 29 27.818 38.413 -0.509
203 HB3 LEU 29 2HB LEU 29 27.987 39.240 1.036
204 HG LEU 29 HG LEU 29 28.655 36.314 0.622
205 HD11 LEU 29 1HD1 LEU 29 30.050 37.762 -0.768
206 HD12 LEU 29 2HD1 LEU 29 30.983 37.036 0.560
207 HD13 LEU 29 3HD1 LEU 29 30.472 38.739 0.661
208 HD21 LEU 29 1HD2 LEU 29 28.190 36.852 2.957
209 HD22 LEU 29 2HD2 LEU 29 29.306 38.233 2.883
210 HD23 LEU 29 3HD2 LEU 29 29.924 36.567 2.722
211 H ALA 30 H ALA 30 25.129 38.656 -1.141
212 HA ALA 30 HA ALA 30 24.362 41.260 -0.075
213 HB1 ALA 30 1HB ALA 30 23.379 41.590 -2.303
214 HB2 ALA 30 2HB ALA 30 25.026 40.933 -2.444
215 HB3 ALA 30 3HB ALA 30 23.619 39.867 -2.685
216 H ASN 31 H ASN 31 22.941 38.107 0.045
217 HA ASN 31 HA ASN 31 20.202 39.288 0.191
218 HB2 ASN 31 1HB ASN 31 20.729 37.510 -1.515
219 HB3 ASN 31 2HB ASN 31 20.934 36.372 -0.179
220 HD21 ASN 31 1HD2 ASN 31 17.424 36.471 -1.609
221 HD22 ASN 31 2HD2 ASN 31 19.000 36.541 -2.399
222 HA PRO 32 HA PRO 32 20.987 38.350 4.505
223 HB2 PRO 32 1HB PRO 32 18.870 39.700 5.604
224 HB3 PRO 32 2HB PRO 32 20.372 40.507 5.051
225 HG2 PRO 32 1HG PRO 32 17.778 40.149 3.558
226 HG3 PRO 32 2HG PRO 32 18.721 41.648 3.837
227 HD2 PRO 32 1HD PRO 32 18.951 40.304 1.553
228 HD3 PRO 32 2HD PRO 32 20.403 41.015 2.342
229 H HIS 33 H HIS 33 17.968 37.743 2.718
230 HA HIS 33 HA HIS 33 16.875 36.076 4.853
231 HB2 HIS 33 1HB HIS 33 15.469 37.290 3.169
232 HB3 HIS 33 2HB HIS 33 16.089 36.206 1.920
233 HD1 HIS 33 HD1 HIS 33 14.245 35.896 5.278
234 HD2 HIS 33 HD2 HIS 33 14.573 33.995 1.587
235 HE1 HIS 33 HE1 HIS 33 12.576 34.001 5.287
236 H GLU 34 H GLU 34 18.543 35.557 1.736
237 HA GLU 34 HA GLU 34 18.269 32.695 1.831
238 HB2 GLU 34 1HB GLU 34 19.427 34.658 0.078
239 HB3 GLU 34 2HB GLU 34 20.537 33.333 0.277
240 HG2 GLU 34 1HG GLU 34 17.651 32.829 -0.409
241 HG3 GLU 34 2HG GLU 34 18.803 33.292 -1.658
242 H LEU 35 H LEU 35 20.757 35.019 2.872
243 HA LEU 35 HA LEU 35 22.643 32.995 3.609
244 HB2 LEU 35 1HB LEU 35 23.969 34.653 4.248
245 HB3 LEU 35 2HB LEU 35 22.897 35.451 3.156
246 HG LEU 35 HG LEU 35 21.732 36.523 5.013
247 HD11 LEU 35 1HD1 LEU 35 23.053 36.727 7.161
248 HD12 LEU 35 2HD1 LEU 35 23.890 35.225 6.681
249 HD13 LEU 35 3HD1 LEU 35 22.128 35.236 6.946
250 HD21 LEU 35 1HD2 LEU 35 23.616 38.099 5.320
251 HD22 LEU 35 2HD2 LEU 35 23.493 37.506 3.651
252 HD23 LEU 35 3HD2 LEU 35 24.732 36.835 4.734
253 H SER 36 H SER 36 19.867 34.378 5.246
254 HA SER 36 HA SER 36 20.520 33.354 7.856
255 HB2 SER 36 1HB SER 36 19.001 35.285 7.503
256 HB3 SER 36 2HB SER 36 17.815 34.192 6.756
257 HG SER 36 HG SER 36 17.583 33.139 8.706
258 H LEU 37 H LEU 37 18.287 32.284 5.214
259 HA LEU 37 HA LEU 37 17.435 29.970 6.690
260 HB2 LEU 37 1HB LEU 37 16.489 29.202 4.694
261 HB3 LEU 37 2HB LEU 37 16.341 30.901 4.841
262 HG LEU 37 HG LEU 37 18.135 31.150 3.127
263 HD11 LEU 37 1HD1 LEU 37 18.782 28.814 3.071
264 HD12 LEU 37 2HD1 LEU 37 18.195 29.391 1.503
265 HD13 LEU 37 3HD1 LEU 37 17.142 28.389 2.538
266 HD21 LEU 37 1HD2 LEU 37 16.399 31.038 1.362
267 HD22 LEU 37 2HD2 LEU 37 15.802 31.810 2.839
268 HD23 LEU 37 3HD2 LEU 37 15.352 30.126 2.479
269 H LEU 38 H LEU 38 20.192 30.697 4.708
270 HA LEU 38 HA LEU 38 21.023 27.999 4.381
271 HB2 LEU 38 1HB LEU 38 21.619 29.931 3.055
272 HB3 LEU 38 2HB LEU 38 22.595 30.558 4.400
273 HG LEU 38 HG LEU 38 23.995 28.486 4.371
274 HD11 LEU 38 1HD1 LEU 38 22.475 26.974 3.240
275 HD12 LEU 38 2HD1 LEU 38 23.993 27.106 2.333
276 HD13 LEU 38 3HD1 LEU 38 22.543 27.968 1.763
277 HD21 LEU 38 1HD2 LEU 38 25.389 29.131 2.539
278 HD22 LEU 38 2HD2 LEU 38 24.703 30.589 3.284
279 HD23 LEU 38 3HD2 LEU 38 24.037 29.975 1.756
280 H LYS 39 H LYS 39 21.904 30.461 6.863
281 HA LYS 39 HA LYS 39 23.695 28.602 8.193
282 HB2 LYS 39 1HB LYS 39 23.465 30.089 10.191
283 HB3 LYS 39 2HB LYS 39 24.075 30.862 8.727
284 HG2 LYS 39 1HG LYS 39 22.048 31.998 8.350
285 HG3 LYS 39 2HG LYS 39 21.161 31.027 9.493
286 HD2 LYS 39 1HD LYS 39 21.478 33.092 10.546
287 HD3 LYS 39 2HD LYS 39 22.662 32.012 11.303
288 HE2 LYS 39 1HE LYS 39 24.441 32.921 9.859
289 HE3 LYS 39 2HE LYS 39 23.246 33.928 9.003
290 HZ1 LYS 39 1HZ LYS 39 23.897 34.153 11.887
291 HZ2 LYS 39 2HZ LYS 39 22.818 35.092 11.066
292 HZ3 LYS 39 3HZ LYS 39 24.428 35.176 10.709
293 H GLU 40 H GLU 40 20.225 29.026 8.229
294 HA GLU 40 HA GLU 40 19.854 27.345 10.580
295 HB2 GLU 40 1HB GLU 40 18.049 28.290 8.334
296 HB3 GLU 40 2HB GLU 40 17.486 27.200 9.612
297 HG2 GLU 40 1HG GLU 40 18.069 28.877 11.309
298 HG3 GLU 40 2HG GLU 40 18.649 29.972 10.047
299 H ARG 41 H ARG 41 19.384 26.781 7.021
300 HA ARG 41 HA ARG 41 18.927 23.944 7.573
301 HB2 ARG 41 1HB ARG 41 18.493 23.676 5.320
302 HB3 ARG 41 2HB ARG 41 17.839 25.239 5.775
303 HG2 ARG 41 1HG ARG 41 19.811 26.301 4.675
304 HG3 ARG 41 2HG ARG 41 20.312 24.693 4.123
305 HD2 ARG 41 1HD ARG 41 18.213 24.413 2.897
306 HD3 ARG 41 2HD ARG 41 17.586 25.927 3.560
307 HE ARG 41 HE ARG 41 19.948 26.570 2.176
308 HH11 ARG 41 1HH1 ARG 41 16.703 25.385 1.396
309 HH12 ARG 41 2HH1 ARG 41 16.698 26.159 -0.165
310 HH21 ARG 41 1HH2 ARG 41 19.840 27.573 0.171
311 HH22 ARG 41 2HH2 ARG 41 18.435 27.374 -0.837
312 H ASN 42 H ASN 42 21.673 25.720 6.559
313 HA ASN 42 HA ASN 42 23.269 23.191 6.476
314 HB2 ASN 42 1HB ASN 42 22.559 24.104 4.182
315 HB3 ASN 42 2HB ASN 42 23.688 25.409 4.457
316 HD21 ASN 42 1HD2 ASN 42 25.432 22.794 2.578
317 HD22 ASN 42 2HD2 ASN 42 24.174 23.974 2.339
318 HA PRO 43 HA PRO 43 25.305 26.618 8.856
319 HB2 PRO 43 1HB PRO 43 26.351 24.999 10.874
320 HB3 PRO 43 2HB PRO 43 24.825 25.935 10.951
321 HG2 PRO 43 1HG PRO 43 25.232 23.043 10.274
322 HG3 PRO 43 2HG PRO 43 24.014 23.798 11.341
323 HD2 PRO 43 1HD PRO 43 23.407 23.046 8.836
324 HD3 PRO 43 2HD PRO 43 22.744 24.570 9.526
325 HA PRO 44 HA PRO 44 29.427 24.558 8.264
326 HB2 PRO 44 1HB PRO 44 29.808 22.527 6.480
327 HB3 PRO 44 2HB PRO 44 29.485 22.250 8.223
328 HG2 PRO 44 1HG PRO 44 27.564 22.232 5.936
329 HG3 PRO 44 2HG PRO 44 27.832 20.987 7.198
330 HD2 PRO 44 1HD PRO 44 25.839 22.781 7.428
331 HD3 PRO 44 2HD PRO 44 26.806 22.300 8.862
332 H LEU 45 H LEU 45 27.138 24.586 5.442
333 HA LEU 45 HA LEU 45 29.227 25.702 3.713
334 HB2 LEU 45 1HB LEU 45 27.274 24.499 2.805
335 HB3 LEU 45 2HB LEU 45 26.218 25.778 3.396
336 HG LEU 45 HG LEU 45 27.224 27.384 1.866
337 HD11 LEU 45 1HD1 LEU 45 29.544 26.617 1.751
338 HD12 LEU 45 2HD1 LEU 45 28.864 26.669 0.123
339 HD13 LEU 45 3HD1 LEU 45 29.043 25.108 0.955
340 HD21 LEU 45 1HD2 LEU 45 26.424 26.442 -0.229
341 HD22 LEU 45 2HD2 LEU 45 25.365 25.912 1.092
342 HD23 LEU 45 3HD2 LEU 45 26.569 24.790 0.415
343 H ALA 46 H ALA 46 26.658 26.848 5.852
344 HA ALA 46 HA ALA 46 26.814 29.575 5.089
345 HB1 ALA 46 1HB ALA 46 26.176 28.448 7.818
346 HB2 ALA 46 2HB ALA 46 25.724 30.042 7.175
347 HB3 ALA 46 3HB ALA 46 25.035 28.567 6.459
348 H GLU 47 H GLU 47 28.617 27.855 7.761
349 HA GLU 47 HA GLU 47 29.907 30.223 8.663
350 HB2 GLU 47 1HB GLU 47 31.527 28.829 9.757
351 HB3 GLU 47 2HB GLU 47 29.916 28.132 9.949
352 HG2 GLU 47 1HG GLU 47 30.400 26.458 8.265
353 HG3 GLU 47 2HG GLU 47 31.973 27.184 7.924
354 H ALA 48 H ALA 48 30.690 28.116 5.959
355 HA ALA 48 HA ALA 48 33.246 29.123 5.394
356 HB1 ALA 48 1HB ALA 48 31.175 28.115 3.401
357 HB2 ALA 48 2HB ALA 48 32.931 28.052 3.249
358 HB3 ALA 48 3HB ALA 48 32.125 27.035 4.449
359 H LEU 49 H LEU 49 30.000 30.183 4.487
360 HA LEU 49 HA LEU 49 30.829 32.304 2.704
361 HB2 LEU 49 1HB LEU 49 28.564 31.224 2.714
362 HB3 LEU 49 2HB LEU 49 28.274 31.915 4.300
363 HG LEU 49 HG LEU 49 28.696 34.211 3.118
364 HD11 LEU 49 1HD1 LEU 49 27.851 32.443 0.794
365 HD12 LEU 49 2HD1 LEU 49 29.434 33.230 0.976
366 HD13 LEU 49 3HD1 LEU 49 27.972 34.217 0.780
367 HD21 LEU 49 1HD2 LEU 49 26.302 34.369 2.686
368 HD22 LEU 49 2HD2 LEU 49 26.606 33.453 4.171
369 HD23 LEU 49 3HD2 LEU 49 26.166 32.594 2.677
370 H LEU 50 H LEU 50 29.864 32.113 6.152
371 HA LEU 50 HA LEU 50 29.816 34.926 6.630
372 HB2 LEU 50 1HB LEU 50 30.616 32.817 8.660
373 HB3 LEU 50 2HB LEU 50 29.922 34.393 8.978
374 HG LEU 50 HG LEU 50 28.578 31.894 8.060
375 HD11 LEU 50 1HD1 LEU 50 27.189 32.236 9.977
376 HD12 LEU 50 2HD1 LEU 50 28.041 33.764 10.334
377 HD13 LEU 50 3HD1 LEU 50 28.908 32.207 10.412
378 HD21 LEU 50 1HD2 LEU 50 27.626 33.484 6.570
379 HD22 LEU 50 2HD2 LEU 50 27.383 34.653 7.900
380 HD23 LEU 50 3HD2 LEU 50 26.450 33.134 7.846
381 H SER 51 H SER 51 32.376 32.579 6.532
382 HA SER 51 HA SER 51 34.357 34.178 7.899
383 HB2 SER 51 1HB SER 51 34.256 31.672 7.681
384 HB3 SER 51 2HB SER 51 34.690 31.875 5.982
385 HG SER 51 HG SER 51 36.515 33.221 7.038
386 H GLY 52 H GLY 52 33.133 34.105 4.634
387 HA2 GLY 52 1HA GLY 52 33.517 35.802 3.087
388 HA3 GLY 52 2HA GLY 52 34.963 36.295 3.973
389 H ASP 53 H ASP 53 35.894 33.394 3.916
390 HA ASP 53 HA ASP 53 37.557 33.705 1.614
391 HB2 ASP 53 1HB ASP 53 37.987 32.394 3.819
392 HB3 ASP 53 2HB ASP 53 37.151 31.116 3.013
393 H LEU 54 H LEU 54 36.927 33.441 -0.451
394 HA LEU 54 HA LEU 54 34.618 31.912 -1.204
395 HB2 LEU 54 1HB LEU 54 35.628 33.708 -2.581
396 HB3 LEU 54 2HB LEU 54 37.032 32.693 -2.875
397 HG LEU 54 HG LEU 54 35.213 32.934 -4.653
398 HD11 LEU 54 1HD1 LEU 54 35.644 30.800 -5.645
399 HD12 LEU 54 2HD1 LEU 54 36.129 30.131 -4.076
400 HD13 LEU 54 3HD1 LEU 54 37.116 31.388 -4.842
401 HD21 LEU 54 1HD2 LEU 54 33.256 32.417 -3.273
402 HD22 LEU 54 2HD2 LEU 54 33.836 30.750 -3.098
403 HD23 LEU 54 3HD2 LEU 54 33.386 31.362 -4.690
404 H GLU 55 H GLU 55 38.079 31.161 -0.823
405 HA GLU 55 HA GLU 55 38.094 28.686 -2.197
406 HB2 GLU 55 1HB GLU 55 39.620 29.454 0.313
407 HB3 GLU 55 2HB GLU 55 40.002 28.091 -0.734
408 HG2 GLU 55 1HG GLU 55 39.948 30.920 -1.790
409 HG3 GLU 55 2HG GLU 55 41.348 30.248 -0.952
410 H LYS 56 H LYS 56 37.528 29.310 1.315
411 HA LYS 56 HA LYS 56 36.855 26.549 1.776
412 HB2 LYS 56 1HB LYS 56 36.252 27.090 3.972
413 HB3 LYS 56 2HB LYS 56 37.576 28.226 3.542
414 HG2 LYS 56 1HG LYS 56 35.690 29.838 3.104
415 HG3 LYS 56 2HG LYS 56 34.720 28.707 4.015
416 HD2 LYS 56 1HD LYS 56 37.394 29.623 5.071
417 HD3 LYS 56 2HD LYS 56 35.957 30.601 5.284
418 HE2 LYS 56 1HE LYS 56 34.817 28.686 6.421
419 HE3 LYS 56 2HE LYS 56 36.307 27.737 6.254
420 HZ1 LYS 56 1HZ LYS 56 37.436 29.327 7.646
421 HZ2 LYS 56 2HZ LYS 56 36.070 28.831 8.439
422 HZ3 LYS 56 3HZ LYS 56 36.119 30.315 7.718
423 H PHE 57 H PHE 57 34.890 29.374 0.845
424 HA PHE 57 HA PHE 57 32.373 28.076 1.229
425 HB2 PHE 57 1HB PHE 57 32.583 30.493 0.825
426 HB3 PHE 57 2HB PHE 57 33.141 30.173 -0.822
427 HD1 PHE 57 HD1 PHE 57 30.220 29.851 1.467
428 HD2 PHE 57 HD2 PHE 57 31.610 29.724 -2.606
429 HE1 PHE 57 HE1 PHE 57 27.865 29.799 0.669
430 HE2 PHE 57 HE2 PHE 57 29.257 29.665 -3.404
431 HZ PHE 57 HZ PHE 57 27.383 29.718 -1.780
432 H SER 58 H SER 58 34.438 28.286 -1.710
433 HA SER 58 HA SER 58 32.783 26.660 -3.353
434 HB2 SER 58 1HB SER 58 34.620 28.095 -4.193
435 HB3 SER 58 2HB SER 58 35.804 27.086 -3.339
436 HG SER 58 HG SER 58 35.706 26.433 -5.465
437 H ARG 59 H ARG 59 35.509 25.836 -1.204
438 HA ARG 59 HA ARG 59 35.629 23.099 -1.995
439 HB2 ARG 59 1HB ARG 59 37.388 24.295 -0.741
440 HB3 ARG 59 2HB ARG 59 36.333 24.382 0.670
441 HG2 ARG 59 1HG ARG 59 36.858 21.663 -0.514
442 HG3 ARG 59 2HG ARG 59 38.216 22.449 0.301
443 HD2 ARG 59 1HD ARG 59 37.213 22.360 2.386
444 HD3 ARG 59 2HD ARG 59 35.572 22.353 1.719
445 HE ARG 59 HE ARG 59 36.650 19.953 0.857
446 HH11 ARG 59 1HH1 ARG 59 36.122 21.413 4.030
447 HH12 ARG 59 2HH1 ARG 59 35.928 19.867 4.808
448 HH21 ARG 59 1HH2 ARG 59 36.346 18.023 1.902
449 HH22 ARG 59 2HH2 ARG 59 36.090 17.982 3.634
450 H VAL 60 H VAL 60 33.791 24.710 0.657
451 HA VAL 60 HA VAL 60 32.690 22.173 1.522
452 HB VAL 60 HB VAL 60 31.746 25.019 2.089
453 HG11 VAL 60 1HG1 VAL 60 29.910 23.493 2.475
454 HG12 VAL 60 2HG1 VAL 60 30.969 22.337 3.314
455 HG13 VAL 60 3HG1 VAL 60 30.604 23.913 4.050
456 HG21 VAL 60 1HG2 VAL 60 34.046 24.498 2.936
457 HG22 VAL 60 2HG2 VAL 60 32.890 24.707 4.257
458 HG23 VAL 60 3HG2 VAL 60 33.402 23.074 3.773
459 H LEU 61 H LEU 61 31.771 24.663 -0.850
460 HA LEU 61 HA LEU 61 29.092 23.881 -1.240
461 HB2 LEU 61 1HB LEU 61 30.356 25.850 -2.262
462 HB3 LEU 61 2HB LEU 61 30.984 24.724 -3.451
463 HG LEU 61 HG LEU 61 28.283 24.248 -3.620
464 HD11 LEU 61 1HD1 LEU 61 27.170 26.398 -3.600
465 HD12 LEU 61 2HD1 LEU 61 28.688 27.220 -3.169
466 HD13 LEU 61 3HD1 LEU 61 27.904 26.115 -2.013
467 HD21 LEU 61 1HD2 LEU 61 28.365 25.348 -5.717
468 HD22 LEU 61 2HD2 LEU 61 30.033 24.797 -5.442
469 HD23 LEU 61 3HD2 LEU 61 29.590 26.490 -5.164
470 H VAL 62 H VAL 62 32.059 22.584 -2.874
471 HA VAL 62 HA VAL 62 30.449 20.753 -4.427
472 HB VAL 62 HB VAL 62 32.688 21.509 -5.164
473 HG11 VAL 62 1HG1 VAL 62 34.730 20.448 -4.290
474 HG12 VAL 62 2HG1 VAL 62 33.933 21.445 -3.070
475 HG13 VAL 62 3HG1 VAL 62 33.788 19.672 -3.004
476 HG21 VAL 62 1HG2 VAL 62 31.632 19.468 -6.092
477 HG22 VAL 62 2HG2 VAL 62 33.406 19.374 -6.112
478 HG23 VAL 62 3HG2 VAL 62 32.482 18.490 -4.876
479 H GLU 63 H GLU 63 32.062 20.481 -1.279
480 HA GLU 63 HA GLU 63 31.679 17.656 -0.920
481 HB2 GLU 63 1HB GLU 63 31.653 19.941 1.084
482 HB3 GLU 63 2HB GLU 63 31.725 18.235 1.526
483 HG2 GLU 63 1HG GLU 63 33.783 19.567 -0.240
484 HG3 GLU 63 2HG GLU 63 33.895 19.571 1.519
485 H GLN 64 H GLN 64 29.657 20.507 -0.225
486 HA GLN 64 HA GLN 64 27.470 19.005 0.886
487 HB2 GLN 64 1HB GLN 64 27.739 21.789 -0.269
488 HB3 GLN 64 2HB GLN 64 26.186 21.156 0.286
489 HG2 GLN 64 1HG GLN 64 28.676 21.325 2.012
490 HG3 GLN 64 2HG GLN 64 27.377 22.518 1.993
491 HE21 GLN 64 1HE2 GLN 64 27.063 19.558 4.523
492 HE22 GLN 64 2HE2 GLN 64 28.534 20.227 3.858
493 H GLN 65 H GLN 65 28.314 19.971 -2.460
494 HA GLN 65 HA GLN 65 25.750 19.172 -3.538
495 HB2 GLN 65 1HB GLN 65 28.503 19.431 -4.774
496 HB3 GLN 65 2HB GLN 65 27.104 18.850 -5.681
497 HG2 GLN 65 1HG GLN 65 25.898 20.958 -5.123
498 HG3 GLN 65 2HG GLN 65 27.369 21.567 -4.366
499 HE21 GLN 65 1HE2 GLN 65 28.588 22.800 -7.372
500 HE22 GLN 65 2HE2 GLN 65 28.526 22.860 -5.624
501 H GLN 66 H GLN 66 28.799 17.398 -2.877
502 HA GLN 66 HA GLN 66 27.954 14.961 -4.130
503 HB2 GLN 66 1HB GLN 66 29.871 15.500 -1.841
504 HB3 GLN 66 2HB GLN 66 29.641 13.906 -2.564
505 HG2 GLN 66 1HG GLN 66 30.430 14.713 -4.715
506 HG3 GLN 66 2HG GLN 66 30.579 16.349 -4.076
507 HE21 GLN 66 1HE2 GLN 66 33.705 15.842 -2.640
508 HE22 GLN 66 2HE2 GLN 66 32.403 16.941 -3.039
509 H ASP 67 H ASP 67 27.528 16.240 -0.804
510 HA ASP 67 HA ASP 67 26.264 13.786 0.112
511 HB2 ASP 67 1HB ASP 67 27.430 15.821 1.408
512 HB3 ASP 67 2HB ASP 67 25.750 16.372 1.510
513 H ARG 68 H ARG 68 25.158 16.918 -1.153
514 HA ARG 68 HA ARG 68 22.364 16.565 -0.692
515 HB2 ARG 68 1HB ARG 68 24.023 18.109 -2.659
516 HB3 ARG 68 2HB ARG 68 22.320 17.878 -3.029
517 HG2 ARG 68 1HG ARG 68 21.652 18.970 -0.988
518 HG3 ARG 68 2HG ARG 68 23.343 19.124 -0.461
519 HD2 ARG 68 1HD ARG 68 23.810 20.796 -1.977
520 HD3 ARG 68 2HD ARG 68 22.668 20.178 -3.180
521 HE ARG 68 HE ARG 68 22.125 22.101 -1.039
522 HH11 ARG 68 1HH1 ARG 68 20.644 19.903 -3.379
523 HH12 ARG 68 2HH1 ARG 68 19.122 20.748 -3.360
524 HH21 ARG 68 1HH2 ARG 68 20.138 23.138 -1.079
525 HH22 ARG 68 2HH2 ARG 68 18.853 22.543 -2.095
526 H ALA 69 H ALA 69 24.465 15.493 -3.404
527 HA ALA 69 HA ALA 69 22.432 14.601 -5.103
528 HB1 ALA 69 1HB ALA 69 24.829 14.690 -5.708
529 HB2 ALA 69 2HB ALA 69 25.156 13.312 -4.629
530 HB3 ALA 69 3HB ALA 69 24.130 13.092 -6.066
531 H ARG 70 H ARG 70 23.633 13.060 -2.166
532 HA ARG 70 HA ARG 70 22.413 10.480 -2.656
533 HB2 ARG 70 1HB ARG 70 23.077 11.789 0.008
534 HB3 ARG 70 2HB ARG 70 22.917 10.059 -0.311
535 HG2 ARG 70 1HG ARG 70 24.941 10.050 -1.617
536 HG3 ARG 70 2HG ARG 70 24.997 11.815 -1.636
537 HD2 ARG 70 1HD ARG 70 25.209 11.765 0.868
538 HD3 ARG 70 2HD ARG 70 25.475 10.015 0.739
539 HE ARG 70 HE ARG 70 27.257 11.087 -1.070
540 HH11 ARG 70 1HH1 ARG 70 26.703 11.763 2.348
541 HH12 ARG 70 2HH1 ARG 70 28.371 12.190 2.627
542 HH21 ARG 70 1HH2 ARG 70 29.360 11.668 -0.642
543 HH22 ARG 70 2HH2 ARG 70 29.836 12.149 0.963
544 H ARG 71 H ARG 71 21.456 13.352 -0.722
545 HA ARG 71 HA ARG 71 18.942 12.072 0.024
546 HB2 ARG 71 1HB ARG 71 18.604 13.895 1.431
547 HB3 ARG 71 2HB ARG 71 20.354 13.677 1.412
548 HG2 ARG 71 1HG ARG 71 20.448 15.522 -0.306
549 HG3 ARG 71 2HG ARG 71 18.732 15.807 0.020
550 HD2 ARG 71 1HD ARG 71 19.354 16.065 2.443
551 HD3 ARG 71 2HD ARG 71 21.059 16.027 1.933
552 HE ARG 71 HE ARG 71 19.584 17.936 0.367
553 HH11 ARG 71 1HH1 ARG 71 20.981 17.543 3.603
554 HH12 ARG 71 2HH1 ARG 71 21.117 19.262 3.859
555 HH21 ARG 71 1HH2 ARG 71 19.782 20.098 0.773
556 HH22 ARG 71 2HH2 ARG 71 20.456 20.684 2.277
557 H GLU 72 H GLU 72 19.905 14.333 -2.465
558 HA GLU 72 HA GLU 72 17.328 15.535 -2.878
559 HB2 GLU 72 1HB GLU 72 19.583 15.110 -4.858
560 HB3 GLU 72 2HB GLU 72 18.112 16.017 -5.200
561 HG2 GLU 72 1HG GLU 72 20.372 16.766 -3.379
562 HG3 GLU 72 2HG GLU 72 19.673 17.656 -4.692
563 H GLN 73 H GLN 73 18.655 12.470 -3.859
564 HA GLN 73 HA GLN 73 16.835 11.713 -5.891
565 HB2 GLN 73 1HB GLN 73 18.095 10.093 -3.650
566 HB3 GLN 73 2HB GLN 73 17.214 9.379 -5.007
567 HG2 GLN 73 1HG GLN 73 18.828 10.222 -6.590
568 HG3 GLN 73 2HG GLN 73 19.649 11.143 -5.326
569 HE21 GLN 73 1HE2 GLN 73 21.835 8.573 -4.636
570 HE22 GLN 73 2HE2 GLN 73 21.480 10.292 -4.721
571 H GLU 74 H GLU 74 16.428 11.771 -2.345
572 HA GLU 74 HA GLU 74 13.744 10.603 -2.479
573 HB2 GLU 74 1HB GLU 74 15.265 12.039 -0.272
574 HB3 GLU 74 2HB GLU 74 13.669 11.323 -0.071
575 HG2 GLU 74 1HG GLU 74 16.116 9.737 -0.921
576 HG3 GLU 74 2HG GLU 74 15.604 9.943 0.760
577 H ARG 75 H ARG 75 15.200 13.860 -2.322
578 HA ARG 75 HA ARG 75 12.753 15.167 -1.554
579 HB2 ARG 75 1HB ARG 75 15.107 16.422 -3.022
580 HB3 ARG 75 2HB ARG 75 13.844 17.261 -2.132
581 HG2 ARG 75 1HG ARG 75 16.156 15.654 -1.053
582 HG3 ARG 75 2HG ARG 75 15.703 17.319 -0.703
583 HD2 ARG 75 1HD ARG 75 14.322 14.776 0.235
584 HD3 ARG 75 2HD ARG 75 15.229 15.929 1.226
585 HE ARG 75 HE ARG 75 13.203 17.448 0.094
586 HH11 ARG 75 1HH1 ARG 75 13.207 14.496 2.033
587 HH12 ARG 75 2HH1 ARG 75 11.643 14.839 2.721
588 HH21 ARG 75 1HH2 ARG 75 11.226 17.819 1.021
589 HH22 ARG 75 2HH2 ARG 75 10.544 16.688 2.156
590 H ILE 76 H ILE 76 14.119 14.427 -4.741
591 HA ILE 76 HA ILE 76 12.207 16.073 -6.142
592 HB ILE 76 HB ILE 76 12.847 14.823 -8.163
593 HG12 ILE 76 1HG1 ILE 76 14.522 13.086 -6.309
594 HG13 ILE 76 2HG1 ILE 76 13.020 12.570 -7.066
595 HG21 ILE 76 1HG2 ILE 76 14.261 16.682 -7.222
596 HG22 ILE 76 2HG2 ILE 76 15.275 15.461 -6.427
597 HG23 ILE 76 3HG2 ILE 76 15.183 15.524 -8.198
598 HD11 ILE 76 1HD1 ILE 76 15.615 13.278 -8.490
599 HD12 ILE 76 2HD1 ILE 76 14.883 11.672 -8.318
600 HD13 ILE 76 3HD1 ILE 76 14.081 12.905 -9.316
601 H ARG 77 H ARG 77 11.804 13.141 -4.428
602 HA ARG 77 HA ARG 77 9.581 12.193 -6.109
603 HB2 ARG 77 1HB ARG 77 10.326 11.278 -3.310
604 HB3 ARG 77 2HB ARG 77 9.314 10.430 -4.479
605 HG2 ARG 77 1HG ARG 77 12.276 10.944 -4.695
606 HG3 ARG 77 2HG ARG 77 11.507 9.397 -4.331
607 HD2 ARG 77 1HD ARG 77 10.464 9.386 -6.560
608 HD3 ARG 77 2HD ARG 77 11.186 10.972 -6.910
609 HE ARG 77 HE ARG 77 13.139 8.972 -6.124
610 HH11 ARG 77 1HH1 ARG 77 11.430 10.395 -8.872
611 HH12 ARG 77 2HH1 ARG 77 12.631 9.862 -10.014
612 HH21 ARG 77 1HH2 ARG 77 14.614 8.311 -7.635
613 HH22 ARG 77 2HH2 ARG 77 14.410 8.699 -9.322
614 H LEU 78 H LEU 78 9.928 14.200 -3.218
615 HA LEU 78 HA LEU 78 7.027 14.600 -3.167
616 HB2 LEU 78 1HB LEU 78 7.679 12.388 -1.948
617 HB3 LEU 78 2HB LEU 78 8.321 13.435 -0.694
618 HG LEU 78 HG LEU 78 6.072 14.337 -0.274
619 HD11 LEU 78 1HD1 LEU 78 5.199 12.445 -2.501
620 HD12 LEU 78 2HD1 LEU 78 5.037 14.215 -2.480
621 HD13 LEU 78 3HD1 LEU 78 4.087 13.231 -1.353
622 HD21 LEU 78 1HD2 LEU 78 5.105 12.307 0.681
623 HD22 LEU 78 2HD2 LEU 78 6.868 12.273 0.870
624 HD23 LEU 78 3HD2 LEU 78 6.097 11.289 -0.394
625 H PHE 79 H PHE 79 6.349 16.261 -1.811
626 HA PHE 79 HA PHE 79 6.342 18.256 -0.873
627 HB2 PHE 79 1HB PHE 79 9.046 17.603 0.235
628 HB3 PHE 79 2HB PHE 79 7.864 18.747 0.845
629 HD1 PHE 79 HD1 PHE 79 9.086 15.380 1.020
630 HD2 PHE 79 HD2 PHE 79 5.622 17.832 1.723
631 HE1 PHE 79 HE1 PHE 79 8.167 13.633 2.536
632 HE2 PHE 79 HE2 PHE 79 4.683 16.084 3.227
633 HZ PHE 79 HZ PHE 79 5.953 13.981 3.639
634 H SER 80 H SER 80 8.260 20.198 -0.370
635 HA SER 80 HA SER 80 9.788 20.639 -2.841
636 HB2 SER 80 1HB SER 80 8.821 22.898 -3.063
637 HB3 SER 80 2HB SER 80 7.568 21.673 -3.288
638 HG SER 80 HG SER 80 7.291 23.624 -1.769
639 H ALA 81 H ALA 81 11.296 22.485 -2.343
640 HA ALA 81 HA ALA 81 11.669 23.207 0.488
641 HB1 ALA 81 1HB ALA 81 12.575 20.889 0.480
642 HB2 ALA 81 2HB ALA 81 13.641 21.307 -0.884
643 HB3 ALA 81 3HB ALA 81 13.880 22.075 0.706
644 H ASP 82 H ASP 82 11.213 24.655 -1.858
645 HA ASP 82 HA ASP 82 13.873 25.510 -2.856
646 HB2 ASP 82 1HB ASP 82 11.692 26.490 -4.422
647 HB3 ASP 82 2HB ASP 82 12.895 25.261 -4.849
648 HA PRO 83 HA PRO 83 13.109 29.526 -1.122
649 HB2 PRO 83 1HB PRO 83 14.855 31.078 -2.488
650 HB3 PRO 83 2HB PRO 83 15.443 29.770 -1.411
651 HG2 PRO 83 1HG PRO 83 15.044 29.748 -4.390
652 HG3 PRO 83 2HG PRO 83 16.483 29.258 -3.441
653 HD2 PRO 83 1HD PRO 83 14.604 27.473 -4.341
654 HD3 PRO 83 2HD PRO 83 15.515 27.228 -2.812
655 H PHE 84 H PHE 84 12.315 31.709 -1.669
656 HA PHE 84 HA PHE 84 10.936 31.793 -4.328
657 HB2 PHE 84 1HB PHE 84 9.135 33.055 -3.208
658 HB3 PHE 84 2HB PHE 84 9.327 31.441 -2.518
659 HD1 PHE 84 HD1 PHE 84 10.201 31.124 -0.247
660 HD2 PHE 84 HD2 PHE 84 9.721 35.064 -1.912
661 HE1 PHE 84 HE1 PHE 84 10.487 32.111 2.023
662 HE2 PHE 84 HE2 PHE 84 9.996 36.061 0.355
663 HZ PHE 84 HZ PHE 84 10.394 34.585 2.324
664 H ASP 85 H ASP 85 13.547 32.804 -3.028
665 HA ASP 85 HA ASP 85 13.330 35.692 -3.066
666 HB2 ASP 85 1HB ASP 85 15.825 33.950 -3.175
667 HB3 ASP 85 2HB ASP 85 15.755 35.674 -2.751
668 H LEU 86 H LEU 86 12.410 34.530 -5.491
669 HA LEU 86 HA LEU 86 14.397 34.769 -7.587
670 HB2 LEU 86 1HB LEU 86 11.367 34.978 -7.721
671 HB3 LEU 86 2HB LEU 86 12.442 34.666 -9.080
672 HG LEU 86 HG LEU 86 12.098 32.803 -6.695
673 HD11 LEU 86 1HD1 LEU 86 10.705 31.442 -8.149
674 HD12 LEU 86 2HD1 LEU 86 10.846 32.648 -9.450
675 HD13 LEU 86 3HD1 LEU 86 10.002 33.053 -7.936
676 HD21 LEU 86 1HD2 LEU 86 13.400 32.372 -9.416
677 HD22 LEU 86 2HD2 LEU 86 13.144 31.116 -8.181
678 HD23 LEU 86 3HD2 LEU 86 14.238 32.475 -7.852
679 H GLU 87 H GLU 87 12.098 36.893 -5.962
680 HA GLU 87 HA GLU 87 12.410 39.158 -7.728
681 HB2 GLU 87 1HB GLU 87 11.517 38.885 -4.833
682 HB3 GLU 87 2HB GLU 87 11.512 40.415 -5.719
683 HG2 GLU 87 1HG GLU 87 9.996 39.387 -7.406
684 HG3 GLU 87 2HG GLU 87 9.909 37.937 -6.395
685 H ALA 88 H ALA 88 14.400 37.760 -5.281
686 HA ALA 88 HA ALA 88 15.751 40.230 -4.590
687 HB1 ALA 88 1HB ALA 88 16.578 37.409 -3.917
688 HB2 ALA 88 2HB ALA 88 17.086 38.908 -3.114
689 HB3 ALA 88 3HB ALA 88 15.400 38.357 -2.974
690 H GLN 89 H GLN 89 15.871 38.443 -7.333
691 HA GLN 89 HA GLN 89 18.814 38.467 -7.603
692 HB2 GLN 89 1HB GLN 89 16.657 37.518 -9.526
693 HB3 GLN 89 2HB GLN 89 18.406 37.344 -9.748
694 HG2 GLN 89 1HG GLN 89 18.342 36.114 -7.455
695 HG3 GLN 89 2HG GLN 89 16.605 35.957 -7.764
696 HE21 GLN 89 1HE2 GLN 89 19.330 33.686 -9.741
697 HE22 GLN 89 2HE2 GLN 89 19.795 34.924 -8.599
698 H ALA 90 H ALA 90 19.969 39.893 -8.735
699 HA ALA 90 HA ALA 90 18.546 41.793 -10.536
700 HB1 ALA 90 1HB ALA 90 19.860 43.661 -9.578
701 HB2 ALA 90 2HB ALA 90 18.859 42.898 -8.317
702 HB3 ALA 90 3HB ALA 90 20.605 42.553 -8.406
703 H LYS 91 H LYS 91 20.159 42.954 -11.950
704 HA LYS 91 HA LYS 91 22.132 41.017 -12.954
705 HB2 LYS 91 1HB LYS 91 22.404 42.497 -14.808
706 HB3 LYS 91 2HB LYS 91 20.672 42.404 -14.481
707 HG2 LYS 91 1HG LYS 91 20.744 44.621 -13.383
708 HG3 LYS 91 2HG LYS 91 22.505 44.674 -13.610
709 HD2 LYS 91 1HD LYS 91 22.079 44.394 -16.083
710 HD3 LYS 91 2HD LYS 91 20.375 44.751 -15.747
711 HE2 LYS 91 1HE LYS 91 20.953 46.942 -14.861
712 HE3 LYS 91 2HE LYS 91 22.685 46.545 -14.893
713 HZ1 LYS 91 1HZ LYS 91 22.194 47.872 -16.787
714 HZ2 LYS 91 2HZ LYS 91 20.948 46.898 -17.263
715 HZ3 LYS 91 3HZ LYS 91 22.505 46.346 -17.334
716 H ILE 92 H ILE 92 24.399 41.654 -13.311
717 HA ILE 92 HA ILE 92 25.326 43.684 -11.323
718 HB ILE 92 HB ILE 92 26.829 41.171 -12.198
719 HG12 ILE 92 1HG1 ILE 92 25.548 41.790 -9.506
720 HG13 ILE 92 2HG1 ILE 92 24.836 40.722 -10.716
721 HG21 ILE 92 1HG2 ILE 92 27.498 43.259 -10.047
722 HG22 ILE 92 2HG2 ILE 92 28.471 41.824 -10.437
723 HG23 ILE 92 3HG2 ILE 92 28.304 43.122 -11.630
724 HD11 ILE 92 1HD1 ILE 92 25.905 39.339 -9.067
725 HD12 ILE 92 2HD1 ILE 92 26.894 39.249 -10.544
726 HD13 ILE 92 3HD1 ILE 92 27.420 40.257 -9.172
727 H GLU 93 H GLU 93 25.610 45.412 -12.580
728 HA GLU 93 HA GLU 93 27.664 45.279 -14.692
729 HB2 GLU 93 1HB GLU 93 24.953 46.666 -14.866
730 HB3 GLU 93 2HB GLU 93 26.326 47.008 -15.915
731 HG2 GLU 93 1HG GLU 93 26.296 44.613 -16.627
732 HG3 GLU 93 2HG GLU 93 24.806 44.404 -15.706
733 H GLU 94 H GLU 94 28.960 47.169 -14.576
734 HA GLU 94 HA GLU 94 28.205 49.330 -12.697
735 HB2 GLU 94 1HB GLU 94 30.340 47.265 -12.256
736 HB3 GLU 94 2HB GLU 94 30.790 48.937 -11.943
737 HG2 GLU 94 1HG GLU 94 28.382 47.600 -10.662
738 HG3 GLU 94 2HG GLU 94 29.996 47.611 -9.942
739 H ASP 95 H ASP 95 29.579 51.214 -13.051
740 HA ASP 95 HA ASP 95 31.423 51.003 -15.336
741 HB2 ASP 95 1HB ASP 95 30.664 52.972 -16.363
742 HB3 ASP 95 2HB ASP 95 29.260 51.928 -16.149
743 H ILE 96 H ILE 96 31.394 54.054 -14.680
744 HA ILE 96 HA ILE 96 33.098 55.386 -13.830
745 HB ILE 96 HB ILE 96 32.571 54.124 -11.114
746 HG12 ILE 96 1HG1 ILE 96 30.668 55.979 -12.615
747 HG13 ILE 96 2HG1 ILE 96 30.366 54.276 -12.261
748 HG21 ILE 96 1HG2 ILE 96 32.818 57.067 -11.986
749 HG22 ILE 96 2HG2 ILE 96 32.834 56.440 -10.320
750 HG23 ILE 96 3HG2 ILE 96 34.189 56.092 -11.403
751 HD11 ILE 96 1HD1 ILE 96 29.126 55.535 -10.668
752 HD12 ILE 96 2HD1 ILE 96 30.500 54.819 -9.797
753 HD13 ILE 96 3HD1 ILE 96 30.526 56.543 -10.250
754 H ARG 97 H ARG 97 34.129 53.177 -15.018
755 HA ARG 97 HA ARG 97 35.919 51.683 -13.334
756 HB2 ARG 97 1HB ARG 97 36.621 50.624 -15.428
757 HB3 ARG 97 2HB ARG 97 34.865 50.734 -15.285
758 HG2 ARG 97 1HG ARG 97 35.239 52.973 -16.723
759 HG3 ARG 97 2HG ARG 97 36.693 52.097 -17.232
760 HD2 ARG 97 1HD ARG 97 33.832 51.069 -17.354
761 HD3 ARG 97 2HD ARG 97 34.778 51.664 -18.735
762 HE ARG 97 HE ARG 97 36.317 49.633 -17.620
763 HH11 ARG 97 1HH1 ARG 97 33.057 49.805 -18.958
764 HH12 ARG 97 2HH1 ARG 97 33.076 48.143 -19.475
765 HH21 ARG 97 1HH2 ARG 97 36.273 47.513 -18.312
766 HH22 ARG 97 2HH2 ARG 97 34.864 46.872 -19.117
767 H GLN 98 H GLN 98 36.476 54.270 -12.886
768 HA GLN 98 HA GLN 98 39.017 54.991 -14.222
769 HB2 GLN 98 1HB GLN 98 37.212 56.680 -13.632
770 HB3 GLN 98 2HB GLN 98 37.525 56.377 -11.930
771 HG2 GLN 98 1HG GLN 98 39.888 57.143 -12.207
772 HG3 GLN 98 2HG GLN 98 39.623 57.363 -13.939
773 HE21 GLN 98 1HE2 GLN 98 39.270 60.684 -12.506
774 HE22 GLN 98 2HE2 GLN 98 40.534 59.514 -12.787
775 HXT GLN 98 HO GLN 98 37.894 53.863 -11.371
Start of MODEL 30
1 H1 SER 1 1H SER 1 25.570 44.449 -0.617
2 H2 SER 1 2H SER 1 24.857 43.069 -0.415
3 H3 SER 1 3H SER 1 26.481 43.191 -0.465
4 HA SER 1 HA SER 1 25.766 42.445 1.718
5 HB2 SER 1 1HB SER 1 27.834 43.830 1.473
6 HB3 SER 1 2HB SER 1 26.867 45.310 1.658
7 HG SER 1 HG SER 1 27.893 44.541 3.635
8 H GLN 2 H GLN 2 24.394 45.385 0.602
9 HA GLN 2 HA GLN 2 22.229 45.211 2.662
10 HB2 GLN 2 1HB GLN 2 23.647 47.734 1.711
11 HB3 GLN 2 2HB GLN 2 22.195 47.702 2.725
12 HG2 GLN 2 1HG GLN 2 23.471 46.447 4.458
13 HG3 GLN 2 2HG GLN 2 24.928 46.593 3.463
14 HE21 GLN 2 1HE2 GLN 2 23.994 49.498 5.994
15 HE22 GLN 2 2HE2 GLN 2 23.324 47.884 6.026
16 H GLN 3 H GLN 3 21.278 43.987 0.831
17 HA GLN 3 HA GLN 3 20.035 45.858 -1.151
18 HB2 GLN 3 1HB GLN 3 20.995 43.013 -1.635
19 HB3 GLN 3 2HB GLN 3 20.091 44.010 -2.783
20 HG2 GLN 3 1HG GLN 3 21.969 45.677 -2.728
21 HG3 GLN 3 2HG GLN 3 22.891 44.541 -1.731
22 HE21 GLN 3 1HE2 GLN 3 24.113 43.904 -5.074
23 HE22 GLN 3 2HE2 GLN 3 24.257 45.080 -3.790
24 H SER 4 H SER 4 18.031 44.769 -2.113
25 HA SER 4 HA SER 4 15.908 44.010 -1.822
26 HB2 SER 4 1HB SER 4 17.363 41.868 -1.289
27 HB3 SER 4 2HB SER 4 16.731 42.099 0.351
28 HG SER 4 HG SER 4 14.967 42.163 -1.857
29 H HIS 5 H HIS 5 17.037 46.180 -0.084
30 HA HIS 5 HA HIS 5 15.515 45.990 2.413
31 HB2 HIS 5 1HB HIS 5 17.583 47.308 2.359
32 HB3 HIS 5 2HB HIS 5 16.945 48.295 1.037
33 HD1 HIS 5 HD1 HIS 5 16.732 47.895 4.782
34 HD2 HIS 5 HD2 HIS 5 15.009 50.181 1.749
35 HE1 HIS 5 HE1 HIS 5 15.491 49.787 5.903
36 H SER 6 H SER 6 13.404 46.289 2.524
37 HA SER 6 HA SER 6 11.256 46.819 1.969
38 HB2 SER 6 1HB SER 6 12.491 49.445 1.074
39 HB3 SER 6 2HB SER 6 10.791 49.168 1.507
40 HG SER 6 HG SER 6 13.050 49.382 3.133
41 H SER 7 H SER 7 12.694 45.384 -0.018
42 HA SER 7 HA SER 7 11.038 45.949 -2.382
43 HB2 SER 7 1HB SER 7 13.183 45.817 -3.815
44 HB3 SER 7 2HB SER 7 12.890 47.350 -2.968
45 HG SER 7 HG SER 7 14.378 46.820 -1.440
46 HA PRO 8 HA PRO 8 11.362 41.604 -2.169
47 HB2 PRO 8 1HB PRO 8 10.990 40.686 -4.682
48 HB3 PRO 8 2HB PRO 8 9.702 41.578 -3.823
49 HG2 PRO 8 1HG PRO 8 11.720 42.620 -5.796
50 HG3 PRO 8 2HG PRO 8 9.933 42.780 -5.822
51 HD2 PRO 8 1HD PRO 8 11.520 44.737 -4.824
52 HD3 PRO 8 2HD PRO 8 9.931 44.348 -4.074
53 H GLY 9 H GLY 9 12.486 39.594 -3.270
54 HA2 GLY 9 1HA GLY 9 15.100 40.168 -4.452
55 HA3 GLY 9 2HA GLY 9 15.159 39.608 -2.766
56 H GLU 10 H GLU 10 12.980 38.754 -5.478
57 HA GLU 10 HA GLU 10 13.228 35.947 -4.707
58 HB2 GLU 10 1HB GLU 10 11.399 35.563 -6.280
59 HB3 GLU 10 2HB GLU 10 11.024 36.911 -5.209
60 HG2 GLU 10 1HG GLU 10 12.195 37.426 -7.958
61 HG3 GLU 10 2HG GLU 10 10.469 37.098 -7.751
62 H ILE 11 H ILE 11 15.463 37.368 -6.051
63 HA ILE 11 HA ILE 11 15.911 36.032 -8.529
64 HB ILE 11 HB ILE 11 18.197 37.172 -7.159
65 HG12 ILE 11 1HG1 ILE 11 15.825 39.041 -7.278
66 HG13 ILE 11 2HG1 ILE 11 16.605 38.438 -5.802
67 HG21 ILE 11 1HG2 ILE 11 17.764 36.904 -9.595
68 HG22 ILE 11 2HG2 ILE 11 16.525 38.171 -9.430
69 HG23 ILE 11 3HG2 ILE 11 18.246 38.554 -9.156
70 HD11 ILE 11 1HD1 ILE 11 17.377 40.668 -6.149
71 HD12 ILE 11 2HD1 ILE 11 18.732 39.580 -6.521
72 HD13 ILE 11 3HD1 ILE 11 17.805 40.341 -7.839
73 H THR 12 H THR 12 15.415 34.503 -5.949
74 HA THR 12 HA THR 12 17.928 33.540 -4.977
75 HB THR 12 HB THR 12 16.555 31.939 -3.682
76 HG1 THR 12 HG1 THR 12 14.214 32.133 -4.064
77 HG21 THR 12 1HG2 THR 12 15.229 33.507 -2.447
78 HG22 THR 12 2HG2 THR 12 15.049 34.575 -3.851
79 HG23 THR 12 3HG2 THR 12 16.628 34.414 -3.053
80 H SER 13 H SER 13 19.095 31.745 -5.436
81 HA SER 13 HA SER 13 18.013 29.666 -7.194
82 HB2 SER 13 1HB SER 13 18.777 31.433 -8.784
83 HB3 SER 13 2HB SER 13 20.399 31.353 -8.063
84 HG SER 13 HG SER 13 19.758 30.015 -10.057
85 H SER 14 H SER 14 19.513 27.878 -7.378
86 HA SER 14 HA SER 14 21.855 27.953 -5.593
87 HB2 SER 14 1HB SER 14 21.101 25.696 -4.617
88 HB3 SER 14 2HB SER 14 20.367 27.185 -3.989
89 HG SER 14 HG SER 14 18.525 26.764 -5.053
90 HA PRO 15 HA PRO 15 22.402 24.195 -8.208
91 HB2 PRO 15 1HB PRO 15 21.062 23.734 -10.533
92 HB3 PRO 15 2HB PRO 15 20.460 23.165 -8.946
93 HG2 PRO 15 1HG PRO 15 19.697 25.643 -10.454
94 HG3 PRO 15 2HG PRO 15 18.638 24.370 -9.765
95 HD2 PRO 15 1HD PRO 15 19.124 26.660 -8.436
96 HD3 PRO 15 2HD PRO 15 19.004 25.092 -7.566
97 H GLN 16 H GLN 16 21.431 27.179 -9.860
98 HA GLN 16 HA GLN 16 23.348 26.985 -12.006
99 HB2 GLN 16 1HB GLN 16 22.028 29.377 -10.674
100 HB3 GLN 16 2HB GLN 16 22.995 29.468 -12.151
101 HG2 GLN 16 1HG GLN 16 21.411 28.072 -13.349
102 HG3 GLN 16 2HG GLN 16 20.482 27.782 -11.870
103 HE21 GLN 16 1HE2 GLN 16 19.531 30.886 -14.134
104 HE22 GLN 16 2HE2 GLN 16 20.513 29.537 -14.656
105 H GLY 17 H GLY 17 23.540 27.838 -8.620
106 HA2 GLY 17 1HA GLY 17 26.143 29.145 -8.921
107 HA3 GLY 17 2HA GLY 17 25.250 28.866 -7.425
108 H LEU 18 H LEU 18 25.289 25.948 -9.079
109 HA LEU 18 HA LEU 18 27.246 24.844 -7.249
110 HB2 LEU 18 1HB LEU 18 26.534 22.821 -7.855
111 HB3 LEU 18 2HB LEU 18 25.142 23.765 -8.316
112 HG LEU 18 HG LEU 18 26.126 23.665 -10.722
113 HD11 LEU 18 1HD1 LEU 18 28.339 22.678 -9.928
114 HD12 LEU 18 2HD1 LEU 18 27.527 21.772 -11.217
115 HD13 LEU 18 3HD1 LEU 18 27.455 21.199 -9.535
116 HD21 LEU 18 1HD2 LEU 18 25.035 21.203 -9.299
117 HD22 LEU 18 2HD2 LEU 18 24.990 21.497 -11.054
118 HD23 LEU 18 3HD2 LEU 18 24.075 22.548 -9.958
119 H ASP 19 H ASP 19 27.210 25.799 -10.646
120 HA ASP 19 HA ASP 19 29.975 24.901 -11.080
121 HB2 ASP 19 1HB ASP 19 28.116 24.938 -12.830
122 HB3 ASP 19 2HB ASP 19 28.263 26.705 -12.823
123 H ASN 20 H ASN 20 28.215 27.767 -10.155
124 HA ASN 20 HA ASN 20 30.768 29.307 -10.150
125 HB2 ASN 20 1HB ASN 20 27.875 30.195 -10.537
126 HB3 ASN 20 2HB ASN 20 29.203 31.302 -10.207
127 HD21 ASN 20 1HD2 ASN 20 30.780 30.642 -13.407
128 HD22 ASN 20 2HD2 ASN 20 31.242 30.528 -11.732
129 HA PRO 21 HA PRO 21 29.503 28.968 -5.719
130 HB2 PRO 21 1HB PRO 21 32.138 28.919 -4.843
131 HB3 PRO 21 2HB PRO 21 31.211 27.449 -5.218
132 HG2 PRO 21 1HG PRO 21 33.109 28.945 -6.896
133 HG3 PRO 21 2HG PRO 21 33.006 27.199 -6.629
134 HD2 PRO 21 1HD PRO 21 32.063 28.256 -8.836
135 HD3 PRO 21 2HD PRO 21 31.152 26.957 -7.983
136 H ALA 22 H ALA 22 31.948 30.823 -7.542
137 HA ALA 22 HA ALA 22 32.344 32.861 -5.606
138 HB1 ALA 22 1HB ALA 22 32.522 33.007 -8.651
139 HB2 ALA 22 2HB ALA 22 33.195 34.198 -7.513
140 HB3 ALA 22 3HB ALA 22 33.837 32.541 -7.542
141 H LEU 23 H LEU 23 30.005 32.606 -8.301
142 HA LEU 23 HA LEU 23 28.904 35.235 -7.800
143 HB2 LEU 23 1HB LEU 23 27.631 32.900 -9.264
144 HB3 LEU 23 2HB LEU 23 27.137 34.583 -9.349
145 HG LEU 23 HG LEU 23 29.693 33.385 -10.460
146 HD11 LEU 23 1HD1 LEU 23 27.594 32.880 -11.696
147 HD12 LEU 23 2HD1 LEU 23 28.693 33.912 -12.631
148 HD13 LEU 23 3HD1 LEU 23 27.272 34.624 -11.831
149 HD21 LEU 23 1HD2 LEU 23 30.186 35.656 -9.733
150 HD22 LEU 23 2HD2 LEU 23 28.750 36.264 -10.591
151 HD23 LEU 23 3HD2 LEU 23 30.112 35.560 -11.502
152 H LEU 24 H LEU 24 28.044 31.898 -6.855
153 HA LEU 24 HA LEU 24 25.551 32.614 -5.641
154 HB2 LEU 24 1HB LEU 24 26.190 30.317 -6.246
155 HB3 LEU 24 2HB LEU 24 27.454 30.324 -5.027
156 HG LEU 24 HG LEU 24 25.871 30.317 -3.245
157 HD11 LEU 24 1HD1 LEU 24 24.145 31.811 -3.974
158 HD12 LEU 24 2HD1 LEU 24 23.390 30.238 -3.670
159 HD13 LEU 24 3HD1 LEU 24 23.718 30.749 -5.342
160 HD21 LEU 24 1HD2 LEU 24 26.336 28.174 -4.463
161 HD22 LEU 24 2HD2 LEU 24 24.814 28.410 -5.351
162 HD23 LEU 24 3HD2 LEU 24 24.790 28.202 -3.587
163 H ARG 25 H ARG 25 28.894 32.402 -4.382
164 HA ARG 25 HA ARG 25 28.294 32.959 -1.635
165 HB2 ARG 25 1HB ARG 25 30.527 32.238 -2.546
166 HB3 ARG 25 2HB ARG 25 30.682 33.794 -3.342
167 HG2 ARG 25 1HG ARG 25 30.338 34.658 -0.813
168 HG3 ARG 25 2HG ARG 25 31.041 33.067 -0.478
169 HD2 ARG 25 1HD ARG 25 32.837 34.638 -0.614
170 HD3 ARG 25 2HD ARG 25 32.893 33.660 -2.095
171 HE ARG 25 HE ARG 25 31.430 35.723 -2.973
172 HH11 ARG 25 1HH1 ARG 25 34.365 35.851 -0.993
173 HH12 ARG 25 2HH1 ARG 25 34.817 37.407 -1.640
174 HH21 ARG 25 1HH2 ARG 25 32.043 37.752 -3.685
175 HH22 ARG 25 2HH2 ARG 25 33.540 38.445 -3.121
176 H ASP 26 H ASP 26 28.922 35.063 -4.453
177 HA ASP 26 HA ASP 26 28.870 37.493 -2.986
178 HB2 ASP 26 1HB ASP 26 29.482 36.712 -5.500
179 HB3 ASP 26 2HB ASP 26 27.938 37.485 -5.799
180 H MET 27 H MET 27 26.265 35.778 -4.766
181 HA MET 27 HA MET 27 24.184 37.701 -4.283
182 HB2 MET 27 1HB MET 27 24.131 35.751 -5.882
183 HB3 MET 27 2HB MET 27 23.958 34.687 -4.484
184 HG2 MET 27 1HG MET 27 21.853 35.892 -3.883
185 HG3 MET 27 2HG MET 27 22.021 36.831 -5.377
186 HE1 MET 27 1HE MET 27 21.062 32.322 -5.017
187 HE2 MET 27 2HE MET 27 22.345 33.136 -4.103
188 HE3 MET 27 3HE MET 27 20.642 33.540 -3.788
189 H LEU 28 H LEU 28 25.279 34.844 -2.440
190 HA LEU 28 HA LEU 28 23.222 34.968 -0.468
191 HB2 LEU 28 1HB LEU 28 25.926 33.752 -0.634
192 HB3 LEU 28 2HB LEU 28 25.046 33.750 0.899
193 HG LEU 28 HG LEU 28 23.792 32.726 -1.654
194 HD11 LEU 28 1HD1 LEU 28 25.465 31.283 0.382
195 HD12 LEU 28 2HD1 LEU 28 25.857 31.576 -1.321
196 HD13 LEU 28 3HD1 LEU 28 24.503 30.510 -0.900
197 HD21 LEU 28 1HD2 LEU 28 23.278 32.176 1.298
198 HD22 LEU 28 2HD2 LEU 28 22.389 31.463 -0.069
199 HD23 LEU 28 3HD2 LEU 28 22.299 33.200 0.248
200 H LEU 29 H LEU 29 26.476 36.388 -0.654
201 HA LEU 29 HA LEU 29 26.497 37.502 2.001
202 HB2 LEU 29 1HB LEU 29 27.893 38.209 -0.585
203 HB3 LEU 29 2HB LEU 29 28.104 39.201 0.853
204 HG LEU 29 HG LEU 29 28.733 36.244 0.820
205 HD11 LEU 29 1HD1 LEU 29 30.080 37.346 -0.899
206 HD12 LEU 29 2HD1 LEU 29 31.090 36.896 0.493
207 HD13 LEU 29 3HD1 LEU 29 30.587 38.590 0.271
208 HD21 LEU 29 1HD2 LEU 29 30.133 36.809 2.768
209 HD22 LEU 29 2HD2 LEU 29 28.439 37.244 3.051
210 HD23 LEU 29 3HD2 LEU 29 29.621 38.509 2.648
211 H ALA 30 H ALA 30 25.145 38.609 -1.060
212 HA ALA 30 HA ALA 30 24.556 41.260 -0.004
213 HB1 ALA 30 1HB ALA 30 23.690 39.891 -2.582
214 HB2 ALA 30 2HB ALA 30 23.515 41.621 -2.212
215 HB3 ALA 30 3HB ALA 30 25.138 40.908 -2.382
216 H ASN 31 H ASN 31 22.959 38.199 0.166
217 HA ASN 31 HA ASN 31 20.305 39.563 0.370
218 HB2 ASN 31 1HB ASN 31 20.776 37.839 -1.426
219 HB3 ASN 31 2HB ASN 31 20.836 36.633 -0.144
220 HD21 ASN 31 1HD2 ASN 31 17.418 37.090 -1.721
221 HD22 ASN 31 2HD2 ASN 31 19.025 37.077 -2.434
222 HA PRO 32 HA PRO 32 20.961 38.428 4.642
223 HB2 PRO 32 1HB PRO 32 18.786 39.679 5.762
224 HB3 PRO 32 2HB PRO 32 20.276 40.541 5.253
225 HG2 PRO 32 1HG PRO 32 17.707 40.170 3.710
226 HG3 PRO 32 2HG PRO 32 18.607 41.684 4.052
227 HD2 PRO 32 1HD PRO 32 18.917 40.427 1.724
228 HD3 PRO 32 2HD PRO 32 20.340 41.130 2.573
229 H HIS 33 H HIS 33 17.840 37.852 2.983
230 HA HIS 33 HA HIS 33 16.855 36.062 5.071
231 HB2 HIS 33 1HB HIS 33 15.369 37.325 3.545
232 HB3 HIS 33 2HB HIS 33 16.043 36.444 2.167
233 HD1 HIS 33 HD1 HIS 33 13.686 35.981 5.113
234 HD2 HIS 33 HD2 HIS 33 15.097 33.871 1.798
235 HE1 HIS 33 HE1 HIS 33 12.235 33.926 4.873
236 H GLU 34 H GLU 34 18.574 35.774 2.003
237 HA GLU 34 HA GLU 34 18.262 32.907 1.843
238 HB2 GLU 34 1HB GLU 34 19.470 35.113 0.337
239 HB3 GLU 34 2HB GLU 34 20.333 33.603 0.167
240 HG2 GLU 34 1HG GLU 34 18.615 33.984 -1.574
241 HG3 GLU 34 2HG GLU 34 18.421 32.496 -0.647
242 H LEU 35 H LEU 35 20.658 35.162 3.125
243 HA LEU 35 HA LEU 35 22.616 33.092 3.624
244 HB2 LEU 35 1HB LEU 35 23.955 34.694 4.305
245 HB3 LEU 35 2HB LEU 35 22.858 35.537 3.270
246 HG LEU 35 HG LEU 35 21.774 36.589 5.166
247 HD11 LEU 35 1HD1 LEU 35 22.134 35.241 7.062
248 HD12 LEU 35 2HD1 LEU 35 23.128 36.681 7.305
249 HD13 LEU 35 3HD1 LEU 35 23.888 35.155 6.775
250 HD21 LEU 35 1HD2 LEU 35 23.556 37.519 3.805
251 HD22 LEU 35 2HD2 LEU 35 24.776 36.764 4.850
252 HD23 LEU 35 3HD2 LEU 35 23.734 38.068 5.487
253 H SER 36 H SER 36 19.863 34.410 5.375
254 HA SER 36 HA SER 36 20.644 33.283 7.915
255 HB2 SER 36 1HB SER 36 18.459 33.927 8.726
256 HB3 SER 36 2HB SER 36 19.184 35.255 7.799
257 HG SER 36 HG SER 36 16.954 34.837 7.309
258 H LEU 37 H LEU 37 18.414 32.233 5.284
259 HA LEU 37 HA LEU 37 17.559 29.890 6.714
260 HB2 LEU 37 1HB LEU 37 16.680 29.121 4.727
261 HB3 LEU 37 2HB LEU 37 16.557 30.833 4.754
262 HG LEU 37 HG LEU 37 18.441 30.930 3.102
263 HD11 LEU 37 1HD1 LEU 37 19.153 28.594 3.260
264 HD12 LEU 37 2HD1 LEU 37 18.592 28.977 1.629
265 HD13 LEU 37 3HD1 LEU 37 17.547 28.060 2.745
266 HD21 LEU 37 1HD2 LEU 37 15.722 29.783 2.418
267 HD22 LEU 37 2HD2 LEU 37 16.804 30.625 1.281
268 HD23 LEU 37 3HD2 LEU 37 16.114 31.500 2.657
269 H LEU 38 H LEU 38 20.331 30.725 4.840
270 HA LEU 38 HA LEU 38 21.249 28.079 4.423
271 HB2 LEU 38 1HB LEU 38 21.846 30.121 3.217
272 HB3 LEU 38 2HB LEU 38 22.787 30.667 4.611
273 HG LEU 38 HG LEU 38 24.204 28.628 4.459
274 HD11 LEU 38 1HD1 LEU 38 24.203 27.385 2.331
275 HD12 LEU 38 2HD1 LEU 38 22.736 28.264 1.841
276 HD13 LEU 38 3HD1 LEU 38 22.704 27.182 3.252
277 HD21 LEU 38 1HD2 LEU 38 25.581 29.415 2.635
278 HD22 LEU 38 2HD2 LEU 38 24.905 30.803 3.515
279 HD23 LEU 38 3HD2 LEU 38 24.208 30.314 1.957
280 H LYS 39 H LYS 39 22.029 30.464 6.987
281 HA LYS 39 HA LYS 39 23.786 28.585 8.340
282 HB2 LYS 39 1HB LYS 39 23.493 30.064 10.349
283 HB3 LYS 39 2HB LYS 39 24.190 30.821 8.916
284 HG2 LYS 39 1HG LYS 39 22.225 32.028 8.455
285 HG3 LYS 39 2HG LYS 39 21.252 31.054 9.536
286 HD2 LYS 39 1HD LYS 39 21.544 33.070 10.657
287 HD3 LYS 39 2HD LYS 39 22.684 31.957 11.436
288 HE2 LYS 39 1HE LYS 39 24.527 32.892 10.086
289 HE3 LYS 39 2HE LYS 39 23.376 33.958 9.240
290 HZ1 LYS 39 1HZ LYS 39 22.871 34.994 11.365
291 HZ2 LYS 39 2HZ LYS 39 24.488 35.110 11.053
292 HZ3 LYS 39 3HZ LYS 39 23.933 34.010 12.153
293 H GLU 40 H GLU 40 20.310 29.092 8.402
294 HA GLU 40 HA GLU 40 19.929 27.446 10.761
295 HB2 GLU 40 1HB GLU 40 18.117 28.386 8.505
296 HB3 GLU 40 2HB GLU 40 17.543 27.332 9.808
297 HG2 GLU 40 1HG GLU 40 18.703 30.117 10.139
298 HG3 GLU 40 2HG GLU 40 17.001 29.660 10.297
299 H ARG 41 H ARG 41 19.449 26.812 7.224
300 HA ARG 41 HA ARG 41 18.994 23.970 7.932
301 HB2 ARG 41 1HB ARG 41 18.894 25.369 5.249
302 HB3 ARG 41 2HB ARG 41 18.363 23.730 5.605
303 HG2 ARG 41 1HG ARG 41 16.931 25.040 7.491
304 HG3 ARG 41 2HG ARG 41 17.122 26.361 6.336
305 HD2 ARG 41 1HD ARG 41 15.143 25.497 5.571
306 HD3 ARG 41 2HD ARG 41 16.247 24.491 4.614
307 HE ARG 41 HE ARG 41 15.887 23.061 6.954
308 HH11 ARG 41 1HH1 ARG 41 13.575 24.358 4.598
309 HH12 ARG 41 2HH1 ARG 41 12.406 23.102 4.945
310 HH21 ARG 41 1HH2 ARG 41 14.309 21.512 7.308
311 HH22 ARG 41 2HH2 ARG 41 12.806 21.544 6.399
312 H ASN 42 H ASN 42 21.626 25.787 6.597
313 HA ASN 42 HA ASN 42 23.150 23.223 6.347
314 HB2 ASN 42 1HB ASN 42 22.419 24.258 4.096
315 HB3 ASN 42 2HB ASN 42 23.602 25.492 4.397
316 HD21 ASN 42 1HD2 ASN 42 25.251 22.915 2.385
317 HD22 ASN 42 2HD2 ASN 42 24.048 24.166 2.210
318 HA PRO 43 HA PRO 43 25.295 26.589 8.756
319 HB2 PRO 43 1HB PRO 43 26.372 24.900 10.715
320 HB3 PRO 43 2HB PRO 43 24.881 25.882 10.852
321 HG2 PRO 43 1HG PRO 43 25.176 22.990 10.109
322 HG3 PRO 43 2HG PRO 43 24.007 23.765 11.219
323 HD2 PRO 43 1HD PRO 43 23.298 23.082 8.731
324 HD3 PRO 43 2HD PRO 43 22.731 24.631 9.453
325 HA PRO 44 HA PRO 44 29.401 24.520 8.046
326 HB2 PRO 44 1HB PRO 44 29.724 22.531 6.198
327 HB3 PRO 44 2HB PRO 44 29.428 22.208 7.936
328 HG2 PRO 44 1HG PRO 44 27.463 22.288 5.681
329 HG3 PRO 44 2HG PRO 44 27.731 21.003 6.900
330 HD2 PRO 44 1HD PRO 44 25.776 22.807 7.216
331 HD3 PRO 44 2HD PRO 44 26.758 22.271 8.620
332 H LEU 45 H LEU 45 27.105 24.572 5.227
333 HA LEU 45 HA LEU 45 29.153 25.783 3.521
334 HB2 LEU 45 1HB LEU 45 27.283 24.538 2.532
335 HB3 LEU 45 2HB LEU 45 26.154 25.710 3.204
336 HG LEU 45 HG LEU 45 26.992 27.459 1.741
337 HD11 LEU 45 1HD1 LEU 45 28.644 27.042 -0.042
338 HD12 LEU 45 2HD1 LEU 45 28.924 25.400 0.573
339 HD13 LEU 45 3HD1 LEU 45 29.391 26.811 1.546
340 HD21 LEU 45 1HD2 LEU 45 26.243 26.538 -0.392
341 HD22 LEU 45 2HD2 LEU 45 25.239 25.917 0.932
342 HD23 LEU 45 3HD2 LEU 45 26.493 24.881 0.208
343 H ALA 46 H ALA 46 26.656 26.773 5.767
344 HA ALA 46 HA ALA 46 26.618 29.512 5.023
345 HB1 ALA 46 1HB ALA 46 26.208 28.408 7.790
346 HB2 ALA 46 2HB ALA 46 25.551 29.904 7.088
347 HB3 ALA 46 3HB ALA 46 25.002 28.324 6.491
348 H GLU 47 H GLU 47 28.609 27.877 7.606
349 HA GLU 47 HA GLU 47 29.739 30.312 8.500
350 HB2 GLU 47 1HB GLU 47 31.539 29.028 9.490
351 HB3 GLU 47 2HB GLU 47 29.949 28.352 9.838
352 HG2 GLU 47 1HG GLU 47 30.406 26.441 8.870
353 HG3 GLU 47 2HG GLU 47 31.157 27.174 7.465
354 H ALA 48 H ALA 48 30.629 28.250 5.810
355 HA ALA 48 HA ALA 48 33.027 29.508 5.110
356 HB1 ALA 48 1HB ALA 48 32.679 28.450 3.002
357 HB2 ALA 48 2HB ALA 48 32.155 27.343 4.273
358 HB3 ALA 48 3HB ALA 48 30.958 28.248 3.316
359 H LEU 49 H LEU 49 29.684 30.186 4.221
360 HA LEU 49 HA LEU 49 30.337 32.262 2.376
361 HB2 LEU 49 1HB LEU 49 28.171 30.998 2.589
362 HB3 LEU 49 2HB LEU 49 27.841 31.839 4.083
363 HG LEU 49 HG LEU 49 26.630 32.558 2.003
364 HD11 LEU 49 1HD1 LEU 49 28.046 34.757 3.462
365 HD12 LEU 49 2HD1 LEU 49 26.603 33.887 4.034
366 HD13 LEU 49 3HD1 LEU 49 26.529 34.864 2.553
367 HD21 LEU 49 1HD2 LEU 49 27.706 34.127 0.538
368 HD22 LEU 49 2HD2 LEU 49 28.595 32.599 0.527
369 HD23 LEU 49 3HD2 LEU 49 29.221 33.996 1.435
370 H LEU 50 H LEU 50 29.553 32.187 5.866
371 HA LEU 50 HA LEU 50 29.314 34.994 6.167
372 HB2 LEU 50 1HB LEU 50 30.417 33.147 8.307
373 HB3 LEU 50 2HB LEU 50 29.568 34.660 8.539
374 HG LEU 50 HG LEU 50 28.471 31.971 7.861
375 HD11 LEU 50 1HD1 LEU 50 27.175 32.255 9.850
376 HD12 LEU 50 2HD1 LEU 50 27.893 33.872 10.091
377 HD13 LEU 50 3HD1 LEU 50 28.913 32.408 10.153
378 HD21 LEU 50 1HD2 LEU 50 26.967 34.572 7.657
379 HD22 LEU 50 2HD2 LEU 50 26.203 32.962 7.760
380 HD23 LEU 50 3HD2 LEU 50 27.236 33.354 6.380
381 H SER 51 H SER 51 32.104 32.851 6.156
382 HA SER 51 HA SER 51 33.984 34.658 7.315
383 HB2 SER 51 1HB SER 51 34.337 32.320 5.436
384 HB3 SER 51 2HB SER 51 35.609 33.089 6.386
385 HG SER 51 HG SER 51 33.308 31.745 7.397
386 H GLY 52 H GLY 52 32.616 34.308 4.111
387 HA2 GLY 52 1HA GLY 52 32.847 35.774 2.317
388 HA3 GLY 52 2HA GLY 52 34.163 36.608 3.161
389 H ASP 53 H ASP 53 35.256 33.715 3.596
390 HA ASP 53 HA ASP 53 37.207 33.803 1.513
391 HB2 ASP 53 1HB ASP 53 37.520 32.659 3.773
392 HB3 ASP 53 2HB ASP 53 36.434 31.448 3.218
393 H LEU 54 H LEU 54 36.811 33.383 -0.576
394 HA LEU 54 HA LEU 54 34.602 31.780 -1.460
395 HB2 LEU 54 1HB LEU 54 35.720 33.522 -2.821
396 HB3 LEU 54 2HB LEU 54 37.164 32.527 -2.905
397 HG LEU 54 HG LEU 54 35.525 32.644 -4.873
398 HD11 LEU 54 1HD1 LEU 54 36.517 29.915 -4.063
399 HD12 LEU 54 2HD1 LEU 54 37.514 31.188 -4.787
400 HD13 LEU 54 3HD1 LEU 54 36.171 30.484 -5.708
401 HD21 LEU 54 1HD2 LEU 54 33.455 32.061 -3.671
402 HD22 LEU 54 2HD2 LEU 54 34.102 30.429 -3.404
403 HD23 LEU 54 3HD2 LEU 54 33.791 30.994 -5.048
404 H GLU 55 H GLU 55 38.037 31.089 -0.734
405 HA GLU 55 HA GLU 55 38.121 28.554 -2.009
406 HB2 GLU 55 1HB GLU 55 39.530 29.399 0.539
407 HB3 GLU 55 2HB GLU 55 39.971 28.031 -0.477
408 HG2 GLU 55 1HG GLU 55 39.946 30.883 -1.477
409 HG3 GLU 55 2HG GLU 55 41.325 30.134 -0.678
410 H LYS 56 H LYS 56 37.402 29.320 1.444
411 HA LYS 56 HA LYS 56 36.765 26.595 2.007
412 HB2 LYS 56 1HB LYS 56 36.216 27.210 4.157
413 HB3 LYS 56 2HB LYS 56 37.361 28.504 3.672
414 HG2 LYS 56 1HG LYS 56 35.320 29.848 3.242
415 HG3 LYS 56 2HG LYS 56 34.480 28.559 4.085
416 HD2 LYS 56 1HD LYS 56 36.954 29.532 5.422
417 HD3 LYS 56 2HD LYS 56 35.600 30.651 5.391
418 HE2 LYS 56 1HE LYS 56 34.136 28.954 6.416
419 HE3 LYS 56 2HE LYS 56 35.464 27.795 6.426
420 HZ1 LYS 56 1HZ LYS 56 35.072 28.794 8.558
421 HZ2 LYS 56 2HZ LYS 56 35.344 30.314 7.958
422 HZ3 LYS 56 3HZ LYS 56 36.580 29.215 8.012
423 H PHE 57 H PHE 57 34.781 29.358 0.887
424 HA PHE 57 HA PHE 57 32.285 28.010 1.087
425 HB2 PHE 57 1HB PHE 57 32.594 30.439 0.647
426 HB3 PHE 57 2HB PHE 57 33.126 30.048 -0.990
427 HD1 PHE 57 HD1 PHE 57 30.244 30.139 1.324
428 HD2 PHE 57 HD2 PHE 57 31.536 29.344 -2.698
429 HE1 PHE 57 HE1 PHE 57 27.873 30.170 0.564
430 HE2 PHE 57 HE2 PHE 57 29.167 29.373 -3.464
431 HZ PHE 57 HZ PHE 57 27.336 29.768 -1.834
432 H SER 58 H SER 58 34.506 28.199 -1.760
433 HA SER 58 HA SER 58 32.904 26.498 -3.403
434 HB2 SER 58 1HB SER 58 34.752 27.991 -4.172
435 HB3 SER 58 2HB SER 58 35.923 26.894 -3.414
436 HG SER 58 HG SER 58 35.763 26.301 -5.533
437 H ARG 59 H ARG 59 35.496 25.774 -1.065
438 HA ARG 59 HA ARG 59 35.811 23.011 -1.814
439 HB2 ARG 59 1HB ARG 59 37.516 24.139 -0.505
440 HB3 ARG 59 2HB ARG 59 36.356 24.528 0.763
441 HG2 ARG 59 1HG ARG 59 36.413 21.662 0.401
442 HG3 ARG 59 2HG ARG 59 38.064 22.270 0.612
443 HD2 ARG 59 1HD ARG 59 37.575 23.235 2.706
444 HD3 ARG 59 2HD ARG 59 35.825 23.215 2.406
445 HE ARG 59 HE ARG 59 36.515 20.542 2.372
446 HH11 ARG 59 1HH1 ARG 59 36.849 23.116 4.779
447 HH12 ARG 59 2HH1 ARG 59 36.693 22.000 6.107
448 HH21 ARG 59 1HH2 ARG 59 36.302 19.226 4.062
449 HH22 ARG 59 2HH2 ARG 59 36.409 19.813 5.711
450 H VAL 60 H VAL 60 33.870 24.617 0.756
451 HA VAL 60 HA VAL 60 32.797 22.066 1.577
452 HB VAL 60 HB VAL 60 33.009 24.108 3.071
453 HG11 VAL 60 1HG1 VAL 60 32.129 25.750 1.626
454 HG12 VAL 60 2HG1 VAL 60 30.562 24.939 1.685
455 HG13 VAL 60 3HG1 VAL 60 31.239 25.658 3.147
456 HG21 VAL 60 1HG2 VAL 60 31.067 23.552 4.398
457 HG22 VAL 60 2HG2 VAL 60 30.274 22.815 2.984
458 HG23 VAL 60 3HG2 VAL 60 31.734 22.071 3.679
459 H LEU 61 H LEU 61 31.922 24.497 -0.842
460 HA LEU 61 HA LEU 61 29.234 23.708 -1.270
461 HB2 LEU 61 1HB LEU 61 30.519 25.683 -2.284
462 HB3 LEU 61 2HB LEU 61 31.168 24.548 -3.451
463 HG LEU 61 HG LEU 61 28.497 24.080 -3.746
464 HD11 LEU 61 1HD1 LEU 61 28.815 27.029 -3.098
465 HD12 LEU 61 2HD1 LEU 61 27.983 25.836 -2.063
466 HD13 LEU 61 3HD1 LEU 61 27.334 26.225 -3.671
467 HD21 LEU 61 1HD2 LEU 61 28.704 25.025 -5.817
468 HD22 LEU 61 2HD2 LEU 61 30.426 25.049 -5.405
469 HD23 LEU 61 3HD2 LEU 61 29.429 26.516 -5.209
470 H VAL 62 H VAL 62 32.270 22.437 -2.814
471 HA VAL 62 HA VAL 62 30.715 20.551 -4.370
472 HB VAL 62 HB VAL 62 32.933 21.355 -5.117
473 HG11 VAL 62 1HG1 VAL 62 34.076 19.584 -2.922
474 HG12 VAL 62 2HG1 VAL 62 35.000 20.354 -4.228
475 HG13 VAL 62 3HG1 VAL 62 34.182 21.357 -3.025
476 HG21 VAL 62 1HG2 VAL 62 31.928 19.280 -6.020
477 HG22 VAL 62 2HG2 VAL 62 33.703 19.202 -6.010
478 HG23 VAL 62 3HG2 VAL 62 32.765 18.336 -4.769
479 H GLU 63 H GLU 63 32.336 20.387 -1.222
480 HA GLU 63 HA GLU 63 31.995 17.555 -0.845
481 HB2 GLU 63 1HB GLU 63 32.100 19.878 1.095
482 HB3 GLU 63 2HB GLU 63 31.983 18.192 1.619
483 HG2 GLU 63 1HG GLU 63 34.093 17.666 0.481
484 HG3 GLU 63 2HG GLU 63 34.223 19.336 -0.084
485 H GLN 64 H GLN 64 29.891 20.375 -0.187
486 HA GLN 64 HA GLN 64 27.717 18.849 0.898
487 HB2 GLN 64 1HB GLN 64 27.951 21.563 -0.403
488 HB3 GLN 64 2HB GLN 64 26.367 20.888 -0.018
489 HG2 GLN 64 1HG GLN 64 28.595 21.295 1.999
490 HG3 GLN 64 2HG GLN 64 27.244 22.406 1.738
491 HE21 GLN 64 1HE2 GLN 64 26.763 19.561 4.381
492 HE22 GLN 64 2HE2 GLN 64 28.272 20.269 3.863
493 H GLN 65 H GLN 65 28.577 19.741 -2.488
494 HA GLN 65 HA GLN 65 26.132 18.764 -3.627
495 HB2 GLN 65 1HB GLN 65 28.949 18.932 -4.734
496 HB3 GLN 65 2HB GLN 65 27.582 18.355 -5.682
497 HG2 GLN 65 1HG GLN 65 26.461 20.494 -5.480
498 HG3 GLN 65 2HG GLN 65 27.727 21.100 -4.412
499 HE21 GLN 65 1HE2 GLN 65 29.425 22.419 -7.146
500 HE22 GLN 65 2HE2 GLN 65 28.808 22.618 -5.522
501 H GLN 66 H GLN 66 29.217 17.105 -2.843
502 HA GLN 66 HA GLN 66 28.470 14.589 -3.983
503 HB2 GLN 66 1HB GLN 66 30.333 15.274 -1.686
504 HB3 GLN 66 2HB GLN 66 30.196 13.663 -2.392
505 HG2 GLN 66 1HG GLN 66 31.017 14.458 -4.520
506 HG3 GLN 66 2HG GLN 66 31.001 16.130 -3.950
507 HE21 GLN 66 1HE2 GLN 66 34.190 15.976 -2.626
508 HE22 GLN 66 2HE2 GLN 66 32.848 16.923 -3.227
509 H ASP 67 H ASP 67 27.978 16.010 -0.749
510 HA ASP 67 HA ASP 67 26.861 13.577 0.376
511 HB2 ASP 67 1HB ASP 67 27.967 15.514 1.608
512 HB3 ASP 67 2HB ASP 67 26.477 16.421 1.329
513 H ARG 68 H ARG 68 25.564 16.494 -1.163
514 HA ARG 68 HA ARG 68 22.805 16.063 -0.519
515 HB2 ARG 68 1HB ARG 68 24.231 17.484 -2.767
516 HB3 ARG 68 2HB ARG 68 22.479 17.284 -2.788
517 HG2 ARG 68 1HG ARG 68 22.246 18.530 -0.725
518 HG3 ARG 68 2HG ARG 68 24.008 18.656 -0.552
519 HD2 ARG 68 1HD ARG 68 23.110 20.714 -1.513
520 HD3 ARG 68 2HD ARG 68 24.116 19.871 -2.711
521 HE ARG 68 HE ARG 68 21.931 18.914 -3.615
522 HH11 ARG 68 1HH1 ARG 68 21.916 22.061 -1.981
523 HH12 ARG 68 2HH1 ARG 68 20.462 22.560 -2.801
524 HH21 ARG 68 1HH2 ARG 68 20.120 19.581 -4.561
525 HH22 ARG 68 2HH2 ARG 68 19.467 21.187 -4.268
526 H ALA 69 H ALA 69 24.836 14.946 -3.225
527 HA ALA 69 HA ALA 69 22.800 13.855 -4.815
528 HB1 ALA 69 1HB ALA 69 25.142 14.090 -5.538
529 HB2 ALA 69 2HB ALA 69 25.650 12.841 -4.375
530 HB3 ALA 69 3HB ALA 69 24.594 12.408 -5.745
531 H ARG 70 H ARG 70 24.238 12.569 -1.859
532 HA ARG 70 HA ARG 70 23.284 9.871 -2.136
533 HB2 ARG 70 1HB ARG 70 23.798 11.472 0.407
534 HB3 ARG 70 2HB ARG 70 23.726 9.709 0.276
535 HG2 ARG 70 1HG ARG 70 25.737 9.714 -1.111
536 HG3 ARG 70 2HG ARG 70 25.760 11.486 -1.096
537 HD2 ARG 70 1HD ARG 70 25.946 11.421 1.395
538 HD3 ARG 70 2HD ARG 70 26.112 9.659 1.302
539 HE ARG 70 HE ARG 70 28.076 11.707 0.498
540 HH11 ARG 70 1HH1 ARG 70 27.290 8.263 0.507
541 HH12 ARG 70 2HH1 ARG 70 28.935 7.792 0.167
542 HH21 ARG 70 1HH2 ARG 70 30.144 11.032 0.061
543 HH22 ARG 70 2HH2 ARG 70 30.521 9.336 -0.072
544 H ARG 71 H ARG 71 21.970 12.711 -0.406
545 HA ARG 71 HA ARG 71 19.574 11.220 0.388
546 HB2 ARG 71 1HB ARG 71 18.826 13.507 1.189
547 HB3 ARG 71 2HB ARG 71 20.242 12.800 1.962
548 HG2 ARG 71 1HG ARG 71 21.704 14.260 0.632
549 HG3 ARG 71 2HG ARG 71 20.280 14.982 -0.148
550 HD2 ARG 71 1HD ARG 71 19.582 16.029 1.821
551 HD3 ARG 71 2HD ARG 71 20.485 14.912 2.857
552 HE ARG 71 HE ARG 71 21.493 17.341 1.582
553 HH11 ARG 71 1HH1 ARG 71 22.448 14.298 3.114
554 HH12 ARG 71 2HH1 ARG 71 24.041 14.908 3.516
555 HH21 ARG 71 1HH2 ARG 71 23.557 18.028 2.167
556 HH22 ARG 71 2HH2 ARG 71 24.634 16.924 2.998
557 H GLU 72 H GLU 72 20.470 13.332 -2.231
558 HA GLU 72 HA GLU 72 17.964 14.258 -3.055
559 HB2 GLU 72 1HB GLU 72 20.564 14.191 -4.130
560 HB3 GLU 72 2HB GLU 72 19.531 13.481 -5.361
561 HG2 GLU 72 1HG GLU 72 18.555 15.466 -5.859
562 HG3 GLU 72 2HG GLU 72 18.393 15.925 -4.159
563 H GLN 73 H GLN 73 19.281 10.999 -3.408
564 HA GLN 73 HA GLN 73 17.515 10.021 -5.392
565 HB2 GLN 73 1HB GLN 73 18.498 8.518 -2.938
566 HB3 GLN 73 2HB GLN 73 17.974 7.823 -4.476
567 HG2 GLN 73 1HG GLN 73 20.469 9.475 -3.949
568 HG3 GLN 73 2HG GLN 73 20.390 7.760 -4.357
569 HE21 GLN 73 1HE2 GLN 73 20.894 10.353 -7.263
570 HE22 GLN 73 2HE2 GLN 73 21.311 10.573 -5.573
571 H GLU 74 H GLU 74 17.013 10.509 -1.894
572 HA GLU 74 HA GLU 74 14.402 9.214 -1.858
573 HB2 GLU 74 1HB GLU 74 15.654 11.232 0.039
574 HB3 GLU 74 2HB GLU 74 14.234 10.246 0.382
575 HG2 GLU 74 1HG GLU 74 15.565 8.222 0.387
576 HG3 GLU 74 2HG GLU 74 16.992 9.100 -0.195
577 H ARG 75 H ARG 75 15.674 12.507 -2.279
578 HA ARG 75 HA ARG 75 13.184 13.869 -1.996
579 HB2 ARG 75 1HB ARG 75 15.910 14.514 -3.099
580 HB3 ARG 75 2HB ARG 75 14.578 15.635 -3.353
581 HG2 ARG 75 1HG ARG 75 15.794 16.339 -1.422
582 HG3 ARG 75 2HG ARG 75 14.216 15.725 -0.914
583 HD2 ARG 75 1HD ARG 75 15.446 13.542 -0.375
584 HD3 ARG 75 2HD ARG 75 16.929 14.496 -0.513
585 HE ARG 75 HE ARG 75 15.316 15.941 1.211
586 HH11 ARG 75 1HH1 ARG 75 16.510 12.615 1.209
587 HH12 ARG 75 2HH1 ARG 75 16.452 12.484 2.938
588 HH21 ARG 75 1HH2 ARG 75 15.288 15.711 3.440
589 HH22 ARG 75 2HH2 ARG 75 15.784 14.210 4.175
590 H ILE 76 H ILE 76 14.862 12.547 -4.888
591 HA ILE 76 HA ILE 76 12.961 13.786 -6.693
592 HB ILE 76 HB ILE 76 13.899 12.326 -8.436
593 HG12 ILE 76 1HG1 ILE 76 15.559 11.063 -6.225
594 HG13 ILE 76 2HG1 ILE 76 14.170 10.291 -6.984
595 HG21 ILE 76 1HG2 ILE 76 15.065 14.433 -7.688
596 HG22 ILE 76 2HG2 ILE 76 16.111 13.442 -6.651
597 HG23 ILE 76 3HG2 ILE 76 16.157 13.241 -8.414
598 HD11 ILE 76 1HD1 ILE 76 16.180 9.389 -7.960
599 HD12 ILE 76 2HD1 ILE 76 15.371 10.392 -9.186
600 HD13 ILE 76 3HD1 ILE 76 16.802 11.012 -8.322
601 H ARG 77 H ARG 77 12.804 10.993 -4.665
602 HA ARG 77 HA ARG 77 10.742 9.624 -6.185
603 HB2 ARG 77 1HB ARG 77 12.308 8.506 -4.600
604 HB3 ARG 77 2HB ARG 77 11.596 9.412 -3.268
605 HG2 ARG 77 1HG ARG 77 9.667 7.882 -4.873
606 HG3 ARG 77 2HG ARG 77 10.863 6.909 -3.996
607 HD2 ARG 77 1HD ARG 77 10.280 7.963 -1.888
608 HD3 ARG 77 2HD ARG 77 9.229 9.125 -2.699
609 HE ARG 77 HE ARG 77 8.593 6.373 -1.975
610 HH11 ARG 77 1HH1 ARG 77 7.602 9.099 -4.026
611 HH12 ARG 77 2HH1 ARG 77 5.928 8.567 -4.012
612 HH21 ARG 77 1HH2 ARG 77 6.427 5.803 -2.077
613 HH22 ARG 77 2HH2 ARG 77 5.299 6.808 -2.961
614 H LEU 78 H LEU 78 10.847 12.301 -3.941
615 HA LEU 78 HA LEU 78 8.129 11.991 -2.969
616 HB2 LEU 78 1HB LEU 78 10.382 13.837 -2.618
617 HB3 LEU 78 2HB LEU 78 8.818 14.643 -2.574
618 HG LEU 78 HG LEU 78 9.436 12.189 -0.905
619 HD11 LEU 78 1HD1 LEU 78 11.059 13.880 -0.314
620 HD12 LEU 78 2HD1 LEU 78 9.827 13.792 0.964
621 HD13 LEU 78 3HD1 LEU 78 9.793 15.127 -0.216
622 HD21 LEU 78 1HD2 LEU 78 7.293 14.365 -0.723
623 HD22 LEU 78 2HD2 LEU 78 7.558 13.097 0.495
624 HD23 LEU 78 3HD2 LEU 78 7.043 12.653 -1.138
625 H PHE 79 H PHE 79 6.580 13.908 -3.216
626 HA PHE 79 HA PHE 79 4.970 14.772 -4.483
627 HB2 PHE 79 1HB PHE 79 7.265 15.581 -6.247
628 HB3 PHE 79 2HB PHE 79 5.664 16.306 -6.171
629 HD1 PHE 79 HD1 PHE 79 9.001 16.231 -4.771
630 HD2 PHE 79 HD2 PHE 79 4.965 17.558 -4.079
631 HE1 PHE 79 HE1 PHE 79 9.824 17.810 -3.031
632 HE2 PHE 79 HE2 PHE 79 5.789 19.163 -2.355
633 HZ PHE 79 HZ PHE 79 8.217 19.295 -1.832
634 H SER 80 H SER 80 5.291 14.909 -7.574
635 HA SER 80 HA SER 80 4.563 13.550 -9.300
636 HB2 SER 80 1HB SER 80 6.394 11.483 -8.033
637 HB3 SER 80 2HB SER 80 5.930 11.618 -9.743
638 HG SER 80 HG SER 80 7.786 13.050 -8.258
639 H ALA 81 H ALA 81 2.743 13.637 -7.362
640 HA ALA 81 HA ALA 81 0.805 12.799 -6.735
641 HB1 ALA 81 1HB ALA 81 0.863 11.540 -8.896
642 HB2 ALA 81 2HB ALA 81 1.458 10.133 -7.982
643 HB3 ALA 81 3HB ALA 81 -0.144 10.813 -7.620
644 H ASP 82 H ASP 82 3.426 12.244 -5.332
645 HA ASP 82 HA ASP 82 2.183 10.719 -3.069
646 HB2 ASP 82 1HB ASP 82 4.892 10.863 -4.061
647 HB3 ASP 82 2HB ASP 82 4.844 11.625 -2.469
648 HA PRO 83 HA PRO 83 1.180 14.572 -1.377
649 HB2 PRO 83 1HB PRO 83 1.994 14.670 1.238
650 HB3 PRO 83 2HB PRO 83 0.703 13.571 0.658
651 HG2 PRO 83 1HG PRO 83 3.619 13.020 1.035
652 HG3 PRO 83 2HG PRO 83 2.207 12.132 1.699
653 HD2 PRO 83 1HD PRO 83 3.418 11.267 -0.509
654 HD3 PRO 83 2HD PRO 83 1.623 11.264 -0.424
655 H PHE 84 H PHE 84 1.714 16.677 -0.511
656 HA PHE 84 HA PHE 84 4.510 17.417 -1.157
657 HB2 PHE 84 1HB PHE 84 3.616 19.609 -1.830
658 HB3 PHE 84 2HB PHE 84 2.819 18.311 -2.727
659 HD1 PHE 84 HD1 PHE 84 0.455 17.800 -2.382
660 HD2 PHE 84 HD2 PHE 84 2.408 20.848 -0.050
661 HE1 PHE 84 HE1 PHE 84 -1.762 18.600 -1.578
662 HE2 PHE 84 HE2 PHE 84 0.195 21.653 0.758
663 HZ PHE 84 HZ PHE 84 -1.896 20.524 0.004
664 H ASP 85 H ASP 85 2.512 16.965 1.191
665 HA ASP 85 HA ASP 85 3.388 19.163 2.979
666 HB2 ASP 85 1HB ASP 85 1.512 18.174 4.442
667 HB3 ASP 85 2HB ASP 85 1.049 19.017 2.969
668 H LEU 86 H LEU 86 5.255 17.316 2.195
669 HA LEU 86 HA LEU 86 5.547 15.082 3.922
670 HB2 LEU 86 1HB LEU 86 7.953 15.233 3.310
671 HB3 LEU 86 2HB LEU 86 6.860 15.245 1.932
672 HG LEU 86 HG LEU 86 7.499 17.968 2.759
673 HD11 LEU 86 1HD1 LEU 86 9.867 17.952 2.124
674 HD12 LEU 86 2HD1 LEU 86 9.828 16.177 1.998
675 HD13 LEU 86 3HD1 LEU 86 9.578 16.966 3.573
676 HD21 LEU 86 1HD2 LEU 86 8.081 18.200 0.401
677 HD22 LEU 86 2HD2 LEU 86 6.552 17.322 0.571
678 HD23 LEU 86 3HD2 LEU 86 8.040 16.436 0.192
679 H GLU 87 H GLU 87 6.350 18.513 4.406
680 HA GLU 87 HA GLU 87 7.691 17.872 6.961
681 HB2 GLU 87 1HB GLU 87 7.103 20.529 5.613
682 HB3 GLU 87 2HB GLU 87 7.876 20.360 7.198
683 HG2 GLU 87 1HG GLU 87 9.658 18.934 6.085
684 HG3 GLU 87 2HG GLU 87 8.955 19.384 4.525
685 H ALA 88 H ALA 88 4.798 19.619 5.859
686 HA ALA 88 HA ALA 88 2.869 20.243 6.836
687 HB1 ALA 88 1HB ALA 88 3.206 17.511 8.106
688 HB2 ALA 88 2HB ALA 88 1.682 18.429 8.061
689 HB3 ALA 88 3HB ALA 88 2.441 17.900 6.547
690 H GLN 89 H GLN 89 5.425 20.606 8.822
691 HA GLN 89 HA GLN 89 3.936 20.862 11.323
692 HB2 GLN 89 1HB GLN 89 6.822 21.228 10.522
693 HB3 GLN 89 2HB GLN 89 6.249 21.599 12.146
694 HG2 GLN 89 1HG GLN 89 5.896 19.388 12.698
695 HG3 GLN 89 2HG GLN 89 5.623 18.900 11.023
696 HE21 GLN 89 1HE2 GLN 89 8.896 17.945 10.437
697 HE22 GLN 89 2HE2 GLN 89 7.234 18.042 9.879
698 H ALA 90 H ALA 90 3.829 22.650 8.919
699 HA ALA 90 HA ALA 90 3.596 24.845 8.308
700 HB1 ALA 90 1HB ALA 90 1.645 24.546 9.696
701 HB2 ALA 90 2HB ALA 90 2.567 25.111 11.116
702 HB3 ALA 90 3HB ALA 90 2.278 26.211 9.746
703 H LYS 91 H LYS 91 5.319 25.875 7.824
704 HA LYS 91 HA LYS 91 7.394 26.514 9.690
705 HB2 LYS 91 1HB LYS 91 8.520 27.592 7.899
706 HB3 LYS 91 2HB LYS 91 7.739 26.156 7.234
707 HG2 LYS 91 1HG LYS 91 5.948 27.584 6.266
708 HG3 LYS 91 2HG LYS 91 6.725 29.016 6.976
709 HD2 LYS 91 1HD LYS 91 8.821 28.333 5.731
710 HD3 LYS 91 2HD LYS 91 7.820 27.198 4.817
711 HE2 LYS 91 1HE LYS 91 6.480 29.009 3.923
712 HE3 LYS 91 2HE LYS 91 7.209 30.173 5.054
713 HZ1 LYS 91 1HZ LYS 91 8.715 28.771 2.920
714 HZ2 LYS 91 2HZ LYS 91 9.319 29.907 3.963
715 HZ3 LYS 91 3HZ LYS 91 8.191 30.338 2.842
716 H ILE 92 H ILE 92 8.139 28.475 10.463
717 HA ILE 92 HA ILE 92 6.312 30.816 10.266
718 HB ILE 92 HB ILE 92 7.797 29.862 12.782
719 HG12 ILE 92 1HG1 ILE 92 4.797 30.146 12.322
720 HG13 ILE 92 2HG1 ILE 92 5.668 28.615 12.232
721 HG21 ILE 92 1HG2 ILE 92 6.016 32.331 12.368
722 HG22 ILE 92 2HG2 ILE 92 6.806 31.854 13.889
723 HG23 ILE 92 3HG2 ILE 92 7.791 32.357 12.508
724 HD11 ILE 92 1HD1 ILE 92 4.614 28.742 14.393
725 HD12 ILE 92 2HD1 ILE 92 6.366 28.913 14.635
726 HD13 ILE 92 3HD1 ILE 92 5.309 30.345 14.710
727 H GLU 93 H GLU 93 7.488 32.391 9.337
728 HA GLU 93 HA GLU 93 10.448 32.391 9.618
729 HB2 GLU 93 1HB GLU 93 8.774 32.684 7.093
730 HB3 GLU 93 2HB GLU 93 10.492 33.076 7.202
731 HG2 GLU 93 1HG GLU 93 10.977 30.729 7.805
732 HG3 GLU 93 2HG GLU 93 9.262 30.340 7.607
733 H GLU 94 H GLU 94 11.294 34.561 8.917
734 HA GLU 94 HA GLU 94 9.292 36.724 9.372
735 HB2 GLU 94 1HB GLU 94 11.054 37.998 10.504
736 HB3 GLU 94 2HB GLU 94 10.707 36.493 11.362
737 HG2 GLU 94 1HG GLU 94 12.734 35.457 10.470
738 HG3 GLU 94 2HG GLU 94 13.055 36.879 9.464
739 H ASP 95 H ASP 95 9.730 38.664 8.202
740 HA ASP 95 HA ASP 95 11.693 38.335 5.979
741 HB2 ASP 95 1HB ASP 95 9.308 38.057 5.220
742 HB3 ASP 95 2HB ASP 95 8.991 39.711 5.763
743 H ILE 96 H ILE 96 12.973 39.385 7.759
744 HA ILE 96 HA ILE 96 12.324 42.207 8.247
745 HB ILE 96 HB ILE 96 14.867 40.745 9.107
746 HG12 ILE 96 1HG1 ILE 96 12.964 39.448 9.914
747 HG13 ILE 96 2HG1 ILE 96 13.765 40.269 11.241
748 HG21 ILE 96 1HG2 ILE 96 14.756 42.456 11.009
749 HG22 ILE 96 2HG2 ILE 96 15.048 43.170 9.414
750 HG23 ILE 96 3HG2 ILE 96 13.428 43.262 10.138
751 HD11 ILE 96 1HD1 ILE 96 11.309 40.310 11.520
752 HD12 ILE 96 2HD1 ILE 96 11.931 41.961 11.332
753 HD13 ILE 96 3HD1 ILE 96 11.119 41.153 9.969
754 H ARG 97 H ARG 97 12.377 41.999 5.671
755 HA ARG 97 HA ARG 97 15.039 42.641 4.546
756 HB2 ARG 97 1HB ARG 97 12.240 42.234 3.527
757 HB3 ARG 97 2HB ARG 97 13.316 43.242 2.561
758 HG2 ARG 97 1HG ARG 97 14.967 41.439 2.449
759 HG3 ARG 97 2HG ARG 97 13.894 40.392 3.399
760 HD2 ARG 97 1HD ARG 97 12.200 40.457 1.648
761 HD3 ARG 97 2HD ARG 97 13.120 41.681 0.758
762 HE ARG 97 HE ARG 97 14.589 40.074 -0.026
763 HH11 ARG 97 1HH1 ARG 97 12.414 38.547 2.334
764 HH12 ARG 97 2HH1 ARG 97 12.928 36.936 1.870
765 HH21 ARG 97 1HH2 ARG 97 15.190 37.992 -0.521
766 HH22 ARG 97 2HH2 ARG 97 14.481 36.630 0.292
767 H GLN 98 H GLN 98 14.500 44.264 6.672
768 HA GLN 98 HA GLN 98 14.438 46.897 5.399
769 HB2 GLN 98 1HB GLN 98 12.003 46.313 5.949
770 HB3 GLN 98 2HB GLN 98 12.438 46.411 7.655
771 HG2 GLN 98 1HG GLN 98 13.160 48.777 7.345
772 HG3 GLN 98 2HG GLN 98 12.902 48.641 5.604
773 HE21 GLN 98 1HE2 GLN 98 9.513 49.292 5.692
774 HE22 GLN 98 2HE2 GLN 98 10.951 49.000 4.739
775 HXT GLN 98 HO GLN 98 15.769 46.326 9.020
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