Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
588490 | 2mtq RC | 25177 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 H MET 1 1.808 0.000 0.855
2 HA MET 1 HA MET 1 2.600 -0.951 -1.319
3 HB2 MET 1 2HB MET 1 1.748 0.172 -3.345
4 HB3 MET 1 3HB MET 1 0.481 -0.680 -2.473
5 HG2 MET 1 2HG MET 1 -0.279 1.424 -1.505
6 HG3 MET 1 3HG MET 1 0.998 2.282 -2.365
7 HE1 MET 1 3HE MET 1 -2.373 1.567 -2.086
8 HE2 MET 1 1HE MET 1 -3.128 1.675 -3.676
9 HE3 MET 1 2HE MET 1 -2.480 0.136 -3.112
10 H GLY 2 H GLY 2 1.990 2.228 -0.033
11 HA2 GLY 2 2HA GLY 2 3.356 4.056 0.219
12 HA3 GLY 2 3HA GLY 2 4.704 2.963 -0.058
13 H SER 3 H SER 3 5.902 4.338 -1.324
14 HA SER 3 HA SER 3 4.671 5.204 -3.854
15 HB2 SER 3 2HB SER 3 5.585 7.002 -2.370
16 HB3 SER 3 3HB SER 3 7.185 6.285 -2.560
17 HG SER 3 HG SER 3 7.161 7.725 -4.153
18 H TRP 4 H TRP 4 5.633 2.535 -3.412
19 HA TRP 4 HA TRP 4 8.223 2.213 -4.548
20 HB2 TRP 4 2HB TRP 4 7.509 0.412 -3.224
21 HB3 TRP 4 3HB TRP 4 5.929 0.350 -3.999
22 HD1 TRP 4 HD1 TRP 4 5.797 -0.847 -6.419
23 HE1 TRP 4 HE1 TRP 4 7.318 -2.610 -7.517
24 HE3 TRP 4 HE3 TRP 4 9.904 -0.364 -3.413
25 HZ2 TRP 4 HZ2 TRP 4 9.914 -3.657 -7.157
26 HZ3 TRP 4 HZ3 TRP 4 11.864 -1.784 -3.856
27 HH2 TRP 4 HH2 TRP 4 11.867 -3.396 -5.690
28 H ALA 5 H ALA 5 4.970 2.347 -5.842
29 HA ALA 5 HA ALA 5 5.386 1.288 -8.379
30 HB1 ALA 5 1HB ALA 5 3.511 2.916 -9.042
31 HB2 ALA 5 2HB ALA 5 3.165 1.700 -7.812
32 HB3 ALA 5 3HB ALA 5 3.495 3.366 -7.337
33 H GLU 6 H GLU 6 5.648 4.686 -7.333
34 HA GLU 6 HA GLU 6 6.435 5.748 -9.795
35 HB2 GLU 6 2HB GLU 6 6.029 6.719 -7.210
36 HB3 GLU 6 3HB GLU 6 7.711 7.089 -7.561
37 HG2 GLU 6 2HG GLU 6 6.902 8.929 -8.518
38 HG3 GLU 6 3HG GLU 6 6.493 7.866 -9.864
39 H PHE 7 H PHE 7 8.441 4.687 -7.051
40 HA PHE 7 HA PHE 7 10.928 5.203 -8.230
41 HB2 PHE 7 2HB PHE 7 9.953 3.543 -5.968
42 HB3 PHE 7 3HB PHE 7 11.550 3.160 -6.601
43 HD1 PHE 7 HD1 PHE 7 9.593 6.215 -5.714
44 HD2 PHE 7 HD2 PHE 7 13.310 4.150 -5.529
45 HE1 PHE 7 HE1 PHE 7 10.551 8.062 -4.400
46 HE2 PHE 7 HE2 PHE 7 14.273 5.993 -4.215
47 HZ PHE 7 HZ PHE 7 12.893 7.952 -3.648
48 H LYS 8 H LYS 8 8.770 2.451 -8.472
49 HA LYS 8 HA LYS 8 10.593 0.672 -9.710
50 HB2 LYS 8 2HB LYS 8 8.509 -0.079 -8.642
51 HB3 LYS 8 3HB LYS 8 7.575 0.754 -9.878
52 HG2 LYS 8 2HG LYS 8 7.614 -1.092 -11.093
53 HG3 LYS 8 3HG LYS 8 9.364 -0.922 -11.246
54 HD2 LYS 8 2HD LYS 8 9.102 -1.992 -8.740
55 HD3 LYS 8 3HD LYS 8 7.786 -2.774 -9.619
56 HE2 LYS 8 2HE LYS 8 9.771 -3.013 -11.424
57 HE3 LYS 8 3HE LYS 8 10.709 -3.042 -9.932
58 HZ1 LYS 8 3HZ LYS 8 9.941 -5.058 -9.400
59 HZ2 LYS 8 1HZ LYS 8 9.515 -5.183 -11.032
60 HZ3 LYS 8 2HZ LYS 8 8.359 -4.714 -9.890
61 H GLN 9 H GLN 9 8.193 2.941 -11.000
62 HA GLN 9 HA GLN 9 8.546 2.283 -13.716
63 HB2 GLN 9 2HB GLN 9 6.803 3.847 -12.381
64 HB3 GLN 9 3HB GLN 9 7.863 5.085 -13.040
65 HG2 GLN 9 2HG GLN 9 7.135 3.105 -15.025
66 HG3 GLN 9 3HG GLN 9 5.726 3.891 -14.314
67 HE21 GLN 9 1HE2 GLN 9 7.919 4.066 -16.744
68 HE22 GLN 9 2HE2 GLN 9 7.816 5.751 -17.112
69 H ARG 10 H ARG 10 9.818 5.064 -11.876
70 HA ARG 10 HA ARG 10 11.445 6.102 -13.876
71 HB2 ARG 10 2HB ARG 10 11.841 6.160 -10.880
72 HB3 ARG 10 3HB ARG 10 12.725 7.161 -12.023
73 HG2 ARG 10 2HG ARG 10 11.078 8.644 -12.127
74 HG3 ARG 10 3HG ARG 10 9.871 7.388 -12.407
75 HD2 ARG 10 2HD ARG 10 9.094 7.888 -10.375
76 HD3 ARG 10 3HD ARG 10 10.518 7.054 -9.753
77 HE ARG 10 HE ARG 10 11.282 9.067 -9.018
78 HH11 ARG 10 1HH1 ARG 10 9.029 9.630 -11.612
79 HH12 ARG 10 2HH1 ARG 10 9.093 11.355 -11.467
80 HH21 ARG 10 1HH2 ARG 10 11.374 11.337 -8.817
81 HH22 ARG 10 2HH2 ARG 10 10.428 12.325 -9.878
82 H LEU 11 H LEU 11 12.185 3.679 -11.397
83 HA LEU 11 HA LEU 11 14.913 3.378 -12.008
84 HB2 LEU 11 2HB LEU 11 14.033 2.546 -9.942
85 HB3 LEU 11 3HB LEU 11 12.922 1.474 -10.792
86 HG LEU 11 HG LEU 11 15.767 1.010 -11.368
87 HD11 LEU 11 1HD1 LEU 11 16.308 1.317 -9.171
88 HD12 LEU 11 2HD1 LEU 11 15.770 -0.362 -9.120
89 HD13 LEU 11 3HD1 LEU 11 14.685 0.927 -8.599
90 HD21 LEU 11 3HD2 LEU 11 14.300 -1.227 -10.356
91 HD22 LEU 11 1HD2 LEU 11 14.907 -0.938 -11.987
92 HD23 LEU 11 2HD2 LEU 11 13.309 -0.353 -11.524
93 H ALA 12 H ALA 12 12.024 1.800 -13.278
94 HA ALA 12 HA ALA 12 13.332 -0.167 -14.817
95 HB1 ALA 12 1HB ALA 12 11.097 0.046 -16.184
96 HB2 ALA 12 2HB ALA 12 11.107 -0.641 -14.559
97 HB3 ALA 12 3HB ALA 12 10.607 1.032 -14.806
98 H ALA 13 H ALA 13 12.216 3.105 -15.613
99 HA ALA 13 HA ALA 13 12.911 3.024 -18.347
100 HB1 ALA 13 1HB ALA 13 13.072 5.659 -17.776
101 HB2 ALA 13 2HB ALA 13 11.558 4.798 -18.056
102 HB3 ALA 13 3HB ALA 13 12.116 5.088 -16.408
103 H ILE 14 H ILE 14 14.688 4.026 -15.462
104 HA ILE 14 HA ILE 14 16.937 5.083 -16.809
105 HB ILE 14 HB ILE 14 16.683 3.955 -14.021
106 HG12 ILE 14 2HG1 ILE 14 16.961 6.846 -14.810
107 HG13 ILE 14 3HG1 ILE 14 15.386 6.060 -14.769
108 HG21 ILE 14 1HG2 ILE 14 18.814 5.736 -14.075
109 HG22 ILE 14 2HG2 ILE 14 18.906 3.981 -13.939
110 HG23 ILE 14 3HG2 ILE 14 19.022 4.749 -15.522
111 HD11 ILE 14 3HD1 ILE 14 17.246 6.679 -12.518
112 HD12 ILE 14 1HD1 ILE 14 15.534 7.061 -12.695
113 HD13 ILE 14 2HD1 ILE 14 16.038 5.404 -12.363
114 H LYS 15 H LYS 15 16.222 1.871 -15.499
115 HA LYS 15 HA LYS 15 18.760 0.748 -16.077
116 HB2 LYS 15 2HB LYS 15 16.726 -0.082 -14.573
117 HB3 LYS 15 3HB LYS 15 16.325 -0.970 -16.037
118 HG2 LYS 15 2HG LYS 15 19.090 -1.328 -15.549
119 HG3 LYS 15 3HG LYS 15 18.230 -1.608 -14.034
120 HD2 LYS 15 2HD LYS 15 17.182 -2.828 -16.547
121 HD3 LYS 15 3HD LYS 15 18.583 -3.556 -15.758
122 HE2 LYS 15 2HE LYS 15 17.168 -3.481 -13.620
123 HE3 LYS 15 3HE LYS 15 15.799 -3.198 -14.694
124 HZ1 LYS 15 3HZ LYS 15 16.573 -5.274 -15.895
125 HZ2 LYS 15 1HZ LYS 15 15.866 -5.496 -14.375
126 HZ3 LYS 15 2HZ LYS 15 17.546 -5.579 -14.545
127 H THR 16 H THR 16 15.703 0.868 -17.847
128 HA THR 16 HA THR 16 16.426 -0.840 -19.959
129 HB THR 16 HB THR 16 14.491 1.484 -19.992
130 HG1 THR 16 HG1 THR 16 13.577 0.102 -18.622
131 HG21 THR 16 3HG2 THR 16 15.421 -0.215 -22.096
132 HG22 THR 16 1HG2 THR 16 14.221 1.074 -22.164
133 HG23 THR 16 2HG2 THR 16 13.725 -0.572 -21.772
134 H ARG 17 H ARG 17 16.500 2.719 -19.761
135 HA ARG 17 HA ARG 17 17.681 3.100 -22.298
136 HB2 ARG 17 2HB ARG 17 17.265 4.791 -19.873
137 HB3 ARG 17 3HB ARG 17 18.388 5.356 -21.104
138 HG2 ARG 17 2HG ARG 17 16.356 6.348 -21.664
139 HG3 ARG 17 3HG ARG 17 16.489 4.975 -22.764
140 HD2 ARG 17 2HD ARG 17 15.107 3.665 -21.117
141 HD3 ARG 17 3HD ARG 17 14.827 5.182 -20.262
142 HE ARG 17 HE ARG 17 13.565 4.312 -22.667
143 HH11 ARG 17 1HH1 ARG 17 14.650 7.127 -20.929
144 HH12 ARG 17 2HH1 ARG 17 13.506 8.191 -21.679
145 HH21 ARG 17 1HH2 ARG 17 12.054 5.703 -23.660
146 HH22 ARG 17 2HH2 ARG 17 12.029 7.380 -23.231
147 H CYS 18 H CYS 18 18.999 2.499 -19.116
148 HA CYS 18 HA CYS 18 21.690 3.196 -19.772
149 HB2 CYS 18 2HB CYS 18 21.110 3.274 -17.470
150 HB3 CYS 18 3HB CYS 18 20.450 1.644 -17.504
151 HG CYS 18 HG CYS 18 22.930 0.393 -17.774
152 H GLN 19 H GLN 19 19.844 0.187 -19.692
153 HA GLN 19 HA GLN 19 22.070 -1.493 -20.285
154 HB2 GLN 19 2HB GLN 19 19.095 -1.963 -20.519
155 HB3 GLN 19 3HB GLN 19 20.313 -3.207 -20.765
156 HG2 GLN 19 2HG GLN 19 20.699 -1.842 -18.252
157 HG3 GLN 19 3HG GLN 19 19.077 -2.520 -18.380
158 HE21 GLN 19 1HE2 GLN 19 22.188 -3.650 -19.636
159 HE22 GLN 19 2HE2 GLN 19 22.154 -5.180 -18.834
160 H ALA 20 H ALA 20 19.668 0.201 -22.194
161 HA ALA 20 HA ALA 20 20.475 -1.077 -24.662
162 HB1 ALA 20 1HB ALA 20 18.125 -0.344 -24.180
163 HB2 ALA 20 2HB ALA 20 18.683 1.321 -24.343
164 HB3 ALA 20 3HB ALA 20 18.782 0.219 -25.717
165 H LEU 21 H LEU 21 21.126 1.882 -22.926
166 HA LEU 21 HA LEU 21 22.525 3.635 -23.315
167 HB2 LEU 21 2HB LEU 21 23.905 1.433 -24.824
168 HB3 LEU 21 3HB LEU 21 24.599 3.044 -24.657
169 HG LEU 21 HG LEU 21 23.986 1.124 -22.411
170 HD11 LEU 21 1HD1 LEU 21 26.722 2.062 -22.817
171 HD12 LEU 21 2HD1 LEU 21 26.101 1.073 -24.139
172 HD13 LEU 21 3HD1 LEU 21 26.111 0.439 -22.493
173 HD21 LEU 21 3HD2 LEU 21 24.033 2.873 -21.048
174 HD22 LEU 21 1HD2 LEU 21 24.279 3.962 -22.413
175 HD23 LEU 21 2HD2 LEU 21 25.668 3.241 -21.599
176 H GLY 22 H GLY 22 20.624 4.493 -24.569
177 HA2 GLY 22 2HA GLY 22 20.280 4.393 -27.289
178 HA3 GLY 22 3HA GLY 22 19.956 5.825 -26.323
179 H GLY 23 H GLY 23 22.780 6.092 -25.521
180 HA2 GLY 23 2HA GLY 23 24.882 6.471 -26.702
181 HA3 GLY 23 3HA GLY 23 23.932 6.905 -28.116
182 H SER 24 H SER 24 24.512 7.901 -24.752
183 HA SER 24 HA SER 24 24.850 10.638 -25.578
184 HB2 SER 24 2HB SER 24 22.487 9.861 -23.855
185 HB3 SER 24 3HB SER 24 23.058 11.515 -24.072
186 HG SER 24 HG SER 24 22.445 11.463 -26.170
187 H GLU 25 H GLU 25 26.574 11.250 -24.468
188 HA GLU 25 HA GLU 25 27.594 9.934 -22.221
189 HB2 GLU 25 2HB GLU 25 29.014 12.020 -21.966
190 HB3 GLU 25 3HB GLU 25 29.107 11.206 -23.522
191 HG2 GLU 25 2HG GLU 25 28.527 13.065 -24.560
192 HG3 GLU 25 3HG GLU 25 27.027 13.143 -23.637
193 H ALA 26 H ALA 26 25.138 12.313 -22.500
194 HA ALA 26 HA ALA 26 25.335 13.219 -19.758
195 HB1 ALA 26 1HB ALA 26 23.510 13.832 -22.049
196 HB2 ALA 26 2HB ALA 26 23.089 14.326 -20.409
197 HB3 ALA 26 3HB ALA 26 24.579 14.910 -21.150
198 H GLU 27 H GLU 27 23.150 11.195 -21.688
199 HA GLU 27 HA GLU 27 21.196 10.657 -19.823
200 HB2 GLU 27 2HB GLU 27 22.370 9.025 -22.049
201 HB3 GLU 27 3HB GLU 27 21.137 8.335 -21.004
202 HG2 GLU 27 2HG GLU 27 19.598 10.112 -21.611
203 HG3 GLU 27 3HG GLU 27 20.836 10.856 -22.621
204 H CYS 28 H CYS 28 24.214 8.838 -20.340
205 HA CYS 28 HA CYS 28 23.881 6.937 -18.346
206 HB2 CYS 28 2HB CYS 28 26.503 8.198 -19.171
207 HB3 CYS 28 3HB CYS 28 26.283 6.615 -18.436
208 HG CYS 28 HG CYS 28 26.813 5.883 -20.946
209 H ALA 29 H ALA 29 25.354 10.158 -18.140
210 HA ALA 29 HA ALA 29 26.155 10.015 -15.454
211 HB1 ALA 29 1HB ALA 29 26.564 11.802 -17.386
212 HB2 ALA 29 2HB ALA 29 25.276 12.636 -16.515
213 HB3 ALA 29 3HB ALA 29 26.762 12.190 -15.676
214 H ALA 30 H ALA 30 23.164 11.258 -16.916
215 HA ALA 30 HA ALA 30 21.932 12.169 -14.585
216 HB1 ALA 30 1HB ALA 30 21.200 12.523 -16.988
217 HB2 ALA 30 2HB ALA 30 20.440 10.935 -16.884
218 HB3 ALA 30 3HB ALA 30 19.920 12.233 -15.809
219 H PHE 31 H PHE 31 22.064 8.945 -15.999
220 HA PHE 31 HA PHE 31 20.150 7.758 -14.277
221 HB2 PHE 31 2HB PHE 31 22.426 6.517 -15.836
222 HB3 PHE 31 3HB PHE 31 21.149 5.608 -15.035
223 HD1 PHE 31 HD1 PHE 31 18.810 7.320 -15.692
224 HD2 PHE 31 HD2 PHE 31 22.080 6.017 -18.085
225 HE1 PHE 31 HE1 PHE 31 17.409 7.512 -17.705
226 HE2 PHE 31 HE2 PHE 31 20.685 6.208 -20.102
227 HZ PHE 31 HZ PHE 31 18.346 6.957 -19.914
228 H GLU 32 H GLU 32 23.707 7.803 -14.218
229 HA GLU 32 HA GLU 32 24.102 6.280 -11.932
230 HB2 GLU 32 2HB GLU 32 25.749 7.526 -13.665
231 HB3 GLU 32 3HB GLU 32 25.888 8.616 -12.293
232 HG2 GLU 32 2HG GLU 32 26.496 6.687 -10.873
233 HG3 GLU 32 3HG GLU 32 26.462 5.663 -12.307
234 H LYS 33 H LYS 33 23.659 9.794 -12.214
235 HA LYS 33 HA LYS 33 23.865 10.328 -9.443
236 HB2 LYS 33 2HB LYS 33 23.218 11.805 -11.870
237 HB3 LYS 33 3HB LYS 33 22.260 12.336 -10.494
238 HG2 LYS 33 2HG LYS 33 24.011 13.669 -10.090
239 HG3 LYS 33 3HG LYS 33 24.725 12.219 -9.381
240 HD2 LYS 33 2HD LYS 33 26.232 12.004 -11.039
241 HD3 LYS 33 3HD LYS 33 25.068 12.458 -12.287
242 HE2 LYS 33 2HE LYS 33 25.431 14.750 -11.946
243 HE3 LYS 33 3HE LYS 33 26.209 14.483 -10.386
244 HZ1 LYS 33 3HZ LYS 33 27.644 13.111 -12.376
245 HZ2 LYS 33 1HZ LYS 33 28.160 14.390 -11.395
246 HZ3 LYS 33 2HZ LYS 33 27.420 14.710 -12.882
247 H GLU 34 H GLU 34 20.991 10.221 -11.559
248 HA GLU 34 HA GLU 34 19.039 10.545 -9.646
249 HB2 GLU 34 2HB GLU 34 19.036 8.920 -12.185
250 HB3 GLU 34 3HB GLU 34 17.596 9.127 -11.198
251 HG2 GLU 34 2HG GLU 34 17.581 11.474 -11.567
252 HG3 GLU 34 3HG GLU 34 19.173 11.425 -12.322
253 H ILE 35 H ILE 35 20.500 7.492 -10.736
254 HA ILE 35 HA ILE 35 19.019 5.790 -9.070
255 HB ILE 35 HB ILE 35 21.766 5.467 -10.270
256 HG12 ILE 35 2HG1 ILE 35 19.799 5.587 -11.805
257 HG13 ILE 35 3HG1 ILE 35 20.653 4.049 -11.876
258 HG21 ILE 35 1HG2 ILE 35 21.049 2.943 -9.762
259 HG22 ILE 35 2HG2 ILE 35 22.008 3.910 -8.643
260 HG23 ILE 35 3HG2 ILE 35 20.271 3.739 -8.394
261 HD11 ILE 35 3HD1 ILE 35 18.253 3.723 -11.923
262 HD12 ILE 35 1HD1 ILE 35 18.947 3.040 -10.453
263 HD13 ILE 35 2HD1 ILE 35 18.091 4.581 -10.391
264 H ALA 36 H ALA 36 22.134 7.404 -8.568
265 HA ALA 36 HA ALA 36 22.844 6.254 -6.140
266 HB1 ALA 36 1HB ALA 36 24.583 7.505 -6.805
267 HB2 ALA 36 2HB ALA 36 23.554 8.691 -7.610
268 HB3 ALA 36 3HB ALA 36 23.803 8.778 -5.866
269 H ALA 37 H ALA 37 20.930 9.193 -6.737
270 HA ALA 37 HA ALA 37 20.454 9.766 -4.006
271 HB1 ALA 37 1HB ALA 37 18.330 10.802 -5.562
272 HB2 ALA 37 2HB ALA 37 19.735 11.654 -4.920
273 HB3 ALA 37 3HB ALA 37 19.804 10.923 -6.523
274 H PHE 38 H PHE 38 18.815 7.767 -6.367
275 HA PHE 38 HA PHE 38 16.373 7.427 -5.021
276 HB2 PHE 38 2HB PHE 38 17.720 6.269 -7.299
277 HB3 PHE 38 3HB PHE 38 16.917 5.016 -6.358
278 HD1 PHE 38 HD2 PHE 38 15.914 8.544 -6.965
279 HD2 PHE 38 HD1 PHE 38 15.051 4.424 -7.590
280 HE1 PHE 38 HE2 PHE 38 13.764 9.154 -7.994
281 HE2 PHE 38 HE1 PHE 38 12.900 5.027 -8.622
282 HZ PHE 38 HZ PHE 38 12.254 7.395 -8.824
283 H GLU 39 H GLU 39 19.259 5.334 -5.055
284 HA GLU 39 HA GLU 39 18.295 3.516 -3.126
285 HB2 GLU 39 2HB GLU 39 20.654 2.787 -2.941
286 HB3 GLU 39 3HB GLU 39 20.104 2.897 -4.607
287 HG2 GLU 39 2HG GLU 39 21.210 5.089 -4.799
288 HG3 GLU 39 3HG GLU 39 21.817 4.900 -3.154
289 H SER 40 H SER 40 20.238 6.451 -2.874
290 HA SER 40 HA SER 40 20.825 6.191 -0.111
291 HB2 SER 40 2HB SER 40 22.069 7.655 -1.739
292 HB3 SER 40 3HB SER 40 20.694 8.758 -1.706
293 HG SER 40 HG SER 40 21.400 9.511 0.115
294 H GLU 41 H GLU 41 18.125 7.485 -1.898
295 HA GLU 41 HA GLU 41 16.980 8.860 0.357
296 HB2 GLU 41 2HB GLU 41 16.132 8.309 -2.458
297 HB3 GLU 41 3HB GLU 41 14.925 8.820 -1.286
298 HG2 GLU 41 2HG GLU 41 17.283 10.487 -1.181
299 HG3 GLU 41 3HG GLU 41 16.577 10.449 -2.796
300 H LEU 42 H LEU 42 16.639 5.732 -1.182
301 HA LEU 42 HA LEU 42 14.282 4.985 0.267
302 HB2 LEU 42 2HB LEU 42 16.276 3.328 -1.269
303 HB3 LEU 42 3HB LEU 42 14.755 2.723 -0.616
304 HG LEU 42 HG LEU 42 14.701 5.018 -2.523
305 HD11 LEU 42 1HD1 LEU 42 14.337 2.902 -4.173
306 HD12 LEU 42 2HD1 LEU 42 15.625 2.299 -3.131
307 HD13 LEU 42 3HD1 LEU 42 15.845 3.804 -4.024
308 HD21 LEU 42 3HD2 LEU 42 12.874 2.897 -1.536
309 HD22 LEU 42 1HD2 LEU 42 12.652 3.475 -3.188
310 HD23 LEU 42 2HD2 LEU 42 12.568 4.608 -1.839
311 H GLN 43 H GLN 43 17.741 4.586 0.696
312 HA GLN 43 HA GLN 43 17.501 2.735 2.874
313 HB2 GLN 43 2HB GLN 43 19.859 2.842 3.034
314 HB3 GLN 43 3HB GLN 43 19.494 2.958 1.318
315 HG2 GLN 43 2HG GLN 43 20.794 4.748 1.271
316 HG3 GLN 43 3HG GLN 43 19.534 5.588 2.174
317 HE21 GLN 43 1HE2 GLN 43 20.133 6.490 4.004
318 HE22 GLN 43 2HE2 GLN 43 21.514 6.060 4.948
319 H ALA 44 H ALA 44 17.197 6.101 2.545
320 HA ALA 44 HA ALA 44 17.951 6.706 5.283
321 HB1 ALA 44 1HB ALA 44 16.628 8.581 3.342
322 HB2 ALA 44 2HB ALA 44 17.629 8.976 4.740
323 HB3 ALA 44 3HB ALA 44 18.360 8.246 3.310
324 H TYR 45 H TYR 45 15.187 5.675 3.611
325 HA TYR 45 HA TYR 45 13.071 6.933 4.837
326 HB2 TYR 45 2HB TYR 45 13.503 4.284 3.606
327 HB3 TYR 45 3HB TYR 45 12.126 4.389 4.697
328 HD1 TYR 45 HD2 TYR 45 10.979 6.963 4.259
329 HD2 TYR 45 HD1 TYR 45 12.780 4.358 1.418
330 HE1 TYR 45 HE2 TYR 45 9.639 7.994 2.473
331 HE2 TYR 45 HE1 TYR 45 11.446 5.382 -0.376
332 HH TYR 45 HH TYR 45 9.033 7.880 0.327
333 H LYS 46 H LYS 46 14.501 3.851 5.933
334 HA LYS 46 HA LYS 46 14.690 4.541 8.631
335 HB2 LYS 46 2HB LYS 46 12.039 4.209 7.925
336 HB3 LYS 46 3HB LYS 46 12.469 2.642 8.598
337 HG2 LYS 46 2HG LYS 46 12.790 5.304 9.968
338 HG3 LYS 46 3HG LYS 46 11.542 4.101 10.301
339 HD2 LYS 46 2HD LYS 46 13.744 2.580 10.587
340 HD3 LYS 46 3HD LYS 46 14.394 4.148 11.070
341 HE2 LYS 46 2HE LYS 46 12.611 4.386 12.719
342 HE3 LYS 46 3HE LYS 46 11.931 2.837 12.220
343 HZ1 LYS 46 3HZ LYS 46 13.893 1.722 12.988
344 HZ2 LYS 46 1HZ LYS 46 13.302 2.693 14.241
345 HZ3 LYS 46 2HZ LYS 46 14.653 3.189 13.352
346 H GLY 47 H GLY 47 13.462 1.681 6.872
347 HA2 GLY 47 2HA GLY 47 15.110 -0.124 8.337
348 HA3 GLY 47 3HA GLY 47 14.185 -0.504 6.892
349 H LYS 48 H LYS 48 17.271 0.336 8.176
350 HA LYS 48 HA LYS 48 18.690 1.129 5.946
351 HB2 LYS 48 2HB LYS 48 19.450 -0.461 8.376
352 HB3 LYS 48 3HB LYS 48 20.629 -0.171 7.103
353 HG2 LYS 48 2HG LYS 48 20.325 2.241 7.374
354 HG3 LYS 48 3HG LYS 48 19.153 1.944 8.661
355 HD2 LYS 48 2HD LYS 48 20.903 2.070 10.051
356 HD3 LYS 48 3HD LYS 48 21.321 0.459 9.462
357 HE2 LYS 48 2HE LYS 48 22.893 1.304 7.942
358 HE3 LYS 48 3HE LYS 48 22.248 2.941 8.051
359 HZ1 LYS 48 3HZ LYS 48 24.423 2.200 9.325
360 HZ2 LYS 48 1HZ LYS 48 23.294 1.750 10.502
361 HZ3 LYS 48 2HZ LYS 48 23.362 3.352 9.964
362 H GLY 49 H GLY 49 17.496 -2.040 6.783
363 HA2 GLY 49 2HA GLY 49 18.561 -3.036 4.218
364 HA3 GLY 49 3HA GLY 49 18.659 -4.012 5.676
365 H ASN 50 H ASN 50 15.889 -2.001 5.032
366 HA ASN 50 HA ASN 50 14.000 -3.968 5.443
367 HB2 ASN 50 2HB ASN 50 14.020 -1.250 4.401
368 HB3 ASN 50 3HB ASN 50 12.780 -2.239 3.634
369 HD21 ASN 50 1HD2 ASN 50 11.208 -0.932 4.653
370 HD22 ASN 50 2HD2 ASN 50 10.809 -1.160 6.318
371 HA PRO 51 HA PRO 51 13.744 -6.463 1.844
372 HB2 PRO 51 2HB PRO 51 11.067 -6.819 1.566
373 HB3 PRO 51 3HB PRO 51 12.008 -7.578 2.855
374 HG2 PRO 51 2HG PRO 51 10.309 -5.116 2.950
375 HG3 PRO 51 3HG PRO 51 10.428 -6.439 4.125
376 HD2 PRO 51 2HD PRO 51 11.695 -4.070 4.465
377 HD3 PRO 51 3HD PRO 51 12.363 -5.604 5.058
378 H GLU 52 H GLU 52 11.770 -3.549 1.870
379 HA GLU 52 HA GLU 52 11.198 -3.570 -0.925
380 HB2 GLU 52 2HB GLU 52 10.441 -1.247 -0.559
381 HB3 GLU 52 3HB GLU 52 9.747 -2.371 0.602
382 HG2 GLU 52 2HG GLU 52 11.471 -1.665 2.237
383 HG3 GLU 52 3HG GLU 52 12.014 -0.452 1.079
384 H VAL 53 H VAL 53 13.607 -1.955 1.101
385 HA VAL 53 HA VAL 53 14.778 -0.469 -1.032
386 HB VAL 53 HB VAL 53 16.082 -1.215 1.585
387 HG11 VAL 53 1HG1 VAL 53 16.655 0.753 -0.576
388 HG12 VAL 53 2HG1 VAL 53 17.061 1.171 1.089
389 HG13 VAL 53 3HG1 VAL 53 17.761 -0.266 0.343
390 HG21 VAL 53 3HG2 VAL 53 13.977 -0.230 2.134
391 HG22 VAL 53 1HG2 VAL 53 15.219 1.001 2.368
392 HG23 VAL 53 2HG2 VAL 53 14.195 1.043 0.933
393 H GLU 54 H GLU 54 15.052 -3.712 0.047
394 HA GLU 54 HA GLU 54 17.668 -4.344 -0.704
395 HB2 GLU 54 2HB GLU 54 15.141 -5.973 -0.577
396 HB3 GLU 54 3HB GLU 54 16.668 -6.684 -1.081
397 HG2 GLU 54 2HG GLU 54 17.191 -5.285 1.297
398 HG3 GLU 54 3HG GLU 54 15.691 -6.175 1.554
399 H ALA 55 H ALA 55 14.663 -4.712 -2.588
400 HA ALA 55 HA ALA 55 15.873 -5.565 -4.966
401 HB1 ALA 55 1HB ALA 55 13.256 -4.179 -4.437
402 HB2 ALA 55 2HB ALA 55 13.742 -4.732 -6.041
403 HB3 ALA 55 3HB ALA 55 13.545 -5.895 -4.729
404 H LEU 56 H LEU 56 14.780 -2.302 -4.030
405 HA LEU 56 HA LEU 56 15.601 -0.959 -6.323
406 HB2 LEU 56 2HB LEU 56 15.514 0.047 -3.483
407 HB3 LEU 56 3HB LEU 56 15.634 1.064 -4.917
408 HG LEU 56 HG LEU 56 13.320 -0.778 -4.788
409 HD11 LEU 56 1HD1 LEU 56 13.936 1.043 -2.639
410 HD12 LEU 56 2HD1 LEU 56 12.615 -0.115 -2.790
411 HD13 LEU 56 3HD1 LEU 56 12.446 1.508 -3.461
412 HD21 LEU 56 3HD2 LEU 56 13.078 0.525 -6.616
413 HD22 LEU 56 1HD2 LEU 56 14.063 1.829 -5.952
414 HD23 LEU 56 2HD2 LEU 56 12.381 1.653 -5.451
415 H ARG 57 H ARG 57 17.401 -1.774 -3.398
416 HA ARG 57 HA ARG 57 19.731 -0.306 -3.989
417 HB2 ARG 57 2HB ARG 57 19.033 -2.551 -2.166
418 HB3 ARG 57 3HB ARG 57 20.739 -2.278 -2.496
419 HG2 ARG 57 2HG ARG 57 20.521 0.029 -1.724
420 HG3 ARG 57 3HG ARG 57 18.809 -0.245 -1.394
421 HD2 ARG 57 2HD ARG 57 20.311 -0.404 0.605
422 HD3 ARG 57 3HD ARG 57 19.309 -1.825 0.312
423 HE ARG 57 HE ARG 57 21.210 -3.048 -0.056
424 HH11 ARG 57 1HH1 ARG 57 21.990 0.343 -0.164
425 HH12 ARG 57 2HH1 ARG 57 23.702 0.080 -0.225
426 HH21 ARG 57 1HH2 ARG 57 23.461 -3.407 -0.136
427 HH22 ARG 57 2HH2 ARG 57 24.537 -2.053 -0.210
428 H LYS 58 H LYS 58 18.822 -3.665 -4.671
429 HA LYS 58 HA LYS 58 21.249 -4.466 -5.831
430 HB2 LYS 58 2HB LYS 58 19.452 -6.019 -5.121
431 HB3 LYS 58 3HB LYS 58 18.464 -5.463 -6.466
432 HG2 LYS 58 2HG LYS 58 19.399 -7.475 -7.193
433 HG3 LYS 58 3HG LYS 58 20.368 -6.222 -7.973
434 HD2 LYS 58 2HD LYS 58 21.853 -7.902 -7.127
435 HD3 LYS 58 3HD LYS 58 22.030 -6.457 -6.128
436 HE2 LYS 58 2HE LYS 58 20.714 -7.417 -4.383
437 HE3 LYS 58 3HE LYS 58 20.248 -8.777 -5.404
438 HZ1 LYS 58 3HZ LYS 58 22.570 -8.451 -3.788
439 HZ2 LYS 58 1HZ LYS 58 22.989 -8.809 -5.387
440 HZ3 LYS 58 2HZ LYS 58 21.966 -9.847 -4.529
441 H GLU 59 H GLU 59 18.216 -3.536 -7.472
442 HA GLU 59 HA GLU 59 19.183 -3.517 -10.066
443 HB2 GLU 59 2HB GLU 59 16.958 -2.075 -8.683
444 HB3 GLU 59 3HB GLU 59 17.362 -1.635 -10.337
445 HG2 GLU 59 2HG GLU 59 15.527 -3.344 -10.023
446 HG3 GLU 59 3HG GLU 59 16.811 -3.757 -11.157
447 H ALA 60 H ALA 60 19.004 -0.792 -7.783
448 HA ALA 60 HA ALA 60 20.052 1.206 -9.369
449 HB1 ALA 60 1HB ALA 60 21.016 2.052 -7.095
450 HB2 ALA 60 2HB ALA 60 19.271 1.964 -7.342
451 HB3 ALA 60 3HB ALA 60 20.097 0.702 -6.428
452 H ALA 61 H ALA 61 21.878 -0.938 -7.178
453 HA ALA 61 HA ALA 61 24.429 -0.020 -7.748
454 HB1 ALA 61 1HB ALA 61 25.251 -2.010 -6.787
455 HB2 ALA 61 2HB ALA 61 23.722 -1.682 -5.970
456 HB3 ALA 61 3HB ALA 61 23.803 -2.915 -7.229
457 H ALA 62 H ALA 62 22.542 -2.523 -9.408
458 HA ALA 62 HA ALA 62 24.504 -3.371 -11.209
459 HB1 ALA 62 1HB ALA 62 21.622 -3.247 -11.997
460 HB2 ALA 62 2HB ALA 62 22.821 -4.498 -12.329
461 HB3 ALA 62 3HB ALA 62 22.149 -4.329 -10.708
462 H ILE 63 H ILE 63 22.049 -0.823 -11.541
463 HA ILE 63 HA ILE 63 22.646 -0.078 -14.172
464 HB ILE 63 HB ILE 63 21.591 1.647 -11.928
465 HG12 ILE 63 2HG1 ILE 63 19.909 0.521 -14.127
466 HG13 ILE 63 3HG1 ILE 63 20.375 -0.536 -12.798
467 HG21 ILE 63 1HG2 ILE 63 21.809 3.345 -13.346
468 HG22 ILE 63 2HG2 ILE 63 22.324 2.271 -14.646
469 HG23 ILE 63 3HG2 ILE 63 20.606 2.560 -14.368
470 HD11 ILE 63 3HD1 ILE 63 18.694 1.939 -12.726
471 HD12 ILE 63 1HD1 ILE 63 18.296 0.309 -12.183
472 HD13 ILE 63 2HD1 ILE 63 19.446 1.286 -11.270
473 H ARG 64 H ARG 64 23.930 1.118 -11.089
474 HA ARG 64 HA ARG 64 25.533 3.170 -12.109
475 HB2 ARG 64 2HB ARG 64 25.028 2.910 -9.719
476 HB3 ARG 64 3HB ARG 64 26.004 1.448 -9.669
477 HG2 ARG 64 2HG ARG 64 27.874 3.060 -10.573
478 HG3 ARG 64 3HG ARG 64 26.849 4.291 -9.832
479 HD2 ARG 64 2HD ARG 64 28.545 3.532 -8.264
480 HD3 ARG 64 3HD ARG 64 26.936 3.075 -7.708
481 HE ARG 64 HE ARG 64 28.233 1.016 -9.224
482 HH11 ARG 64 1HH1 ARG 64 27.907 2.451 -6.069
483 HH12 ARG 64 2HH1 ARG 64 28.369 1.011 -5.223
484 HH21 ARG 64 1HH2 ARG 64 28.843 -0.886 -8.121
485 HH22 ARG 64 2HH2 ARG 64 28.902 -0.886 -6.391
486 H ASP 65 H ASP 65 26.315 -0.232 -11.450
487 HA ASP 65 HA ASP 65 29.016 -0.142 -12.166
488 HB2 ASP 65 2HB ASP 65 27.017 -2.405 -12.313
489 HB3 ASP 65 3HB ASP 65 28.745 -2.611 -12.585
490 H GLU 66 H GLU 66 26.137 -0.788 -14.131
491 HA GLU 66 HA GLU 66 27.446 -1.414 -16.526
492 HB2 GLU 66 2HB GLU 66 24.776 -0.030 -16.226
493 HB3 GLU 66 3HB GLU 66 25.336 -0.932 -17.627
494 HG2 GLU 66 2HG GLU 66 25.430 -2.507 -15.193
495 HG3 GLU 66 3HG GLU 66 23.811 -1.906 -15.550
496 H CYS 67 H CYS 67 26.213 1.703 -15.341
497 HA CYS 67 HA CYS 67 26.905 3.256 -17.549
498 HB2 CYS 67 2HB CYS 67 26.720 3.976 -14.620
499 HB3 CYS 67 3HB CYS 67 26.949 5.165 -15.897
500 HG CYS 67 HG CYS 67 24.212 4.763 -14.779
501 H GLN 68 H GLN 68 28.801 2.381 -14.693
502 HA GLN 68 HA GLN 68 31.063 3.959 -15.373
503 HB2 GLN 68 2HB GLN 68 30.770 1.571 -13.547
504 HB3 GLN 68 3HB GLN 68 32.240 2.525 -13.686
505 HG2 GLN 68 2HG GLN 68 30.828 4.530 -13.048
506 HG3 GLN 68 3HG GLN 68 29.571 3.373 -12.614
507 HE21 GLN 68 1HE2 GLN 68 30.340 1.591 -11.130
508 HE22 GLN 68 2HE2 GLN 68 31.373 2.062 -9.828
509 H ALA 69 H ALA 69 29.987 0.767 -16.241
510 HA ALA 69 HA ALA 69 32.541 -0.048 -17.314
511 HB1 ALA 69 1HB ALA 69 29.884 -1.279 -16.958
512 HB2 ALA 69 2HB ALA 69 30.837 -1.863 -18.322
513 HB3 ALA 69 3HB ALA 69 31.493 -1.948 -16.687
514 H TYR 70 H TYR 70 30.148 2.006 -18.351
515 HA TYR 70 HA TYR 70 30.546 1.384 -21.190
516 HB2 TYR 70 2HB TYR 70 28.561 3.228 -19.844
517 HB3 TYR 70 3HB TYR 70 28.666 2.951 -21.579
518 HD1 TYR 70 HD1 TYR 70 29.258 -0.076 -21.308
519 HD2 TYR 70 HD2 TYR 70 26.298 2.467 -19.610
520 HE1 TYR 70 HE1 TYR 70 27.738 -1.998 -21.095
521 HE2 TYR 70 HE2 TYR 70 24.771 0.552 -19.391
522 HH TYR 70 HH TYR 70 24.612 -1.841 -20.766
523 H ARG 71 H ARG 71 30.961 3.931 -18.796
524 HA ARG 71 HA ARG 71 32.765 5.301 -20.664
525 HB2 ARG 71 2HB ARG 71 30.386 6.354 -20.362
526 HB3 ARG 71 3HB ARG 71 31.031 6.906 -18.822
527 HG2 ARG 71 2HG ARG 71 32.165 8.549 -19.790
528 HG3 ARG 71 3HG ARG 71 32.856 7.459 -20.993
529 HD2 ARG 71 2HD ARG 71 30.349 7.617 -21.926
530 HD3 ARG 71 3HD ARG 71 30.463 9.192 -21.141
531 HE ARG 71 HE ARG 71 31.863 9.871 -22.811
532 HH11 ARG 71 1HH1 ARG 71 31.739 6.392 -22.796
533 HH12 ARG 71 2HH1 ARG 71 32.666 6.223 -24.250
534 HH21 ARG 71 1HH2 ARG 71 33.085 9.661 -24.726
535 HH22 ARG 71 2HH2 ARG 71 33.431 8.083 -25.347
536 H HIS 72 H HIS 72 33.575 3.535 -18.697
537 HA HIS 72 HA HIS 72 35.473 5.048 -17.291
538 HB2 HIS 72 2HB HIS 72 33.005 5.136 -16.030
539 HB3 HIS 72 3HB HIS 72 33.862 3.864 -15.165
540 HD1 HIS 72 HD1 HIS 72 34.452 5.046 -13.041
541 HD2 HIS 72 HD2 HIS 72 35.502 7.230 -16.416
542 HE1 HIS 72 HE1 HIS 72 35.782 7.003 -12.189
543 H ASN 73 H ASN 73 35.251 2.668 -18.907
544 HA ASN 73 HA ASN 73 36.686 0.838 -17.141
545 HB2 ASN 73 2HB ASN 73 34.543 -0.159 -17.037
546 HB3 ASN 73 3HB ASN 73 34.238 0.126 -18.748
547 HD21 ASN 73 1HD2 ASN 73 34.302 -1.640 -19.910
548 HD22 ASN 73 2HD2 ASN 73 35.314 -3.013 -19.634
Start of MODEL 2
1 H1 MET 1 H MET 1 3.179 -1.245 -6.113
2 HA MET 1 HA MET 1 1.531 0.790 -5.956
3 HB2 MET 1 2HB MET 1 0.568 -0.176 -3.803
4 HB3 MET 1 3HB MET 1 0.715 -1.276 -5.167
5 HG2 MET 1 2HG MET 1 2.278 -2.547 -4.154
6 HG3 MET 1 3HG MET 1 3.005 -1.180 -3.314
7 HE1 MET 1 3HE MET 1 0.518 -3.853 -3.554
8 HE2 MET 1 1HE MET 1 1.436 -4.494 -2.190
9 HE3 MET 1 2HE MET 1 -0.245 -4.007 -1.970
10 H GLY 2 H GLY 2 1.353 2.749 -5.061
11 HA2 GLY 2 2HA GLY 2 1.621 4.477 -3.546
12 HA3 GLY 2 3HA GLY 2 2.443 3.356 -2.470
13 H SER 3 H SER 3 4.343 4.224 -1.964
14 HA SER 3 HA SER 3 5.766 6.016 -3.635
15 HB2 SER 3 2HB SER 3 7.118 4.492 -1.436
16 HB3 SER 3 3HB SER 3 7.308 6.182 -1.903
17 HG SER 3 HG SER 3 5.845 6.652 -0.487
18 H TRP 4 H TRP 4 5.914 2.556 -3.124
19 HA TRP 4 HA TRP 4 8.398 2.075 -4.366
20 HB2 TRP 4 2HB TRP 4 7.521 0.322 -3.045
21 HB3 TRP 4 3HB TRP 4 5.973 0.354 -3.885
22 HD1 TRP 4 HD1 TRP 4 5.893 -0.783 -6.344
23 HE1 TRP 4 HE1 TRP 4 7.354 -2.624 -7.394
24 HE3 TRP 4 HE3 TRP 4 9.854 -0.615 -3.117
25 HZ2 TRP 4 HZ2 TRP 4 9.854 -3.844 -6.917
26 HZ3 TRP 4 HZ3 TRP 4 11.740 -2.153 -3.483
27 HH2 TRP 4 HH2 TRP 4 11.738 -3.733 -5.344
28 H ALA 5 H ALA 5 5.095 2.187 -5.628
29 HA ALA 5 HA ALA 5 5.490 1.260 -8.193
30 HB1 ALA 5 1HB ALA 5 3.723 3.614 -7.583
31 HB2 ALA 5 2HB ALA 5 3.497 2.359 -8.801
32 HB3 ALA 5 3HB ALA 5 3.318 1.969 -7.091
33 H GLU 6 H GLU 6 5.814 4.622 -7.056
34 HA GLU 6 HA GLU 6 6.569 5.761 -9.485
35 HB2 GLU 6 2HB GLU 6 7.018 6.502 -6.619
36 HB3 GLU 6 3HB GLU 6 7.824 7.417 -7.885
37 HG2 GLU 6 2HG GLU 6 5.304 7.408 -8.833
38 HG3 GLU 6 3HG GLU 6 4.992 7.357 -7.099
39 H PHE 7 H PHE 7 8.650 4.593 -6.839
40 HA PHE 7 HA PHE 7 11.103 5.078 -8.076
41 HB2 PHE 7 2HB PHE 7 10.146 3.411 -5.833
42 HB3 PHE 7 3HB PHE 7 11.666 2.898 -6.558
43 HD1 PHE 7 HD1 PHE 7 9.985 5.968 -5.277
44 HD2 PHE 7 HD2 PHE 7 13.627 3.826 -5.794
45 HE1 PHE 7 HE1 PHE 7 11.177 7.687 -3.981
46 HE2 PHE 7 HE2 PHE 7 14.824 5.540 -4.498
47 HZ PHE 7 HZ PHE 7 13.599 7.474 -3.589
48 H LYS 8 H LYS 8 8.896 2.359 -8.340
49 HA LYS 8 HA LYS 8 10.644 0.626 -9.741
50 HB2 LYS 8 2HB LYS 8 7.907 0.618 -8.865
51 HB3 LYS 8 3HB LYS 8 7.989 0.074 -10.535
52 HG2 LYS 8 2HG LYS 8 9.506 -1.083 -8.206
53 HG3 LYS 8 3HG LYS 8 8.120 -1.807 -9.024
54 HD2 LYS 8 2HD LYS 8 10.077 -1.170 -10.985
55 HD3 LYS 8 3HD LYS 8 10.878 -2.033 -9.670
56 HE2 LYS 8 2HE LYS 8 8.897 -3.677 -9.848
57 HE3 LYS 8 3HE LYS 8 8.617 -2.934 -11.422
58 HZ1 LYS 8 3HZ LYS 8 11.089 -3.439 -11.805
59 HZ2 LYS 8 1HZ LYS 8 9.985 -4.717 -11.903
60 HZ3 LYS 8 2HZ LYS 8 10.930 -4.520 -10.514
61 H GLN 9 H GLN 9 8.280 3.036 -10.787
62 HA GLN 9 HA GLN 9 8.423 2.473 -13.547
63 HB2 GLN 9 2HB GLN 9 6.813 4.021 -12.073
64 HB3 GLN 9 3HB GLN 9 7.907 5.263 -12.665
65 HG2 GLN 9 2HG GLN 9 7.448 4.446 -14.981
66 HG3 GLN 9 3HG GLN 9 6.206 3.398 -14.297
67 HE21 GLN 9 1HE2 GLN 9 4.853 4.806 -12.582
68 HE22 GLN 9 2HE2 GLN 9 4.180 6.238 -13.276
69 H ARG 10 H ARG 10 9.902 5.152 -11.708
70 HA ARG 10 HA ARG 10 11.467 6.167 -13.770
71 HB2 ARG 10 2HB ARG 10 11.769 6.210 -10.779
72 HB3 ARG 10 3HB ARG 10 12.965 6.966 -11.823
73 HG2 ARG 10 2HG ARG 10 11.571 8.725 -11.300
74 HG3 ARG 10 3HG ARG 10 10.936 8.191 -12.857
75 HD2 ARG 10 2HD ARG 10 9.174 6.956 -11.757
76 HD3 ARG 10 3HD ARG 10 9.848 7.346 -10.175
77 HE ARG 10 HE ARG 10 8.176 9.009 -11.790
78 HH11 ARG 10 1HH1 ARG 10 10.710 9.028 -9.403
79 HH12 ARG 10 2HH1 ARG 10 10.301 10.596 -8.791
80 HH21 ARG 10 1HH2 ARG 10 7.628 11.075 -10.993
81 HH22 ARG 10 2HH2 ARG 10 8.547 11.760 -9.696
82 H LEU 11 H LEU 11 12.237 3.676 -11.369
83 HA LEU 11 HA LEU 11 14.919 3.288 -12.131
84 HB2 LEU 11 2HB LEU 11 14.121 2.472 -10.022
85 HB3 LEU 11 3HB LEU 11 12.934 1.441 -10.818
86 HG LEU 11 HG LEU 11 15.800 0.959 -11.429
87 HD11 LEU 11 1HD1 LEU 11 15.387 -0.665 -9.269
88 HD12 LEU 11 2HD1 LEU 11 14.672 0.857 -8.739
89 HD13 LEU 11 3HD1 LEU 11 16.353 0.811 -9.270
90 HD21 LEU 11 3HD2 LEU 11 14.019 -1.243 -10.711
91 HD22 LEU 11 1HD2 LEU 11 15.034 -1.020 -12.136
92 HD23 LEU 11 2HD2 LEU 11 13.439 -0.269 -12.063
93 H ALA 12 H ALA 12 11.905 1.847 -13.257
94 HA ALA 12 HA ALA 12 13.035 -0.169 -14.868
95 HB1 ALA 12 1HB ALA 12 10.755 -0.394 -14.355
96 HB2 ALA 12 2HB ALA 12 10.379 1.233 -14.923
97 HB3 ALA 12 3HB ALA 12 10.800 -0.029 -16.081
98 H ALA 13 H ALA 13 12.024 3.152 -15.613
99 HA ALA 13 HA ALA 13 12.616 3.046 -18.371
100 HB1 ALA 13 1HB ALA 13 11.435 4.923 -18.160
101 HB2 ALA 13 2HB ALA 13 11.815 5.060 -16.443
102 HB3 ALA 13 3HB ALA 13 12.936 5.694 -17.647
103 H ILE 14 H ILE 14 14.522 4.029 -15.558
104 HA ILE 14 HA ILE 14 16.759 4.985 -16.993
105 HB ILE 14 HB ILE 14 16.616 3.870 -14.190
106 HG12 ILE 14 2HG1 ILE 14 16.877 6.774 -14.852
107 HG13 ILE 14 3HG1 ILE 14 15.295 6.015 -14.995
108 HG21 ILE 14 1HG2 ILE 14 18.857 4.725 -15.806
109 HG22 ILE 14 2HG2 ILE 14 18.702 5.693 -14.341
110 HG23 ILE 14 3HG2 ILE 14 18.840 3.939 -14.228
111 HD11 ILE 14 3HD1 ILE 14 15.120 6.657 -12.851
112 HD12 ILE 14 1HD1 ILE 14 15.994 5.154 -12.555
113 HD13 ILE 14 2HD1 ILE 14 16.866 6.687 -12.603
114 H LYS 15 H LYS 15 15.903 1.803 -15.734
115 HA LYS 15 HA LYS 15 18.395 0.567 -16.287
116 HB2 LYS 15 2HB LYS 15 15.981 -0.170 -15.064
117 HB3 LYS 15 3HB LYS 15 16.169 -1.274 -16.420
118 HG2 LYS 15 2HG LYS 15 18.676 -1.256 -15.304
119 HG3 LYS 15 3HG LYS 15 17.613 -1.144 -13.898
120 HD2 LYS 15 2HD LYS 15 16.318 -3.061 -15.194
121 HD3 LYS 15 3HD LYS 15 17.917 -3.330 -15.891
122 HE2 LYS 15 2HE LYS 15 17.982 -2.955 -13.004
123 HE3 LYS 15 3HE LYS 15 16.997 -4.333 -13.494
124 HZ1 LYS 15 3HZ LYS 15 19.761 -4.211 -13.314
125 HZ2 LYS 15 1HZ LYS 15 19.404 -4.308 -14.965
126 HZ3 LYS 15 2HZ LYS 15 18.823 -5.489 -13.903
127 H THR 16 H THR 16 15.361 0.823 -18.091
128 HA THR 16 HA THR 16 16.064 -0.856 -20.231
129 HB THR 16 HB THR 16 14.261 1.552 -20.465
130 HG1 THR 16 HG1 THR 16 13.145 0.597 -18.936
131 HG21 THR 16 3HG2 THR 16 14.960 -0.621 -22.194
132 HG22 THR 16 1HG2 THR 16 13.886 0.742 -22.506
133 HG23 THR 16 2HG2 THR 16 13.251 -0.732 -21.777
134 H ARG 17 H ARG 17 16.198 2.700 -19.987
135 HA ARG 17 HA ARG 17 17.426 3.100 -22.492
136 HB2 ARG 17 2HB ARG 17 16.850 4.724 -20.101
137 HB3 ARG 17 3HB ARG 17 18.222 5.271 -21.056
138 HG2 ARG 17 2HG ARG 17 16.807 6.291 -22.414
139 HG3 ARG 17 3HG ARG 17 16.179 4.712 -22.891
140 HD2 ARG 17 2HD ARG 17 14.229 5.493 -22.099
141 HD3 ARG 17 3HD ARG 17 14.908 5.097 -20.521
142 HE ARG 17 HE ARG 17 15.753 7.659 -21.100
143 HH11 ARG 17 1HH1 ARG 17 12.714 6.013 -20.681
144 HH12 ARG 17 2HH1 ARG 17 11.888 7.415 -20.087
145 HH21 ARG 17 1HH2 ARG 17 14.676 9.512 -20.320
146 HH22 ARG 17 2HH2 ARG 17 13.004 9.405 -19.883
147 H CYS 18 H CYS 18 18.704 2.428 -19.303
148 HA CYS 18 HA CYS 18 21.409 3.077 -19.885
149 HB2 CYS 18 2HB CYS 18 20.812 3.023 -17.594
150 HB3 CYS 18 3HB CYS 18 20.095 1.422 -17.737
151 HG CYS 18 HG CYS 18 23.448 2.057 -17.995
152 H GLN 19 H GLN 19 19.479 0.151 -20.153
153 HA GLN 19 HA GLN 19 21.679 -1.574 -20.730
154 HB2 GLN 19 2HB GLN 19 18.712 -1.895 -21.200
155 HB3 GLN 19 3HB GLN 19 19.898 -3.166 -21.464
156 HG2 GLN 19 2HG GLN 19 20.120 -1.997 -18.822
157 HG3 GLN 19 3HG GLN 19 18.515 -2.659 -19.132
158 HE21 GLN 19 1HE2 GLN 19 21.791 -3.641 -20.079
159 HE22 GLN 19 2HE2 GLN 19 21.672 -5.250 -19.462
160 H ALA 20 H ALA 20 19.270 0.118 -22.701
161 HA ALA 20 HA ALA 20 20.295 -0.901 -25.178
162 HB1 ALA 20 1HB ALA 20 18.177 -0.340 -25.639
163 HB2 ALA 20 2HB ALA 20 18.101 0.836 -24.326
164 HB3 ALA 20 3HB ALA 20 18.819 1.286 -25.873
165 H LEU 21 H LEU 21 20.933 1.849 -23.156
166 HA LEU 21 HA LEU 21 22.343 3.630 -23.340
167 HB2 LEU 21 2HB LEU 21 23.781 1.532 -24.942
168 HB3 LEU 21 3HB LEU 21 24.483 3.114 -24.608
169 HG LEU 21 HG LEU 21 23.724 1.030 -22.562
170 HD11 LEU 21 1HD1 LEU 21 25.734 0.191 -22.982
171 HD12 LEU 21 2HD1 LEU 21 26.427 1.699 -22.387
172 HD13 LEU 21 3HD1 LEU 21 26.106 1.496 -24.109
173 HD21 LEU 21 3HD2 LEU 21 24.423 3.891 -22.357
174 HD22 LEU 21 1HD2 LEU 21 25.226 2.804 -21.224
175 HD23 LEU 21 2HD2 LEU 21 23.465 2.873 -21.281
176 H GLY 22 H GLY 22 20.174 3.404 -25.314
177 HA2 GLY 22 2HA GLY 22 21.320 4.548 -27.740
178 HA3 GLY 22 3HA GLY 22 19.634 4.123 -27.485
179 H GLY 23 H GLY 23 20.134 5.674 -24.777
180 HA2 GLY 23 2HA GLY 23 18.714 7.962 -25.395
181 HA3 GLY 23 3HA GLY 23 19.770 7.804 -23.999
182 H SER 24 H SER 24 22.088 8.248 -24.356
183 HA SER 24 HA SER 24 23.033 9.566 -26.658
184 HB2 SER 24 2HB SER 24 21.365 11.272 -25.745
185 HB3 SER 24 3HB SER 24 22.476 11.482 -24.392
186 HG SER 24 HG SER 24 22.889 12.999 -26.033
187 H GLU 25 H GLU 25 25.223 10.065 -26.522
188 HA GLU 25 HA GLU 25 26.792 8.590 -24.805
189 HB2 GLU 25 2HB GLU 25 28.636 10.245 -25.451
190 HB3 GLU 25 3HB GLU 25 27.833 9.382 -26.755
191 HG2 GLU 25 2HG GLU 25 27.163 11.270 -27.695
192 HG3 GLU 25 3HG GLU 25 26.478 11.856 -26.180
193 H ALA 26 H ALA 26 25.622 11.889 -24.430
194 HA ALA 26 HA ALA 26 27.101 12.281 -21.969
195 HB1 ALA 26 1HB ALA 26 26.356 14.495 -22.010
196 HB2 ALA 26 2HB ALA 26 26.575 14.082 -23.711
197 HB3 ALA 26 3HB ALA 26 24.957 14.102 -23.010
198 H GLU 27 H GLU 27 23.802 11.600 -22.985
199 HA GLU 27 HA GLU 27 22.406 12.065 -20.653
200 HB2 GLU 27 2HB GLU 27 22.071 10.176 -22.929
201 HB3 GLU 27 3HB GLU 27 21.089 9.907 -21.496
202 HG2 GLU 27 2HG GLU 27 21.211 12.606 -22.775
203 HG3 GLU 27 3HG GLU 27 20.152 11.350 -23.412
204 H CYS 28 H CYS 28 24.490 9.365 -21.475
205 HA CYS 28 HA CYS 28 23.817 7.527 -19.534
206 HB2 CYS 28 2HB CYS 28 26.637 8.174 -20.416
207 HB3 CYS 28 3HB CYS 28 26.067 6.651 -19.746
208 HG CYS 28 HG CYS 28 26.057 7.703 -22.881
209 H ALA 29 H ALA 29 26.019 10.294 -19.251
210 HA ALA 29 HA ALA 29 26.950 9.866 -16.674
211 HB1 ALA 29 1HB ALA 29 26.371 12.500 -18.025
212 HB2 ALA 29 2HB ALA 29 27.375 12.281 -16.591
213 HB3 ALA 29 3HB ALA 29 27.871 11.578 -18.130
214 H ALA 30 H ALA 30 24.160 11.863 -17.656
215 HA ALA 30 HA ALA 30 23.281 12.575 -15.123
216 HB1 ALA 30 1HB ALA 30 21.044 12.112 -16.877
217 HB2 ALA 30 2HB ALA 30 21.709 13.634 -16.282
218 HB3 ALA 30 3HB ALA 30 22.369 12.894 -17.741
219 H PHE 31 H PHE 31 22.714 9.630 -16.960
220 HA PHE 31 HA PHE 31 20.680 8.547 -15.344
221 HB2 PHE 31 2HB PHE 31 22.460 7.598 -17.470
222 HB3 PHE 31 3HB PHE 31 22.024 6.348 -16.310
223 HD1 PHE 31 HD1 PHE 31 19.908 9.196 -17.341
224 HD2 PHE 31 HD2 PHE 31 20.626 5.012 -17.645
225 HE1 PHE 31 HE1 PHE 31 17.741 8.910 -18.471
226 HE2 PHE 31 HE2 PHE 31 18.461 4.719 -18.776
227 HZ PHE 31 HZ PHE 31 17.016 6.669 -19.191
228 H GLU 32 H GLU 32 24.200 8.015 -15.311
229 HA GLU 32 HA GLU 32 24.304 6.220 -13.189
230 HB2 GLU 32 2HB GLU 32 26.171 7.040 -14.791
231 HB3 GLU 32 3HB GLU 32 26.423 8.308 -13.599
232 HG2 GLU 32 2HG GLU 32 26.295 5.647 -12.427
233 HG3 GLU 32 3HG GLU 32 27.601 5.835 -13.596
234 H LYS 33 H LYS 33 24.507 9.765 -13.139
235 HA LYS 33 HA LYS 33 24.894 10.087 -10.391
236 HB2 LYS 33 2HB LYS 33 24.006 11.783 -12.633
237 HB3 LYS 33 3HB LYS 33 23.455 12.306 -11.047
238 HG2 LYS 33 2HG LYS 33 25.497 12.977 -10.420
239 HG3 LYS 33 3HG LYS 33 26.294 11.594 -11.172
240 HD2 LYS 33 2HD LYS 33 26.466 12.641 -13.224
241 HD3 LYS 33 3HD LYS 33 25.118 13.733 -12.895
242 HE2 LYS 33 2HE LYS 33 26.447 15.043 -11.411
243 HE3 LYS 33 3HE LYS 33 27.753 13.860 -11.441
244 HZ1 LYS 33 3HZ LYS 33 28.619 14.900 -13.174
245 HZ2 LYS 33 1HZ LYS 33 27.382 16.054 -13.124
246 HZ3 LYS 33 2HZ LYS 33 27.204 14.664 -14.071
247 H GLU 34 H GLU 34 21.861 10.132 -12.259
248 HA GLU 34 HA GLU 34 20.085 10.572 -10.186
249 HB2 GLU 34 2HB GLU 34 19.916 9.854 -12.898
250 HB3 GLU 34 3HB GLU 34 19.001 8.632 -12.027
251 HG2 GLU 34 2HG GLU 34 18.491 11.419 -11.233
252 HG3 GLU 34 3HG GLU 34 17.976 10.970 -12.858
253 H ILE 35 H ILE 35 21.328 7.466 -11.386
254 HA ILE 35 HA ILE 35 19.894 5.797 -9.663
255 HB ILE 35 HB ILE 35 22.623 5.387 -10.888
256 HG12 ILE 35 2HG1 ILE 35 20.735 5.698 -12.474
257 HG13 ILE 35 3HG1 ILE 35 21.443 4.089 -12.564
258 HG21 ILE 35 1HG2 ILE 35 22.706 3.767 -9.295
259 HG22 ILE 35 2HG2 ILE 35 20.953 3.664 -9.150
260 HG23 ILE 35 3HG2 ILE 35 21.770 2.899 -10.512
261 HD11 ILE 35 3HD1 ILE 35 19.487 3.155 -12.143
262 HD12 ILE 35 1HD1 ILE 35 19.291 4.110 -10.674
263 HD13 ILE 35 2HD1 ILE 35 18.755 4.757 -12.225
264 H ALA 36 H ALA 36 23.088 7.294 -9.272
265 HA ALA 36 HA ALA 36 23.827 6.127 -6.861
266 HB1 ALA 36 1HB ALA 36 25.523 7.653 -6.790
267 HB2 ALA 36 2HB ALA 36 25.060 7.805 -8.485
268 HB3 ALA 36 3HB ALA 36 24.494 8.989 -7.307
269 H ALA 37 H ALA 37 21.993 9.123 -7.416
270 HA ALA 37 HA ALA 37 21.647 9.761 -4.684
271 HB1 ALA 37 1HB ALA 37 19.836 11.258 -5.507
272 HB2 ALA 37 2HB ALA 37 21.376 11.468 -6.342
273 HB3 ALA 37 3HB ALA 37 20.066 10.576 -7.117
274 H PHE 38 H PHE 38 19.800 7.801 -6.943
275 HA PHE 38 HA PHE 38 17.447 7.518 -5.452
276 HB2 PHE 38 2HB PHE 38 18.626 6.317 -7.790
277 HB3 PHE 38 3HB PHE 38 17.888 5.073 -6.785
278 HD1 PHE 38 HD2 PHE 38 17.086 8.510 -8.006
279 HD2 PHE 38 HD1 PHE 38 15.705 4.560 -7.230
280 HE1 PHE 38 HE2 PHE 38 14.872 9.114 -8.893
281 HE2 PHE 38 HE1 PHE 38 13.488 5.157 -8.117
282 HZ PHE 38 HZ PHE 38 13.069 7.437 -8.949
283 H GLU 39 H GLU 39 20.268 5.342 -5.618
284 HA GLU 39 HA GLU 39 19.374 3.575 -3.616
285 HB2 GLU 39 2HB GLU 39 21.749 2.834 -3.521
286 HB3 GLU 39 3HB GLU 39 21.092 2.882 -5.151
287 HG2 GLU 39 2HG GLU 39 22.197 5.048 -5.510
288 HG3 GLU 39 3HG GLU 39 22.897 4.937 -3.896
289 H SER 40 H SER 40 21.380 6.476 -3.491
290 HA SER 40 HA SER 40 22.114 6.244 -0.768
291 HB2 SER 40 2HB SER 40 23.222 7.713 -2.513
292 HB3 SER 40 3HB SER 40 21.866 8.825 -2.322
293 HG SER 40 HG SER 40 23.938 8.211 -0.553
294 H GLU 41 H GLU 41 19.294 7.483 -2.387
295 HA GLU 41 HA GLU 41 18.285 8.862 -0.062
296 HB2 GLU 41 2HB GLU 41 17.264 8.333 -2.827
297 HB3 GLU 41 3HB GLU 41 16.148 8.869 -1.579
298 HG2 GLU 41 2HG GLU 41 17.301 10.908 -1.285
299 HG3 GLU 41 3HG GLU 41 18.675 10.348 -2.237
300 H LEU 42 H LEU 42 17.869 5.750 -1.607
301 HA LEU 42 HA LEU 42 15.589 4.991 -0.040
302 HB2 LEU 42 2HB LEU 42 17.473 3.441 -1.802
303 HB3 LEU 42 3HB LEU 42 16.117 2.700 -0.955
304 HG LEU 42 HG LEU 42 15.500 5.019 -2.692
305 HD11 LEU 42 1HD1 LEU 42 15.335 2.933 -4.458
306 HD12 LEU 42 2HD1 LEU 42 16.876 2.633 -3.654
307 HD13 LEU 42 3HD1 LEU 42 16.584 4.178 -4.454
308 HD21 LEU 42 3HD2 LEU 42 14.211 2.569 -1.665
309 HD22 LEU 42 1HD2 LEU 42 13.727 3.094 -3.277
310 HD23 LEU 42 2HD2 LEU 42 13.552 4.187 -1.904
311 H GLN 43 H GLN 43 19.055 4.690 0.238
312 HA GLN 43 HA GLN 43 19.009 2.726 2.318
313 HB2 GLN 43 2HB GLN 43 21.346 2.970 2.410
314 HB3 GLN 43 3HB GLN 43 20.937 3.236 0.720
315 HG2 GLN 43 2HG GLN 43 22.148 5.088 0.858
316 HG3 GLN 43 3HG GLN 43 20.821 5.764 1.801
317 HE21 GLN 43 1HE2 GLN 43 23.669 3.691 2.237
318 HE22 GLN 43 2HE2 GLN 43 24.155 4.386 3.742
319 H ALA 44 H ALA 44 18.573 6.121 2.185
320 HA ALA 44 HA ALA 44 19.341 6.645 4.911
321 HB1 ALA 44 1HB ALA 44 19.251 8.253 2.825
322 HB2 ALA 44 2HB ALA 44 17.602 8.521 3.394
323 HB3 ALA 44 3HB ALA 44 18.968 8.854 4.459
324 H TYR 45 H TYR 45 16.549 5.484 3.313
325 HA TYR 45 HA TYR 45 14.448 6.403 4.839
326 HB2 TYR 45 2HB TYR 45 14.975 3.876 3.350
327 HB3 TYR 45 3HB TYR 45 13.584 3.919 4.429
328 HD1 TYR 45 HD1 TYR 45 14.934 6.701 2.370
329 HD2 TYR 45 HD2 TYR 45 11.786 3.892 2.921
330 HE1 TYR 45 HE1 TYR 45 13.623 7.836 0.625
331 HE2 TYR 45 HE2 TYR 45 10.467 5.019 1.178
332 HH TYR 45 HH TYR 45 10.688 7.812 0.222
333 H LYS 46 H LYS 46 16.468 3.542 5.477
334 HA LYS 46 HA LYS 46 16.887 2.361 7.376
335 HB2 LYS 46 2HB LYS 46 16.173 5.011 8.643
336 HB3 LYS 46 3HB LYS 46 16.868 3.653 9.519
337 HG2 LYS 46 2HG LYS 46 18.715 3.823 7.654
338 HG3 LYS 46 3HG LYS 46 18.123 5.482 7.542
339 HD2 LYS 46 2HD LYS 46 19.278 6.034 9.359
340 HD3 LYS 46 3HD LYS 46 18.424 4.805 10.295
341 HE2 LYS 46 2HE LYS 46 20.528 3.995 10.541
342 HE3 LYS 46 3HE LYS 46 20.142 3.223 9.004
343 HZ1 LYS 46 3HZ LYS 46 22.308 4.740 9.434
344 HZ2 LYS 46 1HZ LYS 46 21.248 5.884 8.778
345 HZ3 LYS 46 2HZ LYS 46 21.618 4.480 7.911
346 H GLY 47 H GLY 47 14.339 2.024 6.260
347 HA2 GLY 47 2HA GLY 47 12.347 2.139 8.338
348 HA3 GLY 47 3HA GLY 47 12.164 1.399 6.755
349 H LYS 48 H LYS 48 14.193 0.842 9.637
350 HA LYS 48 HA LYS 48 14.697 -1.053 10.790
351 HB2 LYS 48 2HB LYS 48 11.922 -1.756 9.834
352 HB3 LYS 48 3HB LYS 48 12.840 -2.774 10.936
353 HG2 LYS 48 2HG LYS 48 12.947 -0.921 12.539
354 HG3 LYS 48 3HG LYS 48 11.986 0.070 11.439
355 HD2 LYS 48 2HD LYS 48 10.264 -0.716 12.671
356 HD3 LYS 48 3HD LYS 48 10.416 -2.116 11.606
357 HE2 LYS 48 2HE LYS 48 10.718 -3.356 13.428
358 HE3 LYS 48 3HE LYS 48 12.274 -2.554 13.632
359 HZ1 LYS 48 3HZ LYS 48 9.866 -2.276 15.163
360 HZ2 LYS 48 1HZ LYS 48 10.504 -0.785 14.683
361 HZ3 LYS 48 2HZ LYS 48 11.456 -1.866 15.569
362 H GLY 49 H GLY 49 15.585 -0.852 8.060
363 HA2 GLY 49 2HA GLY 49 16.559 -2.134 6.422
364 HA3 GLY 49 3HA GLY 49 16.698 -3.362 7.671
365 H ASN 50 H ASN 50 13.826 -1.977 6.101
366 HA ASN 50 HA ASN 50 12.575 -4.508 5.843
367 HB2 ASN 50 2HB ASN 50 11.949 -1.719 5.157
368 HB3 ASN 50 3HB ASN 50 11.239 -2.905 4.065
369 HD21 ASN 50 1HD2 ASN 50 11.893 -3.088 7.534
370 HD22 ASN 50 2HD2 ASN 50 10.252 -3.351 8.007
371 HA PRO 51 HA PRO 51 14.037 -6.050 2.005
372 HB2 PRO 51 2HB PRO 51 11.784 -7.076 0.890
373 HB3 PRO 51 3HB PRO 51 12.595 -7.819 2.274
374 HG2 PRO 51 2HG PRO 51 10.190 -6.036 2.220
375 HG3 PRO 51 3HG PRO 51 10.470 -7.509 3.167
376 HD2 PRO 51 2HD PRO 51 10.742 -5.028 4.218
377 HD3 PRO 51 3HD PRO 51 11.731 -6.403 4.749
378 H GLU 52 H GLU 52 11.413 -3.755 1.964
379 HA GLU 52 HA GLU 52 11.108 -3.340 -0.771
380 HB2 GLU 52 2HB GLU 52 10.436 -0.985 -0.080
381 HB3 GLU 52 3HB GLU 52 9.540 -2.306 0.658
382 HG2 GLU 52 2HG GLU 52 10.252 -1.809 2.719
383 HG3 GLU 52 3HG GLU 52 11.888 -1.439 2.176
384 H VAL 53 H VAL 53 13.543 -2.141 1.456
385 HA VAL 53 HA VAL 53 14.727 -0.395 -0.530
386 HB VAL 53 HB VAL 53 15.857 -1.159 2.163
387 HG11 VAL 53 1HG1 VAL 53 17.520 -0.152 0.796
388 HG12 VAL 53 2HG1 VAL 53 16.404 1.099 0.248
389 HG13 VAL 53 3HG1 VAL 53 16.962 1.085 1.921
390 HG21 VAL 53 3HG2 VAL 53 14.867 1.091 2.845
391 HG22 VAL 53 1HG2 VAL 53 13.864 0.956 1.401
392 HG23 VAL 53 2HG2 VAL 53 13.747 -0.260 2.673
393 H GLU 54 H GLU 54 15.043 -3.650 0.515
394 HA GLU 54 HA GLU 54 17.750 -4.097 -0.179
395 HB2 GLU 54 2HB GLU 54 15.420 -6.017 -0.047
396 HB3 GLU 54 3HB GLU 54 17.102 -6.499 -0.219
397 HG2 GLU 54 2HG GLU 54 16.040 -4.907 2.100
398 HG3 GLU 54 3HG GLU 54 16.200 -6.662 2.094
399 H ALA 55 H ALA 55 14.721 -4.678 -1.951
400 HA ALA 55 HA ALA 55 15.937 -5.651 -4.304
401 HB1 ALA 55 1HB ALA 55 13.232 -4.479 -3.734
402 HB2 ALA 55 2HB ALA 55 13.705 -5.001 -5.351
403 HB3 ALA 55 3HB ALA 55 13.666 -6.164 -4.026
404 H LEU 56 H LEU 56 14.752 -2.415 -3.426
405 HA LEU 56 HA LEU 56 15.358 -1.158 -5.860
406 HB2 LEU 56 2HB LEU 56 15.076 -0.135 -3.051
407 HB3 LEU 56 3HB LEU 56 15.441 0.938 -4.402
408 HG LEU 56 HG LEU 56 13.058 -0.820 -4.644
409 HD11 LEU 56 1HD1 LEU 56 12.227 1.602 -3.434
410 HD12 LEU 56 2HD1 LEU 56 13.437 0.861 -2.387
411 HD13 LEU 56 3HD1 LEU 56 12.002 -0.050 -2.857
412 HD21 LEU 56 3HD2 LEU 56 12.917 2.038 -5.256
413 HD22 LEU 56 1HD2 LEU 56 12.475 0.641 -6.238
414 HD23 LEU 56 2HD2 LEU 56 14.157 1.165 -6.158
415 H ARG 57 H ARG 57 17.282 -1.659 -2.940
416 HA ARG 57 HA ARG 57 19.488 -0.076 -3.720
417 HB2 ARG 57 2HB ARG 57 19.060 -2.256 -1.713
418 HB3 ARG 57 3HB ARG 57 20.696 -1.711 -2.059
419 HG2 ARG 57 2HG ARG 57 18.439 0.060 -1.143
420 HG3 ARG 57 3HG ARG 57 19.712 -0.591 -0.109
421 HD2 ARG 57 2HD ARG 57 20.003 1.348 -2.394
422 HD3 ARG 57 3HD ARG 57 20.317 1.643 -0.684
423 HE ARG 57 HE ARG 57 22.077 0.392 -2.579
424 HH11 ARG 57 1HH1 ARG 57 21.243 0.690 0.788
425 HH12 ARG 57 2HH1 ARG 57 22.818 0.239 1.353
426 HH21 ARG 57 1HH2 ARG 57 24.154 -0.204 -1.848
427 HH22 ARG 57 2HH2 ARG 57 24.473 -0.268 -0.148
428 H LYS 58 H LYS 58 18.762 -3.520 -4.100
429 HA LYS 58 HA LYS 58 21.224 -4.289 -5.217
430 HB2 LYS 58 2HB LYS 58 19.075 -5.655 -4.406
431 HB3 LYS 58 3HB LYS 58 18.736 -5.641 -6.131
432 HG2 LYS 58 2HG LYS 58 19.921 -7.576 -5.978
433 HG3 LYS 58 3HG LYS 58 21.239 -6.444 -6.287
434 HD2 LYS 58 2HD LYS 58 21.725 -6.323 -3.911
435 HD3 LYS 58 3HD LYS 58 20.358 -7.381 -3.556
436 HE2 LYS 58 2HE LYS 58 21.975 -8.674 -5.492
437 HE3 LYS 58 3HE LYS 58 23.038 -8.084 -4.215
438 HZ1 LYS 58 3HZ LYS 58 20.822 -9.200 -2.972
439 HZ2 LYS 58 1HZ LYS 58 22.403 -9.801 -2.997
440 HZ3 LYS 58 2HZ LYS 58 21.292 -10.295 -4.172
441 H GLU 59 H GLU 59 18.128 -3.662 -6.883
442 HA GLU 59 HA GLU 59 19.068 -3.816 -9.485
443 HB2 GLU 59 2HB GLU 59 16.878 -2.025 -8.418
444 HB3 GLU 59 3HB GLU 59 17.116 -2.448 -10.108
445 HG2 GLU 59 2HG GLU 59 16.948 -4.794 -8.421
446 HG3 GLU 59 3HG GLU 59 15.521 -3.769 -8.280
447 H ALA 60 H ALA 60 18.682 -0.887 -7.491
448 HA ALA 60 HA ALA 60 19.644 0.994 -9.258
449 HB1 ALA 60 1HB ALA 60 18.648 1.488 -7.049
450 HB2 ALA 60 2HB ALA 60 20.154 0.975 -6.287
451 HB3 ALA 60 3HB ALA 60 20.139 2.381 -7.351
452 H ALA 61 H ALA 61 21.540 -0.859 -6.877
453 HA ALA 61 HA ALA 61 24.048 0.172 -7.459
454 HB1 ALA 61 1HB ALA 61 23.339 -2.628 -6.593
455 HB2 ALA 61 2HB ALA 61 24.950 -1.913 -6.520
456 HB3 ALA 61 3HB ALA 61 23.645 -1.249 -5.536
457 H ALA 62 H ALA 62 22.357 -2.563 -8.957
458 HA ALA 62 HA ALA 62 24.403 -3.420 -10.652
459 HB1 ALA 62 1HB ALA 62 22.795 -4.968 -10.805
460 HB2 ALA 62 2HB ALA 62 21.513 -3.808 -10.451
461 HB3 ALA 62 3HB ALA 62 22.143 -3.952 -12.092
462 H ILE 63 H ILE 63 21.796 -1.075 -11.244
463 HA ILE 63 HA ILE 63 22.430 -0.486 -13.904
464 HB ILE 63 HB ILE 63 21.231 1.389 -11.862
465 HG12 ILE 63 2HG1 ILE 63 19.777 -0.381 -13.830
466 HG13 ILE 63 3HG1 ILE 63 20.089 -0.858 -12.164
467 HG21 ILE 63 1HG2 ILE 63 20.186 2.431 -13.868
468 HG22 ILE 63 2HG2 ILE 63 21.939 2.602 -13.801
469 HG23 ILE 63 3HG2 ILE 63 21.210 1.408 -14.874
470 HD11 ILE 63 3HD1 ILE 63 17.923 -0.026 -12.126
471 HD12 ILE 63 1HD1 ILE 63 18.898 1.314 -11.526
472 HD13 ILE 63 2HD1 ILE 63 18.319 1.322 -13.192
473 H ARG 64 H ARG 64 23.541 1.009 -10.887
474 HA ARG 64 HA ARG 64 25.030 3.092 -12.008
475 HB2 ARG 64 2HB ARG 64 24.578 3.132 -9.666
476 HB3 ARG 64 3HB ARG 64 25.348 1.570 -9.424
477 HG2 ARG 64 2HG ARG 64 27.175 3.484 -10.588
478 HG3 ARG 64 3HG ARG 64 26.495 4.064 -9.066
479 HD2 ARG 64 2HD ARG 64 27.624 1.296 -9.354
480 HD3 ARG 64 3HD ARG 64 28.642 2.680 -8.957
481 HE ARG 64 HE ARG 64 26.812 1.327 -7.216
482 HH11 ARG 64 1HH1 ARG 64 28.391 4.359 -7.876
483 HH12 ARG 64 2HH1 ARG 64 28.283 4.921 -6.241
484 HH21 ARG 64 1HH2 ARG 64 26.663 2.056 -5.060
485 HH22 ARG 64 2HH2 ARG 64 27.301 3.610 -4.640
486 H ASP 65 H ASP 65 26.022 -0.198 -11.107
487 HA ASP 65 HA ASP 65 28.728 0.030 -11.772
488 HB2 ASP 65 2HB ASP 65 26.996 -2.442 -11.985
489 HB3 ASP 65 3HB ASP 65 28.752 -2.405 -11.853
490 H GLU 66 H GLU 66 25.951 -0.947 -13.746
491 HA GLU 66 HA GLU 66 27.359 -1.635 -16.066
492 HB2 GLU 66 2HB GLU 66 24.597 -0.418 -15.941
493 HB3 GLU 66 3HB GLU 66 25.255 -1.409 -17.235
494 HG2 GLU 66 2HG GLU 66 25.418 -2.794 -14.722
495 HG3 GLU 66 3HG GLU 66 23.770 -2.255 -15.034
496 H CYS 67 H CYS 67 25.902 1.460 -15.103
497 HA CYS 67 HA CYS 67 26.524 2.911 -17.400
498 HB2 CYS 67 2HB CYS 67 26.239 3.804 -14.528
499 HB3 CYS 67 3HB CYS 67 26.408 4.921 -15.877
500 HG CYS 67 HG CYS 67 23.924 4.986 -16.509
501 H GLN 68 H GLN 68 28.418 2.370 -14.459
502 HA GLN 68 HA GLN 68 30.580 4.049 -15.202
503 HB2 GLN 68 2HB GLN 68 30.425 1.750 -13.249
504 HB3 GLN 68 3HB GLN 68 31.823 2.802 -13.420
505 HG2 GLN 68 2HG GLN 68 30.315 4.731 -12.881
506 HG3 GLN 68 3HG GLN 68 29.067 3.549 -12.486
507 HE21 GLN 68 1HE2 GLN 68 29.289 4.784 -10.410
508 HE22 GLN 68 2HE2 GLN 68 30.425 4.182 -9.257
509 H ALA 69 H ALA 69 29.766 0.723 -15.860
510 HA ALA 69 HA ALA 69 32.379 0.028 -16.852
511 HB1 ALA 69 1HB ALA 69 29.734 -1.408 -17.031
512 HB2 ALA 69 2HB ALA 69 31.279 -2.070 -17.569
513 HB3 ALA 69 3HB ALA 69 31.024 -1.701 -15.863
514 H TYR 70 H TYR 70 29.856 1.841 -18.061
515 HA TYR 70 HA TYR 70 30.373 1.108 -20.850
516 HB2 TYR 70 2HB TYR 70 28.273 2.923 -19.647
517 HB3 TYR 70 3HB TYR 70 28.429 2.557 -21.361
518 HD1 TYR 70 HD1 TYR 70 29.160 -0.418 -20.909
519 HD2 TYR 70 HD2 TYR 70 26.044 2.065 -19.416
520 HE1 TYR 70 HE1 TYR 70 27.729 -2.398 -20.619
521 HE2 TYR 70 HE2 TYR 70 24.605 0.093 -19.121
522 HH TYR 70 HH TYR 70 24.359 -2.100 -19.636
523 H ARG 71 H ARG 71 30.597 3.808 -18.600
524 HA ARG 71 HA ARG 71 32.394 5.150 -20.494
525 HB2 ARG 71 2HB ARG 71 29.985 6.111 -20.398
526 HB3 ARG 71 3HB ARG 71 30.466 6.740 -18.828
527 HG2 ARG 71 2HG ARG 71 32.503 7.399 -20.683
528 HG3 ARG 71 3HG ARG 71 30.948 7.827 -21.400
529 HD2 ARG 71 2HD ARG 71 30.378 9.191 -19.527
530 HD3 ARG 71 3HD ARG 71 31.766 8.608 -18.610
531 HE ARG 71 HE ARG 71 32.917 9.730 -20.770
532 HH11 ARG 71 1HH1 ARG 71 30.518 10.865 -18.518
533 HH12 ARG 71 2HH1 ARG 71 30.980 12.528 -18.663
534 HH21 ARG 71 1HH2 ARG 71 33.535 11.916 -20.970
535 HH22 ARG 71 2HH2 ARG 71 32.696 13.125 -20.059
536 H HIS 72 H HIS 72 33.270 3.575 -18.430
537 HA HIS 72 HA HIS 72 35.017 5.267 -17.052
538 HB2 HIS 72 2HB HIS 72 32.515 5.337 -15.882
539 HB3 HIS 72 3HB HIS 72 33.371 4.140 -14.914
540 HD1 HIS 72 HD1 HIS 72 34.175 7.616 -16.265
541 HD2 HIS 72 HD2 HIS 72 34.629 5.308 -12.840
542 HE1 HIS 72 HE1 HIS 72 35.329 9.105 -14.598
543 H ASN 73 H ASN 73 35.004 2.794 -18.511
544 HA ASN 73 HA ASN 73 36.420 1.142 -16.560
545 HB2 ASN 73 2HB ASN 73 34.355 0.011 -16.535
546 HB3 ASN 73 3HB ASN 73 34.110 0.237 -18.264
547 HD21 ASN 73 1HD2 ASN 73 34.893 -1.236 -19.666
548 HD22 ASN 73 2HD2 ASN 73 35.740 -2.667 -19.198
Start of MODEL 3
1 H1 MET 1 H MET 1 1.123 1.069 0.410
2 HA MET 1 HA MET 1 2.656 -0.087 -1.825
3 HB2 MET 1 2HB MET 1 0.348 0.390 -2.508
4 HB3 MET 1 3HB MET 1 0.528 2.056 -1.974
5 HG2 MET 1 2HG MET 1 2.623 1.797 -3.692
6 HG3 MET 1 3HG MET 1 1.411 0.760 -4.439
7 HE1 MET 1 3HE MET 1 -1.434 2.893 -5.399
8 HE2 MET 1 1HE MET 1 -0.953 1.381 -4.630
9 HE3 MET 1 2HE MET 1 -1.483 2.742 -3.642
10 H GLY 2 H GLY 2 1.703 3.162 -0.686
11 HA2 GLY 2 2HA GLY 2 2.993 4.986 -0.122
12 HA3 GLY 2 3HA GLY 2 4.380 3.911 -0.043
13 H SER 3 H SER 3 5.915 4.867 -1.223
14 HA SER 3 HA SER 3 5.188 5.826 -3.913
15 HB2 SER 3 2HB SER 3 6.386 7.263 -1.915
16 HB3 SER 3 3HB SER 3 7.783 6.690 -2.826
17 HG SER 3 HG SER 3 7.321 8.309 -4.087
18 H TRP 4 H TRP 4 5.845 3.075 -3.133
19 HA TRP 4 HA TRP 4 8.506 2.521 -4.036
20 HB2 TRP 4 2HB TRP 4 7.520 0.989 -2.478
21 HB3 TRP 4 3HB TRP 4 6.117 0.749 -3.515
22 HD1 TRP 4 HD1 TRP 4 6.551 -0.689 -5.811
23 HE1 TRP 4 HE1 TRP 4 8.239 -2.574 -6.283
24 HE3 TRP 4 HE3 TRP 4 9.794 0.142 -1.948
25 HZ2 TRP 4 HZ2 TRP 4 10.629 -3.576 -5.164
26 HZ3 TRP 4 HZ3 TRP 4 11.756 -1.325 -1.719
27 HH2 TRP 4 HH2 TRP 4 12.163 -3.145 -3.295
28 H ALA 5 H ALA 5 5.265 2.182 -5.445
29 HA ALA 5 HA ALA 5 5.899 0.969 -7.839
30 HB1 ALA 5 1HB ALA 5 3.857 3.165 -7.573
31 HB2 ALA 5 2HB ALA 5 3.849 1.805 -8.697
32 HB3 ALA 5 3HB ALA 5 3.606 1.525 -6.973
33 H GLU 6 H GLU 6 5.836 4.461 -7.142
34 HA GLU 6 HA GLU 6 6.568 5.377 -9.664
35 HB2 GLU 6 2HB GLU 6 6.569 6.452 -6.931
36 HB3 GLU 6 3HB GLU 6 7.765 7.186 -7.989
37 HG2 GLU 6 2HG GLU 6 6.064 7.819 -9.562
38 HG3 GLU 6 3HG GLU 6 4.837 6.956 -8.637
39 H PHE 7 H PHE 7 8.646 4.576 -6.891
40 HA PHE 7 HA PHE 7 11.098 5.196 -8.066
41 HB2 PHE 7 2HB PHE 7 10.172 3.719 -5.728
42 HB3 PHE 7 3HB PHE 7 11.647 3.040 -6.409
43 HD1 PHE 7 HD1 PHE 7 10.130 6.098 -5.011
44 HD2 PHE 7 HD2 PHE 7 13.724 4.134 -6.168
45 HE1 PHE 7 HE1 PHE 7 11.444 7.854 -3.897
46 HE2 PHE 7 HE2 PHE 7 15.044 5.886 -5.055
47 HZ PHE 7 HZ PHE 7 13.905 7.749 -3.917
48 H LYS 8 H LYS 8 9.254 2.174 -8.084
49 HA LYS 8 HA LYS 8 11.154 0.588 -9.409
50 HB2 LYS 8 2HB LYS 8 8.935 -0.073 -8.227
51 HB3 LYS 8 3HB LYS 8 8.198 0.225 -9.796
52 HG2 LYS 8 2HG LYS 8 8.695 -1.869 -10.319
53 HG3 LYS 8 3HG LYS 8 10.392 -1.384 -10.354
54 HD2 LYS 8 2HD LYS 8 10.031 -1.747 -7.698
55 HD3 LYS 8 3HD LYS 8 8.902 -2.940 -8.343
56 HE2 LYS 8 2HE LYS 8 10.552 -4.237 -9.193
57 HE3 LYS 8 3HE LYS 8 11.571 -2.858 -9.602
58 HZ1 LYS 8 3HZ LYS 8 11.506 -4.454 -7.192
59 HZ2 LYS 8 1HZ LYS 8 11.614 -2.786 -6.927
60 HZ3 LYS 8 2HZ LYS 8 12.778 -3.569 -7.872
61 H GLN 9 H GLN 9 8.538 2.627 -10.650
62 HA GLN 9 HA GLN 9 8.769 1.932 -13.355
63 HB2 GLN 9 2HB GLN 9 7.249 3.733 -11.826
64 HB3 GLN 9 3HB GLN 9 8.070 4.713 -13.033
65 HG2 GLN 9 2HG GLN 9 7.214 3.108 -14.765
66 HG3 GLN 9 3HG GLN 9 6.220 2.393 -13.496
67 HE21 GLN 9 1HE2 GLN 9 4.333 2.963 -14.599
68 HE22 GLN 9 2HE2 GLN 9 3.755 4.590 -14.632
69 H ARG 10 H ARG 10 10.095 4.786 -11.672
70 HA ARG 10 HA ARG 10 11.557 5.837 -13.772
71 HB2 ARG 10 2HB ARG 10 11.967 5.907 -10.794
72 HB3 ARG 10 3HB ARG 10 13.091 6.709 -11.883
73 HG2 ARG 10 2HG ARG 10 11.762 8.477 -11.853
74 HG3 ARG 10 3HG ARG 10 10.546 7.522 -12.703
75 HD2 ARG 10 2HD ARG 10 9.305 7.197 -10.840
76 HD3 ARG 10 3HD ARG 10 10.718 7.100 -9.789
77 HE ARG 10 HE ARG 10 10.532 9.348 -9.386
78 HH11 ARG 10 1HH1 ARG 10 8.583 8.511 -12.148
79 HH12 ARG 10 2HH1 ARG 10 7.827 10.066 -12.249
80 HH21 ARG 10 1HH2 ARG 10 9.543 11.400 -9.510
81 HH22 ARG 10 2HH2 ARG 10 8.374 11.709 -10.749
82 H LEU 11 H LEU 11 12.563 3.430 -11.365
83 HA LEU 11 HA LEU 11 15.218 3.151 -12.215
84 HB2 LEU 11 2HB LEU 11 13.602 2.036 -10.263
85 HB3 LEU 11 3HB LEU 11 14.035 0.667 -11.285
86 HG LEU 11 HG LEU 11 16.398 1.109 -10.910
87 HD11 LEU 11 1HD1 LEU 11 16.988 3.207 -10.458
88 HD12 LEU 11 2HD1 LEU 11 16.510 2.873 -8.794
89 HD13 LEU 11 3HD1 LEU 11 15.367 3.630 -9.904
90 HD21 LEU 11 3HD2 LEU 11 16.180 0.981 -8.238
91 HD22 LEU 11 1HD2 LEU 11 15.834 -0.379 -9.306
92 HD23 LEU 11 2HD2 LEU 11 14.514 0.617 -8.691
93 H ALA 12 H ALA 12 12.260 1.516 -13.247
94 HA ALA 12 HA ALA 12 13.436 -0.408 -14.915
95 HB1 ALA 12 1HB ALA 12 11.301 -1.022 -14.904
96 HB2 ALA 12 2HB ALA 12 10.783 0.577 -14.369
97 HB3 ALA 12 3HB ALA 12 10.995 0.248 -16.089
98 H ALA 13 H ALA 13 12.243 2.860 -15.637
99 HA ALA 13 HA ALA 13 12.793 2.802 -18.399
100 HB1 ALA 13 1HB ALA 13 12.639 5.264 -18.270
101 HB2 ALA 13 2HB ALA 13 11.297 4.450 -17.464
102 HB3 ALA 13 3HB ALA 13 12.607 5.146 -16.511
103 H ILE 14 H ILE 14 14.721 3.862 -15.625
104 HA ILE 14 HA ILE 14 16.887 4.909 -17.095
105 HB ILE 14 HB ILE 14 16.856 3.745 -14.308
106 HG12 ILE 14 2HG1 ILE 14 16.970 6.666 -14.954
107 HG13 ILE 14 3HG1 ILE 14 15.421 5.833 -15.019
108 HG21 ILE 14 1HG2 ILE 14 19.035 4.593 -15.951
109 HG22 ILE 14 2HG2 ILE 14 18.863 5.700 -14.590
110 HG23 ILE 14 3HG2 ILE 14 19.063 3.972 -14.301
111 HD11 ILE 14 3HD1 ILE 14 17.163 6.425 -12.685
112 HD12 ILE 14 1HD1 ILE 14 15.420 6.612 -12.872
113 HD13 ILE 14 2HD1 ILE 14 16.115 5.008 -12.638
114 H LYS 15 H LYS 15 16.187 1.676 -15.868
115 HA LYS 15 HA LYS 15 18.708 0.543 -16.491
116 HB2 LYS 15 2HB LYS 15 16.348 -0.306 -15.245
117 HB3 LYS 15 3HB LYS 15 16.539 -1.368 -16.634
118 HG2 LYS 15 2HG LYS 15 19.074 -1.228 -15.501
119 HG3 LYS 15 3HG LYS 15 17.967 -1.335 -14.130
120 HD2 LYS 15 2HD LYS 15 17.861 -3.184 -16.508
121 HD3 LYS 15 3HD LYS 15 18.767 -3.539 -15.035
122 HE2 LYS 15 2HE LYS 15 16.917 -4.324 -14.093
123 HE3 LYS 15 3HE LYS 15 16.159 -2.743 -14.270
124 HZ1 LYS 15 3HZ LYS 15 15.734 -5.154 -15.774
125 HZ2 LYS 15 1HZ LYS 15 15.972 -3.796 -16.756
126 HZ3 LYS 15 2HZ LYS 15 14.737 -3.799 -15.600
127 H THR 16 H THR 16 15.636 0.710 -18.244
128 HA THR 16 HA THR 16 16.359 -0.894 -20.428
129 HB THR 16 HB THR 16 14.515 1.474 -20.677
130 HG1 THR 16 HG1 THR 16 14.024 -1.032 -19.412
131 HG21 THR 16 3HG2 THR 16 13.788 -1.151 -21.773
132 HG22 THR 16 1HG2 THR 16 15.241 -0.442 -22.477
133 HG23 THR 16 2HG2 THR 16 13.718 0.447 -22.516
134 H ARG 17 H ARG 17 16.373 2.664 -20.149
135 HA ARG 17 HA ARG 17 17.575 3.135 -22.650
136 HB2 ARG 17 2HB ARG 17 16.992 4.709 -20.222
137 HB3 ARG 17 3HB ARG 17 18.318 5.312 -21.207
138 HG2 ARG 17 2HG ARG 17 16.663 6.413 -22.256
139 HG3 ARG 17 3HG ARG 17 16.491 4.886 -23.125
140 HD2 ARG 17 2HD ARG 17 14.825 4.205 -21.361
141 HD3 ARG 17 3HD ARG 17 14.884 5.867 -20.776
142 HE ARG 17 HE ARG 17 13.559 4.906 -23.139
143 HH11 ARG 17 1HH1 ARG 17 14.989 7.670 -21.579
144 HH12 ARG 17 2HH1 ARG 17 14.072 8.823 -22.491
145 HH21 ARG 17 1HH2 ARG 17 12.346 6.414 -24.346
146 HH22 ARG 17 2HH2 ARG 17 12.568 8.107 -24.064
147 H CYS 18 H CYS 18 18.905 2.473 -19.477
148 HA CYS 18 HA CYS 18 21.582 3.205 -20.075
149 HB2 CYS 18 2HB CYS 18 21.024 3.097 -17.781
150 HB3 CYS 18 3HB CYS 18 20.330 1.489 -17.941
151 HG CYS 18 HG CYS 18 22.429 0.409 -16.938
152 H GLN 19 H GLN 19 19.744 0.222 -20.366
153 HA GLN 19 HA GLN 19 21.984 -1.429 -20.986
154 HB2 GLN 19 2HB GLN 19 19.026 -1.817 -21.464
155 HB3 GLN 19 3HB GLN 19 20.244 -3.052 -21.752
156 HG2 GLN 19 2HG GLN 19 20.471 -1.954 -19.093
157 HG3 GLN 19 3HG GLN 19 18.854 -2.585 -19.398
158 HE21 GLN 19 1HE2 GLN 19 22.040 -3.337 -18.607
159 HE22 GLN 19 2HE2 GLN 19 21.928 -5.057 -18.721
160 H ALA 20 H ALA 20 19.534 0.239 -22.927
161 HA ALA 20 HA ALA 20 20.574 -0.710 -25.423
162 HB1 ALA 20 1HB ALA 20 18.376 -0.207 -25.700
163 HB2 ALA 20 2HB ALA 20 18.427 1.148 -24.572
164 HB3 ALA 20 3HB ALA 20 19.068 1.336 -26.204
165 H LEU 21 H LEU 21 21.169 2.016 -23.353
166 HA LEU 21 HA LEU 21 22.552 3.821 -23.505
167 HB2 LEU 21 2HB LEU 21 24.026 1.774 -25.140
168 HB3 LEU 21 3HB LEU 21 24.703 3.359 -24.770
169 HG LEU 21 HG LEU 21 23.974 1.213 -22.779
170 HD11 LEU 21 1HD1 LEU 21 26.393 1.864 -24.249
171 HD12 LEU 21 2HD1 LEU 21 25.993 0.432 -23.301
172 HD13 LEU 21 3HD1 LEU 21 26.635 1.866 -22.501
173 HD21 LEU 21 3HD2 LEU 21 24.723 4.077 -22.483
174 HD22 LEU 21 1HD2 LEU 21 25.344 2.916 -21.310
175 HD23 LEU 21 2HD2 LEU 21 23.604 3.097 -21.536
176 H GLY 22 H GLY 22 20.391 3.586 -25.493
177 HA2 GLY 22 2HA GLY 22 21.559 4.873 -27.852
178 HA3 GLY 22 3HA GLY 22 19.912 4.277 -27.708
179 H GLY 23 H GLY 23 20.182 5.770 -24.912
180 HA2 GLY 23 2HA GLY 23 18.552 7.929 -25.518
181 HA3 GLY 23 3HA GLY 23 19.552 7.815 -24.077
182 H SER 24 H SER 24 21.940 8.317 -24.492
183 HA SER 24 HA SER 24 22.773 9.897 -26.640
184 HB2 SER 24 2HB SER 24 21.140 11.299 -24.690
185 HB3 SER 24 3HB SER 24 22.752 12.003 -24.806
186 HG SER 24 HG SER 24 22.284 12.726 -26.725
187 H GLU 25 H GLU 25 24.934 10.337 -26.514
188 HA GLU 25 HA GLU 25 26.547 8.933 -24.786
189 HB2 GLU 25 2HB GLU 25 28.378 10.479 -25.493
190 HB3 GLU 25 3HB GLU 25 27.445 9.814 -26.827
191 HG2 GLU 25 2HG GLU 25 27.186 11.880 -27.570
192 HG3 GLU 25 3HG GLU 25 26.153 12.187 -26.175
193 H ALA 26 H ALA 26 25.243 12.174 -24.414
194 HA ALA 26 HA ALA 26 26.743 12.656 -21.981
195 HB1 ALA 26 1HB ALA 26 26.489 14.634 -23.123
196 HB2 ALA 26 2HB ALA 26 24.850 14.247 -23.647
197 HB3 ALA 26 3HB ALA 26 25.150 14.731 -21.978
198 H GLU 27 H GLU 27 23.455 11.833 -22.938
199 HA GLU 27 HA GLU 27 22.086 12.237 -20.581
200 HB2 GLU 27 2HB GLU 27 21.775 10.434 -22.903
201 HB3 GLU 27 3HB GLU 27 20.920 9.950 -21.445
202 HG2 GLU 27 2HG GLU 27 19.853 12.172 -21.372
203 HG3 GLU 27 3HG GLU 27 20.652 12.575 -22.890
204 H CYS 28 H CYS 28 24.301 9.659 -21.425
205 HA CYS 28 HA CYS 28 23.740 7.774 -19.493
206 HB2 CYS 28 2HB CYS 28 26.515 8.582 -20.381
207 HB3 CYS 28 3HB CYS 28 26.032 7.024 -19.722
208 HG CYS 28 HG CYS 28 25.527 5.940 -21.985
209 H ALA 29 H ALA 29 25.761 10.672 -19.204
210 HA ALA 29 HA ALA 29 26.739 10.281 -16.636
211 HB1 ALA 29 1HB ALA 29 26.197 13.042 -16.921
212 HB2 ALA 29 2HB ALA 29 27.728 12.197 -17.153
213 HB3 ALA 29 3HB ALA 29 26.628 12.418 -18.514
214 H ALA 30 H ALA 30 23.827 12.112 -17.587
215 HA ALA 30 HA ALA 30 22.925 12.738 -15.034
216 HB1 ALA 30 1HB ALA 30 20.706 12.200 -16.785
217 HB2 ALA 30 2HB ALA 30 21.305 13.742 -16.173
218 HB3 ALA 30 3HB ALA 30 21.987 13.053 -17.646
219 H PHE 31 H PHE 31 22.554 9.793 -16.908
220 HA PHE 31 HA PHE 31 20.564 8.574 -15.327
221 HB2 PHE 31 2HB PHE 31 22.426 7.749 -17.443
222 HB3 PHE 31 3HB PHE 31 22.012 6.463 -16.313
223 HD1 PHE 31 HD1 PHE 31 19.796 9.240 -17.317
224 HD2 PHE 31 HD2 PHE 31 20.714 5.105 -17.735
225 HE1 PHE 31 HE1 PHE 31 17.668 8.890 -18.502
226 HE2 PHE 31 HE2 PHE 31 18.589 4.749 -18.921
227 HZ PHE 31 HZ PHE 31 17.063 6.643 -19.307
228 H GLU 32 H GLU 32 24.108 8.257 -15.274
229 HA GLU 32 HA GLU 32 24.293 6.437 -13.171
230 HB2 GLU 32 2HB GLU 32 26.206 6.957 -14.562
231 HB3 GLU 32 3HB GLU 32 26.204 8.624 -14.004
232 HG2 GLU 32 2HG GLU 32 27.606 8.057 -12.398
233 HG3 GLU 32 3HG GLU 32 26.362 7.018 -11.705
234 H LYS 33 H LYS 33 24.311 9.987 -13.101
235 HA LYS 33 HA LYS 33 24.686 10.310 -10.350
236 HB2 LYS 33 2HB LYS 33 23.713 11.975 -12.581
237 HB3 LYS 33 3HB LYS 33 23.148 12.463 -10.989
238 HG2 LYS 33 2HG LYS 33 25.127 13.314 -10.440
239 HG3 LYS 33 3HG LYS 33 25.991 11.887 -11.015
240 HD2 LYS 33 2HD LYS 33 26.452 12.820 -13.013
241 HD3 LYS 33 3HD LYS 33 24.865 13.585 -13.133
242 HE2 LYS 33 2HE LYS 33 26.666 14.679 -11.072
243 HE3 LYS 33 3HE LYS 33 27.173 14.933 -12.741
244 HZ1 LYS 33 3HZ LYS 33 25.479 16.529 -11.436
245 HZ2 LYS 33 1HZ LYS 33 24.383 15.489 -12.198
246 HZ3 LYS 33 2HZ LYS 33 25.502 16.361 -13.119
247 H GLU 34 H GLU 34 21.650 10.259 -12.216
248 HA GLU 34 HA GLU 34 19.863 10.582 -10.133
249 HB2 GLU 34 2HB GLU 34 19.714 9.924 -12.857
250 HB3 GLU 34 3HB GLU 34 18.863 8.634 -12.018
251 HG2 GLU 34 2HG GLU 34 17.449 10.281 -10.907
252 HG3 GLU 34 3HG GLU 34 18.306 11.579 -11.737
253 H ILE 35 H ILE 35 21.233 7.556 -11.395
254 HA ILE 35 HA ILE 35 19.871 5.796 -9.701
255 HB ILE 35 HB ILE 35 22.598 5.529 -10.965
256 HG12 ILE 35 2HG1 ILE 35 20.641 5.756 -12.497
257 HG13 ILE 35 3HG1 ILE 35 21.465 4.207 -12.641
258 HG21 ILE 35 1HG2 ILE 35 22.815 3.887 -9.418
259 HG22 ILE 35 2HG2 ILE 35 21.075 3.724 -9.186
260 HG23 ILE 35 3HG2 ILE 35 21.850 2.992 -10.591
261 HD11 ILE 35 3HD1 ILE 35 19.589 3.126 -12.208
262 HD12 ILE 35 1HD1 ILE 35 19.374 4.012 -10.699
263 HD13 ILE 35 2HD1 ILE 35 18.742 4.673 -12.208
264 H ALA 36 H ALA 36 22.999 7.419 -9.291
265 HA ALA 36 HA ALA 36 23.798 6.232 -6.908
266 HB1 ALA 36 1HB ALA 36 25.131 7.789 -8.384
267 HB2 ALA 36 2HB ALA 36 24.292 9.121 -7.587
268 HB3 ALA 36 3HB ALA 36 25.310 8.031 -6.646
269 H ALA 37 H ALA 37 21.846 9.166 -7.394
270 HA ALA 37 HA ALA 37 21.479 9.703 -4.636
271 HB1 ALA 37 1HB ALA 37 20.076 11.428 -5.290
272 HB2 ALA 37 2HB ALA 37 21.148 11.253 -6.681
273 HB3 ALA 37 3HB ALA 37 19.523 10.569 -6.728
274 H PHE 38 H PHE 38 19.757 7.732 -6.961
275 HA PHE 38 HA PHE 38 17.368 7.366 -5.532
276 HB2 PHE 38 2HB PHE 38 18.643 6.228 -7.865
277 HB3 PHE 38 3HB PHE 38 17.858 4.973 -6.912
278 HD1 PHE 38 HD2 PHE 38 17.017 8.499 -7.810
279 HD2 PHE 38 HD1 PHE 38 15.801 4.421 -7.744
280 HE1 PHE 38 HE2 PHE 38 14.844 9.135 -8.773
281 HE2 PHE 38 HE1 PHE 38 13.626 5.050 -8.707
282 HZ PHE 38 HZ PHE 38 13.145 7.410 -9.222
283 H GLU 39 H GLU 39 20.256 5.281 -5.695
284 HA GLU 39 HA GLU 39 19.358 3.454 -3.734
285 HB2 GLU 39 2HB GLU 39 21.688 2.663 -3.692
286 HB3 GLU 39 3HB GLU 39 21.088 2.850 -5.334
287 HG2 GLU 39 2HG GLU 39 22.243 5.033 -5.461
288 HG3 GLU 39 3HG GLU 39 22.917 4.731 -3.861
289 H SER 40 H SER 40 21.301 6.387 -3.574
290 HA SER 40 HA SER 40 22.081 6.111 -0.863
291 HB2 SER 40 2HB SER 40 23.012 8.238 -1.062
292 HB3 SER 40 3HB SER 40 23.014 7.679 -2.735
293 HG SER 40 HG SER 40 22.164 9.839 -2.401
294 H GLU 41 H GLU 41 19.253 7.425 -2.442
295 HA GLU 41 HA GLU 41 18.242 8.644 -0.021
296 HB2 GLU 41 2HB GLU 41 17.251 8.388 -2.838
297 HB3 GLU 41 3HB GLU 41 16.140 8.860 -1.560
298 HG2 GLU 41 2HG GLU 41 18.646 10.361 -1.566
299 HG3 GLU 41 3HG GLU 41 17.678 10.563 -3.026
300 H LEU 42 H LEU 42 17.911 5.650 -1.752
301 HA LEU 42 HA LEU 42 15.547 4.823 -0.310
302 HB2 LEU 42 2HB LEU 42 17.378 3.412 -2.236
303 HB3 LEU 42 3HB LEU 42 16.006 2.626 -1.459
304 HG LEU 42 HG LEU 42 15.702 5.081 -3.170
305 HD11 LEU 42 1HD1 LEU 42 14.784 2.935 -4.641
306 HD12 LEU 42 2HD1 LEU 42 16.314 2.362 -3.976
307 HD13 LEU 42 3HD1 LEU 42 16.268 3.844 -4.931
308 HD21 LEU 42 3HD2 LEU 42 13.705 4.895 -2.116
309 HD22 LEU 42 1HD2 LEU 42 13.908 3.172 -1.795
310 HD23 LEU 42 2HD2 LEU 42 13.414 3.718 -3.398
311 H GLN 43 H GLN 43 18.978 4.566 0.026
312 HA GLN 43 HA GLN 43 18.916 2.338 1.845
313 HB2 GLN 43 2HB GLN 43 21.259 2.575 1.995
314 HB3 GLN 43 3HB GLN 43 20.859 2.981 0.331
315 HG2 GLN 43 2HG GLN 43 22.091 4.801 0.642
316 HG3 GLN 43 3HG GLN 43 20.735 5.412 1.589
317 HE21 GLN 43 1HE2 GLN 43 23.698 5.784 1.769
318 HE22 GLN 43 2HE2 GLN 43 24.087 5.411 3.410
319 H ALA 44 H ALA 44 18.537 5.742 2.072
320 HA ALA 44 HA ALA 44 19.242 5.918 4.867
321 HB1 ALA 44 1HB ALA 44 19.174 7.746 2.871
322 HB2 ALA 44 2HB ALA 44 17.653 8.093 3.695
323 HB3 ALA 44 3HB ALA 44 19.172 8.147 4.589
324 H TYR 45 H TYR 45 16.510 4.986 3.084
325 HA TYR 45 HA TYR 45 14.357 5.876 4.561
326 HB2 TYR 45 2HB TYR 45 14.896 3.616 2.772
327 HB3 TYR 45 3HB TYR 45 13.623 3.298 3.944
328 HD1 TYR 45 HD2 TYR 45 12.167 5.726 4.215
329 HD2 TYR 45 HD1 TYR 45 13.985 4.124 0.717
330 HE1 TYR 45 HE2 TYR 45 10.568 6.971 2.821
331 HE2 TYR 45 HE1 TYR 45 12.392 5.366 -0.686
332 HH TYR 45 HH TYR 45 10.635 7.882 0.313
333 H LYS 46 H LYS 46 15.871 2.671 4.980
334 HA LYS 46 HA LYS 46 16.217 2.815 7.741
335 HB2 LYS 46 2HB LYS 46 13.500 2.559 7.056
336 HB3 LYS 46 3HB LYS 46 14.005 0.968 7.607
337 HG2 LYS 46 2HG LYS 46 14.281 1.643 9.740
338 HG3 LYS 46 3HG LYS 46 14.856 3.245 9.275
339 HD2 LYS 46 2HD LYS 46 12.543 3.874 8.691
340 HD3 LYS 46 3HD LYS 46 11.993 2.288 9.237
341 HE2 LYS 46 2HE LYS 46 13.102 2.875 11.465
342 HE3 LYS 46 3HE LYS 46 13.166 4.529 10.858
343 HZ1 LYS 46 3HZ LYS 46 11.185 4.456 12.023
344 HZ2 LYS 46 1HZ LYS 46 10.801 2.891 11.507
345 HZ3 LYS 46 2HZ LYS 46 10.673 4.191 10.433
346 H GLY 47 H GLY 47 14.743 0.312 5.660
347 HA2 GLY 47 2HA GLY 47 15.824 -1.546 4.716
348 HA3 GLY 47 3HA GLY 47 17.255 -1.168 5.664
349 H LYS 48 H LYS 48 16.312 -1.102 8.213
350 HA LYS 48 HA LYS 48 16.202 -3.815 8.907
351 HB2 LYS 48 2HB LYS 48 15.888 -1.237 10.347
352 HB3 LYS 48 3HB LYS 48 15.262 -2.672 11.147
353 HG2 LYS 48 2HG LYS 48 17.297 -3.310 11.748
354 HG3 LYS 48 3HG LYS 48 17.897 -3.161 10.094
355 HD2 LYS 48 2HD LYS 48 19.191 -1.563 11.063
356 HD3 LYS 48 3HD LYS 48 17.773 -0.570 10.719
357 HE2 LYS 48 2HE LYS 48 17.742 -2.024 13.285
358 HE3 LYS 48 3HE LYS 48 18.942 -0.740 13.143
359 HZ1 LYS 48 3HZ LYS 48 17.186 0.470 13.867
360 HZ2 LYS 48 1HZ LYS 48 16.028 -0.563 13.193
361 HZ3 LYS 48 2HZ LYS 48 16.850 0.541 12.211
362 H GLY 49 H GLY 49 13.643 -1.495 9.767
363 HA2 GLY 49 2HA GLY 49 11.661 -3.492 10.016
364 HA3 GLY 49 3HA GLY 49 11.368 -1.761 9.929
365 H ASN 50 H ASN 50 12.689 -1.531 7.308
366 HA ASN 50 HA ASN 50 10.621 -2.831 5.659
367 HB2 ASN 50 2HB ASN 50 11.163 -0.726 4.137
368 HB3 ASN 50 3HB ASN 50 9.989 -0.631 5.446
369 HD21 ASN 50 1HD2 ASN 50 10.325 0.759 7.069
370 HD22 ASN 50 2HD2 ASN 50 11.733 1.745 7.246
371 HA PRO 51 HA PRO 51 14.761 -4.273 4.179
372 HB2 PRO 51 2HB PRO 51 13.968 -6.838 3.775
373 HB3 PRO 51 3HB PRO 51 14.539 -6.244 5.339
374 HG2 PRO 51 2HG PRO 51 11.734 -6.648 4.375
375 HG3 PRO 51 3HG PRO 51 12.443 -7.047 5.950
376 HD2 PRO 51 2HD PRO 51 10.938 -4.832 5.549
377 HD3 PRO 51 3HD PRO 51 12.276 -4.879 6.715
378 H GLU 52 H GLU 52 11.562 -4.166 2.946
379 HA GLU 52 HA GLU 52 11.770 -5.352 0.458
380 HB2 GLU 52 2HB GLU 52 10.024 -3.739 -0.273
381 HB3 GLU 52 3HB GLU 52 9.654 -4.521 1.257
382 HG2 GLU 52 2HG GLU 52 10.831 -2.362 2.229
383 HG3 GLU 52 3HG GLU 52 10.316 -1.691 0.682
384 H VAL 53 H VAL 53 12.999 -2.262 1.555
385 HA VAL 53 HA VAL 53 13.562 -1.070 -0.908
386 HB VAL 53 HB VAL 53 15.166 -0.807 1.639
387 HG11 VAL 53 1HG1 VAL 53 15.416 0.382 -0.975
388 HG12 VAL 53 2HG1 VAL 53 15.111 1.613 0.252
389 HG13 VAL 53 3HG1 VAL 53 16.480 0.514 0.425
390 HG21 VAL 53 3HG2 VAL 53 13.695 1.311 1.821
391 HG22 VAL 53 1HG2 VAL 53 12.613 0.460 0.718
392 HG23 VAL 53 2HG2 VAL 53 13.005 -0.244 2.287
393 H GLU 54 H GLU 54 15.046 -3.735 0.674
394 HA GLU 54 HA GLU 54 17.651 -3.673 -0.230
395 HB2 GLU 54 2HB GLU 54 17.726 -6.017 0.113
396 HB3 GLU 54 3HB GLU 54 16.576 -5.392 1.287
397 HG2 GLU 54 2HG GLU 54 14.764 -6.003 -0.373
398 HG3 GLU 54 3HG GLU 54 16.010 -6.893 -1.247
399 H ALA 55 H ALA 55 14.733 -4.622 -1.961
400 HA ALA 55 HA ALA 55 16.023 -5.648 -4.262
401 HB1 ALA 55 1HB ALA 55 13.390 -4.442 -4.696
402 HB2 ALA 55 2HB ALA 55 13.948 -6.090 -4.986
403 HB3 ALA 55 3HB ALA 55 13.452 -5.599 -3.366
404 H LEU 56 H LEU 56 14.477 -2.494 -3.649
405 HA LEU 56 HA LEU 56 15.071 -1.316 -6.103
406 HB2 LEU 56 2HB LEU 56 14.054 -0.493 -3.560
407 HB3 LEU 56 3HB LEU 56 15.227 0.694 -4.127
408 HG LEU 56 HG LEU 56 13.952 1.105 -6.111
409 HD11 LEU 56 1HD1 LEU 56 11.586 -0.177 -6.020
410 HD12 LEU 56 2HD1 LEU 56 12.643 -1.424 -5.359
411 HD13 LEU 56 3HD1 LEU 56 12.973 -0.741 -6.951
412 HD21 LEU 56 3HD2 LEU 56 11.574 1.262 -4.635
413 HD22 LEU 56 1HD2 LEU 56 12.787 2.522 -4.861
414 HD23 LEU 56 2HD2 LEU 56 12.884 1.446 -3.467
415 H ARG 57 H ARG 57 16.945 -1.382 -3.096
416 HA ARG 57 HA ARG 57 19.034 0.295 -3.946
417 HB2 ARG 57 2HB ARG 57 18.805 -0.177 -1.614
418 HB3 ARG 57 3HB ARG 57 18.939 -1.909 -1.889
419 HG2 ARG 57 2HG ARG 57 21.221 -0.233 -2.743
420 HG3 ARG 57 3HG ARG 57 20.962 -0.428 -1.009
421 HD2 ARG 57 2HD ARG 57 21.631 -2.566 -1.035
422 HD3 ARG 57 3HD ARG 57 20.740 -2.920 -2.515
423 HE ARG 57 HE ARG 57 22.660 -2.579 -3.709
424 HH11 ARG 57 1HH1 ARG 57 23.050 -1.236 -0.521
425 HH12 ARG 57 2HH1 ARG 57 24.737 -0.897 -0.728
426 HH21 ARG 57 1HH2 ARG 57 24.880 -2.137 -3.994
427 HH22 ARG 57 2HH2 ARG 57 25.776 -1.409 -2.704
428 H LYS 58 H LYS 58 18.638 -3.222 -4.108
429 HA LYS 58 HA LYS 58 21.164 -3.865 -5.114
430 HB2 LYS 58 2HB LYS 58 18.674 -5.201 -4.683
431 HB3 LYS 58 3HB LYS 58 19.255 -5.612 -6.292
432 HG2 LYS 58 2HG LYS 58 21.353 -5.734 -4.288
433 HG3 LYS 58 3HG LYS 58 20.001 -6.812 -3.931
434 HD2 LYS 58 2HD LYS 58 20.196 -7.850 -6.097
435 HD3 LYS 58 3HD LYS 58 21.433 -6.690 -6.584
436 HE2 LYS 58 2HE LYS 58 23.039 -7.631 -5.197
437 HE3 LYS 58 3HE LYS 58 21.837 -8.403 -4.164
438 HZ1 LYS 58 3HZ LYS 58 21.550 -9.418 -6.755
439 HZ2 LYS 58 1HZ LYS 58 22.043 -10.236 -5.359
440 HZ3 LYS 58 2HZ LYS 58 23.192 -9.494 -6.354
441 H GLU 59 H GLU 59 18.123 -3.359 -6.911
442 HA GLU 59 HA GLU 59 19.142 -3.621 -9.477
443 HB2 GLU 59 2HB GLU 59 16.785 -2.266 -8.281
444 HB3 GLU 59 3HB GLU 59 17.221 -1.803 -9.920
445 HG2 GLU 59 2HG GLU 59 16.566 -4.572 -8.946
446 HG3 GLU 59 3HG GLU 59 15.571 -3.547 -9.979
447 H ALA 60 H ALA 60 18.737 -0.633 -7.580
448 HA ALA 60 HA ALA 60 19.726 1.194 -9.392
449 HB1 ALA 60 1HB ALA 60 18.700 1.783 -7.235
450 HB2 ALA 60 2HB ALA 60 20.162 1.244 -6.409
451 HB3 ALA 60 3HB ALA 60 20.226 2.625 -7.503
452 H ALA 61 H ALA 61 21.582 -0.580 -6.919
453 HA ALA 61 HA ALA 61 24.101 0.422 -7.501
454 HB1 ALA 61 1HB ALA 61 23.943 -0.843 -5.552
455 HB2 ALA 61 2HB ALA 61 23.183 -2.202 -6.382
456 HB3 ALA 61 3HB ALA 61 24.895 -1.863 -6.632
457 H ALA 62 H ALA 62 22.432 -2.371 -8.921
458 HA ALA 62 HA ALA 62 24.497 -3.287 -10.558
459 HB1 ALA 62 1HB ALA 62 22.773 -4.409 -11.851
460 HB2 ALA 62 2HB ALA 62 22.436 -4.545 -10.125
461 HB3 ALA 62 3HB ALA 62 21.534 -3.395 -11.111
462 H ILE 63 H ILE 63 21.922 -0.939 -11.257
463 HA ILE 63 HA ILE 63 22.581 -0.449 -13.930
464 HB ILE 63 HB ILE 63 21.375 1.475 -11.939
465 HG12 ILE 63 2HG1 ILE 63 19.658 0.177 -13.940
466 HG13 ILE 63 3HG1 ILE 63 20.352 -0.932 -12.761
467 HG21 ILE 63 1HG2 ILE 63 21.516 1.516 -14.944
468 HG22 ILE 63 2HG2 ILE 63 20.394 2.505 -14.012
469 HG23 ILE 63 3HG2 ILE 63 22.132 2.721 -13.813
470 HD11 ILE 63 3HD1 ILE 63 18.132 0.803 -12.479
471 HD12 ILE 63 1HD1 ILE 63 18.800 -0.336 -11.310
472 HD13 ILE 63 2HD1 ILE 63 19.388 1.326 -11.357
473 H ARG 64 H ARG 64 23.686 1.148 -10.961
474 HA ARG 64 HA ARG 64 25.217 3.162 -12.144
475 HB2 ARG 64 2HB ARG 64 24.597 2.948 -9.705
476 HB3 ARG 64 3HB ARG 64 25.881 1.756 -9.557
477 HG2 ARG 64 2HG ARG 64 27.410 3.589 -10.510
478 HG3 ARG 64 3HG ARG 64 26.094 4.690 -10.095
479 HD2 ARG 64 2HD ARG 64 26.184 3.635 -7.770
480 HD3 ARG 64 3HD ARG 64 27.731 2.953 -8.271
481 HE ARG 64 HE ARG 64 27.720 5.724 -8.767
482 HH11 ARG 64 1HH1 ARG 64 27.819 3.451 -6.132
483 HH12 ARG 64 2HH1 ARG 64 28.688 4.515 -5.076
484 HH21 ARG 64 1HH2 ARG 64 28.864 7.133 -7.386
485 HH22 ARG 64 2HH2 ARG 64 29.281 6.609 -5.790
486 H ASP 65 H ASP 65 26.158 -0.105 -11.112
487 HA ASP 65 HA ASP 65 28.870 0.056 -11.760
488 HB2 ASP 65 2HB ASP 65 26.967 -2.285 -11.679
489 HB3 ASP 65 3HB ASP 65 28.690 -2.473 -11.993
490 H GLU 66 H GLU 66 26.103 -0.957 -13.735
491 HA GLU 66 HA GLU 66 27.530 -1.726 -16.016
492 HB2 GLU 66 2HB GLU 66 24.769 -0.498 -15.921
493 HB3 GLU 66 3HB GLU 66 25.432 -1.477 -17.222
494 HG2 GLU 66 2HG GLU 66 25.062 -3.413 -16.141
495 HG3 GLU 66 3HG GLU 66 25.440 -2.729 -14.561
496 H CYS 67 H CYS 67 26.132 1.414 -15.129
497 HA CYS 67 HA CYS 67 26.757 2.797 -17.469
498 HB2 CYS 67 2HB CYS 67 26.515 3.765 -14.617
499 HB3 CYS 67 3HB CYS 67 26.691 4.845 -15.995
500 HG CYS 67 HG CYS 67 23.961 4.111 -14.752
501 H GLN 68 H GLN 68 28.661 2.322 -14.519
502 HA GLN 68 HA GLN 68 30.848 3.931 -15.331
503 HB2 GLN 68 2HB GLN 68 31.001 1.612 -13.411
504 HB3 GLN 68 3HB GLN 68 32.004 3.056 -13.445
505 HG2 GLN 68 2HG GLN 68 29.357 3.943 -13.159
506 HG3 GLN 68 3HG GLN 68 29.553 2.583 -12.054
507 HE21 GLN 68 1HE2 GLN 68 31.341 5.459 -13.120
508 HE22 GLN 68 2HE2 GLN 68 31.888 5.912 -11.545
509 H ALA 69 H ALA 69 29.976 0.597 -15.875
510 HA ALA 69 HA ALA 69 32.564 -0.184 -16.855
511 HB1 ALA 69 1HB ALA 69 31.484 -2.283 -17.452
512 HB2 ALA 69 2HB ALA 69 31.066 -1.809 -15.806
513 HB3 ALA 69 3HB ALA 69 29.903 -1.580 -17.112
514 H TYR 70 H TYR 70 30.067 1.645 -18.118
515 HA TYR 70 HA TYR 70 30.564 0.834 -20.885
516 HB2 TYR 70 2HB TYR 70 28.546 2.768 -19.726
517 HB3 TYR 70 3HB TYR 70 28.680 2.348 -21.431
518 HD1 TYR 70 HD1 TYR 70 29.293 -0.643 -20.883
519 HD2 TYR 70 HD2 TYR 70 26.279 2.013 -19.479
520 HE1 TYR 70 HE1 TYR 70 27.782 -2.552 -20.532
521 HE2 TYR 70 HE2 TYR 70 24.761 0.111 -19.123
522 HH TYR 70 HH TYR 70 24.682 -2.428 -20.316
523 H ARG 71 H ARG 71 30.899 3.589 -18.713
524 HA ARG 71 HA ARG 71 32.759 4.794 -20.636
525 HB2 ARG 71 2HB ARG 71 31.851 7.037 -20.109
526 HB3 ARG 71 3HB ARG 71 30.684 6.005 -20.924
527 HG2 ARG 71 2HG ARG 71 29.235 6.353 -19.293
528 HG3 ARG 71 3HG ARG 71 30.359 5.642 -18.133
529 HD2 ARG 71 2HD ARG 71 31.492 8.006 -18.265
530 HD3 ARG 71 3HD ARG 71 29.897 8.505 -18.829
531 HE ARG 71 HE ARG 71 29.681 6.961 -16.466
532 HH11 ARG 71 1HH1 ARG 71 30.601 10.117 -17.611
533 HH12 ARG 71 2HH1 ARG 71 30.212 10.914 -16.123
534 HH21 ARG 71 1HH2 ARG 71 29.166 7.998 -14.501
535 HH22 ARG 71 2HH2 ARG 71 29.397 9.708 -14.354
536 H HIS 72 H HIS 72 33.581 3.274 -18.529
537 HA HIS 72 HA HIS 72 35.363 4.948 -17.183
538 HB2 HIS 72 2HB HIS 72 32.867 5.175 -16.047
539 HB3 HIS 72 3HB HIS 72 33.631 3.948 -15.040
540 HD1 HIS 72 HD1 HIS 72 34.035 7.538 -16.107
541 HD2 HIS 72 HD2 HIS 72 35.552 4.883 -13.295
542 HE1 HIS 72 HE1 HIS 72 35.404 8.939 -14.530
543 H ASN 73 H ASN 73 35.288 2.433 -18.557
544 HA ASN 73 HA ASN 73 36.610 0.795 -16.527
545 HB2 ASN 73 2HB ASN 73 34.530 -0.288 -16.509
546 HB3 ASN 73 3HB ASN 73 34.295 -0.065 -18.241
547 HD21 ASN 73 1HD2 ASN 73 36.680 -1.548 -16.066
548 HD22 ASN 73 2HD2 ASN 73 36.842 -3.012 -16.969
Start of MODEL 4
1 H1 MET 1 H MET 1 0.383 3.415 -4.616
2 HA MET 1 HA MET 1 0.861 1.354 -2.565
3 HB2 MET 1 2HB MET 1 0.740 0.578 -4.996
4 HB3 MET 1 3HB MET 1 2.245 1.454 -5.240
5 HG2 MET 1 2HG MET 1 3.211 -0.486 -4.719
6 HG3 MET 1 3HG MET 1 2.852 -0.030 -3.055
7 HE1 MET 1 3HE MET 1 2.692 -3.296 -2.589
8 HE2 MET 1 1HE MET 1 2.390 -3.865 -4.231
9 HE3 MET 1 2HE MET 1 3.602 -2.618 -3.940
10 H GLY 2 H GLY 2 1.313 4.138 -2.188
11 HA2 GLY 2 2HA GLY 2 2.928 5.506 -1.296
12 HA3 GLY 2 3HA GLY 2 3.955 4.083 -1.193
13 H SER 3 H SER 3 5.859 4.702 -2.006
14 HA SER 3 HA SER 3 5.858 6.060 -4.621
15 HB2 SER 3 2HB SER 3 8.382 6.199 -3.176
16 HB3 SER 3 3HB SER 3 7.411 7.500 -3.865
17 HG SER 3 HG SER 3 7.350 6.396 -1.291
18 H TRP 4 H TRP 4 5.744 3.163 -4.032
19 HA TRP 4 HA TRP 4 8.342 2.119 -4.719
20 HB2 TRP 4 2HB TRP 4 6.896 0.808 -3.273
21 HB3 TRP 4 3HB TRP 4 5.637 0.781 -4.505
22 HD1 TRP 4 HD1 TRP 4 6.289 -0.630 -6.813
23 HE1 TRP 4 HE1 TRP 4 7.681 -2.782 -7.047
24 HE3 TRP 4 HE3 TRP 4 8.761 -0.487 -2.341
25 HZ2 TRP 4 HZ2 TRP 4 9.576 -4.228 -5.535
26 HZ3 TRP 4 HZ3 TRP 4 10.346 -2.293 -1.812
27 HH2 TRP 4 HH2 TRP 4 10.744 -4.124 -3.377
28 H ALA 5 H ALA 5 5.154 2.129 -6.323
29 HA ALA 5 HA ALA 5 5.884 1.030 -8.744
30 HB1 ALA 5 1HB ALA 5 3.663 1.287 -8.825
31 HB2 ALA 5 2HB ALA 5 3.694 2.706 -7.777
32 HB3 ALA 5 3HB ALA 5 4.019 2.877 -9.502
33 H GLU 6 H GLU 6 5.975 4.454 -7.794
34 HA GLU 6 HA GLU 6 6.863 5.480 -10.244
35 HB2 GLU 6 2HB GLU 6 6.748 6.423 -7.452
36 HB3 GLU 6 3HB GLU 6 7.967 7.201 -8.451
37 HG2 GLU 6 2HG GLU 6 5.074 6.981 -9.232
38 HG3 GLU 6 3HG GLU 6 5.754 8.357 -8.366
39 H PHE 7 H PHE 7 8.672 4.326 -7.425
40 HA PHE 7 HA PHE 7 11.238 4.977 -8.379
41 HB2 PHE 7 2HB PHE 7 10.102 3.448 -6.172
42 HB3 PHE 7 3HB PHE 7 11.592 2.735 -6.782
43 HD1 PHE 7 HD1 PHE 7 10.476 6.268 -6.357
44 HD2 PHE 7 HD2 PHE 7 13.318 3.260 -5.363
45 HE1 PHE 7 HE1 PHE 7 11.781 7.925 -5.089
46 HE2 PHE 7 HE2 PHE 7 14.627 4.911 -4.092
47 HZ PHE 7 HZ PHE 7 13.858 7.246 -3.953
48 H LYS 8 H LYS 8 9.304 2.023 -8.643
49 HA LYS 8 HA LYS 8 11.275 0.485 -9.969
50 HB2 LYS 8 2HB LYS 8 8.277 0.256 -9.770
51 HB3 LYS 8 3HB LYS 8 9.238 -0.888 -10.699
52 HG2 LYS 8 2HG LYS 8 9.570 -0.322 -7.759
53 HG3 LYS 8 3HG LYS 8 8.721 -1.707 -8.449
54 HD2 LYS 8 2HD LYS 8 11.340 -1.481 -9.606
55 HD3 LYS 8 3HD LYS 8 11.456 -1.493 -7.844
56 HE2 LYS 8 2HE LYS 8 10.717 -3.627 -7.678
57 HE3 LYS 8 3HE LYS 8 9.616 -3.465 -9.046
58 HZ1 LYS 8 3HZ LYS 8 12.329 -4.421 -8.979
59 HZ2 LYS 8 1HZ LYS 8 12.047 -3.294 -10.209
60 HZ3 LYS 8 2HZ LYS 8 11.111 -4.700 -10.121
61 H GLN 9 H GLN 9 8.640 2.539 -11.127
62 HA GLN 9 HA GLN 9 8.850 1.918 -13.856
63 HB2 GLN 9 2HB GLN 9 7.189 3.475 -12.363
64 HB3 GLN 9 3HB GLN 9 8.131 4.700 -13.201
65 HG2 GLN 9 2HG GLN 9 7.014 2.466 -14.801
66 HG3 GLN 9 3HG GLN 9 5.909 3.707 -14.213
67 HE21 GLN 9 1HE2 GLN 9 6.843 6.003 -14.552
68 HE22 GLN 9 2HE2 GLN 9 7.467 6.314 -16.132
69 H ARG 10 H ARG 10 10.105 4.790 -12.146
70 HA ARG 10 HA ARG 10 11.588 5.831 -14.252
71 HB2 ARG 10 2HB ARG 10 11.217 7.191 -12.335
72 HB3 ARG 10 3HB ARG 10 11.972 6.014 -11.268
73 HG2 ARG 10 2HG ARG 10 13.769 6.933 -13.356
74 HG3 ARG 10 3HG ARG 10 13.168 8.246 -12.342
75 HD2 ARG 10 2HD ARG 10 13.752 6.474 -10.432
76 HD3 ARG 10 3HD ARG 10 14.908 5.950 -11.655
77 HE ARG 10 HE ARG 10 16.152 7.787 -11.153
78 HH11 ARG 10 1HH1 ARG 10 12.855 8.411 -10.228
79 HH12 ARG 10 2HH1 ARG 10 13.205 9.959 -9.534
80 HH21 ARG 10 1HH2 ARG 10 16.626 9.824 -10.243
81 HH22 ARG 10 2HH2 ARG 10 15.351 10.762 -9.544
82 H LEU 11 H LEU 11 12.536 3.495 -11.766
83 HA LEU 11 HA LEU 11 15.248 3.297 -12.461
84 HB2 LEU 11 2HB LEU 11 13.307 1.585 -10.997
85 HB3 LEU 11 3HB LEU 11 14.842 0.871 -11.486
86 HG LEU 11 HG LEU 11 14.747 3.418 -9.901
87 HD11 LEU 11 1HD1 LEU 11 14.974 0.697 -8.655
88 HD12 LEU 11 2HD1 LEU 11 13.427 1.530 -8.809
89 HD13 LEU 11 3HD1 LEU 11 14.730 2.257 -7.868
90 HD21 LEU 11 3HD2 LEU 11 16.943 2.240 -9.097
91 HD22 LEU 11 1HD2 LEU 11 16.903 3.111 -10.629
92 HD23 LEU 11 2HD2 LEU 11 16.777 1.352 -10.612
93 H ALA 12 H ALA 12 12.399 1.566 -13.630
94 HA ALA 12 HA ALA 12 13.736 -0.338 -15.208
95 HB1 ALA 12 1HB ALA 12 11.442 -0.134 -16.535
96 HB2 ALA 12 2HB ALA 12 11.555 -0.926 -14.963
97 HB3 ALA 12 3HB ALA 12 10.977 0.736 -15.072
98 H ALA 13 H ALA 13 12.447 2.872 -16.014
99 HA ALA 13 HA ALA 13 13.101 2.812 -18.752
100 HB1 ALA 13 1HB ALA 13 13.165 5.446 -18.229
101 HB2 ALA 13 2HB ALA 13 11.671 4.524 -18.405
102 HB3 ALA 13 3HB ALA 13 12.307 4.874 -16.798
103 H ILE 14 H ILE 14 14.885 3.982 -15.924
104 HA ILE 14 HA ILE 14 17.066 5.085 -17.322
105 HB ILE 14 HB ILE 14 16.886 3.981 -14.520
106 HG12 ILE 14 2HG1 ILE 14 17.028 6.839 -15.496
107 HG13 ILE 14 3HG1 ILE 14 15.524 6.006 -15.116
108 HG21 ILE 14 1HG2 ILE 14 19.130 3.923 -14.625
109 HG22 ILE 14 2HG2 ILE 14 19.191 4.946 -16.060
110 HG23 ILE 14 3HG2 ILE 14 19.001 5.675 -14.465
111 HD11 ILE 14 3HD1 ILE 14 17.731 6.816 -13.260
112 HD12 ILE 14 1HD1 ILE 14 16.027 7.270 -13.219
113 HD13 ILE 14 2HD1 ILE 14 16.512 5.625 -12.806
114 H LYS 15 H LYS 15 16.472 1.843 -16.044
115 HA LYS 15 HA LYS 15 19.040 0.797 -16.587
116 HB2 LYS 15 2HB LYS 15 16.746 -0.121 -15.347
117 HB3 LYS 15 3HB LYS 15 16.857 -1.138 -16.777
118 HG2 LYS 15 2HG LYS 15 19.443 -1.002 -15.659
119 HG3 LYS 15 3HG LYS 15 18.314 -1.308 -14.337
120 HD2 LYS 15 2HD LYS 15 18.196 -2.868 -16.900
121 HD3 LYS 15 3HD LYS 15 19.279 -3.331 -15.585
122 HE2 LYS 15 2HE LYS 15 17.044 -3.066 -14.174
123 HE3 LYS 15 3HE LYS 15 16.315 -3.424 -15.739
124 HZ1 LYS 15 3HZ LYS 15 17.640 -5.445 -15.849
125 HZ2 LYS 15 1HZ LYS 15 16.673 -5.435 -14.461
126 HZ3 LYS 15 2HZ LYS 15 18.327 -5.103 -14.341
127 H THR 16 H THR 16 16.024 0.808 -18.447
128 HA THR 16 HA THR 16 16.873 -0.779 -20.587
129 HB THR 16 HB THR 16 14.888 1.503 -20.620
130 HG1 THR 16 HG1 THR 16 13.381 -0.109 -20.223
131 HG21 THR 16 3HG2 THR 16 15.107 1.180 -22.859
132 HG22 THR 16 1HG2 THR 16 14.022 -0.170 -22.530
133 HG23 THR 16 2HG2 THR 16 15.758 -0.448 -22.671
134 H ARG 17 H ARG 17 16.772 2.783 -20.376
135 HA ARG 17 HA ARG 17 18.075 3.245 -22.825
136 HB2 ARG 17 2HB ARG 17 17.552 4.886 -20.379
137 HB3 ARG 17 3HB ARG 17 18.647 5.504 -21.608
138 HG2 ARG 17 2HG ARG 17 16.789 6.373 -22.500
139 HG3 ARG 17 3HG ARG 17 16.538 4.744 -23.130
140 HD2 ARG 17 2HD ARG 17 15.085 4.192 -21.314
141 HD3 ARG 17 3HD ARG 17 15.479 5.692 -20.474
142 HE ARG 17 HE ARG 17 13.961 6.791 -21.792
143 HH11 ARG 17 1HH1 ARG 17 14.637 3.669 -23.176
144 HH12 ARG 17 2HH1 ARG 17 13.382 3.780 -24.366
145 HH21 ARG 17 1HH2 ARG 17 12.307 6.949 -23.354
146 HH22 ARG 17 2HH2 ARG 17 12.058 5.647 -24.467
147 H CYS 18 H CYS 18 19.281 2.659 -19.590
148 HA CYS 18 HA CYS 18 21.966 3.451 -20.102
149 HB2 CYS 18 2HB CYS 18 21.272 3.406 -17.828
150 HB3 CYS 18 3HB CYS 18 20.693 1.750 -17.962
151 HG CYS 18 HG CYS 18 23.992 2.650 -18.127
152 H GLN 19 H GLN 19 20.205 0.417 -20.349
153 HA GLN 19 HA GLN 19 22.502 -1.203 -20.821
154 HB2 GLN 19 2HB GLN 19 19.573 -1.676 -21.388
155 HB3 GLN 19 3HB GLN 19 20.826 -2.892 -21.593
156 HG2 GLN 19 2HG GLN 19 20.828 -1.633 -18.960
157 HG3 GLN 19 3HG GLN 19 19.343 -2.504 -19.339
158 HE21 GLN 19 1HE2 GLN 19 22.745 -3.092 -20.142
159 HE22 GLN 19 2HE2 GLN 19 22.808 -4.682 -19.468
160 H ALA 20 H ALA 20 20.201 0.494 -22.878
161 HA ALA 20 HA ALA 20 21.303 -0.578 -25.315
162 HB1 ALA 20 1HB ALA 20 19.104 -0.093 -25.666
163 HB2 ALA 20 2HB ALA 20 19.132 1.322 -24.613
164 HB3 ALA 20 3HB ALA 20 19.823 1.415 -26.233
165 H LEU 21 H LEU 21 21.729 2.277 -23.350
166 HA LEU 21 HA LEU 21 23.100 4.089 -23.517
167 HB2 LEU 21 2HB LEU 21 24.717 1.956 -24.883
168 HB3 LEU 21 3HB LEU 21 25.347 3.576 -24.590
169 HG LEU 21 HG LEU 21 24.401 2.704 -22.111
170 HD11 LEU 21 1HD1 LEU 21 26.208 0.558 -23.121
171 HD12 LEU 21 2HD1 LEU 21 24.469 0.421 -23.377
172 HD13 LEU 21 3HD1 LEU 21 25.111 0.551 -21.740
173 HD21 LEU 21 3HD2 LEU 21 27.228 2.657 -23.161
174 HD22 LEU 21 1HD2 LEU 21 26.722 2.800 -21.477
175 HD23 LEU 21 2HD2 LEU 21 26.380 4.104 -22.614
176 H GLY 22 H GLY 22 21.119 3.621 -25.682
177 HA2 GLY 22 2HA GLY 22 22.443 5.229 -27.780
178 HA3 GLY 22 3HA GLY 22 21.230 4.009 -28.141
179 H GLY 23 H GLY 23 19.835 4.990 -25.564
180 HA2 GLY 23 2HA GLY 23 17.830 6.487 -26.731
181 HA3 GLY 23 3HA GLY 23 18.186 6.491 -25.010
182 H SER 24 H SER 24 20.783 7.637 -25.170
183 HA SER 24 HA SER 24 20.926 10.004 -26.640
184 HB2 SER 24 2HB SER 24 19.280 10.150 -24.186
185 HB3 SER 24 3HB SER 24 20.473 11.434 -24.381
186 HG SER 24 HG SER 24 18.127 11.061 -25.675
187 H GLU 25 H GLU 25 23.034 10.367 -26.654
188 HA GLU 25 HA GLU 25 24.896 9.192 -24.980
189 HB2 GLU 25 2HB GLU 25 26.453 11.027 -25.813
190 HB3 GLU 25 3HB GLU 25 25.678 10.033 -27.039
191 HG2 GLU 25 2HG GLU 25 24.749 11.804 -27.981
192 HG3 GLU 25 3HG GLU 25 24.050 12.320 -26.447
193 H ALA 26 H ALA 26 23.064 12.113 -24.542
194 HA ALA 26 HA ALA 26 24.690 13.034 -22.327
195 HB1 ALA 26 1HB ALA 26 22.466 14.106 -23.923
196 HB2 ALA 26 2HB ALA 26 22.477 14.587 -22.226
197 HB3 ALA 26 3HB ALA 26 23.877 14.920 -23.245
198 H GLU 27 H GLU 27 21.664 11.342 -22.848
199 HA GLU 27 HA GLU 27 20.443 11.562 -20.392
200 HB2 GLU 27 2HB GLU 27 20.397 9.646 -22.599
201 HB3 GLU 27 3HB GLU 27 20.021 8.913 -21.046
202 HG2 GLU 27 2HG GLU 27 18.369 10.857 -20.759
203 HG3 GLU 27 3HG GLU 27 18.570 11.090 -22.494
204 H CYS 28 H CYS 28 23.229 9.640 -21.287
205 HA CYS 28 HA CYS 28 23.397 7.849 -19.205
206 HB2 CYS 28 2HB CYS 28 25.719 9.366 -20.414
207 HB3 CYS 28 3HB CYS 28 25.805 7.821 -19.577
208 HG CYS 28 HG CYS 28 25.512 6.388 -21.677
209 H ALA 29 H ALA 29 24.492 11.222 -19.262
210 HA ALA 29 HA ALA 29 25.664 11.298 -16.726
211 HB1 ALA 29 1HB ALA 29 24.677 13.829 -17.036
212 HB2 ALA 29 2HB ALA 29 26.201 13.239 -17.700
213 HB3 ALA 29 3HB ALA 29 24.748 13.248 -18.700
214 H ALA 30 H ALA 30 22.350 12.163 -17.707
215 HA ALA 30 HA ALA 30 21.363 12.900 -15.221
216 HB1 ALA 30 1HB ALA 30 20.311 12.486 -17.784
217 HB2 ALA 30 2HB ALA 30 19.346 11.488 -16.696
218 HB3 ALA 30 3HB ALA 30 19.507 13.218 -16.395
219 H PHE 31 H PHE 31 21.692 9.694 -16.654
220 HA PHE 31 HA PHE 31 20.243 8.278 -14.691
221 HB2 PHE 31 2HB PHE 31 22.468 7.375 -16.529
222 HB3 PHE 31 3HB PHE 31 21.494 6.287 -15.545
223 HD1 PHE 31 HD1 PHE 31 18.836 7.646 -15.887
224 HD2 PHE 31 HD2 PHE 31 21.889 6.660 -18.684
225 HE1 PHE 31 HE1 PHE 31 17.153 7.533 -17.678
226 HE2 PHE 31 HE2 PHE 31 20.211 6.546 -20.480
227 HZ PHE 31 HZ PHE 31 17.840 6.983 -19.979
228 H GLU 32 H GLU 32 23.730 8.880 -15.057
229 HA GLU 32 HA GLU 32 24.633 7.482 -12.839
230 HB2 GLU 32 2HB GLU 32 25.956 8.704 -14.697
231 HB3 GLU 32 3HB GLU 32 25.841 10.111 -13.650
232 HG2 GLU 32 2HG GLU 32 26.736 8.258 -11.900
233 HG3 GLU 32 3HG GLU 32 27.480 7.691 -13.394
234 H LYS 33 H LYS 33 23.722 10.918 -13.043
235 HA LYS 33 HA LYS 33 24.096 11.456 -10.292
236 HB2 LYS 33 2HB LYS 33 23.091 12.864 -12.634
237 HB3 LYS 33 3HB LYS 33 22.187 13.270 -11.181
238 HG2 LYS 33 2HG LYS 33 23.922 14.851 -11.344
239 HG3 LYS 33 3HG LYS 33 24.404 13.727 -10.071
240 HD2 LYS 33 2HD LYS 33 25.471 12.568 -12.312
241 HD3 LYS 33 3HD LYS 33 25.650 14.290 -12.658
242 HE2 LYS 33 2HE LYS 33 27.604 13.856 -11.526
243 HE3 LYS 33 3HE LYS 33 26.558 14.385 -10.209
244 HZ1 LYS 33 3HZ LYS 33 27.798 12.378 -9.645
245 HZ2 LYS 33 1HZ LYS 33 27.088 11.556 -10.942
246 HZ3 LYS 33 2HZ LYS 33 26.132 12.085 -9.652
247 H GLU 34 H GLU 34 21.110 10.946 -12.175
248 HA GLU 34 HA GLU 34 19.267 11.082 -10.137
249 HB2 GLU 34 2HB GLU 34 19.338 9.453 -12.661
250 HB3 GLU 34 3HB GLU 34 17.978 9.342 -11.553
251 HG2 GLU 34 2HG GLU 34 17.426 11.624 -11.858
252 HG3 GLU 34 3HG GLU 34 18.935 11.942 -12.712
253 H ILE 35 H ILE 35 21.034 8.200 -11.241
254 HA ILE 35 HA ILE 35 19.915 6.396 -9.406
255 HB ILE 35 HB ILE 35 22.578 6.369 -10.820
256 HG12 ILE 35 2HG1 ILE 35 20.474 6.175 -12.173
257 HG13 ILE 35 3HG1 ILE 35 21.539 4.779 -12.295
258 HG21 ILE 35 1HG2 ILE 35 22.267 3.807 -10.181
259 HG22 ILE 35 2HG2 ILE 35 23.129 4.940 -9.141
260 HG23 ILE 35 3HG2 ILE 35 21.451 4.525 -8.792
261 HD11 ILE 35 3HD1 ILE 35 19.117 4.942 -10.518
262 HD12 ILE 35 1HD1 ILE 35 19.161 4.180 -12.107
263 HD13 ILE 35 2HD1 ILE 35 20.138 3.530 -10.790
264 H ALA 36 H ALA 36 22.828 8.406 -9.216
265 HA ALA 36 HA ALA 36 23.902 7.467 -6.845
266 HB1 ALA 36 1HB ALA 36 25.252 9.308 -6.870
267 HB2 ALA 36 2HB ALA 36 24.679 9.337 -8.538
268 HB3 ALA 36 3HB ALA 36 23.946 10.399 -7.335
269 H ALA 37 H ALA 37 21.540 10.100 -7.271
270 HA ALA 37 HA ALA 37 21.200 10.592 -4.503
271 HB1 ALA 37 1HB ALA 37 20.554 12.007 -6.630
272 HB2 ALA 37 2HB ALA 37 19.005 11.190 -6.419
273 HB3 ALA 37 3HB ALA 37 19.668 12.174 -5.114
274 H PHE 38 H PHE 38 19.611 8.447 -6.786
275 HA PHE 38 HA PHE 38 17.363 7.763 -5.274
276 HB2 PHE 38 2HB PHE 38 18.517 6.948 -7.704
277 HB3 PHE 38 3HB PHE 38 18.369 5.485 -6.736
278 HD1 PHE 38 HD2 PHE 38 16.190 8.496 -6.953
279 HD2 PHE 38 HD1 PHE 38 16.576 4.303 -7.572
280 HE1 PHE 38 HE2 PHE 38 13.801 8.365 -7.526
281 HE2 PHE 38 HE1 PHE 38 14.187 4.165 -8.147
282 HZ PHE 38 HZ PHE 38 12.796 6.197 -8.124
283 H GLU 39 H GLU 39 20.488 6.062 -5.514
284 HA GLU 39 HA GLU 39 19.906 4.139 -3.539
285 HB2 GLU 39 2HB GLU 39 22.351 3.741 -3.504
286 HB3 GLU 39 3HB GLU 39 21.688 3.772 -5.132
287 HG2 GLU 39 2HG GLU 39 22.476 6.084 -5.390
288 HG3 GLU 39 3HG GLU 39 23.183 6.006 -3.777
289 H SER 40 H SER 40 21.456 7.307 -3.383
290 HA SER 40 HA SER 40 22.292 7.160 -0.696
291 HB2 SER 40 2HB SER 40 23.297 8.875 -1.938
292 HB3 SER 40 3HB SER 40 21.757 9.435 -2.589
293 HG SER 40 HG SER 40 22.444 10.854 -0.992
294 H GLU 41 H GLU 41 19.239 7.968 -2.185
295 HA GLU 41 HA GLU 41 18.089 9.037 0.233
296 HB2 GLU 41 2HB GLU 41 17.219 8.628 -2.562
297 HB3 GLU 41 3HB GLU 41 15.947 8.551 -1.350
298 HG2 GLU 41 2HG GLU 41 16.798 10.768 -0.498
299 HG3 GLU 41 3HG GLU 41 17.789 10.843 -1.953
300 H LEU 42 H LEU 42 18.088 5.980 -1.494
301 HA LEU 42 HA LEU 42 16.030 4.748 0.025
302 HB2 LEU 42 2HB LEU 42 18.260 3.629 -1.656
303 HB3 LEU 42 3HB LEU 42 17.043 2.621 -0.875
304 HG LEU 42 HG LEU 42 16.158 4.807 -2.703
305 HD11 LEU 42 1HD1 LEU 42 17.217 2.129 -3.595
306 HD12 LEU 42 2HD1 LEU 42 17.890 3.712 -3.984
307 HD13 LEU 42 3HD1 LEU 42 16.305 3.252 -4.605
308 HD21 LEU 42 3HD2 LEU 42 14.477 2.928 -3.214
309 HD22 LEU 42 1HD2 LEU 42 14.374 3.741 -1.652
310 HD23 LEU 42 2HD2 LEU 42 15.127 2.151 -1.771
311 H GLN 43 H GLN 43 19.499 5.053 0.416
312 HA GLN 43 HA GLN 43 19.854 3.092 2.405
313 HB2 GLN 43 2HB GLN 43 21.993 3.996 2.731
314 HB3 GLN 43 3HB GLN 43 21.634 4.338 1.044
315 HG2 GLN 43 2HG GLN 43 22.218 6.431 1.485
316 HG3 GLN 43 3HG GLN 43 20.688 6.566 2.349
317 HE21 GLN 43 1HE2 GLN 43 21.436 8.027 3.842
318 HE22 GLN 43 2HE2 GLN 43 22.577 7.616 5.072
319 H ALA 44 H ALA 44 18.446 6.224 2.492
320 HA ALA 44 HA ALA 44 18.743 6.522 5.365
321 HB1 ALA 44 1HB ALA 44 18.692 8.386 3.510
322 HB2 ALA 44 2HB ALA 44 16.950 8.278 3.766
323 HB3 ALA 44 3HB ALA 44 18.016 8.677 5.113
324 H TYR 45 H TYR 45 16.531 5.145 3.153
325 HA TYR 45 HA TYR 45 14.182 5.402 4.776
326 HB2 TYR 45 2HB TYR 45 14.899 4.093 2.220
327 HB3 TYR 45 3HB TYR 45 13.575 3.356 3.116
328 HD1 TYR 45 HD2 TYR 45 11.548 4.715 3.648
329 HD2 TYR 45 HD1 TYR 45 14.610 6.149 1.065
330 HE1 TYR 45 HE2 TYR 45 10.002 6.412 2.766
331 HE2 TYR 45 HE1 TYR 45 13.072 7.850 0.176
332 HH TYR 45 HH TYR 45 10.304 7.935 0.038
333 H LYS 46 H LYS 46 16.847 3.215 4.606
334 HA LYS 46 HA LYS 46 15.820 0.863 5.611
335 HB2 LYS 46 2HB LYS 46 18.463 2.206 5.722
336 HB3 LYS 46 3HB LYS 46 18.198 0.897 6.866
337 HG2 LYS 46 2HG LYS 46 17.365 0.231 4.156
338 HG3 LYS 46 3HG LYS 46 19.081 0.625 4.287
339 HD2 LYS 46 2HD LYS 46 17.733 -1.294 6.168
340 HD3 LYS 46 3HD LYS 46 18.412 -1.815 4.624
341 HE2 LYS 46 2HE LYS 46 20.466 -1.836 5.475
342 HE3 LYS 46 3HE LYS 46 20.301 -0.171 6.031
343 HZ1 LYS 46 3HZ LYS 46 20.671 -2.132 7.707
344 HZ2 LYS 46 1HZ LYS 46 18.990 -2.283 7.579
345 HZ3 LYS 46 2HZ LYS 46 19.671 -0.826 8.103
346 H GLY 47 H GLY 47 14.348 0.842 7.218
347 HA2 GLY 47 2HA GLY 47 15.219 1.919 9.819
348 HA3 GLY 47 3HA GLY 47 13.605 2.268 9.220
349 H LYS 48 H LYS 48 15.488 0.155 11.032
350 HA LYS 48 HA LYS 48 15.119 -1.863 12.026
351 HB2 LYS 48 2HB LYS 48 13.091 -0.284 12.691
352 HB3 LYS 48 3HB LYS 48 12.171 -1.475 11.781
353 HG2 LYS 48 2HG LYS 48 12.034 -2.336 13.895
354 HG3 LYS 48 3HG LYS 48 13.458 -3.182 13.285
355 HD2 LYS 48 2HD LYS 48 14.719 -1.104 14.291
356 HD3 LYS 48 3HD LYS 48 13.263 -0.976 15.281
357 HE2 LYS 48 2HE LYS 48 13.912 -3.671 15.363
358 HE3 LYS 48 3HE LYS 48 15.470 -2.851 15.452
359 HZ1 LYS 48 3HZ LYS 48 14.742 -1.626 17.345
360 HZ2 LYS 48 1HZ LYS 48 14.413 -3.260 17.638
361 HZ3 LYS 48 2HZ LYS 48 13.160 -2.210 17.202
362 H GLY 49 H GLY 49 15.736 -2.375 9.528
363 HA2 GLY 49 2HA GLY 49 15.582 -4.488 8.399
364 HA3 GLY 49 3HA GLY 49 13.868 -4.525 8.786
365 H ASN 50 H ASN 50 12.482 -2.931 7.692
366 HA ASN 50 HA ASN 50 11.617 -2.161 5.727
367 HB2 ASN 50 2HB ASN 50 14.197 -0.799 6.139
368 HB3 ASN 50 3HB ASN 50 13.587 -0.732 4.488
369 HD21 ASN 50 1HD2 ASN 50 12.640 1.140 4.168
370 HD22 ASN 50 2HD2 ASN 50 11.557 1.933 5.256
371 HA PRO 51 HA PRO 51 13.548 -5.546 3.230
372 HB2 PRO 51 2HB PRO 51 11.188 -6.738 2.613
373 HB3 PRO 51 3HB PRO 51 12.081 -7.086 4.098
374 HG2 PRO 51 2HG PRO 51 9.731 -5.279 3.680
375 HG3 PRO 51 3HG PRO 51 10.040 -6.426 4.997
376 HD2 PRO 51 2HD PRO 51 10.462 -3.763 5.255
377 HD3 PRO 51 3HD PRO 51 11.449 -4.972 6.100
378 H GLU 52 H GLU 52 11.212 -3.075 2.708
379 HA GLU 52 HA GLU 52 10.720 -3.524 -0.053
380 HB2 GLU 52 2HB GLU 52 9.890 -1.178 -0.041
381 HB3 GLU 52 3HB GLU 52 9.181 -2.178 1.218
382 HG2 GLU 52 2HG GLU 52 11.251 -1.145 2.575
383 HG3 GLU 52 3HG GLU 52 10.956 0.162 1.429
384 H VAL 53 H VAL 53 12.970 -1.415 1.701
385 HA VAL 53 HA VAL 53 14.100 -0.145 -0.528
386 HB VAL 53 HB VAL 53 15.556 -0.785 2.036
387 HG11 VAL 53 1HG1 VAL 53 16.303 0.600 -0.305
388 HG12 VAL 53 2HG1 VAL 53 16.067 1.810 0.959
389 HG13 VAL 53 3HG1 VAL 53 17.189 0.473 1.215
390 HG21 VAL 53 3HG2 VAL 53 13.483 0.180 2.697
391 HG22 VAL 53 1HG2 VAL 53 14.699 1.455 2.786
392 HG23 VAL 53 2HG2 VAL 53 13.574 1.401 1.428
393 H GLU 54 H GLU 54 14.452 -3.344 0.653
394 HA GLU 54 HA GLU 54 17.024 -4.015 -0.163
395 HB2 GLU 54 2HB GLU 54 14.551 -5.752 -0.256
396 HB3 GLU 54 3HB GLU 54 16.212 -6.328 -0.291
397 HG2 GLU 54 2HG GLU 54 15.134 -4.701 1.985
398 HG3 GLU 54 3HG GLU 54 14.984 -6.456 1.923
399 H ALA 55 H ALA 55 13.993 -4.410 -2.000
400 HA ALA 55 HA ALA 55 15.193 -5.254 -4.392
401 HB1 ALA 55 1HB ALA 55 12.585 -3.769 -4.111
402 HB2 ALA 55 2HB ALA 55 13.073 -4.823 -5.439
403 HB3 ALA 55 3HB ALA 55 12.787 -5.500 -3.836
404 H LEU 56 H LEU 56 13.965 -2.025 -3.501
405 HA LEU 56 HA LEU 56 14.680 -0.651 -5.783
406 HB2 LEU 56 2HB LEU 56 14.863 0.421 -2.973
407 HB3 LEU 56 3HB LEU 56 14.653 1.359 -4.450
408 HG LEU 56 HG LEU 56 12.591 -0.661 -3.668
409 HD11 LEU 56 1HD1 LEU 56 13.312 1.154 -1.827
410 HD12 LEU 56 2HD1 LEU 56 11.653 0.598 -2.047
411 HD13 LEU 56 3HD1 LEU 56 12.176 2.118 -2.770
412 HD21 LEU 56 3HD2 LEU 56 12.927 1.281 -5.709
413 HD22 LEU 56 1HD2 LEU 56 11.579 1.787 -4.690
414 HD23 LEU 56 2HD2 LEU 56 11.566 0.190 -5.440
415 H ARG 57 H ARG 57 16.643 -1.192 -2.867
416 HA ARG 57 HA ARG 57 18.915 0.214 -3.696
417 HB2 ARG 57 2HB ARG 57 18.721 -0.430 -1.404
418 HB3 ARG 57 3HB ARG 57 18.589 -2.132 -1.828
419 HG2 ARG 57 2HG ARG 57 21.055 -0.719 -2.657
420 HG3 ARG 57 3HG ARG 57 20.840 -1.045 -0.936
421 HD2 ARG 57 2HD ARG 57 20.127 -3.384 -2.389
422 HD3 ARG 57 3HD ARG 57 21.687 -2.818 -2.983
423 HE ARG 57 HE ARG 57 21.582 -2.846 -0.136
424 HH11 ARG 57 1HH1 ARG 57 22.003 -4.865 -2.940
425 HH12 ARG 57 2HH1 ARG 57 22.936 -6.061 -2.101
426 HH21 ARG 57 1HH2 ARG 57 22.809 -4.413 0.980
427 HH22 ARG 57 2HH2 ARG 57 23.392 -5.803 0.129
428 H LYS 58 H LYS 58 18.025 -3.189 -4.128
429 HA LYS 58 HA LYS 58 20.379 -4.103 -5.297
430 HB2 LYS 58 2HB LYS 58 17.540 -4.964 -5.309
431 HB3 LYS 58 3HB LYS 58 18.566 -5.622 -6.576
432 HG2 LYS 58 2HG LYS 58 19.951 -5.814 -4.097
433 HG3 LYS 58 3HG LYS 58 18.324 -6.469 -3.896
434 HD2 LYS 58 2HD LYS 58 18.736 -8.234 -5.235
435 HD3 LYS 58 3HD LYS 58 19.685 -7.274 -6.373
436 HE2 LYS 58 2HE LYS 58 21.439 -7.251 -4.437
437 HE3 LYS 58 3HE LYS 58 20.549 -8.665 -3.874
438 HZ1 LYS 58 3HZ LYS 58 21.483 -8.495 -6.666
439 HZ2 LYS 58 1HZ LYS 58 21.111 -9.869 -5.751
440 HZ3 LYS 58 2HZ LYS 58 22.532 -9.006 -5.440
441 H GLU 59 H GLU 59 17.428 -2.959 -6.945
442 HA GLU 59 HA GLU 59 18.374 -3.096 -9.551
443 HB2 GLU 59 2HB GLU 59 16.416 -1.136 -8.343
444 HB3 GLU 59 3HB GLU 59 16.658 -1.366 -10.069
445 HG2 GLU 59 2HG GLU 59 16.173 -3.901 -8.865
446 HG3 GLU 59 3HG GLU 59 14.929 -2.767 -8.341
447 H ALA 60 H ALA 60 18.349 -0.252 -7.400
448 HA ALA 60 HA ALA 60 19.608 1.565 -9.041
449 HB1 ALA 60 1HB ALA 60 18.719 1.635 -6.502
450 HB2 ALA 60 2HB ALA 60 20.461 1.637 -6.221
451 HB3 ALA 60 3HB ALA 60 19.728 2.891 -7.221
452 H ALA 61 H ALA 61 21.166 -0.665 -6.739
453 HA ALA 61 HA ALA 61 23.807 0.039 -7.214
454 HB1 ALA 61 1HB ALA 61 22.867 -1.533 -5.444
455 HB2 ALA 61 2HB ALA 61 22.956 -2.790 -6.679
456 HB3 ALA 61 3HB ALA 61 24.423 -1.963 -6.156
457 H ALA 62 H ALA 62 21.791 -2.346 -8.896
458 HA ALA 62 HA ALA 62 23.744 -3.386 -10.601
459 HB1 ALA 62 1HB ALA 62 21.284 -3.327 -12.003
460 HB2 ALA 62 2HB ALA 62 22.027 -4.678 -11.145
461 HB3 ALA 62 3HB ALA 62 20.926 -3.594 -10.296
462 H ILE 63 H ILE 63 21.505 -0.670 -11.093
463 HA ILE 63 HA ILE 63 22.267 -0.034 -13.709
464 HB ILE 63 HB ILE 63 21.288 1.857 -11.567
465 HG12 ILE 63 2HG1 ILE 63 19.723 0.369 -13.685
466 HG13 ILE 63 3HG1 ILE 63 19.807 -0.105 -11.992
467 HG21 ILE 63 1HG2 ILE 63 21.227 2.123 -14.570
468 HG22 ILE 63 2HG2 ILE 63 20.569 3.273 -13.407
469 HG23 ILE 63 3HG2 ILE 63 22.309 2.995 -13.484
470 HD11 ILE 63 3HD1 ILE 63 18.666 2.465 -13.063
471 HD12 ILE 63 1HD1 ILE 63 17.753 1.084 -12.454
472 HD13 ILE 63 2HD1 ILE 63 18.772 2.020 -11.360
473 H ARG 64 H ARG 64 23.514 1.131 -10.599
474 HA ARG 64 HA ARG 64 25.310 3.031 -11.593
475 HB2 ARG 64 2HB ARG 64 24.558 2.444 -9.142
476 HB3 ARG 64 3HB ARG 64 25.986 1.418 -9.165
477 HG2 ARG 64 2HG ARG 64 27.135 3.624 -10.037
478 HG3 ARG 64 3HG ARG 64 25.772 4.378 -9.207
479 HD2 ARG 64 2HD ARG 64 26.596 2.555 -7.362
480 HD3 ARG 64 3HD ARG 64 28.124 3.002 -8.120
481 HE ARG 64 HE ARG 64 26.494 4.635 -6.411
482 HH11 ARG 64 1HH1 ARG 64 28.877 4.651 -8.949
483 HH12 ARG 64 2HH1 ARG 64 29.474 6.229 -8.556
484 HH21 ARG 64 1HH2 ARG 64 27.272 6.713 -5.884
485 HH22 ARG 64 2HH2 ARG 64 28.561 7.401 -6.813
486 H ASP 65 H ASP 65 25.796 -0.406 -10.838
487 HA ASP 65 HA ASP 65 28.523 -0.541 -11.435
488 HB2 ASP 65 2HB ASP 65 26.325 -2.601 -11.518
489 HB3 ASP 65 3HB ASP 65 27.994 -3.006 -11.909
490 H GLU 66 H GLU 66 25.689 -0.999 -13.513
491 HA GLU 66 HA GLU 66 27.050 -1.774 -15.836
492 HB2 GLU 66 2HB GLU 66 24.479 -0.193 -15.693
493 HB3 GLU 66 3HB GLU 66 25.030 -1.185 -17.036
494 HG2 GLU 66 2HG GLU 66 24.921 -2.703 -14.584
495 HG3 GLU 66 3HG GLU 66 23.368 -1.957 -14.955
496 H CYS 67 H CYS 67 25.973 1.447 -14.782
497 HA CYS 67 HA CYS 67 26.886 2.894 -16.982
498 HB2 CYS 67 2HB CYS 67 26.706 3.775 -14.093
499 HB3 CYS 67 3HB CYS 67 26.869 4.853 -15.474
500 HG CYS 67 HG CYS 67 24.388 4.668 -16.388
501 H GLN 68 H GLN 68 28.569 1.886 -14.049
502 HA GLN 68 HA GLN 68 30.957 3.334 -14.579
503 HB2 GLN 68 2HB GLN 68 30.426 0.938 -12.817
504 HB3 GLN 68 3HB GLN 68 31.953 1.809 -12.859
505 HG2 GLN 68 2HG GLN 68 31.078 3.669 -11.825
506 HG3 GLN 68 3HG GLN 68 29.427 3.295 -12.316
507 HE21 GLN 68 1HE2 GLN 68 31.659 3.187 -9.827
508 HE22 GLN 68 2HE2 GLN 68 30.801 2.144 -8.751
509 H ALA 69 H ALA 69 29.770 0.170 -15.473
510 HA ALA 69 HA ALA 69 32.313 -0.749 -16.470
511 HB1 ALA 69 1HB ALA 69 31.268 -2.763 -16.934
512 HB2 ALA 69 2HB ALA 69 30.354 -2.164 -15.549
513 HB3 ALA 69 3HB ALA 69 29.693 -2.007 -17.177
514 H TYR 70 H TYR 70 30.066 1.420 -17.591
515 HA TYR 70 HA TYR 70 30.582 0.796 -20.415
516 HB2 TYR 70 2HB TYR 70 28.543 2.645 -19.160
517 HB3 TYR 70 3HB TYR 70 28.742 2.391 -20.890
518 HD1 TYR 70 HD1 TYR 70 29.285 -0.642 -20.646
519 HD2 TYR 70 HD2 TYR 70 26.269 1.898 -19.047
520 HE1 TYR 70 HE1 TYR 70 27.738 -2.551 -20.546
521 HE2 TYR 70 HE2 TYR 70 24.714 -0.004 -18.941
522 HH TYR 70 HH TYR 70 24.391 -2.147 -19.434
523 H ARG 71 H ARG 71 30.925 3.296 -17.968
524 HA ARG 71 HA ARG 71 32.798 4.690 -19.750
525 HB2 ARG 71 2HB ARG 71 30.360 5.725 -19.305
526 HB3 ARG 71 3HB ARG 71 31.194 6.357 -17.892
527 HG2 ARG 71 2HG ARG 71 32.525 7.736 -19.118
528 HG3 ARG 71 3HG ARG 71 32.512 6.676 -20.529
529 HD2 ARG 71 2HD ARG 71 30.335 7.389 -21.150
530 HD3 ARG 71 3HD ARG 71 30.093 8.210 -19.609
531 HE ARG 71 HE ARG 71 32.251 9.464 -20.684
532 HH11 ARG 71 1HH1 ARG 71 29.026 8.783 -21.806
533 HH12 ARG 71 2HH1 ARG 71 28.936 10.195 -22.806
534 HH21 ARG 71 1HH2 ARG 71 32.144 11.326 -21.997
535 HH22 ARG 71 2HH2 ARG 71 30.710 11.640 -22.915
536 H HIS 72 H HIS 72 33.502 2.836 -17.794
537 HA HIS 72 HA HIS 72 35.421 4.261 -16.323
538 HB2 HIS 72 2HB HIS 72 32.925 4.390 -15.111
539 HB3 HIS 72 3HB HIS 72 33.743 3.092 -14.247
540 HD1 HIS 72 HD1 HIS 72 33.039 5.960 -13.072
541 HD2 HIS 72 HD2 HIS 72 36.753 4.709 -14.452
542 HE1 HIS 72 HE1 HIS 72 34.717 7.443 -11.926
543 H ASN 73 H ASN 73 35.149 1.917 -17.989
544 HA ASN 73 HA ASN 73 36.485 0.007 -16.228
545 HB2 ASN 73 2HB ASN 73 34.295 -0.905 -16.207
546 HB3 ASN 73 3HB ASN 73 34.069 -0.601 -17.927
547 HD21 ASN 73 1HD2 ASN 73 33.907 -2.480 -18.909
548 HD22 ASN 73 2HD2 ASN 73 34.945 -3.841 -18.676
Start of MODEL 5
1 H1 MET 1 H MET 1 2.378 -0.754 -4.346
2 HA MET 1 HA MET 1 1.678 0.040 -2.328
3 HB2 MET 1 2HB MET 1 3.986 -1.725 -1.528
4 HB3 MET 1 3HB MET 1 2.950 -0.939 -0.343
5 HG2 MET 1 2HG MET 1 1.015 -2.100 -1.235
6 HG3 MET 1 3HG MET 1 2.019 -2.852 -2.471
7 HE1 MET 1 3HE MET 1 0.113 -3.425 0.293
8 HE2 MET 1 1HE MET 1 0.870 -4.636 1.330
9 HE3 MET 1 2HE MET 1 1.240 -2.926 1.556
10 H GLY 2 H GLY 2 1.814 2.074 -1.661
11 HA2 GLY 2 2HA GLY 2 2.704 3.987 -0.715
12 HA3 GLY 2 3HA GLY 2 4.220 3.124 -0.497
13 H SER 3 H SER 3 5.771 4.309 -1.397
14 HA SER 3 HA SER 3 5.236 5.639 -3.957
15 HB2 SER 3 2HB SER 3 6.502 6.532 -1.637
16 HB3 SER 3 3HB SER 3 7.822 6.234 -2.769
17 HG SER 3 HG SER 3 6.425 8.356 -2.716
18 H TRP 4 H TRP 4 5.776 2.760 -3.657
19 HA TRP 4 HA TRP 4 8.450 2.347 -4.662
20 HB2 TRP 4 2HB TRP 4 7.681 0.581 -3.314
21 HB3 TRP 4 3HB TRP 4 6.109 0.542 -4.107
22 HD1 TRP 4 HD1 TRP 4 5.983 -0.679 -6.516
23 HE1 TRP 4 HE1 TRP 4 7.479 -2.485 -7.576
24 HE3 TRP 4 HE3 TRP 4 10.061 -0.246 -3.464
25 HZ2 TRP 4 HZ2 TRP 4 10.049 -3.581 -7.172
26 HZ3 TRP 4 HZ3 TRP 4 11.997 -1.711 -3.868
27 HH2 TRP 4 HH2 TRP 4 11.988 -3.344 -5.683
28 H ALA 5 H ALA 5 5.171 2.386 -5.954
29 HA ALA 5 HA ALA 5 5.582 1.347 -8.478
30 HB1 ALA 5 1HB ALA 5 3.752 3.111 -9.120
31 HB2 ALA 5 2HB ALA 5 3.369 1.768 -8.042
32 HB3 ALA 5 3HB ALA 5 3.691 3.369 -7.376
33 H GLU 6 H GLU 6 5.860 4.765 -7.497
34 HA GLU 6 HA GLU 6 6.657 5.790 -9.961
35 HB2 GLU 6 2HB GLU 6 6.457 6.728 -7.273
36 HB3 GLU 6 3HB GLU 6 8.017 7.224 -7.915
37 HG2 GLU 6 2HG GLU 6 7.107 8.655 -9.404
38 HG3 GLU 6 3HG GLU 6 5.685 7.649 -9.670
39 H PHE 7 H PHE 7 8.674 4.694 -7.242
40 HA PHE 7 HA PHE 7 11.158 5.167 -8.435
41 HB2 PHE 7 2HB PHE 7 10.176 3.466 -6.200
42 HB3 PHE 7 3HB PHE 7 11.779 3.117 -6.838
43 HD1 PHE 7 HD2 PHE 7 9.850 6.218 -6.053
44 HD2 PHE 7 HD1 PHE 7 13.457 4.010 -5.571
45 HE1 PHE 7 HE2 PHE 7 10.783 8.046 -4.696
46 HE2 PHE 7 HE1 PHE 7 14.395 5.834 -4.211
47 HZ PHE 7 HZ PHE 7 13.059 7.856 -3.773
48 H LYS 8 H LYS 8 8.969 2.429 -8.654
49 HA LYS 8 HA LYS 8 10.739 0.642 -9.939
50 HB2 LYS 8 2HB LYS 8 7.999 0.672 -9.139
51 HB3 LYS 8 3HB LYS 8 8.075 0.154 -10.818
52 HG2 LYS 8 2HG LYS 8 9.577 -1.079 -8.518
53 HG3 LYS 8 3HG LYS 8 8.149 -1.747 -9.311
54 HD2 LYS 8 2HD LYS 8 10.128 -1.139 -11.284
55 HD3 LYS 8 3HD LYS 8 10.861 -2.111 -10.006
56 HE2 LYS 8 2HE LYS 8 8.980 -3.720 -10.236
57 HE3 LYS 8 3HE LYS 8 8.393 -2.780 -11.607
58 HZ1 LYS 8 3HZ LYS 8 10.988 -3.219 -12.233
59 HZ2 LYS 8 1HZ LYS 8 9.679 -4.121 -12.813
60 HZ3 LYS 8 2HZ LYS 8 10.556 -4.668 -11.474
61 H GLN 9 H GLN 9 8.359 2.950 -11.200
62 HA GLN 9 HA GLN 9 8.694 2.319 -13.922
63 HB2 GLN 9 2HB GLN 9 7.084 4.030 -12.461
64 HB3 GLN 9 3HB GLN 9 8.079 5.126 -13.410
65 HG2 GLN 9 2HG GLN 9 7.428 3.638 -15.407
66 HG3 GLN 9 3HG GLN 9 6.148 3.046 -14.349
67 HE21 GLN 9 1HE2 GLN 9 4.856 3.983 -16.149
68 HE22 GLN 9 2HE2 GLN 9 4.413 5.649 -16.031
69 H ARG 10 H ARG 10 9.990 5.100 -12.095
70 HA ARG 10 HA ARG 10 11.627 6.128 -14.074
71 HB2 ARG 10 2HB ARG 10 12.099 6.110 -11.087
72 HB3 ARG 10 3HB ARG 10 12.935 7.148 -12.235
73 HG2 ARG 10 2HG ARG 10 11.262 8.611 -12.280
74 HG3 ARG 10 3HG ARG 10 10.050 7.343 -12.471
75 HD2 ARG 10 2HD ARG 10 9.408 7.901 -10.401
76 HD3 ARG 10 3HD ARG 10 10.832 7.004 -9.875
77 HE ARG 10 HE ARG 10 11.720 8.976 -9.170
78 HH11 ARG 10 1HH1 ARG 10 9.338 9.658 -11.615
79 HH12 ARG 10 2HH1 ARG 10 9.479 11.378 -11.458
80 HH21 ARG 10 1HH2 ARG 10 11.916 11.238 -8.954
81 HH22 ARG 10 2HH2 ARG 10 10.947 12.275 -9.945
82 H LEU 11 H LEU 11 12.374 3.656 -11.644
83 HA LEU 11 HA LEU 11 15.081 3.317 -12.290
84 HB2 LEU 11 2HB LEU 11 13.015 1.594 -10.988
85 HB3 LEU 11 3HB LEU 11 14.602 0.928 -11.367
86 HG LEU 11 HG LEU 11 14.062 3.287 -9.564
87 HD11 LEU 11 1HD1 LEU 11 14.955 1.702 -7.824
88 HD12 LEU 11 2HD1 LEU 11 14.753 0.413 -9.010
89 HD13 LEU 11 3HD1 LEU 11 13.350 1.323 -8.450
90 HD21 LEU 11 3HD2 LEU 11 16.169 3.685 -10.480
91 HD22 LEU 11 1HD2 LEU 11 16.581 1.970 -10.520
92 HD23 LEU 11 2HD2 LEU 11 16.521 2.827 -8.980
93 H ALA 12 H ALA 12 12.169 1.759 -13.555
94 HA ALA 12 HA ALA 12 13.419 -0.164 -15.165
95 HB1 ALA 12 1HB ALA 12 10.736 1.115 -15.117
96 HB2 ALA 12 2HB ALA 12 11.197 0.188 -16.545
97 HB3 ALA 12 3HB ALA 12 11.184 -0.583 -14.959
98 H ALA 13 H ALA 13 12.366 3.145 -15.917
99 HA ALA 13 HA ALA 13 13.105 3.115 -18.633
100 HB1 ALA 13 1HB ALA 13 12.765 5.380 -16.680
101 HB2 ALA 13 2HB ALA 13 13.093 5.618 -18.397
102 HB3 ALA 13 3HB ALA 13 11.614 4.805 -17.886
103 H ILE 14 H ILE 14 14.868 4.075 -15.717
104 HA ILE 14 HA ILE 14 17.153 5.098 -16.992
105 HB ILE 14 HB ILE 14 16.908 3.807 -14.273
106 HG12 ILE 14 2HG1 ILE 14 17.196 6.744 -14.699
107 HG13 ILE 14 3HG1 ILE 14 15.629 6.015 -15.032
108 HG21 ILE 14 1HG2 ILE 14 19.209 4.762 -15.737
109 HG22 ILE 14 2HG2 ILE 14 18.987 5.649 -14.231
110 HG23 ILE 14 3HG2 ILE 14 19.131 3.892 -14.206
111 HD11 ILE 14 3HD1 ILE 14 16.769 6.759 -12.536
112 HD12 ILE 14 1HD1 ILE 14 15.158 6.128 -12.880
113 HD13 ILE 14 2HD1 ILE 14 16.488 5.018 -12.543
114 H LYS 15 H LYS 15 16.357 1.837 -15.866
115 HA LYS 15 HA LYS 15 18.869 0.678 -16.452
116 HB2 LYS 15 2HB LYS 15 16.491 -0.163 -15.275
117 HB3 LYS 15 3HB LYS 15 16.632 -1.163 -16.715
118 HG2 LYS 15 2HG LYS 15 19.115 -1.432 -15.816
119 HG3 LYS 15 3HG LYS 15 18.316 -1.086 -14.280
120 HD2 LYS 15 2HD LYS 15 17.886 -3.288 -14.236
121 HD3 LYS 15 3HD LYS 15 16.619 -2.909 -15.404
122 HE2 LYS 15 2HE LYS 15 18.797 -3.133 -17.019
123 HE3 LYS 15 3HE LYS 15 19.171 -4.315 -15.766
124 HZ1 LYS 15 3HZ LYS 15 17.967 -5.453 -17.415
125 HZ2 LYS 15 1HZ LYS 15 16.799 -4.235 -17.537
126 HZ3 LYS 15 2HZ LYS 15 16.867 -5.206 -16.154
127 H THR 16 H THR 16 15.856 0.923 -18.300
128 HA THR 16 HA THR 16 16.580 -0.636 -20.494
129 HB THR 16 HB THR 16 14.882 1.851 -20.687
130 HG1 THR 16 HG1 THR 16 14.274 -0.716 -19.629
131 HG21 THR 16 3HG2 THR 16 15.435 -0.458 -22.395
132 HG22 THR 16 1HG2 THR 16 14.762 1.118 -22.807
133 HG23 THR 16 2HG2 THR 16 13.715 -0.146 -22.162
134 H ARG 17 H ARG 17 16.748 2.920 -20.210
135 HA ARG 17 HA ARG 17 18.123 3.326 -22.626
136 HB2 ARG 17 2HB ARG 17 17.619 4.947 -20.176
137 HB3 ARG 17 3HB ARG 17 18.864 5.500 -21.288
138 HG2 ARG 17 2HG ARG 17 16.957 6.619 -21.989
139 HG3 ARG 17 3HG ARG 17 17.071 5.257 -23.105
140 HD2 ARG 17 2HD ARG 17 15.485 4.019 -21.617
141 HD3 ARG 17 3HD ARG 17 15.274 5.510 -20.700
142 HE ARG 17 HE ARG 17 14.791 5.887 -23.486
143 HH11 ARG 17 1HH1 ARG 17 13.382 4.703 -20.531
144 HH12 ARG 17 2HH1 ARG 17 11.751 4.984 -21.043
145 HH21 ARG 17 1HH2 ARG 17 12.648 6.261 -24.171
146 HH22 ARG 17 2HH2 ARG 17 11.334 5.869 -23.114
147 H CYS 18 H CYS 18 19.241 2.638 -19.373
148 HA CYS 18 HA CYS 18 21.978 3.226 -19.826
149 HB2 CYS 18 2HB CYS 18 21.233 3.159 -17.566
150 HB3 CYS 18 3HB CYS 18 20.558 1.546 -17.763
151 HG CYS 18 HG CYS 18 22.611 0.347 -16.820
152 H GLN 19 H GLN 19 19.999 0.370 -20.281
153 HA GLN 19 HA GLN 19 22.186 -1.413 -20.733
154 HB2 GLN 19 2HB GLN 19 19.246 -1.638 -21.390
155 HB3 GLN 19 3HB GLN 19 20.408 -2.937 -21.620
156 HG2 GLN 19 2HG GLN 19 20.508 -1.840 -18.939
157 HG3 GLN 19 3HG GLN 19 18.908 -2.450 -19.359
158 HE21 GLN 19 1HE2 GLN 19 22.322 -3.297 -19.228
159 HE22 GLN 19 2HE2 GLN 19 22.081 -4.994 -19.014
160 H ALA 20 H ALA 20 19.960 0.379 -22.825
161 HA ALA 20 HA ALA 20 21.089 -0.633 -25.253
162 HB1 ALA 20 1HB ALA 20 19.149 1.565 -24.618
163 HB2 ALA 20 2HB ALA 20 19.752 1.309 -26.256
164 HB3 ALA 20 3HB ALA 20 18.857 0.030 -25.436
165 H LEU 21 H LEU 21 21.678 2.116 -23.183
166 HA LEU 21 HA LEU 21 23.198 3.809 -23.242
167 HB2 LEU 21 2HB LEU 21 24.727 1.794 -24.882
168 HB3 LEU 21 3HB LEU 21 25.413 3.238 -24.141
169 HG LEU 21 HG LEU 21 24.128 1.037 -22.539
170 HD11 LEU 21 1HD1 LEU 21 26.364 0.666 -24.054
171 HD12 LEU 21 2HD1 LEU 21 25.991 -0.201 -22.565
172 HD13 LEU 21 3HD1 LEU 21 27.047 1.210 -22.521
173 HD21 LEU 21 3HD2 LEU 21 24.500 3.417 -21.638
174 HD22 LEU 21 1HD2 LEU 21 26.213 2.997 -21.647
175 HD23 LEU 21 2HD2 LEU 21 25.080 2.058 -20.674
176 H GLY 22 H GLY 22 21.189 3.590 -25.436
177 HA2 GLY 22 2HA GLY 22 22.628 5.202 -27.454
178 HA3 GLY 22 3HA GLY 22 21.299 4.124 -27.855
179 H GLY 23 H GLY 23 20.093 5.135 -25.167
180 HA2 GLY 23 2HA GLY 23 18.187 6.840 -26.209
181 HA3 GLY 23 3HA GLY 23 18.612 6.763 -24.506
182 H SER 24 H SER 24 21.222 7.714 -24.592
183 HA SER 24 HA SER 24 21.631 10.048 -26.062
184 HB2 SER 24 2HB SER 24 19.877 10.352 -23.706
185 HB3 SER 24 3HB SER 24 21.202 11.511 -23.806
186 HG SER 24 HG SER 24 20.363 11.614 -26.154
187 H GLU 25 H GLU 25 23.754 10.302 -25.964
188 HA GLU 25 HA GLU 25 25.458 8.956 -24.257
189 HB2 GLU 25 2HB GLU 25 27.188 10.632 -24.972
190 HB3 GLU 25 3HB GLU 25 26.318 9.861 -26.290
191 HG2 GLU 25 2HG GLU 25 24.875 12.180 -25.637
192 HG3 GLU 25 3HG GLU 25 26.577 12.638 -25.670
193 H ALA 26 H ALA 26 23.817 11.990 -23.793
194 HA ALA 26 HA ALA 26 25.387 12.699 -21.461
195 HB1 ALA 26 1HB ALA 26 24.487 14.401 -23.051
196 HB2 ALA 26 2HB ALA 26 22.869 14.010 -22.468
197 HB3 ALA 26 3HB ALA 26 24.065 14.685 -21.362
198 H GLU 27 H GLU 27 22.280 11.261 -22.208
199 HA GLU 27 HA GLU 27 20.939 11.493 -19.816
200 HB2 GLU 27 2HB GLU 27 20.873 9.671 -22.096
201 HB3 GLU 27 3HB GLU 27 20.373 8.899 -20.598
202 HG2 GLU 27 2HG GLU 27 19.223 11.517 -21.499
203 HG3 GLU 27 3HG GLU 27 18.566 9.968 -22.025
204 H CYS 28 H CYS 28 23.630 9.407 -20.623
205 HA CYS 28 HA CYS 28 23.548 7.535 -18.609
206 HB2 CYS 28 2HB CYS 28 26.036 8.929 -19.619
207 HB3 CYS 28 3HB CYS 28 25.968 7.354 -18.837
208 HG CYS 28 HG CYS 28 25.829 6.066 -21.042
209 H ALA 29 H ALA 29 24.876 10.821 -18.464
210 HA ALA 29 HA ALA 29 25.883 10.718 -15.857
211 HB1 ALA 29 1HB ALA 29 24.971 13.336 -16.262
212 HB2 ALA 29 2HB ALA 29 26.596 12.706 -16.540
213 HB3 ALA 29 3HB ALA 29 25.421 12.727 -17.855
214 H ALA 30 H ALA 30 22.709 11.839 -17.018
215 HA ALA 30 HA ALA 30 21.618 12.574 -14.571
216 HB1 ALA 30 1HB ALA 30 19.707 11.303 -16.381
217 HB2 ALA 30 2HB ALA 30 19.753 12.950 -15.749
218 HB3 ALA 30 3HB ALA 30 20.729 12.517 -17.153
219 H PHE 31 H PHE 31 21.835 9.404 -16.093
220 HA PHE 31 HA PHE 31 20.147 8.030 -14.295
221 HB2 PHE 31 2HB PHE 31 22.430 7.038 -16.012
222 HB3 PHE 31 3HB PHE 31 21.327 5.985 -15.132
223 HD1 PHE 31 HD1 PHE 31 18.791 7.537 -15.596
224 HD2 PHE 31 HD2 PHE 31 21.949 6.418 -18.222
225 HE1 PHE 31 HE1 PHE 31 17.227 7.590 -17.494
226 HE2 PHE 31 HE2 PHE 31 20.390 6.470 -20.124
227 HZ PHE 31 HZ PHE 31 18.025 7.057 -19.762
228 H GLU 32 H GLU 32 23.691 8.351 -14.404
229 HA GLU 32 HA GLU 32 24.310 6.838 -12.163
230 HB2 GLU 32 2HB GLU 32 25.848 8.007 -13.910
231 HB3 GLU 32 3HB GLU 32 25.812 9.359 -12.788
232 HG2 GLU 32 2HG GLU 32 26.429 7.395 -11.081
233 HG3 GLU 32 3HG GLU 32 27.133 6.734 -12.556
234 H LYS 33 H LYS 33 23.682 10.336 -12.354
235 HA LYS 33 HA LYS 33 23.932 10.810 -9.578
236 HB2 LYS 33 2HB LYS 33 23.055 12.313 -11.946
237 HB3 LYS 33 3HB LYS 33 22.267 12.802 -10.452
238 HG2 LYS 33 2HG LYS 33 24.050 13.968 -9.867
239 HG3 LYS 33 3HG LYS 33 25.054 12.519 -9.953
240 HD2 LYS 33 2HD LYS 33 25.444 12.883 -12.312
241 HD3 LYS 33 3HD LYS 33 24.340 14.260 -12.312
242 HE2 LYS 33 2HE LYS 33 25.925 15.641 -11.567
243 HE3 LYS 33 3HE LYS 33 26.397 14.523 -10.288
244 HZ1 LYS 33 3HZ LYS 33 27.361 13.357 -12.543
245 HZ2 LYS 33 1HZ LYS 33 28.265 14.276 -11.447
246 HZ3 LYS 33 2HZ LYS 33 27.625 15.003 -12.833
247 H GLU 34 H GLU 34 21.032 10.537 -11.638
248 HA GLU 34 HA GLU 34 19.092 10.776 -9.697
249 HB2 GLU 34 2HB GLU 34 19.184 9.206 -12.258
250 HB3 GLU 34 3HB GLU 34 17.761 9.167 -11.227
251 HG2 GLU 34 2HG GLU 34 18.959 11.725 -12.242
252 HG3 GLU 34 3HG GLU 34 17.732 10.822 -13.128
253 H ILE 35 H ILE 35 20.700 7.794 -10.781
254 HA ILE 35 HA ILE 35 19.351 6.029 -9.075
255 HB ILE 35 HB ILE 35 22.103 5.862 -10.297
256 HG12 ILE 35 2HG1 ILE 35 20.083 5.838 -11.793
257 HG13 ILE 35 3HG1 ILE 35 21.078 4.390 -11.893
258 HG21 ILE 35 1HG2 ILE 35 20.722 4.053 -8.402
259 HG22 ILE 35 2HG2 ILE 35 21.575 3.310 -9.754
260 HG23 ILE 35 3HG2 ILE 35 22.444 4.356 -8.632
261 HD11 ILE 35 3HD1 ILE 35 18.651 3.940 -11.882
262 HD12 ILE 35 1HD1 ILE 35 19.517 3.161 -10.558
263 HD13 ILE 35 2HD1 ILE 35 18.567 4.616 -10.255
264 H ALA 36 H ALA 36 22.381 7.816 -8.625
265 HA ALA 36 HA ALA 36 23.165 6.746 -6.183
266 HB1 ALA 36 1HB ALA 36 23.883 8.987 -7.810
267 HB2 ALA 36 2HB ALA 36 23.832 9.478 -6.116
268 HB3 ALA 36 3HB ALA 36 24.848 8.125 -6.612
269 H ALA 37 H ALA 37 21.085 9.562 -6.818
270 HA ALA 37 HA ALA 37 20.601 10.153 -4.088
271 HB1 ALA 37 1HB ALA 37 18.587 11.408 -5.105
272 HB2 ALA 37 2HB ALA 37 20.217 11.938 -5.523
273 HB3 ALA 37 3HB ALA 37 19.291 10.956 -6.658
274 H PHE 38 H PHE 38 19.071 8.029 -6.407
275 HA PHE 38 HA PHE 38 16.643 7.593 -5.064
276 HB2 PHE 38 2HB PHE 38 18.059 6.457 -7.309
277 HB3 PHE 38 3HB PHE 38 17.325 5.182 -6.341
278 HD1 PHE 38 HD2 PHE 38 16.127 8.634 -7.030
279 HD2 PHE 38 HD1 PHE 38 15.499 4.458 -7.564
280 HE1 PHE 38 HE2 PHE 38 13.950 9.098 -8.078
281 HE2 PHE 38 HE1 PHE 38 13.322 4.916 -8.614
282 HZ PHE 38 HZ PHE 38 12.544 7.238 -8.871
283 H GLU 39 H GLU 39 19.631 5.646 -5.039
284 HA GLU 39 HA GLU 39 18.740 3.848 -3.049
285 HB2 GLU 39 2HB GLU 39 21.085 3.149 -2.901
286 HB3 GLU 39 3HB GLU 39 20.563 3.289 -4.574
287 HG2 GLU 39 2HG GLU 39 21.648 5.496 -4.699
288 HG3 GLU 39 3HG GLU 39 22.227 5.279 -3.048
289 H SER 40 H SER 40 20.557 6.864 -2.923
290 HA SER 40 HA SER 40 21.205 6.710 -0.161
291 HB2 SER 40 2HB SER 40 22.530 8.157 -1.520
292 HB3 SER 40 3HB SER 40 21.108 9.017 -2.109
293 HG SER 40 HG SER 40 22.347 9.146 0.415
294 H GLU 41 H GLU 41 18.407 7.747 -1.928
295 HA GLU 41 HA GLU 41 17.251 9.203 0.279
296 HB2 GLU 41 2HB GLU 41 16.396 8.498 -2.494
297 HB3 GLU 41 3HB GLU 41 15.167 8.964 -1.327
298 HG2 GLU 41 2HG GLU 41 17.490 10.747 -1.437
299 HG3 GLU 41 3HG GLU 41 16.530 10.683 -2.914
300 H LEU 42 H LEU 42 16.928 6.016 -1.177
301 HA LEU 42 HA LEU 42 14.687 5.242 0.430
302 HB2 LEU 42 2HB LEU 42 16.627 3.567 -1.159
303 HB3 LEU 42 3HB LEU 42 15.117 2.992 -0.454
304 HG LEU 42 HG LEU 42 15.100 5.226 -2.448
305 HD11 LEU 42 1HD1 LEU 42 15.672 2.363 -2.941
306 HD12 LEU 42 2HD1 LEU 42 16.166 3.794 -3.846
307 HD13 LEU 42 3HD1 LEU 42 14.530 3.160 -4.023
308 HD21 LEU 42 3HD2 LEU 42 12.897 3.961 -2.955
309 HD22 LEU 42 1HD2 LEU 42 13.000 4.966 -1.509
310 HD23 LEU 42 2HD2 LEU 42 13.161 3.214 -1.379
311 H GLN 43 H GLN 43 18.164 5.026 0.701
312 HA GLN 43 HA GLN 43 18.157 3.146 2.861
313 HB2 GLN 43 2HB GLN 43 20.487 3.398 2.907
314 HB3 GLN 43 3HB GLN 43 20.064 3.630 1.216
315 HG2 GLN 43 2HG GLN 43 21.355 5.443 1.367
316 HG3 GLN 43 3HG GLN 43 19.948 6.176 2.135
317 HE21 GLN 43 1HE2 GLN 43 20.175 6.963 4.114
318 HE22 GLN 43 2HE2 GLN 43 21.518 6.677 5.163
319 H ALA 44 H ALA 44 17.673 6.524 2.586
320 HA ALA 44 HA ALA 44 18.479 7.197 5.263
321 HB1 ALA 44 1HB ALA 44 16.645 8.918 3.659
322 HB2 ALA 44 2HB ALA 44 17.964 9.376 4.736
323 HB3 ALA 44 3HB ALA 44 18.318 8.714 3.140
324 H TYR 45 H TYR 45 15.646 5.948 3.766
325 HA TYR 45 HA TYR 45 13.596 6.857 5.370
326 HB2 TYR 45 2HB TYR 45 14.086 4.381 3.809
327 HB3 TYR 45 3HB TYR 45 12.790 4.318 4.999
328 HD1 TYR 45 HD1 TYR 45 11.455 6.809 4.897
329 HD2 TYR 45 HD2 TYR 45 13.246 4.668 1.685
330 HE1 TYR 45 HE1 TYR 45 9.943 7.930 3.314
331 HE2 TYR 45 HE2 TYR 45 11.739 5.784 0.093
332 HH TYR 45 HH TYR 45 9.002 7.273 0.888
333 H LYS 46 H LYS 46 15.381 3.808 5.878
334 HA LYS 46 HA LYS 46 15.871 2.626 7.758
335 HB2 LYS 46 2HB LYS 46 15.428 5.192 9.283
336 HB3 LYS 46 3HB LYS 46 16.427 3.823 9.754
337 HG2 LYS 46 2HG LYS 46 17.429 4.641 7.284
338 HG3 LYS 46 3HG LYS 46 17.103 6.129 8.175
339 HD2 LYS 46 2HD LYS 46 18.572 5.571 9.889
340 HD3 LYS 46 3HD LYS 46 18.536 3.852 9.491
341 HE2 LYS 46 2HE LYS 46 20.239 4.055 8.064
342 HE3 LYS 46 3HE LYS 46 19.517 5.464 7.288
343 HZ1 LYS 46 3HZ LYS 46 20.454 6.204 9.829
344 HZ2 LYS 46 1HZ LYS 46 20.976 6.749 8.315
345 HZ3 LYS 46 2HZ LYS 46 21.698 5.392 9.021
346 H GLY 47 H GLY 47 13.473 2.011 7.022
347 HA2 GLY 47 2HA GLY 47 11.744 2.316 9.398
348 HA3 GLY 47 3HA GLY 47 11.137 2.090 7.765
349 H LYS 48 H LYS 48 12.470 0.553 10.572
350 HA LYS 48 HA LYS 48 12.698 -1.629 11.192
351 HB2 LYS 48 2HB LYS 48 10.179 -1.334 10.734
352 HB3 LYS 48 3HB LYS 48 10.476 -2.245 9.259
353 HG2 LYS 48 2HG LYS 48 9.801 -3.887 10.723
354 HG3 LYS 48 3HG LYS 48 11.560 -3.983 10.845
355 HD2 LYS 48 2HD LYS 48 11.263 -2.307 12.803
356 HD3 LYS 48 3HD LYS 48 9.584 -2.852 12.791
357 HE2 LYS 48 2HE LYS 48 11.791 -4.863 12.815
358 HE3 LYS 48 3HE LYS 48 11.353 -4.038 14.309
359 HZ1 LYS 48 3HZ LYS 48 9.497 -5.231 14.494
360 HZ2 LYS 48 1HZ LYS 48 10.159 -6.264 13.329
361 HZ3 LYS 48 2HZ LYS 48 9.085 -5.043 12.864
362 H GLY 49 H GLY 49 14.758 -1.464 9.864
363 HA2 GLY 49 2HA GLY 49 16.235 -2.889 8.747
364 HA3 GLY 49 3HA GLY 49 14.861 -3.790 8.126
365 H ASN 50 H ASN 50 14.819 -3.732 5.987
366 HA ASN 50 HA ASN 50 14.493 -1.403 4.491
367 HB2 ASN 50 2HB ASN 50 16.820 -1.773 3.233
368 HB3 ASN 50 3HB ASN 50 16.657 -0.666 4.593
369 HD21 ASN 50 1HD2 ASN 50 18.433 -0.792 5.757
370 HD22 ASN 50 2HD2 ASN 50 19.215 -2.247 6.262
371 HA PRO 51 HA PRO 51 13.744 -5.627 2.557
372 HB2 PRO 51 2HB PRO 51 11.037 -5.437 2.479
373 HB3 PRO 51 3HB PRO 51 11.914 -6.103 3.862
374 HG2 PRO 51 2HG PRO 51 10.770 -3.363 3.487
375 HG3 PRO 51 3HG PRO 51 10.720 -4.410 4.917
376 HD2 PRO 51 2HD PRO 51 12.470 -2.357 4.674
377 HD3 PRO 51 3HD PRO 51 12.860 -3.846 5.559
378 H GLU 52 H GLU 52 11.816 -2.669 2.021
379 HA GLU 52 HA GLU 52 11.432 -3.154 -0.748
380 HB2 GLU 52 2HB GLU 52 10.719 -0.743 -0.797
381 HB3 GLU 52 3HB GLU 52 9.864 -1.746 0.367
382 HG2 GLU 52 2HG GLU 52 10.674 -0.624 2.137
383 HG3 GLU 52 3HG GLU 52 12.252 -0.371 1.393
384 H VAL 53 H VAL 53 13.946 -1.636 1.101
385 HA VAL 53 HA VAL 53 15.128 -0.230 -1.105
386 HB VAL 53 HB VAL 53 16.504 -0.962 1.474
387 HG11 VAL 53 1HG1 VAL 53 17.214 0.574 -0.834
388 HG12 VAL 53 2HG1 VAL 53 17.152 1.626 0.581
389 HG13 VAL 53 3HG1 VAL 53 18.181 0.194 0.591
390 HG21 VAL 53 3HG2 VAL 53 14.551 0.043 2.264
391 HG22 VAL 53 1HG2 VAL 53 15.698 1.379 2.170
392 HG23 VAL 53 2HG2 VAL 53 14.475 1.177 0.915
393 H GLU 54 H GLU 54 15.236 -3.442 0.098
394 HA GLU 54 HA GLU 54 17.786 -4.272 -0.653
395 HB2 GLU 54 2HB GLU 54 15.162 -5.758 -0.582
396 HB3 GLU 54 3HB GLU 54 16.695 -6.546 -0.928
397 HG2 GLU 54 2HG GLU 54 17.200 -5.133 1.387
398 HG3 GLU 54 3HG GLU 54 15.555 -5.725 1.606
399 H ALA 55 H ALA 55 14.768 -4.533 -2.537
400 HA ALA 55 HA ALA 55 16.002 -5.443 -4.901
401 HB1 ALA 55 1HB ALA 55 13.684 -5.830 -4.658
402 HB2 ALA 55 2HB ALA 55 13.350 -4.118 -4.393
403 HB3 ALA 55 3HB ALA 55 13.850 -4.683 -5.987
404 H LEU 56 H LEU 56 14.881 -2.195 -3.963
405 HA LEU 56 HA LEU 56 15.580 -0.828 -6.269
406 HB2 LEU 56 2HB LEU 56 15.594 0.078 -3.398
407 HB3 LEU 56 3HB LEU 56 15.812 1.168 -4.766
408 HG LEU 56 HG LEU 56 13.378 -0.522 -4.773
409 HD11 LEU 56 1HD1 LEU 56 12.468 0.232 -2.897
410 HD12 LEU 56 2HD1 LEU 56 12.875 1.898 -3.306
411 HD13 LEU 56 3HD1 LEU 56 14.044 0.889 -2.454
412 HD21 LEU 56 3HD2 LEU 56 12.722 2.096 -5.285
413 HD22 LEU 56 1HD2 LEU 56 13.108 0.873 -6.495
414 HD23 LEU 56 2HD2 LEU 56 14.364 1.969 -5.919
415 H ARG 57 H ARG 57 17.562 -1.542 -3.417
416 HA ARG 57 HA ARG 57 19.857 -0.140 -4.248
417 HB2 ARG 57 2HB ARG 57 19.307 -2.312 -2.272
418 HB3 ARG 57 3HB ARG 57 20.978 -1.952 -2.687
419 HG2 ARG 57 2HG ARG 57 20.654 0.368 -2.005
420 HG3 ARG 57 3HG ARG 57 18.973 0.014 -1.600
421 HD2 ARG 57 2HD ARG 57 20.259 -0.023 0.420
422 HD3 ARG 57 3HD ARG 57 19.790 -1.677 0.031
423 HE ARG 57 HE ARG 57 22.280 -1.310 -1.092
424 HH11 ARG 57 1HH1 ARG 57 20.887 -1.183 2.096
425 HH12 ARG 57 2HH1 ARG 57 22.345 -1.669 2.895
426 HH21 ARG 57 1HH2 ARG 57 24.206 -1.951 -0.051
427 HH22 ARG 57 2HH2 ARG 57 24.233 -2.105 1.673
428 H LYS 58 H LYS 58 18.869 -3.515 -4.676
429 HA LYS 58 HA LYS 58 21.192 -4.488 -5.867
430 HB2 LYS 58 2HB LYS 58 18.718 -5.519 -5.249
431 HB3 LYS 58 3HB LYS 58 18.712 -5.562 -7.007
432 HG2 LYS 58 2HG LYS 58 21.209 -6.544 -5.937
433 HG3 LYS 58 3HG LYS 58 19.827 -7.435 -5.294
434 HD2 LYS 58 2HD LYS 58 19.311 -8.341 -7.302
435 HD3 LYS 58 3HD LYS 58 19.775 -6.891 -8.194
436 HE2 LYS 58 2HE LYS 58 21.749 -7.778 -8.693
437 HE3 LYS 58 3HE LYS 58 22.094 -8.059 -6.987
438 HZ1 LYS 58 3HZ LYS 58 20.346 -10.030 -7.571
439 HZ2 LYS 58 1HZ LYS 58 22.029 -10.202 -7.554
440 HZ3 LYS 58 2HZ LYS 58 21.224 -9.911 -9.012
441 H GLU 59 H GLU 59 18.235 -3.334 -7.502
442 HA GLU 59 HA GLU 59 19.200 -3.467 -10.108
443 HB2 GLU 59 2HB GLU 59 16.983 -2.099 -8.732
444 HB3 GLU 59 3HB GLU 59 17.498 -1.340 -10.231
445 HG2 GLU 59 2HG GLU 59 16.999 -3.251 -11.499
446 HG3 GLU 59 3HG GLU 59 16.874 -4.268 -10.065
447 H ALA 60 H ALA 60 19.116 -0.645 -7.932
448 HA ALA 60 HA ALA 60 20.319 1.220 -9.566
449 HB1 ALA 60 1HB ALA 60 21.347 1.871 -7.119
450 HB2 ALA 60 2HB ALA 60 19.740 2.312 -7.699
451 HB3 ALA 60 3HB ALA 60 19.950 0.884 -6.686
452 H ALA 61 H ALA 61 21.944 -0.977 -7.277
453 HA ALA 61 HA ALA 61 24.564 -0.207 -7.768
454 HB1 ALA 61 1HB ALA 61 25.144 -2.562 -7.051
455 HB2 ALA 61 2HB ALA 61 24.147 -1.633 -5.932
456 HB3 ALA 61 3HB ALA 61 23.409 -2.863 -6.958
457 H ALA 62 H ALA 62 22.605 -2.654 -9.433
458 HA ALA 62 HA ALA 62 24.578 -3.631 -11.155
459 HB1 ALA 62 1HB ALA 62 22.209 -3.765 -12.599
460 HB2 ALA 62 2HB ALA 62 22.863 -4.999 -11.521
461 HB3 ALA 62 3HB ALA 62 21.704 -3.819 -10.909
462 H ILE 63 H ILE 63 22.271 -0.968 -11.594
463 HA ILE 63 HA ILE 63 22.954 -0.317 -14.230
464 HB ILE 63 HB ILE 63 21.972 1.534 -12.054
465 HG12 ILE 63 2HG1 ILE 63 20.337 0.211 -14.215
466 HG13 ILE 63 3HG1 ILE 63 20.585 -0.539 -12.642
467 HG21 ILE 63 1HG2 ILE 63 22.840 2.079 -14.698
468 HG22 ILE 63 2HG2 ILE 63 21.090 2.285 -14.646
469 HG23 ILE 63 3HG2 ILE 63 22.117 3.184 -13.529
470 HD11 ILE 63 3HD1 ILE 63 19.537 2.247 -12.808
471 HD12 ILE 63 1HD1 ILE 63 18.463 0.876 -13.083
472 HD13 ILE 63 2HD1 ILE 63 19.315 1.034 -11.547
473 H ARG 64 H ARG 64 24.245 0.877 -11.149
474 HA ARG 64 HA ARG 64 25.984 2.807 -12.197
475 HB2 ARG 64 2HB ARG 64 25.403 2.669 -9.815
476 HB3 ARG 64 3HB ARG 64 26.287 1.154 -9.684
477 HG2 ARG 64 2HG ARG 64 28.223 2.736 -10.672
478 HG3 ARG 64 3HG ARG 64 27.275 3.924 -9.776
479 HD2 ARG 64 2HD ARG 64 28.821 3.154 -8.211
480 HD3 ARG 64 3HD ARG 64 27.359 2.239 -7.844
481 HE ARG 64 HE ARG 64 28.889 0.748 -9.643
482 HH11 ARG 64 1HH1 ARG 64 29.051 1.901 -6.362
483 HH12 ARG 64 2HH1 ARG 64 30.030 0.583 -5.810
484 HH21 ARG 64 1HH2 ARG 64 30.179 -0.992 -8.928
485 HH22 ARG 64 2HH2 ARG 64 30.672 -1.062 -7.270
486 H ASP 65 H ASP 65 26.528 -0.615 -11.429
487 HA ASP 65 HA ASP 65 29.254 -0.712 -12.049
488 HB2 ASP 65 2HB ASP 65 27.089 -2.810 -12.110
489 HB3 ASP 65 3HB ASP 65 28.767 -3.186 -12.493
490 H GLU 66 H GLU 66 26.406 -1.228 -14.095
491 HA GLU 66 HA GLU 66 27.765 -1.989 -16.427
492 HB2 GLU 66 2HB GLU 66 25.145 -0.495 -16.232
493 HB3 GLU 66 3HB GLU 66 25.714 -1.423 -17.613
494 HG2 GLU 66 2HG GLU 66 25.129 -3.391 -16.704
495 HG3 GLU 66 3HG GLU 66 25.586 -2.897 -15.074
496 H CYS 67 H CYS 67 26.605 1.209 -15.386
497 HA CYS 67 HA CYS 67 27.460 2.665 -17.602
498 HB2 CYS 67 2HB CYS 67 27.164 3.484 -14.709
499 HB3 CYS 67 3HB CYS 67 27.496 4.622 -16.008
500 HG CYS 67 HG CYS 67 24.930 5.098 -15.957
501 H GLN 68 H GLN 68 29.196 1.718 -14.681
502 HA GLN 68 HA GLN 68 31.537 3.232 -15.235
503 HB2 GLN 68 2HB GLN 68 31.093 0.824 -13.464
504 HB3 GLN 68 3HB GLN 68 32.590 1.746 -13.518
505 HG2 GLN 68 2HG GLN 68 29.940 2.992 -12.857
506 HG3 GLN 68 3HG GLN 68 30.999 2.284 -11.638
507 HE21 GLN 68 1HE2 GLN 68 32.319 3.641 -10.677
508 HE22 GLN 68 2HE2 GLN 68 32.901 5.133 -11.324
509 H ALA 69 H ALA 69 30.444 0.018 -16.089
510 HA ALA 69 HA ALA 69 33.000 -0.828 -17.109
511 HB1 ALA 69 1HB ALA 69 31.588 -2.731 -18.059
512 HB2 ALA 69 2HB ALA 69 31.666 -2.577 -16.303
513 HB3 ALA 69 3HB ALA 69 30.242 -2.011 -17.177
514 H TYR 70 H TYR 70 30.687 1.277 -18.224
515 HA TYR 70 HA TYR 70 31.196 0.658 -21.049
516 HB2 TYR 70 2HB TYR 70 29.136 2.475 -19.783
517 HB3 TYR 70 3HB TYR 70 29.323 2.215 -21.513
518 HD1 TYR 70 HD2 TYR 70 29.925 -0.808 -21.248
519 HD2 TYR 70 HD1 TYR 70 26.875 1.691 -19.648
520 HE1 TYR 70 HE2 TYR 70 28.413 -2.743 -21.123
521 HE2 TYR 70 HE1 TYR 70 25.355 -0.238 -19.517
522 HH TYR 70 HH TYR 70 25.074 -2.395 -19.962
523 H ARG 71 H ARG 71 31.505 3.179 -18.617
524 HA ARG 71 HA ARG 71 33.361 4.586 -20.404
525 HB2 ARG 71 2HB ARG 71 30.877 5.569 -19.954
526 HB3 ARG 71 3HB ARG 71 31.749 6.292 -18.609
527 HG2 ARG 71 2HG ARG 71 33.274 7.378 -20.088
528 HG3 ARG 71 3HG ARG 71 32.624 6.507 -21.478
529 HD2 ARG 71 2HD ARG 71 30.378 7.613 -20.789
530 HD3 ARG 71 3HD ARG 71 31.405 8.734 -19.897
531 HE ARG 71 HE ARG 71 32.255 8.430 -22.601
532 HH11 ARG 71 1HH1 ARG 71 29.927 10.020 -20.558
533 HH12 ARG 71 2HH1 ARG 71 29.692 11.352 -21.641
534 HH21 ARG 71 1HH2 ARG 71 31.955 10.179 -24.034
535 HH22 ARG 71 2HH2 ARG 71 30.846 11.441 -23.618
536 H HIS 72 H HIS 72 34.105 2.791 -18.428
537 HA HIS 72 HA HIS 72 35.956 4.289 -16.946
538 HB2 HIS 72 2HB HIS 72 33.443 4.360 -15.766
539 HB3 HIS 72 3HB HIS 72 34.284 3.092 -14.880
540 HD1 HIS 72 HD1 HIS 72 35.410 6.516 -16.125
541 HD2 HIS 72 HD2 HIS 72 35.319 4.220 -12.663
542 HE1 HIS 72 HE1 HIS 72 36.542 7.910 -14.364
543 H ASN 73 H ASN 73 35.779 1.921 -18.589
544 HA ASN 73 HA ASN 73 37.194 0.091 -16.817
545 HB2 ASN 73 2HB ASN 73 35.058 -0.906 -16.674
546 HB3 ASN 73 3HB ASN 73 34.721 -0.626 -18.380
547 HD21 ASN 73 1HD2 ASN 73 34.596 -2.495 -19.378
548 HD22 ASN 73 2HD2 ASN 73 35.673 -3.831 -19.178
Start of MODEL 6
1 H1 MET 1 H MET 1 2.631 -1.091 -4.358
2 HA MET 1 HA MET 1 0.860 0.498 -2.713
3 HB2 MET 1 2HB MET 1 2.697 -1.740 -2.321
4 HB3 MET 1 3HB MET 1 2.786 -0.548 -1.031
5 HG2 MET 1 2HG MET 1 0.323 -0.725 -0.777
6 HG3 MET 1 3HG MET 1 0.340 -2.029 -1.963
7 HE1 MET 1 3HE MET 1 0.419 -1.977 2.209
8 HE2 MET 1 1HE MET 1 2.158 -1.710 2.086
9 HE3 MET 1 2HE MET 1 1.040 -0.634 1.247
10 H GLY 2 H GLY 2 1.371 2.314 -1.575
11 HA2 GLY 2 2HA GLY 2 2.471 4.276 -1.109
12 HA3 GLY 2 3HA GLY 2 3.891 3.259 -0.911
13 H SER 3 H SER 3 5.409 4.536 -1.848
14 HA SER 3 HA SER 3 4.909 5.565 -4.543
15 HB2 SER 3 2HB SER 3 6.941 6.193 -2.417
16 HB3 SER 3 3HB SER 3 7.219 6.670 -4.092
17 HG SER 3 HG SER 3 6.178 8.331 -2.961
18 H TRP 4 H TRP 4 5.357 2.720 -4.004
19 HA TRP 4 HA TRP 4 8.010 2.051 -4.823
20 HB2 TRP 4 2HB TRP 4 6.846 0.424 -3.534
21 HB3 TRP 4 3HB TRP 4 5.455 0.460 -4.614
22 HD1 TRP 4 HD1 TRP 4 5.841 -0.681 -7.094
23 HE1 TRP 4 HE1 TRP 4 7.331 -2.670 -7.766
24 HE3 TRP 4 HE3 TRP 4 8.961 -0.761 -3.045
25 HZ2 TRP 4 HZ2 TRP 4 9.536 -4.085 -6.717
26 HZ3 TRP 4 HZ3 TRP 4 10.734 -2.465 -2.956
27 HH2 TRP 4 HH2 TRP 4 11.014 -4.092 -4.755
28 H ALA 5 H ALA 5 4.853 2.018 -6.465
29 HA ALA 5 HA ALA 5 5.626 1.088 -8.943
30 HB1 ALA 5 1HB ALA 5 3.398 1.316 -9.012
31 HB2 ALA 5 2HB ALA 5 3.405 2.689 -7.905
32 HB3 ALA 5 3HB ALA 5 3.743 2.936 -9.618
33 H GLU 6 H GLU 6 5.604 4.462 -7.808
34 HA GLU 6 HA GLU 6 6.519 5.650 -10.163
35 HB2 GLU 6 2HB GLU 6 6.301 6.411 -7.337
36 HB3 GLU 6 3HB GLU 6 7.594 7.234 -8.197
37 HG2 GLU 6 2HG GLU 6 5.885 8.681 -8.578
38 HG3 GLU 6 3HG GLU 6 5.710 7.632 -9.984
39 H PHE 7 H PHE 7 8.366 4.534 -7.334
40 HA PHE 7 HA PHE 7 10.906 5.216 -8.301
41 HB2 PHE 7 2HB PHE 7 9.811 3.736 -6.075
42 HB3 PHE 7 3HB PHE 7 11.229 2.916 -6.719
43 HD1 PHE 7 HD1 PHE 7 10.139 6.377 -5.846
44 HD2 PHE 7 HD2 PHE 7 13.262 3.486 -5.833
45 HE1 PHE 7 HE1 PHE 7 11.592 7.957 -4.644
46 HE2 PHE 7 HE2 PHE 7 14.720 5.061 -4.630
47 HZ PHE 7 HZ PHE 7 13.885 7.300 -4.033
48 H LYS 8 H LYS 8 9.020 2.239 -8.614
49 HA LYS 8 HA LYS 8 11.000 0.704 -9.900
50 HB2 LYS 8 2HB LYS 8 8.960 -0.249 -8.882
51 HB3 LYS 8 3HB LYS 8 7.993 0.491 -10.151
52 HG2 LYS 8 2HG LYS 8 8.515 -1.092 -11.650
53 HG3 LYS 8 3HG LYS 8 10.190 -1.204 -11.104
54 HD2 LYS 8 2HD LYS 8 9.551 -3.200 -10.288
55 HD3 LYS 8 3HD LYS 8 8.867 -2.245 -8.971
56 HE2 LYS 8 2HE LYS 8 7.089 -3.594 -9.592
57 HE3 LYS 8 3HE LYS 8 6.771 -2.107 -10.485
58 HZ1 LYS 8 3HZ LYS 8 8.047 -4.557 -11.578
59 HZ2 LYS 8 1HZ LYS 8 7.791 -3.123 -12.439
60 HZ3 LYS 8 2HZ LYS 8 6.471 -4.029 -11.894
61 H GLN 9 H GLN 9 8.551 2.922 -11.126
62 HA GLN 9 HA GLN 9 8.867 2.327 -13.865
63 HB2 GLN 9 2HB GLN 9 7.314 4.090 -12.306
64 HB3 GLN 9 3HB GLN 9 8.188 5.093 -13.457
65 HG2 GLN 9 2HG GLN 9 7.205 4.064 -15.293
66 HG3 GLN 9 3HG GLN 9 6.717 2.651 -14.359
67 HE21 GLN 9 1HE2 GLN 9 6.210 6.162 -14.435
68 HE22 GLN 9 2HE2 GLN 9 4.522 6.098 -14.077
69 H ARG 10 H ARG 10 10.198 5.003 -11.919
70 HA ARG 10 HA ARG 10 11.768 6.152 -13.910
71 HB2 ARG 10 2HB ARG 10 12.094 6.069 -10.914
72 HB3 ARG 10 3HB ARG 10 13.167 6.994 -11.955
73 HG2 ARG 10 2HG ARG 10 11.720 8.665 -12.071
74 HG3 ARG 10 3HG ARG 10 10.421 7.580 -12.570
75 HD2 ARG 10 2HD ARG 10 9.500 8.169 -10.605
76 HD3 ARG 10 3HD ARG 10 10.607 6.967 -9.942
77 HE ARG 10 HE ARG 10 11.771 9.578 -10.130
78 HH11 ARG 10 1HH1 ARG 10 9.762 7.498 -8.192
79 HH12 ARG 10 2HH1 ARG 10 10.109 8.326 -6.711
80 HH21 ARG 10 1HH2 ARG 10 12.235 10.677 -8.186
81 HH22 ARG 10 2HH2 ARG 10 11.515 10.135 -6.708
82 H LEU 11 H LEU 11 12.603 3.640 -11.544
83 HA LEU 11 HA LEU 11 15.296 3.355 -12.322
84 HB2 LEU 11 2HB LEU 11 13.547 2.195 -10.444
85 HB3 LEU 11 3HB LEU 11 14.211 0.870 -11.398
86 HG LEU 11 HG LEU 11 16.463 1.514 -10.793
87 HD11 LEU 11 1HD1 LEU 11 15.105 3.952 -9.871
88 HD12 LEU 11 2HD1 LEU 11 16.740 3.723 -10.490
89 HD13 LEU 11 3HD1 LEU 11 16.374 3.344 -8.807
90 HD21 LEU 11 3HD2 LEU 11 16.375 1.057 -8.396
91 HD22 LEU 11 1HD2 LEU 11 15.255 0.023 -9.283
92 HD23 LEU 11 2HD2 LEU 11 14.647 1.414 -8.385
93 H ALA 12 H ALA 12 12.320 1.895 -13.482
94 HA ALA 12 HA ALA 12 13.483 -0.128 -15.070
95 HB1 ALA 12 1HB ALA 12 10.817 1.192 -14.953
96 HB2 ALA 12 2HB ALA 12 11.211 0.195 -16.354
97 HB3 ALA 12 3HB ALA 12 11.249 -0.505 -14.736
98 H ALA 13 H ALA 13 12.457 3.186 -15.827
99 HA ALA 13 HA ALA 13 13.088 3.078 -18.579
100 HB1 ALA 13 1HB ALA 13 13.231 5.647 -17.075
101 HB2 ALA 13 2HB ALA 13 12.530 5.302 -18.657
102 HB3 ALA 13 3HB ALA 13 11.686 4.804 -17.191
103 H ILE 14 H ILE 14 14.922 4.149 -15.744
104 HA ILE 14 HA ILE 14 17.178 5.080 -17.184
105 HB ILE 14 HB ILE 14 17.016 4.116 -14.325
106 HG12 ILE 14 2HG1 ILE 14 17.064 6.981 -15.238
107 HG13 ILE 14 3HG1 ILE 14 15.547 6.092 -15.143
108 HG21 ILE 14 1HG2 ILE 14 19.008 6.106 -14.754
109 HG22 ILE 14 2HG2 ILE 14 19.203 4.451 -14.179
110 HG23 ILE 14 3HG2 ILE 14 19.258 4.796 -15.908
111 HD11 ILE 14 3HD1 ILE 14 16.413 5.558 -12.716
112 HD12 ILE 14 1HD1 ILE 14 17.336 7.038 -12.976
113 HD13 ILE 14 2HD1 ILE 14 15.576 7.064 -13.089
114 H LYS 15 H LYS 15 16.352 1.972 -15.728
115 HA LYS 15 HA LYS 15 18.877 0.752 -16.177
116 HB2 LYS 15 2HB LYS 15 16.974 0.022 -14.591
117 HB3 LYS 15 3HB LYS 15 16.277 -0.752 -16.008
118 HG2 LYS 15 2HG LYS 15 18.952 -1.559 -15.958
119 HG3 LYS 15 3HG LYS 15 18.391 -1.653 -14.287
120 HD2 LYS 15 2HD LYS 15 16.286 -2.737 -15.636
121 HD3 LYS 15 3HD LYS 15 17.650 -3.265 -16.625
122 HE2 LYS 15 2HE LYS 15 18.734 -4.092 -14.524
123 HE3 LYS 15 3HE LYS 15 17.230 -3.733 -13.677
124 HZ1 LYS 15 3HZ LYS 15 16.345 -5.617 -14.400
125 HZ2 LYS 15 1HZ LYS 15 17.862 -6.056 -15.007
126 HZ3 LYS 15 2HZ LYS 15 16.743 -5.279 -16.009
127 H THR 16 H THR 16 15.856 0.853 -18.011
128 HA THR 16 HA THR 16 16.586 -0.982 -20.016
129 HB THR 16 HB THR 16 14.678 1.359 -20.189
130 HG1 THR 16 HG1 THR 16 13.911 -1.339 -19.939
131 HG21 THR 16 3HG2 THR 16 13.938 -0.774 -21.897
132 HG22 THR 16 1HG2 THR 16 15.634 -0.413 -22.212
133 HG23 THR 16 2HG2 THR 16 14.422 0.861 -22.344
134 H ARG 17 H ARG 17 16.759 2.575 -19.953
135 HA ARG 17 HA ARG 17 17.949 2.831 -22.505
136 HB2 ARG 17 2HB ARG 17 17.929 4.691 -20.124
137 HB3 ARG 17 3HB ARG 17 18.558 5.130 -21.707
138 HG2 ARG 17 2HG ARG 17 16.498 5.326 -22.627
139 HG3 ARG 17 3HG ARG 17 15.803 4.061 -21.612
140 HD2 ARG 17 2HD ARG 17 14.798 5.844 -20.637
141 HD3 ARG 17 3HD ARG 17 16.306 5.877 -19.724
142 HE ARG 17 HE ARG 17 16.804 7.446 -21.894
143 HH11 ARG 17 1HH1 ARG 17 14.367 7.410 -19.408
144 HH12 ARG 17 2HH1 ARG 17 14.125 9.126 -19.439
145 HH21 ARG 17 1HH2 ARG 17 16.495 9.705 -21.944
146 HH22 ARG 17 2HH2 ARG 17 15.335 10.430 -20.883
147 H CYS 18 H CYS 18 19.250 2.350 -19.288
148 HA CYS 18 HA CYS 18 21.960 2.917 -19.984
149 HB2 CYS 18 2HB CYS 18 21.494 3.151 -17.700
150 HB3 CYS 18 3HB CYS 18 20.619 1.627 -17.627
151 HG CYS 18 HG CYS 18 22.729 0.003 -17.428
152 H GLN 19 H GLN 19 20.020 -0.023 -19.723
153 HA GLN 19 HA GLN 19 22.188 -1.803 -20.228
154 HB2 GLN 19 2HB GLN 19 19.198 -2.192 -20.422
155 HB3 GLN 19 3HB GLN 19 20.376 -3.486 -20.601
156 HG2 GLN 19 2HG GLN 19 20.703 -1.912 -18.162
157 HG3 GLN 19 3HG GLN 19 19.163 -2.763 -18.274
158 HE21 GLN 19 1HE2 GLN 19 19.581 -4.262 -16.715
159 HE22 GLN 19 2HE2 GLN 19 20.781 -5.494 -16.872
160 H ALA 20 H ALA 20 19.881 -0.095 -22.221
161 HA ALA 20 HA ALA 20 20.600 -1.558 -24.615
162 HB1 ALA 20 1HB ALA 20 18.391 -0.959 -24.744
163 HB2 ALA 20 2HB ALA 20 18.653 0.597 -23.955
164 HB3 ALA 20 3HB ALA 20 19.138 0.368 -25.635
165 H LEU 21 H LEU 21 21.404 1.456 -23.048
166 HA LEU 21 HA LEU 21 22.867 3.127 -23.550
167 HB2 LEU 21 2HB LEU 21 24.165 0.768 -24.888
168 HB3 LEU 21 3HB LEU 21 24.927 2.356 -24.820
169 HG LEU 21 HG LEU 21 24.217 0.607 -22.466
170 HD11 LEU 21 1HD1 LEU 21 26.595 0.918 -24.122
171 HD12 LEU 21 2HD1 LEU 21 26.165 -0.354 -22.979
172 HD13 LEU 21 3HD1 LEU 21 26.905 1.138 -22.400
173 HD21 LEU 21 3HD2 LEU 21 24.982 3.452 -22.694
174 HD22 LEU 21 1HD2 LEU 21 25.800 2.511 -21.446
175 HD23 LEU 21 2HD2 LEU 21 24.040 2.622 -21.454
176 H GLY 22 H GLY 22 20.986 3.934 -24.895
177 HA2 GLY 22 2HA GLY 22 20.697 3.666 -27.610
178 HA3 GLY 22 3HA GLY 22 20.384 5.163 -26.745
179 H GLY 23 H GLY 23 23.197 5.421 -25.900
180 HA2 GLY 23 2HA GLY 23 25.330 5.709 -27.026
181 HA3 GLY 23 3HA GLY 23 24.441 6.006 -28.512
182 H SER 24 H SER 24 23.705 7.369 -25.345
183 HA SER 24 HA SER 24 24.392 10.026 -26.423
184 HB2 SER 24 2HB SER 24 22.150 9.265 -24.537
185 HB3 SER 24 3HB SER 24 22.581 10.921 -24.960
186 HG SER 24 HG SER 24 21.625 10.688 -26.824
187 H GLU 25 H GLU 25 26.100 10.867 -25.447
188 HA GLU 25 HA GLU 25 27.298 9.873 -23.132
189 HB2 GLU 25 2HB GLU 25 28.518 12.101 -23.114
190 HB3 GLU 25 3HB GLU 25 28.647 11.154 -24.590
191 HG2 GLU 25 2HG GLU 25 27.843 12.828 -25.782
192 HG3 GLU 25 3HG GLU 25 26.387 12.881 -24.790
193 H ALA 26 H ALA 26 24.617 11.975 -23.512
194 HA ALA 26 HA ALA 26 24.818 13.138 -20.868
195 HB1 ALA 26 1HB ALA 26 23.184 14.571 -21.508
196 HB2 ALA 26 2HB ALA 26 23.718 14.075 -23.115
197 HB3 ALA 26 3HB ALA 26 22.290 13.334 -22.392
198 H GLU 27 H GLU 27 22.746 10.783 -22.533
199 HA GLU 27 HA GLU 27 20.927 10.233 -20.540
200 HB2 GLU 27 2HB GLU 27 22.148 8.524 -22.684
201 HB3 GLU 27 3HB GLU 27 21.012 7.831 -21.535
202 HG2 GLU 27 2HG GLU 27 19.431 9.703 -22.210
203 HG3 GLU 27 3HG GLU 27 20.532 9.994 -23.555
204 H CYS 28 H CYS 28 24.063 8.627 -21.066
205 HA CYS 28 HA CYS 28 23.979 6.877 -18.913
206 HB2 CYS 28 2HB CYS 28 26.451 8.268 -19.963
207 HB3 CYS 28 3HB CYS 28 26.389 6.733 -19.105
208 HG CYS 28 HG CYS 28 26.542 5.459 -21.332
209 H ALA 29 H ALA 29 25.188 10.210 -19.039
210 HA ALA 29 HA ALA 29 26.131 10.363 -16.405
211 HB1 ALA 29 1HB ALA 29 26.340 12.651 -16.738
212 HB2 ALA 29 2HB ALA 29 26.440 12.001 -18.375
213 HB3 ALA 29 3HB ALA 29 24.937 12.725 -17.805
214 H ALA 30 H ALA 30 22.953 11.173 -17.769
215 HA ALA 30 HA ALA 30 21.766 12.168 -15.448
216 HB1 ALA 30 1HB ALA 30 20.142 12.520 -16.916
217 HB2 ALA 30 2HB ALA 30 20.927 11.446 -18.075
218 HB3 ALA 30 3HB ALA 30 19.777 10.794 -16.909
219 H PHE 31 H PHE 31 22.080 8.854 -16.627
220 HA PHE 31 HA PHE 31 20.419 7.652 -14.682
221 HB2 PHE 31 2HB PHE 31 22.755 6.381 -16.121
222 HB3 PHE 31 3HB PHE 31 21.382 5.553 -15.394
223 HD1 PHE 31 HD1 PHE 31 19.227 7.437 -16.378
224 HD2 PHE 31 HD2 PHE 31 22.540 5.621 -18.338
225 HE1 PHE 31 HE1 PHE 31 18.021 7.556 -18.519
226 HE2 PHE 31 HE2 PHE 31 21.340 5.737 -20.482
227 HZ PHE 31 HZ PHE 31 19.078 6.707 -20.575
228 H GLU 32 H GLU 32 23.939 8.106 -14.848
229 HA GLU 32 HA GLU 32 24.630 6.799 -12.491
230 HB2 GLU 32 2HB GLU 32 25.894 8.605 -14.353
231 HB3 GLU 32 3HB GLU 32 26.358 9.006 -12.705
232 HG2 GLU 32 2HG GLU 32 26.486 6.182 -13.020
233 HG3 GLU 32 3HG GLU 32 27.346 6.944 -14.358
234 H LYS 33 H LYS 33 23.778 10.209 -13.003
235 HA LYS 33 HA LYS 33 24.072 10.966 -10.286
236 HB2 LYS 33 2HB LYS 33 23.249 12.206 -12.773
237 HB3 LYS 33 3HB LYS 33 22.221 12.716 -11.440
238 HG2 LYS 33 2HG LYS 33 23.927 13.777 -10.344
239 HG3 LYS 33 3HG LYS 33 25.172 12.752 -11.062
240 HD2 LYS 33 2HD LYS 33 25.272 13.991 -12.990
241 HD3 LYS 33 3HD LYS 33 23.600 14.539 -12.851
242 HE2 LYS 33 2HE LYS 33 25.386 15.445 -10.702
243 HE3 LYS 33 3HE LYS 33 25.782 16.064 -12.304
244 HZ1 LYS 33 3HZ LYS 33 23.589 16.732 -10.581
245 HZ2 LYS 33 1HZ LYS 33 23.087 16.361 -12.154
246 HZ3 LYS 33 2HZ LYS 33 24.226 17.584 -11.897
247 H GLU 34 H GLU 34 21.126 10.486 -12.245
248 HA GLU 34 HA GLU 34 19.248 10.750 -10.248
249 HB2 GLU 34 2HB GLU 34 19.232 8.951 -12.672
250 HB3 GLU 34 3HB GLU 34 17.827 9.202 -11.646
251 HG2 GLU 34 2HG GLU 34 17.588 11.416 -12.295
252 HG3 GLU 34 3HG GLU 34 19.247 11.525 -12.879
253 H ILE 35 H ILE 35 20.920 7.782 -11.263
254 HA ILE 35 HA ILE 35 19.665 6.056 -9.433
255 HB ILE 35 HB ILE 35 22.343 5.883 -10.805
256 HG12 ILE 35 2HG1 ILE 35 20.257 5.744 -12.182
257 HG13 ILE 35 3HG1 ILE 35 21.250 4.292 -12.248
258 HG21 ILE 35 1HG2 ILE 35 21.046 4.020 -8.858
259 HG22 ILE 35 2HG2 ILE 35 22.088 3.393 -10.134
260 HG23 ILE 35 3HG2 ILE 35 22.728 4.541 -8.958
261 HD11 ILE 35 3HD1 ILE 35 18.871 3.777 -12.085
262 HD12 ILE 35 1HD1 ILE 35 19.766 3.183 -10.687
263 HD13 ILE 35 2HD1 ILE 35 18.790 4.646 -10.552
264 H ALA 36 H ALA 36 22.655 7.940 -9.207
265 HA ALA 36 HA ALA 36 23.615 6.973 -6.786
266 HB1 ALA 36 1HB ALA 36 25.202 8.352 -7.540
267 HB2 ALA 36 2HB ALA 36 24.046 9.338 -8.436
268 HB3 ALA 36 3HB ALA 36 24.305 9.627 -6.716
269 H ALA 37 H ALA 37 21.408 9.701 -7.373
270 HA ALA 37 HA ALA 37 21.056 10.371 -4.649
271 HB1 ALA 37 1HB ALA 37 20.363 12.122 -5.894
272 HB2 ALA 37 2HB ALA 37 19.780 11.099 -7.207
273 HB3 ALA 37 3HB ALA 37 18.799 11.316 -5.758
274 H PHE 38 H PHE 38 19.372 8.171 -6.819
275 HA PHE 38 HA PHE 38 17.116 7.647 -5.255
276 HB2 PHE 38 2HB PHE 38 18.438 6.446 -7.554
277 HB3 PHE 38 3HB PHE 38 17.699 5.235 -6.511
278 HD1 PHE 38 HD2 PHE 38 16.729 8.664 -7.628
279 HD2 PHE 38 HD1 PHE 38 15.666 4.555 -7.308
280 HE1 PHE 38 HE2 PHE 38 14.532 9.159 -8.618
281 HE2 PHE 38 HE1 PHE 38 13.468 5.043 -8.299
282 HZ PHE 38 HZ PHE 38 12.898 7.348 -8.954
283 H GLU 39 H GLU 39 20.157 5.794 -5.451
284 HA GLU 39 HA GLU 39 19.531 3.988 -3.391
285 HB2 GLU 39 2HB GLU 39 21.974 3.539 -3.329
286 HB3 GLU 39 3HB GLU 39 21.301 3.493 -4.952
287 HG2 GLU 39 2HG GLU 39 22.135 5.770 -5.343
288 HG3 GLU 39 3HG GLU 39 22.853 5.765 -3.734
289 H SER 40 H SER 40 21.188 7.108 -3.357
290 HA SER 40 HA SER 40 21.991 7.037 -0.653
291 HB2 SER 40 2HB SER 40 23.019 8.610 -2.172
292 HB3 SER 40 3HB SER 40 21.464 9.373 -2.503
293 HG SER 40 HG SER 40 23.152 9.646 -0.324
294 H GLU 41 H GLU 41 19.029 8.053 -2.239
295 HA GLU 41 HA GLU 41 17.902 9.188 0.160
296 HB2 GLU 41 2HB GLU 41 17.026 8.821 -2.656
297 HB3 GLU 41 3HB GLU 41 15.767 8.964 -1.438
298 HG2 GLU 41 2HG GLU 41 17.989 10.953 -1.839
299 HG3 GLU 41 3HG GLU 41 16.367 11.106 -2.512
300 H LEU 42 H LEU 42 17.973 6.100 -1.397
301 HA LEU 42 HA LEU 42 15.682 5.032 -0.029
302 HB2 LEU 42 2HB LEU 42 17.889 3.763 -1.633
303 HB3 LEU 42 3HB LEU 42 16.581 2.841 -0.895
304 HG LEU 42 HG LEU 42 15.893 5.077 -2.743
305 HD11 LEU 42 1HD1 LEU 42 16.825 2.350 -3.627
306 HD12 LEU 42 2HD1 LEU 42 17.618 3.889 -3.961
307 HD13 LEU 42 3HD1 LEU 42 16.034 3.545 -4.656
308 HD21 LEU 42 3HD2 LEU 42 14.122 3.324 -3.330
309 HD22 LEU 42 1HD2 LEU 42 14.027 4.087 -1.743
310 HD23 LEU 42 2HD2 LEU 42 14.690 2.460 -1.901
311 H GLN 43 H GLN 43 19.143 5.132 0.489
312 HA GLN 43 HA GLN 43 19.196 3.180 2.565
313 HB2 GLN 43 2HB GLN 43 21.464 3.789 2.881
314 HB3 GLN 43 3HB GLN 43 21.163 3.929 1.154
315 HG2 GLN 43 2HG GLN 43 21.963 5.985 1.234
316 HG3 GLN 43 3HG GLN 43 20.582 6.444 2.229
317 HE21 GLN 43 1HE2 GLN 43 23.947 5.733 2.159
318 HE22 GLN 43 2HE2 GLN 43 24.290 6.134 3.803
319 H ALA 44 H ALA 44 18.261 6.462 2.417
320 HA ALA 44 HA ALA 44 18.761 7.081 5.181
321 HB1 ALA 44 1HB ALA 44 16.828 8.633 3.526
322 HB2 ALA 44 2HB ALA 44 18.003 9.197 4.715
323 HB3 ALA 44 3HB ALA 44 18.543 8.681 3.118
324 H TYR 45 H TYR 45 16.178 5.684 3.336
325 HA TYR 45 HA TYR 45 13.964 6.177 4.907
326 HB2 TYR 45 2HB TYR 45 14.779 3.876 3.175
327 HB3 TYR 45 3HB TYR 45 13.320 3.742 4.150
328 HD1 TYR 45 HD2 TYR 45 12.097 6.341 4.007
329 HD2 TYR 45 HD1 TYR 45 14.170 4.200 0.970
330 HE1 TYR 45 HE2 TYR 45 10.832 7.565 2.289
331 HE2 TYR 45 HE1 TYR 45 12.911 5.419 -0.756
332 HH TYR 45 HH TYR 45 11.521 7.139 -1.152
333 H LYS 46 H LYS 46 16.591 3.911 5.432
334 HA LYS 46 HA LYS 46 17.221 2.694 7.246
335 HB2 LYS 46 2HB LYS 46 15.915 5.008 8.295
336 HB3 LYS 46 3HB LYS 46 15.481 3.626 9.294
337 HG2 LYS 46 2HG LYS 46 18.098 3.190 9.140
338 HG3 LYS 46 3HG LYS 46 18.104 4.939 8.900
339 HD2 LYS 46 2HD LYS 46 16.868 5.248 10.971
340 HD3 LYS 46 3HD LYS 46 16.777 3.500 11.199
341 HE2 LYS 46 2HE LYS 46 19.251 3.431 11.286
342 HE3 LYS 46 3HE LYS 46 19.277 5.190 11.173
343 HZ1 LYS 46 3HZ LYS 46 19.470 4.595 13.450
344 HZ2 LYS 46 1HZ LYS 46 18.140 3.552 13.370
345 HZ3 LYS 46 2HZ LYS 46 17.915 5.223 13.235
346 H GLY 47 H GLY 47 14.746 2.064 5.589
347 HA2 GLY 47 2HA GLY 47 13.349 0.330 7.517
348 HA3 GLY 47 3HA GLY 47 12.706 0.840 5.963
349 H LYS 48 H LYS 48 15.948 -0.409 6.570
350 HA LYS 48 HA LYS 48 15.917 -2.179 4.410
351 HB2 LYS 48 2HB LYS 48 17.881 -1.265 5.898
352 HB3 LYS 48 3HB LYS 48 17.607 -2.739 6.817
353 HG2 LYS 48 2HG LYS 48 17.799 -3.931 4.540
354 HG3 LYS 48 3HG LYS 48 18.541 -2.426 3.993
355 HD2 LYS 48 2HD LYS 48 19.637 -3.315 6.526
356 HD3 LYS 48 3HD LYS 48 19.814 -4.540 5.266
357 HE2 LYS 48 2HE LYS 48 20.542 -1.674 4.763
358 HE3 LYS 48 3HE LYS 48 21.673 -2.776 5.547
359 HZ1 LYS 48 3HZ LYS 48 20.825 -2.658 2.782
360 HZ2 LYS 48 1HZ LYS 48 20.908 -4.219 3.430
361 HZ3 LYS 48 2HZ LYS 48 22.275 -3.222 3.448
362 H GLY 49 H GLY 49 14.584 -2.483 7.563
363 HA2 GLY 49 2HA GLY 49 14.635 -5.201 8.050
364 HA3 GLY 49 3HA GLY 49 13.309 -4.144 8.510
365 H ASN 50 H ASN 50 12.776 -3.464 5.666
366 HA ASN 50 HA ASN 50 11.373 -5.954 4.963
367 HB2 ASN 50 2HB ASN 50 10.665 -3.056 4.613
368 HB3 ASN 50 3HB ASN 50 9.936 -4.282 3.579
369 HD21 ASN 50 1HD2 ASN 50 8.948 -6.147 4.761
370 HD22 ASN 50 2HD2 ASN 50 8.069 -5.786 6.204
371 HA PRO 51 HA PRO 51 13.512 -6.290 1.146
372 HB2 PRO 51 2HB PRO 51 11.562 -7.197 -0.510
373 HB3 PRO 51 3HB PRO 51 12.291 -8.196 0.751
374 HG2 PRO 51 2HG PRO 51 9.699 -6.700 0.783
375 HG3 PRO 51 3HG PRO 51 10.053 -8.336 1.367
376 HD2 PRO 51 2HD PRO 51 9.871 -6.205 3.026
377 HD3 PRO 51 3HD PRO 51 10.960 -7.571 3.342
378 H GLU 52 H GLU 52 10.808 -4.183 1.430
379 HA GLU 52 HA GLU 52 10.497 -3.135 -1.098
380 HB2 GLU 52 2HB GLU 52 9.899 -0.985 0.070
381 HB3 GLU 52 3HB GLU 52 9.039 -2.410 0.639
382 HG2 GLU 52 2HG GLU 52 10.759 -2.553 2.483
383 HG3 GLU 52 3HG GLU 52 11.290 -0.949 1.982
384 H VAL 53 H VAL 53 12.842 -2.126 1.379
385 HA VAL 53 HA VAL 53 14.126 -0.270 -0.418
386 HB VAL 53 HB VAL 53 15.132 -1.231 2.261
387 HG11 VAL 53 1HG1 VAL 53 16.904 -0.093 1.362
388 HG12 VAL 53 2HG1 VAL 53 15.877 0.956 0.384
389 HG13 VAL 53 3HG1 VAL 53 16.032 1.240 2.118
390 HG21 VAL 53 3HG2 VAL 53 12.915 0.562 1.566
391 HG22 VAL 53 1HG2 VAL 53 13.249 -0.305 3.065
392 HG23 VAL 53 2HG2 VAL 53 14.062 1.224 2.731
393 H GLU 54 H GLU 54 14.433 -3.594 0.384
394 HA GLU 54 HA GLU 54 17.180 -3.946 -0.225
395 HB2 GLU 54 2HB GLU 54 14.875 -5.899 -0.270
396 HB3 GLU 54 3HB GLU 54 16.561 -6.357 -0.463
397 HG2 GLU 54 2HG GLU 54 16.918 -5.184 1.797
398 HG3 GLU 54 3HG GLU 54 15.166 -5.299 1.961
399 H ALA 55 H ALA 55 14.222 -4.440 -2.135
400 HA ALA 55 HA ALA 55 15.577 -5.211 -4.507
401 HB1 ALA 55 1HB ALA 55 13.470 -5.886 -4.819
402 HB2 ALA 55 2HB ALA 55 12.825 -4.694 -3.690
403 HB3 ALA 55 3HB ALA 55 13.160 -4.236 -5.360
404 H LEU 56 H LEU 56 14.175 -2.133 -3.420
405 HA LEU 56 HA LEU 56 14.680 -0.644 -5.727
406 HB2 LEU 56 2HB LEU 56 14.105 -0.073 -2.902
407 HB3 LEU 56 3HB LEU 56 14.952 1.210 -3.764
408 HG LEU 56 HG LEU 56 13.163 1.526 -5.262
409 HD11 LEU 56 1HD1 LEU 56 12.379 -0.467 -6.017
410 HD12 LEU 56 2HD1 LEU 56 11.097 -0.093 -4.866
411 HD13 LEU 56 3HD1 LEU 56 12.388 -1.208 -4.416
412 HD21 LEU 56 3HD2 LEU 56 11.234 1.131 -3.218
413 HD22 LEU 56 1HD2 LEU 56 12.026 2.628 -3.710
414 HD23 LEU 56 2HD2 LEU 56 12.747 1.620 -2.455
415 H ARG 57 H ARG 57 16.647 -0.910 -2.766
416 HA ARG 57 HA ARG 57 18.790 0.657 -3.685
417 HB2 ARG 57 2HB ARG 57 18.223 -0.227 -1.296
418 HB3 ARG 57 3HB ARG 57 19.191 -1.615 -1.771
419 HG2 ARG 57 2HG ARG 57 21.121 -0.490 -1.596
420 HG3 ARG 57 3HG ARG 57 20.443 0.985 -2.287
421 HD2 ARG 57 2HD ARG 57 20.238 1.871 -0.263
422 HD3 ARG 57 3HD ARG 57 19.235 0.516 0.253
423 HE ARG 57 HE ARG 57 22.067 -0.023 0.273
424 HH11 ARG 57 1HH1 ARG 57 19.346 1.187 2.077
425 HH12 ARG 57 2HH1 ARG 57 20.070 0.887 3.622
426 HH21 ARG 57 1HH2 ARG 57 23.031 -0.423 2.301
427 HH22 ARG 57 2HH2 ARG 57 22.166 -0.028 3.748
428 H LYS 58 H LYS 58 18.155 -2.811 -3.887
429 HA LYS 58 HA LYS 58 20.645 -3.616 -4.890
430 HB2 LYS 58 2HB LYS 58 18.992 -5.206 -4.052
431 HB3 LYS 58 3HB LYS 58 17.906 -4.802 -5.376
432 HG2 LYS 58 2HG LYS 58 18.903 -6.236 -6.745
433 HG3 LYS 58 3HG LYS 58 20.507 -5.616 -6.344
434 HD2 LYS 58 2HD LYS 58 19.065 -7.372 -4.401
435 HD3 LYS 58 3HD LYS 58 19.883 -8.091 -5.790
436 HE2 LYS 58 2HE LYS 58 21.944 -7.628 -4.981
437 HE3 LYS 58 3HE LYS 58 21.435 -6.099 -4.265
438 HZ1 LYS 58 3HZ LYS 58 20.236 -8.322 -2.949
439 HZ2 LYS 58 1HZ LYS 58 21.170 -7.068 -2.302
440 HZ3 LYS 58 2HZ LYS 58 21.923 -8.444 -2.933
441 H GLU 59 H GLU 59 17.630 -2.935 -6.673
442 HA GLU 59 HA GLU 59 18.637 -3.231 -9.242
443 HB2 GLU 59 2HB GLU 59 16.324 -1.841 -8.028
444 HB3 GLU 59 3HB GLU 59 16.791 -1.296 -9.633
445 HG2 GLU 59 2HG GLU 59 16.275 -3.304 -10.619
446 HG3 GLU 59 3HG GLU 59 16.472 -4.212 -9.121
447 H ALA 60 H ALA 60 18.316 -0.221 -7.360
448 HA ALA 60 HA ALA 60 19.402 1.558 -9.159
449 HB1 ALA 60 1HB ALA 60 18.901 1.503 -6.316
450 HB2 ALA 60 2HB ALA 60 20.366 2.412 -6.693
451 HB3 ALA 60 3HB ALA 60 18.834 2.856 -7.446
452 H ALA 61 H ALA 61 21.156 -0.283 -6.661
453 HA ALA 61 HA ALA 61 23.719 0.625 -7.209
454 HB1 ALA 61 1HB ALA 61 24.474 -1.569 -6.249
455 HB2 ALA 61 2HB ALA 61 23.340 -0.662 -5.248
456 HB3 ALA 61 3HB ALA 61 22.777 -2.045 -6.186
457 H ALA 62 H ALA 62 21.962 -2.102 -8.649
458 HA ALA 62 HA ALA 62 24.011 -3.106 -10.253
459 HB1 ALA 62 1HB ALA 62 21.733 -3.547 -11.734
460 HB2 ALA 62 2HB ALA 62 22.356 -4.589 -10.454
461 HB3 ALA 62 3HB ALA 62 21.119 -3.385 -10.089
462 H ILE 63 H ILE 63 21.527 -0.677 -11.019
463 HA ILE 63 HA ILE 63 22.268 -0.213 -13.673
464 HB ILE 63 HB ILE 63 21.103 1.791 -11.737
465 HG12 ILE 63 2HG1 ILE 63 19.629 0.008 -13.678
466 HG13 ILE 63 3HG1 ILE 63 19.858 -0.402 -11.981
467 HG21 ILE 63 1HG2 ILE 63 21.839 2.977 -13.628
468 HG22 ILE 63 2HG2 ILE 63 21.304 1.711 -14.732
469 HG23 ILE 63 3HG2 ILE 63 20.117 2.709 -13.894
470 HD11 ILE 63 3HD1 ILE 63 18.444 2.050 -13.000
471 HD12 ILE 63 1HD1 ILE 63 17.662 0.580 -12.422
472 HD13 ILE 63 2HD1 ILE 63 18.618 1.564 -11.314
473 H ARG 64 H ARG 64 23.356 1.352 -10.681
474 HA ARG 64 HA ARG 64 24.973 3.318 -11.825
475 HB2 ARG 64 2HB ARG 64 24.368 3.293 -9.449
476 HB3 ARG 64 3HB ARG 64 25.351 1.855 -9.206
477 HG2 ARG 64 2HG ARG 64 27.169 3.543 -10.294
478 HG3 ARG 64 3HG ARG 64 26.138 4.670 -9.410
479 HD2 ARG 64 2HD ARG 64 26.402 3.226 -7.398
480 HD3 ARG 64 3HD ARG 64 27.558 2.252 -8.304
481 HE ARG 64 HE ARG 64 28.209 5.050 -8.239
482 HH11 ARG 64 1HH1 ARG 64 28.488 2.007 -6.571
483 HH12 ARG 64 2HH1 ARG 64 29.917 2.464 -5.705
484 HH21 ARG 64 1HH2 ARG 64 30.089 5.664 -7.105
485 HH22 ARG 64 2HH2 ARG 64 30.827 4.545 -6.008
486 H ASP 65 H ASP 65 25.805 0.026 -10.772
487 HA ASP 65 HA ASP 65 28.527 0.106 -11.378
488 HB2 ASP 65 2HB ASP 65 26.641 -2.257 -11.501
489 HB3 ASP 65 3HB ASP 65 28.399 -2.359 -11.463
490 H GLU 66 H GLU 66 25.761 -0.792 -13.404
491 HA GLU 66 HA GLU 66 27.195 -1.621 -15.660
492 HB2 GLU 66 2HB GLU 66 24.502 -0.253 -15.665
493 HB3 GLU 66 3HB GLU 66 25.141 -1.335 -16.894
494 HG2 GLU 66 2HG GLU 66 25.165 -2.639 -14.345
495 HG3 GLU 66 3HG GLU 66 23.561 -1.987 -14.675
496 H CYS 67 H CYS 67 25.849 1.571 -14.854
497 HA CYS 67 HA CYS 67 26.619 2.918 -17.165
498 HB2 CYS 67 2HB CYS 67 26.305 3.911 -14.329
499 HB3 CYS 67 3HB CYS 67 26.569 4.977 -15.704
500 HG CYS 67 HG CYS 67 23.860 5.047 -14.984
501 H GLN 68 H GLN 68 28.414 2.319 -14.179
502 HA GLN 68 HA GLN 68 30.674 3.884 -14.884
503 HB2 GLN 68 2HB GLN 68 30.647 1.528 -12.999
504 HB3 GLN 68 3HB GLN 68 31.758 2.892 -12.994
505 HG2 GLN 68 2HG GLN 68 29.149 3.942 -12.761
506 HG3 GLN 68 3HG GLN 68 29.278 2.593 -11.633
507 HE21 GLN 68 1HE2 GLN 68 29.427 3.648 -9.743
508 HE22 GLN 68 2HE2 GLN 68 30.680 4.766 -9.338
509 H ALA 69 H ALA 69 29.733 0.570 -15.482
510 HA ALA 69 HA ALA 69 32.325 -0.235 -16.443
511 HB1 ALA 69 1HB ALA 69 31.107 -2.299 -17.161
512 HB2 ALA 69 2HB ALA 69 30.967 -1.922 -15.443
513 HB3 ALA 69 3HB ALA 69 29.627 -1.571 -16.535
514 H TYR 70 H TYR 70 29.920 1.671 -17.706
515 HA TYR 70 HA TYR 70 30.475 0.868 -20.477
516 HB2 TYR 70 2HB TYR 70 28.283 2.621 -19.351
517 HB3 TYR 70 3HB TYR 70 28.504 2.260 -21.059
518 HD1 TYR 70 HD2 TYR 70 29.296 -0.683 -20.635
519 HD2 TYR 70 HD1 TYR 70 26.098 1.684 -19.129
520 HE1 TYR 70 HE2 TYR 70 27.922 -2.708 -20.387
521 HE2 TYR 70 HE1 TYR 70 24.716 -0.334 -18.875
522 HH TYR 70 HH TYR 70 25.047 -2.983 -20.314
523 H ARG 71 H ARG 71 30.607 3.567 -18.231
524 HA ARG 71 HA ARG 71 32.349 4.977 -20.130
525 HB2 ARG 71 2HB ARG 71 29.861 5.844 -19.830
526 HB3 ARG 71 3HB ARG 71 30.539 6.582 -18.385
527 HG2 ARG 71 2HG ARG 71 32.381 7.367 -20.141
528 HG3 ARG 71 3HG ARG 71 31.006 7.207 -21.235
529 HD2 ARG 71 2HD ARG 71 29.804 8.533 -19.261
530 HD3 ARG 71 3HD ARG 71 31.453 9.099 -18.997
531 HE ARG 71 HE ARG 71 29.702 9.900 -21.076
532 HH11 ARG 71 1HH1 ARG 71 33.048 9.217 -20.403
533 HH12 ARG 71 2HH1 ARG 71 33.648 10.275 -21.638
534 HH21 ARG 71 1HH2 ARG 71 30.478 11.295 -22.705
535 HH22 ARG 71 2HH2 ARG 71 32.185 11.457 -22.946
536 H HIS 72 H HIS 72 33.208 3.347 -18.039
537 HA HIS 72 HA HIS 72 34.996 5.044 -16.695
538 HB2 HIS 72 2HB HIS 72 32.498 5.042 -15.479
539 HB3 HIS 72 3HB HIS 72 33.431 3.893 -14.525
540 HD1 HIS 72 HD1 HIS 72 36.085 5.097 -14.186
541 HD2 HIS 72 HD2 HIS 72 32.651 7.434 -14.255
542 HE1 HIS 72 HE1 HIS 72 36.703 7.234 -13.013
543 H ASN 73 H ASN 73 34.920 2.559 -18.177
544 HA ASN 73 HA ASN 73 36.474 0.939 -16.319
545 HB2 ASN 73 2HB ASN 73 34.364 -0.132 -16.076
546 HB3 ASN 73 3HB ASN 73 34.043 -0.052 -17.806
547 HD21 ASN 73 1HD2 ASN 73 35.824 -1.659 -15.289
548 HD22 ASN 73 2HD2 ASN 73 36.287 -3.038 -16.221
Start of MODEL 7
1 H1 MET 1 H MET 1 0.344 0.681 -1.380
2 HA MET 1 HA MET 1 2.606 0.178 -2.710
3 HB2 MET 1 2HB MET 1 0.545 2.304 -3.171
4 HB3 MET 1 3HB MET 1 1.934 2.187 -4.243
5 HG2 MET 1 2HG MET 1 0.966 0.556 -5.371
6 HG3 MET 1 3HG MET 1 0.820 -0.409 -3.904
7 HE1 MET 1 3HE MET 1 -2.018 -1.475 -4.320
8 HE2 MET 1 1HE MET 1 -2.530 -0.640 -5.787
9 HE3 MET 1 2HE MET 1 -0.879 -1.243 -5.647
10 H GLY 2 H GLY 2 1.911 3.290 -1.138
11 HA2 GLY 2 2HA GLY 2 3.302 4.985 -0.460
12 HA3 GLY 2 3HA GLY 2 4.558 3.761 -0.357
13 H SER 3 H SER 3 6.303 4.472 -1.380
14 HA SER 3 HA SER 3 5.946 5.883 -3.940
15 HB2 SER 3 2HB SER 3 8.299 6.001 -2.037
16 HB3 SER 3 3HB SER 3 8.129 6.921 -3.532
17 HG SER 3 HG SER 3 6.364 7.086 -1.314
18 H TRP 4 H TRP 4 6.030 2.965 -3.482
19 HA TRP 4 HA TRP 4 8.582 2.063 -4.458
20 HB2 TRP 4 2HB TRP 4 7.403 0.562 -3.023
21 HB3 TRP 4 3HB TRP 4 5.942 0.672 -4.000
22 HD1 TRP 4 HD1 TRP 4 6.064 -0.551 -6.469
23 HE1 TRP 4 HE1 TRP 4 7.361 -2.655 -7.189
24 HE3 TRP 4 HE3 TRP 4 9.462 -0.756 -2.654
25 HZ2 TRP 4 HZ2 TRP 4 9.536 -4.197 -6.263
26 HZ3 TRP 4 HZ3 TRP 4 11.116 -2.578 -2.645
27 HH2 TRP 4 HH2 TRP 4 11.151 -4.262 -4.413
28 H ALA 5 H ALA 5 5.282 2.166 -5.801
29 HA ALA 5 HA ALA 5 5.793 1.182 -8.326
30 HB1 ALA 5 1HB ALA 5 3.939 3.337 -8.568
31 HB2 ALA 5 2HB ALA 5 3.627 1.601 -8.552
32 HB3 ALA 5 3HB ALA 5 3.660 2.505 -7.038
33 H GLU 6 H GLU 6 6.021 4.556 -7.223
34 HA GLU 6 HA GLU 6 6.757 5.676 -9.684
35 HB2 GLU 6 2HB GLU 6 7.545 6.619 -6.922
36 HB3 GLU 6 3HB GLU 6 7.555 7.585 -8.391
37 HG2 GLU 6 2HG GLU 6 4.964 6.450 -8.051
38 HG3 GLU 6 3HG GLU 6 5.457 7.226 -6.547
39 H PHE 7 H PHE 7 8.778 4.556 -6.980
40 HA PHE 7 HA PHE 7 11.258 5.150 -8.148
41 HB2 PHE 7 2HB PHE 7 10.290 3.590 -5.862
42 HB3 PHE 7 3HB PHE 7 11.781 2.966 -6.560
43 HD1 PHE 7 HD2 PHE 7 10.373 6.341 -5.796
44 HD2 PHE 7 HD1 PHE 7 13.672 3.670 -5.490
45 HE1 PHE 7 HE2 PHE 7 11.651 8.064 -4.592
46 HE2 PHE 7 HE1 PHE 7 14.956 5.388 -4.284
47 HZ PHE 7 HZ PHE 7 13.946 7.589 -3.835
48 H LYS 8 H LYS 8 9.193 2.307 -8.360
49 HA LYS 8 HA LYS 8 11.046 0.644 -9.707
50 HB2 LYS 8 2HB LYS 8 8.193 0.576 -9.027
51 HB3 LYS 8 3HB LYS 8 8.581 -0.251 -10.530
52 HG2 LYS 8 2HG LYS 8 10.521 -1.219 -8.919
53 HG3 LYS 8 3HG LYS 8 9.218 -0.969 -7.755
54 HD2 LYS 8 2HD LYS 8 8.987 -3.185 -8.578
55 HD3 LYS 8 3HD LYS 8 7.713 -2.227 -9.336
56 HE2 LYS 8 2HE LYS 8 9.041 -2.032 -11.363
57 HE3 LYS 8 3HE LYS 8 10.361 -2.921 -10.605
58 HZ1 LYS 8 3HZ LYS 8 9.298 -4.548 -11.807
59 HZ2 LYS 8 1HZ LYS 8 7.753 -3.914 -11.535
60 HZ3 LYS 8 2HZ LYS 8 8.562 -4.732 -10.295
61 H GLN 9 H GLN 9 8.570 2.900 -10.827
62 HA GLN 9 HA GLN 9 8.742 2.269 -13.570
63 HB2 GLN 9 2HB GLN 9 7.300 4.083 -11.952
64 HB3 GLN 9 3HB GLN 9 8.108 5.043 -13.185
65 HG2 GLN 9 2HG GLN 9 7.069 3.811 -14.935
66 HG3 GLN 9 3HG GLN 9 6.435 2.623 -13.798
67 HE21 GLN 9 1HE2 GLN 9 4.384 2.854 -13.308
68 HE22 GLN 9 2HE2 GLN 9 3.483 4.328 -13.342
69 H ARG 10 H ARG 10 10.108 5.057 -11.807
70 HA ARG 10 HA ARG 10 11.632 6.076 -13.898
71 HB2 ARG 10 2HB ARG 10 12.235 6.173 -10.936
72 HB3 ARG 10 3HB ARG 10 12.957 7.211 -12.158
73 HG2 ARG 10 2HG ARG 10 11.219 8.597 -12.144
74 HG3 ARG 10 3HG ARG 10 10.059 7.271 -12.242
75 HD2 ARG 10 2HD ARG 10 9.498 7.861 -10.156
76 HD3 ARG 10 3HD ARG 10 10.980 7.030 -9.684
77 HE ARG 10 HE ARG 10 11.827 9.049 -9.067
78 HH11 ARG 10 1HH1 ARG 10 9.301 9.586 -11.402
79 HH12 ARG 10 2HH1 ARG 10 9.384 11.313 -11.289
80 HH21 ARG 10 1HH2 ARG 10 11.947 11.322 -8.910
81 HH22 ARG 10 2HH2 ARG 10 10.890 12.299 -9.873
82 H LEU 11 H LEU 11 12.501 3.693 -11.423
83 HA LEU 11 HA LEU 11 15.198 3.394 -12.182
84 HB2 LEU 11 2HB LEU 11 13.260 1.660 -10.692
85 HB3 LEU 11 3HB LEU 11 14.888 1.095 -11.060
86 HG LEU 11 HG LEU 11 14.343 3.627 -9.524
87 HD11 LEU 11 1HD1 LEU 11 14.151 0.842 -8.672
88 HD12 LEU 11 2HD1 LEU 11 13.586 2.314 -7.883
89 HD13 LEU 11 3HD1 LEU 11 15.265 1.807 -7.703
90 HD21 LEU 11 3HD2 LEU 11 16.566 3.820 -9.324
91 HD22 LEU 11 1HD2 LEU 11 16.629 2.738 -10.716
92 HD23 LEU 11 2HD2 LEU 11 16.794 2.087 -9.085
93 H ALA 12 H ALA 12 12.236 1.845 -13.276
94 HA ALA 12 HA ALA 12 13.432 -0.209 -14.799
95 HB1 ALA 12 1HB ALA 12 11.242 -0.347 -15.937
96 HB2 ALA 12 2HB ALA 12 11.106 -0.333 -14.178
97 HB3 ALA 12 3HB ALA 12 10.746 1.125 -15.102
98 H ALA 13 H ALA 13 12.330 3.053 -15.663
99 HA ALA 13 HA ALA 13 12.932 2.864 -18.416
100 HB1 ALA 13 1HB ALA 13 12.217 5.006 -18.557
101 HB2 ALA 13 2HB ALA 13 11.589 4.653 -16.946
102 HB3 ALA 13 3HB ALA 13 13.116 5.517 -17.128
103 H ILE 14 H ILE 14 14.793 4.024 -15.638
104 HA ILE 14 HA ILE 14 17.008 4.980 -17.111
105 HB ILE 14 HB ILE 14 16.872 4.010 -14.254
106 HG12 ILE 14 2HG1 ILE 14 17.061 6.876 -15.100
107 HG13 ILE 14 3HG1 ILE 14 15.499 6.066 -15.155
108 HG21 ILE 14 1HG2 ILE 14 19.118 4.737 -15.881
109 HG22 ILE 14 2HG2 ILE 14 18.922 5.897 -14.568
110 HG23 ILE 14 3HG2 ILE 14 19.085 4.179 -14.209
111 HD11 ILE 14 3HD1 ILE 14 16.656 5.491 -12.646
112 HD12 ILE 14 1HD1 ILE 14 16.835 7.221 -12.933
113 HD13 ILE 14 2HD1 ILE 14 15.238 6.476 -13.003
114 H LYS 15 H LYS 15 16.269 1.848 -15.656
115 HA LYS 15 HA LYS 15 18.796 0.667 -16.161
116 HB2 LYS 15 2HB LYS 15 16.794 -0.085 -14.621
117 HB3 LYS 15 3HB LYS 15 16.294 -0.969 -16.057
118 HG2 LYS 15 2HG LYS 15 17.927 -2.492 -15.846
119 HG3 LYS 15 3HG LYS 15 19.116 -1.299 -15.318
120 HD2 LYS 15 2HD LYS 15 18.844 -1.946 -13.209
121 HD3 LYS 15 3HD LYS 15 17.127 -1.545 -13.296
122 HE2 LYS 15 2HE LYS 15 18.171 -4.126 -14.406
123 HE3 LYS 15 3HE LYS 15 17.813 -3.957 -12.688
124 HZ1 LYS 15 3HZ LYS 15 15.917 -3.609 -14.944
125 HZ2 LYS 15 1HZ LYS 15 15.547 -3.249 -13.333
126 HZ3 LYS 15 2HZ LYS 15 15.904 -4.839 -13.783
127 H THR 16 H THR 16 15.750 0.727 -17.960
128 HA THR 16 HA THR 16 16.490 -1.056 -20.000
129 HB THR 16 HB THR 16 14.560 1.268 -20.146
130 HG1 THR 16 HG1 THR 16 14.078 -1.499 -19.651
131 HG21 THR 16 3HG2 THR 16 13.525 -0.160 -21.963
132 HG22 THR 16 1HG2 THR 16 15.019 -1.096 -21.956
133 HG23 THR 16 2HG2 THR 16 15.054 0.617 -22.375
134 H ARG 17 H ARG 17 16.552 2.509 -19.950
135 HA ARG 17 HA ARG 17 17.756 2.793 -22.486
136 HB2 ARG 17 2HB ARG 17 17.665 4.650 -20.106
137 HB3 ARG 17 3HB ARG 17 18.308 5.109 -21.676
138 HG2 ARG 17 2HG ARG 17 16.223 5.045 -22.692
139 HG3 ARG 17 3HG ARG 17 15.529 4.036 -21.422
140 HD2 ARG 17 2HD ARG 17 14.656 5.968 -20.680
141 HD3 ARG 17 3HD ARG 17 16.263 6.227 -20.003
142 HE ARG 17 HE ARG 17 16.611 7.888 -21.544
143 HH11 ARG 17 1HH1 ARG 17 13.830 6.013 -22.477
144 HH12 ARG 17 2HH1 ARG 17 13.363 7.097 -23.746
145 HH21 ARG 17 1HH2 ARG 17 16.007 9.322 -23.212
146 HH22 ARG 17 2HH2 ARG 17 14.602 8.978 -24.164
147 H CYS 18 H CYS 18 19.057 2.313 -19.275
148 HA CYS 18 HA CYS 18 21.752 2.977 -19.941
149 HB2 CYS 18 2HB CYS 18 21.264 3.147 -17.655
150 HB3 CYS 18 3HB CYS 18 20.437 1.595 -17.621
151 HG CYS 18 HG CYS 18 22.459 0.174 -16.912
152 H GLN 19 H GLN 19 19.905 -0.029 -19.752
153 HA GLN 19 HA GLN 19 22.128 -1.731 -20.275
154 HB2 GLN 19 2HB GLN 19 19.154 -2.203 -20.523
155 HB3 GLN 19 3HB GLN 19 20.372 -3.457 -20.709
156 HG2 GLN 19 2HG GLN 19 20.709 -1.984 -18.241
157 HG3 GLN 19 3HG GLN 19 19.107 -2.709 -18.370
158 HE21 GLN 19 1HE2 GLN 19 22.540 -3.335 -18.307
159 HE22 GLN 19 2HE2 GLN 19 22.426 -5.016 -17.925
160 H ALA 20 H ALA 20 19.781 -0.063 -22.262
161 HA ALA 20 HA ALA 20 20.582 -1.443 -24.678
162 HB1 ALA 20 1HB ALA 20 18.724 -0.591 -25.610
163 HB2 ALA 20 2HB ALA 20 18.268 -0.241 -23.943
164 HB3 ALA 20 3HB ALA 20 18.998 1.017 -24.939
165 H LEU 21 H LEU 21 21.270 1.560 -23.034
166 HA LEU 21 HA LEU 21 22.692 3.282 -23.474
167 HB2 LEU 21 2HB LEU 21 24.066 1.001 -24.869
168 HB3 LEU 21 3HB LEU 21 24.780 2.608 -24.754
169 HG LEU 21 HG LEU 21 24.110 0.778 -22.451
170 HD11 LEU 21 1HD1 LEU 21 26.270 0.690 -24.134
171 HD12 LEU 21 2HD1 LEU 21 26.228 0.077 -22.482
172 HD13 LEU 21 3HD1 LEU 21 26.854 1.693 -22.807
173 HD21 LEU 21 3HD2 LEU 21 24.085 2.595 -21.177
174 HD22 LEU 21 1HD2 LEU 21 24.458 3.625 -22.559
175 HD23 LEU 21 2HD2 LEU 21 25.765 2.887 -21.631
176 H GLY 22 H GLY 22 20.813 4.096 -24.801
177 HA2 GLY 22 2HA GLY 22 20.522 3.895 -27.519
178 HA3 GLY 22 3HA GLY 22 20.195 5.367 -26.617
179 H GLY 23 H GLY 23 23.003 5.644 -25.772
180 HA2 GLY 23 2HA GLY 23 25.132 5.992 -26.882
181 HA3 GLY 23 3HA GLY 23 24.244 6.290 -28.370
182 H SER 24 H SER 24 23.293 7.621 -25.275
183 HA SER 24 HA SER 24 23.991 10.295 -26.295
184 HB2 SER 24 2HB SER 24 21.769 9.477 -24.408
185 HB3 SER 24 3HB SER 24 22.148 11.140 -24.857
186 HG SER 24 HG SER 24 21.464 10.762 -26.891
187 H GLU 25 H GLU 25 25.658 11.194 -25.299
188 HA GLU 25 HA GLU 25 26.888 10.212 -22.997
189 HB2 GLU 25 2HB GLU 25 28.062 12.436 -22.948
190 HB3 GLU 25 3HB GLU 25 28.153 11.582 -24.482
191 HG2 GLU 25 2HG GLU 25 25.870 13.200 -24.630
192 HG3 GLU 25 3HG GLU 25 27.136 14.196 -23.915
193 H ALA 26 H ALA 26 24.129 12.215 -23.351
194 HA ALA 26 HA ALA 26 24.280 13.344 -20.688
195 HB1 ALA 26 1HB ALA 26 21.729 13.824 -21.570
196 HB2 ALA 26 2HB ALA 26 23.115 14.889 -21.805
197 HB3 ALA 26 3HB ALA 26 22.651 13.754 -23.072
198 H GLU 27 H GLU 27 22.285 10.952 -22.397
199 HA GLU 27 HA GLU 27 20.494 10.299 -20.411
200 HB2 GLU 27 2HB GLU 27 21.768 8.669 -22.586
201 HB3 GLU 27 3HB GLU 27 20.648 7.925 -21.454
202 HG2 GLU 27 2HG GLU 27 18.960 9.631 -22.099
203 HG3 GLU 27 3HG GLU 27 20.080 10.204 -23.333
204 H CYS 28 H CYS 28 23.676 8.802 -20.979
205 HA CYS 28 HA CYS 28 23.650 7.020 -18.847
206 HB2 CYS 28 2HB CYS 28 26.081 8.473 -19.906
207 HB3 CYS 28 3HB CYS 28 26.058 6.925 -19.070
208 HG CYS 28 HG CYS 28 25.851 7.522 -22.272
209 H ALA 29 H ALA 29 24.768 10.384 -18.952
210 HA ALA 29 HA ALA 29 25.745 10.530 -16.328
211 HB1 ALA 29 1HB ALA 29 24.880 13.072 -16.821
212 HB2 ALA 29 2HB ALA 29 26.428 12.406 -17.342
213 HB3 ALA 29 3HB ALA 29 25.057 12.421 -18.451
214 H ALA 30 H ALA 30 22.530 11.257 -17.647
215 HA ALA 30 HA ALA 30 21.351 12.204 -15.296
216 HB1 ALA 30 1HB ALA 30 19.217 11.723 -16.354
217 HB2 ALA 30 2HB ALA 30 20.337 12.435 -17.517
218 HB3 ALA 30 3HB ALA 30 20.021 10.700 -17.547
219 H PHE 31 H PHE 31 21.741 8.918 -16.523
220 HA PHE 31 HA PHE 31 20.122 7.646 -14.586
221 HB2 PHE 31 2HB PHE 31 22.474 6.469 -16.078
222 HB3 PHE 31 3HB PHE 31 21.152 5.581 -15.327
223 HD1 PHE 31 HD1 PHE 31 18.904 7.393 -16.237
224 HD2 PHE 31 HD2 PHE 31 22.233 5.722 -18.297
225 HE1 PHE 31 HE1 PHE 31 17.642 7.488 -18.347
226 HE2 PHE 31 HE2 PHE 31 20.976 5.815 -20.410
227 HZ PHE 31 HZ PHE 31 18.678 6.700 -20.438
228 H GLU 32 H GLU 32 23.631 8.176 -14.773
229 HA GLU 32 HA GLU 32 24.356 6.861 -12.427
230 HB2 GLU 32 2HB GLU 32 25.771 8.037 -14.333
231 HB3 GLU 32 3HB GLU 32 25.776 9.372 -13.190
232 HG2 GLU 32 2HG GLU 32 26.973 8.175 -11.601
233 HG3 GLU 32 3HG GLU 32 26.575 6.622 -12.332
234 H LYS 33 H LYS 33 23.434 10.251 -12.927
235 HA LYS 33 HA LYS 33 23.756 11.016 -10.212
236 HB2 LYS 33 2HB LYS 33 23.056 12.273 -12.669
237 HB3 LYS 33 3HB LYS 33 21.806 12.660 -11.493
238 HG2 LYS 33 2HG LYS 33 23.122 14.214 -10.634
239 HG3 LYS 33 3HG LYS 33 24.289 12.967 -10.189
240 HD2 LYS 33 2HD LYS 33 24.225 14.006 -12.991
241 HD3 LYS 33 3HD LYS 33 25.012 14.952 -11.725
242 HE2 LYS 33 2HE LYS 33 26.716 13.475 -11.497
243 HE3 LYS 33 3HE LYS 33 25.695 12.079 -11.836
244 HZ1 LYS 33 3HZ LYS 33 27.450 13.387 -13.568
245 HZ2 LYS 33 1HZ LYS 33 25.884 13.642 -14.157
246 HZ3 LYS 33 2HZ LYS 33 26.446 12.067 -13.903
247 H GLU 34 H GLU 34 20.794 10.491 -12.136
248 HA GLU 34 HA GLU 34 18.939 10.721 -10.111
249 HB2 GLU 34 2HB GLU 34 18.917 8.942 -12.551
250 HB3 GLU 34 3HB GLU 34 17.523 9.156 -11.500
251 HG2 GLU 34 2HG GLU 34 18.772 11.628 -12.501
252 HG3 GLU 34 3HG GLU 34 17.976 10.616 -13.705
253 H ILE 35 H ILE 35 20.639 7.784 -11.167
254 HA ILE 35 HA ILE 35 19.433 6.039 -9.315
255 HB ILE 35 HB ILE 35 22.072 5.878 -10.763
256 HG12 ILE 35 2HG1 ILE 35 19.979 5.752 -12.108
257 HG13 ILE 35 3HG1 ILE 35 20.932 4.274 -12.173
258 HG21 ILE 35 1HG2 ILE 35 20.762 3.865 -8.948
259 HG22 ILE 35 2HG2 ILE 35 22.028 3.458 -10.105
260 HG23 ILE 35 3HG2 ILE 35 22.365 4.582 -8.789
261 HD11 ILE 35 3HD1 ILE 35 18.486 4.726 -10.481
262 HD12 ILE 35 1HD1 ILE 35 18.566 3.788 -11.972
263 HD13 ILE 35 2HD1 ILE 35 19.440 3.244 -10.539
264 H ALA 36 H ALA 36 22.403 7.958 -9.168
265 HA ALA 36 HA ALA 36 23.462 6.981 -6.793
266 HB1 ALA 36 1HB ALA 36 23.743 9.442 -8.374
267 HB2 ALA 36 2HB ALA 36 24.176 9.588 -6.670
268 HB3 ALA 36 3HB ALA 36 24.975 8.386 -7.683
269 H ALA 37 H ALA 37 21.196 9.683 -7.268
270 HA ALA 37 HA ALA 37 20.922 10.302 -4.523
271 HB1 ALA 37 1HB ALA 37 20.140 12.072 -5.665
272 HB2 ALA 37 2HB ALA 37 19.612 11.089 -7.031
273 HB3 ALA 37 3HB ALA 37 18.604 11.209 -5.589
274 H PHE 38 H PHE 38 19.163 8.151 -6.690
275 HA PHE 38 HA PHE 38 16.971 7.566 -5.073
276 HB2 PHE 38 2HB PHE 38 18.260 6.394 -7.412
277 HB3 PHE 38 3HB PHE 38 17.525 5.179 -6.370
278 HD1 PHE 38 HD1 PHE 38 16.434 8.654 -7.122
279 HD2 PHE 38 HD2 PHE 38 15.610 4.492 -7.470
280 HE1 PHE 38 HE1 PHE 38 14.228 9.174 -8.079
281 HE2 PHE 38 HE2 PHE 38 13.403 5.006 -8.428
282 HZ PHE 38 HZ PHE 38 12.710 7.350 -8.735
283 H GLU 39 H GLU 39 20.018 5.736 -5.376
284 HA GLU 39 HA GLU 39 19.456 3.914 -3.308
285 HB2 GLU 39 2HB GLU 39 21.878 3.425 -3.352
286 HB3 GLU 39 3HB GLU 39 21.165 3.444 -4.959
287 HG2 GLU 39 2HG GLU 39 22.029 5.719 -5.295
288 HG3 GLU 39 3HG GLU 39 22.788 5.646 -3.706
289 H SER 40 H SER 40 21.101 7.036 -3.322
290 HA SER 40 HA SER 40 22.018 6.944 -0.650
291 HB2 SER 40 2HB SER 40 23.049 8.536 -2.074
292 HB3 SER 40 3HB SER 40 21.498 9.218 -2.564
293 HG SER 40 HG SER 40 22.766 10.421 -0.940
294 H GLU 41 H GLU 41 18.960 7.772 -2.089
295 HA GLU 41 HA GLU 41 17.932 8.997 0.324
296 HB2 GLU 41 2HB GLU 41 16.922 8.531 -2.435
297 HB3 GLU 41 3HB GLU 41 15.730 8.706 -1.155
298 HG2 GLU 41 2HG GLU 41 16.361 10.892 -0.692
299 HG3 GLU 41 3HG GLU 41 17.924 10.711 -1.487
300 H LEU 42 H LEU 42 17.883 5.891 -1.250
301 HA LEU 42 HA LEU 42 15.756 4.834 0.381
302 HB2 LEU 42 2HB LEU 42 17.719 3.457 -1.445
303 HB3 LEU 42 3HB LEU 42 16.332 2.686 -0.679
304 HG LEU 42 HG LEU 42 15.848 5.049 -2.424
305 HD11 LEU 42 1HD1 LEU 42 16.568 2.297 -3.409
306 HD12 LEU 42 2HD1 LEU 42 17.341 3.828 -3.818
307 HD13 LEU 42 3HD1 LEU 42 15.703 3.492 -4.376
308 HD21 LEU 42 3HD2 LEU 42 13.803 4.386 -1.805
309 HD22 LEU 42 1HD2 LEU 42 14.374 2.802 -1.278
310 HD23 LEU 42 2HD2 LEU 42 14.020 3.090 -2.982
311 H GLN 43 H GLN 43 19.209 5.057 0.536
312 HA GLN 43 HA GLN 43 19.552 2.977 2.483
313 HB2 GLN 43 2HB GLN 43 21.835 3.584 2.520
314 HB3 GLN 43 3HB GLN 43 21.317 3.810 0.855
315 HG2 GLN 43 2HG GLN 43 22.247 5.819 0.992
316 HG3 GLN 43 3HG GLN 43 20.858 6.272 1.977
317 HE21 GLN 43 1HE2 GLN 43 21.532 7.446 3.617
318 HE22 GLN 43 2HE2 GLN 43 22.903 7.113 4.613
319 H ALA 44 H ALA 44 18.695 6.308 2.550
320 HA ALA 44 HA ALA 44 19.478 6.779 5.277
321 HB1 ALA 44 1HB ALA 44 19.113 8.473 3.303
322 HB2 ALA 44 2HB ALA 44 17.454 8.478 3.904
323 HB3 ALA 44 3HB ALA 44 18.781 8.939 4.971
324 H TYR 45 H TYR 45 16.767 5.396 3.686
325 HA TYR 45 HA TYR 45 14.690 5.943 5.453
326 HB2 TYR 45 2HB TYR 45 15.288 3.719 3.554
327 HB3 TYR 45 3HB TYR 45 13.964 3.509 4.694
328 HD1 TYR 45 HD1 TYR 45 15.045 6.622 2.968
329 HD2 TYR 45 HD2 TYR 45 12.060 3.612 3.338
330 HE1 TYR 45 HE1 TYR 45 13.569 7.912 1.483
331 HE2 TYR 45 HE2 TYR 45 10.576 4.893 1.853
332 HH TYR 45 HH TYR 45 10.275 6.816 0.764
333 H LYS 46 H LYS 46 16.597 2.927 5.384
334 HA LYS 46 HA LYS 46 17.244 1.497 7.030
335 HB2 LYS 46 2HB LYS 46 16.769 3.756 8.973
336 HB3 LYS 46 3HB LYS 46 17.850 2.383 9.167
337 HG2 LYS 46 2HG LYS 46 19.199 3.250 7.270
338 HG3 LYS 46 3HG LYS 46 18.164 4.680 7.247
339 HD2 LYS 46 2HD LYS 46 19.126 4.131 9.915
340 HD3 LYS 46 3HD LYS 46 20.465 4.287 8.776
341 HE2 LYS 46 2HE LYS 46 19.334 6.413 7.971
342 HE3 LYS 46 3HE LYS 46 18.300 6.282 9.394
343 HZ1 LYS 46 3HZ LYS 46 19.967 7.592 10.195
344 HZ2 LYS 46 1HZ LYS 46 21.162 6.890 9.225
345 HZ3 LYS 46 2HZ LYS 46 20.597 6.074 10.595
346 H GLY 47 H GLY 47 14.618 1.306 6.238
347 HA2 GLY 47 2HA GLY 47 12.846 1.296 8.503
348 HA3 GLY 47 3HA GLY 47 12.500 0.657 6.903
349 H LYS 48 H LYS 48 14.725 -0.090 9.590
350 HA LYS 48 HA LYS 48 15.277 -2.053 10.598
351 HB2 LYS 48 2HB LYS 48 12.516 -2.864 9.670
352 HB3 LYS 48 3HB LYS 48 13.485 -3.741 10.846
353 HG2 LYS 48 2HG LYS 48 13.496 -1.534 12.167
354 HG3 LYS 48 3HG LYS 48 12.152 -1.076 11.119
355 HD2 LYS 48 2HD LYS 48 10.881 -3.002 11.844
356 HD3 LYS 48 3HD LYS 48 12.246 -3.578 12.804
357 HE2 LYS 48 2HE LYS 48 12.034 -1.829 14.353
358 HE3 LYS 48 3HE LYS 48 11.016 -0.880 13.272
359 HZ1 LYS 48 3HZ LYS 48 9.196 -2.269 13.657
360 HZ2 LYS 48 1HZ LYS 48 9.885 -2.062 15.188
361 HZ3 LYS 48 2HZ LYS 48 10.143 -3.498 14.332
362 H GLY 49 H GLY 49 15.815 -1.626 7.702
363 HA2 GLY 49 2HA GLY 49 16.781 -2.790 5.977
364 HA3 GLY 49 3HA GLY 49 17.028 -4.089 7.134
365 H ASN 50 H ASN 50 14.099 -2.647 5.708
366 HA ASN 50 HA ASN 50 12.801 -5.155 5.458
367 HB2 ASN 50 2HB ASN 50 12.216 -2.349 4.744
368 HB3 ASN 50 3HB ASN 50 11.416 -3.560 3.747
369 HD21 ASN 50 1HD2 ASN 50 10.357 -1.658 5.729
370 HD22 ASN 50 2HD2 ASN 50 9.484 -2.619 6.870
371 HA PRO 51 HA PRO 51 14.152 -6.691 1.577
372 HB2 PRO 51 2HB PRO 51 11.858 -7.670 0.505
373 HB3 PRO 51 3HB PRO 51 12.686 -8.437 1.865
374 HG2 PRO 51 2HG PRO 51 10.312 -6.614 1.877
375 HG3 PRO 51 3HG PRO 51 10.587 -8.098 2.807
376 HD2 PRO 51 2HD PRO 51 10.924 -5.631 3.869
377 HD3 PRO 51 3HD PRO 51 11.901 -7.027 4.369
378 H GLU 52 H GLU 52 11.679 -4.269 1.656
379 HA GLU 52 HA GLU 52 11.361 -3.857 -1.119
380 HB2 GLU 52 2HB GLU 52 10.488 -1.619 -0.450
381 HB3 GLU 52 3HB GLU 52 9.737 -2.958 0.407
382 HG2 GLU 52 2HG GLU 52 11.712 -2.376 2.124
383 HG3 GLU 52 3HG GLU 52 11.452 -0.785 1.412
384 H VAL 53 H VAL 53 13.469 -2.306 1.281
385 HA VAL 53 HA VAL 53 14.695 -0.525 -0.559
386 HB VAL 53 HB VAL 53 15.862 -1.514 2.044
387 HG11 VAL 53 1HG1 VAL 53 17.560 -0.311 1.099
388 HG12 VAL 53 2HG1 VAL 53 16.465 0.717 0.172
389 HG13 VAL 53 3HG1 VAL 53 16.682 0.991 1.901
390 HG21 VAL 53 3HG2 VAL 53 13.641 0.370 1.478
391 HG22 VAL 53 1HG2 VAL 53 13.897 -0.702 2.855
392 HG23 VAL 53 2HG2 VAL 53 14.786 0.817 2.743
393 H GLU 54 H GLU 54 15.132 -3.855 0.138
394 HA GLU 54 HA GLU 54 17.854 -4.119 -0.606
395 HB2 GLU 54 2HB GLU 54 15.616 -6.151 -0.660
396 HB3 GLU 54 3HB GLU 54 17.323 -6.527 -0.846
397 HG2 GLU 54 2HG GLU 54 16.226 -5.151 1.584
398 HG3 GLU 54 3HG GLU 54 16.322 -6.905 1.439
399 H ALA 55 H ALA 55 14.826 -4.643 -2.397
400 HA ALA 55 HA ALA 55 16.065 -5.330 -4.845
401 HB1 ALA 55 1HB ALA 55 13.944 -5.972 -5.104
402 HB2 ALA 55 2HB ALA 55 13.362 -4.833 -3.888
403 HB3 ALA 55 3HB ALA 55 13.614 -4.297 -5.549
404 H LEU 56 H LEU 56 14.934 -2.266 -3.500
405 HA LEU 56 HA LEU 56 15.274 -0.708 -5.822
406 HB2 LEU 56 2HB LEU 56 15.513 0.188 -2.954
407 HB3 LEU 56 3HB LEU 56 15.182 1.209 -4.352
408 HG LEU 56 HG LEU 56 13.282 -0.995 -3.694
409 HD11 LEU 56 1HD1 LEU 56 12.578 -0.131 -1.775
410 HD12 LEU 56 2HD1 LEU 56 12.495 1.488 -2.468
411 HD13 LEU 56 3HD1 LEU 56 14.009 0.900 -1.779
412 HD21 LEU 56 3HD2 LEU 56 11.908 1.287 -4.368
413 HD22 LEU 56 1HD2 LEU 56 12.346 -0.018 -5.470
414 HD23 LEU 56 2HD2 LEU 56 13.376 1.408 -5.340
415 H ARG 57 H ARG 57 17.401 -1.134 -2.993
416 HA ARG 57 HA ARG 57 19.527 0.415 -4.002
417 HB2 ARG 57 2HB ARG 57 20.816 -0.428 -2.200
418 HB3 ARG 57 3HB ARG 57 19.166 -0.318 -1.604
419 HG2 ARG 57 2HG ARG 57 18.862 -2.698 -1.895
420 HG3 ARG 57 3HG ARG 57 20.473 -2.839 -2.601
421 HD2 ARG 57 2HD ARG 57 20.401 -1.537 0.025
422 HD3 ARG 57 3HD ARG 57 19.878 -3.221 0.031
423 HE ARG 57 HE ARG 57 22.540 -2.249 -0.337
424 HH11 ARG 57 1HH1 ARG 57 20.345 -4.830 -1.137
425 HH12 ARG 57 2HH1 ARG 57 21.602 -5.996 -1.390
426 HH21 ARG 57 1HH2 ARG 57 24.204 -3.774 -0.667
427 HH22 ARG 57 2HH2 ARG 57 23.796 -5.394 -1.121
428 H LYS 58 H LYS 58 18.674 -2.967 -4.365
429 HA LYS 58 HA LYS 58 21.117 -3.874 -5.446
430 HB2 LYS 58 2HB LYS 58 19.428 -5.418 -4.604
431 HB3 LYS 58 3HB LYS 58 18.304 -4.907 -5.857
432 HG2 LYS 58 2HG LYS 58 19.255 -6.204 -7.420
433 HG3 LYS 58 3HG LYS 58 20.891 -5.887 -6.839
434 HD2 LYS 58 2HD LYS 58 19.342 -7.442 -4.941
435 HD3 LYS 58 3HD LYS 58 19.444 -8.232 -6.517
436 HE2 LYS 58 2HE LYS 58 21.928 -7.073 -5.366
437 HE3 LYS 58 3HE LYS 58 21.303 -8.560 -4.655
438 HZ1 LYS 58 3HZ LYS 58 22.886 -9.028 -6.412
439 HZ2 LYS 58 1HZ LYS 58 21.957 -8.154 -7.524
440 HZ3 LYS 58 2HZ LYS 58 21.348 -9.580 -6.848
441 H GLU 59 H GLU 59 18.079 -2.963 -7.082
442 HA GLU 59 HA GLU 59 19.023 -3.204 -9.699
443 HB2 GLU 59 2HB GLU 59 16.769 -1.751 -8.399
444 HB3 GLU 59 3HB GLU 59 17.177 -1.323 -10.055
445 HG2 GLU 59 2HG GLU 59 15.387 -3.044 -9.813
446 HG3 GLU 59 3HG GLU 59 16.748 -3.520 -10.826
447 H ALA 60 H ALA 60 18.822 -0.310 -7.635
448 HA ALA 60 HA ALA 60 19.850 1.558 -9.395
449 HB1 ALA 60 1HB ALA 60 19.689 1.324 -6.454
450 HB2 ALA 60 2HB ALA 60 20.833 2.506 -7.092
451 HB3 ALA 60 3HB ALA 60 19.127 2.607 -7.526
452 H ALA 61 H ALA 61 21.659 -0.394 -7.023
453 HA ALA 61 HA ALA 61 24.212 0.519 -7.618
454 HB1 ALA 61 1HB ALA 61 25.043 -1.425 -6.527
455 HB2 ALA 61 2HB ALA 61 23.551 -0.965 -5.707
456 HB3 ALA 61 3HB ALA 61 23.553 -2.314 -6.842
457 H ALA 62 H ALA 62 22.391 -2.149 -9.086
458 HA ALA 62 HA ALA 62 24.389 -3.109 -10.784
459 HB1 ALA 62 1HB ALA 62 22.808 -4.552 -11.383
460 HB2 ALA 62 2HB ALA 62 21.714 -3.691 -10.299
461 HB3 ALA 62 3HB ALA 62 21.778 -3.264 -12.009
462 H ILE 63 H ILE 63 21.901 -0.639 -11.366
463 HA ILE 63 HA ILE 63 22.527 -0.105 -14.040
464 HB ILE 63 HB ILE 63 21.424 1.794 -11.966
465 HG12 ILE 63 2HG1 ILE 63 19.904 0.243 -14.060
466 HG13 ILE 63 3HG1 ILE 63 20.171 -0.380 -12.436
467 HG21 ILE 63 1HG2 ILE 63 20.398 2.675 -14.272
468 HG22 ILE 63 2HG2 ILE 63 21.912 3.280 -13.602
469 HG23 ILE 63 3HG2 ILE 63 21.936 2.050 -14.865
470 HD11 ILE 63 3HD1 ILE 63 18.730 2.167 -13.133
471 HD12 ILE 63 1HD1 ILE 63 17.983 0.648 -12.642
472 HD13 ILE 63 2HD1 ILE 63 18.994 1.542 -11.506
473 H ARG 64 H ARG 64 23.755 1.357 -11.051
474 HA ARG 64 HA ARG 64 25.342 3.343 -12.213
475 HB2 ARG 64 2HB ARG 64 24.759 3.103 -9.771
476 HB3 ARG 64 3HB ARG 64 25.984 1.845 -9.672
477 HG2 ARG 64 2HG ARG 64 27.621 3.576 -10.547
478 HG3 ARG 64 3HG ARG 64 26.361 4.769 -10.224
479 HD2 ARG 64 2HD ARG 64 26.455 3.287 -7.899
480 HD3 ARG 64 3HD ARG 64 28.147 3.391 -8.386
481 HE ARG 64 HE ARG 64 26.943 5.934 -8.564
482 HH11 ARG 64 1HH1 ARG 64 28.050 3.612 -6.218
483 HH12 ARG 64 2HH1 ARG 64 28.393 4.803 -5.008
484 HH21 ARG 64 1HH2 ARG 64 27.391 7.512 -6.978
485 HH22 ARG 64 2HH2 ARG 64 28.017 7.021 -5.441
486 H ASP 65 H ASP 65 26.159 0.012 -11.293
487 HA ASP 65 HA ASP 65 28.867 0.084 -11.986
488 HB2 ASP 65 2HB ASP 65 26.890 -2.199 -11.952
489 HB3 ASP 65 3HB ASP 65 28.614 -2.420 -12.237
490 H GLU 66 H GLU 66 26.021 -0.768 -13.922
491 HA GLU 66 HA GLU 66 27.361 -1.553 -16.248
492 HB2 GLU 66 2HB GLU 66 24.664 -0.201 -16.048
493 HB3 GLU 66 3HB GLU 66 25.251 -1.150 -17.407
494 HG2 GLU 66 2HG GLU 66 24.850 -3.120 -16.387
495 HG3 GLU 66 3HG GLU 66 25.249 -2.498 -14.786
496 H CYS 67 H CYS 67 26.079 1.630 -15.319
497 HA CYS 67 HA CYS 67 26.787 3.011 -17.638
498 HB2 CYS 67 2HB CYS 67 26.518 3.961 -14.783
499 HB3 CYS 67 3HB CYS 67 26.761 5.048 -16.145
500 HG CYS 67 HG CYS 67 24.061 5.099 -15.376
501 H GLN 68 H GLN 68 28.636 2.362 -14.698
502 HA GLN 68 HA GLN 68 30.893 3.924 -15.486
503 HB2 GLN 68 2HB GLN 68 30.583 1.766 -13.394
504 HB3 GLN 68 3HB GLN 68 32.037 2.731 -13.607
505 HG2 GLN 68 2HG GLN 68 31.111 4.589 -12.699
506 HG3 GLN 68 3HG GLN 68 29.487 4.190 -13.259
507 HE21 GLN 68 1HE2 GLN 68 30.351 5.065 -10.634
508 HE22 GLN 68 2HE2 GLN 68 29.878 3.827 -9.526
509 H ALA 69 H ALA 69 29.792 0.738 -16.173
510 HA ALA 69 HA ALA 69 32.409 -0.201 -17.024
511 HB1 ALA 69 1HB ALA 69 30.612 -2.094 -17.859
512 HB2 ALA 69 2HB ALA 69 31.454 -2.091 -16.309
513 HB3 ALA 69 3HB ALA 69 29.827 -1.421 -16.430
514 H TYR 70 H TYR 70 30.065 1.725 -18.323
515 HA TYR 70 HA TYR 70 30.444 0.753 -21.063
516 HB2 TYR 70 2HB TYR 70 28.522 2.803 -19.945
517 HB3 TYR 70 3HB TYR 70 28.621 2.340 -21.640
518 HD1 TYR 70 HD2 TYR 70 29.125 -0.661 -21.016
519 HD2 TYR 70 HD1 TYR 70 26.225 2.147 -19.669
520 HE1 TYR 70 HE2 TYR 70 27.542 -2.499 -20.608
521 HE2 TYR 70 HE1 TYR 70 24.635 0.316 -19.257
522 HH TYR 70 HH TYR 70 25.583 -3.061 -19.635
523 H ARG 71 H ARG 71 30.910 3.585 -19.015
524 HA ARG 71 HA ARG 71 32.494 4.817 -21.173
525 HB2 ARG 71 2HB ARG 71 30.576 6.180 -20.546
526 HB3 ARG 71 3HB ARG 71 31.057 6.122 -18.856
527 HG2 ARG 71 2HG ARG 71 32.621 7.719 -19.106
528 HG3 ARG 71 3HG ARG 71 33.081 7.166 -20.718
529 HD2 ARG 71 2HD ARG 71 30.407 8.179 -20.785
530 HD3 ARG 71 3HD ARG 71 31.464 9.370 -20.028
531 HE ARG 71 HE ARG 71 31.408 8.635 -22.782
532 HH11 ARG 71 1HH1 ARG 71 33.490 9.727 -20.215
533 HH12 ARG 71 2HH1 ARG 71 34.628 10.482 -21.282
534 HH21 ARG 71 1HH2 ARG 71 32.899 9.624 -24.197
535 HH22 ARG 71 2HH2 ARG 71 34.290 10.423 -23.547
536 H HIS 72 H HIS 72 32.402 3.958 -17.771
537 HA HIS 72 HA HIS 72 35.131 4.926 -17.381
538 HB2 HIS 72 2HB HIS 72 32.912 4.822 -15.713
539 HB3 HIS 72 3HB HIS 72 33.941 3.520 -15.124
540 HD1 HIS 72 HD1 HIS 72 33.644 7.203 -15.246
541 HD2 HIS 72 HD2 HIS 72 36.473 4.373 -14.129
542 HE1 HIS 72 HE1 HIS 72 35.364 8.462 -13.911
543 H ASN 73 H ASN 73 34.691 2.710 -19.155
544 HA ASN 73 HA ASN 73 36.666 0.930 -18.172
545 HB2 ASN 73 2HB ASN 73 34.578 0.182 -16.918
546 HB3 ASN 73 3HB ASN 73 33.941 -0.331 -18.478
547 HD21 ASN 73 1HD2 ASN 73 34.054 -2.451 -18.583
548 HD22 ASN 73 2HD2 ASN 73 35.414 -3.420 -18.138
Start of MODEL 8
1 H1 MET 1 H MET 1 1.699 -0.656 -3.482
2 HA MET 1 HA MET 1 1.092 1.359 -2.417
3 HB2 MET 1 2HB MET 1 1.274 0.872 0.069
4 HB3 MET 1 3HB MET 1 0.463 -0.347 -0.905
5 HG2 MET 1 2HG MET 1 2.540 -1.664 -0.942
6 HG3 MET 1 3HG MET 1 3.299 -0.458 0.094
7 HE1 MET 1 3HE MET 1 1.123 -3.728 0.060
8 HE2 MET 1 1HE MET 1 2.861 -3.645 0.348
9 HE3 MET 1 2HE MET 1 1.774 -4.131 1.649
10 H GLY 2 H GLY 2 1.702 3.133 -0.966
11 HA2 GLY 2 2HA GLY 2 3.185 4.669 -0.078
12 HA3 GLY 2 3HA GLY 2 4.461 3.472 -0.241
13 H SER 3 H SER 3 6.061 4.301 -1.402
14 HA SER 3 HA SER 3 5.370 5.806 -3.841
15 HB2 SER 3 2HB SER 3 6.587 6.940 -1.740
16 HB3 SER 3 3HB SER 3 8.007 6.272 -2.544
17 HG SER 3 HG SER 3 7.333 8.460 -3.183
18 H TRP 4 H TRP 4 5.849 2.929 -3.487
19 HA TRP 4 HA TRP 4 8.455 2.380 -4.573
20 HB2 TRP 4 2HB TRP 4 7.625 0.657 -3.209
21 HB3 TRP 4 3HB TRP 4 6.033 0.705 -3.962
22 HD1 TRP 4 HD1 TRP 4 5.813 -0.453 -6.416
23 HE1 TRP 4 HE1 TRP 4 7.166 -2.362 -7.489
24 HE3 TRP 4 HE3 TRP 4 9.900 -0.379 -3.345
25 HZ2 TRP 4 HZ2 TRP 4 9.637 -3.665 -7.087
26 HZ3 TRP 4 HZ3 TRP 4 11.714 -1.989 -3.757
27 HH2 TRP 4 HH2 TRP 4 11.583 -3.598 -5.589
28 H ALA 5 H ALA 5 5.166 2.623 -5.805
29 HA ALA 5 HA ALA 5 5.519 1.559 -8.348
30 HB1 ALA 5 1HB ALA 5 3.407 2.530 -7.090
31 HB2 ALA 5 2HB ALA 5 3.790 3.957 -8.053
32 HB3 ALA 5 3HB ALA 5 3.466 2.417 -8.849
33 H GLU 6 H GLU 6 5.899 4.939 -7.289
34 HA GLU 6 HA GLU 6 6.648 5.994 -9.770
35 HB2 GLU 6 2HB GLU 6 6.847 6.848 -6.945
36 HB3 GLU 6 3HB GLU 6 7.972 7.616 -8.057
37 HG2 GLU 6 2HG GLU 6 6.388 8.936 -8.857
38 HG3 GLU 6 3HG GLU 6 5.328 7.565 -9.180
39 H PHE 7 H PHE 7 8.704 4.942 -7.057
40 HA PHE 7 HA PHE 7 11.165 5.379 -8.313
41 HB2 PHE 7 2HB PHE 7 10.208 3.874 -5.962
42 HB3 PHE 7 3HB PHE 7 11.721 3.295 -6.653
43 HD1 PHE 7 HD1 PHE 7 10.035 6.276 -5.257
44 HD2 PHE 7 HD2 PHE 7 13.734 4.444 -6.293
45 HE1 PHE 7 HE1 PHE 7 11.247 8.070 -4.088
46 HE2 PHE 7 HE2 PHE 7 14.952 6.234 -5.125
47 HZ PHE 7 HZ PHE 7 13.709 8.050 -4.020
48 H LYS 8 H LYS 8 8.928 2.696 -8.483
49 HA LYS 8 HA LYS 8 10.686 0.840 -9.712
50 HB2 LYS 8 2HB LYS 8 8.585 0.188 -8.585
51 HB3 LYS 8 3HB LYS 8 7.669 0.988 -9.855
52 HG2 LYS 8 2HG LYS 8 7.741 -1.422 -10.186
53 HG3 LYS 8 3HG LYS 8 8.553 -0.568 -11.501
54 HD2 LYS 8 2HD LYS 8 10.447 -1.664 -11.102
55 HD3 LYS 8 3HD LYS 8 10.431 -1.154 -9.412
56 HE2 LYS 8 2HE LYS 8 10.446 -3.544 -9.465
57 HE3 LYS 8 3HE LYS 8 8.847 -3.020 -8.939
58 HZ1 LYS 8 3HZ LYS 8 9.510 -3.784 -11.729
59 HZ2 LYS 8 1HZ LYS 8 7.974 -3.451 -11.103
60 HZ3 LYS 8 2HZ LYS 8 8.811 -4.832 -10.600
61 H GLN 9 H GLN 9 8.328 3.155 -10.995
62 HA GLN 9 HA GLN 9 8.609 2.440 -13.706
63 HB2 GLN 9 2HB GLN 9 6.950 4.094 -12.347
64 HB3 GLN 9 3HB GLN 9 8.018 5.272 -13.100
65 HG2 GLN 9 2HG GLN 9 7.521 4.338 -15.292
66 HG3 GLN 9 3HG GLN 9 6.469 3.135 -14.547
67 HE21 GLN 9 1HE2 GLN 9 4.829 4.003 -15.954
68 HE22 GLN 9 2HE2 GLN 9 3.969 5.427 -15.489
69 H ARG 10 H ARG 10 10.011 5.189 -11.915
70 HA ARG 10 HA ARG 10 11.622 6.158 -13.972
71 HB2 ARG 10 2HB ARG 10 11.789 6.322 -10.979
72 HB3 ARG 10 3HB ARG 10 13.061 7.010 -11.981
73 HG2 ARG 10 2HG ARG 10 11.658 8.808 -11.589
74 HG3 ARG 10 3HG ARG 10 11.151 8.245 -13.183
75 HD2 ARG 10 2HD ARG 10 9.314 6.993 -12.139
76 HD3 ARG 10 3HD ARG 10 9.816 7.591 -10.558
77 HE ARG 10 HE ARG 10 8.839 9.612 -11.043
78 HH11 ARG 10 1HH1 ARG 10 9.071 7.705 -13.946
79 HH12 ARG 10 2HH1 ARG 10 8.089 8.779 -14.886
80 HH21 ARG 10 1HH2 ARG 10 7.544 11.034 -12.269
81 HH22 ARG 10 2HH2 ARG 10 7.222 10.673 -13.931
82 H LEU 11 H LEU 11 12.344 3.768 -11.454
83 HA LEU 11 HA LEU 11 15.049 3.377 -12.122
84 HB2 LEU 11 2HB LEU 11 14.246 2.620 -10.014
85 HB3 LEU 11 3HB LEU 11 13.026 1.602 -10.776
86 HG LEU 11 HG LEU 11 15.850 0.983 -11.410
87 HD11 LEU 11 1HD1 LEU 11 15.263 -0.429 -9.046
88 HD12 LEU 11 2HD1 LEU 11 14.986 1.279 -8.704
89 HD13 LEU 11 3HD1 LEU 11 16.549 0.747 -9.322
90 HD21 LEU 11 3HD2 LEU 11 14.666 -1.329 -10.749
91 HD22 LEU 11 1HD2 LEU 11 14.536 -0.600 -12.350
92 HD23 LEU 11 2HD2 LEU 11 13.240 -0.382 -11.175
93 H ALA 12 H ALA 12 12.083 1.865 -13.285
94 HA ALA 12 HA ALA 12 13.278 -0.199 -14.784
95 HB1 ALA 12 1HB ALA 12 11.019 -0.516 -14.429
96 HB2 ALA 12 2HB ALA 12 10.612 1.149 -14.845
97 HB3 ALA 12 3HB ALA 12 11.053 0.006 -16.114
98 H ALA 13 H ALA 13 12.259 3.080 -15.692
99 HA ALA 13 HA ALA 13 12.953 2.874 -18.421
100 HB1 ALA 13 1HB ALA 13 12.106 4.933 -18.558
101 HB2 ALA 13 2HB ALA 13 11.699 4.752 -16.851
102 HB3 ALA 13 3HB ALA 13 13.197 5.557 -17.320
103 H ILE 14 H ILE 14 14.741 3.986 -15.579
104 HA ILE 14 HA ILE 14 17.015 4.927 -16.965
105 HB ILE 14 HB ILE 14 16.792 3.903 -14.132
106 HG12 ILE 14 2HG1 ILE 14 17.012 6.788 -14.883
107 HG13 ILE 14 3HG1 ILE 14 15.453 5.989 -15.049
108 HG21 ILE 14 1HG2 ILE 14 18.849 5.816 -14.404
109 HG22 ILE 14 2HG2 ILE 14 18.995 4.109 -13.987
110 HG23 ILE 14 3HG2 ILE 14 19.082 4.614 -15.674
111 HD11 ILE 14 3HD1 ILE 14 16.984 6.686 -12.612
112 HD12 ILE 14 1HD1 ILE 14 15.254 6.791 -12.937
113 HD13 ILE 14 2HD1 ILE 14 15.991 5.229 -12.578
114 H LYS 15 H LYS 15 16.164 1.778 -15.619
115 HA LYS 15 HA LYS 15 18.691 0.564 -16.045
116 HB2 LYS 15 2HB LYS 15 16.277 -0.164 -14.847
117 HB3 LYS 15 3HB LYS 15 16.466 -1.295 -16.181
118 HG2 LYS 15 2HG LYS 15 18.973 -1.211 -15.003
119 HG3 LYS 15 3HG LYS 15 17.847 -1.175 -13.645
120 HD2 LYS 15 2HD LYS 15 17.463 -3.134 -15.876
121 HD3 LYS 15 3HD LYS 15 18.632 -3.462 -14.594
122 HE2 LYS 15 2HE LYS 15 16.777 -4.448 -13.696
123 HE3 LYS 15 3HE LYS 15 16.595 -2.819 -13.047
124 HZ1 LYS 15 3HZ LYS 15 15.283 -3.794 -15.526
125 HZ2 LYS 15 1HZ LYS 15 15.039 -2.298 -14.774
126 HZ3 LYS 15 2HZ LYS 15 14.534 -3.720 -14.011
127 H THR 16 H THR 16 15.717 0.710 -17.957
128 HA THR 16 HA THR 16 16.508 -1.038 -20.008
129 HB THR 16 HB THR 16 14.694 1.343 -20.392
130 HG1 THR 16 HG1 THR 16 13.635 0.412 -18.781
131 HG21 THR 16 3HG2 THR 16 15.318 -1.115 -21.886
132 HG22 THR 16 1HG2 THR 16 14.699 0.434 -22.459
133 HG23 THR 16 2HG2 THR 16 13.600 -0.744 -21.739
134 H ARG 17 H ARG 17 16.608 2.526 -19.888
135 HA ARG 17 HA ARG 17 17.926 2.836 -22.365
136 HB2 ARG 17 2HB ARG 17 17.224 4.554 -20.075
137 HB3 ARG 17 3HB ARG 17 18.630 5.080 -20.991
138 HG2 ARG 17 2HG ARG 17 17.176 6.099 -22.330
139 HG3 ARG 17 3HG ARG 17 16.817 4.491 -22.961
140 HD2 ARG 17 2HD ARG 17 14.836 4.349 -21.853
141 HD3 ARG 17 3HD ARG 17 15.403 5.320 -20.495
142 HE ARG 17 HE ARG 17 15.254 7.089 -22.557
143 HH11 ARG 17 1HH1 ARG 17 13.021 4.855 -21.094
144 HH12 ARG 17 2HH1 ARG 17 11.624 5.815 -21.452
145 HH21 ARG 17 1HH2 ARG 17 13.422 8.362 -23.034
146 HH22 ARG 17 2HH2 ARG 17 11.853 7.809 -22.556
147 H CYS 18 H CYS 18 19.074 2.285 -19.110
148 HA CYS 18 HA CYS 18 21.794 2.963 -19.604
149 HB2 CYS 18 2HB CYS 18 21.110 3.001 -17.339
150 HB3 CYS 18 3HB CYS 18 20.408 1.391 -17.440
151 HG CYS 18 HG CYS 18 22.666 -0.008 -17.210
152 H GLN 19 H GLN 19 19.902 0.021 -19.868
153 HA GLN 19 HA GLN 19 22.153 -1.700 -20.271
154 HB2 GLN 19 2HB GLN 19 19.209 -2.093 -20.821
155 HB3 GLN 19 3HB GLN 19 20.423 -3.354 -20.991
156 HG2 GLN 19 2HG GLN 19 20.431 -2.002 -18.394
157 HG3 GLN 19 3HG GLN 19 18.953 -2.892 -18.758
158 HE21 GLN 19 1HE2 GLN 19 18.998 -4.824 -17.883
159 HE22 GLN 19 2HE2 GLN 19 20.366 -5.873 -17.787
160 H ALA 20 H ALA 20 19.784 -0.138 -22.392
161 HA ALA 20 HA ALA 20 20.912 -1.245 -24.786
162 HB1 ALA 20 1HB ALA 20 19.139 -0.346 -25.860
163 HB2 ALA 20 2HB ALA 20 18.492 -0.238 -24.222
164 HB3 ALA 20 3HB ALA 20 19.232 1.176 -24.972
165 H LEU 21 H LEU 21 21.400 1.621 -22.879
166 HA LEU 21 HA LEU 21 22.776 3.424 -23.095
167 HB2 LEU 21 2HB LEU 21 24.358 1.369 -24.627
168 HB3 LEU 21 3HB LEU 21 24.987 2.942 -24.140
169 HG LEU 21 HG LEU 21 24.018 0.839 -22.207
170 HD11 LEU 21 1HD1 LEU 21 26.362 0.817 -23.760
171 HD12 LEU 21 2HD1 LEU 21 25.959 -0.213 -22.386
172 HD13 LEU 21 3HD1 LEU 21 26.841 1.293 -22.131
173 HD21 LEU 21 3HD2 LEU 21 25.907 3.003 -21.478
174 HD22 LEU 21 1HD2 LEU 21 24.639 2.232 -20.525
175 HD23 LEU 21 2HD2 LEU 21 24.219 3.451 -21.729
176 H GLY 22 H GLY 22 20.695 3.016 -25.153
177 HA2 GLY 22 2HA GLY 22 21.945 4.212 -27.522
178 HA3 GLY 22 3HA GLY 22 20.322 3.543 -27.440
179 H GLY 23 H GLY 23 20.911 5.420 -24.733
180 HA2 GLY 23 2HA GLY 23 19.041 7.413 -25.567
181 HA3 GLY 23 3HA GLY 23 19.918 7.382 -24.045
182 H SER 24 H SER 24 22.368 7.843 -24.358
183 HA SER 24 HA SER 24 23.296 9.395 -26.486
184 HB2 SER 24 2HB SER 24 21.556 10.820 -24.666
185 HB3 SER 24 3HB SER 24 23.177 11.514 -24.650
186 HG SER 24 HG SER 24 21.291 11.442 -26.679
187 H GLU 25 H GLU 25 25.452 9.773 -26.283
188 HA GLU 25 HA GLU 25 26.966 8.420 -24.430
189 HB2 GLU 25 2HB GLU 25 28.861 9.837 -25.145
190 HB3 GLU 25 3HB GLU 25 27.918 9.237 -26.502
191 HG2 GLU 25 2HG GLU 25 26.725 11.439 -26.526
192 HG3 GLU 25 3HG GLU 25 27.898 12.008 -25.340
193 H ALA 26 H ALA 26 25.693 11.687 -24.248
194 HA ALA 26 HA ALA 26 27.104 12.258 -21.780
195 HB1 ALA 26 1HB ALA 26 25.957 13.810 -23.816
196 HB2 ALA 26 2HB ALA 26 25.023 14.145 -22.358
197 HB3 ALA 26 3HB ALA 26 26.771 14.375 -22.357
198 H GLU 27 H GLU 27 23.860 11.395 -22.829
199 HA GLU 27 HA GLU 27 22.389 11.927 -20.559
200 HB2 GLU 27 2HB GLU 27 22.174 10.014 -22.798
201 HB3 GLU 27 3HB GLU 27 21.268 9.586 -21.353
202 HG2 GLU 27 2HG GLU 27 20.374 11.998 -21.467
203 HG3 GLU 27 3HG GLU 27 20.963 11.972 -23.128
204 H CYS 28 H CYS 28 24.631 9.305 -21.167
205 HA CYS 28 HA CYS 28 23.984 7.528 -19.161
206 HB2 CYS 28 2HB CYS 28 26.797 8.289 -19.967
207 HB3 CYS 28 3HB CYS 28 26.281 6.767 -19.250
208 HG CYS 28 HG CYS 28 26.093 5.605 -21.522
209 H ALA 29 H ALA 29 26.003 10.434 -18.940
210 HA ALA 29 HA ALA 29 26.863 10.184 -16.314
211 HB1 ALA 29 1HB ALA 29 27.866 12.088 -16.846
212 HB2 ALA 29 2HB ALA 29 26.887 12.192 -18.310
213 HB3 ALA 29 3HB ALA 29 26.316 12.929 -16.814
214 H ALA 30 H ALA 30 24.004 11.966 -17.490
215 HA ALA 30 HA ALA 30 22.990 12.737 -15.023
216 HB1 ALA 30 1HB ALA 30 22.195 12.984 -17.650
217 HB2 ALA 30 2HB ALA 30 20.898 12.040 -16.917
218 HB3 ALA 30 3HB ALA 30 21.338 13.609 -16.241
219 H PHE 31 H PHE 31 22.684 9.684 -16.734
220 HA PHE 31 HA PHE 31 20.639 8.558 -15.159
221 HB2 PHE 31 2HB PHE 31 22.606 7.594 -17.127
222 HB3 PHE 31 3HB PHE 31 22.090 6.386 -15.954
223 HD1 PHE 31 HD2 PHE 31 19.990 9.140 -17.220
224 HD2 PHE 31 HD1 PHE 31 20.872 4.981 -17.410
225 HE1 PHE 31 HE2 PHE 31 17.933 8.767 -18.517
226 HE2 PHE 31 HE1 PHE 31 18.817 4.601 -18.708
227 HZ PHE 31 HZ PHE 31 17.343 6.495 -19.262
228 H GLU 32 H GLU 32 24.178 8.236 -14.953
229 HA GLU 32 HA GLU 32 24.285 6.549 -12.743
230 HB2 GLU 32 2HB GLU 32 26.236 7.071 -14.131
231 HB3 GLU 32 3HB GLU 32 26.229 8.724 -13.535
232 HG2 GLU 32 2HG GLU 32 26.587 7.805 -11.237
233 HG3 GLU 32 3HG GLU 32 26.812 6.221 -11.977
234 H LYS 33 H LYS 33 24.225 10.092 -12.877
235 HA LYS 33 HA LYS 33 24.499 10.574 -10.131
236 HB2 LYS 33 2HB LYS 33 23.746 12.093 -12.502
237 HB3 LYS 33 3HB LYS 33 22.879 12.625 -11.067
238 HG2 LYS 33 2HG LYS 33 24.785 13.962 -11.126
239 HG3 LYS 33 3HG LYS 33 25.165 12.717 -9.934
240 HD2 LYS 33 2HD LYS 33 27.064 12.480 -11.112
241 HD3 LYS 33 3HD LYS 33 26.056 11.556 -12.228
242 HE2 LYS 33 2HE LYS 33 26.117 13.160 -13.809
243 HE3 LYS 33 3HE LYS 33 26.016 14.467 -12.630
244 HZ1 LYS 33 3HZ LYS 33 28.420 13.843 -12.092
245 HZ2 LYS 33 1HZ LYS 33 28.127 14.682 -13.531
246 HZ3 LYS 33 2HZ LYS 33 28.408 13.015 -13.567
247 H GLU 34 H GLU 34 21.548 10.355 -12.115
248 HA GLU 34 HA GLU 34 19.668 10.774 -10.131
249 HB2 GLU 34 2HB GLU 34 19.655 9.919 -12.815
250 HB3 GLU 34 3HB GLU 34 18.754 8.707 -11.916
251 HG2 GLU 34 2HG GLU 34 18.197 11.643 -11.659
252 HG3 GLU 34 3HG GLU 34 17.433 10.633 -12.885
253 H ILE 35 H ILE 35 21.125 7.698 -11.154
254 HA ILE 35 HA ILE 35 19.722 6.025 -9.409
255 HB ILE 35 HB ILE 35 22.513 5.707 -10.517
256 HG12 ILE 35 2HG1 ILE 35 20.661 5.881 -12.179
257 HG13 ILE 35 3HG1 ILE 35 21.477 4.322 -12.205
258 HG21 ILE 35 1HG2 ILE 35 20.889 4.010 -8.736
259 HG22 ILE 35 2HG2 ILE 35 21.675 3.190 -10.084
260 HG23 ILE 35 3HG2 ILE 35 22.639 4.108 -8.928
261 HD11 ILE 35 3HD1 ILE 35 19.243 4.265 -10.399
262 HD12 ILE 35 1HD1 ILE 35 18.745 4.799 -12.004
263 HD13 ILE 35 2HD1 ILE 35 19.580 3.258 -11.807
264 H ALA 36 H ALA 36 22.814 7.713 -8.981
265 HA ALA 36 HA ALA 36 23.537 6.685 -6.504
266 HB1 ALA 36 1HB ALA 36 24.884 8.192 -8.039
267 HB2 ALA 36 2HB ALA 36 24.018 9.541 -7.303
268 HB3 ALA 36 3HB ALA 36 25.029 8.494 -6.307
269 H ALA 37 H ALA 37 21.556 9.545 -7.239
270 HA ALA 37 HA ALA 37 21.089 10.282 -4.553
271 HB1 ALA 37 1HB ALA 37 20.772 11.752 -6.550
272 HB2 ALA 37 2HB ALA 37 19.292 10.858 -6.901
273 HB3 ALA 37 3HB ALA 37 19.434 11.775 -5.402
274 H PHE 38 H PHE 38 19.406 8.128 -6.770
275 HA PHE 38 HA PHE 38 17.046 7.758 -5.320
276 HB2 PHE 38 2HB PHE 38 18.435 6.415 -7.509
277 HB3 PHE 38 3HB PHE 38 17.526 5.298 -6.496
278 HD1 PHE 38 HD2 PHE 38 16.689 8.817 -7.305
279 HD2 PHE 38 HD1 PHE 38 15.743 4.707 -7.877
280 HE1 PHE 38 HE2 PHE 38 14.616 9.459 -8.464
281 HE2 PHE 38 HE1 PHE 38 13.668 5.342 -9.038
282 HZ PHE 38 HZ PHE 38 13.102 7.721 -9.331
283 H GLU 39 H GLU 39 19.991 5.746 -5.320
284 HA GLU 39 HA GLU 39 19.157 4.022 -3.260
285 HB2 GLU 39 2HB GLU 39 21.564 3.433 -3.070
286 HB3 GLU 39 3HB GLU 39 20.964 3.384 -4.722
287 HG2 GLU 39 2HG GLU 39 21.952 5.590 -5.134
288 HG3 GLU 39 3HG GLU 39 22.584 5.600 -3.488
289 H SER 40 H SER 40 20.979 7.046 -3.212
290 HA SER 40 HA SER 40 21.670 6.994 -0.479
291 HB2 SER 40 2HB SER 40 22.789 8.485 -2.061
292 HB3 SER 40 3HB SER 40 21.282 9.361 -2.328
293 HG SER 40 HG SER 40 22.836 10.275 -0.758
294 H GLU 41 H GLU 41 18.783 7.981 -2.177
295 HA GLU 41 HA GLU 41 17.625 9.307 0.106
296 HB2 GLU 41 2HB GLU 41 16.731 8.672 -2.674
297 HB3 GLU 41 3HB GLU 41 15.517 9.068 -1.465
298 HG2 GLU 41 2HG GLU 41 17.296 11.073 -1.082
299 HG3 GLU 41 3HG GLU 41 17.473 10.785 -2.812
300 H LEU 42 H LEU 42 17.510 6.136 -1.362
301 HA LEU 42 HA LEU 42 15.246 5.209 0.114
302 HB2 LEU 42 2HB LEU 42 17.406 3.791 -1.427
303 HB3 LEU 42 3HB LEU 42 16.083 2.944 -0.626
304 HG LEU 42 HG LEU 42 15.465 5.084 -2.617
305 HD11 LEU 42 1HD1 LEU 42 16.976 3.843 -3.907
306 HD12 LEU 42 2HD1 LEU 42 15.391 3.194 -4.323
307 HD13 LEU 42 3HD1 LEU 42 16.442 2.310 -3.218
308 HD21 LEU 42 3HD2 LEU 42 14.027 2.495 -2.333
309 HD22 LEU 42 1HD2 LEU 42 13.405 4.100 -2.719
310 HD23 LEU 42 2HD2 LEU 42 13.847 3.702 -1.059
311 H GLN 43 H GLN 43 18.706 5.249 0.627
312 HA GLN 43 HA GLN 43 18.773 3.385 2.761
313 HB2 GLN 43 2HB GLN 43 21.011 4.038 3.079
314 HB3 GLN 43 3HB GLN 43 20.730 4.232 1.354
315 HG2 GLN 43 2HG GLN 43 21.529 6.285 1.551
316 HG3 GLN 43 3HG GLN 43 20.063 6.694 2.440
317 HE21 GLN 43 1HE2 GLN 43 23.313 5.372 2.866
318 HE22 GLN 43 2HE2 GLN 43 23.564 6.027 4.445
319 H ALA 44 H ALA 44 17.757 6.647 2.541
320 HA ALA 44 HA ALA 44 18.186 7.354 5.284
321 HB1 ALA 44 1HB ALA 44 16.159 8.716 3.567
322 HB2 ALA 44 2HB ALA 44 17.254 9.398 4.770
323 HB3 ALA 44 3HB ALA 44 17.876 8.887 3.200
324 H TYR 45 H TYR 45 15.768 5.620 3.553
325 HA TYR 45 HA TYR 45 13.519 6.053 5.151
326 HB2 TYR 45 2HB TYR 45 14.413 3.758 3.431
327 HB3 TYR 45 3HB TYR 45 12.934 3.641 4.379
328 HD1 TYR 45 HD2 TYR 45 11.746 6.270 4.150
329 HD2 TYR 45 HD1 TYR 45 13.810 3.991 1.209
330 HE1 TYR 45 HE2 TYR 45 10.513 7.450 2.379
331 HE2 TYR 45 HE1 TYR 45 12.584 5.166 -0.570
332 HH TYR 45 HH TYR 45 9.969 7.392 0.162
333 H LYS 46 H LYS 46 16.319 4.015 5.626
334 HA LYS 46 HA LYS 46 17.071 2.838 7.421
335 HB2 LYS 46 2HB LYS 46 15.982 5.068 8.495
336 HB3 LYS 46 3HB LYS 46 14.987 3.842 9.268
337 HG2 LYS 46 2HG LYS 46 16.608 3.317 10.684
338 HG3 LYS 46 3HG LYS 46 17.772 3.114 9.372
339 HD2 LYS 46 2HD LYS 46 18.753 4.857 10.473
340 HD3 LYS 46 3HD LYS 46 17.693 5.764 9.391
341 HE2 LYS 46 2HE LYS 46 16.534 4.932 11.979
342 HE3 LYS 46 3HE LYS 46 17.798 6.159 12.047
343 HZ1 LYS 46 3HZ LYS 46 16.549 7.616 10.742
344 HZ2 LYS 46 1HZ LYS 46 15.416 6.954 11.810
345 HZ3 LYS 46 2HZ LYS 46 15.493 6.405 10.212
346 H GLY 47 H GLY 47 14.704 1.965 5.746
347 HA2 GLY 47 2HA GLY 47 13.535 0.038 7.653
348 HA3 GLY 47 3HA GLY 47 12.752 0.574 6.174
349 H LYS 48 H LYS 48 16.142 -0.304 6.404
350 HA LYS 48 HA LYS 48 16.087 -1.994 4.182
351 HB2 LYS 48 2HB LYS 48 18.044 -0.939 5.790
352 HB3 LYS 48 3HB LYS 48 18.138 -2.651 6.179
353 HG2 LYS 48 2HG LYS 48 17.968 -2.568 3.406
354 HG3 LYS 48 3HG LYS 48 19.049 -1.241 3.836
355 HD2 LYS 48 2HD LYS 48 20.631 -2.837 3.877
356 HD3 LYS 48 3HD LYS 48 19.958 -3.224 5.463
357 HE2 LYS 48 2HE LYS 48 18.322 -4.715 4.060
358 HE3 LYS 48 3HE LYS 48 19.599 -4.620 2.849
359 HZ1 LYS 48 3HZ LYS 48 20.727 -6.155 3.948
360 HZ2 LYS 48 1HZ LYS 48 19.474 -6.287 5.076
361 HZ3 LYS 48 2HZ LYS 48 20.745 -5.205 5.347
362 H GLY 49 H GLY 49 15.185 -2.574 7.452
363 HA2 GLY 49 2HA GLY 49 15.618 -5.280 7.788
364 HA3 GLY 49 3HA GLY 49 14.242 -4.414 8.454
365 H ASN 50 H ASN 50 13.292 -3.702 5.727
366 HA ASN 50 HA ASN 50 12.055 -6.296 5.113
367 HB2 ASN 50 2HB ASN 50 11.122 -3.460 4.892
368 HB3 ASN 50 3HB ASN 50 10.429 -4.676 3.823
369 HD21 ASN 50 1HD2 ASN 50 10.498 -3.373 6.973
370 HD22 ASN 50 2HD2 ASN 50 9.335 -4.433 7.686
371 HA PRO 51 HA PRO 51 13.849 -6.523 1.116
372 HB2 PRO 51 2HB PRO 51 11.808 -7.520 -0.371
373 HB3 PRO 51 3HB PRO 51 12.691 -8.485 0.818
374 HG2 PRO 51 2HG PRO 51 10.043 -7.115 1.081
375 HG3 PRO 51 3HG PRO 51 10.524 -8.733 1.623
376 HD2 PRO 51 2HD PRO 51 10.385 -6.614 3.304
377 HD3 PRO 51 3HD PRO 51 11.561 -7.927 3.517
378 H GLU 52 H GLU 52 11.085 -4.546 1.644
379 HA GLU 52 HA GLU 52 10.516 -3.512 -0.848
380 HB2 GLU 52 2HB GLU 52 9.888 -1.408 0.375
381 HB3 GLU 52 3HB GLU 52 9.165 -2.878 1.012
382 HG2 GLU 52 2HG GLU 52 11.056 -2.909 2.697
383 HG3 GLU 52 3HG GLU 52 11.418 -1.268 2.164
384 H VAL 53 H VAL 53 13.005 -2.414 1.440
385 HA VAL 53 HA VAL 53 14.054 -0.511 -0.475
386 HB VAL 53 HB VAL 53 15.031 -1.300 2.272
387 HG11 VAL 53 1HG1 VAL 53 16.465 0.702 2.113
388 HG12 VAL 53 2HG1 VAL 53 16.897 -0.537 0.933
389 HG13 VAL 53 3HG1 VAL 53 15.987 0.886 0.426
390 HG21 VAL 53 3HG2 VAL 53 13.808 0.400 3.130
391 HG22 VAL 53 1HG2 VAL 53 13.999 1.406 1.694
392 HG23 VAL 53 2HG2 VAL 53 12.811 0.102 1.707
393 H GLU 54 H GLU 54 14.694 -3.749 0.573
394 HA GLU 54 HA GLU 54 17.394 -3.944 -0.237
395 HB2 GLU 54 2HB GLU 54 17.231 -6.052 0.520
396 HB3 GLU 54 3HB GLU 54 15.617 -5.597 1.046
397 HG2 GLU 54 2HG GLU 54 14.720 -6.415 -1.098
398 HG3 GLU 54 3HG GLU 54 16.341 -6.942 -1.547
399 H ALA 55 H ALA 55 14.345 -4.357 -1.933
400 HA ALA 55 HA ALA 55 15.443 -5.481 -4.301
401 HB1 ALA 55 1HB ALA 55 12.841 -4.024 -3.852
402 HB2 ALA 55 2HB ALA 55 13.265 -4.916 -5.313
403 HB3 ALA 55 3HB ALA 55 13.101 -5.767 -3.777
404 H LEU 56 H LEU 56 14.236 -2.194 -3.602
405 HA LEU 56 HA LEU 56 15.041 -1.043 -6.022
406 HB2 LEU 56 2HB LEU 56 13.884 -0.185 -3.578
407 HB3 LEU 56 3HB LEU 56 15.233 0.890 -3.942
408 HG LEU 56 HG LEU 56 14.247 1.520 -6.034
409 HD11 LEU 56 1HD1 LEU 56 13.007 0.058 -7.148
410 HD12 LEU 56 2HD1 LEU 56 11.693 0.382 -6.018
411 HD13 LEU 56 3HD1 LEU 56 12.810 -0.947 -5.713
412 HD21 LEU 56 3HD2 LEU 56 13.313 2.971 -4.573
413 HD22 LEU 56 1HD2 LEU 56 12.660 1.692 -3.548
414 HD23 LEU 56 2HD2 LEU 56 11.833 2.132 -5.043
415 H ARG 57 H ARG 57 16.766 -1.534 -2.997
416 HA ARG 57 HA ARG 57 19.010 0.076 -3.610
417 HB2 ARG 57 2HB ARG 57 18.403 -0.731 -1.326
418 HB3 ARG 57 3HB ARG 57 18.910 -2.345 -1.804
419 HG2 ARG 57 2HG ARG 57 20.763 -1.548 -0.691
420 HG3 ARG 57 3HG ARG 57 21.161 -1.205 -2.376
421 HD2 ARG 57 2HD ARG 57 21.342 0.961 -1.923
422 HD3 ARG 57 3HD ARG 57 19.693 0.992 -1.301
423 HE ARG 57 HE ARG 57 21.060 -0.021 0.774
424 HH11 ARG 57 1HH1 ARG 57 21.613 2.756 -1.251
425 HH12 ARG 57 2HH1 ARG 57 22.401 3.669 -0.008
426 HH21 ARG 57 1HH2 ARG 57 22.097 1.171 2.419
427 HH22 ARG 57 2HH2 ARG 57 22.677 2.766 2.079
428 H LYS 58 H LYS 58 18.351 -3.381 -4.032
429 HA LYS 58 HA LYS 58 20.880 -4.110 -5.013
430 HB2 LYS 58 2HB LYS 58 18.952 -5.619 -4.244
431 HB3 LYS 58 3HB LYS 58 18.301 -5.412 -5.865
432 HG2 LYS 58 2HG LYS 58 19.486 -7.425 -5.934
433 HG3 LYS 58 3HG LYS 58 20.548 -6.246 -6.708
434 HD2 LYS 58 2HD LYS 58 21.143 -6.176 -3.957
435 HD3 LYS 58 3HD LYS 58 21.029 -7.881 -4.402
436 HE2 LYS 58 2HE LYS 58 22.688 -5.827 -5.859
437 HE3 LYS 58 3HE LYS 58 23.312 -6.942 -4.645
438 HZ1 LYS 58 3HZ LYS 58 21.993 -8.551 -6.401
439 HZ2 LYS 58 1HZ LYS 58 23.667 -8.317 -6.338
440 HZ3 LYS 58 2HZ LYS 58 22.726 -7.405 -7.407
441 H GLU 59 H GLU 59 17.875 -3.415 -6.808
442 HA GLU 59 HA GLU 59 18.931 -3.605 -9.373
443 HB2 GLU 59 2HB GLU 59 16.690 -1.856 -8.349
444 HB3 GLU 59 3HB GLU 59 17.033 -2.130 -10.051
445 HG2 GLU 59 2HG GLU 59 16.543 -4.439 -8.221
446 HG3 GLU 59 3HG GLU 59 15.195 -3.515 -8.881
447 H ALA 60 H ALA 60 18.520 -0.690 -7.367
448 HA ALA 60 HA ALA 60 19.566 1.194 -9.088
449 HB1 ALA 60 1HB ALA 60 20.325 2.351 -6.910
450 HB2 ALA 60 2HB ALA 60 18.605 2.047 -7.154
451 HB3 ALA 60 3HB ALA 60 19.546 0.991 -6.101
452 H ALA 61 H ALA 61 21.351 -0.684 -6.639
453 HA ALA 61 HA ALA 61 23.891 0.311 -7.135
454 HB1 ALA 61 1HB ALA 61 23.995 -0.995 -5.303
455 HB2 ALA 61 2HB ALA 61 22.791 -2.132 -5.913
456 HB3 ALA 61 3HB ALA 61 24.463 -2.237 -6.464
457 H ALA 62 H ALA 62 22.224 -2.413 -8.683
458 HA ALA 62 HA ALA 62 24.319 -3.291 -10.308
459 HB1 ALA 62 1HB ALA 62 21.334 -3.437 -10.611
460 HB2 ALA 62 2HB ALA 62 22.433 -4.144 -11.796
461 HB3 ALA 62 3HB ALA 62 22.457 -4.707 -10.125
462 H ILE 63 H ILE 63 21.780 -0.893 -10.959
463 HA ILE 63 HA ILE 63 22.476 -0.327 -13.610
464 HB ILE 63 HB ILE 63 21.256 1.536 -11.569
465 HG12 ILE 63 2HG1 ILE 63 19.573 0.324 -13.656
466 HG13 ILE 63 3HG1 ILE 63 20.223 -0.824 -12.492
467 HG21 ILE 63 1HG2 ILE 63 21.413 1.691 -14.572
468 HG22 ILE 63 2HG2 ILE 63 20.338 2.684 -13.589
469 HG23 ILE 63 3HG2 ILE 63 22.086 2.824 -13.401
470 HD11 ILE 63 3HD1 ILE 63 19.246 1.409 -11.054
471 HD12 ILE 63 1HD1 ILE 63 18.013 0.922 -12.217
472 HD13 ILE 63 2HD1 ILE 63 18.646 -0.250 -11.060
473 H ARG 64 H ARG 64 23.554 1.163 -10.576
474 HA ARG 64 HA ARG 64 25.125 3.195 -11.681
475 HB2 ARG 64 2HB ARG 64 24.514 3.103 -9.305
476 HB3 ARG 64 3HB ARG 64 25.539 1.689 -9.092
477 HG2 ARG 64 2HG ARG 64 27.305 3.453 -10.148
478 HG3 ARG 64 3HG ARG 64 26.244 4.529 -9.236
479 HD2 ARG 64 2HD ARG 64 26.572 3.128 -7.241
480 HD3 ARG 64 3HD ARG 64 27.667 2.096 -8.161
481 HE ARG 64 HE ARG 64 29.309 3.677 -7.919
482 HH11 ARG 64 1HH1 ARG 64 26.233 5.074 -7.078
483 HH12 ARG 64 2HH1 ARG 64 26.921 6.539 -6.458
484 HH21 ARG 64 1HH2 ARG 64 30.227 5.600 -7.106
485 HH22 ARG 64 2HH2 ARG 64 29.193 6.837 -6.475
486 H ASP 65 H ASP 65 26.005 -0.110 -10.723
487 HA ASP 65 HA ASP 65 28.732 0.038 -11.312
488 HB2 ASP 65 2HB ASP 65 26.810 -2.289 -11.334
489 HB3 ASP 65 3HB ASP 65 28.541 -2.479 -11.598
490 H GLU 66 H GLU 66 25.989 -0.884 -13.360
491 HA GLU 66 HA GLU 66 27.451 -1.618 -15.634
492 HB2 GLU 66 2HB GLU 66 24.699 -0.371 -15.549
493 HB3 GLU 66 3HB GLU 66 25.376 -1.310 -16.872
494 HG2 GLU 66 2HG GLU 66 24.971 -3.277 -15.865
495 HG3 GLU 66 3HG GLU 66 25.340 -2.655 -14.258
496 H CYS 67 H CYS 67 26.040 1.510 -14.718
497 HA CYS 67 HA CYS 67 26.737 2.940 -17.007
498 HB2 CYS 67 2HB CYS 67 26.423 3.848 -14.143
499 HB3 CYS 67 3HB CYS 67 26.642 4.956 -15.491
500 HG CYS 67 HG CYS 67 24.276 4.204 -16.784
501 H GLN 68 H GLN 68 28.564 2.378 -14.026
502 HA GLN 68 HA GLN 68 30.778 3.998 -14.743
503 HB2 GLN 68 2HB GLN 68 30.834 1.641 -12.861
504 HB3 GLN 68 3HB GLN 68 31.894 3.044 -12.856
505 HG2 GLN 68 2HG GLN 68 29.250 3.998 -12.614
506 HG3 GLN 68 3HG GLN 68 29.431 2.653 -11.489
507 HE21 GLN 68 1HE2 GLN 68 29.143 5.537 -11.009
508 HE22 GLN 68 2HE2 GLN 68 30.512 5.991 -10.058
509 H ALA 69 H ALA 69 29.904 0.680 -15.379
510 HA ALA 69 HA ALA 69 32.514 -0.089 -16.313
511 HB1 ALA 69 1HB ALA 69 31.292 -2.136 -17.117
512 HB2 ALA 69 2HB ALA 69 31.179 -1.817 -15.386
513 HB3 ALA 69 3HB ALA 69 29.823 -1.429 -16.445
514 H TYR 70 H TYR 70 30.064 1.780 -17.594
515 HA TYR 70 HA TYR 70 30.624 1.018 -20.365
516 HB2 TYR 70 2HB TYR 70 28.562 2.912 -19.219
517 HB3 TYR 70 3HB TYR 70 28.742 2.529 -20.928
518 HD1 TYR 70 HD1 TYR 70 29.361 -0.466 -20.439
519 HD2 TYR 70 HD2 TYR 70 26.300 2.133 -19.033
520 HE1 TYR 70 HE1 TYR 70 27.857 -2.394 -20.167
521 HE2 TYR 70 HE2 TYR 70 24.788 0.213 -18.756
522 HH TYR 70 HH TYR 70 25.866 -3.009 -18.887
523 H ARG 71 H ARG 71 30.888 3.726 -18.128
524 HA ARG 71 HA ARG 71 32.782 4.987 -19.981
525 HB2 ARG 71 2HB ARG 71 31.849 7.208 -19.444
526 HB3 ARG 71 3HB ARG 71 30.690 6.181 -20.278
527 HG2 ARG 71 2HG ARG 71 29.230 6.532 -18.658
528 HG3 ARG 71 3HG ARG 71 30.330 5.771 -17.507
529 HD2 ARG 71 2HD ARG 71 30.078 7.839 -16.549
530 HD3 ARG 71 3HD ARG 71 31.501 8.115 -17.553
531 HE ARG 71 HE ARG 71 29.002 8.736 -18.844
532 HH11 ARG 71 1HH1 ARG 71 31.583 9.928 -16.835
533 HH12 ARG 71 2HH1 ARG 71 31.306 11.590 -17.239
534 HH21 ARG 71 1HH2 ARG 71 28.627 10.920 -19.384
535 HH22 ARG 71 2HH2 ARG 71 29.624 12.153 -18.689
536 H HIS 72 H HIS 72 33.554 3.420 -17.881
537 HA HIS 72 HA HIS 72 35.298 5.078 -16.461
538 HB2 HIS 72 2HB HIS 72 32.777 5.261 -15.377
539 HB3 HIS 72 3HB HIS 72 33.523 4.013 -14.384
540 HD1 HIS 72 HD1 HIS 72 35.940 4.770 -13.328
541 HD2 HIS 72 HD2 HIS 72 33.383 7.786 -14.602
542 HE1 HIS 72 HE1 HIS 72 36.754 6.863 -12.197
543 H ASN 73 H ASN 73 35.258 2.587 -17.894
544 HA ASN 73 HA ASN 73 36.566 0.919 -15.881
545 HB2 ASN 73 2HB ASN 73 34.489 -0.173 -15.903
546 HB3 ASN 73 3HB ASN 73 34.273 0.075 -17.633
547 HD21 ASN 73 1HD2 ASN 73 34.425 -1.721 -18.742
548 HD22 ASN 73 2HD2 ASN 73 35.462 -3.057 -18.391
Start of MODEL 9
1 H1 MET 1 H MET 1 0.609 -0.879 -4.476
2 HA MET 1 HA MET 1 3.381 -1.091 -3.767
3 HB2 MET 1 2HB MET 1 1.841 0.062 -6.050
4 HB3 MET 1 3HB MET 1 3.505 0.579 -5.814
5 HG2 MET 1 2HG MET 1 4.090 -1.193 -7.007
6 HG3 MET 1 3HG MET 1 3.654 -2.161 -5.601
7 HE1 MET 1 3HE MET 1 2.299 -4.624 -7.114
8 HE2 MET 1 1HE MET 1 2.460 -3.819 -5.553
9 HE3 MET 1 2HE MET 1 0.860 -4.084 -6.247
10 H GLY 2 H GLY 2 1.447 1.806 -4.555
11 HA2 GLY 2 2HA GLY 2 1.360 3.867 -3.525
12 HA3 GLY 2 3HA GLY 2 2.202 3.162 -2.153
13 H SER 3 H SER 3 3.990 4.255 -1.726
14 HA SER 3 HA SER 3 5.272 6.016 -3.474
15 HB2 SER 3 2HB SER 3 7.216 5.182 -1.623
16 HB3 SER 3 3HB SER 3 6.156 6.586 -1.495
17 HG SER 3 HG SER 3 5.047 5.590 -0.016
18 H TRP 4 H TRP 4 5.827 2.611 -2.815
19 HA TRP 4 HA TRP 4 8.311 2.313 -4.064
20 HB2 TRP 4 2HB TRP 4 7.570 0.492 -2.767
21 HB3 TRP 4 3HB TRP 4 6.017 0.421 -3.595
22 HD1 TRP 4 HD1 TRP 4 5.997 -0.714 -6.057
23 HE1 TRP 4 HE1 TRP 4 7.571 -2.451 -7.121
24 HE3 TRP 4 HE3 TRP 4 9.960 -0.286 -2.856
25 HZ2 TRP 4 HZ2 TRP 4 10.151 -3.500 -6.664
26 HZ3 TRP 4 HZ3 TRP 4 11.943 -1.693 -3.239
27 HH2 TRP 4 HH2 TRP 4 12.034 -3.266 -5.104
28 H ALA 5 H ALA 5 5.039 2.259 -5.385
29 HA ALA 5 HA ALA 5 5.509 1.317 -7.933
30 HB1 ALA 5 1HB ALA 5 3.354 1.788 -8.162
31 HB2 ALA 5 2HB ALA 5 3.400 2.604 -6.598
32 HB3 ALA 5 3HB ALA 5 3.682 3.519 -8.079
33 H GLU 6 H GLU 6 5.675 4.707 -6.841
34 HA GLU 6 HA GLU 6 6.437 5.843 -9.266
35 HB2 GLU 6 2HB GLU 6 6.647 6.621 -6.410
36 HB3 GLU 6 3HB GLU 6 7.684 7.481 -7.539
37 HG2 GLU 6 2HG GLU 6 5.603 7.932 -8.901
38 HG3 GLU 6 3HG GLU 6 4.687 7.340 -7.517
39 H PHE 7 H PHE 7 8.510 4.758 -6.580
40 HA PHE 7 HA PHE 7 10.968 5.328 -7.767
41 HB2 PHE 7 2HB PHE 7 10.070 3.437 -5.630
42 HB3 PHE 7 3HB PHE 7 11.714 3.305 -6.246
43 HD1 PHE 7 HD1 PHE 7 13.310 5.129 -5.928
44 HD2 PHE 7 HD2 PHE 7 9.392 5.284 -4.273
45 HE1 PHE 7 HE1 PHE 7 14.017 6.952 -4.434
46 HE2 PHE 7 HE2 PHE 7 10.092 7.107 -2.777
47 HZ PHE 7 HZ PHE 7 12.407 7.944 -2.857
48 H LYS 8 H LYS 8 8.925 2.460 -7.993
49 HA LYS 8 HA LYS 8 10.745 0.835 -9.406
50 HB2 LYS 8 2HB LYS 8 8.732 -0.035 -8.279
51 HB3 LYS 8 3HB LYS 8 7.721 0.788 -9.459
52 HG2 LYS 8 2HG LYS 8 7.807 -1.011 -10.740
53 HG3 LYS 8 3HG LYS 8 9.547 -0.774 -10.921
54 HD2 LYS 8 2HD LYS 8 9.391 -1.924 -8.450
55 HD3 LYS 8 3HD LYS 8 8.064 -2.717 -9.302
56 HE2 LYS 8 2HE LYS 8 10.217 -2.672 -11.097
57 HE3 LYS 8 3HE LYS 8 10.900 -3.135 -9.539
58 HZ1 LYS 8 3HZ LYS 8 8.861 -4.728 -9.498
59 HZ2 LYS 8 1HZ LYS 8 10.249 -5.150 -10.369
60 HZ3 LYS 8 2HZ LYS 8 8.900 -4.526 -11.177
61 H GLN 9 H GLN 9 8.244 3.093 -10.488
62 HA GLN 9 HA GLN 9 8.413 2.548 -13.234
63 HB2 GLN 9 2HB GLN 9 6.996 4.324 -11.585
64 HB3 GLN 9 3HB GLN 9 7.862 5.338 -12.732
65 HG2 GLN 9 2HG GLN 9 6.323 4.911 -14.253
66 HG3 GLN 9 3HG GLN 9 6.748 3.201 -14.194
67 HE21 GLN 9 1HE2 GLN 9 5.888 2.404 -11.784
68 HE22 GLN 9 2HE2 GLN 9 4.177 2.597 -11.646
69 H ARG 10 H ARG 10 9.874 5.251 -11.416
70 HA ARG 10 HA ARG 10 11.391 6.313 -13.476
71 HB2 ARG 10 2HB ARG 10 11.727 6.289 -10.494
72 HB3 ARG 10 3HB ARG 10 12.954 7.023 -11.517
73 HG2 ARG 10 2HG ARG 10 11.591 8.804 -10.929
74 HG3 ARG 10 3HG ARG 10 11.017 8.361 -12.538
75 HD2 ARG 10 2HD ARG 10 9.196 7.074 -11.533
76 HD3 ARG 10 3HD ARG 10 9.773 7.511 -9.925
77 HE ARG 10 HE ARG 10 8.191 9.117 -11.676
78 HH11 ARG 10 1HH1 ARG 10 10.614 9.233 -9.178
79 HH12 ARG 10 2HH1 ARG 10 10.176 10.823 -8.646
80 HH21 ARG 10 1HH2 ARG 10 7.606 11.211 -10.985
81 HH22 ARG 10 2HH2 ARG 10 8.465 11.947 -9.674
82 H LEU 11 H LEU 11 12.285 3.804 -11.128
83 HA LEU 11 HA LEU 11 14.929 3.440 -11.992
84 HB2 LEU 11 2HB LEU 11 12.981 1.939 -10.370
85 HB3 LEU 11 3HB LEU 11 14.270 0.978 -11.093
86 HG LEU 11 HG LEU 11 15.946 2.248 -9.935
87 HD11 LEU 11 1HD1 LEU 11 15.498 4.414 -9.621
88 HD12 LEU 11 2HD1 LEU 11 14.702 3.891 -8.137
89 HD13 LEU 11 3HD1 LEU 11 13.755 4.148 -9.602
90 HD21 LEU 11 3HD2 LEU 11 15.285 0.535 -8.544
91 HD22 LEU 11 1HD2 LEU 11 13.659 1.185 -8.338
92 HD23 LEU 11 2HD2 LEU 11 15.021 1.942 -7.512
93 H ALA 12 H ALA 12 11.894 2.010 -13.074
94 HA ALA 12 HA ALA 12 12.971 0.030 -14.753
95 HB1 ALA 12 1HB ALA 12 10.622 0.080 -14.042
96 HB2 ALA 12 2HB ALA 12 10.354 1.498 -15.056
97 HB3 ALA 12 3HB ALA 12 10.780 -0.046 -15.794
98 H ALA 13 H ALA 13 11.973 3.372 -15.430
99 HA ALA 13 HA ALA 13 12.530 3.323 -18.191
100 HB1 ALA 13 1HB ALA 13 12.092 5.447 -16.160
101 HB2 ALA 13 2HB ALA 13 12.799 5.907 -17.709
102 HB3 ALA 13 3HB ALA 13 11.224 5.117 -17.659
103 H ILE 14 H ILE 14 14.503 4.233 -15.395
104 HA ILE 14 HA ILE 14 16.733 5.164 -16.852
105 HB ILE 14 HB ILE 14 16.592 4.014 -14.063
106 HG12 ILE 14 2HG1 ILE 14 16.977 6.909 -14.710
107 HG13 ILE 14 3HG1 ILE 14 15.360 6.222 -14.824
108 HG21 ILE 14 1HG2 ILE 14 18.857 4.723 -15.689
109 HG22 ILE 14 2HG2 ILE 14 18.762 5.762 -14.268
110 HG23 ILE 14 3HG2 ILE 14 18.813 4.010 -14.077
111 HD11 ILE 14 3HD1 ILE 14 15.228 6.807 -12.672
112 HD12 ILE 14 1HD1 ILE 14 16.131 5.318 -12.396
113 HD13 ILE 14 2HD1 ILE 14 16.979 6.863 -12.471
114 H LYS 15 H LYS 15 15.832 1.975 -15.648
115 HA LYS 15 HA LYS 15 18.288 0.696 -16.248
116 HB2 LYS 15 2HB LYS 15 15.814 -0.022 -15.087
117 HB3 LYS 15 3HB LYS 15 16.071 -1.123 -16.434
118 HG2 LYS 15 2HG LYS 15 18.482 -1.294 -15.362
119 HG3 LYS 15 3HG LYS 15 17.599 -0.814 -13.911
120 HD2 LYS 15 2HD LYS 15 16.393 -2.756 -13.838
121 HD3 LYS 15 3HD LYS 15 16.455 -2.988 -15.587
122 HE2 LYS 15 2HE LYS 15 17.988 -4.556 -15.131
123 HE3 LYS 15 3HE LYS 15 19.088 -3.199 -14.890
124 HZ1 LYS 15 3HZ LYS 15 17.878 -4.974 -12.934
125 HZ2 LYS 15 1HZ LYS 15 17.970 -3.345 -12.488
126 HZ3 LYS 15 2HZ LYS 15 19.375 -4.189 -12.904
127 H THR 16 H THR 16 15.255 1.062 -18.037
128 HA THR 16 HA THR 16 15.919 -0.569 -20.225
129 HB THR 16 HB THR 16 14.129 1.868 -20.262
130 HG1 THR 16 HG1 THR 16 13.568 0.281 -18.642
131 HG21 THR 16 3HG2 THR 16 12.962 0.454 -22.040
132 HG22 THR 16 1HG2 THR 16 14.437 -0.512 -22.077
133 HG23 THR 16 2HG2 THR 16 14.494 1.201 -22.493
134 H ARG 17 H ARG 17 16.128 2.975 -19.883
135 HA ARG 17 HA ARG 17 17.358 3.420 -22.379
136 HB2 ARG 17 2HB ARG 17 16.828 4.987 -19.939
137 HB3 ARG 17 3HB ARG 17 18.206 5.531 -20.886
138 HG2 ARG 17 2HG ARG 17 16.301 6.752 -21.607
139 HG3 ARG 17 3HG ARG 17 16.710 5.602 -22.882
140 HD2 ARG 17 2HD ARG 17 14.883 4.251 -22.427
141 HD3 ARG 17 3HD ARG 17 14.712 4.867 -20.784
142 HE ARG 17 HE ARG 17 14.241 6.866 -22.779
143 HH11 ARG 17 1HH1 ARG 17 12.808 4.232 -21.012
144 HH12 ARG 17 2HH1 ARG 17 11.189 4.825 -21.184
145 HH21 ARG 17 1HH2 ARG 17 12.115 7.658 -23.013
146 HH22 ARG 17 2HH2 ARG 17 10.796 6.773 -22.323
147 H CYS 18 H CYS 18 18.629 2.611 -19.222
148 HA CYS 18 HA CYS 18 21.347 3.220 -19.797
149 HB2 CYS 18 2HB CYS 18 20.790 3.123 -17.507
150 HB3 CYS 18 3HB CYS 18 19.986 1.568 -17.681
151 HG CYS 18 HG CYS 18 23.365 1.989 -18.011
152 H GLN 19 H GLN 19 19.344 0.354 -20.140
153 HA GLN 19 HA GLN 19 21.499 -1.411 -20.768
154 HB2 GLN 19 2HB GLN 19 18.524 -1.646 -21.239
155 HB3 GLN 19 3HB GLN 19 19.678 -2.939 -21.536
156 HG2 GLN 19 2HG GLN 19 19.839 -1.781 -18.856
157 HG3 GLN 19 3HG GLN 19 18.301 -2.561 -19.223
158 HE21 GLN 19 1HE2 GLN 19 18.231 -4.590 -18.617
159 HE22 GLN 19 2HE2 GLN 19 19.554 -5.701 -18.598
160 H ALA 20 H ALA 20 19.159 0.434 -22.676
161 HA ALA 20 HA ALA 20 20.128 -0.560 -25.188
162 HB1 ALA 20 1HB ALA 20 18.490 1.930 -24.859
163 HB2 ALA 20 2HB ALA 20 18.505 0.779 -26.196
164 HB3 ALA 20 3HB ALA 20 17.781 0.328 -24.653
165 H LEU 21 H LEU 21 20.807 2.173 -23.127
166 HA LEU 21 HA LEU 21 22.272 3.911 -23.279
167 HB2 LEU 21 2HB LEU 21 23.697 1.755 -24.812
168 HB3 LEU 21 3HB LEU 21 24.434 3.322 -24.483
169 HG LEU 21 HG LEU 21 23.557 2.400 -21.999
170 HD11 LEU 21 1HD1 LEU 21 24.589 0.182 -23.722
171 HD12 LEU 21 2HD1 LEU 21 23.245 0.178 -22.581
172 HD13 LEU 21 3HD1 LEU 21 24.905 0.199 -21.986
173 HD21 LEU 21 3HD2 LEU 21 26.349 2.079 -23.055
174 HD22 LEU 21 1HD2 LEU 21 25.826 2.501 -21.424
175 HD23 LEU 21 2HD2 LEU 21 25.648 3.666 -22.736
176 H GLY 22 H GLY 22 20.162 3.720 -25.325
177 HA2 GLY 22 2HA GLY 22 21.468 4.948 -27.651
178 HA3 GLY 22 3HA GLY 22 19.817 4.347 -27.597
179 H GLY 23 H GLY 23 20.782 6.197 -24.888
180 HA2 GLY 23 2HA GLY 23 18.922 8.291 -25.643
181 HA3 GLY 23 3HA GLY 23 19.724 8.115 -24.089
182 H SER 24 H SER 24 22.250 8.358 -24.358
183 HA SER 24 HA SER 24 23.316 10.017 -26.335
184 HB2 SER 24 2HB SER 24 21.707 11.407 -24.361
185 HB3 SER 24 3HB SER 24 23.378 11.970 -24.333
186 HG SER 24 HG SER 24 21.450 12.440 -26.160
187 H GLU 25 H GLU 25 25.491 10.133 -26.122
188 HA GLU 25 HA GLU 25 26.860 8.515 -24.368
189 HB2 GLU 25 2HB GLU 25 28.889 9.790 -25.002
190 HB3 GLU 25 3HB GLU 25 27.899 9.345 -26.385
191 HG2 GLU 25 2HG GLU 25 26.894 11.668 -26.225
192 HG3 GLU 25 3HG GLU 25 28.208 12.042 -25.112
193 H ALA 26 H ALA 26 25.906 11.866 -23.967
194 HA ALA 26 HA ALA 26 27.385 12.151 -21.490
195 HB1 ALA 26 1HB ALA 26 25.404 14.210 -22.066
196 HB2 ALA 26 2HB ALA 26 27.142 14.351 -21.793
197 HB3 ALA 26 3HB ALA 26 26.532 13.935 -23.395
198 H GLU 27 H GLU 27 24.068 11.643 -22.541
199 HA GLU 27 HA GLU 27 22.668 12.163 -20.225
200 HB2 GLU 27 2HB GLU 27 22.268 10.428 -22.575
201 HB3 GLU 27 3HB GLU 27 21.353 9.967 -21.146
202 HG2 GLU 27 2HG GLU 27 21.331 12.740 -22.305
203 HG3 GLU 27 3HG GLU 27 20.169 11.488 -22.741
204 H CYS 28 H CYS 28 24.679 9.407 -21.009
205 HA CYS 28 HA CYS 28 23.897 7.570 -19.109
206 HB2 CYS 28 2HB CYS 28 26.760 8.146 -19.890
207 HB3 CYS 28 3HB CYS 28 26.123 6.631 -19.263
208 HG CYS 28 HG CYS 28 25.160 5.679 -21.494
209 H ALA 29 H ALA 29 26.145 10.285 -18.730
210 HA ALA 29 HA ALA 29 26.997 9.809 -16.134
211 HB1 ALA 29 1HB ALA 29 26.475 12.625 -16.888
212 HB2 ALA 29 2HB ALA 29 27.922 11.880 -16.207
213 HB3 ALA 29 3HB ALA 29 27.560 11.698 -17.924
214 H ALA 30 H ALA 30 24.272 11.868 -17.168
215 HA ALA 30 HA ALA 30 23.337 12.559 -14.645
216 HB1 ALA 30 1HB ALA 30 22.529 12.984 -17.267
217 HB2 ALA 30 2HB ALA 30 21.161 12.170 -16.508
218 HB3 ALA 30 3HB ALA 30 21.796 13.660 -15.812
219 H PHE 31 H PHE 31 22.776 9.658 -16.549
220 HA PHE 31 HA PHE 31 20.661 8.594 -15.027
221 HB2 PHE 31 2HB PHE 31 22.511 7.631 -17.092
222 HB3 PHE 31 3HB PHE 31 21.979 6.379 -15.975
223 HD1 PHE 31 HD2 PHE 31 20.000 9.308 -17.046
224 HD2 PHE 31 HD1 PHE 31 20.615 5.112 -17.413
225 HE1 PHE 31 HE2 PHE 31 17.883 9.109 -18.284
226 HE2 PHE 31 HE1 PHE 31 18.499 4.907 -18.652
227 HZ PHE 31 HZ PHE 31 17.129 6.907 -19.088
228 H GLU 32 H GLU 32 24.167 8.012 -14.863
229 HA GLU 32 HA GLU 32 24.160 6.173 -12.773
230 HB2 GLU 32 2HB GLU 32 26.265 8.264 -13.356
231 HB3 GLU 32 3HB GLU 32 26.496 6.795 -12.417
232 HG2 GLU 32 2HG GLU 32 26.866 5.585 -14.236
233 HG3 GLU 32 3HG GLU 32 25.429 6.216 -15.037
234 H LYS 33 H LYS 33 24.465 9.713 -12.641
235 HA LYS 33 HA LYS 33 24.722 9.967 -9.873
236 HB2 LYS 33 2HB LYS 33 24.243 11.707 -12.125
237 HB3 LYS 33 3HB LYS 33 23.257 12.199 -10.754
238 HG2 LYS 33 2HG LYS 33 25.006 13.099 -9.738
239 HG3 LYS 33 3HG LYS 33 25.938 11.609 -9.899
240 HD2 LYS 33 2HD LYS 33 27.254 12.936 -11.181
241 HD3 LYS 33 3HD LYS 33 26.084 12.491 -12.425
242 HE2 LYS 33 2HE LYS 33 24.788 14.577 -11.596
243 HE3 LYS 33 3HE LYS 33 26.330 15.045 -10.881
244 HZ1 LYS 33 3HZ LYS 33 26.970 15.788 -12.849
245 HZ2 LYS 33 1HZ LYS 33 25.495 15.327 -13.537
246 HZ3 LYS 33 2HZ LYS 33 26.796 14.245 -13.520
247 H GLU 34 H GLU 34 21.796 10.064 -11.894
248 HA GLU 34 HA GLU 34 19.927 10.550 -9.902
249 HB2 GLU 34 2HB GLU 34 19.876 9.878 -12.629
250 HB3 GLU 34 3HB GLU 34 18.890 8.664 -11.826
251 HG2 GLU 34 2HG GLU 34 18.056 11.015 -10.668
252 HG3 GLU 34 3HG GLU 34 18.343 11.466 -12.347
253 H ILE 35 H ILE 35 21.165 7.435 -11.076
254 HA ILE 35 HA ILE 35 19.600 5.774 -9.463
255 HB ILE 35 HB ILE 35 22.381 5.331 -10.549
256 HG12 ILE 35 2HG1 ILE 35 20.568 5.670 -12.216
257 HG13 ILE 35 3HG1 ILE 35 21.267 4.056 -12.285
258 HG21 ILE 35 1HG2 ILE 35 22.434 3.639 -9.070
259 HG22 ILE 35 2HG2 ILE 35 20.692 3.681 -8.804
260 HG23 ILE 35 3HG2 ILE 35 21.349 2.848 -10.212
261 HD11 ILE 35 3HD1 ILE 35 19.065 4.009 -10.491
262 HD12 ILE 35 1HD1 ILE 35 18.561 4.788 -11.991
263 HD13 ILE 35 2HD1 ILE 35 19.263 3.170 -12.030
264 H ALA 36 H ALA 36 22.801 7.188 -8.867
265 HA ALA 36 HA ALA 36 23.355 5.976 -6.425
266 HB1 ALA 36 1HB ALA 36 24.501 8.417 -6.115
267 HB2 ALA 36 2HB ALA 36 25.204 7.089 -7.040
268 HB3 ALA 36 3HB ALA 36 24.293 8.353 -7.865
269 H ALA 37 H ALA 37 21.674 9.043 -7.071
270 HA ALA 37 HA ALA 37 21.179 9.661 -4.352
271 HB1 ALA 37 1HB ALA 37 21.119 11.413 -5.980
272 HB2 ALA 37 2HB ALA 37 19.834 10.604 -6.878
273 HB3 ALA 37 3HB ALA 37 19.509 11.265 -5.275
274 H PHE 38 H PHE 38 19.466 7.761 -6.740
275 HA PHE 38 HA PHE 38 16.970 7.606 -5.464
276 HB2 PHE 38 2HB PHE 38 18.326 6.277 -7.664
277 HB3 PHE 38 3HB PHE 38 17.322 5.157 -6.749
278 HD1 PHE 38 HD1 PHE 38 14.943 6.313 -6.080
279 HD2 PHE 38 HD2 PHE 38 17.325 7.208 -9.492
280 HE1 PHE 38 HE1 PHE 38 12.946 7.144 -7.252
281 HE2 PHE 38 HE2 PHE 38 15.332 8.042 -10.668
282 HZ PHE 38 HZ PHE 38 13.139 8.012 -9.548
283 H GLU 39 H GLU 39 19.710 5.327 -5.384
284 HA GLU 39 HA GLU 39 18.557 3.613 -3.454
285 HB2 GLU 39 2HB GLU 39 20.873 2.728 -3.197
286 HB3 GLU 39 3HB GLU 39 20.321 2.792 -4.865
287 HG2 GLU 39 2HG GLU 39 21.590 4.844 -5.215
288 HG3 GLU 39 3HG GLU 39 22.139 4.792 -3.541
289 H SER 40 H SER 40 20.687 6.409 -3.217
290 HA SER 40 HA SER 40 21.222 6.145 -0.438
291 HB2 SER 40 2HB SER 40 22.592 7.484 -2.084
292 HB3 SER 40 3HB SER 40 21.311 8.696 -2.060
293 HG SER 40 HG SER 40 21.729 9.094 0.071
294 H GLU 41 H GLU 41 18.613 7.501 -2.275
295 HA GLU 41 HA GLU 41 17.554 9.061 -0.094
296 HB2 GLU 41 2HB GLU 41 16.758 8.486 -2.904
297 HB3 GLU 41 3HB GLU 41 15.494 8.984 -1.788
298 HG2 GLU 41 2HG GLU 41 17.475 10.808 -1.294
299 HG3 GLU 41 3HG GLU 41 17.619 10.539 -3.030
300 H LEU 42 H LEU 42 16.872 5.952 -1.617
301 HA LEU 42 HA LEU 42 14.552 5.417 -0.031
302 HB2 LEU 42 2HB LEU 42 16.297 3.608 -1.693
303 HB3 LEU 42 3HB LEU 42 14.789 3.111 -0.929
304 HG LEU 42 HG LEU 42 14.626 5.450 -2.727
305 HD11 LEU 42 1HD1 LEU 42 14.362 3.220 -4.410
306 HD12 LEU 42 2HD1 LEU 42 15.908 3.036 -3.583
307 HD13 LEU 42 3HD1 LEU 42 15.566 4.505 -4.497
308 HD21 LEU 42 3HD2 LEU 42 12.694 3.689 -3.440
309 HD22 LEU 42 1HD2 LEU 42 12.523 4.894 -2.164
310 HD23 LEU 42 2HD2 LEU 42 12.958 3.235 -1.756
311 H GLN 43 H GLN 43 17.976 4.786 0.258
312 HA GLN 43 HA GLN 43 17.720 2.893 2.394
313 HB2 GLN 43 2HB GLN 43 20.061 2.833 2.441
314 HB3 GLN 43 3HB GLN 43 19.678 3.144 0.753
315 HG2 GLN 43 2HG GLN 43 21.240 4.737 0.971
316 HG3 GLN 43 3HG GLN 43 19.902 5.666 1.644
317 HE21 GLN 43 1HE2 GLN 43 22.845 3.978 2.312
318 HE22 GLN 43 2HE2 GLN 43 23.022 4.503 3.949
319 H ALA 44 H ALA 44 17.610 6.291 2.159
320 HA ALA 44 HA ALA 44 18.477 6.800 4.872
321 HB1 ALA 44 1HB ALA 44 18.650 8.344 2.757
322 HB2 ALA 44 2HB ALA 44 17.031 8.839 3.252
323 HB3 ALA 44 3HB ALA 44 18.389 9.032 4.360
324 H TYR 45 H TYR 45 15.601 5.868 3.333
325 HA TYR 45 HA TYR 45 13.583 7.135 4.702
326 HB2 TYR 45 2HB TYR 45 13.891 4.482 3.424
327 HB3 TYR 45 3HB TYR 45 12.554 4.641 4.558
328 HD1 TYR 45 HD2 TYR 45 11.486 7.248 4.162
329 HD2 TYR 45 HD1 TYR 45 13.118 4.603 1.257
330 HE1 TYR 45 HE2 TYR 45 10.134 8.337 2.420
331 HE2 TYR 45 HE1 TYR 45 11.771 5.685 -0.494
332 HH TYR 45 HH TYR 45 9.331 7.160 -0.290
333 H LYS 46 H LYS 46 15.051 4.025 5.658
334 HA LYS 46 HA LYS 46 15.069 4.768 8.429
335 HB2 LYS 46 2HB LYS 46 13.621 2.735 9.053
336 HB3 LYS 46 3HB LYS 46 12.802 4.190 8.499
337 HG2 LYS 46 2HG LYS 46 12.644 3.190 6.241
338 HG3 LYS 46 3HG LYS 46 13.356 1.709 6.885
339 HD2 LYS 46 2HD LYS 46 11.281 1.055 7.376
340 HD3 LYS 46 3HD LYS 46 11.279 2.293 8.634
341 HE2 LYS 46 2HE LYS 46 10.441 3.915 6.937
342 HE3 LYS 46 3HE LYS 46 10.306 2.580 5.794
343 HZ1 LYS 46 3HZ LYS 46 8.684 3.175 8.156
344 HZ2 LYS 46 1HZ LYS 46 8.919 1.550 7.750
345 HZ3 LYS 46 2HZ LYS 46 8.209 2.606 6.636
346 H GLY 47 H GLY 47 15.134 2.018 6.169
347 HA2 GLY 47 2HA GLY 47 16.651 0.314 5.918
348 HA3 GLY 47 3HA GLY 47 17.804 1.338 6.759
349 H LYS 48 H LYS 48 17.779 -1.423 7.065
350 HA LYS 48 HA LYS 48 17.910 -3.009 8.690
351 HB2 LYS 48 2HB LYS 48 18.659 -0.771 9.942
352 HB3 LYS 48 3HB LYS 48 17.189 -1.095 10.853
353 HG2 LYS 48 2HG LYS 48 18.437 -2.407 12.137
354 HG3 LYS 48 3HG LYS 48 18.449 -3.545 10.787
355 HD2 LYS 48 2HD LYS 48 20.466 -2.188 9.939
356 HD3 LYS 48 3HD LYS 48 20.532 -1.534 11.577
357 HE2 LYS 48 2HE LYS 48 20.656 -4.455 10.831
358 HE3 LYS 48 3HE LYS 48 22.026 -3.454 11.310
359 HZ1 LYS 48 3HZ LYS 48 21.333 -4.674 13.202
360 HZ2 LYS 48 1HZ LYS 48 19.710 -4.251 12.981
361 HZ3 LYS 48 2HZ LYS 48 20.833 -3.078 13.451
362 H GLY 49 H GLY 49 16.271 -4.406 8.497
363 HA2 GLY 49 2HA GLY 49 14.364 -5.442 9.436
364 HA3 GLY 49 3HA GLY 49 13.844 -3.878 10.046
365 H ASN 50 H ASN 50 14.453 -2.731 7.299
366 HA ASN 50 HA ASN 50 11.942 -3.618 6.044
367 HB2 ASN 50 2HB ASN 50 12.019 -1.345 4.917
368 HB3 ASN 50 3HB ASN 50 11.741 -1.327 6.656
369 HD21 ASN 50 1HD2 ASN 50 13.714 -0.282 4.106
370 HD22 ASN 50 2HD2 ASN 50 14.918 0.521 5.049
371 HA PRO 51 HA PRO 51 15.103 -5.109 3.099
372 HB2 PRO 51 2HB PRO 51 13.554 -7.123 2.144
373 HB3 PRO 51 3HB PRO 51 14.514 -7.267 3.621
374 HG2 PRO 51 2HG PRO 51 11.594 -6.685 3.309
375 HG3 PRO 51 3HG PRO 51 12.403 -7.765 4.460
376 HD2 PRO 51 2HD PRO 51 11.553 -5.286 5.140
377 HD3 PRO 51 3HD PRO 51 12.990 -6.035 5.865
378 H GLU 52 H GLU 52 11.920 -3.873 2.795
379 HA GLU 52 HA GLU 52 11.352 -4.105 0.107
380 HB2 GLU 52 2HB GLU 52 10.097 -1.970 0.352
381 HB3 GLU 52 3HB GLU 52 9.754 -3.135 1.623
382 HG2 GLU 52 2HG GLU 52 11.543 -1.877 2.971
383 HG3 GLU 52 3HG GLU 52 11.333 -0.600 1.775
384 H VAL 53 H VAL 53 13.441 -1.749 1.719
385 HA VAL 53 HA VAL 53 14.037 -0.304 -0.680
386 HB VAL 53 HB VAL 53 15.438 -0.316 1.997
387 HG11 VAL 53 1HG1 VAL 53 15.787 1.460 -0.411
388 HG12 VAL 53 2HG1 VAL 53 16.388 1.860 1.199
389 HG13 VAL 53 3HG1 VAL 53 17.000 0.436 0.357
390 HG21 VAL 53 3HG2 VAL 53 12.954 0.549 1.560
391 HG22 VAL 53 1HG2 VAL 53 14.059 1.359 2.671
392 HG23 VAL 53 2HG2 VAL 53 13.835 1.985 1.037
393 H GLU 54 H GLU 54 15.269 -3.142 0.839
394 HA GLU 54 HA GLU 54 17.900 -3.195 -0.057
395 HB2 GLU 54 2HB GLU 54 17.924 -5.296 0.758
396 HB3 GLU 54 3HB GLU 54 16.312 -4.907 1.341
397 HG2 GLU 54 2HG GLU 54 15.395 -5.860 -0.769
398 HG3 GLU 54 3HG GLU 54 17.027 -6.385 -1.178
399 H ALA 55 H ALA 55 14.915 -3.916 -1.751
400 HA ALA 55 HA ALA 55 16.075 -5.124 -4.033
401 HB1 ALA 55 1HB ALA 55 13.434 -3.715 -3.679
402 HB2 ALA 55 2HB ALA 55 13.897 -4.628 -5.116
403 HB3 ALA 55 3HB ALA 55 13.743 -5.448 -3.562
404 H LEU 56 H LEU 56 14.889 -1.809 -3.476
405 HA LEU 56 HA LEU 56 15.623 -0.769 -5.968
406 HB2 LEU 56 2HB LEU 56 15.563 0.736 -3.360
407 HB3 LEU 56 3HB LEU 56 15.374 1.404 -4.980
408 HG LEU 56 HG LEU 56 13.373 -0.619 -4.355
409 HD11 LEU 56 1HD1 LEU 56 12.882 -0.011 -2.274
410 HD12 LEU 56 2HD1 LEU 56 12.348 1.531 -2.941
411 HD13 LEU 56 3HD1 LEU 56 13.994 1.357 -2.333
412 HD21 LEU 56 3HD2 LEU 56 13.679 1.566 -6.029
413 HD22 LEU 56 1HD2 LEU 56 12.471 2.089 -4.856
414 HD23 LEU 56 2HD2 LEU 56 12.209 0.619 -5.794
415 H ARG 57 H ARG 57 17.439 -1.120 -2.972
416 HA ARG 57 HA ARG 57 19.682 0.419 -3.741
417 HB2 ARG 57 2HB ARG 57 18.888 -0.778 -1.431
418 HB3 ARG 57 3HB ARG 57 20.170 -1.868 -1.943
419 HG2 ARG 57 2HG ARG 57 21.807 -0.290 -1.688
420 HG3 ARG 57 3HG ARG 57 20.700 1.058 -1.953
421 HD2 ARG 57 2HD ARG 57 20.558 1.320 0.247
422 HD3 ARG 57 3HD ARG 57 19.794 -0.265 0.353
423 HE ARG 57 HE ARG 57 22.611 -0.522 0.227
424 HH11 ARG 57 1HH1 ARG 57 20.029 0.391 2.376
425 HH12 ARG 57 2HH1 ARG 57 20.896 -0.042 3.812
426 HH21 ARG 57 1HH2 ARG 57 23.763 -1.095 2.111
427 HH22 ARG 57 2HH2 ARG 57 23.020 -0.886 3.660
428 H LYS 58 H LYS 58 18.975 -3.049 -3.959
429 HA LYS 58 HA LYS 58 21.459 -3.858 -4.986
430 HB2 LYS 58 2HB LYS 58 19.225 -5.161 -4.191
431 HB3 LYS 58 3HB LYS 58 19.062 -5.308 -5.936
432 HG2 LYS 58 2HG LYS 58 21.744 -5.929 -5.009
433 HG3 LYS 58 3HG LYS 58 20.510 -6.968 -4.292
434 HD2 LYS 58 2HD LYS 58 20.126 -8.031 -6.228
435 HD3 LYS 58 3HD LYS 58 20.148 -6.531 -7.158
436 HE2 LYS 58 2HE LYS 58 22.003 -7.573 -8.006
437 HE3 LYS 58 3HE LYS 58 22.729 -6.656 -6.687
438 HZ1 LYS 58 3HZ LYS 58 22.121 -9.546 -6.796
439 HZ2 LYS 58 1HZ LYS 58 22.361 -8.753 -5.321
440 HZ3 LYS 58 2HZ LYS 58 23.599 -8.790 -6.473
441 H GLU 59 H GLU 59 18.401 -3.275 -6.733
442 HA GLU 59 HA GLU 59 19.374 -3.587 -9.311
443 HB2 GLU 59 2HB GLU 59 16.999 -2.511 -8.070
444 HB3 GLU 59 3HB GLU 59 17.461 -1.536 -9.457
445 HG2 GLU 59 2HG GLU 59 16.726 -3.065 -10.878
446 HG3 GLU 59 3HG GLU 59 17.632 -4.344 -10.072
447 H ALA 60 H ALA 60 19.084 -0.579 -7.427
448 HA ALA 60 HA ALA 60 20.070 1.214 -9.276
449 HB1 ALA 60 1HB ALA 60 20.152 1.134 -6.289
450 HB2 ALA 60 2HB ALA 60 20.961 2.433 -7.166
451 HB3 ALA 60 3HB ALA 60 19.225 2.188 -7.357
452 H ALA 61 H ALA 61 21.948 -0.562 -6.819
453 HA ALA 61 HA ALA 61 24.472 0.369 -7.481
454 HB1 ALA 61 1HB ALA 61 23.415 -2.036 -6.128
455 HB2 ALA 61 2HB ALA 61 25.082 -2.117 -6.699
456 HB3 ALA 61 3HB ALA 61 24.595 -0.847 -5.577
457 H ALA 62 H ALA 62 22.708 -2.408 -8.815
458 HA ALA 62 HA ALA 62 24.717 -3.383 -10.493
459 HB1 ALA 62 1HB ALA 62 22.003 -3.598 -11.573
460 HB2 ALA 62 2HB ALA 62 23.166 -4.858 -11.160
461 HB3 ALA 62 3HB ALA 62 22.167 -4.134 -9.900
462 H ILE 63 H ILE 63 22.177 -0.984 -11.123
463 HA ILE 63 HA ILE 63 22.727 -0.559 -13.834
464 HB ILE 63 HB ILE 63 21.650 1.417 -11.820
465 HG12 ILE 63 2HG1 ILE 63 19.848 0.122 -13.761
466 HG13 ILE 63 3HG1 ILE 63 20.531 -0.961 -12.553
467 HG21 ILE 63 1HG2 ILE 63 20.705 2.576 -13.757
468 HG22 ILE 63 2HG2 ILE 63 22.466 2.521 -13.831
469 HG23 ILE 63 3HG2 ILE 63 21.507 1.431 -14.832
470 HD11 ILE 63 3HD1 ILE 63 19.650 1.377 -11.224
471 HD12 ILE 63 1HD1 ILE 63 18.361 0.836 -12.299
472 HD13 ILE 63 2HD1 ILE 63 19.028 -0.268 -11.095
473 H ARG 64 H ARG 64 23.994 1.062 -10.943
474 HA ARG 64 HA ARG 64 25.532 3.005 -12.242
475 HB2 ARG 64 2HB ARG 64 24.967 2.812 -9.755
476 HB3 ARG 64 3HB ARG 64 26.317 1.690 -9.648
477 HG2 ARG 64 2HG ARG 64 27.314 3.926 -10.992
478 HG3 ARG 64 3HG ARG 64 26.324 4.560 -9.676
479 HD2 ARG 64 2HD ARG 64 27.634 2.623 -8.361
480 HD3 ARG 64 3HD ARG 64 28.837 3.005 -9.592
481 HE ARG 64 HE ARG 64 28.150 4.588 -7.332
482 HH11 ARG 64 1HH1 ARG 64 29.162 4.781 -10.658
483 HH12 ARG 64 2HH1 ARG 64 29.924 6.326 -10.472
484 HH21 ARG 64 1HH2 ARG 64 29.150 6.622 -7.075
485 HH22 ARG 64 2HH2 ARG 64 29.917 7.372 -8.434
486 H ASP 65 H ASP 65 26.399 -0.262 -11.156
487 HA ASP 65 HA ASP 65 29.100 -0.196 -11.878
488 HB2 ASP 65 2HB ASP 65 27.171 -2.523 -11.766
489 HB3 ASP 65 3HB ASP 65 28.914 -2.692 -11.953
490 H GLU 66 H GLU 66 26.246 -1.176 -13.741
491 HA GLU 66 HA GLU 66 27.586 -2.052 -16.040
492 HB2 GLU 66 2HB GLU 66 24.858 -0.758 -15.890
493 HB3 GLU 66 3HB GLU 66 25.457 -1.777 -17.191
494 HG2 GLU 66 2HG GLU 66 25.068 -3.679 -16.064
495 HG3 GLU 66 3HG GLU 66 25.533 -2.983 -14.513
496 H CYS 67 H CYS 67 26.264 1.143 -15.224
497 HA CYS 67 HA CYS 67 26.870 2.438 -17.618
498 HB2 CYS 67 2HB CYS 67 26.703 3.502 -14.795
499 HB3 CYS 67 3HB CYS 67 26.872 4.533 -16.210
500 HG CYS 67 HG CYS 67 24.149 3.459 -14.862
501 H GLN 68 H GLN 68 28.827 2.011 -14.696
502 HA GLN 68 HA GLN 68 31.026 3.555 -15.601
503 HB2 GLN 68 2HB GLN 68 30.845 1.388 -13.504
504 HB3 GLN 68 3HB GLN 68 32.274 2.376 -13.777
505 HG2 GLN 68 2HG GLN 68 29.585 3.237 -12.764
506 HG3 GLN 68 3HG GLN 68 31.147 3.336 -11.953
507 HE21 GLN 68 1HE2 GLN 68 32.647 4.908 -12.642
508 HE22 GLN 68 2HE2 GLN 68 32.135 6.317 -13.501
509 H ALA 69 H ALA 69 30.080 0.222 -16.018
510 HA ALA 69 HA ALA 69 32.633 -0.639 -17.024
511 HB1 ALA 69 1HB ALA 69 31.304 -2.287 -15.948
512 HB2 ALA 69 2HB ALA 69 29.918 -1.938 -16.981
513 HB3 ALA 69 3HB ALA 69 31.353 -2.705 -17.661
514 H TYR 70 H TYR 70 30.152 1.200 -18.294
515 HA TYR 70 HA TYR 70 30.579 0.289 -21.043
516 HB2 TYR 70 2HB TYR 70 28.603 2.280 -19.909
517 HB3 TYR 70 3HB TYR 70 28.701 1.807 -21.602
518 HD1 TYR 70 HD2 TYR 70 29.287 -1.171 -20.988
519 HD2 TYR 70 HD1 TYR 70 26.340 1.556 -19.580
520 HE1 TYR 70 HE2 TYR 70 27.763 -3.052 -20.553
521 HE2 TYR 70 HE1 TYR 70 24.809 -0.317 -19.140
522 HH TYR 70 HH TYR 70 24.521 -2.715 -20.060
523 H ARG 71 H ARG 71 30.987 3.106 -18.966
524 HA ARG 71 HA ARG 71 32.819 4.231 -20.963
525 HB2 ARG 71 2HB ARG 71 30.452 5.311 -20.895
526 HB3 ARG 71 3HB ARG 71 31.007 6.035 -19.392
527 HG2 ARG 71 2HG ARG 71 32.923 7.009 -20.622
528 HG3 ARG 71 3HG ARG 71 32.236 6.372 -22.118
529 HD2 ARG 71 2HD ARG 71 30.314 7.750 -21.922
530 HD3 ARG 71 3HD ARG 71 30.723 8.198 -20.267
531 HE ARG 71 HE ARG 71 31.759 9.358 -22.684
532 HH11 ARG 71 1HH1 ARG 71 32.335 8.800 -19.296
533 HH12 ARG 71 2HH1 ARG 71 33.412 10.146 -19.124
534 HH21 ARG 71 1HH2 ARG 71 33.176 11.133 -22.470
535 HH22 ARG 71 2HH2 ARG 71 33.890 11.472 -20.930
536 H HIS 72 H HIS 72 33.662 2.760 -18.824
537 HA HIS 72 HA HIS 72 35.495 4.453 -17.570
538 HB2 HIS 72 2HB HIS 72 33.023 4.730 -16.385
539 HB3 HIS 72 3HB HIS 72 33.810 3.537 -15.356
540 HD1 HIS 72 HD1 HIS 72 33.333 7.004 -15.501
541 HD2 HIS 72 HD2 HIS 72 36.643 4.607 -14.754
542 HE1 HIS 72 HE1 HIS 72 34.964 8.474 -14.276
543 H ASN 73 H ASN 73 35.365 1.901 -18.869
544 HA ASN 73 HA ASN 73 36.739 0.316 -16.837
545 HB2 ASN 73 2HB ASN 73 34.643 -0.729 -16.675
546 HB3 ASN 73 3HB ASN 73 34.332 -0.579 -18.401
547 HD21 ASN 73 1HD2 ASN 73 34.343 -2.463 -19.365
548 HD22 ASN 73 2HD2 ASN 73 35.391 -3.790 -19.010
Start of MODEL 10
1 H1 MET 1 H MET 1 0.849 0.826 -0.422
2 HA MET 1 HA MET 1 3.212 -0.384 -1.531
3 HB2 MET 1 2HB MET 1 1.199 1.513 -2.751
4 HB3 MET 1 3HB MET 1 2.477 0.694 -3.638
5 HG2 MET 1 2HG MET 1 1.459 -1.362 -3.482
6 HG3 MET 1 3HG MET 1 0.533 -0.911 -2.052
7 HE1 MET 1 3HE MET 1 0.276 -1.384 -5.943
8 HE2 MET 1 1HE MET 1 -0.281 -2.465 -4.666
9 HE3 MET 1 2HE MET 1 -1.452 -1.636 -5.691
10 H GLY 2 H GLY 2 2.145 2.889 -0.719
11 HA2 GLY 2 2HA GLY 2 3.341 4.821 -0.385
12 HA3 GLY 2 3HA GLY 2 4.770 3.809 -0.234
13 H SER 3 H SER 3 6.264 4.756 -1.476
14 HA SER 3 HA SER 3 5.499 5.696 -4.146
15 HB2 SER 3 2HB SER 3 7.879 6.263 -2.380
16 HB3 SER 3 3HB SER 3 7.844 6.723 -4.082
17 HG SER 3 HG SER 3 6.826 8.425 -3.408
18 H TRP 4 H TRP 4 5.883 2.856 -3.394
19 HA TRP 4 HA TRP 4 8.346 1.930 -4.448
20 HB2 TRP 4 2HB TRP 4 7.112 0.493 -2.977
21 HB3 TRP 4 3HB TRP 4 5.690 0.557 -4.015
22 HD1 TRP 4 HD1 TRP 4 5.919 -0.753 -6.433
23 HE1 TRP 4 HE1 TRP 4 7.251 -2.876 -7.021
24 HE3 TRP 4 HE3 TRP 4 9.154 -0.804 -2.474
25 HZ2 TRP 4 HZ2 TRP 4 9.389 -4.374 -5.948
26 HZ3 TRP 4 HZ3 TRP 4 10.812 -2.617 -2.329
27 HH2 TRP 4 HH2 TRP 4 10.925 -4.364 -4.031
28 H ALA 5 H ALA 5 5.059 1.941 -5.833
29 HA ALA 5 HA ALA 5 5.626 0.921 -8.329
30 HB1 ALA 5 1HB ALA 5 3.720 3.082 -8.533
31 HB2 ALA 5 2HB ALA 5 3.473 1.342 -8.694
32 HB3 ALA 5 3HB ALA 5 3.426 2.097 -7.100
33 H GLU 6 H GLU 6 5.775 4.317 -7.287
34 HA GLU 6 HA GLU 6 6.504 5.408 -9.765
35 HB2 GLU 6 2HB GLU 6 6.221 6.321 -7.069
36 HB3 GLU 6 3HB GLU 6 7.744 6.922 -7.709
37 HG2 GLU 6 2HG GLU 6 6.424 7.722 -9.716
38 HG3 GLU 6 3HG GLU 6 4.976 7.380 -8.770
39 H PHE 7 H PHE 7 8.521 4.370 -7.026
40 HA PHE 7 HA PHE 7 11.000 5.003 -8.178
41 HB2 PHE 7 2HB PHE 7 10.049 3.392 -5.900
42 HB3 PHE 7 3HB PHE 7 11.604 2.894 -6.558
43 HD1 PHE 7 HD2 PHE 7 9.788 5.941 -5.424
44 HD2 PHE 7 HD1 PHE 7 13.523 3.939 -5.827
45 HE1 PHE 7 HE2 PHE 7 10.891 7.753 -4.177
46 HE2 PHE 7 HE1 PHE 7 14.631 5.747 -4.579
47 HZ PHE 7 HZ PHE 7 13.315 7.658 -3.753
48 H LYS 8 H LYS 8 9.004 2.106 -8.360
49 HA LYS 8 HA LYS 8 10.899 0.461 -9.661
50 HB2 LYS 8 2HB LYS 8 7.992 0.380 -9.126
51 HB3 LYS 8 3HB LYS 8 8.538 -0.560 -10.508
52 HG2 LYS 8 2HG LYS 8 10.355 -1.293 -8.636
53 HG3 LYS 8 3HG LYS 8 8.924 -1.019 -7.639
54 HD2 LYS 8 2HD LYS 8 8.893 -3.306 -8.297
55 HD3 LYS 8 3HD LYS 8 7.652 -2.479 -9.242
56 HE2 LYS 8 2HE LYS 8 9.173 -2.351 -11.143
57 HE3 LYS 8 3HE LYS 8 10.438 -3.136 -10.198
58 HZ1 LYS 8 3HZ LYS 8 9.043 -5.103 -10.033
59 HZ2 LYS 8 1HZ LYS 8 9.323 -4.704 -11.653
60 HZ3 LYS 8 2HZ LYS 8 7.831 -4.350 -10.941
61 H GLN 9 H GLN 9 8.381 2.632 -10.864
62 HA GLN 9 HA GLN 9 8.636 1.974 -13.592
63 HB2 GLN 9 2HB GLN 9 7.161 3.840 -12.011
64 HB3 GLN 9 3HB GLN 9 7.898 4.708 -13.351
65 HG2 GLN 9 2HG GLN 9 6.847 3.274 -14.947
66 HG3 GLN 9 3HG GLN 9 6.252 2.213 -13.671
67 HE21 GLN 9 1HE2 GLN 9 5.661 4.980 -15.544
68 HE22 GLN 9 2HE2 GLN 9 4.187 5.470 -14.789
69 H ARG 10 H ARG 10 9.882 4.822 -11.837
70 HA ARG 10 HA ARG 10 11.407 5.886 -13.893
71 HB2 ARG 10 2HB ARG 10 11.968 5.958 -10.922
72 HB3 ARG 10 3HB ARG 10 12.714 7.010 -12.119
73 HG2 ARG 10 2HG ARG 10 10.961 8.381 -12.158
74 HG3 ARG 10 3HG ARG 10 9.810 7.046 -12.245
75 HD2 ARG 10 2HD ARG 10 9.236 7.710 -10.177
76 HD3 ARG 10 3HD ARG 10 10.675 6.817 -9.687
77 HE ARG 10 HE ARG 10 11.601 8.800 -9.062
78 HH11 ARG 10 1HH1 ARG 10 9.123 9.441 -11.422
79 HH12 ARG 10 2HH1 ARG 10 9.278 11.163 -11.309
80 HH21 ARG 10 1HH2 ARG 10 11.814 11.065 -8.903
81 HH22 ARG 10 2HH2 ARG 10 10.810 12.085 -9.876
82 H LEU 11 H LEU 11 12.331 3.506 -11.431
83 HA LEU 11 HA LEU 11 15.032 3.273 -12.159
84 HB2 LEU 11 2HB LEU 11 13.090 1.542 -10.700
85 HB3 LEU 11 3HB LEU 11 14.657 0.878 -11.158
86 HG LEU 11 HG LEU 11 14.549 3.448 -9.642
87 HD11 LEU 11 1HD1 LEU 11 13.292 1.136 -8.701
88 HD12 LEU 11 2HD1 LEU 11 13.749 2.563 -7.772
89 HD13 LEU 11 3HD1 LEU 11 14.855 1.194 -7.886
90 HD21 LEU 11 3HD2 LEU 11 16.623 2.254 -10.665
91 HD22 LEU 11 1HD2 LEU 11 16.473 1.194 -9.264
92 HD23 LEU 11 2HD2 LEU 11 16.714 2.927 -9.037
93 H ALA 12 H ALA 12 12.145 1.578 -13.287
94 HA ALA 12 HA ALA 12 13.434 -0.346 -14.879
95 HB1 ALA 12 1HB ALA 12 10.727 0.862 -15.412
96 HB2 ALA 12 2HB ALA 12 11.309 -0.733 -15.891
97 HB3 ALA 12 3HB ALA 12 11.029 -0.372 -14.188
98 H ALA 13 H ALA 13 12.207 2.892 -15.659
99 HA ALA 13 HA ALA 13 12.816 2.816 -18.411
100 HB1 ALA 13 1HB ALA 13 12.879 5.422 -17.997
101 HB2 ALA 13 2HB ALA 13 11.366 4.517 -17.944
102 HB3 ALA 13 3HB ALA 13 12.185 4.954 -16.445
103 H ILE 14 H ILE 14 14.659 3.935 -15.603
104 HA ILE 14 HA ILE 14 16.840 5.005 -17.033
105 HB ILE 14 HB ILE 14 16.805 3.854 -14.241
106 HG12 ILE 14 2HG1 ILE 14 16.788 6.779 -14.825
107 HG13 ILE 14 3HG1 ILE 14 15.282 5.889 -15.020
108 HG21 ILE 14 1HG2 ILE 14 18.772 5.734 -15.540
109 HG22 ILE 14 2HG2 ILE 14 18.802 5.195 -13.861
110 HG23 ILE 14 3HG2 ILE 14 19.064 4.036 -15.163
111 HD11 ILE 14 3HD1 ILE 14 15.001 6.393 -12.859
112 HD12 ILE 14 1HD1 ILE 14 16.070 5.017 -12.589
113 HD13 ILE 14 2HD1 ILE 14 16.724 6.655 -12.588
114 H LYS 15 H LYS 15 16.184 1.778 -15.759
115 HA LYS 15 HA LYS 15 18.738 0.691 -16.341
116 HB2 LYS 15 2HB LYS 15 16.429 -0.179 -15.049
117 HB3 LYS 15 3HB LYS 15 16.576 -1.250 -16.436
118 HG2 LYS 15 2HG LYS 15 19.146 -1.052 -15.329
119 HG3 LYS 15 3HG LYS 15 18.034 -1.258 -13.974
120 HD2 LYS 15 2HD LYS 15 17.018 -3.177 -15.282
121 HD3 LYS 15 3HD LYS 15 18.405 -3.049 -16.365
122 HE2 LYS 15 2HE LYS 15 18.872 -4.745 -14.740
123 HE3 LYS 15 3HE LYS 15 19.891 -3.349 -14.392
124 HZ1 LYS 15 3HZ LYS 15 19.018 -3.209 -12.377
125 HZ2 LYS 15 1HZ LYS 15 18.156 -4.636 -12.663
126 HZ3 LYS 15 2HZ LYS 15 17.444 -3.138 -12.994
127 H THR 16 H THR 16 15.677 0.775 -18.113
128 HA THR 16 HA THR 16 16.427 -0.879 -20.251
129 HB THR 16 HB THR 16 14.470 1.427 -20.246
130 HG1 THR 16 HG1 THR 16 13.008 -0.047 -19.598
131 HG21 THR 16 3HG2 THR 16 13.454 0.116 -22.163
132 HG22 THR 16 1HG2 THR 16 14.967 -0.787 -22.228
133 HG23 THR 16 2HG2 THR 16 14.966 0.953 -22.516
134 H ARG 17 H ARG 17 16.430 2.682 -20.039
135 HA ARG 17 HA ARG 17 17.636 3.102 -22.552
136 HB2 ARG 17 2HB ARG 17 16.959 4.723 -20.198
137 HB3 ARG 17 3HB ARG 17 18.354 5.309 -21.095
138 HG2 ARG 17 2HG ARG 17 16.720 6.425 -22.199
139 HG3 ARG 17 3HG ARG 17 16.725 4.938 -23.148
140 HD2 ARG 17 2HD ARG 17 14.950 4.123 -21.463
141 HD3 ARG 17 3HD ARG 17 14.786 5.828 -21.043
142 HE ARG 17 HE ARG 17 14.597 5.640 -23.808
143 HH11 ARG 17 1HH1 ARG 17 12.846 4.550 -21.004
144 HH12 ARG 17 2HH1 ARG 17 11.310 4.543 -21.805
145 HH21 ARG 17 1HH2 ARG 17 12.580 5.635 -24.873
146 HH22 ARG 17 2HH2 ARG 17 11.160 5.160 -24.006
147 H CYS 18 H CYS 18 18.944 2.501 -19.363
148 HA CYS 18 HA CYS 18 21.622 3.252 -19.960
149 HB2 CYS 18 2HB CYS 18 21.074 3.212 -17.669
150 HB3 CYS 18 3HB CYS 18 20.352 1.612 -17.781
151 HG CYS 18 HG CYS 18 23.706 2.190 -18.131
152 H GLN 19 H GLN 19 19.784 0.281 -20.247
153 HA GLN 19 HA GLN 19 22.057 -1.374 -20.796
154 HB2 GLN 19 2HB GLN 19 19.100 -1.825 -21.226
155 HB3 GLN 19 3HB GLN 19 20.336 -3.050 -21.485
156 HG2 GLN 19 2HG GLN 19 20.543 -1.837 -18.864
157 HG3 GLN 19 3HG GLN 19 18.959 -2.559 -19.143
158 HE21 GLN 19 1HE2 GLN 19 21.139 -3.369 -17.357
159 HE22 GLN 19 2HE2 GLN 19 21.516 -5.000 -17.786
160 H ALA 20 H ALA 20 19.550 0.180 -22.759
161 HA ALA 20 HA ALA 20 20.581 -0.827 -25.235
162 HB1 ALA 20 1HB ALA 20 18.319 -0.381 -25.360
163 HB2 ALA 20 2HB ALA 20 18.462 1.139 -24.476
164 HB3 ALA 20 3HB ALA 20 19.014 1.036 -26.148
165 H LEU 21 H LEU 21 21.068 2.036 -23.299
166 HA LEU 21 HA LEU 21 22.408 3.862 -23.532
167 HB2 LEU 21 2HB LEU 21 23.999 1.873 -25.143
168 HB3 LEU 21 3HB LEU 21 24.604 3.438 -24.605
169 HG LEU 21 HG LEU 21 23.704 1.246 -22.740
170 HD11 LEU 21 1HD1 LEU 21 25.707 0.284 -22.856
171 HD12 LEU 21 2HD1 LEU 21 26.543 1.835 -22.802
172 HD13 LEU 21 3HD1 LEU 21 25.956 1.203 -24.340
173 HD21 LEU 21 3HD2 LEU 21 24.494 2.556 -21.005
174 HD22 LEU 21 1HD2 LEU 21 23.750 3.751 -22.068
175 HD23 LEU 21 2HD2 LEU 21 25.501 3.541 -22.067
176 H GLY 22 H GLY 22 20.295 3.381 -25.569
177 HA2 GLY 22 2HA GLY 22 21.443 4.584 -27.973
178 HA3 GLY 22 3HA GLY 22 19.808 3.962 -27.802
179 H GLY 23 H GLY 23 21.116 6.073 -25.374
180 HA2 GLY 23 2HA GLY 23 19.140 8.095 -26.159
181 HA3 GLY 23 3HA GLY 23 19.907 7.960 -24.583
182 H SER 24 H SER 24 22.066 8.709 -24.324
183 HA SER 24 HA SER 24 23.384 10.087 -26.476
184 HB2 SER 24 2HB SER 24 22.673 11.870 -24.178
185 HB3 SER 24 3HB SER 24 23.087 12.296 -25.838
186 HG SER 24 HG SER 24 20.924 12.589 -25.697
187 H GLU 25 H GLU 25 25.498 10.807 -25.920
188 HA GLU 25 HA GLU 25 26.816 9.162 -24.048
189 HB2 GLU 25 2HB GLU 25 28.820 10.345 -24.644
190 HB3 GLU 25 3HB GLU 25 27.858 10.127 -26.099
191 HG2 GLU 25 2HG GLU 25 28.319 12.295 -26.417
192 HG3 GLU 25 3HG GLU 25 26.972 12.540 -25.307
193 H ALA 26 H ALA 26 25.462 12.361 -23.836
194 HA ALA 26 HA ALA 26 26.775 12.964 -21.325
195 HB1 ALA 26 1HB ALA 26 24.611 14.740 -21.845
196 HB2 ALA 26 2HB ALA 26 26.345 15.056 -21.920
197 HB3 ALA 26 3HB ALA 26 25.493 14.468 -23.348
198 H GLU 27 H GLU 27 23.515 12.143 -22.451
199 HA GLU 27 HA GLU 27 22.078 12.432 -20.125
200 HB2 GLU 27 2HB GLU 27 20.466 11.572 -21.404
201 HB3 GLU 27 3HB GLU 27 21.675 11.215 -22.628
202 HG2 GLU 27 2HG GLU 27 22.053 9.023 -21.621
203 HG3 GLU 27 3HG GLU 27 20.840 9.380 -20.393
204 H CYS 28 H CYS 28 24.242 9.819 -21.048
205 HA CYS 28 HA CYS 28 23.628 7.893 -19.184
206 HB2 CYS 28 2HB CYS 28 26.375 8.712 -20.152
207 HB3 CYS 28 3HB CYS 28 26.005 7.200 -19.332
208 HG CYS 28 HG CYS 28 23.956 7.423 -21.844
209 H ALA 29 H ALA 29 25.714 10.729 -18.766
210 HA ALA 29 HA ALA 29 26.658 10.234 -16.209
211 HB1 ALA 29 1HB ALA 29 25.948 13.036 -16.750
212 HB2 ALA 29 2HB ALA 29 27.497 12.319 -16.302
213 HB3 ALA 29 3HB ALA 29 26.948 12.258 -17.977
214 H ALA 30 H ALA 30 23.761 12.110 -17.111
215 HA ALA 30 HA ALA 30 22.853 12.638 -14.530
216 HB1 ALA 30 1HB ALA 30 21.012 12.170 -16.857
217 HB2 ALA 30 2HB ALA 30 20.810 13.276 -15.499
218 HB3 ALA 30 3HB ALA 30 22.026 13.608 -16.732
219 H PHE 31 H PHE 31 22.491 9.788 -16.538
220 HA PHE 31 HA PHE 31 20.447 8.520 -15.073
221 HB2 PHE 31 2HB PHE 31 22.356 7.780 -17.169
222 HB3 PHE 31 3HB PHE 31 21.942 6.447 -16.096
223 HD1 PHE 31 HD2 PHE 31 19.669 9.211 -16.971
224 HD2 PHE 31 HD1 PHE 31 20.722 5.143 -17.650
225 HE1 PHE 31 HE2 PHE 31 17.567 8.877 -18.205
226 HE2 PHE 31 HE1 PHE 31 18.621 4.803 -18.886
227 HZ PHE 31 HZ PHE 31 17.040 6.671 -19.164
228 H GLU 32 H GLU 32 23.985 8.163 -14.917
229 HA GLU 32 HA GLU 32 24.053 6.276 -12.852
230 HB2 GLU 32 2HB GLU 32 25.951 7.115 -14.390
231 HB3 GLU 32 3HB GLU 32 26.162 8.391 -13.198
232 HG2 GLU 32 2HG GLU 32 26.260 6.397 -11.515
233 HG3 GLU 32 3HG GLU 32 26.670 5.468 -12.956
234 H LYS 33 H LYS 33 24.166 9.819 -12.736
235 HA LYS 33 HA LYS 33 24.516 10.090 -9.970
236 HB2 LYS 33 2HB LYS 33 23.505 11.840 -12.157
237 HB3 LYS 33 3HB LYS 33 23.176 12.332 -10.501
238 HG2 LYS 33 2HG LYS 33 25.342 12.819 -10.067
239 HG3 LYS 33 3HG LYS 33 25.956 11.544 -11.122
240 HD2 LYS 33 2HD LYS 33 25.242 12.933 -13.077
241 HD3 LYS 33 3HD LYS 33 24.858 14.231 -11.943
242 HE2 LYS 33 2HE LYS 33 27.527 13.105 -11.573
243 HE3 LYS 33 3HE LYS 33 27.285 13.830 -13.162
244 HZ1 LYS 33 3HZ LYS 33 26.261 15.440 -11.018
245 HZ2 LYS 33 1HZ LYS 33 27.281 15.868 -12.298
246 HZ3 LYS 33 2HZ LYS 33 27.927 15.173 -10.898
247 H GLU 34 H GLU 34 21.520 10.163 -11.897
248 HA GLU 34 HA GLU 34 19.703 10.527 -9.844
249 HB2 GLU 34 2HB GLU 34 19.598 9.859 -12.586
250 HB3 GLU 34 3HB GLU 34 18.631 8.656 -11.744
251 HG2 GLU 34 2HG GLU 34 18.290 11.617 -11.360
252 HG3 GLU 34 3HG GLU 34 17.388 10.675 -12.546
253 H ILE 35 H ILE 35 20.972 7.467 -11.131
254 HA ILE 35 HA ILE 35 19.519 5.743 -9.474
255 HB ILE 35 HB ILE 35 22.231 5.387 -10.745
256 HG12 ILE 35 2HG1 ILE 35 20.337 5.661 -12.298
257 HG13 ILE 35 3HG1 ILE 35 21.006 4.035 -12.374
258 HG21 ILE 35 1HG2 ILE 35 22.409 3.745 -9.187
259 HG22 ILE 35 2HG2 ILE 35 20.665 3.613 -8.967
260 HG23 ILE 35 3HG2 ILE 35 21.434 2.873 -10.370
261 HD11 ILE 35 3HD1 ILE 35 18.448 4.923 -11.080
262 HD12 ILE 35 1HD1 ILE 35 18.661 3.813 -12.434
263 HD13 ILE 35 2HD1 ILE 35 19.163 3.333 -10.812
264 H ALA 36 H ALA 36 22.706 7.232 -9.018
265 HA ALA 36 HA ALA 36 23.442 5.976 -6.650
266 HB1 ALA 36 1HB ALA 36 24.984 7.770 -6.314
267 HB2 ALA 36 2HB ALA 36 24.886 7.458 -8.048
268 HB3 ALA 36 3HB ALA 36 24.045 8.843 -7.352
269 H ALA 37 H ALA 37 21.617 8.997 -7.095
270 HA ALA 37 HA ALA 37 21.244 9.487 -4.327
271 HB1 ALA 37 1HB ALA 37 21.076 11.264 -5.984
272 HB2 ALA 37 2HB ALA 37 19.652 10.492 -6.683
273 HB3 ALA 37 3HB ALA 37 19.588 11.139 -5.044
274 H PHE 38 H PHE 38 19.502 7.612 -6.702
275 HA PHE 38 HA PHE 38 17.060 7.342 -5.331
276 HB2 PHE 38 2HB PHE 38 18.262 6.288 -7.696
277 HB3 PHE 38 3HB PHE 38 17.595 4.946 -6.772
278 HD1 PHE 38 HD2 PHE 38 16.408 8.449 -7.212
279 HD2 PHE 38 HD1 PHE 38 15.640 4.304 -7.804
280 HE1 PHE 38 HE2 PHE 38 14.161 8.989 -8.056
281 HE2 PHE 38 HE1 PHE 38 13.391 4.838 -8.650
282 HZ PHE 38 HZ PHE 38 12.649 7.183 -8.775
283 H GLU 39 H GLU 39 19.853 5.130 -5.479
284 HA GLU 39 HA GLU 39 18.836 3.322 -3.558
285 HB2 GLU 39 2HB GLU 39 21.088 2.378 -3.523
286 HB3 GLU 39 3HB GLU 39 20.570 2.693 -5.173
287 HG2 GLU 39 2HG GLU 39 21.880 4.778 -5.157
288 HG3 GLU 39 3HG GLU 39 22.447 4.382 -3.536
289 H SER 40 H SER 40 20.925 6.148 -3.334
290 HA SER 40 HA SER 40 21.627 5.788 -0.603
291 HB2 SER 40 2HB SER 40 23.044 7.176 -1.938
292 HB3 SER 40 3HB SER 40 21.693 8.200 -2.423
293 HG SER 40 HG SER 40 21.841 9.263 -0.603
294 H GLU 41 H GLU 41 18.911 7.212 -2.240
295 HA GLU 41 HA GLU 41 17.948 8.634 0.074
296 HB2 GLU 41 2HB GLU 41 16.940 8.151 -2.701
297 HB3 GLU 41 3HB GLU 41 15.819 8.711 -1.468
298 HG2 GLU 41 2HG GLU 41 18.374 10.177 -1.742
299 HG3 GLU 41 3HG GLU 41 17.183 10.368 -3.027
300 H LEU 42 H LEU 42 17.293 5.574 -1.532
301 HA LEU 42 HA LEU 42 15.024 4.933 0.099
302 HB2 LEU 42 2HB LEU 42 16.740 3.274 -1.738
303 HB3 LEU 42 3HB LEU 42 15.325 2.649 -0.893
304 HG LEU 42 HG LEU 42 14.995 5.041 -2.637
305 HD11 LEU 42 1HD1 LEU 42 14.443 2.808 -4.232
306 HD12 LEU 42 2HD1 LEU 42 16.053 2.540 -3.566
307 HD13 LEU 42 3HD1 LEU 42 15.707 4.015 -4.468
308 HD21 LEU 42 3HD2 LEU 42 12.968 4.567 -1.746
309 HD22 LEU 42 1HD2 LEU 42 13.353 2.864 -1.494
310 HD23 LEU 42 2HD2 LEU 42 12.902 3.438 -3.100
311 H GLN 43 H GLN 43 18.469 4.348 0.232
312 HA GLN 43 HA GLN 43 18.316 2.375 2.308
313 HB2 GLN 43 2HB GLN 43 20.663 2.345 2.264
314 HB3 GLN 43 3HB GLN 43 20.200 2.681 0.601
315 HG2 GLN 43 2HG GLN 43 21.702 4.323 0.739
316 HG3 GLN 43 3HG GLN 43 20.432 5.191 1.600
317 HE21 GLN 43 1HE2 GLN 43 22.829 2.683 2.365
318 HE22 GLN 43 2HE2 GLN 43 23.407 3.437 3.808
319 H ALA 44 H ALA 44 18.287 5.804 2.176
320 HA ALA 44 HA ALA 44 19.274 6.265 4.828
321 HB1 ALA 44 1HB ALA 44 18.975 8.508 4.412
322 HB2 ALA 44 2HB ALA 44 19.179 7.878 2.777
323 HB3 ALA 44 3HB ALA 44 17.565 8.242 3.387
324 H TYR 45 H TYR 45 16.178 5.596 3.394
325 HA TYR 45 HA TYR 45 14.414 6.600 5.261
326 HB2 TYR 45 2HB TYR 45 14.350 4.176 3.497
327 HB3 TYR 45 3HB TYR 45 13.047 4.459 4.645
328 HD1 TYR 45 HD2 TYR 45 12.638 7.323 4.547
329 HD2 TYR 45 HD1 TYR 45 13.534 4.628 1.379
330 HE1 TYR 45 HE2 TYR 45 11.559 8.851 2.950
331 HE2 TYR 45 HE1 TYR 45 12.459 6.149 -0.227
332 HH TYR 45 HH TYR 45 10.908 9.157 0.847
333 H LYS 46 H LYS 46 15.716 3.277 5.238
334 HA LYS 46 HA LYS 46 16.074 1.770 6.903
335 HB2 LYS 46 2HB LYS 46 17.617 3.514 7.707
336 HB3 LYS 46 3HB LYS 46 16.305 4.252 8.616
337 HG2 LYS 46 2HG LYS 46 16.123 1.915 9.739
338 HG3 LYS 46 3HG LYS 46 17.768 1.704 9.135
339 HD2 LYS 46 2HD LYS 46 17.180 4.245 10.534
340 HD3 LYS 46 3HD LYS 46 17.210 2.784 11.525
341 HE2 LYS 46 2HE LYS 46 19.416 3.628 9.649
342 HE3 LYS 46 3HE LYS 46 19.401 3.954 11.382
343 HZ1 LYS 46 3HZ LYS 46 18.908 1.218 10.948
344 HZ2 LYS 46 1HZ LYS 46 20.208 1.943 11.752
345 HZ3 LYS 46 2HZ LYS 46 20.295 1.661 10.087
346 H GLY 47 H GLY 47 14.037 0.818 6.873
347 HA2 GLY 47 2HA GLY 47 12.256 1.680 9.066
348 HA3 GLY 47 3HA GLY 47 11.627 1.163 7.509
349 H LYS 48 H LYS 48 13.712 0.012 10.154
350 HA LYS 48 HA LYS 48 13.903 -2.020 11.158
351 HB2 LYS 48 2HB LYS 48 11.242 -2.737 9.937
352 HB3 LYS 48 3HB LYS 48 11.953 -3.355 11.422
353 HG2 LYS 48 2HG LYS 48 11.785 -0.593 11.781
354 HG3 LYS 48 3HG LYS 48 10.268 -1.063 11.012
355 HD2 LYS 48 2HD LYS 48 9.604 -2.332 12.787
356 HD3 LYS 48 3HD LYS 48 11.256 -2.757 13.240
357 HE2 LYS 48 2HE LYS 48 11.226 -1.183 14.804
358 HE3 LYS 48 3HE LYS 48 10.968 0.042 13.563
359 HZ1 LYS 48 3HZ LYS 48 8.935 0.352 14.342
360 HZ2 LYS 48 1HZ LYS 48 9.185 -0.821 15.535
361 HZ3 LYS 48 2HZ LYS 48 8.538 -1.264 14.037
362 H GLY 49 H GLY 49 15.532 -2.108 9.252
363 HA2 GLY 49 2HA GLY 49 16.674 -3.828 8.124
364 HA3 GLY 49 3HA GLY 49 15.165 -4.721 8.004
365 H ASN 50 H ASN 50 13.933 -2.067 7.048
366 HA ASN 50 HA ASN 50 13.193 -1.434 4.965
367 HB2 ASN 50 2HB ASN 50 15.105 -0.433 3.600
368 HB3 ASN 50 3HB ASN 50 14.894 0.192 5.233
369 HD21 ASN 50 1HD2 ASN 50 16.966 -1.421 3.056
370 HD22 ASN 50 2HD2 ASN 50 18.304 -1.635 4.128
371 HA PRO 51 HA PRO 51 14.236 -5.483 2.919
372 HB2 PRO 51 2HB PRO 51 11.655 -6.262 2.599
373 HB3 PRO 51 3HB PRO 51 12.584 -6.593 4.066
374 HG2 PRO 51 2HG PRO 51 10.583 -4.430 3.539
375 HG3 PRO 51 3HG PRO 51 10.779 -5.446 4.979
376 HD2 PRO 51 2HD PRO 51 11.705 -2.904 4.852
377 HD3 PRO 51 3HD PRO 51 12.515 -4.170 5.797
378 H GLU 52 H GLU 52 11.624 -3.181 2.191
379 HA GLU 52 HA GLU 52 11.364 -3.797 -0.534
380 HB2 GLU 52 2HB GLU 52 10.388 -1.468 -0.699
381 HB3 GLU 52 3HB GLU 52 9.635 -2.531 0.482
382 HG2 GLU 52 2HG GLU 52 10.708 -1.428 2.287
383 HG3 GLU 52 3HG GLU 52 11.747 -0.517 1.193
384 H VAL 53 H VAL 53 13.534 -1.628 1.180
385 HA VAL 53 HA VAL 53 14.557 -0.284 -1.093
386 HB VAL 53 HB VAL 53 15.885 -0.750 1.581
387 HG11 VAL 53 1HG1 VAL 53 17.591 -0.072 0.134
388 HG12 VAL 53 2HG1 VAL 53 16.535 1.042 -0.737
389 HG13 VAL 53 3HG1 VAL 53 17.061 1.424 0.902
390 HG21 VAL 53 3HG2 VAL 53 14.386 1.696 0.671
391 HG22 VAL 53 1HG2 VAL 53 13.635 0.395 1.595
392 HG23 VAL 53 2HG2 VAL 53 14.968 1.316 2.291
393 H GLU 54 H GLU 54 15.103 -3.414 0.208
394 HA GLU 54 HA GLU 54 17.715 -3.949 -0.577
395 HB2 GLU 54 2HB GLU 54 15.363 -5.847 -0.618
396 HB3 GLU 54 3HB GLU 54 17.059 -6.311 -0.614
397 HG2 GLU 54 2HG GLU 54 16.020 -4.593 1.584
398 HG3 GLU 54 3HG GLU 54 15.660 -6.318 1.590
399 H ALA 55 H ALA 55 14.722 -4.592 -2.406
400 HA ALA 55 HA ALA 55 15.929 -5.494 -4.753
401 HB1 ALA 55 1HB ALA 55 13.352 -3.947 -4.686
402 HB2 ALA 55 2HB ALA 55 13.832 -5.230 -5.798
403 HB3 ALA 55 3HB ALA 55 13.481 -5.610 -4.112
404 H LEU 56 H LEU 56 14.703 -2.223 -4.023
405 HA LEU 56 HA LEU 56 15.487 -0.976 -6.369
406 HB2 LEU 56 2HB LEU 56 15.552 0.291 -3.638
407 HB3 LEU 56 3HB LEU 56 15.326 1.100 -5.188
408 HG LEU 56 HG LEU 56 13.307 -0.939 -4.509
409 HD11 LEU 56 1HD1 LEU 56 14.035 1.043 -2.583
410 HD12 LEU 56 2HD1 LEU 56 12.759 -0.171 -2.505
411 HD13 LEU 56 3HD1 LEU 56 12.432 1.406 -3.224
412 HD21 LEU 56 3HD2 LEU 56 13.498 1.682 -5.890
413 HD22 LEU 56 1HD2 LEU 56 11.940 1.224 -5.202
414 HD23 LEU 56 2HD2 LEU 56 12.714 0.185 -6.399
415 H ARG 57 H ARG 57 17.338 -1.552 -3.412
416 HA ARG 57 HA ARG 57 19.619 -0.066 -4.103
417 HB2 ARG 57 2HB ARG 57 18.947 -2.166 -2.139
418 HB3 ARG 57 3HB ARG 57 20.650 -2.045 -2.559
419 HG2 ARG 57 2HG ARG 57 20.666 0.296 -1.919
420 HG3 ARG 57 3HG ARG 57 18.942 0.221 -1.553
421 HD2 ARG 57 2HD ARG 57 19.850 -0.059 0.539
422 HD3 ARG 57 3HD ARG 57 19.666 -1.735 0.023
423 HE ARG 57 HE ARG 57 22.232 -0.580 -0.593
424 HH11 ARG 57 1HH1 ARG 57 20.331 -2.286 1.772
425 HH12 ARG 57 2HH1 ARG 57 21.706 -2.967 2.578
426 HH21 ARG 57 1HH2 ARG 57 24.050 -1.469 0.459
427 HH22 ARG 57 2HH2 ARG 57 23.821 -2.500 1.831
428 H LYS 58 H LYS 58 18.813 -3.482 -4.622
429 HA LYS 58 HA LYS 58 21.244 -4.263 -5.778
430 HB2 LYS 58 2HB LYS 58 18.435 -5.317 -6.071
431 HB3 LYS 58 3HB LYS 58 19.809 -6.072 -6.868
432 HG2 LYS 58 2HG LYS 58 19.953 -5.589 -3.937
433 HG3 LYS 58 3HG LYS 58 18.953 -6.914 -4.536
434 HD2 LYS 58 2HD LYS 58 20.922 -8.035 -4.329
435 HD3 LYS 58 3HD LYS 58 21.151 -7.400 -5.959
436 HE2 LYS 58 2HE LYS 58 23.024 -6.442 -5.242
437 HE3 LYS 58 3HE LYS 58 22.032 -5.377 -4.248
438 HZ1 LYS 58 3HZ LYS 58 22.118 -7.173 -2.518
439 HZ2 LYS 58 1HZ LYS 58 23.586 -6.388 -2.817
440 HZ3 LYS 58 2HZ LYS 58 23.308 -7.930 -3.452
441 H GLU 59 H GLU 59 18.181 -3.440 -7.418
442 HA GLU 59 HA GLU 59 19.096 -3.523 -10.025
443 HB2 GLU 59 2HB GLU 59 17.008 -1.705 -8.812
444 HB3 GLU 59 3HB GLU 59 17.245 -1.930 -10.539
445 HG2 GLU 59 2HG GLU 59 16.915 -4.451 -9.969
446 HG3 GLU 59 3HG GLU 59 16.141 -3.818 -8.517
447 H ALA 60 H ALA 60 18.943 -0.682 -7.880
448 HA ALA 60 HA ALA 60 19.993 1.224 -9.570
449 HB1 ALA 60 1HB ALA 60 20.928 2.244 -7.397
450 HB2 ALA 60 2HB ALA 60 19.184 2.020 -7.540
451 HB3 ALA 60 3HB ALA 60 20.144 0.880 -6.598
452 H ALA 61 H ALA 61 21.818 -0.834 -7.299
453 HA ALA 61 HA ALA 61 24.372 0.047 -7.909
454 HB1 ALA 61 1HB ALA 61 25.127 -2.204 -7.134
455 HB2 ALA 61 2HB ALA 61 24.018 -1.387 -6.032
456 HB3 ALA 61 3HB ALA 61 23.432 -2.689 -7.068
457 H ALA 62 H ALA 62 22.467 -2.505 -9.472
458 HA ALA 62 HA ALA 62 24.417 -3.430 -11.245
459 HB1 ALA 62 1HB ALA 62 21.563 -3.323 -12.099
460 HB2 ALA 62 2HB ALA 62 22.743 -4.625 -12.265
461 HB3 ALA 62 3HB ALA 62 22.005 -4.297 -10.697
462 H ILE 63 H ILE 63 21.965 -0.893 -11.682
463 HA ILE 63 HA ILE 63 22.574 -0.243 -14.333
464 HB ILE 63 HB ILE 63 21.547 1.604 -12.175
465 HG12 ILE 63 2HG1 ILE 63 19.683 0.528 -14.176
466 HG13 ILE 63 3HG1 ILE 63 20.359 -0.689 -13.099
467 HG21 ILE 63 1HG2 ILE 63 20.656 2.940 -14.003
468 HG22 ILE 63 2HG2 ILE 63 22.407 2.792 -14.136
469 HG23 ILE 63 3HG2 ILE 63 21.359 1.827 -15.176
470 HD11 ILE 63 3HD1 ILE 63 19.591 1.508 -11.504
471 HD12 ILE 63 1HD1 ILE 63 18.263 1.161 -12.612
472 HD13 ILE 63 2HD1 ILE 63 18.889 -0.109 -11.560
473 H ARG 64 H ARG 64 23.856 1.062 -11.294
474 HA ARG 64 HA ARG 64 25.467 3.070 -12.382
475 HB2 ARG 64 2HB ARG 64 24.878 2.312 -9.872
476 HB3 ARG 64 3HB ARG 64 26.488 1.617 -10.005
477 HG2 ARG 64 2HG ARG 64 27.099 4.008 -10.899
478 HG3 ARG 64 3HG ARG 64 25.644 4.467 -10.012
479 HD2 ARG 64 2HD ARG 64 26.688 3.126 -8.067
480 HD3 ARG 64 3HD ARG 64 28.190 3.273 -8.978
481 HE ARG 64 HE ARG 64 27.306 5.819 -8.864
482 HH11 ARG 64 1HH1 ARG 64 27.783 3.362 -6.445
483 HH12 ARG 64 2HH1 ARG 64 28.146 4.491 -5.182
484 HH21 ARG 64 1HH2 ARG 64 27.782 7.316 -7.210
485 HH22 ARG 64 2HH2 ARG 64 28.144 6.740 -5.619
486 H ASP 65 H ASP 65 26.242 -0.310 -11.609
487 HA ASP 65 HA ASP 65 28.941 -0.254 -12.328
488 HB2 ASP 65 2HB ASP 65 26.897 -2.468 -12.292
489 HB3 ASP 65 3HB ASP 65 28.570 -2.758 -12.760
490 H GLU 66 H GLU 66 26.061 -0.943 -14.276
491 HA GLU 66 HA GLU 66 27.368 -1.651 -16.649
492 HB2 GLU 66 2HB GLU 66 24.710 -0.233 -16.414
493 HB3 GLU 66 3HB GLU 66 25.265 -1.213 -17.764
494 HG2 GLU 66 2HG GLU 66 25.366 -2.704 -15.302
495 HG3 GLU 66 3HG GLU 66 23.755 -2.043 -15.581
496 H CYS 67 H CYS 67 26.172 1.508 -15.544
497 HA CYS 67 HA CYS 67 26.861 2.994 -17.801
498 HB2 CYS 67 2HB CYS 67 26.702 3.795 -14.892
499 HB3 CYS 67 3HB CYS 67 26.934 4.947 -16.202
500 HG CYS 67 HG CYS 67 24.346 5.331 -15.896
501 H GLN 68 H GLN 68 28.764 2.207 -14.920
502 HA GLN 68 HA GLN 68 31.035 3.739 -15.653
503 HB2 GLN 68 2HB GLN 68 31.034 1.297 -13.881
504 HB3 GLN 68 3HB GLN 68 32.167 2.642 -13.856
505 HG2 GLN 68 2HG GLN 68 29.587 3.717 -13.467
506 HG3 GLN 68 3HG GLN 68 29.740 2.314 -12.410
507 HE21 GLN 68 1HE2 GLN 68 30.793 2.550 -10.558
508 HE22 GLN 68 2HE2 GLN 68 31.765 3.909 -10.121
509 H ALA 69 H ALA 69 29.960 0.503 -16.399
510 HA ALA 69 HA ALA 69 32.487 -0.357 -17.470
511 HB1 ALA 69 1HB ALA 69 29.726 -1.554 -17.617
512 HB2 ALA 69 2HB ALA 69 31.174 -2.315 -18.278
513 HB3 ALA 69 3HB ALA 69 31.044 -2.026 -16.543
514 H TYR 70 H TYR 70 30.093 1.694 -18.568
515 HA TYR 70 HA TYR 70 30.516 1.036 -21.391
516 HB2 TYR 70 2HB TYR 70 28.586 2.965 -20.084
517 HB3 TYR 70 3HB TYR 70 28.689 2.658 -21.814
518 HD1 TYR 70 HD2 TYR 70 29.176 -0.379 -21.505
519 HD2 TYR 70 HD1 TYR 70 26.305 2.278 -19.833
520 HE1 TYR 70 HE2 TYR 70 27.593 -2.247 -21.270
521 HE2 TYR 70 HE1 TYR 70 24.714 0.418 -19.592
522 HH TYR 70 HH TYR 70 24.960 -2.424 -21.151
523 H ARG 71 H ARG 71 30.989 3.618 -19.042
524 HA ARG 71 HA ARG 71 32.866 4.883 -20.910
525 HB2 ARG 71 2HB ARG 71 30.492 6.004 -20.654
526 HB3 ARG 71 3HB ARG 71 31.182 6.623 -19.160
527 HG2 ARG 71 2HG ARG 71 32.903 7.769 -20.333
528 HG3 ARG 71 3HG ARG 71 32.477 6.973 -21.850
529 HD2 ARG 71 2HD ARG 71 30.623 8.279 -22.174
530 HD3 ARG 71 3HD ARG 71 30.387 8.560 -20.449
531 HE ARG 71 HE ARG 71 31.719 10.413 -20.607
532 HH11 ARG 71 1HH1 ARG 71 32.184 8.434 -23.433
533 HH12 ARG 71 2HH1 ARG 71 33.158 9.607 -24.255
534 HH21 ARG 71 1HH2 ARG 71 33.001 11.966 -21.678
535 HH22 ARG 71 2HH2 ARG 71 33.623 11.616 -23.255
536 H HIS 72 H HIS 72 33.644 3.171 -18.925
537 HA HIS 72 HA HIS 72 35.530 4.665 -17.506
538 HB2 HIS 72 2HB HIS 72 33.054 4.889 -16.301
539 HB3 HIS 72 3HB HIS 72 33.822 3.593 -15.389
540 HD1 HIS 72 HD1 HIS 72 33.414 7.073 -15.231
541 HD2 HIS 72 HD2 HIS 72 36.669 4.548 -14.689
542 HE1 HIS 72 HE1 HIS 72 35.074 8.396 -13.881
543 H ASN 73 H ASN 73 35.302 2.256 -19.054
544 HA ASN 73 HA ASN 73 36.610 0.428 -17.187
545 HB2 ASN 73 2HB ASN 73 34.468 -0.541 -17.153
546 HB3 ASN 73 3HB ASN 73 34.200 -0.225 -18.865
547 HD21 ASN 73 1HD2 ASN 73 35.711 -2.295 -16.530
548 HD22 ASN 73 2HD2 ASN 73 36.110 -3.575 -17.619
Start of MODEL 11
1 H1 MET 1 H MET 1 1.746 0.407 -3.841
2 HA MET 1 HA MET 1 1.282 2.105 -2.180
3 HB2 MET 1 2HB MET 1 2.193 1.061 -0.137
4 HB3 MET 1 3HB MET 1 1.503 -0.122 -1.239
5 HG2 MET 1 2HG MET 1 4.331 0.292 -1.710
6 HG3 MET 1 3HG MET 1 3.993 -0.223 -0.060
7 HE1 MET 1 3HE MET 1 4.694 -2.695 0.202
8 HE2 MET 1 1HE MET 1 3.009 -2.417 0.643
9 HE3 MET 1 2HE MET 1 3.453 -3.853 -0.280
10 H GLY 2 H GLY 2 1.992 3.849 -0.981
11 HA2 GLY 2 2HA GLY 2 3.328 5.645 -0.472
12 HA3 GLY 2 3HA GLY 2 4.636 4.478 -0.349
13 H SER 3 H SER 3 6.256 5.577 -1.328
14 HA SER 3 HA SER 3 5.768 6.622 -4.032
15 HB2 SER 3 2HB SER 3 7.892 7.243 -1.978
16 HB3 SER 3 3HB SER 3 8.009 7.778 -3.654
17 HG SER 3 HG SER 3 6.305 9.093 -3.372
18 H TRP 4 H TRP 4 6.199 3.784 -3.316
19 HA TRP 4 HA TRP 4 8.842 3.111 -4.229
20 HB2 TRP 4 2HB TRP 4 7.861 1.607 -2.663
21 HB3 TRP 4 3HB TRP 4 6.387 1.466 -3.618
22 HD1 TRP 4 HD1 TRP 4 6.570 -0.003 -5.914
23 HE1 TRP 4 HE1 TRP 4 8.116 -1.975 -6.506
24 HE3 TRP 4 HE3 TRP 4 10.139 0.654 -2.313
25 HZ2 TRP 4 HZ2 TRP 4 10.528 -3.103 -5.569
26 HZ3 TRP 4 HZ3 TRP 4 12.032 -0.916 -2.229
27 HH2 TRP 4 HH2 TRP 4 12.221 -2.755 -3.824
28 H ALA 5 H ALA 5 5.564 2.941 -5.574
29 HA ALA 5 HA ALA 5 6.071 1.684 -7.972
30 HB1 ALA 5 1HB ALA 5 4.234 3.931 -8.263
31 HB2 ALA 5 2HB ALA 5 3.949 2.199 -8.447
32 HB3 ALA 5 3HB ALA 5 3.907 2.935 -6.844
33 H GLU 6 H GLU 6 6.236 5.182 -7.310
34 HA GLU 6 HA GLU 6 6.999 6.016 -9.853
35 HB2 GLU 6 2HB GLU 6 7.244 7.129 -7.108
36 HB3 GLU 6 3HB GLU 6 8.248 7.852 -8.357
37 HG2 GLU 6 2HG GLU 6 6.535 9.061 -9.040
38 HG3 GLU 6 3HG GLU 6 5.635 7.591 -9.407
39 H PHE 7 H PHE 7 9.060 5.203 -7.066
40 HA PHE 7 HA PHE 7 11.528 5.641 -8.281
41 HB2 PHE 7 2HB PHE 7 10.547 4.235 -5.904
42 HB3 PHE 7 3HB PHE 7 12.024 3.545 -6.567
43 HD1 PHE 7 HD1 PHE 7 10.592 6.898 -5.769
44 HD2 PHE 7 HD2 PHE 7 14.014 4.367 -5.785
45 HE1 PHE 7 HE1 PHE 7 11.903 8.669 -4.675
46 HE2 PHE 7 HE2 PHE 7 15.330 6.134 -4.691
47 HZ PHE 7 HZ PHE 7 14.275 8.289 -4.134
48 H LYS 8 H LYS 8 9.494 2.751 -8.229
49 HA LYS 8 HA LYS 8 11.294 0.999 -9.485
50 HB2 LYS 8 2HB LYS 8 8.396 1.058 -8.932
51 HB3 LYS 8 3HB LYS 8 8.874 0.058 -10.298
52 HG2 LYS 8 2HG LYS 8 10.014 -0.167 -7.520
53 HG3 LYS 8 3HG LYS 8 8.736 -1.191 -8.181
54 HD2 LYS 8 2HD LYS 8 11.071 -1.039 -9.914
55 HD3 LYS 8 3HD LYS 8 11.448 -1.683 -8.314
56 HE2 LYS 8 2HE LYS 8 9.952 -3.465 -8.555
57 HE3 LYS 8 3HE LYS 8 9.101 -2.688 -9.889
58 HZ1 LYS 8 3HZ LYS 8 11.561 -4.240 -9.911
59 HZ2 LYS 8 1HZ LYS 8 11.519 -2.898 -10.941
60 HZ3 LYS 8 2HZ LYS 8 10.350 -4.112 -11.086
61 H GLN 9 H GLN 9 8.793 3.128 -10.824
62 HA GLN 9 HA GLN 9 9.033 2.356 -13.503
63 HB2 GLN 9 2HB GLN 9 7.579 4.264 -12.052
64 HB3 GLN 9 3HB GLN 9 8.480 5.182 -13.251
65 HG2 GLN 9 2HG GLN 9 7.587 3.538 -14.964
66 HG3 GLN 9 3HG GLN 9 6.483 2.991 -13.703
67 HE21 GLN 9 1HE2 GLN 9 6.236 4.522 -16.336
68 HE22 GLN 9 2HE2 GLN 9 5.221 5.860 -15.931
69 H ARG 10 H ARG 10 10.501 5.165 -11.863
70 HA ARG 10 HA ARG 10 12.038 6.093 -13.969
71 HB2 ARG 10 2HB ARG 10 12.327 6.233 -10.992
72 HB3 ARG 10 3HB ARG 10 13.623 6.839 -12.015
73 HG2 ARG 10 2HG ARG 10 12.315 8.711 -11.552
74 HG3 ARG 10 3HG ARG 10 11.826 8.226 -13.177
75 HD2 ARG 10 2HD ARG 10 9.900 7.027 -12.199
76 HD3 ARG 10 3HD ARG 10 10.374 7.614 -10.605
77 HE ARG 10 HE ARG 10 8.995 9.078 -12.643
78 HH11 ARG 10 1HH1 ARG 10 11.142 9.353 -9.917
79 HH12 ARG 10 2HH1 ARG 10 10.695 10.989 -9.563
80 HH21 ARG 10 1HH2 ARG 10 8.397 11.232 -12.188
81 HH22 ARG 10 2HH2 ARG 10 9.132 12.056 -10.855
82 H LEU 11 H LEU 11 12.877 3.674 -11.513
83 HA LEU 11 HA LEU 11 15.522 3.231 -12.322
84 HB2 LEU 11 2HB LEU 11 13.806 2.227 -10.386
85 HB3 LEU 11 3HB LEU 11 14.204 0.827 -11.379
86 HG LEU 11 HG LEU 11 16.573 1.170 -10.951
87 HD11 LEU 11 1HD1 LEU 11 15.595 3.718 -9.852
88 HD12 LEU 11 2HD1 LEU 11 17.133 3.323 -10.618
89 HD13 LEU 11 3HD1 LEU 11 16.864 2.920 -8.922
90 HD21 LEU 11 3HD2 LEU 11 16.336 1.054 -8.307
91 HD22 LEU 11 1HD2 LEU 11 15.837 -0.274 -9.356
92 HD23 LEU 11 2HD2 LEU 11 14.635 0.854 -8.729
93 H ALA 12 H ALA 12 12.490 1.746 -13.369
94 HA ALA 12 HA ALA 12 13.574 -0.264 -14.995
95 HB1 ALA 12 1HB ALA 12 10.951 1.057 -14.718
96 HB2 ALA 12 2HB ALA 12 11.260 0.252 -16.258
97 HB3 ALA 12 3HB ALA 12 11.365 -0.658 -14.751
98 H ALA 13 H ALA 13 12.568 3.051 -15.791
99 HA ALA 13 HA ALA 13 13.174 2.914 -18.540
100 HB1 ALA 13 1HB ALA 13 13.531 5.564 -17.431
101 HB2 ALA 13 2HB ALA 13 12.321 4.969 -18.568
102 HB3 ALA 13 3HB ALA 13 12.062 4.793 -16.833
103 H ILE 14 H ILE 14 15.083 3.943 -15.741
104 HA ILE 14 HA ILE 14 17.324 4.879 -17.160
105 HB ILE 14 HB ILE 14 17.193 3.703 -14.381
106 HG12 ILE 14 2HG1 ILE 14 17.467 6.620 -14.941
107 HG13 ILE 14 3HG1 ILE 14 15.883 5.884 -15.163
108 HG21 ILE 14 1HG2 ILE 14 19.278 5.580 -14.608
109 HG22 ILE 14 2HG2 ILE 14 19.406 3.843 -14.335
110 HG23 ILE 14 3HG2 ILE 14 19.433 4.481 -15.979
111 HD11 ILE 14 3HD1 ILE 14 15.548 6.201 -13.000
112 HD12 ILE 14 1HD1 ILE 14 16.752 4.949 -12.699
113 HD13 ILE 14 2HD1 ILE 14 17.235 6.645 -12.740
114 H LYS 15 H LYS 15 16.514 1.681 -15.882
115 HA LYS 15 HA LYS 15 18.982 0.452 -16.510
116 HB2 LYS 15 2HB LYS 15 16.692 -0.298 -15.172
117 HB3 LYS 15 3HB LYS 15 16.643 -1.307 -16.611
118 HG2 LYS 15 2HG LYS 15 19.247 -1.560 -15.811
119 HG3 LYS 15 3HG LYS 15 18.382 -1.450 -14.276
120 HD2 LYS 15 2HD LYS 15 16.851 -3.239 -15.082
121 HD3 LYS 15 3HD LYS 15 17.865 -3.402 -16.518
122 HE2 LYS 15 2HE LYS 15 18.453 -5.089 -14.878
123 HE3 LYS 15 3HE LYS 15 19.782 -3.948 -15.082
124 HZ1 LYS 15 3HZ LYS 15 19.597 -3.233 -12.981
125 HZ2 LYS 15 1HZ LYS 15 18.779 -4.690 -12.714
126 HZ3 LYS 15 2HZ LYS 15 17.906 -3.268 -12.989
127 H THR 16 H THR 16 15.905 0.669 -18.256
128 HA THR 16 HA THR 16 16.528 -0.976 -20.415
129 HB THR 16 HB THR 16 14.862 1.528 -20.650
130 HG1 THR 16 HG1 THR 16 14.212 -0.995 -19.502
131 HG21 THR 16 3HG2 THR 16 13.694 -0.675 -21.942
132 HG22 THR 16 1HG2 THR 16 15.408 -0.725 -22.350
133 HG23 THR 16 2HG2 THR 16 14.463 0.725 -22.690
134 H ARG 17 H ARG 17 16.757 2.585 -20.272
135 HA ARG 17 HA ARG 17 18.050 2.879 -22.749
136 HB2 ARG 17 2HB ARG 17 17.757 4.612 -20.322
137 HB3 ARG 17 3HB ARG 17 18.838 5.105 -21.619
138 HG2 ARG 17 2HG ARG 17 17.150 5.765 -22.907
139 HG3 ARG 17 3HG ARG 17 16.235 4.287 -22.605
140 HD2 ARG 17 2HD ARG 17 15.777 5.345 -20.283
141 HD3 ARG 17 3HD ARG 17 16.253 6.853 -21.063
142 HE ARG 17 HE ARG 17 14.351 5.615 -22.684
143 HH11 ARG 17 1HH1 ARG 17 14.572 7.064 -19.526
144 HH12 ARG 17 2HH1 ARG 17 12.916 7.572 -19.500
145 HH21 ARG 17 1HH2 ARG 17 12.169 6.279 -22.661
146 HH22 ARG 17 2HH2 ARG 17 11.550 7.124 -21.283
147 H CYS 18 H CYS 18 19.274 2.302 -19.512
148 HA CYS 18 HA CYS 18 22.002 2.827 -20.086
149 HB2 CYS 18 2HB CYS 18 21.377 2.866 -17.802
150 HB3 CYS 18 3HB CYS 18 20.612 1.285 -17.903
151 HG CYS 18 HG CYS 18 22.989 -0.136 -18.105
152 H GLN 19 H GLN 19 19.957 0.006 -20.397
153 HA GLN 19 HA GLN 19 22.100 -1.839 -20.838
154 HB2 GLN 19 2HB GLN 19 19.137 -2.031 -21.393
155 HB3 GLN 19 3HB GLN 19 20.267 -3.360 -21.614
156 HG2 GLN 19 2HG GLN 19 20.421 -2.133 -18.975
157 HG3 GLN 19 3HG GLN 19 18.844 -2.830 -19.342
158 HE21 GLN 19 1HE2 GLN 19 22.094 -3.444 -18.520
159 HE22 GLN 19 2HE2 GLN 19 22.009 -5.169 -18.505
160 H ALA 20 H ALA 20 19.863 -0.051 -22.918
161 HA ALA 20 HA ALA 20 20.899 -1.179 -25.342
162 HB1 ALA 20 1HB ALA 20 18.675 -0.505 -25.503
163 HB2 ALA 20 2HB ALA 20 18.989 1.047 -24.724
164 HB3 ALA 20 3HB ALA 20 19.555 0.755 -26.368
165 H LEU 21 H LEU 21 21.575 1.633 -23.389
166 HA LEU 21 HA LEU 21 23.099 3.316 -23.560
167 HB2 LEU 21 2HB LEU 21 24.502 1.072 -24.985
168 HB3 LEU 21 3HB LEU 21 25.272 2.629 -24.687
169 HG LEU 21 HG LEU 21 24.288 0.698 -22.587
170 HD11 LEU 21 1HD1 LEU 21 26.568 0.528 -24.072
171 HD12 LEU 21 2HD1 LEU 21 26.363 -0.126 -22.448
172 HD13 LEU 21 3HD1 LEU 21 27.111 1.455 -22.674
173 HD21 LEU 21 3HD2 LEU 21 24.760 3.506 -22.462
174 HD22 LEU 21 1HD2 LEU 21 26.011 2.676 -21.537
175 HD23 LEU 21 2HD2 LEU 21 24.310 2.399 -21.164
176 H GLY 22 H GLY 22 21.043 3.030 -25.694
177 HA2 GLY 22 2HA GLY 22 22.454 4.548 -27.803
178 HA3 GLY 22 3HA GLY 22 21.130 3.444 -28.146
179 H GLY 23 H GLY 23 19.924 4.543 -25.503
180 HA2 GLY 23 2HA GLY 23 18.009 6.203 -26.602
181 HA3 GLY 23 3HA GLY 23 18.431 6.181 -24.896
182 H SER 24 H SER 24 21.065 7.125 -25.067
183 HA SER 24 HA SER 24 21.421 9.435 -26.589
184 HB2 SER 24 2HB SER 24 19.757 9.775 -24.169
185 HB3 SER 24 3HB SER 24 21.060 10.947 -24.364
186 HG SER 24 HG SER 24 20.226 11.431 -26.426
187 H GLU 25 H GLU 25 23.549 9.649 -26.576
188 HA GLU 25 HA GLU 25 25.296 8.355 -24.868
189 HB2 GLU 25 2HB GLU 25 27.002 10.043 -25.698
190 HB3 GLU 25 3HB GLU 25 26.150 9.127 -26.933
191 HG2 GLU 25 2HG GLU 25 25.386 10.977 -27.871
192 HG3 GLU 25 3HG GLU 25 24.728 11.547 -26.338
193 H ALA 26 H ALA 26 23.689 11.415 -24.480
194 HA ALA 26 HA ALA 26 25.349 12.223 -22.246
195 HB1 ALA 26 1HB ALA 26 24.364 14.268 -22.400
196 HB2 ALA 26 2HB ALA 26 24.063 13.695 -24.041
197 HB3 ALA 26 3HB ALA 26 22.788 13.601 -22.826
198 H GLU 27 H GLU 27 22.207 10.771 -22.804
199 HA GLU 27 HA GLU 27 20.967 11.110 -20.373
200 HB2 GLU 27 2HB GLU 27 20.806 9.185 -22.565
201 HB3 GLU 27 3HB GLU 27 20.355 8.491 -21.014
202 HG2 GLU 27 2HG GLU 27 18.760 10.369 -20.704
203 HG3 GLU 27 3HG GLU 27 19.142 10.902 -22.340
204 H CYS 28 H CYS 28 23.624 8.991 -21.193
205 HA CYS 28 HA CYS 28 23.618 7.200 -19.104
206 HB2 CYS 28 2HB CYS 28 26.067 8.547 -20.260
207 HB3 CYS 28 3HB CYS 28 26.025 7.003 -19.418
208 HG CYS 28 HG CYS 28 23.989 6.317 -21.639
209 H ALA 29 H ALA 29 24.931 10.493 -19.142
210 HA ALA 29 HA ALA 29 26.053 10.501 -16.583
211 HB1 ALA 29 1HB ALA 29 26.705 12.474 -17.361
212 HB2 ALA 29 2HB ALA 29 25.483 12.425 -18.632
213 HB3 ALA 29 3HB ALA 29 25.083 13.091 -17.049
214 H ALA 30 H ALA 30 22.821 11.572 -17.632
215 HA ALA 30 HA ALA 30 21.837 12.369 -15.160
216 HB1 ALA 30 1HB ALA 30 19.911 12.693 -16.257
217 HB2 ALA 30 2HB ALA 30 20.831 12.243 -17.693
218 HB3 ALA 30 3HB ALA 30 19.860 11.034 -16.853
219 H PHE 31 H PHE 31 22.000 9.156 -16.598
220 HA PHE 31 HA PHE 31 20.406 7.829 -14.685
221 HB2 PHE 31 2HB PHE 31 22.620 6.786 -16.461
222 HB3 PHE 31 3HB PHE 31 21.540 5.765 -15.518
223 HD1 PHE 31 HD1 PHE 31 19.010 7.366 -15.950
224 HD2 PHE 31 HD2 PHE 31 22.053 6.067 -18.628
225 HE1 PHE 31 HE1 PHE 31 17.385 7.380 -17.798
226 HE2 PHE 31 HE2 PHE 31 20.433 6.079 -20.480
227 HZ PHE 31 HZ PHE 31 18.096 6.737 -20.067
228 H GLU 32 H GLU 32 23.930 8.220 -14.951
229 HA GLU 32 HA GLU 32 24.676 6.756 -12.711
230 HB2 GLU 32 2HB GLU 32 25.898 8.757 -14.440
231 HB3 GLU 32 3HB GLU 32 26.479 8.864 -12.784
232 HG2 GLU 32 2HG GLU 32 26.775 6.286 -13.020
233 HG3 GLU 32 3HG GLU 32 26.751 6.639 -14.746
234 H LYS 33 H LYS 33 23.977 10.237 -12.948
235 HA LYS 33 HA LYS 33 24.330 10.764 -10.189
236 HB2 LYS 33 2HB LYS 33 23.583 12.232 -12.553
237 HB3 LYS 33 3HB LYS 33 22.517 12.657 -11.221
238 HG2 LYS 33 2HG LYS 33 24.088 14.077 -10.566
239 HG3 LYS 33 3HG LYS 33 25.042 12.672 -10.088
240 HD2 LYS 33 2HD LYS 33 26.440 12.855 -11.857
241 HD3 LYS 33 3HD LYS 33 25.160 13.398 -12.945
242 HE2 LYS 33 2HE LYS 33 25.597 15.564 -12.560
243 HE3 LYS 33 3HE LYS 33 25.804 15.309 -10.827
244 HZ1 LYS 33 3HZ LYS 33 28.008 14.159 -11.728
245 HZ2 LYS 33 1HZ LYS 33 27.928 15.805 -11.345
246 HZ3 LYS 33 2HZ LYS 33 27.790 15.304 -12.954
247 H GLU 34 H GLU 34 21.357 10.462 -12.139
248 HA GLU 34 HA GLU 34 19.490 10.710 -10.131
249 HB2 GLU 34 2HB GLU 34 19.483 9.092 -12.667
250 HB3 GLU 34 3HB GLU 34 18.094 9.109 -11.590
251 HG2 GLU 34 2HG GLU 34 19.289 11.649 -12.628
252 HG3 GLU 34 3HG GLU 34 18.116 10.728 -13.568
253 H ILE 35 H ILE 35 21.088 7.732 -11.235
254 HA ILE 35 HA ILE 35 19.801 5.982 -9.455
255 HB ILE 35 HB ILE 35 22.480 5.796 -10.824
256 HG12 ILE 35 2HG1 ILE 35 20.383 5.740 -12.202
257 HG13 ILE 35 3HG1 ILE 35 21.366 4.285 -12.325
258 HG21 ILE 35 1HG2 ILE 35 21.080 3.774 -9.087
259 HG22 ILE 35 2HG2 ILE 35 22.368 3.362 -10.219
260 HG23 ILE 35 3HG2 ILE 35 22.694 4.453 -8.873
261 HD11 ILE 35 3HD1 ILE 35 18.968 3.804 -12.174
262 HD12 ILE 35 1HD1 ILE 35 19.877 3.115 -10.829
263 HD13 ILE 35 2HD1 ILE 35 18.925 4.581 -10.592
264 H ALA 36 H ALA 36 22.828 7.800 -9.169
265 HA ALA 36 HA ALA 36 23.768 6.748 -6.778
266 HB1 ALA 36 1HB ALA 36 24.824 8.471 -8.406
267 HB2 ALA 36 2HB ALA 36 24.048 9.666 -7.365
268 HB3 ALA 36 3HB ALA 36 25.226 8.540 -6.689
269 H ALA 37 H ALA 37 21.593 9.518 -7.280
270 HA ALA 37 HA ALA 37 21.235 10.038 -4.505
271 HB1 ALA 37 1HB ALA 37 20.056 11.022 -7.033
272 HB2 ALA 37 2HB ALA 37 19.091 11.222 -5.570
273 HB3 ALA 37 3HB ALA 37 20.710 11.915 -5.660
274 H PHE 38 H PHE 38 19.598 8.020 -6.850
275 HA PHE 38 HA PHE 38 17.225 7.545 -5.421
276 HB2 PHE 38 2HB PHE 38 18.539 6.486 -7.773
277 HB3 PHE 38 3HB PHE 38 17.789 5.196 -6.838
278 HD1 PHE 38 HD2 PHE 38 16.748 8.720 -7.454
279 HD2 PHE 38 HD1 PHE 38 15.851 4.585 -7.919
280 HE1 PHE 38 HE2 PHE 38 14.559 9.306 -8.411
281 HE2 PHE 38 HE1 PHE 38 13.661 5.165 -8.878
282 HZ PHE 38 HZ PHE 38 13.012 7.528 -9.124
283 H GLU 39 H GLU 39 20.152 5.520 -5.666
284 HA GLU 39 HA GLU 39 19.331 3.672 -3.691
285 HB2 GLU 39 2HB GLU 39 21.567 2.798 -3.798
286 HB3 GLU 39 3HB GLU 39 21.064 3.229 -5.426
287 HG2 GLU 39 2HG GLU 39 23.191 4.060 -5.386
288 HG3 GLU 39 3HG GLU 39 22.267 5.479 -4.900
289 H SER 40 H SER 40 21.182 6.655 -3.568
290 HA SER 40 HA SER 40 22.082 6.367 -0.890
291 HB2 SER 40 2HB SER 40 23.293 7.902 -2.218
292 HB3 SER 40 3HB SER 40 21.828 8.727 -2.748
293 HG SER 40 HG SER 40 23.367 9.375 -0.732
294 H GLU 41 H GLU 41 19.171 7.630 -2.356
295 HA GLU 41 HA GLU 41 18.217 8.810 0.104
296 HB2 GLU 41 2HB GLU 41 17.093 8.505 -2.663
297 HB3 GLU 41 3HB GLU 41 16.060 9.003 -1.331
298 HG2 GLU 41 2HG GLU 41 18.551 10.510 -1.502
299 HG3 GLU 41 3HG GLU 41 17.523 10.669 -2.925
300 H LEU 42 H LEU 42 17.862 5.822 -1.648
301 HA LEU 42 HA LEU 42 15.579 4.923 -0.142
302 HB2 LEU 42 2HB LEU 42 17.447 3.545 -2.058
303 HB3 LEU 42 3HB LEU 42 16.108 2.725 -1.258
304 HG LEU 42 HG LEU 42 15.545 5.178 -2.859
305 HD11 LEU 42 1HD1 LEU 42 15.166 2.984 -4.560
306 HD12 LEU 42 2HD1 LEU 42 16.803 2.829 -3.922
307 HD13 LEU 42 3HD1 LEU 42 16.315 4.309 -4.747
308 HD21 LEU 42 3HD2 LEU 42 13.432 4.086 -3.218
309 HD22 LEU 42 1HD2 LEU 42 13.808 4.051 -1.495
310 HD23 LEU 42 2HD2 LEU 42 14.027 2.601 -2.474
311 H GLN 43 H GLN 43 19.047 4.661 0.079
312 HA GLN 43 HA GLN 43 19.088 2.497 1.938
313 HB2 GLN 43 2HB GLN 43 21.417 2.882 2.113
314 HB3 GLN 43 3HB GLN 43 20.999 3.239 0.442
315 HG2 GLN 43 2HG GLN 43 22.060 5.164 0.701
316 HG3 GLN 43 3HG GLN 43 20.721 5.669 1.731
317 HE21 GLN 43 1HE2 GLN 43 23.951 4.345 1.673
318 HE22 GLN 43 2HE2 GLN 43 24.343 4.712 3.315
319 H ALA 44 H ALA 44 18.526 5.877 2.188
320 HA ALA 44 HA ALA 44 19.280 6.180 4.929
321 HB1 ALA 44 1HB ALA 44 17.281 7.973 3.633
322 HB2 ALA 44 2HB ALA 44 18.600 8.366 4.737
323 HB3 ALA 44 3HB ALA 44 18.947 7.975 3.053
324 H TYR 45 H TYR 45 16.473 5.024 3.278
325 HA TYR 45 HA TYR 45 14.525 5.482 5.254
326 HB2 TYR 45 2HB TYR 45 14.764 3.441 3.050
327 HB3 TYR 45 3HB TYR 45 13.381 3.471 4.139
328 HD1 TYR 45 HD2 TYR 45 12.806 6.289 4.463
329 HD2 TYR 45 HD1 TYR 45 14.049 4.186 0.979
330 HE1 TYR 45 HE2 TYR 45 11.732 7.996 3.057
331 HE2 TYR 45 HE1 TYR 45 12.979 5.889 -0.437
332 HH TYR 45 HH TYR 45 11.659 7.690 -0.473
333 H LYS 46 H LYS 46 16.099 2.375 4.476
334 HA LYS 46 HA LYS 46 16.480 0.520 5.747
335 HB2 LYS 46 2HB LYS 46 18.150 2.216 6.631
336 HB3 LYS 46 3HB LYS 46 17.042 2.483 7.970
337 HG2 LYS 46 2HG LYS 46 17.290 -0.235 7.974
338 HG3 LYS 46 3HG LYS 46 18.901 0.287 7.476
339 HD2 LYS 46 2HD LYS 46 19.178 1.597 9.433
340 HD3 LYS 46 3HD LYS 46 17.472 1.446 9.859
341 HE2 LYS 46 2HE LYS 46 19.150 -1.011 9.612
342 HE3 LYS 46 3HE LYS 46 19.282 -0.015 11.061
343 HZ1 LYS 46 3HZ LYS 46 16.637 -0.235 10.835
344 HZ2 LYS 46 1HZ LYS 46 17.588 -1.297 11.746
345 HZ3 LYS 46 2HZ LYS 46 17.111 -1.721 10.180
346 H GLY 47 H GLY 47 13.973 0.446 5.573
347 HA2 GLY 47 2HA GLY 47 12.467 0.960 7.943
348 HA3 GLY 47 3HA GLY 47 11.932 0.024 6.555
349 H LYS 48 H LYS 48 12.351 -0.192 9.742
350 HA LYS 48 HA LYS 48 13.824 -2.451 10.305
351 HB2 LYS 48 2HB LYS 48 11.921 -0.854 11.649
352 HB3 LYS 48 3HB LYS 48 11.387 -2.520 11.828
353 HG2 LYS 48 2HG LYS 48 14.016 -2.781 12.388
354 HG3 LYS 48 3HG LYS 48 13.714 -1.144 12.975
355 HD2 LYS 48 2HD LYS 48 12.000 -1.902 14.443
356 HD3 LYS 48 3HD LYS 48 11.998 -3.508 13.712
357 HE2 LYS 48 2HE LYS 48 14.594 -3.274 14.476
358 HE3 LYS 48 3HE LYS 48 13.783 -2.349 15.738
359 HZ1 LYS 48 3HZ LYS 48 12.786 -5.018 14.992
360 HZ2 LYS 48 1HZ LYS 48 12.614 -4.185 16.455
361 HZ3 LYS 48 2HZ LYS 48 14.104 -4.870 16.042
362 H GLY 49 H GLY 49 10.650 -2.207 8.844
363 HA2 GLY 49 2HA GLY 49 10.677 -5.140 8.494
364 HA3 GLY 49 3HA GLY 49 9.199 -4.267 8.872
365 H ASN 50 H ASN 50 11.339 -2.603 6.807
366 HA ASN 50 HA ASN 50 9.662 -3.325 4.495
367 HB2 ASN 50 2HB ASN 50 11.209 -0.752 4.775
368 HB3 ASN 50 3HB ASN 50 9.888 -1.114 3.669
369 HD21 ASN 50 1HD2 ASN 50 7.825 -0.821 4.316
370 HD22 ASN 50 2HD2 ASN 50 7.374 -0.200 5.864
371 HA PRO 51 HA PRO 51 13.958 -4.788 3.550
372 HB2 PRO 51 2HB PRO 51 13.160 -7.135 2.445
373 HB3 PRO 51 3HB PRO 51 13.431 -6.933 4.180
374 HG2 PRO 51 2HG PRO 51 10.860 -6.891 2.647
375 HG3 PRO 51 3HG PRO 51 11.225 -7.670 4.198
376 HD2 PRO 51 2HD PRO 51 9.921 -5.303 4.028
377 HD3 PRO 51 3HD PRO 51 10.997 -5.706 5.382
378 H GLU 52 H GLU 52 11.074 -4.165 1.799
379 HA GLU 52 HA GLU 52 11.677 -4.816 -0.802
380 HB2 GLU 52 2HB GLU 52 10.257 -2.883 -1.459
381 HB3 GLU 52 3HB GLU 52 9.526 -3.898 -0.223
382 HG2 GLU 52 2HG GLU 52 10.799 -2.062 1.306
383 HG3 GLU 52 3HG GLU 52 10.379 -1.097 -0.107
384 H VAL 53 H VAL 53 12.844 -2.092 1.095
385 HA VAL 53 HA VAL 53 13.984 -0.511 -0.855
386 HB VAL 53 HB VAL 53 15.193 -1.101 1.850
387 HG11 VAL 53 1HG1 VAL 53 16.261 1.041 1.663
388 HG12 VAL 53 2HG1 VAL 53 16.658 0.090 0.230
389 HG13 VAL 53 3HG1 VAL 53 15.442 1.365 0.135
390 HG21 VAL 53 3HG2 VAL 53 12.751 0.260 1.084
391 HG22 VAL 53 1HG2 VAL 53 13.325 -0.215 2.683
392 HG23 VAL 53 2HG2 VAL 53 13.844 1.316 1.978
393 H GLU 54 H GLU 54 15.063 -3.586 0.379
394 HA GLU 54 HA GLU 54 17.735 -3.516 -0.474
395 HB2 GLU 54 2HB GLU 54 17.804 -5.800 -0.033
396 HB3 GLU 54 3HB GLU 54 16.506 -5.243 1.014
397 HG2 GLU 54 2HG GLU 54 14.945 -5.890 -0.918
398 HG3 GLU 54 3HG GLU 54 16.325 -6.795 -1.537
399 H ALA 55 H ALA 55 14.758 -4.298 -2.167
400 HA ALA 55 HA ALA 55 15.960 -5.365 -4.501
401 HB1 ALA 55 1HB ALA 55 13.541 -4.329 -5.324
402 HB2 ALA 55 2HB ALA 55 13.818 -5.953 -4.693
403 HB3 ALA 55 3HB ALA 55 13.284 -4.665 -3.612
404 H LEU 56 H LEU 56 14.502 -2.167 -3.881
405 HA LEU 56 HA LEU 56 15.161 -0.995 -6.318
406 HB2 LEU 56 2HB LEU 56 14.151 -0.152 -3.776
407 HB3 LEU 56 3HB LEU 56 15.353 1.006 -4.340
408 HG LEU 56 HG LEU 56 14.095 1.460 -6.318
409 HD11 LEU 56 1HD1 LEU 56 11.684 0.109 -6.067
410 HD12 LEU 56 2HD1 LEU 56 12.913 -1.114 -5.743
411 HD13 LEU 56 3HD1 LEU 56 12.954 -0.202 -7.252
412 HD21 LEU 56 3HD2 LEU 56 12.707 1.543 -3.701
413 HD22 LEU 56 1HD2 LEU 56 11.750 1.902 -5.138
414 HD23 LEU 56 2HD2 LEU 56 13.188 2.858 -4.775
415 H ARG 57 H ARG 57 17.016 -1.180 -3.310
416 HA ARG 57 HA ARG 57 19.156 0.461 -4.121
417 HB2 ARG 57 2HB ARG 57 18.610 -0.334 -1.768
418 HB3 ARG 57 3HB ARG 57 19.369 -1.858 -2.206
419 HG2 ARG 57 2HG ARG 57 21.152 -0.833 -1.258
420 HG3 ARG 57 3HG ARG 57 21.346 -0.240 -2.909
421 HD2 ARG 57 2HD ARG 57 20.041 1.784 -2.255
422 HD3 ARG 57 3HD ARG 57 20.068 1.201 -0.591
423 HE ARG 57 HE ARG 57 22.175 2.526 -1.967
424 HH11 ARG 57 1HH1 ARG 57 21.522 0.080 0.423
425 HH12 ARG 57 2HH1 ARG 57 23.036 0.288 1.239
426 HH21 ARG 57 1HH2 ARG 57 24.171 2.809 -0.901
427 HH22 ARG 57 2HH2 ARG 57 24.542 1.841 0.485
428 H LYS 58 H LYS 58 18.652 -3.039 -4.328
429 HA LYS 58 HA LYS 58 21.170 -3.740 -5.327
430 HB2 LYS 58 2HB LYS 58 18.474 -4.978 -5.301
431 HB3 LYS 58 3HB LYS 58 19.617 -5.608 -6.480
432 HG2 LYS 58 2HG LYS 58 21.236 -5.816 -4.500
433 HG3 LYS 58 3HG LYS 58 19.800 -5.621 -3.491
434 HD2 LYS 58 2HD LYS 58 19.353 -7.783 -3.748
435 HD3 LYS 58 3HD LYS 58 19.169 -7.524 -5.484
436 HE2 LYS 58 2HE LYS 58 20.864 -8.999 -5.626
437 HE3 LYS 58 3HE LYS 58 21.861 -7.587 -5.279
438 HZ1 LYS 58 3HZ LYS 58 21.651 -8.196 -2.882
439 HZ2 LYS 58 1HZ LYS 58 22.526 -9.305 -3.815
440 HZ3 LYS 58 2HZ LYS 58 20.933 -9.651 -3.363
441 H GLU 59 H GLU 59 18.142 -3.207 -7.140
442 HA GLU 59 HA GLU 59 19.173 -3.455 -9.698
443 HB2 GLU 59 2HB GLU 59 16.855 -1.942 -8.555
444 HB3 GLU 59 3HB GLU 59 17.273 -1.734 -10.249
445 HG2 GLU 59 2HG GLU 59 17.207 -4.324 -10.320
446 HG3 GLU 59 3HG GLU 59 16.270 -4.161 -8.835
447 H ALA 60 H ALA 60 18.763 -0.465 -7.805
448 HA ALA 60 HA ALA 60 19.784 1.358 -9.599
449 HB1 ALA 60 1HB ALA 60 20.589 1.735 -6.779
450 HB2 ALA 60 2HB ALA 60 19.773 2.839 -7.886
451 HB3 ALA 60 3HB ALA 60 18.864 1.551 -7.096
452 H ALA 61 H ALA 61 21.616 -0.404 -7.098
453 HA ALA 61 HA ALA 61 24.142 0.574 -7.674
454 HB1 ALA 61 1HB ALA 61 23.987 -2.288 -6.962
455 HB2 ALA 61 2HB ALA 61 24.908 -0.979 -6.220
456 HB3 ALA 61 3HB ALA 61 23.190 -1.159 -5.865
457 H ALA 62 H ALA 62 22.447 -2.192 -9.106
458 HA ALA 62 HA ALA 62 24.519 -3.148 -10.715
459 HB1 ALA 62 1HB ALA 62 22.101 -4.063 -10.208
460 HB2 ALA 62 2HB ALA 62 21.726 -3.260 -11.733
461 HB3 ALA 62 3HB ALA 62 22.962 -4.517 -11.679
462 H ILE 63 H ILE 63 21.973 -0.781 -11.463
463 HA ILE 63 HA ILE 63 22.681 -0.304 -14.125
464 HB ILE 63 HB ILE 63 21.476 1.667 -12.179
465 HG12 ILE 63 2HG1 ILE 63 20.035 -0.133 -14.129
466 HG13 ILE 63 3HG1 ILE 63 20.290 -0.563 -12.441
467 HG21 ILE 63 1HG2 ILE 63 21.726 3.089 -13.882
468 HG22 ILE 63 2HG2 ILE 63 22.137 1.798 -15.010
469 HG23 ILE 63 3HG2 ILE 63 20.446 2.172 -14.677
470 HD11 ILE 63 3HD1 ILE 63 18.876 1.116 -11.677
471 HD12 ILE 63 1HD1 ILE 63 18.948 2.000 -13.201
472 HD13 ILE 63 2HD1 ILE 63 18.055 0.482 -13.104
473 H ARG 64 H ARG 64 23.752 1.289 -11.142
474 HA ARG 64 HA ARG 64 25.315 3.291 -12.308
475 HB2 ARG 64 2HB ARG 64 24.761 3.367 -9.960
476 HB3 ARG 64 3HB ARG 64 25.621 1.862 -9.664
477 HG2 ARG 64 2HG ARG 64 26.989 3.632 -8.879
478 HG3 ARG 64 3HG ARG 64 27.722 3.022 -10.363
479 HD2 ARG 64 2HD ARG 64 26.638 4.865 -11.607
480 HD3 ARG 64 3HD ARG 64 26.015 5.492 -10.082
481 HE ARG 64 HE ARG 64 28.877 5.156 -10.152
482 HH11 ARG 64 1HH1 ARG 64 26.204 7.293 -10.789
483 HH12 ARG 64 2HH1 ARG 64 27.159 8.734 -10.675
484 HH21 ARG 64 1HH2 ARG 64 30.146 7.045 -10.000
485 HH22 ARG 64 2HH2 ARG 64 29.401 8.592 -10.227
486 H ASP 65 H ASP 65 26.209 0.019 -11.253
487 HA ASP 65 HA ASP 65 28.935 0.159 -11.853
488 HB2 ASP 65 2HB ASP 65 27.053 -2.208 -11.870
489 HB3 ASP 65 3HB ASP 65 28.805 -2.341 -11.998
490 H GLU 66 H GLU 66 26.192 -0.845 -13.864
491 HA GLU 66 HA GLU 66 27.638 -1.651 -16.116
492 HB2 GLU 66 2HB GLU 66 24.902 -0.367 -16.069
493 HB3 GLU 66 3HB GLU 66 25.565 -1.358 -17.361
494 HG2 GLU 66 2HG GLU 66 25.143 -3.287 -16.286
495 HG3 GLU 66 3HG GLU 66 25.509 -2.610 -14.700
496 H CYS 67 H CYS 67 26.216 1.516 -15.346
497 HA CYS 67 HA CYS 67 26.982 2.848 -17.674
498 HB2 CYS 67 2HB CYS 67 26.565 3.878 -14.864
499 HB3 CYS 67 3HB CYS 67 26.827 4.928 -16.251
500 HG CYS 67 HG CYS 67 24.175 5.134 -15.992
501 H GLN 68 H GLN 68 28.718 2.372 -14.630
502 HA GLN 68 HA GLN 68 30.958 3.973 -15.379
503 HB2 GLN 68 2HB GLN 68 30.619 1.882 -13.226
504 HB3 GLN 68 3HB GLN 68 32.057 2.876 -13.412
505 HG2 GLN 68 2HG GLN 68 30.352 4.849 -13.281
506 HG3 GLN 68 3HG GLN 68 29.328 3.642 -12.506
507 HE21 GLN 68 1HE2 GLN 68 31.538 6.006 -11.959
508 HE22 GLN 68 2HE2 GLN 68 32.105 5.521 -10.402
509 H ALA 69 H ALA 69 29.986 0.738 -16.012
510 HA ALA 69 HA ALA 69 32.668 -0.143 -16.715
511 HB1 ALA 69 1HB ALA 69 31.479 -1.861 -15.701
512 HB2 ALA 69 2HB ALA 69 29.996 -1.488 -16.582
513 HB3 ALA 69 3HB ALA 69 31.351 -2.245 -17.418
514 H TYR 70 H TYR 70 30.339 1.672 -18.174
515 HA TYR 70 HA TYR 70 30.853 0.612 -20.861
516 HB2 TYR 70 2HB TYR 70 28.826 2.639 -19.896
517 HB3 TYR 70 3HB TYR 70 29.009 2.119 -21.567
518 HD1 TYR 70 HD1 TYR 70 29.574 -0.840 -20.820
519 HD2 TYR 70 HD2 TYR 70 26.542 1.921 -19.686
520 HE1 TYR 70 HE1 TYR 70 28.032 -2.712 -20.409
521 HE2 TYR 70 HE2 TYR 70 24.992 0.057 -19.270
522 HH TYR 70 HH TYR 70 25.555 -3.075 -20.341
523 H ARG 71 H ARG 71 31.164 3.518 -18.891
524 HA ARG 71 HA ARG 71 32.830 4.703 -21.014
525 HB2 ARG 71 2HB ARG 71 32.234 6.902 -20.121
526 HB3 ARG 71 3HB ARG 71 30.797 6.003 -20.591
527 HG2 ARG 71 2HG ARG 71 31.176 5.369 -17.912
528 HG3 ARG 71 3HG ARG 71 31.531 7.094 -18.026
529 HD2 ARG 71 2HD ARG 71 29.312 7.001 -19.524
530 HD3 ARG 71 3HD ARG 71 28.991 5.639 -18.451
531 HE ARG 71 HE ARG 71 28.549 7.138 -16.797
532 HH11 ARG 71 1HH1 ARG 71 30.558 8.691 -19.179
533 HH12 ARG 71 2HH1 ARG 71 30.502 10.240 -18.406
534 HH21 ARG 71 1HH2 ARG 71 28.468 9.173 -15.770
535 HH22 ARG 71 2HH2 ARG 71 29.314 10.513 -16.467
536 H HIS 72 H HIS 72 32.516 4.005 -17.595
537 HA HIS 72 HA HIS 72 35.149 5.137 -17.037
538 HB2 HIS 72 2HB HIS 72 32.810 4.938 -15.539
539 HB3 HIS 72 3HB HIS 72 33.884 3.741 -14.821
540 HD1 HIS 72 HD1 HIS 72 34.495 4.957 -12.708
541 HD2 HIS 72 HD2 HIS 72 35.095 7.261 -16.112
542 HE1 HIS 72 HE1 HIS 72 35.716 7.010 -11.923
543 H ASN 73 H ASN 73 34.930 2.818 -18.748
544 HA ASN 73 HA ASN 73 36.928 1.193 -17.539
545 HB2 ASN 73 2HB ASN 73 34.731 0.379 -16.488
546 HB3 ASN 73 3HB ASN 73 34.345 -0.261 -18.083
547 HD21 ASN 73 1HD2 ASN 73 36.767 -0.345 -15.523
548 HD22 ASN 73 2HD2 ASN 73 37.293 -1.962 -15.828
Start of MODEL 12
1 H1 MET 1 H MET 1 0.287 1.271 -1.135
2 HA MET 1 HA MET 1 2.578 -0.241 -2.205
3 HB2 MET 1 2HB MET 1 0.287 0.352 -3.525
4 HB3 MET 1 3HB MET 1 1.259 1.759 -3.935
5 HG2 MET 1 2HG MET 1 1.926 0.452 -5.633
6 HG3 MET 1 3HG MET 1 3.048 -0.171 -4.425
7 HE1 MET 1 3HE MET 1 -0.306 -2.358 -6.532
8 HE2 MET 1 1HE MET 1 -0.281 -0.612 -6.278
9 HE3 MET 1 2HE MET 1 0.985 -1.382 -7.235
10 H GLY 2 H GLY 2 1.384 2.899 -1.224
11 HA2 GLY 2 2HA GLY 2 2.454 4.891 -0.833
12 HA3 GLY 2 3HA GLY 2 3.890 3.917 -0.554
13 H SER 3 H SER 3 5.397 5.160 -1.553
14 HA SER 3 HA SER 3 4.912 5.998 -4.316
15 HB2 SER 3 2HB SER 3 6.650 7.568 -4.048
16 HB3 SER 3 3HB SER 3 5.824 7.572 -2.491
17 HG SER 3 HG SER 3 8.028 7.434 -2.133
18 H TRP 4 H TRP 4 5.462 3.207 -3.511
19 HA TRP 4 HA TRP 4 8.136 2.586 -4.320
20 HB2 TRP 4 2HB TRP 4 7.059 1.061 -2.825
21 HB3 TRP 4 3HB TRP 4 5.676 0.886 -3.902
22 HD1 TRP 4 HD1 TRP 4 6.086 -0.571 -6.174
23 HE1 TRP 4 HE1 TRP 4 7.730 -2.495 -6.642
24 HE3 TRP 4 HE3 TRP 4 9.332 0.174 -2.295
25 HZ2 TRP 4 HZ2 TRP 4 10.090 -3.557 -5.515
26 HZ3 TRP 4 HZ3 TRP 4 11.257 -1.341 -2.061
27 HH2 TRP 4 HH2 TRP 4 11.626 -3.167 -3.639
28 H ALA 5 H ALA 5 4.947 2.321 -5.863
29 HA ALA 5 HA ALA 5 5.652 1.126 -8.242
30 HB1 ALA 5 1HB ALA 5 3.367 1.432 -7.878
31 HB2 ALA 5 2HB ALA 5 3.550 3.162 -7.585
32 HB3 ALA 5 3HB ALA 5 3.733 2.520 -9.217
33 H GLU 6 H GLU 6 5.659 4.608 -7.499
34 HA GLU 6 HA GLU 6 6.513 5.530 -9.984
35 HB2 GLU 6 2HB GLU 6 6.877 6.622 -7.201
36 HB3 GLU 6 3HB GLU 6 7.472 7.475 -8.618
37 HG2 GLU 6 2HG GLU 6 5.222 7.604 -9.515
38 HG3 GLU 6 3HG GLU 6 4.606 6.694 -8.137
39 H PHE 7 H PHE 7 8.458 4.704 -7.120
40 HA PHE 7 HA PHE 7 10.967 5.253 -8.214
41 HB2 PHE 7 2HB PHE 7 9.950 4.107 -5.823
42 HB3 PHE 7 3HB PHE 7 11.171 3.006 -6.454
43 HD1 PHE 7 HD2 PHE 7 10.857 6.724 -6.329
44 HD2 PHE 7 HD1 PHE 7 13.166 3.281 -5.367
45 HE1 PHE 7 HE2 PHE 7 12.625 8.170 -5.415
46 HE2 PHE 7 HE1 PHE 7 14.938 4.721 -4.451
47 HZ PHE 7 HZ PHE 7 14.670 7.169 -4.475
48 H LYS 8 H LYS 8 9.007 2.319 -8.315
49 HA LYS 8 HA LYS 8 10.940 0.649 -9.513
50 HB2 LYS 8 2HB LYS 8 8.765 -0.041 -8.381
51 HB3 LYS 8 3HB LYS 8 7.956 0.404 -9.878
52 HG2 LYS 8 2HG LYS 8 8.515 -1.511 -10.848
53 HG3 LYS 8 3HG LYS 8 10.206 -1.342 -10.371
54 HD2 LYS 8 2HD LYS 8 9.771 -3.153 -9.104
55 HD3 LYS 8 3HD LYS 8 9.072 -1.971 -7.994
56 HE2 LYS 8 2HE LYS 8 6.874 -2.394 -8.806
57 HE3 LYS 8 3HE LYS 8 7.489 -3.352 -10.152
58 HZ1 LYS 8 3HZ LYS 8 6.558 -4.501 -8.025
59 HZ2 LYS 8 1HZ LYS 8 8.107 -4.202 -7.412
60 HZ3 LYS 8 2HZ LYS 8 7.916 -5.135 -8.810
61 H GLN 9 H GLN 9 8.388 2.693 -10.879
62 HA GLN 9 HA GLN 9 8.727 1.948 -13.564
63 HB2 GLN 9 2HB GLN 9 7.225 3.891 -12.092
64 HB3 GLN 9 3HB GLN 9 7.971 4.679 -13.477
65 HG2 GLN 9 2HG GLN 9 7.004 2.918 -14.931
66 HG3 GLN 9 3HG GLN 9 6.161 2.277 -13.521
67 HE21 GLN 9 1HE2 GLN 9 5.231 4.418 -12.249
68 HE22 GLN 9 2HE2 GLN 9 4.148 5.322 -13.247
69 H ARG 10 H ARG 10 9.920 4.879 -11.911
70 HA ARG 10 HA ARG 10 11.476 5.878 -13.965
71 HB2 ARG 10 2HB ARG 10 12.009 6.022 -10.992
72 HB3 ARG 10 3HB ARG 10 12.771 7.042 -12.205
73 HG2 ARG 10 2HG ARG 10 11.008 8.403 -12.332
74 HG3 ARG 10 3HG ARG 10 9.857 7.065 -12.329
75 HD2 ARG 10 2HD ARG 10 9.389 7.424 -10.188
76 HD3 ARG 10 3HD ARG 10 11.091 7.263 -9.757
77 HE ARG 10 HE ARG 10 9.600 9.681 -9.956
78 HH11 ARG 10 1HH1 ARG 10 12.768 8.309 -10.409
79 HH12 ARG 10 2HH1 ARG 10 13.597 9.807 -10.142
80 HH21 ARG 10 1HH2 ARG 10 10.680 11.659 -9.604
81 HH22 ARG 10 2HH2 ARG 10 12.409 11.711 -9.684
82 H LEU 11 H LEU 11 12.394 3.579 -11.422
83 HA LEU 11 HA LEU 11 15.095 3.321 -12.116
84 HB2 LEU 11 2HB LEU 11 13.130 1.729 -10.580
85 HB3 LEU 11 3HB LEU 11 14.580 0.888 -11.124
86 HG LEU 11 HG LEU 11 15.003 3.466 -9.740
87 HD11 LEU 11 1HD1 LEU 11 13.825 2.985 -7.925
88 HD12 LEU 11 2HD1 LEU 11 14.850 1.570 -7.686
89 HD13 LEU 11 3HD1 LEU 11 13.344 1.424 -8.592
90 HD21 LEU 11 3HD2 LEU 11 16.293 0.748 -9.757
91 HD22 LEU 11 1HD2 LEU 11 16.788 2.042 -8.665
92 HD23 LEU 11 2HD2 LEU 11 16.925 2.259 -10.410
93 H ALA 12 H ALA 12 12.230 1.580 -13.243
94 HA ALA 12 HA ALA 12 13.548 -0.357 -14.791
95 HB1 ALA 12 1HB ALA 12 11.190 -0.526 -14.181
96 HB2 ALA 12 2HB ALA 12 10.817 0.849 -15.221
97 HB3 ALA 12 3HB ALA 12 11.408 -0.655 -15.927
98 H ALA 13 H ALA 13 12.307 2.857 -15.646
99 HA ALA 13 HA ALA 13 12.947 2.741 -18.386
100 HB1 ALA 13 1HB ALA 13 11.688 4.569 -18.248
101 HB2 ALA 13 2HB ALA 13 11.984 4.723 -16.515
102 HB3 ALA 13 3HB ALA 13 13.121 5.419 -17.669
103 H ILE 14 H ILE 14 14.767 3.894 -15.579
104 HA ILE 14 HA ILE 14 16.955 4.964 -16.988
105 HB ILE 14 HB ILE 14 16.915 3.785 -14.208
106 HG12 ILE 14 2HG1 ILE 14 16.899 6.716 -14.737
107 HG13 ILE 14 3HG1 ILE 14 15.396 5.835 -14.990
108 HG21 ILE 14 1HG2 ILE 14 18.916 5.071 -13.798
109 HG22 ILE 14 2HG2 ILE 14 19.174 4.006 -15.178
110 HG23 ILE 14 3HG2 ILE 14 18.869 5.724 -15.435
111 HD11 ILE 14 3HD1 ILE 14 15.005 6.084 -12.829
112 HD12 ILE 14 1HD1 ILE 14 16.324 4.954 -12.527
113 HD13 ILE 14 2HD1 ILE 14 16.636 6.690 -12.540
114 H LYS 15 H LYS 15 16.353 1.735 -15.667
115 HA LYS 15 HA LYS 15 18.899 0.670 -16.311
116 HB2 LYS 15 2HB LYS 15 16.756 -0.202 -14.858
117 HB3 LYS 15 3HB LYS 15 16.638 -1.215 -16.291
118 HG2 LYS 15 2HG LYS 15 18.563 -2.335 -15.832
119 HG3 LYS 15 3HG LYS 15 19.295 -0.961 -14.999
120 HD2 LYS 15 2HD LYS 15 18.866 -2.311 -13.206
121 HD3 LYS 15 3HD LYS 15 17.341 -1.425 -13.277
122 HE2 LYS 15 2HE LYS 15 16.396 -3.457 -13.288
123 HE3 LYS 15 3HE LYS 15 16.862 -3.492 -14.987
124 HZ1 LYS 15 3HZ LYS 15 18.123 -4.824 -12.691
125 HZ2 LYS 15 1HZ LYS 15 19.070 -4.424 -14.035
126 HZ3 LYS 15 2HZ LYS 15 17.738 -5.450 -14.215
127 H THR 16 H THR 16 15.797 0.718 -18.007
128 HA THR 16 HA THR 16 16.471 -0.970 -20.135
129 HB THR 16 HB THR 16 14.605 1.408 -20.246
130 HG1 THR 16 HG1 THR 16 13.342 0.259 -19.008
131 HG21 THR 16 3HG2 THR 16 15.142 0.490 -22.444
132 HG22 THR 16 1HG2 THR 16 13.475 0.120 -22.006
133 HG23 THR 16 2HG2 THR 16 14.715 -1.127 -21.885
134 H ARG 17 H ARG 17 16.449 2.602 -20.096
135 HA ARG 17 HA ARG 17 17.673 2.921 -22.600
136 HB2 ARG 17 2HB ARG 17 17.039 4.633 -20.293
137 HB3 ARG 17 3HB ARG 17 18.412 5.178 -21.247
138 HG2 ARG 17 2HG ARG 17 16.586 6.268 -22.191
139 HG3 ARG 17 3HG ARG 17 16.881 4.907 -23.275
140 HD2 ARG 17 2HD ARG 17 15.156 3.791 -21.511
141 HD3 ARG 17 3HD ARG 17 14.599 5.464 -21.502
142 HE ARG 17 HE ARG 17 14.211 3.565 -23.568
143 HH11 ARG 17 1HH1 ARG 17 14.858 6.942 -23.023
144 HH12 ARG 17 2HH1 ARG 17 14.121 7.456 -24.504
145 HH21 ARG 17 1HH2 ARG 17 13.239 4.229 -25.521
146 HH22 ARG 17 2HH2 ARG 17 13.200 5.912 -25.924
147 H CYS 18 H CYS 18 19.001 2.449 -19.394
148 HA CYS 18 HA CYS 18 21.675 3.162 -20.022
149 HB2 CYS 18 2HB CYS 18 21.144 3.169 -17.730
150 HB3 CYS 18 3HB CYS 18 20.407 1.573 -17.805
151 HG CYS 18 HG CYS 18 23.764 2.133 -18.157
152 H GLN 19 H GLN 19 19.902 0.107 -20.040
153 HA GLN 19 HA GLN 19 22.149 -1.526 -20.626
154 HB2 GLN 19 2HB GLN 19 19.193 -1.996 -21.040
155 HB3 GLN 19 3HB GLN 19 20.430 -3.225 -21.262
156 HG2 GLN 19 2HG GLN 19 20.602 -1.911 -18.676
157 HG3 GLN 19 3HG GLN 19 19.051 -2.706 -18.945
158 HE21 GLN 19 1HE2 GLN 19 19.708 -4.117 -17.214
159 HE22 GLN 19 2HE2 GLN 19 20.750 -5.454 -17.548
160 H ALA 20 H ALA 20 19.693 0.050 -22.619
161 HA ALA 20 HA ALA 20 20.661 -1.067 -25.075
162 HB1 ALA 20 1HB ALA 20 18.299 -0.284 -24.629
163 HB2 ALA 20 2HB ALA 20 18.909 1.362 -24.798
164 HB3 ALA 20 3HB ALA 20 19.014 0.239 -26.154
165 H LEU 21 H LEU 21 21.264 1.835 -23.225
166 HA LEU 21 HA LEU 21 22.726 3.559 -23.479
167 HB2 LEU 21 2HB LEU 21 24.137 1.522 -25.194
168 HB3 LEU 21 3HB LEU 21 24.845 3.042 -24.651
169 HG LEU 21 HG LEU 21 23.911 0.863 -22.789
170 HD11 LEU 21 1HD1 LEU 21 25.728 -0.275 -23.360
171 HD12 LEU 21 2HD1 LEU 21 26.691 1.050 -22.709
172 HD13 LEU 21 3HD1 LEU 21 26.278 1.020 -24.423
173 HD21 LEU 21 3HD2 LEU 21 24.787 2.103 -21.069
174 HD22 LEU 21 1HD2 LEU 21 24.181 3.384 -22.120
175 HD23 LEU 21 2HD2 LEU 21 25.898 2.982 -22.121
176 H GLY 22 H GLY 22 21.004 4.675 -24.663
177 HA2 GLY 22 2HA GLY 22 20.520 4.714 -27.345
178 HA3 GLY 22 3HA GLY 22 20.482 6.160 -26.348
179 H GLY 23 H GLY 23 23.311 6.089 -25.703
180 HA2 GLY 23 2HA GLY 23 25.409 6.215 -26.897
181 HA3 GLY 23 3HA GLY 23 24.501 6.581 -28.356
182 H SER 24 H SER 24 23.742 8.073 -25.295
183 HA SER 24 HA SER 24 24.820 10.613 -26.332
184 HB2 SER 24 2HB SER 24 22.263 9.994 -24.881
185 HB3 SER 24 3HB SER 24 22.972 11.606 -24.784
186 HG SER 24 HG SER 24 21.880 10.264 -26.986
187 H GLU 25 H GLU 25 26.543 11.240 -25.226
188 HA GLU 25 HA GLU 25 27.376 10.187 -22.777
189 HB2 GLU 25 2HB GLU 25 28.891 12.227 -22.714
190 HB3 GLU 25 3HB GLU 25 29.022 11.201 -24.135
191 HG2 GLU 25 2HG GLU 25 28.583 12.913 -25.456
192 HG3 GLU 25 3HG GLU 25 27.057 13.205 -24.624
193 H ALA 26 H ALA 26 25.040 12.584 -23.474
194 HA ALA 26 HA ALA 26 25.175 13.880 -20.894
195 HB1 ALA 26 1HB ALA 26 24.525 15.254 -22.725
196 HB2 ALA 26 2HB ALA 26 23.250 14.130 -23.195
197 HB3 ALA 26 3HB ALA 26 23.107 15.047 -21.696
198 H GLU 27 H GLU 27 22.933 11.687 -22.570
199 HA GLU 27 HA GLU 27 21.027 11.462 -20.546
200 HB2 GLU 27 2HB GLU 27 20.067 10.220 -22.128
201 HB3 GLU 27 3HB GLU 27 21.568 10.216 -23.042
202 HG2 GLU 27 2HG GLU 27 22.306 8.223 -21.920
203 HG3 GLU 27 3HG GLU 27 20.901 8.260 -20.856
204 H CYS 28 H CYS 28 23.973 9.581 -21.127
205 HA CYS 28 HA CYS 28 23.629 7.683 -19.103
206 HB2 CYS 28 2HB CYS 28 26.269 8.815 -20.042
207 HB3 CYS 28 3HB CYS 28 25.989 7.237 -19.315
208 HG CYS 28 HG CYS 28 26.053 6.164 -21.655
209 H ALA 29 H ALA 29 25.062 10.909 -19.029
210 HA ALA 29 HA ALA 29 26.113 10.819 -16.431
211 HB1 ALA 29 1HB ALA 29 26.581 12.562 -18.171
212 HB2 ALA 29 2HB ALA 29 25.013 13.272 -17.787
213 HB3 ALA 29 3HB ALA 29 26.270 13.191 -16.553
214 H ALA 30 H ALA 30 23.005 12.157 -17.561
215 HA ALA 30 HA ALA 30 21.983 12.864 -15.068
216 HB1 ALA 30 1HB ALA 30 21.090 13.356 -17.442
217 HB2 ALA 30 2HB ALA 30 20.203 11.844 -17.247
218 HB3 ALA 30 3HB ALA 30 19.938 13.173 -16.119
219 H PHE 31 H PHE 31 22.032 9.767 -16.717
220 HA PHE 31 HA PHE 31 20.178 8.435 -15.049
221 HB2 PHE 31 2HB PHE 31 22.274 7.595 -16.998
222 HB3 PHE 31 3HB PHE 31 21.640 6.382 -15.891
223 HD1 PHE 31 HD2 PHE 31 19.676 9.184 -17.249
224 HD2 PHE 31 HD1 PHE 31 20.552 5.027 -17.503
225 HE1 PHE 31 HE2 PHE 31 17.729 8.867 -18.719
226 HE2 PHE 31 HE1 PHE 31 18.607 4.703 -18.974
227 HZ PHE 31 HZ PHE 31 17.191 6.624 -19.583
228 H GLU 32 H GLU 32 23.733 8.565 -15.007
229 HA GLU 32 HA GLU 32 24.144 6.909 -12.799
230 HB2 GLU 32 2HB GLU 32 25.704 8.894 -14.294
231 HB3 GLU 32 3HB GLU 32 26.188 8.732 -12.611
232 HG2 GLU 32 2HG GLU 32 26.154 6.179 -13.150
233 HG3 GLU 32 3HG GLU 32 26.300 6.734 -14.816
234 H LYS 33 H LYS 33 23.579 10.398 -12.972
235 HA LYS 33 HA LYS 33 23.963 10.952 -10.239
236 HB2 LYS 33 2HB LYS 33 23.230 12.390 -12.561
237 HB3 LYS 33 3HB LYS 33 21.970 12.685 -11.369
238 HG2 LYS 33 2HG LYS 33 23.504 14.393 -11.008
239 HG3 LYS 33 3HG LYS 33 23.883 13.212 -9.753
240 HD2 LYS 33 2HD LYS 33 25.869 12.617 -10.722
241 HD3 LYS 33 3HD LYS 33 25.311 12.998 -12.353
242 HE2 LYS 33 2HE LYS 33 26.804 14.707 -11.975
243 HE3 LYS 33 3HE LYS 33 25.292 15.452 -11.458
244 HZ1 LYS 33 3HZ LYS 33 27.172 14.109 -9.599
245 HZ2 LYS 33 1HZ LYS 33 25.834 15.063 -9.196
246 HZ3 LYS 33 2HZ LYS 33 27.194 15.772 -9.909
247 H GLU 34 H GLU 34 20.926 10.524 -12.065
248 HA GLU 34 HA GLU 34 19.149 10.681 -9.959
249 HB2 GLU 34 2HB GLU 34 19.031 9.964 -12.671
250 HB3 GLU 34 3HB GLU 34 18.330 8.609 -11.797
251 HG2 GLU 34 2HG GLU 34 16.776 10.132 -10.683
252 HG3 GLU 34 3HG GLU 34 17.474 11.485 -11.571
253 H ILE 35 H ILE 35 20.813 7.796 -11.196
254 HA ILE 35 HA ILE 35 19.666 5.947 -9.425
255 HB ILE 35 HB ILE 35 22.345 5.901 -10.812
256 HG12 ILE 35 2HG1 ILE 35 20.289 5.903 -12.238
257 HG13 ILE 35 3HG1 ILE 35 21.268 4.450 -12.408
258 HG21 ILE 35 1HG2 ILE 35 22.768 4.347 -9.202
259 HG22 ILE 35 2HG2 ILE 35 21.062 3.978 -8.953
260 HG23 ILE 35 3HG2 ILE 35 21.910 3.326 -10.355
261 HD11 ILE 35 3HD1 ILE 35 19.289 4.104 -10.353
262 HD12 ILE 35 1HD1 ILE 35 18.543 4.604 -11.871
263 HD13 ILE 35 2HD1 ILE 35 19.565 3.167 -11.822
264 H ALA 36 H ALA 36 22.617 7.892 -9.172
265 HA ALA 36 HA ALA 36 23.660 6.827 -6.829
266 HB1 ALA 36 1HB ALA 36 23.795 9.763 -7.417
267 HB2 ALA 36 2HB ALA 36 25.020 8.713 -6.702
268 HB3 ALA 36 3HB ALA 36 24.646 8.589 -8.421
269 H ALA 37 H ALA 37 21.362 9.515 -7.219
270 HA ALA 37 HA ALA 37 21.067 10.052 -4.463
271 HB1 ALA 37 1HB ALA 37 20.410 11.761 -5.930
272 HB2 ALA 37 2HB ALA 37 19.371 10.681 -6.860
273 HB3 ALA 37 3HB ALA 37 18.906 11.163 -5.229
274 H PHE 38 H PHE 38 19.337 7.925 -6.685
275 HA PHE 38 HA PHE 38 17.182 7.236 -5.058
276 HB2 PHE 38 2HB PHE 38 18.485 6.141 -7.442
277 HB3 PHE 38 3HB PHE 38 17.717 4.913 -6.440
278 HD1 PHE 38 HD2 PHE 38 16.694 8.426 -7.104
279 HD2 PHE 38 HD1 PHE 38 15.807 4.291 -7.586
280 HE1 PHE 38 HE2 PHE 38 14.509 9.011 -8.071
281 HE2 PHE 38 HE1 PHE 38 13.620 4.870 -8.555
282 HZ PHE 38 HZ PHE 38 12.968 7.233 -8.798
283 H GLU 39 H GLU 39 20.267 5.494 -5.470
284 HA GLU 39 HA GLU 39 19.780 3.575 -3.474
285 HB2 GLU 39 2HB GLU 39 22.219 3.166 -3.555
286 HB3 GLU 39 3HB GLU 39 21.487 3.220 -5.152
287 HG2 GLU 39 2HG GLU 39 22.283 5.514 -5.437
288 HG3 GLU 39 3HG GLU 39 23.030 5.447 -3.841
289 H SER 40 H SER 40 21.298 6.755 -3.368
290 HA SER 40 HA SER 40 22.287 6.597 -0.733
291 HB2 SER 40 2HB SER 40 23.034 8.310 -2.332
292 HB3 SER 40 3HB SER 40 21.431 9.043 -2.300
293 HG SER 40 HG SER 40 23.438 9.563 -0.703
294 H GLU 41 H GLU 41 19.142 7.379 -2.040
295 HA GLU 41 HA GLU 41 18.122 8.364 0.477
296 HB2 GLU 41 2HB GLU 41 16.872 7.814 -2.208
297 HB3 GLU 41 3HB GLU 41 15.904 8.254 -0.808
298 HG2 GLU 41 2HG GLU 41 18.181 10.024 -1.325
299 HG3 GLU 41 3HG GLU 41 16.948 10.010 -2.585
300 H LEU 42 H LEU 42 18.131 5.370 -1.327
301 HA LEU 42 HA LEU 42 16.142 4.090 0.303
302 HB2 LEU 42 2HB LEU 42 18.144 2.936 -1.634
303 HB3 LEU 42 3HB LEU 42 16.815 2.046 -0.893
304 HG LEU 42 HG LEU 42 16.204 4.475 -2.516
305 HD11 LEU 42 1HD1 LEU 42 17.687 3.334 -3.988
306 HD12 LEU 42 2HD1 LEU 42 16.042 2.983 -4.516
307 HD13 LEU 42 3HD1 LEU 42 16.954 1.773 -3.614
308 HD21 LEU 42 3HD2 LEU 42 14.782 1.834 -2.217
309 HD22 LEU 42 1HD2 LEU 42 14.153 3.314 -2.940
310 HD23 LEU 42 2HD2 LEU 42 14.475 3.248 -1.208
311 H GLN 43 H GLN 43 19.573 4.525 0.419
312 HA GLN 43 HA GLN 43 20.132 2.345 2.180
313 HB2 GLN 43 2HB GLN 43 22.335 3.174 2.279
314 HB3 GLN 43 3HB GLN 43 21.783 3.549 0.652
315 HG2 GLN 43 2HG GLN 43 22.429 5.633 1.011
316 HG3 GLN 43 3HG GLN 43 21.091 5.780 2.149
317 HE21 GLN 43 1HE2 GLN 43 23.578 7.165 2.258
318 HE22 GLN 43 2HE2 GLN 43 24.361 6.706 3.728
319 H ALA 44 H ALA 44 18.871 5.510 2.579
320 HA ALA 44 HA ALA 44 19.663 5.933 5.282
321 HB1 ALA 44 1HB ALA 44 17.202 7.168 4.125
322 HB2 ALA 44 2HB ALA 44 18.406 7.865 5.210
323 HB3 ALA 44 3HB ALA 44 18.790 7.625 3.506
324 H TYR 45 H TYR 45 17.001 4.286 3.737
325 HA TYR 45 HA TYR 45 15.520 4.001 6.214
326 HB2 TYR 45 2HB TYR 45 14.966 2.646 3.572
327 HB3 TYR 45 3HB TYR 45 13.844 2.897 4.905
328 HD1 TYR 45 HD2 TYR 45 13.635 5.506 5.585
329 HD2 TYR 45 HD1 TYR 45 14.716 4.023 1.746
330 HE1 TYR 45 HE2 TYR 45 12.892 7.618 4.566
331 HE2 TYR 45 HE1 TYR 45 13.978 6.131 0.717
332 HH TYR 45 HH TYR 45 12.352 8.620 2.592
333 H LYS 46 H LYS 46 16.719 1.643 3.818
334 HA LYS 46 HA LYS 46 17.390 -0.525 4.046
335 HB2 LYS 46 2HB LYS 46 19.356 0.650 4.944
336 HB3 LYS 46 3HB LYS 46 18.650 0.602 6.554
337 HG2 LYS 46 2HG LYS 46 18.694 -2.046 5.535
338 HG3 LYS 46 3HG LYS 46 20.285 -1.326 5.280
339 HD2 LYS 46 2HD LYS 46 18.991 -0.913 7.921
340 HD3 LYS 46 3HD LYS 46 19.619 -2.523 7.558
341 HE2 LYS 46 2HE LYS 46 21.722 -1.853 7.859
342 HE3 LYS 46 3HE LYS 46 21.498 -0.461 6.801
343 HZ1 LYS 46 3HZ LYS 46 20.203 -0.128 9.328
344 HZ2 LYS 46 1HZ LYS 46 21.300 0.888 8.538
345 HZ3 LYS 46 2HZ LYS 46 21.867 -0.382 9.499
346 H GLY 47 H GLY 47 15.248 -1.332 4.369
347 HA2 GLY 47 2HA GLY 47 13.706 -2.635 5.461
348 HA3 GLY 47 3HA GLY 47 14.974 -2.981 6.628
349 H LYS 48 H LYS 48 14.392 -2.525 8.632
350 HA LYS 48 HA LYS 48 13.308 -1.606 10.414
351 HB2 LYS 48 2HB LYS 48 14.038 0.798 8.761
352 HB3 LYS 48 3HB LYS 48 13.206 0.972 10.301
353 HG2 LYS 48 2HG LYS 48 15.231 -0.660 11.022
354 HG3 LYS 48 3HG LYS 48 15.998 0.261 9.726
355 HD2 LYS 48 2HD LYS 48 15.038 2.331 10.923
356 HD3 LYS 48 3HD LYS 48 14.817 1.250 12.301
357 HE2 LYS 48 2HE LYS 48 17.450 1.553 10.880
358 HE3 LYS 48 3HE LYS 48 16.977 2.583 12.230
359 HZ1 LYS 48 3HZ LYS 48 18.131 0.915 13.275
360 HZ2 LYS 48 1HZ LYS 48 17.593 -0.292 12.218
361 HZ3 LYS 48 2HZ LYS 48 16.549 0.327 13.396
362 H GLY 49 H GLY 49 11.370 -2.779 9.510
363 HA2 GLY 49 2HA GLY 49 9.059 -2.734 9.441
364 HA3 GLY 49 3HA GLY 49 9.127 -0.982 9.555
365 H ASN 50 H ASN 50 11.070 -2.253 7.080
366 HA ASN 50 HA ASN 50 9.143 -2.525 5.026
367 HB2 ASN 50 2HB ASN 50 10.158 0.185 5.598
368 HB3 ASN 50 3HB ASN 50 10.252 -0.301 3.908
369 HD21 ASN 50 1HD2 ASN 50 8.488 1.515 5.707
370 HD22 ASN 50 2HD2 ASN 50 6.893 1.173 5.138
371 HA PRO 51 HA PRO 51 13.398 -4.149 4.194
372 HB2 PRO 51 2HB PRO 51 12.552 -6.619 3.451
373 HB3 PRO 51 3HB PRO 51 12.864 -6.176 5.133
374 HG2 PRO 51 2HG PRO 51 10.260 -6.319 3.663
375 HG3 PRO 51 3HG PRO 51 10.652 -6.875 5.301
376 HD2 PRO 51 2HD PRO 51 9.367 -4.539 4.824
377 HD3 PRO 51 3HD PRO 51 10.469 -4.760 6.198
378 H GLU 52 H GLU 52 10.475 -3.766 2.430
379 HA GLU 52 HA GLU 52 11.059 -4.777 -0.068
380 HB2 GLU 52 2HB GLU 52 9.600 -2.931 -0.951
381 HB3 GLU 52 3HB GLU 52 8.889 -3.879 0.348
382 HG2 GLU 52 2HG GLU 52 8.690 -2.106 1.671
383 HG3 GLU 52 3HG GLU 52 10.333 -1.565 1.334
384 H VAL 53 H VAL 53 12.277 -1.887 1.480
385 HA VAL 53 HA VAL 53 13.313 -0.519 -0.708
386 HB VAL 53 HB VAL 53 14.613 -0.701 2.011
387 HG11 VAL 53 1HG1 VAL 53 14.708 1.881 0.794
388 HG12 VAL 53 2HG1 VAL 53 16.042 0.825 1.262
389 HG13 VAL 53 3HG1 VAL 53 15.323 0.682 -0.343
390 HG21 VAL 53 3HG2 VAL 53 12.081 0.489 1.156
391 HG22 VAL 53 1HG2 VAL 53 12.659 0.089 2.773
392 HG23 VAL 53 2HG2 VAL 53 13.145 1.604 2.012
393 H GLU 54 H GLU 54 14.457 -3.387 0.896
394 HA GLU 54 HA GLU 54 17.121 -3.457 0.203
395 HB2 GLU 54 2HB GLU 54 15.079 -5.665 0.380
396 HB3 GLU 54 3HB GLU 54 16.777 -5.986 0.060
397 HG2 GLU 54 2HG GLU 54 16.053 -4.325 2.418
398 HG3 GLU 54 3HG GLU 54 15.813 -6.070 2.493
399 H ALA 55 H ALA 55 14.418 -4.761 -1.723
400 HA ALA 55 HA ALA 55 15.823 -5.589 -3.945
401 HB1 ALA 55 1HB ALA 55 13.382 -4.415 -4.834
402 HB2 ALA 55 2HB ALA 55 13.775 -6.120 -4.608
403 HB3 ALA 55 3HB ALA 55 13.110 -5.183 -3.270
404 H LEU 56 H LEU 56 14.358 -2.383 -3.412
405 HA LEU 56 HA LEU 56 15.108 -1.181 -5.791
406 HB2 LEU 56 2HB LEU 56 14.771 -0.052 -3.025
407 HB3 LEU 56 3HB LEU 56 15.104 0.961 -4.429
408 HG LEU 56 HG LEU 56 12.699 -0.842 -4.197
409 HD11 LEU 56 1HD1 LEU 56 11.410 1.039 -3.547
410 HD12 LEU 56 2HD1 LEU 56 12.771 2.136 -3.775
411 HD13 LEU 56 3HD1 LEU 56 12.794 0.967 -2.455
412 HD21 LEU 56 3HD2 LEU 56 12.212 -0.225 -6.278
413 HD22 LEU 56 1HD2 LEU 56 13.847 0.429 -6.386
414 HD23 LEU 56 2HD2 LEU 56 12.508 1.476 -5.915
415 H ARG 57 H ARG 57 16.930 -1.440 -2.760
416 HA ARG 57 HA ARG 57 19.137 0.109 -3.501
417 HB2 ARG 57 2HB ARG 57 18.764 -2.146 -1.551
418 HB3 ARG 57 3HB ARG 57 20.353 -1.439 -1.811
419 HG2 ARG 57 2HG ARG 57 17.993 0.273 -1.130
420 HG3 ARG 57 3HG ARG 57 18.921 -0.556 0.122
421 HD2 ARG 57 2HD ARG 57 20.251 1.167 -1.945
422 HD3 ARG 57 3HD ARG 57 19.573 1.854 -0.469
423 HE ARG 57 HE ARG 57 21.145 -0.108 0.480
424 HH11 ARG 57 1HH1 ARG 57 21.712 2.446 -1.817
425 HH12 ARG 57 2HH1 ARG 57 23.396 2.590 -1.437
426 HH21 ARG 57 1HH2 ARG 57 23.361 0.073 0.989
427 HH22 ARG 57 2HH2 ARG 57 24.333 1.240 0.159
428 H LYS 58 H LYS 58 18.558 -3.375 -3.852
429 HA LYS 58 HA LYS 58 21.038 -4.076 -4.929
430 HB2 LYS 58 2HB LYS 58 18.784 -5.441 -4.261
431 HB3 LYS 58 3HB LYS 58 18.696 -5.506 -6.016
432 HG2 LYS 58 2HG LYS 58 21.140 -6.317 -4.466
433 HG3 LYS 58 3HG LYS 58 19.849 -7.439 -4.901
434 HD2 LYS 58 2HD LYS 58 20.200 -6.873 -7.278
435 HD3 LYS 58 3HD LYS 58 21.538 -5.821 -6.809
436 HE2 LYS 58 2HE LYS 58 22.938 -7.552 -6.447
437 HE3 LYS 58 3HE LYS 58 21.670 -8.570 -5.766
438 HZ1 LYS 58 3HZ LYS 58 21.348 -8.082 -8.578
439 HZ2 LYS 58 1HZ LYS 58 21.315 -9.542 -7.724
440 HZ3 LYS 58 2HZ LYS 58 22.793 -8.880 -8.210
441 H GLU 59 H GLU 59 17.995 -3.403 -6.669
442 HA GLU 59 HA GLU 59 18.961 -3.566 -9.252
443 HB2 GLU 59 2HB GLU 59 16.810 -1.775 -8.117
444 HB3 GLU 59 3HB GLU 59 17.105 -1.973 -9.839
445 HG2 GLU 59 2HG GLU 59 16.679 -4.419 -8.220
446 HG3 GLU 59 3HG GLU 59 15.287 -3.388 -8.547
447 H ALA 60 H ALA 60 18.759 -0.666 -7.197
448 HA ALA 60 HA ALA 60 19.796 1.204 -8.939
449 HB1 ALA 60 1HB ALA 60 20.336 1.082 -5.975
450 HB2 ALA 60 2HB ALA 60 20.394 2.514 -7.004
451 HB3 ALA 60 3HB ALA 60 18.856 1.703 -6.707
452 H ALA 61 H ALA 61 21.625 -0.767 -6.595
453 HA ALA 61 HA ALA 61 24.174 0.127 -7.212
454 HB1 ALA 61 1HB ALA 61 23.949 -1.221 -5.305
455 HB2 ALA 61 2HB ALA 61 23.180 -2.525 -6.211
456 HB3 ALA 61 3HB ALA 61 24.898 -2.190 -6.433
457 H ALA 62 H ALA 62 22.322 -2.510 -8.700
458 HA ALA 62 HA ALA 62 24.296 -3.455 -10.434
459 HB1 ALA 62 1HB ALA 62 22.671 -4.758 -11.343
460 HB2 ALA 62 2HB ALA 62 21.832 -4.276 -9.868
461 HB3 ALA 62 3HB ALA 62 21.489 -3.450 -11.388
462 H ILE 63 H ILE 63 21.818 -0.959 -10.950
463 HA ILE 63 HA ILE 63 22.417 -0.389 -13.622
464 HB ILE 63 HB ILE 63 21.361 1.498 -11.513
465 HG12 ILE 63 2HG1 ILE 63 19.536 0.366 -13.523
466 HG13 ILE 63 3HG1 ILE 63 20.201 -0.817 -12.403
467 HG21 ILE 63 1HG2 ILE 63 21.520 1.682 -14.505
468 HG22 ILE 63 2HG2 ILE 63 20.338 2.602 -13.576
469 HG23 ILE 63 3HG2 ILE 63 22.062 2.847 -13.297
470 HD11 ILE 63 3HD1 ILE 63 19.387 1.414 -10.881
471 HD12 ILE 63 1HD1 ILE 63 18.083 1.028 -12.003
472 HD13 ILE 63 2HD1 ILE 63 18.698 -0.209 -10.907
473 H ARG 64 H ARG 64 23.689 1.020 -10.626
474 HA ARG 64 HA ARG 64 25.278 3.012 -11.777
475 HB2 ARG 64 2HB ARG 64 24.858 3.038 -9.415
476 HB3 ARG 64 3HB ARG 64 25.603 1.458 -9.209
477 HG2 ARG 64 2HG ARG 64 27.092 3.168 -8.411
478 HG3 ARG 64 3HG ARG 64 27.772 2.425 -9.861
479 HD2 ARG 64 2HD ARG 64 27.693 4.343 -11.014
480 HD3 ARG 64 3HD ARG 64 26.077 4.731 -10.426
481 HE ARG 64 HE ARG 64 28.095 5.102 -8.433
482 HH11 ARG 64 1HH1 ARG 64 26.543 6.554 -11.189
483 HH12 ARG 64 2HH1 ARG 64 26.899 8.177 -10.699
484 HH21 ARG 64 1HH2 ARG 64 28.570 7.234 -7.776
485 HH22 ARG 64 2HH2 ARG 64 28.053 8.563 -8.758
486 H ASP 65 H ASP 65 26.086 -0.336 -10.905
487 HA ASP 65 HA ASP 65 28.785 -0.274 -11.628
488 HB2 ASP 65 2HB ASP 65 26.801 -2.554 -11.634
489 HB3 ASP 65 3HB ASP 65 28.531 -2.765 -11.893
490 H GLU 66 H GLU 66 25.911 -1.064 -13.548
491 HA GLU 66 HA GLU 66 27.228 -1.823 -15.900
492 HB2 GLU 66 2HB GLU 66 24.544 -0.449 -15.703
493 HB3 GLU 66 3HB GLU 66 25.116 -1.458 -17.025
494 HG2 GLU 66 2HG GLU 66 25.245 -2.868 -14.514
495 HG3 GLU 66 3HG GLU 66 23.622 -2.255 -14.823
496 H CYS 67 H CYS 67 25.954 1.345 -14.909
497 HA CYS 67 HA CYS 67 26.625 2.769 -17.208
498 HB2 CYS 67 2HB CYS 67 26.436 3.666 -14.329
499 HB3 CYS 67 3HB CYS 67 26.644 4.776 -15.678
500 HG CYS 67 HG CYS 67 24.038 5.092 -15.320
501 H GLN 68 H GLN 68 28.542 2.046 -14.330
502 HA GLN 68 HA GLN 68 30.779 3.632 -15.074
503 HB2 GLN 68 2HB GLN 68 30.533 1.301 -13.168
504 HB3 GLN 68 3HB GLN 68 31.983 2.280 -13.343
505 HG2 GLN 68 2HG GLN 68 31.060 4.090 -12.303
506 HG3 GLN 68 3HG GLN 68 29.415 3.651 -12.758
507 HE21 GLN 68 1HE2 GLN 68 29.985 4.452 -10.212
508 HE22 GLN 68 2HE2 GLN 68 29.833 3.115 -9.129
509 H ALA 69 H ALA 69 29.778 0.359 -15.766
510 HA ALA 69 HA ALA 69 32.329 -0.432 -16.850
511 HB1 ALA 69 1HB ALA 69 31.025 -2.152 -15.855
512 HB2 ALA 69 2HB ALA 69 29.623 -1.750 -16.848
513 HB3 ALA 69 3HB ALA 69 31.054 -2.462 -17.592
514 H TYR 70 H TYR 70 29.878 1.520 -17.946
515 HA TYR 70 HA TYR 70 30.283 0.794 -20.762
516 HB2 TYR 70 2HB TYR 70 28.211 2.585 -19.477
517 HB3 TYR 70 3HB TYR 70 28.329 2.259 -21.202
518 HD1 TYR 70 HD2 TYR 70 29.064 -0.724 -20.845
519 HD2 TYR 70 HD1 TYR 70 25.994 1.720 -19.201
520 HE1 TYR 70 HE2 TYR 70 27.639 -2.709 -20.569
521 HE2 TYR 70 HE1 TYR 70 24.561 -0.259 -18.920
522 HH TYR 70 HH TYR 70 25.136 -3.172 -20.411
523 H ARG 71 H ARG 71 30.599 3.436 -18.462
524 HA ARG 71 HA ARG 71 32.303 4.834 -20.403
525 HB2 ARG 71 2HB ARG 71 29.889 5.788 -20.066
526 HB3 ARG 71 3HB ARG 71 30.542 6.401 -18.553
527 HG2 ARG 71 2HG ARG 71 31.951 7.879 -19.599
528 HG3 ARG 71 3HG ARG 71 32.015 6.932 -21.086
529 HD2 ARG 71 2HD ARG 71 29.394 7.558 -21.029
530 HD3 ARG 71 3HD ARG 71 30.067 8.965 -20.206
531 HE ARG 71 HE ARG 71 30.215 8.394 -22.979
532 HH11 ARG 71 1HH1 ARG 71 32.029 9.768 -20.345
533 HH12 ARG 71 2HH1 ARG 71 32.963 10.815 -21.362
534 HH21 ARG 71 1HH2 ARG 71 31.438 9.767 -24.329
535 HH22 ARG 71 2HH2 ARG 71 32.625 10.814 -23.628
536 H HIS 72 H HIS 72 33.215 3.144 -18.395
537 HA HIS 72 HA HIS 72 35.095 4.764 -17.087
538 HB2 HIS 72 2HB HIS 72 32.652 4.803 -15.769
539 HB3 HIS 72 3HB HIS 72 33.585 3.602 -14.881
540 HD1 HIS 72 HD1 HIS 72 33.449 7.252 -15.653
541 HD2 HIS 72 HD2 HIS 72 35.778 4.608 -13.453
542 HE1 HIS 72 HE1 HIS 72 34.900 8.692 -14.190
543 H ASN 73 H ASN 73 34.909 2.324 -18.619
544 HA ASN 73 HA ASN 73 36.430 0.593 -16.820
545 HB2 ASN 73 2HB ASN 73 34.355 -0.502 -16.669
546 HB3 ASN 73 3HB ASN 73 33.977 -0.213 -18.365
547 HD21 ASN 73 1HD2 ASN 73 34.481 -1.719 -19.822
548 HD22 ASN 73 2HD2 ASN 73 35.380 -3.157 -19.490
Start of MODEL 13
1 H1 MET 1 H MET 1 1.277 0.688 -4.608
2 HA MET 1 HA MET 1 0.689 1.192 -1.833
3 HB2 MET 1 2HB MET 1 2.788 -0.625 -3.026
4 HB3 MET 1 3HB MET 1 2.188 -0.660 -1.374
5 HG2 MET 1 2HG MET 1 -0.123 -1.009 -2.612
6 HG3 MET 1 3HG MET 1 0.935 -1.638 -3.873
7 HE1 MET 1 3HE MET 1 -1.019 -3.460 -3.175
8 HE2 MET 1 1HE MET 1 -0.694 -4.726 -1.990
9 HE3 MET 1 2HE MET 1 -1.367 -3.182 -1.468
10 H GLY 2 H GLY 2 1.509 2.990 -0.948
11 HA2 GLY 2 2HA GLY 2 3.018 4.601 -0.312
12 HA3 GLY 2 3HA GLY 2 4.192 3.294 -0.341
13 H SER 3 H SER 3 5.877 4.531 -1.122
14 HA SER 3 HA SER 3 5.508 5.808 -3.737
15 HB2 SER 3 2HB SER 3 6.692 6.824 -1.540
16 HB3 SER 3 3HB SER 3 8.093 6.071 -2.301
17 HG SER 3 HG SER 3 7.845 7.358 -4.054
18 H TRP 4 H TRP 4 5.703 2.910 -3.374
19 HA TRP 4 HA TRP 4 8.331 2.174 -4.332
20 HB2 TRP 4 2HB TRP 4 7.320 0.587 -2.881
21 HB3 TRP 4 3HB TRP 4 5.808 0.615 -3.784
22 HD1 TRP 4 HD1 TRP 4 5.859 -0.611 -6.246
23 HE1 TRP 4 HE1 TRP 4 7.243 -2.627 -7.049
24 HE3 TRP 4 HE3 TRP 4 9.491 -0.586 -2.648
25 HZ2 TRP 4 HZ2 TRP 4 9.567 -4.022 -6.261
26 HZ3 TRP 4 HZ3 TRP 4 11.258 -2.296 -2.744
27 HH2 TRP 4 HH2 TRP 4 11.293 -3.978 -4.514
28 H ALA 5 H ALA 5 5.044 2.382 -5.624
29 HA ALA 5 HA ALA 5 5.492 1.281 -8.142
30 HB1 ALA 5 1HB ALA 5 3.265 1.789 -7.263
31 HB2 ALA 5 2HB ALA 5 3.596 3.514 -7.425
32 HB3 ALA 5 3HB ALA 5 3.508 2.494 -8.861
33 H GLU 6 H GLU 6 5.739 4.675 -7.100
34 HA GLU 6 HA GLU 6 6.469 5.735 -9.593
35 HB2 GLU 6 2HB GLU 6 6.044 6.727 -7.018
36 HB3 GLU 6 3HB GLU 6 7.716 7.132 -7.378
37 HG2 GLU 6 2HG GLU 6 6.169 8.923 -7.995
38 HG3 GLU 6 3HG GLU 6 7.048 8.290 -9.386
39 H PHE 7 H PHE 7 8.474 4.657 -6.864
40 HA PHE 7 HA PHE 7 10.961 5.249 -8.030
41 HB2 PHE 7 2HB PHE 7 9.998 3.648 -5.743
42 HB3 PHE 7 3HB PHE 7 11.558 3.161 -6.398
43 HD1 PHE 7 HD1 PHE 7 9.695 6.106 -5.120
44 HD2 PHE 7 HD2 PHE 7 13.490 4.309 -5.812
45 HE1 PHE 7 HE1 PHE 7 10.781 7.926 -3.870
46 HE2 PHE 7 HE2 PHE 7 14.582 6.125 -4.562
47 HZ PHE 7 HZ PHE 7 13.227 7.936 -3.589
48 H LYS 8 H LYS 8 8.925 2.374 -8.161
49 HA LYS 8 HA LYS 8 10.778 0.687 -9.460
50 HB2 LYS 8 2HB LYS 8 8.762 -0.148 -8.322
51 HB3 LYS 8 3HB LYS 8 7.755 0.624 -9.540
52 HG2 LYS 8 2HG LYS 8 7.864 -1.652 -10.124
53 HG3 LYS 8 3HG LYS 8 8.933 -0.811 -11.249
54 HD2 LYS 8 2HD LYS 8 10.692 -1.995 -10.565
55 HD3 LYS 8 3HD LYS 8 10.361 -1.616 -8.873
56 HE2 LYS 8 2HE LYS 8 8.885 -3.464 -8.662
57 HE3 LYS 8 3HE LYS 8 8.867 -3.735 -10.404
58 HZ1 LYS 8 3HZ LYS 8 11.424 -3.892 -8.970
59 HZ2 LYS 8 1HZ LYS 8 10.923 -4.702 -10.369
60 HZ3 LYS 8 2HZ LYS 8 10.346 -5.191 -8.857
61 H GLN 9 H GLN 9 8.291 2.887 -10.681
62 HA GLN 9 HA GLN 9 8.527 2.204 -13.401
63 HB2 GLN 9 2HB GLN 9 6.976 3.956 -11.889
64 HB3 GLN 9 3HB GLN 9 7.877 5.002 -12.978
65 HG2 GLN 9 2HG GLN 9 6.988 2.918 -14.584
66 HG3 GLN 9 3HG GLN 9 5.633 3.272 -13.514
67 HE21 GLN 9 1HE2 GLN 9 7.823 4.608 -15.894
68 HE22 GLN 9 2HE2 GLN 9 6.832 5.953 -16.333
69 H ARG 10 H ARG 10 9.899 4.977 -11.625
70 HA ARG 10 HA ARG 10 11.415 6.033 -13.699
71 HB2 ARG 10 2HB ARG 10 11.981 6.042 -10.730
72 HB3 ARG 10 3HB ARG 10 12.814 7.050 -11.906
73 HG2 ARG 10 2HG ARG 10 11.149 8.530 -11.982
74 HG3 ARG 10 3HG ARG 10 9.914 7.272 -12.055
75 HD2 ARG 10 2HD ARG 10 9.381 7.914 -9.981
76 HD3 ARG 10 3HD ARG 10 10.836 7.050 -9.485
77 HE ARG 10 HE ARG 10 11.585 9.634 -10.216
78 HH11 ARG 10 1HH1 ARG 10 9.682 8.041 -7.774
79 HH12 ARG 10 2HH1 ARG 10 9.966 9.257 -6.574
80 HH21 ARG 10 1HH2 ARG 10 11.966 11.242 -8.644
81 HH22 ARG 10 2HH2 ARG 10 11.264 11.078 -7.070
82 H LEU 11 H LEU 11 12.316 3.602 -11.275
83 HA LEU 11 HA LEU 11 14.989 3.286 -12.085
84 HB2 LEU 11 2HB LEU 11 13.055 1.779 -10.447
85 HB3 LEU 11 3HB LEU 11 14.393 0.843 -11.110
86 HG LEU 11 HG LEU 11 15.295 3.301 -9.853
87 HD11 LEU 11 1HD1 LEU 11 13.704 3.257 -8.223
88 HD12 LEU 11 2HD1 LEU 11 14.859 2.118 -7.530
89 HD13 LEU 11 3HD1 LEU 11 13.432 1.521 -8.377
90 HD21 LEU 11 3HD2 LEU 11 16.329 0.862 -10.472
91 HD22 LEU 11 1HD2 LEU 11 16.051 0.698 -8.738
92 HD23 LEU 11 2HD2 LEU 11 17.059 2.011 -9.349
93 H ALA 12 H ALA 12 12.007 1.737 -13.151
94 HA ALA 12 HA ALA 12 13.158 -0.266 -14.752
95 HB1 ALA 12 1HB ALA 12 11.023 -0.642 -15.605
96 HB2 ALA 12 2HB ALA 12 10.719 0.016 -13.997
97 HB3 ALA 12 3HB ALA 12 10.547 1.046 -15.417
98 H ALA 13 H ALA 13 12.080 3.023 -15.550
99 HA ALA 13 HA ALA 13 12.679 2.894 -18.302
100 HB1 ALA 13 1HB ALA 13 11.421 4.694 -16.713
101 HB2 ALA 13 2HB ALA 13 12.941 5.530 -17.035
102 HB3 ALA 13 3HB ALA 13 11.921 5.008 -18.375
103 H ILE 14 H ILE 14 14.572 3.958 -15.507
104 HA ILE 14 HA ILE 14 16.793 4.920 -16.959
105 HB ILE 14 HB ILE 14 16.677 3.844 -14.140
106 HG12 ILE 14 2HG1 ILE 14 16.839 6.741 -14.894
107 HG13 ILE 14 3HG1 ILE 14 15.282 5.922 -14.920
108 HG21 ILE 14 1HG2 ILE 14 18.722 5.764 -14.455
109 HG22 ILE 14 2HG2 ILE 14 18.883 4.051 -14.073
110 HG23 ILE 14 3HG2 ILE 14 18.907 4.585 -15.753
111 HD11 ILE 14 3HD1 ILE 14 15.928 5.197 -12.512
112 HD12 ILE 14 1HD1 ILE 14 17.052 6.553 -12.608
113 HD13 ILE 14 2HD1 ILE 14 15.321 6.825 -12.811
114 H LYS 15 H LYS 15 15.979 1.745 -15.661
115 HA LYS 15 HA LYS 15 18.489 0.533 -16.180
116 HB2 LYS 15 2HB LYS 15 16.227 -0.216 -14.845
117 HB3 LYS 15 3HB LYS 15 16.124 -1.214 -16.289
118 HG2 LYS 15 2HG LYS 15 17.726 -2.577 -15.574
119 HG3 LYS 15 3HG LYS 15 18.785 -1.232 -15.143
120 HD2 LYS 15 2HD LYS 15 18.425 -2.140 -13.072
121 HD3 LYS 15 3HD LYS 15 17.091 -0.987 -13.137
122 HE2 LYS 15 2HE LYS 15 15.763 -2.718 -12.668
123 HE3 LYS 15 3HE LYS 15 16.041 -3.238 -14.330
124 HZ1 LYS 15 3HZ LYS 15 18.034 -4.456 -13.439
125 HZ2 LYS 15 1HZ LYS 15 16.531 -5.072 -12.965
126 HZ3 LYS 15 2HZ LYS 15 17.444 -4.145 -11.884
127 H THR 16 H THR 16 15.471 0.730 -18.019
128 HA THR 16 HA THR 16 16.221 -0.957 -20.137
129 HB THR 16 HB THR 16 14.396 1.423 -20.446
130 HG1 THR 16 HG1 THR 16 13.033 0.494 -19.126
131 HG21 THR 16 3HG2 THR 16 14.478 -1.314 -21.718
132 HG22 THR 16 1HG2 THR 16 14.863 0.221 -22.494
133 HG23 THR 16 2HG2 THR 16 13.210 -0.119 -21.984
134 H ARG 17 H ARG 17 16.291 2.604 -19.932
135 HA ARG 17 HA ARG 17 17.540 3.003 -22.424
136 HB2 ARG 17 2HB ARG 17 16.888 4.631 -20.066
137 HB3 ARG 17 3HB ARG 17 18.300 5.185 -20.956
138 HG2 ARG 17 2HG ARG 17 16.615 6.356 -21.981
139 HG3 ARG 17 3HG ARG 17 16.748 4.944 -23.031
140 HD2 ARG 17 2HD ARG 17 14.576 4.598 -22.703
141 HD3 ARG 17 3HD ARG 17 14.960 4.192 -21.031
142 HE ARG 17 HE ARG 17 14.101 6.216 -20.370
143 HH11 ARG 17 1HH1 ARG 17 14.523 6.202 -23.826
144 HH12 ARG 17 2HH1 ARG 17 13.668 7.690 -24.067
145 HH21 ARG 17 1HH2 ARG 17 12.973 8.175 -20.675
146 HH22 ARG 17 2HH2 ARG 17 12.788 8.811 -22.274
147 H CYS 18 H CYS 18 18.800 2.355 -19.225
148 HA CYS 18 HA CYS 18 21.504 3.032 -19.804
149 HB2 CYS 18 2HB CYS 18 20.976 3.029 -17.519
150 HB3 CYS 18 3HB CYS 18 20.150 1.479 -17.616
151 HG CYS 18 HG CYS 18 22.195 -0.047 -17.153
152 H GLN 19 H GLN 19 19.631 0.045 -19.916
153 HA GLN 19 HA GLN 19 21.846 -1.648 -20.492
154 HB2 GLN 19 2HB GLN 19 18.880 -2.037 -20.917
155 HB3 GLN 19 3HB GLN 19 20.086 -3.295 -21.152
156 HG2 GLN 19 2HG GLN 19 20.392 -2.094 -18.563
157 HG3 GLN 19 3HG GLN 19 18.733 -2.642 -18.799
158 HE21 GLN 19 1HE2 GLN 19 22.094 -3.623 -18.778
159 HE22 GLN 19 2HE2 GLN 19 21.801 -5.306 -18.519
160 H ALA 20 H ALA 20 19.529 0.131 -22.451
161 HA ALA 20 HA ALA 20 20.461 -1.018 -24.927
162 HB1 ALA 20 1HB ALA 20 18.864 0.388 -26.003
163 HB2 ALA 20 2HB ALA 20 18.109 -0.255 -24.545
164 HB3 ALA 20 3HB ALA 20 18.706 1.404 -24.570
165 H LEU 21 H LEU 21 21.099 1.830 -23.013
166 HA LEU 21 HA LEU 21 22.527 3.587 -23.266
167 HB2 LEU 21 2HB LEU 21 23.985 1.383 -24.697
168 HB3 LEU 21 3HB LEU 21 24.692 2.979 -24.456
169 HG LEU 21 HG LEU 21 23.855 2.178 -21.919
170 HD11 LEU 21 1HD1 LEU 21 23.648 -0.114 -22.995
171 HD12 LEU 21 2HD1 LEU 21 24.662 0.002 -21.557
172 HD13 LEU 21 3HD1 LEU 21 25.404 -0.080 -23.155
173 HD21 LEU 21 3HD2 LEU 21 26.112 2.379 -21.370
174 HD22 LEU 21 1HD2 LEU 21 25.932 3.420 -22.783
175 HD23 LEU 21 2HD2 LEU 21 26.647 1.816 -22.954
176 H GLY 22 H GLY 22 20.408 3.243 -25.287
177 HA2 GLY 22 2HA GLY 22 21.629 4.251 -27.737
178 HA3 GLY 22 3HA GLY 22 19.938 3.829 -27.514
179 H GLY 23 H GLY 23 20.229 5.509 -24.896
180 HA2 GLY 23 2HA GLY 23 18.877 7.767 -25.731
181 HA3 GLY 23 3HA GLY 23 19.812 7.673 -24.246
182 H SER 24 H SER 24 22.005 8.352 -24.261
183 HA SER 24 HA SER 24 23.140 9.546 -26.615
184 HB2 SER 24 2HB SER 24 22.381 11.377 -24.327
185 HB3 SER 24 3HB SER 24 23.209 11.838 -25.814
186 HG SER 24 HG SER 24 21.142 12.307 -26.242
187 H GLU 25 H GLU 25 25.320 10.236 -26.307
188 HA GLU 25 HA GLU 25 26.809 8.636 -24.565
189 HB2 GLU 25 2HB GLU 25 27.790 11.231 -25.744
190 HB3 GLU 25 3HB GLU 25 28.734 9.806 -25.334
191 HG2 GLU 25 2HG GLU 25 27.468 8.573 -27.109
192 HG3 GLU 25 3HG GLU 25 26.776 10.120 -27.591
193 H ALA 26 H ALA 26 25.615 11.922 -24.232
194 HA ALA 26 HA ALA 26 27.038 12.345 -21.742
195 HB1 ALA 26 1HB ALA 26 26.051 14.542 -21.747
196 HB2 ALA 26 2HB ALA 26 26.685 14.187 -23.355
197 HB3 ALA 26 3HB ALA 26 24.951 14.085 -23.048
198 H GLU 27 H GLU 27 23.775 11.604 -22.826
199 HA GLU 27 HA GLU 27 22.310 12.070 -20.541
200 HB2 GLU 27 2HB GLU 27 22.078 10.143 -22.797
201 HB3 GLU 27 3HB GLU 27 21.070 9.862 -21.384
202 HG2 GLU 27 2HG GLU 27 21.141 12.564 -22.645
203 HG3 GLU 27 3HG GLU 27 20.171 11.278 -23.361
204 H CYS 28 H CYS 28 24.462 9.391 -21.267
205 HA CYS 28 HA CYS 28 23.782 7.577 -19.310
206 HB2 CYS 28 2HB CYS 28 26.607 8.271 -20.136
207 HB3 CYS 28 3HB CYS 28 26.058 6.749 -19.445
208 HG CYS 28 HG CYS 28 26.519 6.178 -22.075
209 H ALA 29 H ALA 29 25.919 10.393 -19.018
210 HA ALA 29 HA ALA 29 26.792 10.029 -16.412
211 HB1 ALA 29 1HB ALA 29 26.196 12.620 -17.836
212 HB2 ALA 29 2HB ALA 29 27.148 12.463 -16.359
213 HB3 ALA 29 3HB ALA 29 27.722 11.735 -17.859
214 H ALA 30 H ALA 30 23.979 11.935 -17.502
215 HA ALA 30 HA ALA 30 23.021 12.673 -15.002
216 HB1 ALA 30 1HB ALA 30 21.125 13.399 -16.073
217 HB2 ALA 30 2HB ALA 30 22.257 13.316 -17.424
218 HB3 ALA 30 3HB ALA 30 21.086 12.021 -17.174
219 H PHE 31 H PHE 31 22.593 9.679 -16.791
220 HA PHE 31 HA PHE 31 20.533 8.577 -15.220
221 HB2 PHE 31 2HB PHE 31 22.418 7.624 -17.258
222 HB3 PHE 31 3HB PHE 31 21.949 6.391 -16.092
223 HD1 PHE 31 HD1 PHE 31 19.819 9.180 -17.234
224 HD2 PHE 31 HD2 PHE 31 20.652 5.014 -17.500
225 HE1 PHE 31 HE1 PHE 31 17.708 8.838 -18.453
226 HE2 PHE 31 HE2 PHE 31 18.544 4.666 -18.719
227 HZ PHE 31 HZ PHE 31 17.069 6.579 -19.198
228 H GLU 32 H GLU 32 24.061 8.130 -15.065
229 HA GLU 32 HA GLU 32 24.132 6.390 -12.893
230 HB2 GLU 32 2HB GLU 32 26.115 6.734 -14.181
231 HB3 GLU 32 3HB GLU 32 26.114 8.458 -13.837
232 HG2 GLU 32 2HG GLU 32 26.182 6.960 -11.391
233 HG3 GLU 32 3HG GLU 32 27.478 6.442 -12.468
234 H LYS 33 H LYS 33 24.261 9.938 -12.944
235 HA LYS 33 HA LYS 33 24.571 10.344 -10.195
236 HB2 LYS 33 2HB LYS 33 23.852 11.949 -12.522
237 HB3 LYS 33 3HB LYS 33 23.040 12.488 -11.058
238 HG2 LYS 33 2HG LYS 33 24.906 13.369 -10.225
239 HG3 LYS 33 3HG LYS 33 25.865 11.945 -10.637
240 HD2 LYS 33 2HD LYS 33 26.268 12.727 -12.826
241 HD3 LYS 33 3HD LYS 33 25.010 13.959 -12.702
242 HE2 LYS 33 2HE LYS 33 26.351 15.090 -10.957
243 HE3 LYS 33 3HE LYS 33 27.624 13.894 -11.197
244 HZ1 LYS 33 3HZ LYS 33 26.820 15.093 -13.655
245 HZ2 LYS 33 1HZ LYS 33 28.362 14.980 -12.970
246 HZ3 LYS 33 2HZ LYS 33 27.340 16.258 -12.544
247 H GLU 34 H GLU 34 21.593 10.282 -12.148
248 HA GLU 34 HA GLU 34 19.751 10.753 -10.142
249 HB2 GLU 34 2HB GLU 34 19.673 9.953 -12.834
250 HB3 GLU 34 3HB GLU 34 18.757 8.737 -11.954
251 HG2 GLU 34 2HG GLU 34 18.278 11.698 -11.731
252 HG3 GLU 34 3HG GLU 34 17.399 10.627 -12.821
253 H ILE 35 H ILE 35 21.066 7.630 -11.216
254 HA ILE 35 HA ILE 35 19.615 5.997 -9.473
255 HB ILE 35 HB ILE 35 22.380 5.580 -10.612
256 HG12 ILE 35 2HG1 ILE 35 20.520 5.843 -12.254
257 HG13 ILE 35 3HG1 ILE 35 21.272 4.252 -12.302
258 HG21 ILE 35 1HG2 ILE 35 22.462 3.958 -9.046
259 HG22 ILE 35 2HG2 ILE 35 20.714 3.934 -8.825
260 HG23 ILE 35 3HG2 ILE 35 21.440 3.092 -10.193
261 HD11 ILE 35 3HD1 ILE 35 19.329 3.273 -11.925
262 HD12 ILE 35 1HD1 ILE 35 19.070 4.237 -10.472
263 HD13 ILE 35 2HD1 ILE 35 18.559 4.855 -12.043
264 H ALA 36 H ALA 36 22.783 7.542 -9.058
265 HA ALA 36 HA ALA 36 23.483 6.462 -6.598
266 HB1 ALA 36 1HB ALA 36 24.547 8.925 -6.390
267 HB2 ALA 36 2HB ALA 36 25.237 7.641 -7.384
268 HB3 ALA 36 3HB ALA 36 24.216 8.876 -8.122
269 H ALA 37 H ALA 37 21.620 9.414 -7.282
270 HA ALA 37 HA ALA 37 21.203 10.121 -4.576
271 HB1 ALA 37 1HB ALA 37 20.203 11.000 -7.194
272 HB2 ALA 37 2HB ALA 37 19.101 11.268 -5.843
273 HB3 ALA 37 3HB ALA 37 20.729 11.945 -5.800
274 H PHE 38 H PHE 38 19.457 8.058 -6.815
275 HA PHE 38 HA PHE 38 17.058 7.797 -5.395
276 HB2 PHE 38 2HB PHE 38 18.337 6.520 -7.641
277 HB3 PHE 38 3HB PHE 38 17.572 5.311 -6.615
278 HD1 PHE 38 HD1 PHE 38 16.705 8.752 -7.781
279 HD2 PHE 38 HD2 PHE 38 15.495 4.695 -7.343
280 HE1 PHE 38 HE1 PHE 38 14.522 9.299 -8.776
281 HE2 PHE 38 HE2 PHE 38 13.311 5.236 -8.338
282 HZ PHE 38 HZ PHE 38 12.822 7.540 -9.056
283 H GLU 39 H GLU 39 19.905 5.648 -5.388
284 HA GLU 39 HA GLU 39 18.964 3.961 -3.337
285 HB2 GLU 39 2HB GLU 39 21.305 3.191 -3.174
286 HB3 GLU 39 3HB GLU 39 20.733 3.249 -4.835
287 HG2 GLU 39 2HG GLU 39 21.887 5.397 -5.137
288 HG3 GLU 39 3HG GLU 39 22.499 5.279 -3.489
289 H SER 40 H SER 40 20.958 6.873 -3.291
290 HA SER 40 HA SER 40 21.637 6.762 -0.547
291 HB2 SER 40 2HB SER 40 22.604 8.856 -0.848
292 HB3 SER 40 3HB SER 40 22.627 8.214 -2.491
293 HG SER 40 HG SER 40 20.831 10.089 -1.364
294 H GLU 41 H GLU 41 18.850 7.942 -2.277
295 HA GLU 41 HA GLU 41 17.783 9.394 -0.026
296 HB2 GLU 41 2HB GLU 41 16.922 8.829 -2.817
297 HB3 GLU 41 3HB GLU 41 15.668 9.215 -1.647
298 HG2 GLU 41 2HG GLU 41 18.080 10.958 -1.964
299 HG3 GLU 41 3HG GLU 41 16.685 11.117 -3.029
300 H LEU 42 H LEU 42 17.423 6.218 -1.450
301 HA LEU 42 HA LEU 42 15.096 5.494 0.044
302 HB2 LEU 42 2HB LEU 42 17.124 3.889 -1.493
303 HB3 LEU 42 3HB LEU 42 15.741 3.162 -0.678
304 HG LEU 42 HG LEU 42 15.219 5.338 -2.637
305 HD11 LEU 42 1HD1 LEU 42 16.080 2.548 -3.366
306 HD12 LEU 42 2HD1 LEU 42 16.780 4.075 -3.904
307 HD13 LEU 42 3HD1 LEU 42 15.171 3.603 -4.448
308 HD21 LEU 42 3HD2 LEU 42 13.812 2.719 -2.166
309 HD22 LEU 42 1HD2 LEU 42 13.194 4.153 -2.986
310 HD23 LEU 42 2HD2 LEU 42 13.469 4.183 -1.244
311 H GLN 43 H GLN 43 18.558 5.209 0.517
312 HA GLN 43 HA GLN 43 18.466 3.391 2.687
313 HB2 GLN 43 2HB GLN 43 20.765 3.852 2.989
314 HB3 GLN 43 3HB GLN 43 20.483 3.976 1.258
315 HG2 GLN 43 2HG GLN 43 21.426 5.972 1.306
316 HG3 GLN 43 3HG GLN 43 20.065 6.546 2.268
317 HE21 GLN 43 1HE2 GLN 43 20.652 7.554 4.036
318 HE22 GLN 43 2HE2 GLN 43 22.053 7.220 4.991
319 H ALA 44 H ALA 44 17.774 6.731 2.416
320 HA ALA 44 HA ALA 44 18.312 7.444 5.138
321 HB1 ALA 44 1HB ALA 44 18.122 8.960 3.027
322 HB2 ALA 44 2HB ALA 44 16.402 8.967 3.420
323 HB3 ALA 44 3HB ALA 44 17.577 9.560 4.594
324 H TYR 45 H TYR 45 15.705 5.932 3.471
325 HA TYR 45 HA TYR 45 13.542 6.612 5.107
326 HB2 TYR 45 2HB TYR 45 14.153 4.217 3.396
327 HB3 TYR 45 3HB TYR 45 12.682 4.283 4.360
328 HD1 TYR 45 HD2 TYR 45 11.802 7.028 4.109
329 HD2 TYR 45 HD1 TYR 45 13.556 4.493 1.177
330 HE1 TYR 45 HE2 TYR 45 10.693 8.322 2.335
331 HE2 TYR 45 HE1 TYR 45 12.454 5.780 -0.605
332 HH TYR 45 HH TYR 45 11.279 8.728 -0.286
333 H LYS 46 H LYS 46 15.360 3.542 5.199
334 HA LYS 46 HA LYS 46 15.873 3.548 7.943
335 HB2 LYS 46 2HB LYS 46 13.179 3.162 7.502
336 HB3 LYS 46 3HB LYS 46 13.783 1.517 7.656
337 HG2 LYS 46 2HG LYS 46 14.263 3.707 9.665
338 HG3 LYS 46 3HG LYS 46 12.992 2.487 9.785
339 HD2 LYS 46 2HD LYS 46 15.067 0.860 9.433
340 HD3 LYS 46 3HD LYS 46 15.928 2.226 10.147
341 HE2 LYS 46 2HE LYS 46 13.475 0.981 11.372
342 HE3 LYS 46 3HE LYS 46 15.118 0.485 11.773
343 HZ1 LYS 46 3HZ LYS 46 14.660 2.032 13.391
344 HZ2 LYS 46 1HZ LYS 46 13.754 3.024 12.362
345 HZ3 LYS 46 2HZ LYS 46 15.440 2.993 12.237
346 H GLY 47 H GLY 47 14.961 1.496 5.200
347 HA2 GLY 47 2HA GLY 47 16.195 -0.182 4.187
348 HA3 GLY 47 3HA GLY 47 17.470 0.092 5.366
349 H LYS 48 H LYS 48 16.574 -0.507 7.721
350 HA LYS 48 HA LYS 48 16.235 -3.329 7.668
351 HB2 LYS 48 2HB LYS 48 16.478 -1.236 9.765
352 HB3 LYS 48 3HB LYS 48 15.754 -2.767 10.240
353 HG2 LYS 48 2HG LYS 48 18.392 -2.630 8.818
354 HG3 LYS 48 3HG LYS 48 18.258 -2.504 10.573
355 HD2 LYS 48 2HD LYS 48 17.682 -4.691 10.823
356 HD3 LYS 48 3HD LYS 48 16.845 -4.760 9.270
357 HE2 LYS 48 2HE LYS 48 18.644 -5.967 8.650
358 HE3 LYS 48 3HE LYS 48 19.384 -4.381 8.437
359 HZ1 LYS 48 3HZ LYS 48 19.662 -5.117 11.119
360 HZ2 LYS 48 1HZ LYS 48 20.876 -4.922 9.958
361 HZ3 LYS 48 2HZ LYS 48 20.153 -6.435 10.179
362 H GLY 49 H GLY 49 14.050 -0.672 7.729
363 HA2 GLY 49 2HA GLY 49 11.833 -1.671 9.040
364 HA3 GLY 49 3HA GLY 49 11.755 -0.603 7.647
365 H ASN 50 H ASN 50 12.430 -1.951 5.532
366 HA ASN 50 HA ASN 50 11.146 -4.573 5.566
367 HB2 ASN 50 2HB ASN 50 10.138 -2.163 4.098
368 HB3 ASN 50 3HB ASN 50 9.927 -3.759 3.386
369 HD21 ASN 50 1HD2 ASN 50 8.003 -1.785 4.482
370 HD22 ASN 50 2HD2 ASN 50 7.077 -2.660 5.649
371 HA PRO 51 HA PRO 51 14.201 -5.664 2.612
372 HB2 PRO 51 2HB PRO 51 12.868 -7.431 1.040
373 HB3 PRO 51 3HB PRO 51 13.370 -7.805 2.694
374 HG2 PRO 51 2HG PRO 51 10.690 -6.942 1.676
375 HG3 PRO 51 3HG PRO 51 11.084 -8.198 2.864
376 HD2 PRO 51 2HD PRO 51 10.219 -5.734 3.581
377 HD3 PRO 51 3HD PRO 51 11.353 -6.674 4.572
378 H GLU 52 H GLU 52 11.286 -4.159 1.595
379 HA GLU 52 HA GLU 52 11.462 -4.063 -1.144
380 HB2 GLU 52 2HB GLU 52 10.406 -1.779 -0.948
381 HB3 GLU 52 3HB GLU 52 9.580 -3.070 -0.086
382 HG2 GLU 52 2HG GLU 52 10.786 -2.322 1.983
383 HG3 GLU 52 3HG GLU 52 11.331 -0.918 1.067
384 H VAL 53 H VAL 53 13.066 -1.892 1.172
385 HA VAL 53 HA VAL 53 14.363 -0.242 -0.657
386 HB VAL 53 HB VAL 53 15.312 -1.104 2.079
387 HG11 VAL 53 1HG1 VAL 53 17.151 -0.193 0.783
388 HG12 VAL 53 2HG1 VAL 53 16.180 1.219 0.360
389 HG13 VAL 53 3HG1 VAL 53 16.664 0.949 2.035
390 HG21 VAL 53 3HG2 VAL 53 14.230 0.827 2.929
391 HG22 VAL 53 1HG2 VAL 53 13.904 1.442 1.308
392 HG23 VAL 53 2HG2 VAL 53 13.054 0.013 1.897
393 H GLU 54 H GLU 54 15.165 -3.454 0.466
394 HA GLU 54 HA GLU 54 17.848 -3.520 -0.414
395 HB2 GLU 54 2HB GLU 54 17.842 -5.627 0.383
396 HB3 GLU 54 3HB GLU 54 16.255 -5.209 1.013
397 HG2 GLU 54 2HG GLU 54 15.866 -7.219 -0.039
398 HG3 GLU 54 3HG GLU 54 15.380 -6.047 -1.263
399 H ALA 55 H ALA 55 14.796 -4.008 -2.032
400 HA ALA 55 HA ALA 55 15.851 -5.253 -4.368
401 HB1 ALA 55 1HB ALA 55 13.239 -3.945 -3.701
402 HB2 ALA 55 2HB ALA 55 13.602 -4.472 -5.345
403 HB3 ALA 55 3HB ALA 55 13.582 -5.644 -4.028
404 H LEU 56 H LEU 56 14.672 -1.941 -3.757
405 HA LEU 56 HA LEU 56 15.411 -0.887 -6.246
406 HB2 LEU 56 2HB LEU 56 14.826 0.278 -3.564
407 HB3 LEU 56 3HB LEU 56 15.499 1.313 -4.821
408 HG LEU 56 HG LEU 56 13.584 0.939 -6.229
409 HD11 LEU 56 1HD1 LEU 56 12.946 -1.159 -4.209
410 HD12 LEU 56 2HD1 LEU 56 12.885 -1.233 -5.969
411 HD13 LEU 56 3HD1 LEU 56 11.634 -0.365 -5.080
412 HD21 LEU 56 3HD2 LEU 56 12.747 1.539 -3.393
413 HD22 LEU 56 1HD2 LEU 56 11.829 1.937 -4.846
414 HD23 LEU 56 2HD2 LEU 56 13.394 2.699 -4.556
415 H ARG 57 H ARG 57 17.190 -1.196 -3.220
416 HA ARG 57 HA ARG 57 19.422 0.366 -3.978
417 HB2 ARG 57 2HB ARG 57 18.837 -0.302 -1.634
418 HB3 ARG 57 3HB ARG 57 19.378 -1.931 -2.017
419 HG2 ARG 57 2HG ARG 57 21.279 -1.136 -1.078
420 HG3 ARG 57 3HG ARG 57 21.569 -0.630 -2.743
421 HD2 ARG 57 2HD ARG 57 21.641 1.498 -2.116
422 HD3 ARG 57 3HD ARG 57 20.026 1.371 -1.420
423 HE ARG 57 HE ARG 57 21.551 0.283 0.499
424 HH11 ARG 57 1HH1 ARG 57 21.844 3.243 -1.310
425 HH12 ARG 57 2HH1 ARG 57 22.640 4.099 -0.031
426 HH21 ARG 57 1HH2 ARG 57 22.598 1.399 2.191
427 HH22 ARG 57 2HH2 ARG 57 23.069 3.049 1.960
428 H LYS 58 H LYS 58 18.746 -3.106 -4.172
429 HA LYS 58 HA LYS 58 21.259 -3.917 -5.124
430 HB2 LYS 58 2HB LYS 58 19.483 -5.436 -4.250
431 HB3 LYS 58 3HB LYS 58 18.580 -5.177 -5.736
432 HG2 LYS 58 2HG LYS 58 19.750 -6.729 -6.796
433 HG3 LYS 58 3HG LYS 58 21.278 -5.982 -6.324
434 HD2 LYS 58 2HD LYS 58 19.645 -7.806 -4.560
435 HD3 LYS 58 3HD LYS 58 21.026 -8.323 -5.530
436 HE2 LYS 58 2HE LYS 58 22.275 -6.413 -4.282
437 HE3 LYS 58 3HE LYS 58 20.955 -6.550 -3.121
438 HZ1 LYS 58 3HZ LYS 58 21.612 -9.095 -3.352
439 HZ2 LYS 58 1HZ LYS 58 22.352 -8.065 -2.232
440 HZ3 LYS 58 2HZ LYS 58 23.120 -8.411 -3.699
441 H GLU 59 H GLU 59 18.251 -3.347 -6.960
442 HA GLU 59 HA GLU 59 19.312 -3.672 -9.507
443 HB2 GLU 59 2HB GLU 59 17.060 -1.876 -8.591
444 HB3 GLU 59 3HB GLU 59 17.406 -2.253 -10.273
445 HG2 GLU 59 2HG GLU 59 16.957 -4.596 -9.875
446 HG3 GLU 59 3HG GLU 59 16.696 -4.276 -8.161
447 H ALA 60 H ALA 60 18.896 -0.652 -7.665
448 HA ALA 60 HA ALA 60 19.925 1.138 -9.493
449 HB1 ALA 60 1HB ALA 60 18.969 2.096 -7.608
450 HB2 ALA 60 2HB ALA 60 19.912 1.099 -6.500
451 HB3 ALA 60 3HB ALA 60 20.689 2.414 -7.382
452 H ALA 61 H ALA 61 21.724 -0.611 -6.962
453 HA ALA 61 HA ALA 61 24.260 0.370 -7.512
454 HB1 ALA 61 1HB ALA 61 25.021 -1.912 -6.596
455 HB2 ALA 61 2HB ALA 61 24.067 -0.862 -5.547
456 HB3 ALA 61 3HB ALA 61 23.301 -2.226 -6.363
457 H ALA 62 H ALA 62 22.605 -2.442 -8.912
458 HA ALA 62 HA ALA 62 24.695 -3.388 -10.500
459 HB1 ALA 62 1HB ALA 62 23.197 -4.909 -11.136
460 HB2 ALA 62 2HB ALA 62 22.063 -4.096 -10.058
461 HB3 ALA 62 3HB ALA 62 22.102 -3.681 -11.771
462 H ILE 63 H ILE 63 22.137 -1.045 -11.271
463 HA ILE 63 HA ILE 63 22.832 -0.606 -13.946
464 HB ILE 63 HB ILE 63 21.597 1.354 -12.008
465 HG12 ILE 63 2HG1 ILE 63 19.917 -0.001 -14.010
466 HG13 ILE 63 3HG1 ILE 63 20.583 -1.068 -12.778
467 HG21 ILE 63 1HG2 ILE 63 21.581 2.834 -13.659
468 HG22 ILE 63 2HG2 ILE 63 22.490 1.709 -14.665
469 HG23 ILE 63 3HG2 ILE 63 20.727 1.694 -14.698
470 HD11 ILE 63 3HD1 ILE 63 18.996 -0.427 -11.388
471 HD12 ILE 63 1HD1 ILE 63 19.592 1.231 -11.468
472 HD13 ILE 63 2HD1 ILE 63 18.361 0.681 -12.605
473 H ARG 64 H ARG 64 23.899 1.032 -10.987
474 HA ARG 64 HA ARG 64 25.443 3.031 -12.181
475 HB2 ARG 64 2HB ARG 64 24.943 3.197 -9.854
476 HB3 ARG 64 3HB ARG 64 25.687 1.640 -9.517
477 HG2 ARG 64 2HG ARG 64 27.121 3.412 -8.748
478 HG3 ARG 64 3HG ARG 64 27.881 2.586 -10.110
479 HD2 ARG 64 2HD ARG 64 28.060 4.525 -11.174
480 HD3 ARG 64 3HD ARG 64 26.304 4.687 -11.161
481 HE ARG 64 HE ARG 64 26.541 6.308 -9.583
482 HH11 ARG 64 1HH1 ARG 64 29.367 4.276 -9.501
483 HH12 ARG 64 2HH1 ARG 64 30.180 5.232 -8.307
484 HH21 ARG 64 1HH2 ARG 64 27.602 7.576 -8.011
485 HH22 ARG 64 2HH2 ARG 64 29.175 7.108 -7.459
486 H ASP 65 H ASP 65 26.371 -0.219 -11.087
487 HA ASP 65 HA ASP 65 29.092 -0.062 -11.707
488 HB2 ASP 65 2HB ASP 65 27.190 -2.401 -11.581
489 HB3 ASP 65 3HB ASP 65 28.912 -2.601 -11.896
490 H GLU 66 H GLU 66 26.344 -1.113 -13.686
491 HA GLU 66 HA GLU 66 27.794 -1.933 -15.937
492 HB2 GLU 66 2HB GLU 66 25.029 -0.710 -15.887
493 HB3 GLU 66 3HB GLU 66 25.705 -1.706 -17.168
494 HG2 GLU 66 2HG GLU 66 25.332 -3.626 -16.062
495 HG3 GLU 66 3HG GLU 66 25.699 -2.919 -14.490
496 H CYS 67 H CYS 67 26.341 1.218 -15.166
497 HA CYS 67 HA CYS 67 27.014 2.546 -17.521
498 HB2 CYS 67 2HB CYS 67 26.696 3.585 -14.702
499 HB3 CYS 67 3HB CYS 67 26.896 4.631 -16.103
500 HG CYS 67 HG CYS 67 24.488 4.345 -17.133
501 H GLN 68 H GLN 68 28.863 2.128 -14.532
502 HA GLN 68 HA GLN 68 31.049 3.752 -15.321
503 HB2 GLN 68 2HB GLN 68 30.847 1.545 -13.268
504 HB3 GLN 68 3HB GLN 68 32.257 2.577 -13.467
505 HG2 GLN 68 2HG GLN 68 30.793 4.542 -13.014
506 HG3 GLN 68 3HG GLN 68 29.491 3.414 -12.638
507 HE21 GLN 68 1HE2 GLN 68 31.693 5.329 -11.266
508 HE22 GLN 68 2HE2 GLN 68 31.979 4.480 -9.789
509 H ALA 69 H ALA 69 30.217 0.404 -15.833
510 HA ALA 69 HA ALA 69 32.838 -0.345 -16.770
511 HB1 ALA 69 1HB ALA 69 30.197 -1.795 -16.885
512 HB2 ALA 69 2HB ALA 69 31.749 -2.481 -17.368
513 HB3 ALA 69 3HB ALA 69 31.475 -2.015 -15.689
514 H TYR 70 H TYR 70 30.348 1.426 -18.078
515 HA TYR 70 HA TYR 70 30.866 0.537 -20.824
516 HB2 TYR 70 2HB TYR 70 28.747 2.395 -19.727
517 HB3 TYR 70 3HB TYR 70 28.914 1.942 -21.419
518 HD1 TYR 70 HD2 TYR 70 29.673 -1.001 -20.785
519 HD2 TYR 70 HD1 TYR 70 26.515 1.536 -19.483
520 HE1 TYR 70 HE2 TYR 70 28.255 -2.974 -20.400
521 HE2 TYR 70 HE1 TYR 70 25.089 -0.430 -19.093
522 HH TYR 70 HH TYR 70 26.253 -3.712 -19.797
523 H ARG 71 H ARG 71 31.065 3.348 -18.712
524 HA ARG 71 HA ARG 71 32.855 4.608 -20.668
525 HB2 ARG 71 2HB ARG 71 30.346 5.519 -20.424
526 HB3 ARG 71 3HB ARG 71 31.086 6.402 -19.096
527 HG2 ARG 71 2HG ARG 71 32.762 7.301 -20.665
528 HG3 ARG 71 3HG ARG 71 31.933 6.471 -21.984
529 HD2 ARG 71 2HD ARG 71 30.374 8.060 -22.123
530 HD3 ARG 71 3HD ARG 71 30.112 8.055 -20.379
531 HE ARG 71 HE ARG 71 32.523 9.397 -21.173
532 HH11 ARG 71 1HH1 ARG 71 29.092 9.732 -20.690
533 HH12 ARG 71 2HH1 ARG 71 29.162 11.445 -20.438
534 HH21 ARG 71 1HH2 ARG 71 32.629 11.652 -20.844
535 HH22 ARG 71 2HH2 ARG 71 31.175 12.536 -20.527
536 H HIS 72 H HIS 72 33.705 3.132 -18.500
537 HA HIS 72 HA HIS 72 35.447 4.908 -17.211
538 HB2 HIS 72 2HB HIS 72 32.940 5.002 -16.051
539 HB3 HIS 72 3HB HIS 72 33.810 3.862 -15.027
540 HD1 HIS 72 HD1 HIS 72 36.467 4.984 -14.599
541 HD2 HIS 72 HD2 HIS 72 33.144 7.451 -14.956
542 HE1 HIS 72 HE1 HIS 72 37.116 7.149 -13.496
543 H ASN 73 H ASN 73 35.437 2.358 -18.553
544 HA ASN 73 HA ASN 73 36.880 0.818 -16.530
545 HB2 ASN 73 2HB ASN 73 34.822 -0.325 -16.444
546 HB3 ASN 73 3HB ASN 73 34.575 -0.191 -18.183
547 HD21 ASN 73 1HD2 ASN 73 34.749 -2.061 -19.158
548 HD22 ASN 73 2HD2 ASN 73 35.850 -3.329 -18.753
Start of MODEL 14
1 H1 MET 1 H MET 1 1.329 -1.159 -2.744
2 HA MET 1 HA MET 1 2.249 -0.687 -0.525
3 HB2 MET 1 2HB MET 1 4.512 -1.146 -2.470
4 HB3 MET 1 3HB MET 1 4.451 -1.623 -0.778
5 HG2 MET 1 2HG MET 1 2.567 -3.139 -1.335
6 HG3 MET 1 3HG MET 1 2.798 -2.731 -3.033
7 HE1 MET 1 3HE MET 1 5.266 -2.578 -3.880
8 HE2 MET 1 1HE MET 1 6.392 -3.925 -3.707
9 HE3 MET 1 2HE MET 1 4.871 -4.153 -4.569
10 H GLY 2 H GLY 2 1.683 1.848 -1.209
11 HA2 GLY 2 2HA GLY 2 2.390 3.949 -0.528
12 HA3 GLY 2 3HA GLY 2 3.975 3.270 -0.186
13 H SER 3 H SER 3 5.523 4.157 -1.360
14 HA SER 3 HA SER 3 4.852 5.203 -4.023
15 HB2 SER 3 2HB SER 3 6.931 5.948 -1.987
16 HB3 SER 3 3HB SER 3 7.158 6.372 -3.684
17 HG SER 3 HG SER 3 5.019 7.362 -3.529
18 H TRP 4 H TRP 4 5.427 2.383 -3.398
19 HA TRP 4 HA TRP 4 8.058 1.782 -4.335
20 HB2 TRP 4 2HB TRP 4 7.032 0.162 -2.927
21 HB3 TRP 4 3HB TRP 4 5.581 0.109 -3.925
22 HD1 TRP 4 HD1 TRP 4 5.875 -1.105 -6.387
23 HE1 TRP 4 HE1 TRP 4 7.396 -3.065 -7.071
24 HE3 TRP 4 HE3 TRP 4 9.205 -0.937 -2.513
25 HZ2 TRP 4 HZ2 TRP 4 9.702 -4.369 -6.096
26 HZ3 TRP 4 HZ3 TRP 4 11.040 -2.576 -2.462
27 HH2 TRP 4 HH2 TRP 4 11.281 -4.256 -4.218
28 H ALA 5 H ALA 5 4.829 1.731 -5.805
29 HA ALA 5 HA ALA 5 5.501 0.683 -8.290
30 HB1 ALA 5 1HB ALA 5 3.515 2.664 -8.691
31 HB2 ALA 5 2HB ALA 5 3.312 0.917 -8.548
32 HB3 ALA 5 3HB ALA 5 3.240 1.934 -7.109
33 H GLU 6 H GLU 6 5.435 4.083 -7.246
34 HA GLU 6 HA GLU 6 6.209 5.201 -9.701
35 HB2 GLU 6 2HB GLU 6 5.741 6.114 -7.033
36 HB3 GLU 6 3HB GLU 6 7.258 6.797 -7.600
37 HG2 GLU 6 2HG GLU 6 5.877 8.394 -8.384
38 HG3 GLU 6 3HG GLU 6 5.769 7.286 -9.750
39 H PHE 7 H PHE 7 8.144 4.261 -6.874
40 HA PHE 7 HA PHE 7 10.637 5.048 -7.901
41 HB2 PHE 7 2HB PHE 7 9.662 3.431 -5.654
42 HB3 PHE 7 3HB PHE 7 11.243 2.938 -6.251
43 HD1 PHE 7 HD1 PHE 7 9.317 5.731 -4.818
44 HD2 PHE 7 HD2 PHE 7 13.171 4.267 -5.878
45 HE1 PHE 7 HE1 PHE 7 10.358 7.571 -3.560
46 HE2 PHE 7 HE2 PHE 7 14.218 6.103 -4.620
47 HZ PHE 7 HZ PHE 7 12.812 7.758 -3.458
48 H LYS 8 H LYS 8 8.864 2.001 -8.114
49 HA LYS 8 HA LYS 8 10.903 0.493 -9.347
50 HB2 LYS 8 2HB LYS 8 8.072 0.181 -8.749
51 HB3 LYS 8 3HB LYS 8 8.502 -0.549 -10.290
52 HG2 LYS 8 2HG LYS 8 9.878 -1.112 -7.672
53 HG3 LYS 8 3HG LYS 8 8.635 -2.126 -8.408
54 HD2 LYS 8 2HD LYS 8 11.101 -1.400 -9.942
55 HD3 LYS 8 3HD LYS 8 11.137 -2.716 -8.767
56 HE2 LYS 8 2HE LYS 8 9.148 -3.689 -9.968
57 HE3 LYS 8 3HE LYS 8 9.409 -2.478 -11.222
58 HZ1 LYS 8 3HZ LYS 8 10.468 -4.843 -11.402
59 HZ2 LYS 8 1HZ LYS 8 11.665 -4.168 -10.415
60 HZ3 LYS 8 2HZ LYS 8 11.322 -3.477 -11.920
61 H GLN 9 H GLN 9 8.308 2.502 -10.659
62 HA GLN 9 HA GLN 9 8.690 1.849 -13.371
63 HB2 GLN 9 2HB GLN 9 6.941 3.443 -11.934
64 HB3 GLN 9 3HB GLN 9 7.832 4.600 -12.914
65 HG2 GLN 9 2HG GLN 9 7.030 3.759 -14.888
66 HG3 GLN 9 3HG GLN 9 6.735 2.158 -14.211
67 HE21 GLN 9 1HE2 GLN 9 5.053 4.174 -15.705
68 HE22 GLN 9 2HE2 GLN 9 3.617 4.313 -14.755
69 H ARG 10 H ARG 10 9.847 4.655 -11.500
70 HA ARG 10 HA ARG 10 11.334 5.863 -13.513
71 HB2 ARG 10 2HB ARG 10 11.798 5.821 -10.527
72 HB3 ARG 10 3HB ARG 10 12.655 6.879 -11.639
73 HG2 ARG 10 2HG ARG 10 10.933 8.296 -11.812
74 HG3 ARG 10 3HG ARG 10 9.742 6.995 -11.881
75 HD2 ARG 10 2HD ARG 10 9.162 7.663 -9.826
76 HD3 ARG 10 3HD ARG 10 10.627 6.838 -9.298
77 HE ARG 10 HE ARG 10 11.487 8.872 -8.753
78 HH11 ARG 10 1HH1 ARG 10 8.999 9.336 -11.144
79 HH12 ARG 10 2HH1 ARG 10 9.099 11.066 -11.102
80 HH21 ARG 10 1HH2 ARG 10 11.628 11.148 -8.688
81 HH22 ARG 10 2HH2 ARG 10 10.595 12.095 -9.705
82 H LEU 11 H LEU 11 12.345 3.437 -11.124
83 HA LEU 11 HA LEU 11 15.041 3.300 -11.902
84 HB2 LEU 11 2HB LEU 11 13.364 2.036 -10.037
85 HB3 LEU 11 3HB LEU 11 14.075 0.749 -11.007
86 HG LEU 11 HG LEU 11 16.303 1.480 -10.411
87 HD11 LEU 11 1HD1 LEU 11 16.062 3.290 -8.373
88 HD12 LEU 11 2HD1 LEU 11 14.871 3.868 -9.538
89 HD13 LEU 11 3HD1 LEU 11 16.554 3.665 -10.025
90 HD21 LEU 11 3HD2 LEU 11 16.033 1.269 -7.838
91 HD22 LEU 11 1HD2 LEU 11 15.566 -0.080 -8.873
92 HD23 LEU 11 2HD2 LEU 11 14.332 0.995 -8.215
93 H ALA 12 H ALA 12 12.174 1.588 -13.034
94 HA ALA 12 HA ALA 12 13.468 -0.309 -14.656
95 HB1 ALA 12 1HB ALA 12 10.729 0.749 -14.390
96 HB2 ALA 12 2HB ALA 12 11.128 0.015 -15.944
97 HB3 ALA 12 3HB ALA 12 11.305 -0.917 -14.457
98 H ALA 13 H ALA 13 12.193 2.921 -15.406
99 HA ALA 13 HA ALA 13 12.833 2.877 -18.154
100 HB1 ALA 13 1HB ALA 13 12.655 5.336 -16.427
101 HB2 ALA 13 2HB ALA 13 12.357 5.205 -18.161
102 HB3 ALA 13 3HB ALA 13 11.245 4.456 -17.015
103 H ILE 14 H ILE 14 14.608 4.016 -15.312
104 HA ILE 14 HA ILE 14 16.775 5.168 -16.701
105 HB ILE 14 HB ILE 14 16.655 4.013 -13.914
106 HG12 ILE 14 2HG1 ILE 14 16.756 6.926 -14.634
107 HG13 ILE 14 3HG1 ILE 14 15.223 6.060 -14.664
108 HG21 ILE 14 1HG2 ILE 14 18.898 4.943 -15.467
109 HG22 ILE 14 2HG2 ILE 14 18.662 5.943 -14.035
110 HG23 ILE 14 3HG2 ILE 14 18.870 4.200 -13.868
111 HD11 ILE 14 3HD1 ILE 14 16.570 5.494 -12.215
112 HD12 ILE 14 1HD1 ILE 14 16.512 7.239 -12.466
113 HD13 ILE 14 2HD1 ILE 14 15.021 6.296 -12.478
114 H LYS 15 H LYS 15 16.232 1.914 -15.425
115 HA LYS 15 HA LYS 15 18.814 0.914 -16.020
116 HB2 LYS 15 2HB LYS 15 16.718 -0.030 -14.599
117 HB3 LYS 15 3HB LYS 15 16.532 -0.973 -16.072
118 HG2 LYS 15 2HG LYS 15 19.232 -1.159 -15.500
119 HG3 LYS 15 3HG LYS 15 18.448 -1.249 -13.921
120 HD2 LYS 15 2HD LYS 15 17.446 -2.886 -16.223
121 HD3 LYS 15 3HD LYS 15 18.824 -3.430 -15.263
122 HE2 LYS 15 2HE LYS 15 17.389 -4.268 -13.788
123 HE3 LYS 15 3HE LYS 15 16.876 -2.622 -13.418
124 HZ1 LYS 15 3HZ LYS 15 14.891 -3.225 -14.169
125 HZ2 LYS 15 1HZ LYS 15 15.474 -4.682 -14.801
126 HZ3 LYS 15 2HZ LYS 15 15.552 -3.267 -15.725
127 H THR 16 H THR 16 15.751 0.887 -17.793
128 HA THR 16 HA THR 16 16.548 -0.729 -19.936
129 HB THR 16 HB THR 16 14.546 1.539 -19.939
130 HG1 THR 16 HG1 THR 16 13.323 0.156 -18.919
131 HG21 THR 16 3HG2 THR 16 15.230 0.946 -22.207
132 HG22 THR 16 1HG2 THR 16 13.580 0.412 -21.894
133 HG23 THR 16 2HG2 THR 16 14.903 -0.754 -21.873
134 H ARG 17 H ARG 17 16.528 2.826 -19.672
135 HA ARG 17 HA ARG 17 17.698 3.299 -22.193
136 HB2 ARG 17 2HB ARG 17 17.246 4.903 -19.723
137 HB3 ARG 17 3HB ARG 17 18.391 5.521 -20.906
138 HG2 ARG 17 2HG ARG 17 16.401 6.525 -21.521
139 HG3 ARG 17 3HG ARG 17 16.500 5.142 -22.612
140 HD2 ARG 17 2HD ARG 17 15.142 3.920 -20.767
141 HD3 ARG 17 3HD ARG 17 14.748 5.550 -20.222
142 HE ARG 17 HE ARG 17 14.205 5.534 -22.912
143 HH11 ARG 17 1HH1 ARG 17 13.155 3.719 -20.133
144 HH12 ARG 17 2HH1 ARG 17 11.577 3.401 -20.774
145 HH21 ARG 17 1HH2 ARG 17 12.131 5.121 -23.767
146 HH22 ARG 17 2HH2 ARG 17 10.996 4.198 -22.842
147 H CYS 18 H CYS 18 19.066 2.799 -18.988
148 HA CYS 18 HA CYS 18 21.728 3.503 -19.651
149 HB2 CYS 18 2HB CYS 18 20.435 1.988 -17.415
150 HB3 CYS 18 3HB CYS 18 22.185 1.942 -17.585
151 HG CYS 18 HG CYS 18 20.277 4.738 -17.089
152 H GLN 19 H GLN 19 19.916 0.492 -19.790
153 HA GLN 19 HA GLN 19 22.169 -1.158 -20.374
154 HB2 GLN 19 2HB GLN 19 19.207 -1.605 -20.768
155 HB3 GLN 19 3HB GLN 19 20.434 -2.836 -21.036
156 HG2 GLN 19 2HG GLN 19 20.629 -1.573 -18.420
157 HG3 GLN 19 3HG GLN 19 19.087 -2.383 -18.695
158 HE21 GLN 19 1HE2 GLN 19 19.441 -4.050 -17.291
159 HE22 GLN 19 2HE2 GLN 19 20.630 -5.276 -17.550
160 H ALA 20 H ALA 20 19.663 0.394 -22.338
161 HA ALA 20 HA ALA 20 20.621 -0.666 -24.811
162 HB1 ALA 20 1HB ALA 20 18.596 1.373 -24.020
163 HB2 ALA 20 2HB ALA 20 19.146 1.312 -25.695
164 HB3 ALA 20 3HB ALA 20 18.400 -0.107 -24.960
165 H LEU 21 H LEU 21 21.286 2.189 -22.917
166 HA LEU 21 HA LEU 21 22.731 3.928 -23.181
167 HB2 LEU 21 2HB LEU 21 24.239 2.056 -24.992
168 HB3 LEU 21 3HB LEU 21 24.887 3.410 -24.068
169 HG LEU 21 HG LEU 21 23.618 1.188 -22.557
170 HD11 LEU 21 1HD1 LEU 21 26.447 0.732 -23.050
171 HD12 LEU 21 2HD1 LEU 21 25.459 0.549 -24.499
172 HD13 LEU 21 3HD1 LEU 21 25.096 -0.402 -23.059
173 HD21 LEU 21 3HD2 LEU 21 25.036 1.859 -20.859
174 HD22 LEU 21 1HD2 LEU 21 24.689 3.383 -21.677
175 HD23 LEU 21 2HD2 LEU 21 26.215 2.551 -21.974
176 H GLY 22 H GLY 22 20.535 3.551 -25.164
177 HA2 GLY 22 2HA GLY 22 21.709 4.842 -27.529
178 HA3 GLY 22 3HA GLY 22 20.120 4.097 -27.453
179 H GLY 23 H GLY 23 20.801 5.984 -24.727
180 HA2 GLY 23 2HA GLY 23 18.815 7.927 -25.524
181 HA3 GLY 23 3HA GLY 23 19.605 7.821 -23.958
182 H SER 24 H SER 24 22.123 8.257 -24.228
183 HA SER 24 HA SER 24 23.046 10.028 -26.178
184 HB2 SER 24 2HB SER 24 21.340 11.253 -24.169
185 HB3 SER 24 3HB SER 24 22.956 11.958 -24.164
186 HG SER 24 HG SER 24 21.932 13.087 -25.700
187 H GLU 25 H GLU 25 25.204 10.250 -25.983
188 HA GLU 25 HA GLU 25 26.683 8.753 -24.209
189 HB2 GLU 25 2HB GLU 25 28.624 10.143 -24.884
190 HB3 GLU 25 3HB GLU 25 27.658 9.600 -26.249
191 HG2 GLU 25 2HG GLU 25 27.601 11.702 -26.932
192 HG3 GLU 25 3HG GLU 25 26.563 12.054 -25.552
193 H ALA 26 H ALA 26 25.508 12.036 -23.861
194 HA ALA 26 HA ALA 26 26.992 12.473 -21.409
195 HB1 ALA 26 1HB ALA 26 26.646 14.632 -21.816
196 HB2 ALA 26 2HB ALA 26 25.915 14.144 -23.345
197 HB3 ALA 26 3HB ALA 26 24.901 14.402 -21.926
198 H GLU 27 H GLU 27 23.733 11.651 -22.409
199 HA GLU 27 HA GLU 27 22.288 12.147 -20.118
200 HB2 GLU 27 2HB GLU 27 22.045 10.323 -22.404
201 HB3 GLU 27 3HB GLU 27 21.234 9.754 -20.952
202 HG2 GLU 27 2HG GLU 27 20.806 12.430 -22.260
203 HG3 GLU 27 3HG GLU 27 19.741 11.032 -22.399
204 H CYS 28 H CYS 28 24.573 9.578 -20.758
205 HA CYS 28 HA CYS 28 23.970 7.750 -18.791
206 HB2 CYS 28 2HB CYS 28 26.759 8.622 -19.571
207 HB3 CYS 28 3HB CYS 28 26.304 7.080 -18.856
208 HG CYS 28 HG CYS 28 24.467 6.989 -21.362
209 H ALA 29 H ALA 29 25.883 10.720 -18.492
210 HA ALA 29 HA ALA 29 26.709 10.435 -15.850
211 HB1 ALA 29 1HB ALA 29 27.650 12.407 -16.242
212 HB2 ALA 29 2HB ALA 29 26.849 12.418 -17.813
213 HB3 ALA 29 3HB ALA 29 26.076 13.182 -16.424
214 H ALA 30 H ALA 30 23.828 12.137 -17.083
215 HA ALA 30 HA ALA 30 22.748 12.902 -14.642
216 HB1 ALA 30 1HB ALA 30 20.710 13.273 -15.778
217 HB2 ALA 30 2HB ALA 30 21.989 13.583 -16.954
218 HB3 ALA 30 3HB ALA 30 21.091 12.066 -17.007
219 H PHE 31 H PHE 31 22.537 9.829 -16.340
220 HA PHE 31 HA PHE 31 20.517 8.660 -14.763
221 HB2 PHE 31 2HB PHE 31 22.624 7.643 -16.610
222 HB3 PHE 31 3HB PHE 31 21.838 6.486 -15.541
223 HD1 PHE 31 HD1 PHE 31 19.098 7.309 -15.448
224 HD2 PHE 31 HD2 PHE 31 21.802 7.368 -18.735
225 HE1 PHE 31 HE1 PHE 31 17.201 7.156 -17.008
226 HE2 PHE 31 HE2 PHE 31 19.909 7.217 -20.300
227 HZ PHE 31 HZ PHE 31 17.605 7.111 -19.437
228 H GLU 32 H GLU 32 24.063 8.415 -14.554
229 HA GLU 32 HA GLU 32 24.218 6.739 -12.345
230 HB2 GLU 32 2HB GLU 32 26.007 8.484 -13.804
231 HB3 GLU 32 3HB GLU 32 26.355 8.528 -12.081
232 HG2 GLU 32 2HG GLU 32 26.748 6.198 -12.006
233 HG3 GLU 32 3HG GLU 32 26.091 5.967 -13.625
234 H LYS 33 H LYS 33 24.119 10.289 -12.447
235 HA LYS 33 HA LYS 33 24.321 10.741 -9.693
236 HB2 LYS 33 2HB LYS 33 23.566 12.280 -12.062
237 HB3 LYS 33 3HB LYS 33 22.721 12.798 -10.609
238 HG2 LYS 33 2HG LYS 33 24.534 14.095 -10.345
239 HG3 LYS 33 3HG LYS 33 25.228 12.627 -9.652
240 HD2 LYS 33 2HD LYS 33 26.692 12.409 -11.331
241 HD3 LYS 33 3HD LYS 33 25.461 12.732 -12.554
242 HE2 LYS 33 2HE LYS 33 25.660 15.167 -11.948
243 HE3 LYS 33 3HE LYS 33 27.061 14.733 -10.971
244 HZ1 LYS 33 3HZ LYS 33 27.543 13.572 -13.392
245 HZ2 LYS 33 1HZ LYS 33 28.234 15.007 -12.822
246 HZ3 LYS 33 2HZ LYS 33 26.857 15.063 -13.801
247 H GLU 34 H GLU 34 21.423 10.473 -11.745
248 HA GLU 34 HA GLU 34 19.484 10.877 -9.817
249 HB2 GLU 34 2HB GLU 34 19.553 10.009 -12.490
250 HB3 GLU 34 3HB GLU 34 18.673 8.767 -11.611
251 HG2 GLU 34 2HG GLU 34 17.044 10.306 -10.872
252 HG3 GLU 34 3HG GLU 34 18.013 11.687 -11.384
253 H ILE 35 H ILE 35 21.017 7.814 -10.769
254 HA ILE 35 HA ILE 35 19.602 6.139 -9.035
255 HB ILE 35 HB ILE 35 22.427 5.849 -10.063
256 HG12 ILE 35 2HG1 ILE 35 20.593 6.001 -11.770
257 HG13 ILE 35 3HG1 ILE 35 21.476 4.478 -11.795
258 HG21 ILE 35 1HG2 ILE 35 20.774 4.157 -8.311
259 HG22 ILE 35 2HG2 ILE 35 21.571 3.323 -9.644
260 HG23 ILE 35 3HG2 ILE 35 22.527 4.245 -8.484
261 HD11 ILE 35 3HD1 ILE 35 19.016 4.607 -10.153
262 HD12 ILE 35 1HD1 ILE 35 18.838 4.589 -11.908
263 HD13 ILE 35 2HD1 ILE 35 19.688 3.275 -11.094
264 H ALA 36 H ALA 36 22.661 7.873 -8.559
265 HA ALA 36 HA ALA 36 23.345 6.889 -6.056
266 HB1 ALA 36 1HB ALA 36 23.799 9.765 -6.740
267 HB2 ALA 36 2HB ALA 36 24.861 8.632 -5.905
268 HB3 ALA 36 3HB ALA 36 24.617 8.492 -7.645
269 H ALA 37 H ALA 37 21.333 9.710 -6.857
270 HA ALA 37 HA ALA 37 20.787 10.443 -4.182
271 HB1 ALA 37 1HB ALA 37 18.743 11.575 -5.358
272 HB2 ALA 37 2HB ALA 37 20.380 12.162 -5.651
273 HB3 ALA 37 3HB ALA 37 19.595 11.114 -6.832
274 H PHE 38 H PHE 38 19.206 8.266 -6.446
275 HA PHE 38 HA PHE 38 16.796 7.877 -5.087
276 HB2 PHE 38 2HB PHE 38 18.237 6.610 -7.252
277 HB3 PHE 38 3HB PHE 38 17.456 5.404 -6.235
278 HD1 PHE 38 HD1 PHE 38 16.542 8.792 -7.517
279 HD2 PHE 38 HD2 PHE 38 15.446 4.704 -7.066
280 HE1 PHE 38 HE1 PHE 38 14.397 9.247 -8.633
281 HE2 PHE 38 HE2 PHE 38 13.300 5.153 -8.182
282 HZ PHE 38 HZ PHE 38 12.773 7.426 -8.968
283 H GLU 39 H GLU 39 19.765 5.904 -4.949
284 HA GLU 39 HA GLU 39 18.858 4.203 -2.892
285 HB2 GLU 39 2HB GLU 39 21.250 3.593 -2.637
286 HB3 GLU 39 3HB GLU 39 20.697 3.536 -4.305
287 HG2 GLU 39 2HG GLU 39 21.709 5.749 -4.687
288 HG3 GLU 39 3HG GLU 39 22.323 5.726 -3.034
289 H SER 40 H SER 40 20.657 7.235 -2.856
290 HA SER 40 HA SER 40 21.281 7.215 -0.095
291 HB2 SER 40 2HB SER 40 22.525 8.657 -1.570
292 HB3 SER 40 3HB SER 40 21.056 9.488 -2.080
293 HG SER 40 HG SER 40 22.586 10.305 -0.233
294 H GLU 41 H GLU 41 18.449 8.112 -1.896
295 HA GLU 41 HA GLU 41 17.241 9.572 0.281
296 HB2 GLU 41 2HB GLU 41 16.484 8.856 -2.503
297 HB3 GLU 41 3HB GLU 41 15.174 9.165 -1.372
298 HG2 GLU 41 2HG GLU 41 17.391 11.131 -1.498
299 HG3 GLU 41 3HG GLU 41 16.246 11.080 -2.837
300 H LEU 42 H LEU 42 17.020 6.354 -1.125
301 HA LEU 42 HA LEU 42 14.791 5.535 0.471
302 HB2 LEU 42 2HB LEU 42 16.814 3.857 -1.005
303 HB3 LEU 42 3HB LEU 42 15.266 3.301 -0.372
304 HG LEU 42 HG LEU 42 15.279 5.514 -2.368
305 HD11 LEU 42 1HD1 LEU 42 14.999 3.366 -3.974
306 HD12 LEU 42 2HD1 LEU 42 16.223 2.770 -2.853
307 HD13 LEU 42 3HD1 LEU 42 16.510 4.253 -3.765
308 HD21 LEU 42 3HD2 LEU 42 13.438 3.389 -1.400
309 HD22 LEU 42 1HD2 LEU 42 13.264 3.957 -3.061
310 HD23 LEU 42 2HD2 LEU 42 13.129 5.096 -1.721
311 H GLN 43 H GLN 43 18.252 5.526 0.841
312 HA GLN 43 HA GLN 43 18.354 3.636 2.973
313 HB2 GLN 43 2HB GLN 43 20.633 4.127 3.117
314 HB3 GLN 43 3HB GLN 43 20.261 4.412 1.422
315 HG2 GLN 43 2HG GLN 43 21.293 6.361 1.702
316 HG3 GLN 43 3HG GLN 43 19.822 6.870 2.529
317 HE21 GLN 43 1HE2 GLN 43 22.389 7.927 3.000
318 HE22 GLN 43 2HE2 GLN 43 22.834 7.549 4.626
319 H ALA 44 H ALA 44 17.537 6.962 2.754
320 HA ALA 44 HA ALA 44 18.171 7.723 5.423
321 HB1 ALA 44 1HB ALA 44 17.690 9.197 3.339
322 HB2 ALA 44 2HB ALA 44 16.007 9.047 3.844
323 HB3 ALA 44 3HB ALA 44 17.195 9.758 4.936
324 H TYR 45 H TYR 45 15.428 6.191 3.901
325 HA TYR 45 HA TYR 45 13.415 6.638 5.733
326 HB2 TYR 45 2HB TYR 45 14.059 4.223 4.049
327 HB3 TYR 45 3HB TYR 45 12.620 4.296 5.059
328 HD1 TYR 45 HD1 TYR 45 11.615 6.967 4.726
329 HD2 TYR 45 HD2 TYR 45 13.425 4.421 1.837
330 HE1 TYR 45 HE1 TYR 45 10.415 8.154 2.937
331 HE2 TYR 45 HE2 TYR 45 12.230 5.602 0.040
332 HH TYR 45 HH TYR 45 9.634 7.519 0.510
333 H LYS 46 H LYS 46 15.598 3.813 5.722
334 HA LYS 46 HA LYS 46 16.382 2.490 7.397
335 HB2 LYS 46 2HB LYS 46 15.644 4.744 9.266
336 HB3 LYS 46 3HB LYS 46 16.830 3.476 9.545
337 HG2 LYS 46 2HG LYS 46 17.612 4.738 7.173
338 HG3 LYS 46 3HG LYS 46 17.155 6.031 8.285
339 HD2 LYS 46 2HD LYS 46 18.787 5.470 9.817
340 HD3 LYS 46 3HD LYS 46 18.881 3.797 9.261
341 HE2 LYS 46 2HE LYS 46 20.469 4.280 7.767
342 HE3 LYS 46 3HE LYS 46 19.604 5.704 7.190
343 HZ1 LYS 46 3HZ LYS 46 21.741 5.502 9.127
344 HZ2 LYS 46 1HZ LYS 46 20.479 6.533 9.581
345 HZ3 LYS 46 2HZ LYS 46 21.303 6.795 8.128
346 H GLY 47 H GLY 47 14.202 1.446 6.728
347 HA2 GLY 47 2HA GLY 47 12.215 1.494 8.863
348 HA3 GLY 47 3HA GLY 47 12.071 0.657 7.325
349 H LYS 48 H LYS 48 11.293 -1.156 8.568
350 HA LYS 48 HA LYS 48 12.960 -2.462 10.475
351 HB2 LYS 48 2HB LYS 48 10.597 -3.502 8.900
352 HB3 LYS 48 3HB LYS 48 11.348 -4.331 10.258
353 HG2 LYS 48 2HG LYS 48 10.798 -2.295 11.645
354 HG3 LYS 48 3HG LYS 48 9.815 -1.748 10.285
355 HD2 LYS 48 2HD LYS 48 8.927 -4.293 10.567
356 HD3 LYS 48 3HD LYS 48 9.323 -3.893 12.240
357 HE2 LYS 48 2HE LYS 48 8.021 -1.648 11.486
358 HE3 LYS 48 3HE LYS 48 7.201 -2.844 10.484
359 HZ1 LYS 48 3HZ LYS 48 5.991 -2.785 12.459
360 HZ2 LYS 48 1HZ LYS 48 7.373 -2.731 13.433
361 HZ3 LYS 48 2HZ LYS 48 6.962 -4.160 12.628
362 H GLY 49 H GLY 49 14.966 -2.534 9.270
363 HA2 GLY 49 2HA GLY 49 16.542 -3.972 8.337
364 HA3 GLY 49 3HA GLY 49 15.237 -5.046 7.856
365 H ASN 50 H ASN 50 14.209 -2.170 6.807
366 HA ASN 50 HA ASN 50 13.963 -1.288 4.718
367 HB2 ASN 50 2HB ASN 50 16.955 -1.699 4.814
368 HB3 ASN 50 3HB ASN 50 16.140 -0.801 3.537
369 HD21 ASN 50 1HD2 ASN 50 16.474 1.275 3.835
370 HD22 ASN 50 2HD2 ASN 50 16.366 2.119 5.339
371 HA PRO 51 HA PRO 51 14.189 -5.553 2.770
372 HB2 PRO 51 2HB PRO 51 11.506 -5.890 2.528
373 HB3 PRO 51 3HB PRO 51 12.409 -6.371 3.969
374 HG2 PRO 51 2HG PRO 51 10.782 -3.905 3.489
375 HG3 PRO 51 3HG PRO 51 10.848 -4.939 4.928
376 HD2 PRO 51 2HD PRO 51 12.180 -2.587 4.761
377 HD3 PRO 51 3HD PRO 51 12.795 -3.970 5.689
378 H GLU 52 H GLU 52 11.765 -3.023 2.079
379 HA GLU 52 HA GLU 52 11.528 -3.567 -0.663
380 HB2 GLU 52 2HB GLU 52 10.647 -1.198 -0.789
381 HB3 GLU 52 3HB GLU 52 9.831 -2.258 0.351
382 HG2 GLU 52 2HG GLU 52 10.910 -1.242 2.202
383 HG3 GLU 52 3HG GLU 52 12.007 -0.348 1.150
384 H VAL 53 H VAL 53 13.939 -1.875 1.138
385 HA VAL 53 HA VAL 53 14.994 -0.330 -1.018
386 HB VAL 53 HB VAL 53 16.342 -1.184 1.549
387 HG11 VAL 53 1HG1 VAL 53 17.051 0.900 -0.508
388 HG12 VAL 53 2HG1 VAL 53 17.759 0.837 1.107
389 HG13 VAL 53 3HG1 VAL 53 18.004 -0.500 -0.017
390 HG21 VAL 53 3HG2 VAL 53 14.478 1.034 0.864
391 HG22 VAL 53 1HG2 VAL 53 14.599 0.074 2.338
392 HG23 VAL 53 2HG2 VAL 53 15.774 1.349 2.017
393 H GLU 54 H GLU 54 15.267 -3.614 -0.062
394 HA GLU 54 HA GLU 54 17.811 -4.272 -1.012
395 HB2 GLU 54 2HB GLU 54 17.170 -6.496 -0.829
396 HB3 GLU 54 3HB GLU 54 16.080 -5.697 0.296
397 HG2 GLU 54 2HG GLU 54 14.410 -5.624 -1.616
398 HG3 GLU 54 3HG GLU 54 15.480 -6.754 -2.444
399 H ALA 55 H ALA 55 14.731 -3.958 -2.690
400 HA ALA 55 HA ALA 55 15.662 -4.981 -5.182
401 HB1 ALA 55 1HB ALA 55 13.286 -3.212 -4.613
402 HB2 ALA 55 2HB ALA 55 13.574 -4.125 -6.095
403 HB3 ALA 55 3HB ALA 55 13.289 -4.976 -4.576
404 H LEU 56 H LEU 56 14.895 -1.663 -4.111
405 HA LEU 56 HA LEU 56 15.796 -0.344 -6.394
406 HB2 LEU 56 2HB LEU 56 15.984 0.740 -3.594
407 HB3 LEU 56 3HB LEU 56 15.807 1.650 -5.092
408 HG LEU 56 HG LEU 56 13.616 -0.222 -4.576
409 HD11 LEU 56 1HD1 LEU 56 14.536 1.518 -2.447
410 HD12 LEU 56 2HD1 LEU 56 13.309 0.251 -2.424
411 HD13 LEU 56 3HD1 LEU 56 12.883 1.882 -2.944
412 HD21 LEU 56 3HD2 LEU 56 12.507 2.202 -4.882
413 HD22 LEU 56 1HD2 LEU 56 13.039 1.201 -6.233
414 HD23 LEU 56 2HD2 LEU 56 14.076 2.496 -5.634
415 H ARG 57 H ARG 57 17.545 -1.379 -3.511
416 HA ARG 57 HA ARG 57 19.983 -0.078 -4.127
417 HB2 ARG 57 2HB ARG 57 19.565 -0.808 -1.873
418 HB3 ARG 57 3HB ARG 57 19.369 -2.475 -2.396
419 HG2 ARG 57 2HG ARG 57 21.955 -1.164 -2.993
420 HG3 ARG 57 3HG ARG 57 21.613 -1.568 -1.310
421 HD2 ARG 57 2HD ARG 57 21.882 -3.761 -1.670
422 HD3 ARG 57 3HD ARG 57 20.953 -3.716 -3.168
423 HE ARG 57 HE ARG 57 23.369 -2.537 -3.753
424 HH11 ARG 57 1HH1 ARG 57 22.287 -5.630 -2.577
425 HH12 ARG 57 2HH1 ARG 57 23.607 -6.505 -3.278
426 HH21 ARG 57 1HH2 ARG 57 25.112 -3.678 -4.682
427 HH22 ARG 57 2HH2 ARG 57 25.214 -5.394 -4.475
428 H LYS 58 H LYS 58 18.780 -3.354 -4.745
429 HA LYS 58 HA LYS 58 21.128 -4.379 -5.901
430 HB2 LYS 58 2HB LYS 58 18.322 -5.179 -5.680
431 HB3 LYS 58 3HB LYS 58 19.083 -5.730 -7.167
432 HG2 LYS 58 2HG LYS 58 20.952 -6.306 -5.210
433 HG3 LYS 58 3HG LYS 58 19.402 -6.688 -4.456
434 HD2 LYS 58 2HD LYS 58 20.165 -8.663 -5.550
435 HD3 LYS 58 3HD LYS 58 18.836 -8.011 -6.512
436 HE2 LYS 58 2HE LYS 58 20.151 -7.815 -8.295
437 HE3 LYS 58 3HE LYS 58 21.336 -6.888 -7.376
438 HZ1 LYS 58 3HZ LYS 58 21.971 -9.167 -8.426
439 HZ2 LYS 58 1HZ LYS 58 21.239 -9.803 -7.039
440 HZ3 LYS 58 2HZ LYS 58 22.553 -8.748 -6.893
441 H GLU 59 H GLU 59 18.159 -3.248 -7.532
442 HA GLU 59 HA GLU 59 19.109 -3.361 -10.135
443 HB2 GLU 59 2HB GLU 59 17.129 -1.404 -8.955
444 HB3 GLU 59 3HB GLU 59 17.350 -1.706 -10.673
445 HG2 GLU 59 2HG GLU 59 16.674 -3.948 -8.818
446 HG3 GLU 59 3HG GLU 59 15.418 -2.866 -9.418
447 H ALA 60 H ALA 60 19.099 -0.567 -7.926
448 HA ALA 60 HA ALA 60 20.274 1.316 -9.559
449 HB1 ALA 60 1HB ALA 60 19.488 2.096 -7.509
450 HB2 ALA 60 2HB ALA 60 20.394 0.889 -6.594
451 HB3 ALA 60 3HB ALA 60 21.241 2.233 -7.362
452 H ALA 61 H ALA 61 21.949 -0.919 -7.342
453 HA ALA 61 HA ALA 61 24.559 -0.171 -7.911
454 HB1 ALA 61 1HB ALA 61 25.241 -2.116 -6.841
455 HB2 ALA 61 2HB ALA 61 23.648 -1.813 -6.145
456 HB3 ALA 61 3HB ALA 61 23.843 -3.034 -7.404
457 H ALA 62 H ALA 62 22.524 -2.584 -9.533
458 HA ALA 62 HA ALA 62 24.438 -3.559 -11.326
459 HB1 ALA 62 1HB ALA 62 21.481 -3.311 -11.854
460 HB2 ALA 62 2HB ALA 62 22.609 -4.455 -12.584
461 HB3 ALA 62 3HB ALA 62 22.211 -4.581 -10.870
462 H ILE 63 H ILE 63 22.135 -0.878 -11.653
463 HA ILE 63 HA ILE 63 22.713 -0.212 -14.311
464 HB ILE 63 HB ILE 63 21.801 1.585 -12.062
465 HG12 ILE 63 2HG1 ILE 63 20.207 0.255 -14.262
466 HG13 ILE 63 3HG1 ILE 63 20.327 -0.357 -12.616
467 HG21 ILE 63 1HG2 ILE 63 20.838 2.704 -14.339
468 HG22 ILE 63 2HG2 ILE 63 22.311 3.218 -13.517
469 HG23 ILE 63 3HG2 ILE 63 22.406 2.110 -14.885
470 HD11 ILE 63 3HD1 ILE 63 18.915 1.194 -11.795
471 HD12 ILE 63 1HD1 ILE 63 19.460 2.445 -12.912
472 HD13 ILE 63 2HD1 ILE 63 18.336 1.201 -13.461
473 H ARG 64 H ARG 64 24.131 0.961 -11.278
474 HA ARG 64 HA ARG 64 25.848 2.874 -12.396
475 HB2 ARG 64 2HB ARG 64 25.219 2.313 -9.897
476 HB3 ARG 64 3HB ARG 64 26.673 1.326 -9.976
477 HG2 ARG 64 2HG ARG 64 27.680 3.575 -10.965
478 HG3 ARG 64 3HG ARG 64 26.369 4.270 -10.009
479 HD2 ARG 64 2HD ARG 64 27.781 2.226 -8.533
480 HD3 ARG 64 3HD ARG 64 28.883 3.480 -9.101
481 HE ARG 64 HE ARG 64 26.891 3.730 -7.061
482 HH11 ARG 64 1HH1 ARG 64 28.679 5.456 -9.499
483 HH12 ARG 64 2HH1 ARG 64 28.529 6.990 -8.708
484 HH21 ARG 64 1HH2 ARG 64 26.687 5.745 -6.010
485 HH22 ARG 64 2HH2 ARG 64 27.397 7.153 -6.723
486 H ASP 65 H ASP 65 26.378 -0.550 -11.635
487 HA ASP 65 HA ASP 65 29.082 -0.686 -12.327
488 HB2 ASP 65 2HB ASP 65 26.880 -2.742 -12.322
489 HB3 ASP 65 3HB ASP 65 28.528 -3.154 -12.788
490 H GLU 66 H GLU 66 26.181 -1.188 -14.306
491 HA GLU 66 HA GLU 66 27.479 -1.938 -16.673
492 HB2 GLU 66 2HB GLU 66 24.879 -0.415 -16.441
493 HB3 GLU 66 3HB GLU 66 25.406 -1.392 -17.804
494 HG2 GLU 66 2HG GLU 66 25.419 -2.918 -15.355
495 HG3 GLU 66 3HG GLU 66 23.837 -2.205 -15.667
496 H CYS 67 H CYS 67 26.313 1.262 -15.635
497 HA CYS 67 HA CYS 67 27.190 2.696 -17.866
498 HB2 CYS 67 2HB CYS 67 26.933 3.649 -15.006
499 HB3 CYS 67 3HB CYS 67 27.043 4.688 -16.422
500 HG CYS 67 HG CYS 67 24.586 2.615 -16.943
501 H GLN 68 H GLN 68 28.893 1.626 -15.004
502 HA GLN 68 HA GLN 68 31.227 3.225 -15.505
503 HB2 GLN 68 2HB GLN 68 30.744 0.894 -13.645
504 HB3 GLN 68 3HB GLN 68 32.242 1.814 -13.703
505 HG2 GLN 68 2HG GLN 68 30.072 3.631 -13.425
506 HG3 GLN 68 3HG GLN 68 29.903 2.354 -12.221
507 HE21 GLN 68 1HE2 GLN 68 30.976 5.327 -12.520
508 HE22 GLN 68 2HE2 GLN 68 32.335 5.311 -11.454
509 H ALA 69 H ALA 69 30.071 0.106 -16.455
510 HA ALA 69 HA ALA 69 32.689 -0.797 -17.342
511 HB1 ALA 69 1HB ALA 69 29.961 -2.043 -17.303
512 HB2 ALA 69 2HB ALA 69 31.295 -2.770 -18.200
513 HB3 ALA 69 3HB ALA 69 31.423 -2.547 -16.455
514 H TYR 70 H TYR 70 30.404 1.256 -18.527
515 HA TYR 70 HA TYR 70 30.981 0.543 -21.327
516 HB2 TYR 70 2HB TYR 70 28.664 2.110 -20.176
517 HB3 TYR 70 3HB TYR 70 28.952 1.865 -21.895
518 HD1 TYR 70 HD1 TYR 70 29.845 -1.020 -21.768
519 HD2 TYR 70 HD2 TYR 70 26.589 1.012 -19.931
520 HE1 TYR 70 HE1 TYR 70 28.585 -3.131 -21.680
521 HE2 TYR 70 HE2 TYR 70 25.321 -1.094 -19.837
522 HH TYR 70 HH TYR 70 25.556 -3.455 -21.441
523 H ARG 71 H ARG 71 32.502 2.221 -19.291
524 HA ARG 71 HA ARG 71 33.586 4.097 -21.025
525 HB2 ARG 71 2HB ARG 71 31.102 4.966 -19.963
526 HB3 ARG 71 3HB ARG 71 32.362 5.915 -19.186
527 HG2 ARG 71 2HG ARG 71 33.165 6.713 -21.272
528 HG3 ARG 71 3HG ARG 71 32.158 5.572 -22.165
529 HD2 ARG 71 2HD ARG 71 30.388 6.929 -22.089
530 HD3 ARG 71 3HD ARG 71 30.604 7.236 -20.366
531 HE ARG 71 HE ARG 71 32.469 8.634 -22.059
532 HH11 ARG 71 1HH1 ARG 71 29.337 8.714 -20.539
533 HH12 ARG 71 2HH1 ARG 71 29.225 10.443 -20.563
534 HH21 ARG 71 1HH2 ARG 71 32.333 10.911 -22.096
535 HH22 ARG 71 2HH2 ARG 71 30.929 11.692 -21.450
536 H HIS 72 H HIS 72 32.756 3.395 -17.671
537 HA HIS 72 HA HIS 72 35.196 4.635 -16.698
538 HB2 HIS 72 2HB HIS 72 32.778 4.442 -15.562
539 HB3 HIS 72 3HB HIS 72 33.500 2.977 -14.904
540 HD1 HIS 72 HD1 HIS 72 34.630 3.325 -12.743
541 HD2 HIS 72 HD2 HIS 72 34.636 6.779 -15.052
542 HE1 HIS 72 HE1 HIS 72 35.740 5.080 -11.324
543 H ASN 73 H ASN 73 34.833 1.994 -18.360
544 HA ASN 73 HA ASN 73 36.633 0.376 -16.678
545 HB2 ASN 73 2HB ASN 73 34.649 -0.891 -16.917
546 HB3 ASN 73 3HB ASN 73 34.486 -0.465 -18.619
547 HD21 ASN 73 1HD2 ASN 73 36.329 -2.345 -16.309
548 HD22 ASN 73 2HD2 ASN 73 36.940 -3.493 -17.446
Start of MODEL 15
1 H1 MET 1 H MET 1 1.791 1.123 1.168
2 HA MET 1 HA MET 1 2.983 -0.296 -1.069
3 HB2 MET 1 2HB MET 1 0.773 1.720 -1.365
4 HB3 MET 1 3HB MET 1 1.960 1.484 -2.641
5 HG2 MET 1 2HG MET 1 0.726 -0.174 -3.413
6 HG3 MET 1 3HG MET 1 1.082 -1.076 -1.942
7 HE1 MET 1 3HE MET 1 -1.854 -2.067 -0.800
8 HE2 MET 1 1HE MET 1 -0.158 -1.746 -0.436
9 HE3 MET 1 2HE MET 1 -1.423 -0.818 0.370
10 H GLY 2 H GLY 2 2.260 2.934 0.257
11 HA2 GLY 2 2HA GLY 2 3.645 4.715 0.694
12 HA3 GLY 2 3HA GLY 2 4.994 3.594 0.595
13 H SER 3 H SER 3 6.283 5.116 -0.482
14 HA SER 3 HA SER 3 5.380 6.012 -3.115
15 HB2 SER 3 2HB SER 3 7.297 7.511 -3.077
16 HB3 SER 3 3HB SER 3 6.405 7.662 -1.563
17 HG SER 3 HG SER 3 8.927 6.572 -2.051
18 H TRP 4 H TRP 4 6.126 3.213 -2.511
19 HA TRP 4 HA TRP 4 8.666 2.710 -3.724
20 HB2 TRP 4 2HB TRP 4 7.883 1.079 -2.178
21 HB3 TRP 4 3HB TRP 4 6.334 0.935 -3.005
22 HD1 TRP 4 HD1 TRP 4 6.337 -0.424 -5.364
23 HE1 TRP 4 HE1 TRP 4 7.893 -2.288 -6.217
24 HE3 TRP 4 HE3 TRP 4 10.239 0.232 -2.126
25 HZ2 TRP 4 HZ2 TRP 4 10.438 -3.342 -5.598
26 HZ3 TRP 4 HZ3 TRP 4 12.196 -1.247 -2.323
27 HH2 TRP 4 HH2 TRP 4 12.291 -2.996 -4.023
28 H ALA 5 H ALA 5 5.297 2.449 -4.812
29 HA ALA 5 HA ALA 5 5.660 1.353 -7.311
30 HB1 ALA 5 1HB ALA 5 3.659 3.048 -7.858
31 HB2 ALA 5 2HB ALA 5 3.446 1.577 -6.907
32 HB3 ALA 5 3HB ALA 5 3.639 3.131 -6.096
33 H GLU 6 H GLU 6 5.748 4.810 -6.456
34 HA GLU 6 HA GLU 6 6.262 5.815 -9.004
35 HB2 GLU 6 2HB GLU 6 6.892 6.818 -6.243
36 HB3 GLU 6 3HB GLU 6 7.420 7.709 -7.664
37 HG2 GLU 6 2HG GLU 6 5.451 8.724 -7.598
38 HG3 GLU 6 3HG GLU 6 4.763 7.211 -8.183
39 H PHE 7 H PHE 7 8.589 5.027 -6.422
40 HA PHE 7 HA PHE 7 10.914 5.605 -7.850
41 HB2 PHE 7 2HB PHE 7 10.229 4.086 -5.421
42 HB3 PHE 7 3HB PHE 7 11.715 3.571 -6.213
43 HD1 PHE 7 HD1 PHE 7 9.993 6.425 -4.642
44 HD2 PHE 7 HD2 PHE 7 13.676 4.891 -6.126
45 HE1 PHE 7 HE1 PHE 7 11.193 8.302 -3.595
46 HE2 PHE 7 HE2 PHE 7 14.881 6.765 -5.081
47 HZ PHE 7 HZ PHE 7 13.640 8.472 -3.813
48 H LYS 8 H LYS 8 8.911 2.727 -7.798
49 HA LYS 8 HA LYS 8 10.703 1.005 -9.146
50 HB2 LYS 8 2HB LYS 8 8.483 0.499 -7.854
51 HB3 LYS 8 3HB LYS 8 7.730 0.750 -9.423
52 HG2 LYS 8 2HG LYS 8 8.064 -1.543 -9.331
53 HG3 LYS 8 3HG LYS 8 9.428 -0.966 -10.291
54 HD2 LYS 8 2HD LYS 8 10.551 -0.830 -7.881
55 HD3 LYS 8 3HD LYS 8 9.371 -2.099 -7.548
56 HE2 LYS 8 2HE LYS 8 10.261 -3.492 -9.247
57 HE3 LYS 8 3HE LYS 8 11.236 -2.180 -9.908
58 HZ1 LYS 8 3HZ LYS 8 12.417 -2.181 -7.699
59 HZ2 LYS 8 1HZ LYS 8 12.697 -3.527 -8.686
60 HZ3 LYS 8 2HZ LYS 8 11.642 -3.648 -7.370
61 H GLN 9 H GLN 9 8.079 3.096 -10.295
62 HA GLN 9 HA GLN 9 8.235 2.371 -13.009
63 HB2 GLN 9 2HB GLN 9 6.522 3.872 -11.598
64 HB3 GLN 9 3HB GLN 9 7.479 5.159 -12.320
65 HG2 GLN 9 2HG GLN 9 6.751 4.712 -14.430
66 HG3 GLN 9 3HG GLN 9 6.487 3.001 -14.096
67 HE21 GLN 9 1HE2 GLN 9 4.812 5.275 -15.223
68 HE22 GLN 9 2HE2 GLN 9 3.325 5.162 -14.351
69 H ARG 10 H ARG 10 9.483 5.311 -11.413
70 HA ARG 10 HA ARG 10 10.892 6.338 -13.562
71 HB2 ARG 10 2HB ARG 10 11.565 6.509 -10.619
72 HB3 ARG 10 3HB ARG 10 12.273 7.522 -11.870
73 HG2 ARG 10 2HG ARG 10 10.555 8.919 -11.809
74 HG3 ARG 10 3HG ARG 10 9.399 7.600 -12.003
75 HD2 ARG 10 2HD ARG 10 10.127 7.228 -9.434
76 HD3 ARG 10 3HD ARG 10 10.325 8.975 -9.564
77 HE ARG 10 HE ARG 10 7.857 7.506 -9.558
78 HH11 ARG 10 1HH1 ARG 10 9.430 10.446 -10.560
79 HH12 ARG 10 2HH1 ARG 10 7.963 11.365 -10.619
80 HH21 ARG 10 1HH2 ARG 10 5.918 8.705 -9.633
81 HH22 ARG 10 2HH2 ARG 10 5.966 10.374 -10.091
82 H LEU 11 H LEU 11 12.021 4.097 -11.048
83 HA LEU 11 HA LEU 11 14.675 3.885 -11.920
84 HB2 LEU 11 2HB LEU 11 14.178 3.068 -9.777
85 HB3 LEU 11 3HB LEU 11 12.870 2.050 -10.378
86 HG LEU 11 HG LEU 11 15.585 1.411 -11.360
87 HD11 LEU 11 1HD1 LEU 11 16.539 1.294 -9.359
88 HD12 LEU 11 2HD1 LEU 11 15.399 0.009 -8.965
89 HD13 LEU 11 3HD1 LEU 11 15.023 1.679 -8.543
90 HD21 LEU 11 3HD2 LEU 11 14.490 -0.885 -10.510
91 HD22 LEU 11 1HD2 LEU 11 14.159 -0.182 -12.093
92 HD23 LEU 11 2HD2 LEU 11 13.025 0.064 -10.765
93 H ALA 12 H ALA 12 11.766 2.128 -12.865
94 HA ALA 12 HA ALA 12 12.993 0.142 -14.426
95 HB1 ALA 12 1HB ALA 12 10.809 -0.172 -15.447
96 HB2 ALA 12 2HB ALA 12 10.653 0.037 -13.703
97 HB3 ALA 12 3HB ALA 12 10.263 1.371 -14.789
98 H ALA 13 H ALA 13 11.729 3.342 -15.309
99 HA ALA 13 HA ALA 13 12.257 3.163 -18.066
100 HB1 ALA 13 1HB ALA 13 12.507 5.861 -17.337
101 HB2 ALA 13 2HB ALA 13 11.079 5.040 -17.967
102 HB3 ALA 13 3HB ALA 13 11.332 5.157 -16.226
103 H ILE 14 H ILE 14 14.200 4.414 -15.377
104 HA ILE 14 HA ILE 14 16.338 5.400 -16.909
105 HB ILE 14 HB ILE 14 16.337 4.346 -14.079
106 HG12 ILE 14 2HG1 ILE 14 14.853 6.310 -14.595
107 HG13 ILE 14 3HG1 ILE 14 16.106 6.636 -13.402
108 HG21 ILE 14 1HG2 ILE 14 18.424 5.628 -13.812
109 HG22 ILE 14 2HG2 ILE 14 18.586 4.307 -14.967
110 HG23 ILE 14 3HG2 ILE 14 18.417 5.965 -15.543
111 HD11 ILE 14 3HD1 ILE 14 17.239 8.051 -14.779
112 HD12 ILE 14 1HD1 ILE 14 16.680 7.252 -16.248
113 HD13 ILE 14 2HD1 ILE 14 15.593 8.314 -15.353
114 H LYS 15 H LYS 15 15.767 2.223 -15.456
115 HA LYS 15 HA LYS 15 18.270 1.102 -16.134
116 HB2 LYS 15 2HB LYS 15 16.173 0.288 -14.618
117 HB3 LYS 15 3HB LYS 15 15.941 -0.715 -16.044
118 HG2 LYS 15 2HG LYS 15 18.613 -1.008 -15.580
119 HG3 LYS 15 3HG LYS 15 17.965 -0.868 -13.944
120 HD2 LYS 15 2HD LYS 15 17.981 -3.187 -14.553
121 HD3 LYS 15 3HD LYS 15 16.305 -2.636 -14.522
122 HE2 LYS 15 2HE LYS 15 16.985 -2.149 -17.110
123 HE3 LYS 15 3HE LYS 15 17.947 -3.586 -16.765
124 HZ1 LYS 15 3HZ LYS 15 15.449 -4.082 -15.710
125 HZ2 LYS 15 1HZ LYS 15 16.116 -4.761 -17.109
126 HZ3 LYS 15 2HZ LYS 15 15.156 -3.372 -17.217
127 H THR 16 H THR 16 15.143 1.146 -17.790
128 HA THR 16 HA THR 16 15.764 -0.578 -19.897
129 HB THR 16 HB THR 16 13.917 1.817 -19.924
130 HG1 THR 16 HG1 THR 16 12.353 0.011 -19.652
131 HG21 THR 16 3HG2 THR 16 13.555 1.388 -22.079
132 HG22 THR 16 1HG2 THR 16 13.054 -0.250 -21.661
133 HG23 THR 16 2HG2 THR 16 14.744 0.086 -22.035
134 H ARG 17 H ARG 17 15.879 2.990 -19.867
135 HA ARG 17 HA ARG 17 17.018 3.288 -22.406
136 HB2 ARG 17 2HB ARG 17 16.666 4.992 -20.015
137 HB3 ARG 17 3HB ARG 17 17.942 5.482 -21.121
138 HG2 ARG 17 2HG ARG 17 15.874 6.621 -21.647
139 HG3 ARG 17 3HG ARG 17 16.325 5.529 -22.958
140 HD2 ARG 17 2HD ARG 17 14.676 3.961 -22.359
141 HD3 ARG 17 3HD ARG 17 14.425 4.709 -20.782
142 HE ARG 17 HE ARG 17 13.752 6.653 -22.574
143 HH11 ARG 17 1HH1 ARG 17 12.742 3.370 -22.011
144 HH12 ARG 17 2HH1 ARG 17 11.130 3.629 -22.590
145 HH21 ARG 17 1HH2 ARG 17 11.633 7.007 -23.339
146 HH22 ARG 17 2HH2 ARG 17 10.500 5.697 -23.346
147 H CYS 18 H CYS 18 18.485 2.797 -19.245
148 HA CYS 18 HA CYS 18 21.157 3.305 -20.033
149 HB2 CYS 18 2HB CYS 18 21.166 3.316 -17.776
150 HB3 CYS 18 3HB CYS 18 19.778 2.240 -17.673
151 HG CYS 18 HG CYS 18 21.120 0.209 -16.887
152 H GLN 19 H GLN 19 19.203 0.364 -19.877
153 HA GLN 19 HA GLN 19 21.288 -1.435 -20.522
154 HB2 GLN 19 2HB GLN 19 18.297 -1.678 -20.872
155 HB3 GLN 19 3HB GLN 19 19.432 -3.003 -21.095
156 HG2 GLN 19 2HG GLN 19 19.881 -1.776 -18.552
157 HG3 GLN 19 3HG GLN 19 18.174 -2.181 -18.727
158 HE21 GLN 19 1HE2 GLN 19 21.386 -3.387 -18.407
159 HE22 GLN 19 2HE2 GLN 19 20.974 -5.056 -18.237
160 H ALA 20 H ALA 20 18.974 0.371 -22.474
161 HA ALA 20 HA ALA 20 19.781 -0.867 -24.941
162 HB1 ALA 20 1HB ALA 20 17.598 -0.161 -25.064
163 HB2 ALA 20 2HB ALA 20 17.918 1.335 -24.186
164 HB3 ALA 20 3HB ALA 20 18.432 1.172 -25.865
165 H LEU 21 H LEU 21 20.648 1.990 -23.128
166 HA LEU 21 HA LEU 21 22.248 3.581 -23.417
167 HB2 LEU 21 2HB LEU 21 23.421 1.429 -25.171
168 HB3 LEU 21 3HB LEU 21 24.272 2.896 -24.692
169 HG LEU 21 HG LEU 21 23.263 0.815 -22.756
170 HD11 LEU 21 1HD1 LEU 21 25.021 -0.435 -23.253
171 HD12 LEU 21 2HD1 LEU 21 26.090 0.914 -22.871
172 HD13 LEU 21 3HD1 LEU 21 25.490 0.703 -24.516
173 HD21 LEU 21 3HD2 LEU 21 25.443 2.693 -22.094
174 HD22 LEU 21 1HD2 LEU 21 24.135 2.068 -21.090
175 HD23 LEU 21 2HD2 LEU 21 23.824 3.383 -22.223
176 H GLY 22 H GLY 22 20.557 4.819 -24.545
177 HA2 GLY 22 2HA GLY 22 20.026 4.913 -27.222
178 HA3 GLY 22 3HA GLY 22 20.081 6.345 -26.205
179 H GLY 23 H GLY 23 22.921 6.086 -25.609
180 HA2 GLY 23 2HA GLY 23 24.998 6.113 -26.847
181 HA3 GLY 23 3HA GLY 23 24.084 6.578 -28.274
182 H SER 24 H SER 24 25.021 7.713 -25.045
183 HA SER 24 HA SER 24 25.747 10.282 -26.064
184 HB2 SER 24 2HB SER 24 23.196 9.985 -24.485
185 HB3 SER 24 3HB SER 24 24.102 11.498 -24.506
186 HG SER 24 HG SER 24 23.798 11.622 -26.716
187 H GLU 25 H GLU 25 27.564 10.627 -24.985
188 HA GLU 25 HA GLU 25 28.334 9.369 -22.626
189 HB2 GLU 25 2HB GLU 25 30.053 11.241 -22.488
190 HB3 GLU 25 3HB GLU 25 30.045 10.289 -23.966
191 HG2 GLU 25 2HG GLU 25 29.733 12.101 -25.187
192 HG3 GLU 25 3HG GLU 25 28.287 12.519 -24.270
193 H ALA 26 H ALA 26 26.347 12.142 -23.120
194 HA ALA 26 HA ALA 26 26.636 13.140 -20.419
195 HB1 ALA 26 1HB ALA 26 26.108 14.972 -21.590
196 HB2 ALA 26 2HB ALA 26 25.365 14.043 -22.893
197 HB3 ALA 26 3HB ALA 26 24.444 14.411 -21.434
198 H GLU 27 H GLU 27 24.054 11.608 -22.336
199 HA GLU 27 HA GLU 27 22.068 11.492 -20.432
200 HB2 GLU 27 2HB GLU 27 22.788 9.514 -22.595
201 HB3 GLU 27 3HB GLU 27 21.327 9.386 -21.626
202 HG2 GLU 27 2HG GLU 27 20.667 11.641 -22.419
203 HG3 GLU 27 3HG GLU 27 22.072 11.631 -23.484
204 H CYS 28 H CYS 28 24.609 9.069 -21.024
205 HA CYS 28 HA CYS 28 23.899 7.248 -19.056
206 HB2 CYS 28 2HB CYS 28 26.731 7.926 -19.865
207 HB3 CYS 28 3HB CYS 28 26.154 6.402 -19.201
208 HG CYS 28 HG CYS 28 24.395 6.115 -21.552
209 H ALA 29 H ALA 29 25.907 10.147 -18.817
210 HA ALA 29 HA ALA 29 26.804 9.800 -16.188
211 HB1 ALA 29 1HB ALA 29 27.450 12.064 -16.236
212 HB2 ALA 29 2HB ALA 29 27.598 11.495 -17.899
213 HB3 ALA 29 3HB ALA 29 26.212 12.475 -17.423
214 H ALA 30 H ALA 30 24.019 11.675 -17.390
215 HA ALA 30 HA ALA 30 23.039 12.521 -14.927
216 HB1 ALA 30 1HB ALA 30 20.830 12.687 -16.115
217 HB2 ALA 30 2HB ALA 30 22.176 13.506 -16.908
218 HB3 ALA 30 3HB ALA 30 21.611 11.950 -17.515
219 H PHE 31 H PHE 31 22.618 9.470 -16.615
220 HA PHE 31 HA PHE 31 20.526 8.455 -15.004
221 HB2 PHE 31 2HB PHE 31 22.484 7.300 -16.933
222 HB3 PHE 31 3HB PHE 31 21.646 6.193 -15.850
223 HD1 PHE 31 HD1 PHE 31 20.267 9.300 -17.302
224 HD2 PHE 31 HD2 PHE 31 20.287 5.045 -17.380
225 HE1 PHE 31 HE1 PHE 31 18.313 9.322 -18.797
226 HE2 PHE 31 HE2 PHE 31 18.334 5.059 -18.877
227 HZ PHE 31 HZ PHE 31 17.345 7.200 -19.588
228 H GLU 32 H GLU 32 24.047 7.943 -14.907
229 HA GLU 32 HA GLU 32 24.136 6.223 -12.724
230 HB2 GLU 32 2HB GLU 32 26.140 8.304 -13.609
231 HB3 GLU 32 3HB GLU 32 26.470 7.061 -12.410
232 HG2 GLU 32 2HG GLU 32 26.552 5.388 -13.956
233 HG3 GLU 32 3HG GLU 32 25.456 6.210 -15.067
234 H LYS 33 H LYS 33 24.247 9.768 -12.800
235 HA LYS 33 HA LYS 33 24.591 10.166 -10.041
236 HB2 LYS 33 2HB LYS 33 23.949 11.789 -12.372
237 HB3 LYS 33 3HB LYS 33 23.112 12.346 -10.929
238 HG2 LYS 33 2HG LYS 33 25.026 13.540 -10.719
239 HG3 LYS 33 3HG LYS 33 25.526 12.074 -9.875
240 HD2 LYS 33 2HD LYS 33 27.222 11.904 -11.304
241 HD3 LYS 33 3HD LYS 33 26.049 11.609 -12.590
242 HE2 LYS 33 2HE LYS 33 27.355 13.413 -13.344
243 HE3 LYS 33 3HE LYS 33 25.850 14.135 -12.778
244 HZ1 LYS 33 3HZ LYS 33 27.949 13.923 -10.792
245 HZ2 LYS 33 1HZ LYS 33 26.886 15.199 -11.115
246 HZ3 LYS 33 2HZ LYS 33 28.271 14.992 -12.064
247 H GLU 34 H GLU 34 21.607 10.345 -11.991
248 HA GLU 34 HA GLU 34 19.799 10.783 -9.955
249 HB2 GLU 34 2HB GLU 34 19.671 10.143 -12.685
250 HB3 GLU 34 3HB GLU 34 18.698 8.926 -11.872
251 HG2 GLU 34 2HG GLU 34 17.432 10.722 -10.759
252 HG3 GLU 34 3HG GLU 34 18.368 11.909 -11.666
253 H ILE 35 H ILE 35 20.975 7.668 -11.190
254 HA ILE 35 HA ILE 35 19.435 6.018 -9.530
255 HB ILE 35 HB ILE 35 22.134 5.546 -10.790
256 HG12 ILE 35 2HG1 ILE 35 20.171 5.875 -12.298
257 HG13 ILE 35 3HG1 ILE 35 20.903 4.280 -12.436
258 HG21 ILE 35 1HG2 ILE 35 20.662 3.957 -8.845
259 HG22 ILE 35 2HG2 ILE 35 21.031 3.072 -10.324
260 HG23 ILE 35 3HG2 ILE 35 22.332 3.814 -9.393
261 HD11 ILE 35 3HD1 ILE 35 18.490 4.130 -12.471
262 HD12 ILE 35 1HD1 ILE 35 19.135 3.356 -11.024
263 HD13 ILE 35 2HD1 ILE 35 18.397 4.955 -10.915
264 H ALA 36 H ALA 36 22.668 7.397 -9.066
265 HA ALA 36 HA ALA 36 23.352 6.136 -6.687
266 HB1 ALA 36 1HB ALA 36 24.940 7.894 -6.348
267 HB2 ALA 36 2HB ALA 36 24.853 7.559 -8.078
268 HB3 ALA 36 3HB ALA 36 24.043 8.977 -7.413
269 H ALA 37 H ALA 37 21.640 9.222 -7.151
270 HA ALA 37 HA ALA 37 21.265 9.742 -4.395
271 HB1 ALA 37 1HB ALA 37 19.373 10.781 -6.457
272 HB2 ALA 37 2HB ALA 37 20.051 11.589 -5.043
273 HB3 ALA 37 3HB ALA 37 21.055 11.313 -6.466
274 H PHE 38 H PHE 38 19.406 7.969 -6.785
275 HA PHE 38 HA PHE 38 16.991 7.746 -5.379
276 HB2 PHE 38 2HB PHE 38 18.182 6.590 -7.736
277 HB3 PHE 38 3HB PHE 38 17.341 5.349 -6.814
278 HD1 PHE 38 HD2 PHE 38 16.527 8.950 -7.255
279 HD2 PHE 38 HD1 PHE 38 15.401 4.913 -7.995
280 HE1 PHE 38 HE2 PHE 38 14.383 9.722 -8.183
281 HE2 PHE 38 HE1 PHE 38 13.255 5.678 -8.925
282 HZ PHE 38 HZ PHE 38 12.743 8.085 -9.019
283 H GLU 39 H GLU 39 19.696 5.431 -5.580
284 HA GLU 39 HA GLU 39 18.658 3.627 -3.684
285 HB2 GLU 39 2HB GLU 39 20.959 2.722 -3.588
286 HB3 GLU 39 3HB GLU 39 20.386 2.943 -5.235
287 HG2 GLU 39 2HG GLU 39 21.649 5.050 -5.367
288 HG3 GLU 39 3HG GLU 39 22.265 4.758 -3.742
289 H SER 40 H SER 40 20.803 6.411 -3.378
290 HA SER 40 HA SER 40 21.466 6.014 -0.656
291 HB2 SER 40 2HB SER 40 22.877 7.453 -1.927
292 HB3 SER 40 3HB SER 40 21.517 8.456 -2.433
293 HG SER 40 HG SER 40 23.023 9.058 -0.523
294 H GLU 41 H GLU 41 18.767 7.523 -2.273
295 HA GLU 41 HA GLU 41 17.769 8.784 0.125
296 HB2 GLU 41 2HB GLU 41 16.796 8.544 -2.702
297 HB3 GLU 41 3HB GLU 41 15.704 9.095 -1.439
298 HG2 GLU 41 2HG GLU 41 17.252 10.916 -0.905
299 HG3 GLU 41 3HG GLU 41 18.323 10.372 -2.195
300 H LEU 42 H LEU 42 17.277 5.815 -1.633
301 HA LEU 42 HA LEU 42 14.862 5.100 -0.243
302 HB2 LEU 42 2HB LEU 42 16.727 3.485 -1.974
303 HB3 LEU 42 3HB LEU 42 15.193 2.898 -1.336
304 HG LEU 42 HG LEU 42 15.213 5.363 -3.018
305 HD11 LEU 42 1HD1 LEU 42 14.702 3.449 -4.855
306 HD12 LEU 42 2HD1 LEU 42 15.963 2.663 -3.905
307 HD13 LEU 42 3HD1 LEU 42 16.269 4.232 -4.648
308 HD21 LEU 42 3HD2 LEU 42 13.096 3.802 -3.731
309 HD22 LEU 42 1HD2 LEU 42 13.055 5.060 -2.495
310 HD23 LEU 42 2HD2 LEU 42 13.301 3.376 -2.031
311 H GLN 43 H GLN 43 18.284 4.585 0.169
312 HA GLN 43 HA GLN 43 18.028 2.466 2.079
313 HB2 GLN 43 2HB GLN 43 20.375 2.584 2.311
314 HB3 GLN 43 3HB GLN 43 20.054 2.948 0.621
315 HG2 GLN 43 2HG GLN 43 21.319 4.745 0.877
316 HG3 GLN 43 3HG GLN 43 20.019 5.422 1.856
317 HE21 GLN 43 1HE2 GLN 43 22.996 5.660 1.961
318 HE22 GLN 43 2HE2 GLN 43 23.412 5.269 3.591
319 H ALA 44 H ALA 44 17.750 5.869 2.195
320 HA ALA 44 HA ALA 44 18.434 6.146 4.983
321 HB1 ALA 44 1HB ALA 44 18.257 8.388 4.671
322 HB2 ALA 44 2HB ALA 44 18.474 7.905 2.988
323 HB3 ALA 44 3HB ALA 44 16.858 8.244 3.607
324 H TYR 45 H TYR 45 15.684 5.202 3.210
325 HA TYR 45 HA TYR 45 13.557 6.139 4.710
326 HB2 TYR 45 2HB TYR 45 14.025 3.744 3.013
327 HB3 TYR 45 3HB TYR 45 12.615 3.717 4.067
328 HD1 TYR 45 HD2 TYR 45 11.569 6.379 4.009
329 HD2 TYR 45 HD1 TYR 45 13.354 4.164 0.846
330 HE1 TYR 45 HE2 TYR 45 10.314 7.718 2.372
331 HE2 TYR 45 HE1 TYR 45 12.105 5.497 -0.801
332 HH TYR 45 HH TYR 45 9.509 7.176 -0.219
333 H LYS 46 H LYS 46 14.995 2.894 5.073
334 HA LYS 46 HA LYS 46 15.036 1.457 6.845
335 HB2 LYS 46 2HB LYS 46 15.797 4.112 7.994
336 HB3 LYS 46 3HB LYS 46 15.598 2.738 9.075
337 HG2 LYS 46 2HG LYS 46 17.261 2.251 6.697
338 HG3 LYS 46 3HG LYS 46 17.915 3.392 7.873
339 HD2 LYS 46 2HD LYS 46 18.731 1.428 8.723
340 HD3 LYS 46 3HD LYS 46 17.192 1.518 9.583
341 HE2 LYS 46 2HE LYS 46 16.454 -0.347 8.613
342 HE3 LYS 46 3HE LYS 46 16.892 0.237 7.009
343 HZ1 LYS 46 3HZ LYS 46 18.027 -1.865 7.969
344 HZ2 LYS 46 1HZ LYS 46 18.991 -0.759 8.812
345 HZ3 LYS 46 2HZ LYS 46 18.955 -0.733 7.121
346 H GLY 47 H GLY 47 12.599 1.367 6.346
347 HA2 GLY 47 2HA GLY 47 10.917 2.537 8.410
348 HA3 GLY 47 3HA GLY 47 10.376 1.574 7.042
349 H LYS 48 H LYS 48 12.693 0.914 9.663
350 HA LYS 48 HA LYS 48 12.916 -0.888 11.042
351 HB2 LYS 48 2HB LYS 48 11.018 0.245 12.115
352 HB3 LYS 48 3HB LYS 48 9.901 -0.652 11.095
353 HG2 LYS 48 2HG LYS 48 9.955 -2.429 12.430
354 HG3 LYS 48 3HG LYS 48 11.716 -2.396 12.539
355 HD2 LYS 48 2HD LYS 48 11.684 -0.890 14.342
356 HD3 LYS 48 3HD LYS 48 9.999 -0.448 14.052
357 HE2 LYS 48 2HE LYS 48 9.382 -1.985 15.531
358 HE3 LYS 48 3HE LYS 48 10.039 -3.231 14.470
359 HZ1 LYS 48 3HZ LYS 48 12.037 -3.266 15.620
360 HZ2 LYS 48 1HZ LYS 48 10.898 -3.095 16.859
361 HZ3 LYS 48 2HZ LYS 48 11.785 -1.754 16.335
362 H GLY 49 H GLY 49 13.729 -2.347 9.497
363 HA2 GLY 49 2HA GLY 49 13.775 -4.432 8.521
364 HA3 GLY 49 3HA GLY 49 12.172 -4.715 9.183
365 H ASN 50 H ASN 50 13.595 -2.540 6.736
366 HA ASN 50 HA ASN 50 11.366 -3.271 4.955
367 HB2 ASN 50 2HB ASN 50 12.780 -0.717 5.484
368 HB3 ASN 50 3HB ASN 50 12.331 -1.030 3.810
369 HD21 ASN 50 1HD2 ASN 50 10.869 0.695 3.870
370 HD22 ASN 50 2HD2 ASN 50 9.343 0.559 4.670
371 HA PRO 51 HA PRO 51 15.149 -5.102 3.036
372 HB2 PRO 51 2HB PRO 51 13.893 -7.357 2.193
373 HB3 PRO 51 3HB PRO 51 14.577 -7.187 3.815
374 HG2 PRO 51 2HG PRO 51 11.737 -6.888 2.915
375 HG3 PRO 51 3HG PRO 51 12.374 -7.703 4.355
376 HD2 PRO 51 2HD PRO 51 11.301 -5.219 4.442
377 HD3 PRO 51 3HD PRO 51 12.616 -5.729 5.519
378 H GLU 52 H GLU 52 12.005 -4.206 1.982
379 HA GLU 52 HA GLU 52 12.024 -4.901 -0.704
380 HB2 GLU 52 2HB GLU 52 10.576 -2.834 -1.001
381 HB3 GLU 52 3HB GLU 52 10.020 -4.013 0.178
382 HG2 GLU 52 2HG GLU 52 10.762 -2.665 1.994
383 HG3 GLU 52 3HG GLU 52 11.594 -1.557 0.903
384 H VAL 53 H VAL 53 13.578 -2.208 0.941
385 HA VAL 53 HA VAL 53 14.372 -0.804 -1.391
386 HB VAL 53 HB VAL 53 15.577 -0.768 1.379
387 HG11 VAL 53 1HG1 VAL 53 17.184 0.064 -0.208
388 HG12 VAL 53 2HG1 VAL 53 15.965 1.094 -0.961
389 HG13 VAL 53 3HG1 VAL 53 16.505 1.424 0.686
390 HG21 VAL 53 3HG2 VAL 53 13.245 -0.095 1.374
391 HG22 VAL 53 1HG2 VAL 53 14.281 1.306 1.647
392 HG23 VAL 53 2HG2 VAL 53 13.554 1.042 0.062
393 H GLU 54 H GLU 54 15.669 -3.533 0.317
394 HA GLU 54 HA GLU 54 18.331 -3.507 -0.377
395 HB2 GLU 54 2HB GLU 54 16.526 -5.932 -0.370
396 HB3 GLU 54 3HB GLU 54 18.277 -5.942 -0.215
397 HG2 GLU 54 2HG GLU 54 16.700 -4.367 1.746
398 HG3 GLU 54 3HG GLU 54 16.700 -6.124 1.881
399 H ALA 55 H ALA 55 15.621 -4.780 -2.296
400 HA ALA 55 HA ALA 55 17.177 -5.587 -4.508
401 HB1 ALA 55 1HB ALA 55 14.417 -5.558 -3.790
402 HB2 ALA 55 2HB ALA 55 14.594 -4.911 -5.422
403 HB3 ALA 55 3HB ALA 55 15.231 -6.509 -5.033
404 H LEU 56 H LEU 56 15.593 -2.554 -3.681
405 HA LEU 56 HA LEU 56 15.893 -1.290 -6.186
406 HB2 LEU 56 2HB LEU 56 15.002 -0.596 -3.548
407 HB3 LEU 56 3HB LEU 56 16.040 0.679 -4.184
408 HG LEU 56 HG LEU 56 14.588 1.035 -6.045
409 HD11 LEU 56 1HD1 LEU 56 13.550 -0.727 -6.917
410 HD12 LEU 56 2HD1 LEU 56 12.343 -0.536 -5.645
411 HD13 LEU 56 3HD1 LEU 56 13.694 -1.646 -5.418
412 HD21 LEU 56 3HD2 LEU 56 13.034 2.174 -4.892
413 HD22 LEU 56 1HD2 LEU 56 13.906 1.591 -3.474
414 HD23 LEU 56 2HD2 LEU 56 12.469 0.737 -4.037
415 H ARG 57 H ARG 57 17.853 -1.075 -3.218
416 HA ARG 57 HA ARG 57 19.833 0.612 -4.285
417 HB2 ARG 57 2HB ARG 57 21.204 -0.097 -2.374
418 HB3 ARG 57 3HB ARG 57 19.560 0.289 -1.883
419 HG2 ARG 57 2HG ARG 57 19.010 -2.074 -1.785
420 HG3 ARG 57 3HG ARG 57 20.634 -2.487 -2.338
421 HD2 ARG 57 2HD ARG 57 20.394 -0.754 0.058
422 HD3 ARG 57 3HD ARG 57 19.964 -2.454 0.237
423 HE ARG 57 HE ARG 57 22.493 -2.047 -1.058
424 HH11 ARG 57 1HH1 ARG 57 20.867 -2.313 2.009
425 HH12 ARG 57 2HH1 ARG 57 22.286 -2.818 2.865
426 HH21 ARG 57 1HH2 ARG 57 24.368 -2.711 0.058
427 HH22 ARG 57 2HH2 ARG 57 24.277 -3.043 1.755
428 H LYS 58 H LYS 58 19.493 -2.891 -4.238
429 HA LYS 58 HA LYS 58 22.074 -3.558 -5.122
430 HB2 LYS 58 2HB LYS 58 20.550 -5.217 -4.184
431 HB3 LYS 58 3HB LYS 58 19.455 -5.009 -5.544
432 HG2 LYS 58 2HG LYS 58 20.628 -6.388 -6.845
433 HG3 LYS 58 3HG LYS 58 22.172 -5.695 -6.345
434 HD2 LYS 58 2HD LYS 58 20.705 -7.367 -4.378
435 HD3 LYS 58 3HD LYS 58 21.475 -8.186 -5.738
436 HE2 LYS 58 2HE LYS 58 23.542 -6.751 -5.090
437 HE3 LYS 58 3HE LYS 58 22.716 -6.577 -3.542
438 HZ1 LYS 58 3HZ LYS 58 24.108 -8.428 -3.312
439 HZ2 LYS 58 1HZ LYS 58 23.688 -9.060 -4.824
440 HZ3 LYS 58 2HZ LYS 58 22.569 -9.086 -3.556
441 H GLU 59 H GLU 59 19.049 -3.276 -6.994
442 HA GLU 59 HA GLU 59 20.172 -3.663 -9.517
443 HB2 GLU 59 2HB GLU 59 17.725 -2.133 -8.641
444 HB3 GLU 59 3HB GLU 59 18.148 -2.358 -10.332
445 HG2 GLU 59 2HG GLU 59 18.270 -4.908 -9.419
446 HG3 GLU 59 3HG GLU 59 16.990 -4.238 -8.409
447 H ALA 60 H ALA 60 19.652 -0.674 -7.686
448 HA ALA 60 HA ALA 60 20.429 1.169 -9.614
449 HB1 ALA 60 1HB ALA 60 19.585 2.271 -7.829
450 HB2 ALA 60 2HB ALA 60 20.287 1.148 -6.664
451 HB3 ALA 60 3HB ALA 60 21.290 2.399 -7.397
452 H ALA 61 H ALA 61 22.453 -0.321 -7.083
453 HA ALA 61 HA ALA 61 24.879 0.820 -7.816
454 HB1 ALA 61 1HB ALA 61 25.902 -1.202 -6.711
455 HB2 ALA 61 2HB ALA 61 24.739 -0.304 -5.736
456 HB3 ALA 61 3HB ALA 61 24.262 -1.817 -6.506
457 H ALA 62 H ALA 62 23.367 -2.180 -8.949
458 HA ALA 62 HA ALA 62 25.478 -3.082 -10.558
459 HB1 ALA 62 1HB ALA 62 23.981 -4.629 -11.451
460 HB2 ALA 62 2HB ALA 62 23.337 -4.304 -9.840
461 HB3 ALA 62 3HB ALA 62 22.600 -3.549 -11.253
462 H ILE 63 H ILE 63 22.722 -0.982 -11.307
463 HA ILE 63 HA ILE 63 23.204 -0.724 -14.062
464 HB ILE 63 HB ILE 63 21.912 1.259 -12.185
465 HG12 ILE 63 2HG1 ILE 63 20.338 -0.434 -14.050
466 HG13 ILE 63 3HG1 ILE 63 21.043 -1.242 -12.654
467 HG21 ILE 63 1HG2 ILE 63 21.834 2.642 -13.919
468 HG22 ILE 63 2HG2 ILE 63 22.583 1.439 -14.967
469 HG23 ILE 63 3HG2 ILE 63 20.832 1.464 -14.765
470 HD11 ILE 63 3HD1 ILE 63 19.918 0.991 -11.543
471 HD12 ILE 63 1HD1 ILE 63 18.778 0.573 -12.822
472 HD13 ILE 63 2HD1 ILE 63 19.195 -0.617 -11.588
473 H ARG 64 H ARG 64 24.384 1.126 -11.292
474 HA ARG 64 HA ARG 64 25.701 3.130 -12.802
475 HB2 ARG 64 2HB ARG 64 25.081 3.353 -10.402
476 HB3 ARG 64 3HB ARG 64 26.331 2.184 -10.002
477 HG2 ARG 64 2HG ARG 64 27.551 4.183 -11.571
478 HG3 ARG 64 3HG ARG 64 26.555 4.999 -10.364
479 HD2 ARG 64 2HD ARG 64 27.624 3.633 -8.607
480 HD3 ARG 64 3HD ARG 64 28.658 2.903 -9.834
481 HE ARG 64 HE ARG 64 29.116 5.548 -10.143
482 HH11 ARG 64 1HH1 ARG 64 29.171 3.423 -7.386
483 HH12 ARG 64 2HH1 ARG 64 30.391 4.326 -6.550
484 HH21 ARG 64 1HH2 ARG 64 30.722 6.746 -9.053
485 HH22 ARG 64 2HH2 ARG 64 31.271 6.217 -7.499
486 H ASP 65 H ASP 65 26.665 -0.022 -11.593
487 HA ASP 65 HA ASP 65 29.440 0.238 -12.076
488 HB2 ASP 65 2HB ASP 65 27.726 -2.254 -11.991
489 HB3 ASP 65 3HB ASP 65 29.486 -2.226 -11.924
490 H GLU 66 H GLU 66 26.814 -1.179 -14.010
491 HA GLU 66 HA GLU 66 28.426 -1.964 -16.184
492 HB2 GLU 66 2HB GLU 66 26.273 -2.021 -17.454
493 HB3 GLU 66 3HB GLU 66 26.240 -2.916 -15.942
494 HG2 GLU 66 2HG GLU 66 25.096 -1.032 -14.867
495 HG3 GLU 66 3HG GLU 66 25.098 -0.170 -16.404
496 H CYS 67 H CYS 67 26.561 0.985 -15.565
497 HA CYS 67 HA CYS 67 26.988 2.225 -18.041
498 HB2 CYS 67 2HB CYS 67 26.471 3.358 -15.292
499 HB3 CYS 67 3HB CYS 67 26.573 4.365 -16.731
500 HG CYS 67 HG CYS 67 24.480 1.949 -17.376
501 H GLN 68 H GLN 68 28.903 2.225 -15.075
502 HA GLN 68 HA GLN 68 30.807 4.137 -15.996
503 HB2 GLN 68 2HB GLN 68 30.931 2.101 -13.767
504 HB3 GLN 68 3HB GLN 68 32.169 3.316 -14.060
505 HG2 GLN 68 2HG GLN 68 29.561 4.526 -13.913
506 HG3 GLN 68 3HG GLN 68 29.895 3.562 -12.475
507 HE21 GLN 68 1HE2 GLN 68 31.120 6.155 -14.509
508 HE22 GLN 68 2HE2 GLN 68 32.055 6.928 -13.279
509 H ALA 69 H ALA 69 30.482 0.675 -16.240
510 HA ALA 69 HA ALA 69 33.192 0.227 -17.098
511 HB1 ALA 69 1HB ALA 69 32.097 -1.560 -15.958
512 HB2 ALA 69 2HB ALA 69 30.752 -1.539 -17.099
513 HB3 ALA 69 3HB ALA 69 32.350 -2.066 -17.629
514 H TYR 70 H TYR 70 30.458 1.490 -18.567
515 HA TYR 70 HA TYR 70 31.158 0.522 -21.235
516 HB2 TYR 70 2HB TYR 70 28.842 2.223 -20.290
517 HB3 TYR 70 3HB TYR 70 29.084 1.681 -21.947
518 HD1 TYR 70 HD1 TYR 70 30.146 -1.119 -21.064
519 HD2 TYR 70 HD2 TYR 70 26.689 1.152 -20.065
520 HE1 TYR 70 HE1 TYR 70 28.932 -3.199 -20.564
521 HE2 TYR 70 HE2 TYR 70 25.466 -0.921 -19.560
522 HH TYR 70 HH TYR 70 25.549 -3.284 -20.096
523 H ARG 71 H ARG 71 31.004 3.493 -19.344
524 HA ARG 71 HA ARG 71 32.750 4.770 -21.321
525 HB2 ARG 71 2HB ARG 71 30.270 5.434 -21.562
526 HB3 ARG 71 3HB ARG 71 30.497 6.304 -20.051
527 HG2 ARG 71 2HG ARG 71 31.837 7.887 -20.999
528 HG3 ARG 71 3HG ARG 71 32.430 6.793 -22.251
529 HD2 ARG 71 2HD ARG 71 29.682 7.026 -22.704
530 HD3 ARG 71 3HD ARG 71 30.234 8.658 -22.329
531 HE ARG 71 HE ARG 71 31.394 8.692 -24.309
532 HH11 ARG 71 1HH1 ARG 71 30.381 5.436 -23.610
533 HH12 ARG 71 2HH1 ARG 71 30.835 4.821 -25.165
534 HH21 ARG 71 1HH2 ARG 71 31.995 7.895 -26.360
535 HH22 ARG 71 2HH2 ARG 71 31.754 6.221 -26.728
536 H HIS 72 H HIS 72 33.701 3.662 -19.043
537 HA HIS 72 HA HIS 72 35.076 5.757 -17.813
538 HB2 HIS 72 2HB HIS 72 32.535 5.681 -16.814
539 HB3 HIS 72 3HB HIS 72 33.386 4.645 -15.673
540 HD1 HIS 72 HD1 HIS 72 32.562 8.074 -16.221
541 HD2 HIS 72 HD2 HIS 72 35.839 6.060 -14.650
542 HE1 HIS 72 HE1 HIS 72 33.814 9.782 -14.865
543 H ASN 73 H ASN 73 35.504 3.133 -18.915
544 HA ASN 73 HA ASN 73 36.990 1.974 -16.677
545 HB2 ASN 73 2HB ASN 73 35.138 0.536 -16.624
546 HB3 ASN 73 3HB ASN 73 34.963 0.546 -18.376
547 HD21 ASN 73 1HD2 ASN 73 37.636 -0.133 -16.140
548 HD22 ASN 73 2HD2 ASN 73 38.032 -1.673 -16.815
Start of MODEL 16
1 H1 MET 1 H MET 1 5.487 -2.078 -4.240
2 HA MET 1 HA MET 1 3.399 -0.428 -4.611
3 HB2 MET 1 2HB MET 1 4.070 -1.921 -2.072
4 HB3 MET 1 3HB MET 1 2.497 -1.209 -2.405
5 HG2 MET 1 2HG MET 1 2.349 -2.640 -4.431
6 HG3 MET 1 3HG MET 1 3.844 -3.425 -3.926
7 HE1 MET 1 3HE MET 1 1.576 -5.213 -4.558
8 HE2 MET 1 1HE MET 1 2.926 -5.920 -3.669
9 HE3 MET 1 2HE MET 1 1.270 -6.217 -3.139
10 H GLY 2 H GLY 2 3.025 1.658 -4.279
11 HA2 GLY 2 2HA GLY 2 2.870 3.671 -3.145
12 HA3 GLY 2 3HA GLY 2 3.648 2.912 -1.764
13 H SER 3 H SER 3 5.387 4.049 -1.236
14 HA SER 3 HA SER 3 6.768 5.825 -2.855
15 HB2 SER 3 2HB SER 3 7.070 5.987 -0.499
16 HB3 SER 3 3HB SER 3 7.627 4.317 -0.384
17 HG SER 3 HG SER 3 9.558 4.888 -1.122
18 H TRP 4 H TRP 4 7.282 2.384 -2.345
19 HA TRP 4 HA TRP 4 9.758 2.261 -3.755
20 HB2 TRP 4 2HB TRP 4 9.203 0.553 -2.121
21 HB3 TRP 4 3HB TRP 4 7.768 0.099 -3.036
22 HD1 TRP 4 HD1 TRP 4 10.837 0.713 -5.126
23 HE1 TRP 4 HE1 TRP 4 11.761 -1.533 -5.977
24 HE3 TRP 4 HE3 TRP 4 8.005 -2.459 -2.286
25 HZ2 TRP 4 HZ2 TRP 4 11.345 -4.285 -5.507
26 HZ3 TRP 4 HZ3 TRP 4 8.330 -4.884 -2.548
27 HH2 TRP 4 HH2 TRP 4 9.965 -5.776 -4.126
28 H ALA 5 H ALA 5 6.393 1.524 -4.613
29 HA ALA 5 HA ALA 5 6.702 0.486 -7.131
30 HB1 ALA 5 1HB ALA 5 4.572 1.182 -5.662
31 HB2 ALA 5 2HB ALA 5 4.541 2.479 -6.857
32 HB3 ALA 5 3HB ALA 5 4.477 0.796 -7.380
33 H GLU 6 H GLU 6 6.408 3.943 -6.313
34 HA GLU 6 HA GLU 6 6.684 4.949 -8.899
35 HB2 GLU 6 2HB GLU 6 7.032 6.029 -6.159
36 HB3 GLU 6 3HB GLU 6 7.787 6.937 -7.461
37 HG2 GLU 6 2HG GLU 6 5.656 7.152 -8.589
38 HG3 GLU 6 3HG GLU 6 4.879 6.172 -7.347
39 H PHE 7 H PHE 7 9.183 4.502 -6.401
40 HA PHE 7 HA PHE 7 11.363 5.370 -7.906
41 HB2 PHE 7 2HB PHE 7 10.941 3.914 -5.422
42 HB3 PHE 7 3HB PHE 7 12.376 3.355 -6.275
43 HD1 PHE 7 HD2 PHE 7 10.716 6.548 -5.295
44 HD2 PHE 7 HD1 PHE 7 14.361 4.426 -5.861
45 HE1 PHE 7 HE2 PHE 7 11.971 8.483 -4.439
46 HE2 PHE 7 HE1 PHE 7 15.623 6.357 -5.005
47 HZ PHE 7 HZ PHE 7 14.428 8.390 -4.294
48 H LYS 8 H LYS 8 9.756 2.254 -7.792
49 HA LYS 8 HA LYS 8 11.708 0.784 -9.216
50 HB2 LYS 8 2HB LYS 8 9.401 0.152 -7.904
51 HB3 LYS 8 3HB LYS 8 8.902 -0.035 -9.580
52 HG2 LYS 8 2HG LYS 8 10.539 -1.689 -9.984
53 HG3 LYS 8 3HG LYS 8 11.370 -1.338 -8.467
54 HD2 LYS 8 2HD LYS 8 10.211 -3.145 -7.753
55 HD3 LYS 8 3HD LYS 8 8.931 -1.952 -7.518
56 HE2 LYS 8 2HE LYS 8 7.811 -2.595 -9.454
57 HE3 LYS 8 3HE LYS 8 9.238 -3.371 -10.138
58 HZ1 LYS 8 3HZ LYS 8 7.687 -5.029 -9.397
59 HZ2 LYS 8 1HZ LYS 8 7.627 -4.355 -7.846
60 HZ3 LYS 8 2HZ LYS 8 9.052 -5.077 -8.400
61 H GLN 9 H GLN 9 8.786 2.507 -10.249
62 HA GLN 9 HA GLN 9 8.914 1.803 -12.967
63 HB2 GLN 9 2HB GLN 9 7.248 3.366 -11.339
64 HB3 GLN 9 3HB GLN 9 7.837 4.457 -12.586
65 HG2 GLN 9 2HG GLN 9 6.257 1.932 -12.908
66 HG3 GLN 9 3HG GLN 9 5.843 3.566 -13.424
67 HE21 GLN 9 1HE2 GLN 9 6.327 0.811 -14.740
68 HE22 GLN 9 2HE2 GLN 9 7.293 1.205 -16.116
69 H ARG 10 H ARG 10 9.894 4.857 -11.400
70 HA ARG 10 HA ARG 10 11.069 6.037 -13.625
71 HB2 ARG 10 2HB ARG 10 11.539 6.337 -10.672
72 HB3 ARG 10 3HB ARG 10 12.500 7.242 -11.833
73 HG2 ARG 10 2HG ARG 10 10.813 8.723 -11.307
74 HG3 ARG 10 3HG ARG 10 10.217 7.979 -12.792
75 HD2 ARG 10 2HD ARG 10 8.814 6.474 -11.504
76 HD3 ARG 10 3HD ARG 10 9.454 7.135 -10.000
77 HE ARG 10 HE ARG 10 7.434 8.295 -11.683
78 HH11 ARG 10 1HH1 ARG 10 9.876 8.931 -9.285
79 HH12 ARG 10 2HH1 ARG 10 9.136 10.397 -8.732
80 HH21 ARG 10 1HH2 ARG 10 6.451 10.223 -10.964
81 HH22 ARG 10 2HH2 ARG 10 7.188 11.131 -9.687
82 H LEU 11 H LEU 11 12.509 3.920 -11.174
83 HA LEU 11 HA LEU 11 15.156 4.048 -12.107
84 HB2 LEU 11 2HB LEU 11 14.708 3.186 -9.930
85 HB3 LEU 11 3HB LEU 11 13.668 1.922 -10.583
86 HG LEU 11 HG LEU 11 16.451 1.848 -11.528
87 HD11 LEU 11 1HD1 LEU 11 15.871 2.080 -8.702
88 HD12 LEU 11 2HD1 LEU 11 17.423 2.058 -9.540
89 HD13 LEU 11 3HD1 LEU 11 16.640 0.542 -9.094
90 HD21 LEU 11 3HD2 LEU 11 14.445 -0.135 -10.478
91 HD22 LEU 11 1HD2 LEU 11 16.094 -0.570 -10.928
92 HD23 LEU 11 2HD2 LEU 11 14.991 0.082 -12.141
93 H ALA 12 H ALA 12 12.462 1.931 -12.957
94 HA ALA 12 HA ALA 12 13.891 0.129 -14.575
95 HB1 ALA 12 1HB ALA 12 11.075 0.800 -14.105
96 HB2 ALA 12 2HB ALA 12 11.419 0.132 -15.701
97 HB3 ALA 12 3HB ALA 12 11.861 -0.772 -14.252
98 H ALA 13 H ALA 13 12.158 3.123 -15.378
99 HA ALA 13 HA ALA 13 12.590 3.013 -18.160
100 HB1 ALA 13 1HB ALA 13 11.075 4.628 -17.918
101 HB2 ALA 13 2HB ALA 13 11.543 4.926 -16.244
102 HB3 ALA 13 3HB ALA 13 12.427 5.702 -17.559
103 H ILE 14 H ILE 14 14.433 4.519 -15.537
104 HA ILE 14 HA ILE 14 16.337 5.820 -17.151
105 HB ILE 14 HB ILE 14 16.654 4.782 -14.332
106 HG12 ILE 14 2HG1 ILE 14 16.193 7.652 -15.013
107 HG13 ILE 14 3HG1 ILE 14 14.816 6.555 -15.048
108 HG21 ILE 14 1HG2 ILE 14 18.800 5.230 -15.429
109 HG22 ILE 14 2HG2 ILE 14 18.255 6.860 -15.818
110 HG23 ILE 14 3HG2 ILE 14 18.475 6.383 -14.135
111 HD11 ILE 14 3HD1 ILE 14 14.996 7.682 -12.907
112 HD12 ILE 14 1HD1 ILE 14 15.243 5.945 -12.727
113 HD13 ILE 14 2HD1 ILE 14 16.625 7.041 -12.693
114 H LYS 15 H LYS 15 16.262 2.589 -15.720
115 HA LYS 15 HA LYS 15 18.890 1.847 -16.451
116 HB2 LYS 15 2HB LYS 15 17.343 0.718 -14.758
117 HB3 LYS 15 3HB LYS 15 16.576 -0.059 -16.137
118 HG2 LYS 15 2HG LYS 15 18.634 -1.152 -16.731
119 HG3 LYS 15 3HG LYS 15 19.503 -0.278 -15.468
120 HD2 LYS 15 2HD LYS 15 19.092 -2.398 -14.551
121 HD3 LYS 15 3HD LYS 15 17.862 -1.355 -13.834
122 HE2 LYS 15 2HE LYS 15 16.466 -2.155 -15.926
123 HE3 LYS 15 3HE LYS 15 17.585 -3.515 -15.865
124 HZ1 LYS 15 3HZ LYS 15 16.294 -2.704 -13.371
125 HZ2 LYS 15 1HZ LYS 15 16.740 -4.246 -13.904
126 HZ3 LYS 15 2HZ LYS 15 15.345 -3.510 -14.515
127 H THR 16 H THR 16 15.748 1.374 -18.024
128 HA THR 16 HA THR 16 16.613 -0.187 -20.175
129 HB THR 16 HB THR 16 14.346 1.814 -20.106
130 HG1 THR 16 HG1 THR 16 14.418 -0.999 -19.635
131 HG21 THR 16 3HG2 THR 16 13.414 0.515 -21.969
132 HG22 THR 16 1HG2 THR 16 14.871 -0.478 -22.004
133 HG23 THR 16 2HG2 THR 16 14.963 1.238 -22.400
134 H ARG 17 H ARG 17 16.201 3.346 -19.970
135 HA ARG 17 HA ARG 17 17.050 3.944 -22.567
136 HB2 ARG 17 2HB ARG 17 16.542 5.407 -20.098
137 HB3 ARG 17 3HB ARG 17 17.856 6.110 -21.032
138 HG2 ARG 17 2HG ARG 17 15.887 7.202 -21.724
139 HG3 ARG 17 3HG ARG 17 16.306 6.078 -23.018
140 HD2 ARG 17 2HD ARG 17 14.708 4.528 -21.460
141 HD3 ARG 17 3HD ARG 17 13.984 6.117 -21.220
142 HE ARG 17 HE ARG 17 14.400 5.754 -23.959
143 HH11 ARG 17 1HH1 ARG 17 12.463 4.439 -21.382
144 HH12 ARG 17 2HH1 ARG 17 11.153 3.988 -22.422
145 HH21 ARG 17 1HH2 ARG 17 12.682 5.165 -25.338
146 HH22 ARG 17 2HH2 ARG 17 11.278 4.401 -24.672
147 H CYS 18 H CYS 18 18.882 3.705 -19.542
148 HA CYS 18 HA CYS 18 21.372 4.479 -20.630
149 HB2 CYS 18 2HB CYS 18 20.388 3.834 -18.099
150 HB3 CYS 18 3HB CYS 18 21.615 2.614 -18.418
151 HG CYS 18 HG CYS 18 22.451 5.836 -19.014
152 H GLN 19 H GLN 19 19.833 1.329 -20.172
153 HA GLN 19 HA GLN 19 22.027 -0.252 -20.953
154 HB2 GLN 19 2HB GLN 19 19.058 -0.792 -21.068
155 HB3 GLN 19 3HB GLN 19 20.286 -2.006 -21.402
156 HG2 GLN 19 2HG GLN 19 20.615 -0.592 -18.855
157 HG3 GLN 19 3HG GLN 19 19.155 -1.573 -18.982
158 HE21 GLN 19 1HE2 GLN 19 19.716 -3.767 -20.172
159 HE22 GLN 19 2HE2 GLN 19 21.038 -4.623 -19.462
160 H ALA 20 H ALA 20 19.487 1.341 -22.782
161 HA ALA 20 HA ALA 20 20.167 0.083 -25.272
162 HB1 ALA 20 1HB ALA 20 18.428 2.458 -24.629
163 HB2 ALA 20 2HB ALA 20 18.619 1.775 -26.245
164 HB3 ALA 20 3HB ALA 20 17.907 0.805 -24.956
165 H LEU 21 H LEU 21 21.176 2.915 -23.537
166 HA LEU 21 HA LEU 21 22.638 4.599 -24.008
167 HB2 LEU 21 2HB LEU 21 23.941 2.674 -25.907
168 HB3 LEU 21 3HB LEU 21 24.695 3.941 -24.941
169 HG LEU 21 HG LEU 21 23.364 1.728 -23.480
170 HD11 LEU 21 1HD1 LEU 21 25.488 1.313 -25.430
171 HD12 LEU 21 2HD1 LEU 21 24.468 0.142 -24.594
172 HD13 LEU 21 3HD1 LEU 21 25.914 0.772 -23.806
173 HD21 LEU 21 3HD2 LEU 21 25.422 2.047 -22.071
174 HD22 LEU 21 1HD2 LEU 21 24.358 3.450 -22.181
175 HD23 LEU 21 2HD2 LEU 21 25.846 3.396 -23.127
176 H GLY 22 H GLY 22 20.262 4.372 -25.718
177 HA2 GLY 22 2HA GLY 22 21.303 5.525 -28.225
178 HA3 GLY 22 3HA GLY 22 19.721 4.782 -28.042
179 H GLY 23 H GLY 23 21.200 7.096 -25.826
180 HA2 GLY 23 2HA GLY 23 19.031 8.979 -26.523
181 HA3 GLY 23 3HA GLY 23 19.673 8.786 -24.898
182 H SER 24 H SER 24 22.260 9.006 -25.003
183 HA SER 24 HA SER 24 23.419 10.797 -26.808
184 HB2 SER 24 2HB SER 24 21.673 12.053 -24.888
185 HB3 SER 24 3HB SER 24 23.335 12.579 -24.623
186 HG SER 24 HG SER 24 23.255 12.826 -27.076
187 H GLU 25 H GLU 25 25.583 10.990 -26.441
188 HA GLU 25 HA GLU 25 26.832 9.240 -24.664
189 HB2 GLU 25 2HB GLU 25 28.921 10.440 -25.241
190 HB3 GLU 25 3HB GLU 25 27.964 10.015 -26.653
191 HG2 GLU 25 2HG GLU 25 27.050 12.351 -26.613
192 HG3 GLU 25 3HG GLU 25 28.250 12.719 -25.376
193 H ALA 26 H ALA 26 25.809 12.542 -24.268
194 HA ALA 26 HA ALA 26 27.307 12.917 -21.816
195 HB1 ALA 26 1HB ALA 26 27.107 15.040 -22.427
196 HB2 ALA 26 2HB ALA 26 25.959 14.608 -23.695
197 HB3 ALA 26 3HB ALA 26 25.383 14.947 -22.063
198 H GLU 27 H GLU 27 23.961 12.348 -22.798
199 HA GLU 27 HA GLU 27 22.627 12.740 -20.427
200 HB2 GLU 27 2HB GLU 27 20.913 11.943 -21.614
201 HB3 GLU 27 3HB GLU 27 22.049 11.565 -22.901
202 HG2 GLU 27 2HG GLU 27 22.396 9.342 -21.927
203 HG3 GLU 27 3HG GLU 27 21.224 9.724 -20.667
204 H CYS 28 H CYS 28 24.638 10.027 -21.380
205 HA CYS 28 HA CYS 28 23.976 8.122 -19.517
206 HB2 CYS 28 2HB CYS 28 26.692 8.871 -20.606
207 HB3 CYS 28 3HB CYS 28 26.404 7.434 -19.633
208 HG CYS 28 HG CYS 28 25.892 5.959 -21.659
209 H ALA 29 H ALA 29 26.155 10.887 -19.097
210 HA ALA 29 HA ALA 29 27.065 10.330 -16.528
211 HB1 ALA 29 1HB ALA 29 27.921 12.119 -18.045
212 HB2 ALA 29 2HB ALA 29 26.508 13.084 -17.614
213 HB3 ALA 29 3HB ALA 29 27.679 12.633 -16.375
214 H ALA 30 H ALA 30 24.294 12.359 -17.489
215 HA ALA 30 HA ALA 30 23.393 13.019 -14.945
216 HB1 ALA 30 1HB ALA 30 21.248 12.549 -16.876
217 HB2 ALA 30 2HB ALA 30 21.709 14.024 -16.026
218 HB3 ALA 30 3HB ALA 30 22.564 13.548 -17.493
219 H PHE 31 H PHE 31 22.845 10.119 -16.856
220 HA PHE 31 HA PHE 31 20.791 9.007 -15.278
221 HB2 PHE 31 2HB PHE 31 22.723 7.959 -17.294
222 HB3 PHE 31 3HB PHE 31 21.871 6.797 -16.283
223 HD1 PHE 31 HD2 PHE 31 20.918 9.958 -18.028
224 HD2 PHE 31 HD1 PHE 31 20.110 5.831 -17.374
225 HE1 PHE 31 HE2 PHE 31 18.961 10.109 -19.512
226 HE2 PHE 31 HE1 PHE 31 18.152 5.975 -18.857
227 HZ PHE 31 HZ PHE 31 17.575 8.116 -19.927
228 H GLU 32 H GLU 32 24.306 8.439 -15.263
229 HA GLU 32 HA GLU 32 24.398 6.587 -13.193
230 HB2 GLU 32 2HB GLU 32 26.355 6.959 -14.506
231 HB3 GLU 32 3HB GLU 32 26.396 8.664 -14.079
232 HG2 GLU 32 2HG GLU 32 28.103 7.279 -12.930
233 HG3 GLU 32 3HG GLU 32 27.040 8.169 -11.842
234 H LYS 33 H LYS 33 24.587 10.128 -13.044
235 HA LYS 33 HA LYS 33 24.977 10.359 -10.280
236 HB2 LYS 33 2HB LYS 33 24.569 12.106 -12.466
237 HB3 LYS 33 3HB LYS 33 23.366 12.529 -11.254
238 HG2 LYS 33 2HG LYS 33 24.900 13.636 -10.113
239 HG3 LYS 33 3HG LYS 33 25.841 12.155 -9.925
240 HD2 LYS 33 2HD LYS 33 26.809 12.599 -12.200
241 HD3 LYS 33 3HD LYS 33 26.013 14.174 -12.157
242 HE2 LYS 33 2HE LYS 33 27.967 14.847 -11.260
243 HE3 LYS 33 3HE LYS 33 27.275 14.201 -9.772
244 HZ1 LYS 33 3HZ LYS 33 28.817 12.432 -11.546
245 HZ2 LYS 33 1HZ LYS 33 28.577 12.328 -9.875
246 HZ3 LYS 33 2HZ LYS 33 29.635 13.486 -10.506
247 H GLU 34 H GLU 34 21.956 10.554 -12.163
248 HA GLU 34 HA GLU 34 20.173 10.936 -10.093
249 HB2 GLU 34 2HB GLU 34 20.012 10.326 -12.827
250 HB3 GLU 34 3HB GLU 34 19.081 9.075 -12.015
251 HG2 GLU 34 2HG GLU 34 18.688 12.046 -11.739
252 HG3 GLU 34 3HG GLU 34 17.666 10.935 -12.649
253 H ILE 35 H ILE 35 21.346 7.845 -11.403
254 HA ILE 35 HA ILE 35 19.878 6.156 -9.726
255 HB ILE 35 HB ILE 35 22.587 5.709 -10.983
256 HG12 ILE 35 2HG1 ILE 35 20.701 6.147 -12.547
257 HG13 ILE 35 3HG1 ILE 35 21.365 4.525 -12.709
258 HG21 ILE 35 1HG2 ILE 35 21.510 3.239 -10.683
259 HG22 ILE 35 2HG2 ILE 35 22.674 3.962 -9.575
260 HG23 ILE 35 3HG2 ILE 35 20.950 4.036 -9.213
261 HD11 ILE 35 3HD1 ILE 35 19.510 3.649 -11.371
262 HD12 ILE 35 1HD1 ILE 35 18.838 5.276 -11.261
263 HD13 ILE 35 2HD1 ILE 35 18.955 4.474 -12.827
264 H ALA 36 H ALA 36 23.110 7.560 -9.313
265 HA ALA 36 HA ALA 36 23.858 6.289 -6.964
266 HB1 ALA 36 1HB ALA 36 25.523 7.888 -6.752
267 HB2 ALA 36 2HB ALA 36 25.171 7.921 -8.480
268 HB3 ALA 36 3HB ALA 36 24.516 9.172 -7.423
269 H ALA 37 H ALA 37 22.087 9.353 -7.347
270 HA ALA 37 HA ALA 37 21.760 9.835 -4.581
271 HB1 ALA 37 1HB ALA 37 21.143 11.788 -5.433
272 HB2 ALA 37 2HB ALA 37 20.982 11.082 -7.042
273 HB3 ALA 37 3HB ALA 37 19.618 11.051 -5.924
274 H PHE 38 H PHE 38 19.894 8.027 -6.936
275 HA PHE 38 HA PHE 38 17.513 7.739 -5.489
276 HB2 PHE 38 2HB PHE 38 18.680 6.634 -7.870
277 HB3 PHE 38 3HB PHE 38 17.940 5.343 -6.928
278 HD1 PHE 38 HD1 PHE 38 16.912 8.895 -7.329
279 HD2 PHE 38 HD2 PHE 38 15.987 4.802 -8.044
280 HE1 PHE 38 HE1 PHE 38 14.699 9.547 -8.183
281 HE2 PHE 38 HE2 PHE 38 13.774 5.448 -8.900
282 HZ PHE 38 HZ PHE 38 13.127 7.823 -8.972
283 H GLU 39 H GLU 39 20.305 5.533 -5.698
284 HA GLU 39 HA GLU 39 19.339 3.695 -3.788
285 HB2 GLU 39 2HB GLU 39 21.695 2.893 -3.702
286 HB3 GLU 39 3HB GLU 39 21.055 3.023 -5.334
287 HG2 GLU 39 2HG GLU 39 22.221 5.159 -5.613
288 HG3 GLU 39 3HG GLU 39 22.880 5.000 -3.986
289 H SER 40 H SER 40 21.412 6.539 -3.525
290 HA SER 40 HA SER 40 22.119 6.180 -0.810
291 HB2 SER 40 2HB SER 40 23.173 7.741 -2.592
292 HB3 SER 40 3HB SER 40 21.916 8.883 -2.116
293 HG SER 40 HG SER 40 22.805 8.242 0.132
294 H GLU 41 H GLU 41 19.365 7.627 -2.401
295 HA GLU 41 HA GLU 41 18.359 8.864 0.003
296 HB2 GLU 41 2HB GLU 41 17.334 8.558 -2.802
297 HB3 GLU 41 3HB GLU 41 16.268 9.118 -1.521
298 HG2 GLU 41 2HG GLU 41 18.692 10.599 -1.389
299 HG3 GLU 41 3HG GLU 41 18.111 10.608 -3.053
300 H LEU 42 H LEU 42 17.927 5.868 -1.726
301 HA LEU 42 HA LEU 42 15.550 5.089 -0.315
302 HB2 LEU 42 2HB LEU 42 17.475 3.575 -2.064
303 HB3 LEU 42 3HB LEU 42 16.044 2.846 -1.339
304 HG LEU 42 HG LEU 42 15.762 5.263 -3.077
305 HD11 LEU 42 1HD1 LEU 42 16.536 4.215 -4.869
306 HD12 LEU 42 2HD1 LEU 42 15.278 2.998 -4.661
307 HD13 LEU 42 3HD1 LEU 42 16.864 2.760 -3.928
308 HD21 LEU 42 3HD2 LEU 42 13.680 4.827 -2.338
309 HD22 LEU 42 1HD2 LEU 42 14.057 3.150 -1.941
310 HD23 LEU 42 2HD2 LEU 42 13.699 3.602 -3.608
311 H GLN 43 H GLN 43 18.989 4.691 0.108
312 HA GLN 43 HA GLN 43 18.783 2.619 2.079
313 HB2 GLN 43 2HB GLN 43 21.131 2.787 2.294
314 HB3 GLN 43 3HB GLN 43 20.791 3.082 0.594
315 HG2 GLN 43 2HG GLN 43 21.979 4.938 0.747
316 HG3 GLN 43 3HG GLN 43 20.723 5.594 1.796
317 HE21 GLN 43 1HE2 GLN 43 23.905 4.319 1.602
318 HE22 GLN 43 2HE2 GLN 43 24.342 4.562 3.256
319 H ALA 44 H ALA 44 18.356 5.988 2.096
320 HA ALA 44 HA ALA 44 19.056 6.345 4.888
321 HB1 ALA 44 1HB ALA 44 17.634 8.337 3.144
322 HB2 ALA 44 2HB ALA 44 18.621 8.637 4.575
323 HB3 ALA 44 3HB ALA 44 19.380 8.095 3.078
324 H TYR 45 H TYR 45 16.349 5.355 3.096
325 HA TYR 45 HA TYR 45 14.188 6.372 4.493
326 HB2 TYR 45 2HB TYR 45 14.695 3.977 2.845
327 HB3 TYR 45 3HB TYR 45 13.328 3.853 3.946
328 HD1 TYR 45 HD1 TYR 45 12.054 6.386 3.946
329 HD2 TYR 45 HD2 TYR 45 13.977 4.416 0.702
330 HE1 TYR 45 HE1 TYR 45 10.660 7.649 2.361
331 HE2 TYR 45 HE2 TYR 45 12.589 5.674 -0.892
332 HH TYR 45 HH TYR 45 10.643 6.925 -1.051
333 H LYS 46 H LYS 46 15.628 3.154 5.050
334 HA LYS 46 HA LYS 46 15.872 3.403 7.826
335 HB2 LYS 46 2HB LYS 46 13.192 2.777 6.881
336 HB3 LYS 46 3HB LYS 46 13.821 1.526 7.946
337 HG2 LYS 46 2HG LYS 46 13.701 2.833 9.764
338 HG3 LYS 46 3HG LYS 46 14.231 4.274 8.893
339 HD2 LYS 46 2HD LYS 46 12.115 4.903 8.380
340 HD3 LYS 46 3HD LYS 46 11.551 3.240 8.200
341 HE2 LYS 46 2HE LYS 46 11.969 3.222 10.821
342 HE3 LYS 46 3HE LYS 46 11.701 4.953 10.622
343 HZ1 LYS 46 3HZ LYS 46 9.831 2.865 9.647
344 HZ2 LYS 46 1HZ LYS 46 9.566 4.536 9.682
345 HZ3 LYS 46 2HZ LYS 46 9.665 3.665 11.129
346 H GLY 47 H GLY 47 14.436 0.710 5.995
347 HA2 GLY 47 2HA GLY 47 15.651 -1.118 5.074
348 HA3 GLY 47 3HA GLY 47 17.016 -0.686 6.093
349 H LYS 48 H LYS 48 16.309 -0.731 8.560
350 HA LYS 48 HA LYS 48 16.029 -3.374 9.297
351 HB2 LYS 48 2HB LYS 48 15.395 -2.473 11.561
352 HB3 LYS 48 3HB LYS 48 16.876 -1.809 10.883
353 HG2 LYS 48 2HG LYS 48 15.513 0.151 10.099
354 HG3 LYS 48 3HG LYS 48 14.178 -0.493 11.058
355 HD2 LYS 48 2HD LYS 48 15.036 0.359 12.927
356 HD3 LYS 48 3HD LYS 48 16.593 -0.416 12.622
357 HE2 LYS 48 2HE LYS 48 17.242 1.437 11.177
358 HE3 LYS 48 3HE LYS 48 15.675 2.202 11.435
359 HZ1 LYS 48 3HZ LYS 48 17.909 1.884 13.328
360 HZ2 LYS 48 1HZ LYS 48 16.331 2.084 13.904
361 HZ3 LYS 48 2HZ LYS 48 17.035 3.278 12.935
362 H GLY 49 H GLY 49 13.498 -0.873 9.173
363 HA2 GLY 49 2HA GLY 49 11.488 -3.011 9.470
364 HA3 GLY 49 3HA GLY 49 11.219 -1.318 9.856
365 H ASN 50 H ASN 50 12.970 -1.919 6.979
366 HA ASN 50 HA ASN 50 10.552 -1.772 5.332
367 HB2 ASN 50 2HB ASN 50 12.914 0.081 4.956
368 HB3 ASN 50 3HB ASN 50 11.429 0.062 4.009
369 HD21 ASN 50 1HD2 ASN 50 10.051 1.588 4.514
370 HD22 ASN 50 2HD2 ASN 50 9.862 2.324 6.066
371 HA PRO 51 HA PRO 51 13.566 -4.865 3.707
372 HB2 PRO 51 2HB PRO 51 11.667 -6.696 3.066
373 HB3 PRO 51 3HB PRO 51 12.376 -6.572 4.680
374 HG2 PRO 51 2HG PRO 51 9.767 -5.506 3.670
375 HG3 PRO 51 3HG PRO 51 10.125 -6.318 5.205
376 HD2 PRO 51 2HD PRO 51 9.879 -3.629 5.003
377 HD3 PRO 51 3HD PRO 51 10.975 -4.403 6.165
378 H GLU 52 H GLU 52 10.837 -3.175 2.472
379 HA GLU 52 HA GLU 52 10.780 -4.150 -0.166
380 HB2 GLU 52 2HB GLU 52 9.646 -2.004 -0.705
381 HB3 GLU 52 3HB GLU 52 8.948 -2.833 0.679
382 HG2 GLU 52 2HG GLU 52 10.566 -1.295 2.038
383 HG3 GLU 52 3HG GLU 52 10.525 -0.311 0.577
384 H VAL 53 H VAL 53 12.768 -1.737 1.416
385 HA VAL 53 HA VAL 53 13.857 -0.529 -0.883
386 HB VAL 53 HB VAL 53 15.176 -0.863 1.814
387 HG11 VAL 53 1HG1 VAL 53 16.376 1.211 1.163
388 HG12 VAL 53 2HG1 VAL 53 16.768 -0.178 0.147
389 HG13 VAL 53 3HG1 VAL 53 15.670 1.069 -0.446
390 HG21 VAL 53 3HG2 VAL 53 12.879 0.676 0.990
391 HG22 VAL 53 1HG2 VAL 53 13.554 0.441 2.602
392 HG23 VAL 53 2HG2 VAL 53 14.173 1.726 1.565
393 H GLU 54 H GLU 54 14.387 -3.598 0.549
394 HA GLU 54 HA GLU 54 17.007 -4.191 -0.054
395 HB2 GLU 54 2HB GLU 54 14.555 -5.945 -0.208
396 HB3 GLU 54 3HB GLU 54 16.193 -6.562 -0.369
397 HG2 GLU 54 2HG GLU 54 15.523 -4.925 2.018
398 HG3 GLU 54 3HG GLU 54 14.936 -6.585 1.936
399 H ALA 55 H ALA 55 14.212 -4.857 -2.171
400 HA ALA 55 HA ALA 55 15.664 -5.659 -4.410
401 HB1 ALA 55 1HB ALA 55 12.911 -4.784 -3.876
402 HB2 ALA 55 2HB ALA 55 13.456 -4.575 -5.541
403 HB3 ALA 55 3HB ALA 55 13.508 -6.170 -4.789
404 H LEU 56 H LEU 56 14.763 -2.448 -3.302
405 HA LEU 56 HA LEU 56 15.443 -1.046 -5.659
406 HB2 LEU 56 2HB LEU 56 15.196 -0.245 -2.778
407 HB3 LEU 56 3HB LEU 56 15.694 0.905 -4.016
408 HG LEU 56 HG LEU 56 13.138 -0.614 -4.337
409 HD11 LEU 56 1HD1 LEU 56 12.562 1.913 -3.225
410 HD12 LEU 56 2HD1 LEU 56 13.715 1.122 -2.151
411 HD13 LEU 56 3HD1 LEU 56 12.200 0.320 -2.562
412 HD21 LEU 56 3HD2 LEU 56 14.411 1.073 -5.981
413 HD22 LEU 56 1HD2 LEU 56 13.470 2.236 -5.047
414 HD23 LEU 56 2HD2 LEU 56 12.653 0.936 -5.914
415 H ARG 57 H ARG 57 17.283 -1.874 -2.751
416 HA ARG 57 HA ARG 57 19.620 -0.443 -3.417
417 HB2 ARG 57 2HB ARG 57 19.296 -1.167 -1.154
418 HB3 ARG 57 3HB ARG 57 19.172 -2.849 -1.651
419 HG2 ARG 57 2HG ARG 57 21.682 -1.435 -2.320
420 HG3 ARG 57 3HG ARG 57 21.390 -1.806 -0.620
421 HD2 ARG 57 2HD ARG 57 20.717 -4.102 -2.144
422 HD3 ARG 57 3HD ARG 57 22.292 -3.532 -2.694
423 HE ARG 57 HE ARG 57 22.181 -3.591 0.136
424 HH11 ARG 57 1HH1 ARG 57 22.454 -5.660 -2.650
425 HH12 ARG 57 2HH1 ARG 57 23.315 -6.903 -1.806
426 HH21 ARG 57 1HH2 ARG 57 23.316 -5.220 1.259
427 HH22 ARG 57 2HH2 ARG 57 23.804 -6.653 0.418
428 H LYS 58 H LYS 58 18.642 -3.799 -4.001
429 HA LYS 58 HA LYS 58 21.053 -4.657 -5.176
430 HB2 LYS 58 2HB LYS 58 19.242 -6.160 -4.353
431 HB3 LYS 58 3HB LYS 58 18.263 -5.682 -5.733
432 HG2 LYS 58 2HG LYS 58 19.155 -7.648 -6.487
433 HG3 LYS 58 3HG LYS 58 20.333 -6.490 -7.108
434 HD2 LYS 58 2HD LYS 58 21.541 -6.921 -4.839
435 HD3 LYS 58 3HD LYS 58 20.570 -8.395 -4.814
436 HE2 LYS 58 2HE LYS 58 21.488 -9.058 -6.964
437 HE3 LYS 58 3HE LYS 58 22.409 -7.558 -7.055
438 HZ1 LYS 58 3HZ LYS 58 24.032 -8.519 -5.923
439 HZ2 LYS 58 1HZ LYS 58 23.159 -9.968 -5.864
440 HZ3 LYS 58 2HZ LYS 58 22.994 -8.830 -4.624
441 H GLU 59 H GLU 59 17.974 -3.803 -6.773
442 HA GLU 59 HA GLU 59 18.882 -3.873 -9.389
443 HB2 GLU 59 2HB GLU 59 16.738 -2.181 -8.106
444 HB3 GLU 59 3HB GLU 59 17.014 -2.221 -9.842
445 HG2 GLU 59 2HG GLU 59 16.817 -4.896 -8.903
446 HG3 GLU 59 3HG GLU 59 15.459 -3.972 -8.263
447 H ALA 60 H ALA 60 18.702 -1.055 -7.219
448 HA ALA 60 HA ALA 60 19.703 0.884 -8.902
449 HB1 ALA 60 1HB ALA 60 20.335 0.671 -5.963
450 HB2 ALA 60 2HB ALA 60 20.294 2.136 -6.946
451 HB3 ALA 60 3HB ALA 60 18.803 1.255 -6.612
452 H ALA 61 H ALA 61 21.576 -1.188 -6.687
453 HA ALA 61 HA ALA 61 24.113 -0.256 -7.294
454 HB1 ALA 61 1HB ALA 61 23.567 -1.826 -5.460
455 HB2 ALA 61 2HB ALA 61 23.392 -3.113 -6.654
456 HB3 ALA 61 3HB ALA 61 24.957 -2.335 -6.419
457 H ALA 62 H ALA 62 22.265 -2.843 -8.877
458 HA ALA 62 HA ALA 62 24.214 -3.666 -10.697
459 HB1 ALA 62 1HB ALA 62 22.501 -4.780 -11.855
460 HB2 ALA 62 2HB ALA 62 21.975 -4.755 -10.172
461 HB3 ALA 62 3HB ALA 62 21.278 -3.623 -11.330
462 H ILE 63 H ILE 63 21.716 -1.163 -11.012
463 HA ILE 63 HA ILE 63 22.224 -0.457 -13.672
464 HB ILE 63 HB ILE 63 21.237 1.318 -11.436
465 HG12 ILE 63 2HG1 ILE 63 19.400 0.199 -13.476
466 HG13 ILE 63 3HG1 ILE 63 20.037 -0.941 -12.296
467 HG21 ILE 63 1HG2 ILE 63 20.192 2.598 -13.319
468 HG22 ILE 63 2HG2 ILE 63 21.951 2.694 -13.244
469 HG23 ILE 63 3HG2 ILE 63 21.175 1.642 -14.428
470 HD11 ILE 63 3HD1 ILE 63 17.800 0.331 -11.866
471 HD12 ILE 63 1HD1 ILE 63 18.940 0.047 -10.551
472 HD13 ILE 63 2HD1 ILE 63 18.876 1.624 -11.338
473 H ARG 64 H ARG 64 23.561 0.851 -10.652
474 HA ARG 64 HA ARG 64 25.118 2.884 -11.753
475 HB2 ARG 64 2HB ARG 64 24.751 2.762 -9.372
476 HB3 ARG 64 3HB ARG 64 25.568 1.207 -9.282
477 HG2 ARG 64 2HG ARG 64 27.178 3.386 -10.410
478 HG3 ARG 64 3HG ARG 64 26.723 3.583 -8.716
479 HD2 ARG 64 2HD ARG 64 27.487 0.978 -8.760
480 HD3 ARG 64 3HD ARG 64 28.562 1.668 -9.974
481 HE ARG 64 HE ARG 64 29.667 2.807 -8.313
482 HH11 ARG 64 1HH1 ARG 64 26.693 1.503 -7.058
483 HH12 ARG 64 2HH1 ARG 64 27.074 1.873 -5.409
484 HH21 ARG 64 1HH2 ARG 64 30.180 3.299 -6.145
485 HH22 ARG 64 2HH2 ARG 64 29.058 2.895 -4.891
486 H ASP 65 H ASP 65 25.965 -0.497 -11.070
487 HA ASP 65 HA ASP 65 28.639 -0.382 -11.880
488 HB2 ASP 65 2HB ASP 65 26.643 -2.641 -11.815
489 HB3 ASP 65 3HB ASP 65 28.315 -2.883 -12.312
490 H GLU 66 H GLU 66 25.697 -1.065 -13.727
491 HA GLU 66 HA GLU 66 26.952 -1.715 -16.159
492 HB2 GLU 66 2HB GLU 66 24.236 -0.444 -15.779
493 HB3 GLU 66 3HB GLU 66 24.785 -1.338 -17.190
494 HG2 GLU 66 2HG GLU 66 25.035 -2.874 -14.743
495 HG3 GLU 66 3HG GLU 66 23.380 -2.353 -15.052
496 H CYS 67 H CYS 67 25.729 1.367 -14.900
497 HA CYS 67 HA CYS 67 26.213 2.930 -17.166
498 HB2 CYS 67 2HB CYS 67 26.301 3.739 -14.251
499 HB3 CYS 67 3HB CYS 67 26.203 4.853 -15.609
500 HG CYS 67 HG CYS 67 23.676 4.865 -14.642
501 H GLN 68 H GLN 68 28.310 2.143 -14.423
502 HA GLN 68 HA GLN 68 30.483 3.758 -15.325
503 HB2 GLN 68 2HB GLN 68 30.433 1.470 -13.349
504 HB3 GLN 68 3HB GLN 68 31.785 2.568 -13.592
505 HG2 GLN 68 2HG GLN 68 29.565 4.201 -13.126
506 HG3 GLN 68 3HG GLN 68 29.447 2.882 -11.961
507 HE21 GLN 68 1HE2 GLN 68 30.489 5.895 -12.250
508 HE22 GLN 68 2HE2 GLN 68 31.841 5.882 -11.174
509 H ALA 69 H ALA 69 29.443 0.486 -15.891
510 HA ALA 69 HA ALA 69 31.910 -0.495 -16.920
511 HB1 ALA 69 1HB ALA 69 29.090 -1.487 -17.313
512 HB2 ALA 69 2HB ALA 69 30.548 -2.357 -17.792
513 HB3 ALA 69 3HB ALA 69 30.238 -2.027 -16.088
514 H TYR 70 H TYR 70 29.414 1.484 -18.202
515 HA TYR 70 HA TYR 70 29.688 0.885 -20.948
516 HB2 TYR 70 2HB TYR 70 28.786 3.426 -19.577
517 HB3 TYR 70 3HB TYR 70 28.626 3.112 -21.302
518 HD1 TYR 70 HD1 TYR 70 28.052 0.018 -20.511
519 HD2 TYR 70 HD2 TYR 70 26.307 3.787 -19.586
520 HE1 TYR 70 HE1 TYR 70 25.891 -1.087 -20.111
521 HE2 TYR 70 HE2 TYR 70 24.142 2.692 -19.182
522 HH TYR 70 HH TYR 70 23.726 -0.795 -19.679
523 H ARG 71 H ARG 71 31.295 3.225 -18.839
524 HA ARG 71 HA ARG 71 33.703 3.225 -20.236
525 HB2 ARG 71 2HB ARG 71 33.563 5.556 -21.224
526 HB3 ARG 71 3HB ARG 71 32.678 4.301 -22.080
527 HG2 ARG 71 2HG ARG 71 31.080 5.666 -20.061
528 HG3 ARG 71 3HG ARG 71 31.682 6.735 -21.329
529 HD2 ARG 71 2HD ARG 71 30.762 4.338 -22.547
530 HD3 ARG 71 3HD ARG 71 29.517 4.901 -21.433
531 HE ARG 71 HE ARG 71 29.148 6.712 -22.798
532 HH11 ARG 71 1HH1 ARG 71 32.084 5.103 -23.754
533 HH12 ARG 71 2HH1 ARG 71 32.260 6.013 -25.218
534 HH21 ARG 71 1HH2 ARG 71 29.368 7.915 -24.723
535 HH22 ARG 71 2HH2 ARG 71 30.715 7.612 -25.768
536 H HIS 72 H HIS 72 33.332 3.057 -17.647
537 HA HIS 72 HA HIS 72 34.875 5.099 -16.536
538 HB2 HIS 72 2HB HIS 72 32.332 6.029 -16.875
539 HB3 HIS 72 3HB HIS 72 32.246 5.386 -15.237
540 HD1 HIS 72 HD1 HIS 72 34.025 7.993 -17.285
541 HD2 HIS 72 HD2 HIS 72 33.561 6.873 -13.311
542 HE1 HIS 72 HE1 HIS 72 35.028 9.865 -15.937
543 H ASN 73 H ASN 73 34.863 2.316 -16.491
544 HA ASN 73 HA ASN 73 34.720 1.853 -13.611
545 HB2 ASN 73 2HB ASN 73 32.675 0.863 -14.130
546 HB3 ASN 73 3HB ASN 73 33.235 0.294 -15.699
547 HD21 ASN 73 1HD2 ASN 73 33.375 -0.241 -12.246
548 HD22 ASN 73 2HD2 ASN 73 33.873 -1.893 -12.329
Start of MODEL 17
1 H1 MET 1 H MET 1 3.516 -1.637 -5.921
2 HA MET 1 HA MET 1 1.851 0.408 -6.774
3 HB2 MET 1 2HB MET 1 1.588 -1.838 -4.843
4 HB3 MET 1 3HB MET 1 0.362 -0.579 -4.789
5 HG2 MET 1 2HG MET 1 -0.582 -1.240 -6.704
6 HG3 MET 1 3HG MET 1 0.970 -1.553 -7.478
7 HE1 MET 1 3HE MET 1 -1.809 -4.304 -7.451
8 HE2 MET 1 1HE MET 1 -1.078 -2.965 -8.337
9 HE3 MET 1 2HE MET 1 -0.354 -4.572 -8.413
10 H GLY 2 H GLY 2 1.015 2.245 -5.867
11 HA2 GLY 2 2HA GLY 2 0.679 3.914 -4.291
12 HA3 GLY 2 3HA GLY 2 1.503 2.914 -3.103
13 H SER 3 H SER 3 3.335 3.734 -2.372
14 HA SER 3 HA SER 3 4.612 5.921 -3.757
15 HB2 SER 3 2HB SER 3 5.708 4.592 -1.291
16 HB3 SER 3 3HB SER 3 5.835 6.279 -1.787
17 HG SER 3 HG SER 3 4.270 6.375 -0.319
18 H TRP 4 H TRP 4 5.151 2.518 -3.268
19 HA TRP 4 HA TRP 4 7.891 2.525 -4.096
20 HB2 TRP 4 2HB TRP 4 7.299 0.703 -2.735
21 HB3 TRP 4 3HB TRP 4 5.835 0.374 -3.658
22 HD1 TRP 4 HD1 TRP 4 6.152 -0.901 -6.033
23 HE1 TRP 4 HE1 TRP 4 8.010 -2.481 -6.856
24 HE3 TRP 4 HE3 TRP 4 9.763 0.232 -2.595
25 HZ2 TRP 4 HZ2 TRP 4 10.656 -3.158 -6.142
26 HZ3 TRP 4 HZ3 TRP 4 11.929 -0.927 -2.735
27 HH2 TRP 4 HH2 TRP 4 12.364 -2.587 -4.471
28 H ALA 5 H ALA 5 4.789 2.049 -5.678
29 HA ALA 5 HA ALA 5 5.540 0.953 -8.088
30 HB1 ALA 5 1HB ALA 5 3.620 2.915 -8.707
31 HB2 ALA 5 2HB ALA 5 3.357 1.200 -8.391
32 HB3 ALA 5 3HB ALA 5 3.271 2.363 -7.068
33 H GLU 6 H GLU 6 5.343 4.435 -7.332
34 HA GLU 6 HA GLU 6 6.262 5.424 -9.748
35 HB2 GLU 6 2HB GLU 6 6.446 6.458 -6.934
36 HB3 GLU 6 3HB GLU 6 7.169 7.350 -8.266
37 HG2 GLU 6 2HG GLU 6 4.387 6.516 -8.691
38 HG3 GLU 6 3HG GLU 6 4.636 7.683 -7.393
39 H PHE 7 H PHE 7 8.208 4.811 -6.822
40 HA PHE 7 HA PHE 7 10.699 5.410 -7.838
41 HB2 PHE 7 2HB PHE 7 9.654 3.897 -5.583
42 HB3 PHE 7 3HB PHE 7 11.166 3.223 -6.182
43 HD1 PHE 7 HD2 PHE 7 9.610 6.419 -5.099
44 HD2 PHE 7 HD1 PHE 7 13.189 4.160 -5.553
45 HE1 PHE 7 HE2 PHE 7 10.859 8.161 -3.893
46 HE2 PHE 7 HE1 PHE 7 14.443 5.899 -4.346
47 HZ PHE 7 HZ PHE 7 13.279 7.903 -3.515
48 H LYS 8 H LYS 8 8.871 2.405 -8.115
49 HA LYS 8 HA LYS 8 10.907 0.858 -9.305
50 HB2 LYS 8 2HB LYS 8 8.847 -0.085 -8.304
51 HB3 LYS 8 3HB LYS 8 7.913 0.591 -9.632
52 HG2 LYS 8 2HG LYS 8 8.414 -1.106 -10.977
53 HG3 LYS 8 3HG LYS 8 10.128 -1.034 -10.563
54 HD2 LYS 8 2HD LYS 8 9.617 -3.092 -9.712
55 HD3 LYS 8 3HD LYS 8 9.252 -2.095 -8.301
56 HE2 LYS 8 2HE LYS 8 7.262 -3.065 -10.350
57 HE3 LYS 8 3HE LYS 8 7.480 -3.725 -8.730
58 HZ1 LYS 8 3HZ LYS 8 6.163 -1.275 -9.573
59 HZ2 LYS 8 1HZ LYS 8 7.080 -1.167 -8.156
60 HZ3 LYS 8 2HZ LYS 8 5.824 -2.294 -8.266
61 H GLN 9 H GLN 9 8.412 2.957 -10.660
62 HA GLN 9 HA GLN 9 8.808 2.311 -13.366
63 HB2 GLN 9 2HB GLN 9 7.440 4.407 -11.843
64 HB3 GLN 9 3HB GLN 9 8.029 4.948 -13.409
65 HG2 GLN 9 2HG GLN 9 6.877 2.903 -14.378
66 HG3 GLN 9 3HG GLN 9 6.081 2.749 -12.813
67 HE21 GLN 9 1HE2 GLN 9 5.609 5.358 -12.168
68 HE22 GLN 9 2HE2 GLN 9 4.498 6.049 -13.295
69 H ARG 10 H ARG 10 10.316 4.738 -11.285
70 HA ARG 10 HA ARG 10 11.834 5.988 -13.323
71 HB2 ARG 10 2HB ARG 10 12.658 5.872 -10.431
72 HB3 ARG 10 3HB ARG 10 12.929 7.161 -11.596
73 HG2 ARG 10 2HG ARG 10 10.443 6.463 -10.098
74 HG3 ARG 10 3HG ARG 10 11.260 8.019 -10.252
75 HD2 ARG 10 2HD ARG 10 10.651 7.622 -12.816
76 HD3 ARG 10 3HD ARG 10 9.357 6.675 -12.084
77 HE ARG 10 HE ARG 10 9.553 9.231 -10.871
78 HH11 ARG 10 1HH1 ARG 10 8.438 7.618 -13.748
79 HH12 ARG 10 2HH1 ARG 10 7.219 8.799 -14.095
80 HH21 ARG 10 1HH2 ARG 10 7.952 10.793 -11.318
81 HH22 ARG 10 2HH2 ARG 10 6.944 10.605 -12.713
82 H LEU 11 H LEU 11 12.576 3.409 -11.006
83 HA LEU 11 HA LEU 11 15.285 3.100 -11.768
84 HB2 LEU 11 2HB LEU 11 13.333 1.653 -10.114
85 HB3 LEU 11 3HB LEU 11 14.605 0.652 -10.811
86 HG LEU 11 HG LEU 11 15.688 3.041 -9.585
87 HD11 LEU 11 1HD1 LEU 11 15.222 2.333 -7.250
88 HD12 LEU 11 2HD1 LEU 11 14.008 1.217 -7.875
89 HD13 LEU 11 3HD1 LEU 11 13.807 2.954 -8.102
90 HD21 LEU 11 3HD2 LEU 11 16.057 0.074 -9.234
91 HD22 LEU 11 1HD2 LEU 11 16.993 1.282 -8.355
92 HD23 LEU 11 2HD2 LEU 11 17.092 1.200 -10.114
93 H ALA 12 H ALA 12 12.279 1.687 -12.910
94 HA ALA 12 HA ALA 12 13.449 -0.334 -14.522
95 HB1 ALA 12 1HB ALA 12 11.233 -0.757 -14.066
96 HB2 ALA 12 2HB ALA 12 10.744 0.915 -14.345
97 HB3 ALA 12 3HB ALA 12 11.135 -0.129 -15.712
98 H ALA 13 H ALA 13 12.345 2.966 -15.194
99 HA ALA 13 HA ALA 13 12.857 2.885 -17.980
100 HB1 ALA 13 1HB ALA 13 11.988 4.948 -17.994
101 HB2 ALA 13 2HB ALA 13 11.604 4.636 -16.301
102 HB3 ALA 13 3HB ALA 13 13.072 5.517 -16.725
103 H ILE 14 H ILE 14 14.775 3.915 -15.196
104 HA ILE 14 HA ILE 14 16.940 4.974 -16.685
105 HB ILE 14 HB ILE 14 16.833 3.929 -13.855
106 HG12 ILE 14 2HG1 ILE 14 17.102 6.804 -14.663
107 HG13 ILE 14 3HG1 ILE 14 15.517 6.039 -14.687
108 HG21 ILE 14 1HG2 ILE 14 19.059 3.961 -13.900
109 HG22 ILE 14 2HG2 ILE 14 19.087 4.714 -15.494
110 HG23 ILE 14 3HG2 ILE 14 18.943 5.714 -14.048
111 HD11 ILE 14 3HD1 ILE 14 15.408 6.737 -12.570
112 HD12 ILE 14 1HD1 ILE 14 16.408 5.325 -12.230
113 HD13 ILE 14 2HD1 ILE 14 17.158 6.909 -12.429
114 H LYS 15 H LYS 15 16.295 1.790 -15.288
115 HA LYS 15 HA LYS 15 18.823 0.673 -15.942
116 HB2 LYS 15 2HB LYS 15 16.950 -0.142 -14.287
117 HB3 LYS 15 3HB LYS 15 16.357 -1.006 -15.699
118 HG2 LYS 15 2HG LYS 15 19.100 -1.532 -15.600
119 HG3 LYS 15 3HG LYS 15 18.526 -1.657 -13.936
120 HD2 LYS 15 2HD LYS 15 17.290 -3.059 -16.305
121 HD3 LYS 15 3HD LYS 15 18.409 -3.802 -15.160
122 HE2 LYS 15 2HE LYS 15 16.739 -4.235 -13.762
123 HE3 LYS 15 3HE LYS 15 16.299 -2.528 -13.716
124 HZ1 LYS 15 3HZ LYS 15 14.680 -4.405 -14.628
125 HZ2 LYS 15 1HZ LYS 15 15.472 -4.022 -16.073
126 HZ3 LYS 15 2HZ LYS 15 14.654 -2.818 -15.212
127 H THR 16 H THR 16 15.682 0.718 -17.562
128 HA THR 16 HA THR 16 16.323 -1.039 -19.662
129 HB THR 16 HB THR 16 14.353 1.256 -19.650
130 HG1 THR 16 HG1 THR 16 14.294 -1.386 -18.732
131 HG21 THR 16 3HG2 THR 16 14.735 0.675 -21.920
132 HG22 THR 16 1HG2 THR 16 13.242 -0.135 -21.449
133 HG23 THR 16 2HG2 THR 16 14.747 -1.049 -21.550
134 H ARG 17 H ARG 17 16.354 2.525 -19.561
135 HA ARG 17 HA ARG 17 17.401 2.854 -22.163
136 HB2 ARG 17 2HB ARG 17 17.245 4.638 -19.748
137 HB3 ARG 17 3HB ARG 17 18.069 5.162 -21.210
138 HG2 ARG 17 2HG ARG 17 16.155 5.604 -22.255
139 HG3 ARG 17 3HG ARG 17 15.425 4.081 -21.742
140 HD2 ARG 17 2HD ARG 17 14.422 5.014 -19.949
141 HD3 ARG 17 3HD ARG 17 15.774 6.099 -19.628
142 HE ARG 17 HE ARG 17 14.629 7.072 -21.911
143 HH11 ARG 17 1HH1 ARG 17 13.516 6.375 -18.687
144 HH12 ARG 17 2HH1 ARG 17 12.306 7.615 -18.696
145 HH21 ARG 17 1HH2 ARG 17 13.039 8.708 -21.936
146 HH22 ARG 17 2HH2 ARG 17 12.035 8.941 -20.545
147 H CYS 18 H CYS 18 18.893 2.395 -19.028
148 HA CYS 18 HA CYS 18 21.533 3.093 -19.842
149 HB2 CYS 18 2HB CYS 18 21.068 3.221 -17.516
150 HB3 CYS 18 3HB CYS 18 20.435 1.580 -17.477
151 HG CYS 18 HG CYS 18 22.655 0.909 -16.308
152 H GLN 19 H GLN 19 19.757 0.050 -19.558
153 HA GLN 19 HA GLN 19 21.968 -1.611 -20.228
154 HB2 GLN 19 2HB GLN 19 18.991 -2.120 -20.315
155 HB3 GLN 19 3HB GLN 19 20.211 -3.357 -20.592
156 HG2 GLN 19 2HG GLN 19 20.602 -1.871 -18.114
157 HG3 GLN 19 3HG GLN 19 19.072 -2.745 -18.186
158 HE21 GLN 19 1HE2 GLN 19 19.880 -4.072 -16.489
159 HE22 GLN 19 2HE2 GLN 19 20.979 -5.361 -16.830
160 H ALA 20 H ALA 20 19.458 0.001 -22.071
161 HA ALA 20 HA ALA 20 20.160 -1.332 -24.538
162 HB1 ALA 20 1HB ALA 20 18.592 0.708 -25.337
163 HB2 ALA 20 2HB ALA 20 17.971 -0.828 -24.729
164 HB3 ALA 20 3HB ALA 20 18.087 0.565 -23.653
165 H LEU 21 H LEU 21 20.892 1.672 -22.913
166 HA LEU 21 HA LEU 21 22.281 3.405 -23.406
167 HB2 LEU 21 2HB LEU 21 23.575 1.167 -24.939
168 HB3 LEU 21 3HB LEU 21 24.282 2.778 -24.839
169 HG LEU 21 HG LEU 21 23.776 0.906 -22.526
170 HD11 LEU 21 1HD1 LEU 21 25.888 0.203 -22.709
171 HD12 LEU 21 2HD1 LEU 21 26.493 1.816 -23.084
172 HD13 LEU 21 3HD1 LEU 21 25.802 0.815 -24.361
173 HD21 LEU 21 3HD2 LEU 21 25.504 3.013 -21.825
174 HD22 LEU 21 1HD2 LEU 21 23.881 2.691 -21.215
175 HD23 LEU 21 2HD2 LEU 21 24.105 3.747 -22.610
176 H GLY 22 H GLY 22 20.361 4.295 -24.566
177 HA2 GLY 22 2HA GLY 22 19.824 4.134 -27.248
178 HA3 GLY 22 3HA GLY 22 19.630 5.608 -26.310
179 H GLY 23 H GLY 23 22.501 5.802 -25.717
180 HA2 GLY 23 2HA GLY 23 24.531 6.046 -27.056
181 HA3 GLY 23 3HA GLY 23 23.501 6.471 -28.415
182 H SER 24 H SER 24 24.329 7.554 -25.129
183 HA SER 24 HA SER 24 24.760 10.238 -26.063
184 HB2 SER 24 2HB SER 24 22.423 9.657 -24.229
185 HB3 SER 24 3HB SER 24 23.066 11.268 -24.548
186 HG SER 24 HG SER 24 21.639 9.547 -26.235
187 H GLU 25 H GLU 25 26.550 10.796 -25.032
188 HA GLU 25 HA GLU 25 27.572 9.511 -22.767
189 HB2 GLU 25 2HB GLU 25 29.109 11.526 -22.639
190 HB3 GLU 25 3HB GLU 25 29.108 10.648 -24.162
191 HG2 GLU 25 2HG GLU 25 28.590 12.492 -25.259
192 HG3 GLU 25 3HG GLU 25 27.131 12.691 -24.289
193 H ALA 26 H ALA 26 25.240 12.009 -23.063
194 HA ALA 26 HA ALA 26 25.575 13.006 -20.368
195 HB1 ALA 26 1HB ALA 26 24.230 14.708 -20.976
196 HB2 ALA 26 2HB ALA 26 24.605 14.152 -22.607
197 HB3 ALA 26 3HB ALA 26 23.103 13.654 -21.829
198 H GLU 27 H GLU 27 23.222 11.031 -22.144
199 HA GLU 27 HA GLU 27 21.308 10.669 -20.198
200 HB2 GLU 27 2HB GLU 27 22.320 8.891 -22.392
201 HB3 GLU 27 3HB GLU 27 21.088 8.310 -21.281
202 HG2 GLU 27 2HG GLU 27 19.791 10.420 -21.895
203 HG3 GLU 27 3HG GLU 27 20.925 10.573 -23.236
204 H CYS 28 H CYS 28 24.209 8.675 -20.734
205 HA CYS 28 HA CYS 28 23.857 6.857 -18.678
206 HB2 CYS 28 2HB CYS 28 26.504 8.009 -19.582
207 HB3 CYS 28 3HB CYS 28 26.248 6.458 -18.791
208 HG CYS 28 HG CYS 28 26.845 5.993 -21.477
209 H ALA 29 H ALA 29 25.463 10.021 -18.579
210 HA ALA 29 HA ALA 29 26.291 9.923 -15.902
211 HB1 ALA 29 1HB ALA 29 27.001 11.576 -17.678
212 HB2 ALA 29 2HB ALA 29 25.498 12.438 -17.346
213 HB3 ALA 29 3HB ALA 29 26.702 12.242 -16.073
214 H ALA 30 H ALA 30 23.350 11.317 -17.343
215 HA ALA 30 HA ALA 30 22.180 12.316 -15.035
216 HB1 ALA 30 1HB ALA 30 20.421 12.765 -16.351
217 HB2 ALA 30 2HB ALA 30 21.460 12.189 -17.655
218 HB3 ALA 30 3HB ALA 30 20.289 11.098 -16.914
219 H PHE 31 H PHE 31 22.146 9.039 -16.338
220 HA PHE 31 HA PHE 31 20.237 7.991 -14.527
221 HB2 PHE 31 2HB PHE 31 22.392 6.670 -16.180
222 HB3 PHE 31 3HB PHE 31 21.237 5.767 -15.204
223 HD1 PHE 31 HD2 PHE 31 18.764 7.283 -15.664
224 HD2 PHE 31 HD1 PHE 31 21.849 6.155 -18.371
225 HE1 PHE 31 HE2 PHE 31 17.151 7.340 -17.521
226 HE2 PHE 31 HE1 PHE 31 20.241 6.211 -20.232
227 HZ PHE 31 HZ PHE 31 17.889 6.803 -19.808
228 H GLU 32 H GLU 32 23.795 7.832 -14.569
229 HA GLU 32 HA GLU 32 24.205 6.388 -12.255
230 HB2 GLU 32 2HB GLU 32 25.846 7.538 -14.040
231 HB3 GLU 32 3HB GLU 32 26.022 8.689 -12.722
232 HG2 GLU 32 2HG GLU 32 26.285 5.786 -12.132
233 HG3 GLU 32 3HG GLU 32 27.611 6.619 -12.942
234 H LYS 33 H LYS 33 23.775 9.894 -12.597
235 HA LYS 33 HA LYS 33 24.093 10.507 -9.857
236 HB2 LYS 33 2HB LYS 33 23.523 11.918 -12.272
237 HB3 LYS 33 3HB LYS 33 22.333 12.390 -11.066
238 HG2 LYS 33 2HG LYS 33 24.151 13.912 -10.929
239 HG3 LYS 33 3HG LYS 33 24.218 12.873 -9.504
240 HD2 LYS 33 2HD LYS 33 26.150 11.875 -10.158
241 HD3 LYS 33 3HD LYS 33 25.746 11.974 -11.873
242 HE2 LYS 33 2HE LYS 33 27.470 13.487 -11.737
243 HE3 LYS 33 3HE LYS 33 26.078 14.541 -11.494
244 HZ1 LYS 33 3HZ LYS 33 27.145 15.196 -9.667
245 HZ2 LYS 33 1HZ LYS 33 28.209 13.880 -9.685
246 HZ3 LYS 33 2HZ LYS 33 26.678 13.720 -8.985
247 H GLU 34 H GLU 34 21.134 10.252 -11.835
248 HA GLU 34 HA GLU 34 19.263 10.629 -9.843
249 HB2 GLU 34 2HB GLU 34 19.288 9.565 -12.525
250 HB3 GLU 34 3HB GLU 34 18.192 8.635 -11.512
251 HG2 GLU 34 2HG GLU 34 17.460 11.113 -10.803
252 HG3 GLU 34 3HG GLU 34 18.006 11.421 -12.450
253 H ILE 35 H ILE 35 20.741 7.568 -10.886
254 HA ILE 35 HA ILE 35 19.363 5.898 -9.101
255 HB ILE 35 HB ILE 35 22.087 5.568 -10.359
256 HG12 ILE 35 2HG1 ILE 35 20.157 5.681 -11.911
257 HG13 ILE 35 3HG1 ILE 35 20.934 4.101 -11.920
258 HG21 ILE 35 1HG2 ILE 35 21.345 3.053 -9.822
259 HG22 ILE 35 2HG2 ILE 35 22.331 4.020 -8.726
260 HG23 ILE 35 3HG2 ILE 35 20.595 3.873 -8.453
261 HD11 ILE 35 3HD1 ILE 35 19.164 3.278 -10.402
262 HD12 ILE 35 1HD1 ILE 35 18.363 4.842 -10.548
263 HD13 ILE 35 2HD1 ILE 35 18.560 3.815 -11.969
264 H ALA 36 H ALA 36 22.458 7.594 -8.787
265 HA ALA 36 HA ALA 36 23.295 6.544 -6.353
266 HB1 ALA 36 1HB ALA 36 24.979 7.810 -7.120
267 HB2 ALA 36 2HB ALA 36 23.895 8.932 -7.942
268 HB3 ALA 36 3HB ALA 36 24.199 9.106 -6.214
269 H ALA 37 H ALA 37 21.284 9.413 -6.971
270 HA ALA 37 HA ALA 37 20.909 10.060 -4.236
271 HB1 ALA 37 1HB ALA 37 18.957 10.820 -6.376
272 HB2 ALA 37 2HB ALA 37 19.479 11.738 -4.963
273 HB3 ALA 37 3HB ALA 37 20.571 11.530 -6.332
274 H PHE 38 H PHE 38 19.233 7.963 -6.478
275 HA PHE 38 HA PHE 38 16.835 7.632 -5.051
276 HB2 PHE 38 2HB PHE 38 18.107 6.457 -7.346
277 HB3 PHE 38 3HB PHE 38 17.424 5.186 -6.337
278 HD1 PHE 38 HD2 PHE 38 16.219 8.642 -7.007
279 HD2 PHE 38 HD1 PHE 38 15.512 4.464 -7.410
280 HE1 PHE 38 HE2 PHE 38 13.988 9.112 -7.932
281 HE2 PHE 38 HE1 PHE 38 13.280 4.928 -8.337
282 HZ PHE 38 HZ PHE 38 12.515 7.254 -8.598
283 H GLU 39 H GLU 39 19.747 5.574 -5.110
284 HA GLU 39 HA GLU 39 18.857 3.831 -3.069
285 HB2 GLU 39 2HB GLU 39 21.194 3.059 -2.989
286 HB3 GLU 39 3HB GLU 39 20.591 3.161 -4.637
287 HG2 GLU 39 2HG GLU 39 21.743 5.309 -4.911
288 HG3 GLU 39 3HG GLU 39 22.375 5.164 -3.273
289 H SER 40 H SER 40 20.787 6.778 -3.044
290 HA SER 40 HA SER 40 21.550 6.627 -0.315
291 HB2 SER 40 2HB SER 40 22.745 8.025 -1.964
292 HB3 SER 40 3HB SER 40 21.327 9.064 -2.099
293 HG SER 40 HG SER 40 23.043 9.760 -0.606
294 H GLU 41 H GLU 41 18.731 7.824 -1.978
295 HA GLU 41 HA GLU 41 17.713 9.237 0.327
296 HB2 GLU 41 2HB GLU 41 16.699 8.690 -2.441
297 HB3 GLU 41 3HB GLU 41 15.596 9.275 -1.203
298 HG2 GLU 41 2HG GLU 41 18.109 10.776 -1.457
299 HG3 GLU 41 3HG GLU 41 17.025 10.864 -2.845
300 H LEU 42 H LEU 42 17.325 6.110 -1.179
301 HA LEU 42 HA LEU 42 15.019 5.386 0.388
302 HB2 LEU 42 2HB LEU 42 16.855 3.770 -1.371
303 HB3 LEU 42 3HB LEU 42 15.425 3.120 -0.572
304 HG LEU 42 HG LEU 42 15.119 5.467 -2.387
305 HD11 LEU 42 1HD1 LEU 42 16.148 2.876 -3.189
306 HD12 LEU 42 2HD1 LEU 42 16.000 4.371 -4.112
307 HD13 LEU 42 3HD1 LEU 42 14.627 3.272 -3.988
308 HD21 LEU 42 3HD2 LEU 42 13.459 3.306 -1.236
309 HD22 LEU 42 1HD2 LEU 42 13.057 3.835 -2.871
310 HD23 LEU 42 2HD2 LEU 42 13.069 4.999 -1.546
311 H GLN 43 H GLN 43 18.474 5.096 0.651
312 HA GLN 43 HA GLN 43 18.423 3.091 2.707
313 HB2 GLN 43 2HB GLN 43 20.768 3.284 2.760
314 HB3 GLN 43 3HB GLN 43 20.334 3.554 1.078
315 HG2 GLN 43 2HG GLN 43 21.634 5.352 1.214
316 HG3 GLN 43 3HG GLN 43 20.294 6.087 2.093
317 HE21 GLN 43 1HE2 GLN 43 21.394 7.354 3.477
318 HE22 GLN 43 2HE2 GLN 43 22.500 6.770 4.668
319 H ALA 44 H ALA 44 18.114 6.510 2.581
320 HA ALA 44 HA ALA 44 18.954 7.040 5.269
321 HB1 ALA 44 1HB ALA 44 17.125 8.875 3.797
322 HB2 ALA 44 2HB ALA 44 18.500 9.247 4.838
323 HB3 ALA 44 3HB ALA 44 18.769 8.643 3.203
324 H TYR 45 H TYR 45 15.978 6.120 3.720
325 HA TYR 45 HA TYR 45 14.071 6.952 5.530
326 HB2 TYR 45 2HB TYR 45 14.274 4.541 3.756
327 HB3 TYR 45 3HB TYR 45 12.908 4.716 4.852
328 HD1 TYR 45 HD2 TYR 45 12.280 7.540 4.740
329 HD2 TYR 45 HD1 TYR 45 13.505 4.934 1.608
330 HE1 TYR 45 HE2 TYR 45 11.146 8.983 3.103
331 HE2 TYR 45 HE1 TYR 45 12.376 6.371 -0.038
332 HH TYR 45 HH TYR 45 10.495 8.034 -0.046
333 H LYS 46 H LYS 46 15.649 3.750 5.531
334 HA LYS 46 HA LYS 46 15.997 3.762 8.363
335 HB2 LYS 46 2HB LYS 46 13.475 2.916 7.439
336 HB3 LYS 46 3HB LYS 46 14.347 1.450 7.871
337 HG2 LYS 46 2HG LYS 46 14.476 2.015 10.091
338 HG3 LYS 46 3HG LYS 46 14.340 3.746 9.770
339 HD2 LYS 46 2HD LYS 46 11.951 2.776 8.833
340 HD3 LYS 46 3HD LYS 46 12.255 1.750 10.236
341 HE2 LYS 46 2HE LYS 46 12.892 4.202 11.219
342 HE3 LYS 46 3HE LYS 46 11.608 4.612 10.084
343 HZ1 LYS 46 3HZ LYS 46 11.136 2.348 11.861
344 HZ2 LYS 46 1HZ LYS 46 10.059 3.524 11.298
345 HZ3 LYS 46 2HZ LYS 46 11.120 3.887 12.564
346 H GLY 47 H GLY 47 15.653 1.692 5.494
347 HA2 GLY 47 2HA GLY 47 16.987 0.016 4.669
348 HA3 GLY 47 3HA GLY 47 18.310 0.814 5.506
349 H LYS 48 H LYS 48 18.492 -1.830 5.333
350 HA LYS 48 HA LYS 48 18.941 -3.654 6.624
351 HB2 LYS 48 2HB LYS 48 17.886 -2.169 9.021
352 HB3 LYS 48 3HB LYS 48 19.079 -3.460 8.978
353 HG2 LYS 48 2HG LYS 48 19.442 -0.634 8.005
354 HG3 LYS 48 3HG LYS 48 20.171 -1.370 9.434
355 HD2 LYS 48 2HD LYS 48 21.092 -3.098 7.682
356 HD3 LYS 48 3HD LYS 48 20.811 -1.774 6.548
357 HE2 LYS 48 2HE LYS 48 22.186 -0.304 7.979
358 HE3 LYS 48 3HE LYS 48 22.513 -1.676 9.037
359 HZ1 LYS 48 3HZ LYS 48 23.523 -1.123 6.346
360 HZ2 LYS 48 1HZ LYS 48 23.293 -2.740 6.788
361 HZ3 LYS 48 2HZ LYS 48 24.329 -1.756 7.693
362 H GLY 49 H GLY 49 16.119 -2.256 8.303
363 HA2 GLY 49 2HA GLY 49 14.780 -4.776 8.403
364 HA3 GLY 49 3HA GLY 49 14.102 -3.220 8.857
365 H ASN 50 H ASN 50 13.740 -1.745 6.835
366 HA ASN 50 HA ASN 50 11.667 -2.782 5.351
367 HB2 ASN 50 2HB ASN 50 13.545 -0.553 4.535
368 HB3 ASN 50 3HB ASN 50 11.948 -0.846 3.854
369 HD21 ASN 50 1HD2 ASN 50 10.114 -0.463 5.131
370 HD22 ASN 50 2HD2 ASN 50 10.184 0.560 6.522
371 HA PRO 51 HA PRO 51 14.043 -5.516 2.687
372 HB2 PRO 51 2HB PRO 51 11.868 -6.770 1.654
373 HB3 PRO 51 3HB PRO 51 12.538 -7.161 3.243
374 HG2 PRO 51 2HG PRO 51 10.194 -5.433 2.548
375 HG3 PRO 51 3HG PRO 51 10.353 -6.636 3.842
376 HD2 PRO 51 2HD PRO 51 10.598 -3.976 4.287
377 HD3 PRO 51 3HD PRO 51 11.502 -5.187 5.219
378 H GLU 52 H GLU 52 11.690 -3.124 1.923
379 HA GLU 52 HA GLU 52 11.600 -3.433 -0.886
380 HB2 GLU 52 2HB GLU 52 10.779 -1.079 -0.883
381 HB3 GLU 52 3HB GLU 52 9.905 -2.135 0.218
382 HG2 GLU 52 2HG GLU 52 11.774 -1.176 1.890
383 HG3 GLU 52 3HG GLU 52 11.626 0.186 0.781
384 H VAL 53 H VAL 53 13.592 -1.388 1.224
385 HA VAL 53 HA VAL 53 14.994 -0.016 -0.762
386 HB VAL 53 HB VAL 53 16.126 -0.847 1.910
387 HG11 VAL 53 1HG1 VAL 53 17.379 1.277 1.697
388 HG12 VAL 53 2HG1 VAL 53 17.778 0.110 0.435
389 HG13 VAL 53 3HG1 VAL 53 16.717 1.472 0.074
390 HG21 VAL 53 3HG2 VAL 53 14.248 0.184 2.672
391 HG22 VAL 53 1HG2 VAL 53 15.232 1.619 2.386
392 HG23 VAL 53 2HG2 VAL 53 14.030 1.123 1.195
393 H GLU 54 H GLU 54 15.199 -3.291 0.240
394 HA GLU 54 HA GLU 54 17.871 -3.862 -0.438
395 HB2 GLU 54 2HB GLU 54 15.504 -5.732 -0.613
396 HB3 GLU 54 3HB GLU 54 17.196 -6.189 -0.475
397 HG2 GLU 54 2HG GLU 54 17.271 -5.119 1.745
398 HG3 GLU 54 3HG GLU 54 15.549 -4.769 1.605
399 H ALA 55 H ALA 55 14.875 -4.272 -2.321
400 HA ALA 55 HA ALA 55 16.093 -5.182 -4.678
401 HB1 ALA 55 1HB ALA 55 13.949 -5.489 -5.155
402 HB2 ALA 55 2HB ALA 55 13.463 -4.435 -3.826
403 HB3 ALA 55 3HB ALA 55 13.789 -3.753 -5.419
404 H LEU 56 H LEU 56 15.096 -1.903 -3.722
405 HA LEU 56 HA LEU 56 15.855 -0.582 -6.059
406 HB2 LEU 56 2HB LEU 56 16.004 0.537 -3.267
407 HB3 LEU 56 3HB LEU 56 15.824 1.442 -4.769
408 HG LEU 56 HG LEU 56 13.699 -0.522 -4.168
409 HD11 LEU 56 1HD1 LEU 56 12.769 1.639 -2.801
410 HD12 LEU 56 2HD1 LEU 56 14.459 1.600 -2.299
411 HD13 LEU 56 3HD1 LEU 56 13.435 0.184 -2.059
412 HD21 LEU 56 3HD2 LEU 56 14.036 2.104 -5.501
413 HD22 LEU 56 1HD2 LEU 56 12.459 1.747 -4.797
414 HD23 LEU 56 2HD2 LEU 56 13.142 0.673 -6.018
415 H ARG 57 H ARG 57 17.722 -1.377 -3.165
416 HA ARG 57 HA ARG 57 20.061 0.032 -3.854
417 HB2 ARG 57 2HB ARG 57 19.412 -2.210 -1.990
418 HB3 ARG 57 3HB ARG 57 21.102 -1.867 -2.334
419 HG2 ARG 57 2HG ARG 57 20.758 0.456 -1.598
420 HG3 ARG 57 3HG ARG 57 19.087 0.058 -1.196
421 HD2 ARG 57 2HD ARG 57 20.047 -1.763 0.298
422 HD3 ARG 57 3HD ARG 57 21.609 -0.979 0.068
423 HE ARG 57 HE ARG 57 19.838 0.988 0.886
424 HH11 ARG 57 1HH1 ARG 57 21.174 -1.968 2.148
425 HH12 ARG 57 2HH1 ARG 57 21.082 -1.457 3.801
426 HH21 ARG 57 1HH2 ARG 57 19.711 1.672 3.058
427 HH22 ARG 57 2HH2 ARG 57 20.249 0.613 4.318
428 H LYS 58 H LYS 58 19.077 -3.327 -4.431
429 HA LYS 58 HA LYS 58 21.454 -4.198 -5.641
430 HB2 LYS 58 2HB LYS 58 18.718 -5.173 -5.354
431 HB3 LYS 58 3HB LYS 58 19.449 -5.651 -6.880
432 HG2 LYS 58 2HG LYS 58 21.070 -6.020 -4.431
433 HG3 LYS 58 3HG LYS 58 19.685 -7.090 -4.661
434 HD2 LYS 58 2HD LYS 58 21.127 -8.328 -5.863
435 HD3 LYS 58 3HD LYS 58 20.817 -7.142 -7.133
436 HE2 LYS 58 2HE LYS 58 22.758 -5.858 -5.825
437 HE3 LYS 58 3HE LYS 58 23.199 -7.513 -5.408
438 HZ1 LYS 58 3HZ LYS 58 23.879 -7.931 -7.482
439 HZ2 LYS 58 1HZ LYS 58 23.931 -6.250 -7.668
440 HZ3 LYS 58 2HZ LYS 58 22.580 -7.118 -8.197
441 H GLU 59 H GLU 59 18.398 -3.238 -7.220
442 HA GLU 59 HA GLU 59 19.281 -3.299 -9.839
443 HB2 GLU 59 2HB GLU 59 17.239 -1.497 -8.534
444 HB3 GLU 59 3HB GLU 59 17.480 -1.592 -10.273
445 HG2 GLU 59 2HG GLU 59 17.169 -4.214 -9.623
446 HG3 GLU 59 3HG GLU 59 16.108 -3.426 -8.456
447 H ALA 60 H ALA 60 19.290 -0.533 -7.600
448 HA ALA 60 HA ALA 60 20.339 1.402 -9.264
449 HB1 ALA 60 1HB ALA 60 21.406 2.274 -7.062
450 HB2 ALA 60 2HB ALA 60 19.650 2.196 -7.207
451 HB3 ALA 60 3HB ALA 60 20.517 0.945 -6.316
452 H ALA 61 H ALA 61 22.171 -0.780 -7.117
453 HA ALA 61 HA ALA 61 24.730 0.040 -7.801
454 HB1 ALA 61 1HB ALA 61 23.900 -1.654 -6.012
455 HB2 ALA 61 2HB ALA 61 24.171 -2.849 -7.282
456 HB3 ALA 61 3HB ALA 61 25.506 -1.844 -6.716
457 H ALA 62 H ALA 62 22.695 -2.428 -9.336
458 HA ALA 62 HA ALA 62 24.550 -3.371 -11.199
459 HB1 ALA 62 1HB ALA 62 21.784 -3.244 -12.160
460 HB2 ALA 62 2HB ALA 62 22.855 -4.631 -11.957
461 HB3 ALA 62 3HB ALA 62 21.976 -3.985 -10.571
462 H ILE 63 H ILE 63 22.163 -0.753 -11.487
463 HA ILE 63 HA ILE 63 22.682 -0.072 -14.150
464 HB ILE 63 HB ILE 63 21.766 1.718 -11.897
465 HG12 ILE 63 2HG1 ILE 63 19.924 0.715 -14.001
466 HG13 ILE 63 3HG1 ILE 63 20.469 -0.454 -12.803
467 HG21 ILE 63 1HG2 ILE 63 20.872 3.158 -13.682
468 HG22 ILE 63 2HG2 ILE 63 22.630 3.036 -13.737
469 HG23 ILE 63 3HG2 ILE 63 21.647 2.124 -14.883
470 HD11 ILE 63 3HD1 ILE 63 18.670 1.864 -12.516
471 HD12 ILE 63 1HD1 ILE 63 18.635 0.289 -11.724
472 HD13 ILE 63 2HD1 ILE 63 19.758 1.531 -11.169
473 H ARG 64 H ARG 64 24.124 1.132 -11.142
474 HA ARG 64 HA ARG 64 25.746 3.118 -12.253
475 HB2 ARG 64 2HB ARG 64 25.464 3.084 -9.893
476 HB3 ARG 64 3HB ARG 64 26.045 1.429 -9.775
477 HG2 ARG 64 2HG ARG 64 28.285 2.188 -10.448
478 HG3 ARG 64 3HG ARG 64 27.687 3.848 -10.491
479 HD2 ARG 64 2HD ARG 64 28.903 3.153 -8.385
480 HD3 ARG 64 3HD ARG 64 27.310 3.876 -8.162
481 HE ARG 64 HE ARG 64 27.285 1.001 -8.296
482 HH11 ARG 64 1HH1 ARG 64 27.637 3.781 -6.229
483 HH12 ARG 64 2HH1 ARG 64 27.170 2.934 -4.791
484 HH21 ARG 64 1HH2 ARG 64 26.669 -0.125 -6.410
485 HH22 ARG 64 2HH2 ARG 64 26.621 0.712 -4.895
486 H ASP 65 H ASP 65 26.466 -0.296 -11.574
487 HA ASP 65 HA ASP 65 29.128 -0.296 -12.418
488 HB2 ASP 65 2HB ASP 65 27.090 -2.529 -12.519
489 HB3 ASP 65 3HB ASP 65 28.826 -2.743 -12.726
490 H GLU 66 H GLU 66 26.147 -0.887 -14.242
491 HA GLU 66 HA GLU 66 27.326 -1.581 -16.684
492 HB2 GLU 66 2HB GLU 66 24.715 -0.113 -16.291
493 HB3 GLU 66 3HB GLU 66 25.184 -1.061 -17.695
494 HG2 GLU 66 2HG GLU 66 25.351 -2.602 -15.252
495 HG3 GLU 66 3HG GLU 66 23.739 -1.937 -15.507
496 H CYS 67 H CYS 67 26.240 1.586 -15.488
497 HA CYS 67 HA CYS 67 26.871 3.091 -17.746
498 HB2 CYS 67 2HB CYS 67 26.850 3.851 -14.823
499 HB3 CYS 67 3HB CYS 67 27.052 5.017 -16.124
500 HG CYS 67 HG CYS 67 24.461 5.355 -15.457
501 H GLN 68 H GLN 68 28.877 2.191 -14.975
502 HA GLN 68 HA GLN 68 31.148 3.695 -15.776
503 HB2 GLN 68 2HB GLN 68 30.877 1.324 -13.923
504 HB3 GLN 68 3HB GLN 68 32.365 2.237 -14.139
505 HG2 GLN 68 2HG GLN 68 30.948 4.283 -13.485
506 HG3 GLN 68 3HG GLN 68 29.798 3.096 -12.872
507 HE21 GLN 68 1HE2 GLN 68 31.491 1.182 -11.877
508 HE22 GLN 68 2HE2 GLN 68 32.375 1.830 -10.541
509 H ALA 69 H ALA 69 29.952 0.515 -16.548
510 HA ALA 69 HA ALA 69 32.422 -0.372 -17.747
511 HB1 ALA 69 1HB ALA 69 30.826 -1.932 -16.664
512 HB2 ALA 69 2HB ALA 69 29.681 -1.606 -17.966
513 HB3 ALA 69 3HB ALA 69 31.227 -2.375 -18.324
514 H TYR 70 H TYR 70 30.036 1.739 -18.682
515 HA TYR 70 HA TYR 70 30.274 1.086 -21.532
516 HB2 TYR 70 2HB TYR 70 28.409 2.993 -20.105
517 HB3 TYR 70 3HB TYR 70 28.419 2.699 -21.841
518 HD1 TYR 70 HD2 TYR 70 28.949 -0.344 -21.554
519 HD2 TYR 70 HD1 TYR 70 26.136 2.298 -19.762
520 HE1 TYR 70 HE2 TYR 70 27.390 -2.221 -21.247
521 HE2 TYR 70 HE1 TYR 70 24.570 0.428 -19.449
522 HH TYR 70 HH TYR 70 24.727 -2.383 -21.012
523 H ARG 71 H ARG 71 30.875 3.639 -19.184
524 HA ARG 71 HA ARG 71 32.621 4.945 -21.150
525 HB2 ARG 71 2HB ARG 71 30.356 6.106 -20.874
526 HB3 ARG 71 3HB ARG 71 30.896 6.526 -19.254
527 HG2 ARG 71 2HG ARG 71 32.832 7.693 -20.224
528 HG3 ARG 71 3HG ARG 71 32.226 7.314 -21.838
529 HD2 ARG 71 2HD ARG 71 30.574 8.860 -21.727
530 HD3 ARG 71 3HD ARG 71 30.324 8.623 -19.998
531 HE ARG 71 HE ARG 71 31.837 10.297 -19.575
532 HH11 ARG 71 1HH1 ARG 71 32.037 9.362 -22.923
533 HH12 ARG 71 2HH1 ARG 71 33.067 10.683 -23.365
534 HH21 ARG 71 1HH2 ARG 71 33.194 12.040 -20.145
535 HH22 ARG 71 2HH2 ARG 71 33.726 12.205 -21.785
536 H HIS 72 H HIS 72 33.481 3.175 -19.208
537 HA HIS 72 HA HIS 72 35.481 4.651 -17.909
538 HB2 HIS 72 2HB HIS 72 33.084 4.822 -16.533
539 HB3 HIS 72 3HB HIS 72 33.937 3.526 -15.700
540 HD1 HIS 72 HD1 HIS 72 35.572 4.244 -13.979
541 HD2 HIS 72 HD2 HIS 72 34.714 7.285 -16.677
542 HE1 HIS 72 HE1 HIS 72 36.772 6.275 -13.107
543 H ASN 73 H ASN 73 35.122 2.264 -19.489
544 HA ASN 73 HA ASN 73 36.591 0.411 -17.774
545 HB2 ASN 73 2HB ASN 73 34.433 -0.531 -17.562
546 HB3 ASN 73 3HB ASN 73 34.053 -0.247 -19.258
547 HD21 ASN 73 1HD2 ASN 73 34.102 -1.973 -20.484
548 HD22 ASN 73 2HD2 ASN 73 35.057 -3.389 -20.220
Start of MODEL 18
1 H1 MET 1 H MET 1 3.781 -1.087 -5.055
2 HA MET 1 HA MET 1 1.411 0.567 -5.535
3 HB2 MET 1 2HB MET 1 1.874 -1.789 -4.037
4 HB3 MET 1 3HB MET 1 1.507 -0.516 -2.881
5 HG2 MET 1 2HG MET 1 -0.345 -0.273 -4.992
6 HG3 MET 1 3HG MET 1 -0.259 -1.980 -4.566
7 HE1 MET 1 3HE MET 1 -2.347 -2.245 -4.067
8 HE2 MET 1 1HE MET 1 -2.724 -2.371 -2.348
9 HE3 MET 1 2HE MET 1 -3.406 -1.056 -3.306
10 H GLY 2 H GLY 2 0.965 2.413 -4.368
11 HA2 GLY 2 2HA GLY 2 1.390 4.292 -3.118
12 HA3 GLY 2 3HA GLY 2 2.409 3.282 -2.104
13 H SER 3 H SER 3 4.089 4.686 -1.832
14 HA SER 3 HA SER 3 5.236 6.237 -3.895
15 HB2 SER 3 2HB SER 3 6.118 5.432 -1.140
16 HB3 SER 3 3HB SER 3 7.235 6.274 -2.214
17 HG SER 3 HG SER 3 5.865 7.600 -0.771
18 H TRP 4 H TRP 4 5.781 2.978 -2.783
19 HA TRP 4 HA TRP 4 8.305 2.502 -3.885
20 HB2 TRP 4 2HB TRP 4 7.400 0.891 -2.378
21 HB3 TRP 4 3HB TRP 4 5.965 0.666 -3.375
22 HD1 TRP 4 HD1 TRP 4 6.306 -0.732 -5.694
23 HE1 TRP 4 HE1 TRP 4 8.010 -2.565 -6.296
24 HE3 TRP 4 HE3 TRP 4 9.742 0.110 -2.003
25 HZ2 TRP 4 HZ2 TRP 4 10.483 -3.527 -5.333
26 HZ3 TRP 4 HZ3 TRP 4 11.749 -1.311 -1.913
27 HH2 TRP 4 HH2 TRP 4 12.109 -3.092 -3.544
28 H ALA 5 H ALA 5 5.075 2.158 -5.308
29 HA ALA 5 HA ALA 5 5.715 0.996 -7.724
30 HB1 ALA 5 1HB ALA 5 3.746 3.072 -8.102
31 HB2 ALA 5 2HB ALA 5 3.555 1.319 -8.139
32 HB3 ALA 5 3HB ALA 5 3.461 2.184 -6.605
33 H GLU 6 H GLU 6 5.635 4.477 -6.968
34 HA GLU 6 HA GLU 6 6.386 5.435 -9.469
35 HB2 GLU 6 2HB GLU 6 5.744 6.604 -7.125
36 HB3 GLU 6 3HB GLU 6 7.484 6.854 -7.112
37 HG2 GLU 6 2HG GLU 6 7.438 8.277 -8.891
38 HG3 GLU 6 3HG GLU 6 5.992 7.544 -9.583
39 H PHE 7 H PHE 7 8.448 4.633 -6.682
40 HA PHE 7 HA PHE 7 10.904 5.267 -7.845
41 HB2 PHE 7 2HB PHE 7 9.989 3.657 -5.548
42 HB3 PHE 7 3HB PHE 7 11.567 3.211 -6.189
43 HD1 PHE 7 HD2 PHE 7 9.615 5.845 -4.560
44 HD2 PHE 7 HD1 PHE 7 13.449 4.694 -6.005
45 HE1 PHE 7 HE2 PHE 7 10.637 7.713 -3.328
46 HE2 PHE 7 HE1 PHE 7 14.477 6.560 -4.773
47 HZ PHE 7 HZ PHE 7 13.071 8.073 -3.434
48 H LYS 8 H LYS 8 9.072 2.239 -7.872
49 HA LYS 8 HA LYS 8 10.993 0.659 -9.176
50 HB2 LYS 8 2HB LYS 8 8.803 -0.042 -8.002
51 HB3 LYS 8 3HB LYS 8 8.029 0.298 -9.544
52 HG2 LYS 8 2HG LYS 8 8.448 -1.998 -9.575
53 HG3 LYS 8 3HG LYS 8 9.728 -1.296 -10.567
54 HD2 LYS 8 2HD LYS 8 11.347 -1.920 -9.133
55 HD3 LYS 8 3HD LYS 8 10.376 -1.525 -7.713
56 HE2 LYS 8 2HE LYS 8 10.576 -3.823 -7.550
57 HE3 LYS 8 3HE LYS 8 9.022 -3.638 -8.362
58 HZ1 LYS 8 3HZ LYS 8 11.572 -4.093 -9.806
59 HZ2 LYS 8 1HZ LYS 8 10.005 -4.160 -10.439
60 HZ3 LYS 8 2HZ LYS 8 10.526 -5.341 -9.348
61 H GLN 9 H GLN 9 8.386 2.693 -10.435
62 HA GLN 9 HA GLN 9 8.633 1.987 -13.139
63 HB2 GLN 9 2HB GLN 9 7.089 3.778 -11.626
64 HB3 GLN 9 3HB GLN 9 7.917 4.766 -12.823
65 HG2 GLN 9 2HG GLN 9 6.175 2.375 -13.372
66 HG3 GLN 9 3HG GLN 9 5.764 4.066 -13.655
67 HE21 GLN 9 1HE2 GLN 9 7.851 5.119 -14.876
68 HE22 GLN 9 2HE2 GLN 9 8.204 4.307 -16.360
69 H ARG 10 H ARG 10 9.938 4.845 -11.448
70 HA ARG 10 HA ARG 10 11.406 5.903 -13.542
71 HB2 ARG 10 2HB ARG 10 11.834 5.969 -10.563
72 HB3 ARG 10 3HB ARG 10 12.911 6.813 -11.668
73 HG2 ARG 10 2HG ARG 10 11.512 8.521 -11.777
74 HG3 ARG 10 3HG ARG 10 10.212 7.461 -12.325
75 HD2 ARG 10 2HD ARG 10 9.198 7.974 -10.402
76 HD3 ARG 10 3HD ARG 10 10.369 6.895 -9.644
77 HE ARG 10 HE ARG 10 11.286 8.719 -8.640
78 HH11 ARG 10 1HH1 ARG 10 9.585 9.774 -11.489
79 HH12 ARG 10 2HH1 ARG 10 9.871 11.457 -11.196
80 HH21 ARG 10 1HH2 ARG 10 11.670 10.932 -8.243
81 HH22 ARG 10 2HH2 ARG 10 11.058 12.115 -9.350
82 H LEU 11 H LEU 11 12.408 3.503 -11.127
83 HA LEU 11 HA LEU 11 15.070 3.236 -11.958
84 HB2 LEU 11 2HB LEU 11 13.428 2.098 -10.029
85 HB3 LEU 11 3HB LEU 11 13.914 0.741 -11.043
86 HG LEU 11 HG LEU 11 16.257 1.233 -10.616
87 HD11 LEU 11 1HD1 LEU 11 16.234 3.017 -8.488
88 HD12 LEU 11 2HD1 LEU 11 15.169 3.745 -9.691
89 HD13 LEU 11 3HD1 LEU 11 16.827 3.322 -10.121
90 HD21 LEU 11 3HD2 LEU 11 14.338 0.708 -8.434
91 HD22 LEU 11 1HD2 LEU 11 15.986 1.107 -7.949
92 HD23 LEU 11 2HD2 LEU 11 15.689 -0.263 -9.020
93 H ALA 12 H ALA 12 12.131 1.567 -13.000
94 HA ALA 12 HA ALA 12 13.335 -0.338 -14.668
95 HB1 ALA 12 1HB ALA 12 10.955 0.093 -15.892
96 HB2 ALA 12 2HB ALA 12 11.174 -0.917 -14.463
97 HB3 ALA 12 3HB ALA 12 10.635 0.753 -14.288
98 H ALA 13 H ALA 13 12.125 2.925 -15.379
99 HA ALA 13 HA ALA 13 12.659 2.884 -18.142
100 HB1 ALA 13 1HB ALA 13 12.931 5.535 -17.317
101 HB2 ALA 13 2HB ALA 13 11.472 4.748 -17.919
102 HB3 ALA 13 3HB ALA 13 11.788 4.810 -16.186
103 H ILE 14 H ILE 14 14.611 3.925 -15.378
104 HA ILE 14 HA ILE 14 16.770 4.970 -16.858
105 HB ILE 14 HB ILE 14 16.721 3.809 -14.071
106 HG12 ILE 14 2HG1 ILE 14 17.008 6.717 -14.637
107 HG13 ILE 14 3HG1 ILE 14 15.420 6.000 -14.889
108 HG21 ILE 14 1HG2 ILE 14 18.930 4.647 -15.723
109 HG22 ILE 14 2HG2 ILE 14 18.805 5.648 -14.277
110 HG23 ILE 14 3HG2 ILE 14 18.942 3.896 -14.128
111 HD11 ILE 14 3HD1 ILE 14 16.129 5.024 -12.434
112 HD12 ILE 14 1HD1 ILE 14 16.812 6.649 -12.420
113 HD13 ILE 14 2HD1 ILE 14 15.091 6.418 -12.730
114 H LYS 15 H LYS 15 16.075 1.735 -15.632
115 HA LYS 15 HA LYS 15 18.586 0.597 -16.287
116 HB2 LYS 15 2HB LYS 15 16.199 -0.256 -15.054
117 HB3 LYS 15 3HB LYS 15 16.454 -1.336 -16.419
118 HG2 LYS 15 2HG LYS 15 18.941 -1.271 -15.354
119 HG3 LYS 15 3HG LYS 15 17.949 -1.074 -13.908
120 HD2 LYS 15 2HD LYS 15 17.265 -3.195 -15.899
121 HD3 LYS 15 3HD LYS 15 18.577 -3.464 -14.750
122 HE2 LYS 15 2HE LYS 15 17.172 -3.647 -12.993
123 HE3 LYS 15 3HE LYS 15 16.080 -2.404 -13.603
124 HZ1 LYS 15 3HZ LYS 15 16.233 -5.125 -14.767
125 HZ2 LYS 15 1HZ LYS 15 15.045 -3.950 -15.032
126 HZ3 LYS 15 2HZ LYS 15 15.157 -4.715 -13.528
127 H THR 16 H THR 16 15.499 0.787 -18.009
128 HA THR 16 HA THR 16 16.199 -0.813 -20.207
129 HB THR 16 HB THR 16 14.343 1.550 -20.414
130 HG1 THR 16 HG1 THR 16 13.042 0.624 -19.032
131 HG21 THR 16 3HG2 THR 16 13.507 -0.990 -21.544
132 HG22 THR 16 1HG2 THR 16 15.059 -0.459 -22.190
133 HG23 THR 16 2HG2 THR 16 13.647 0.591 -22.311
134 H ARG 17 H ARG 17 16.218 2.742 -19.900
135 HA ARG 17 HA ARG 17 17.383 3.231 -22.416
136 HB2 ARG 17 2HB ARG 17 16.781 4.782 -19.992
137 HB3 ARG 17 3HB ARG 17 18.153 5.385 -20.913
138 HG2 ARG 17 2HG ARG 17 16.638 6.493 -22.111
139 HG3 ARG 17 3HG ARG 17 16.289 4.936 -22.865
140 HD2 ARG 17 2HD ARG 17 14.837 4.940 -20.482
141 HD3 ARG 17 3HD ARG 17 14.638 6.561 -21.145
142 HE ARG 17 HE ARG 17 14.232 4.704 -23.200
143 HH11 ARG 17 1HH1 ARG 17 12.738 5.761 -20.239
144 HH12 ARG 17 2HH1 ARG 17 11.133 5.360 -20.753
145 HH21 ARG 17 1HH2 ARG 17 12.124 4.172 -23.888
146 HH22 ARG 17 2HH2 ARG 17 10.785 4.455 -22.829
147 H CYS 18 H CYS 18 18.755 2.535 -19.270
148 HA CYS 18 HA CYS 18 21.425 3.276 -19.897
149 HB2 CYS 18 2HB CYS 18 20.855 3.143 -17.594
150 HB3 CYS 18 3HB CYS 18 20.227 1.509 -17.768
151 HG CYS 18 HG CYS 18 23.534 2.337 -18.075
152 H GLN 19 H GLN 19 19.583 0.294 -20.184
153 HA GLN 19 HA GLN 19 21.818 -1.346 -20.855
154 HB2 GLN 19 2HB GLN 19 18.853 -1.746 -21.275
155 HB3 GLN 19 3HB GLN 19 20.071 -2.975 -21.590
156 HG2 GLN 19 2HG GLN 19 20.187 -1.789 -18.912
157 HG3 GLN 19 3HG GLN 19 18.717 -2.698 -19.263
158 HE21 GLN 19 1HE2 GLN 19 18.797 -4.765 -18.794
159 HE22 GLN 19 2HE2 GLN 19 20.219 -5.745 -18.726
160 H ALA 20 H ALA 20 19.319 0.320 -22.734
161 HA ALA 20 HA ALA 20 20.314 -0.610 -25.257
162 HB1 ALA 20 1HB ALA 20 18.488 0.364 -26.167
163 HB2 ALA 20 2HB ALA 20 17.932 0.346 -24.493
164 HB3 ALA 20 3HB ALA 20 18.630 1.816 -25.174
165 H LEU 21 H LEU 21 20.935 2.104 -23.181
166 HA LEU 21 HA LEU 21 22.301 3.920 -23.349
167 HB2 LEU 21 2HB LEU 21 23.746 1.900 -25.042
168 HB3 LEU 21 3HB LEU 21 24.420 3.488 -24.681
169 HG LEU 21 HG LEU 21 23.759 1.330 -22.678
170 HD11 LEU 21 1HD1 LEU 21 25.891 1.383 -24.315
171 HD12 LEU 21 2HD1 LEU 21 25.932 0.738 -22.675
172 HD13 LEU 21 3HD1 LEU 21 26.494 2.380 -22.991
173 HD21 LEU 21 3HD2 LEU 21 24.455 4.198 -22.406
174 HD22 LEU 21 1HD2 LEU 21 25.222 3.067 -21.291
175 HD23 LEU 21 2HD2 LEU 21 23.463 3.167 -21.374
176 H GLY 22 H GLY 22 20.091 3.684 -25.285
177 HA2 GLY 22 2HA GLY 22 21.179 4.993 -27.666
178 HA3 GLY 22 3HA GLY 22 19.535 4.407 -27.466
179 H GLY 23 H GLY 23 20.672 6.157 -24.789
180 HA2 GLY 23 2HA GLY 23 18.800 8.288 -25.335
181 HA3 GLY 23 3HA GLY 23 19.762 8.089 -23.877
182 H SER 24 H SER 24 22.180 8.468 -24.228
183 HA SER 24 HA SER 24 23.152 10.034 -26.327
184 HB2 SER 24 2HB SER 24 21.497 11.492 -24.477
185 HB3 SER 24 3HB SER 24 23.157 12.082 -24.382
186 HG SER 24 HG SER 24 23.070 12.722 -26.436
187 H GLU 25 H GLU 25 25.330 10.385 -26.128
188 HA GLU 25 HA GLU 25 26.825 8.860 -24.396
189 HB2 GLU 25 2HB GLU 25 28.725 10.457 -24.974
190 HB3 GLU 25 3HB GLU 25 27.909 9.679 -26.322
191 HG2 GLU 25 2HG GLU 25 26.693 11.663 -26.831
192 HG3 GLU 25 3HG GLU 25 27.253 12.448 -25.355
193 H ALA 26 H ALA 26 25.673 12.153 -23.975
194 HA ALA 26 HA ALA 26 27.118 12.493 -21.485
195 HB1 ALA 26 1HB ALA 26 25.106 14.274 -22.856
196 HB2 ALA 26 2HB ALA 26 26.036 14.699 -21.418
197 HB3 ALA 26 3HB ALA 26 26.862 14.410 -22.949
198 H GLU 27 H GLU 27 23.829 11.858 -22.566
199 HA GLU 27 HA GLU 27 22.402 12.279 -20.245
200 HB2 GLU 27 2HB GLU 27 22.080 10.551 -22.620
201 HB3 GLU 27 3HB GLU 27 21.159 10.069 -21.202
202 HG2 GLU 27 2HG GLU 27 21.084 12.825 -22.403
203 HG3 GLU 27 3HG GLU 27 19.934 11.545 -22.782
204 H CYS 28 H CYS 28 24.501 9.602 -21.086
205 HA CYS 28 HA CYS 28 23.786 7.711 -19.212
206 HB2 CYS 28 2HB CYS 28 26.624 8.391 -20.006
207 HB3 CYS 28 3HB CYS 28 26.045 6.849 -19.387
208 HG CYS 28 HG CYS 28 26.435 7.645 -22.444
209 H ALA 29 H ALA 29 25.951 10.489 -18.799
210 HA ALA 29 HA ALA 29 26.825 9.993 -16.212
211 HB1 ALA 29 1HB ALA 29 27.441 11.871 -17.922
212 HB2 ALA 29 2HB ALA 29 26.216 12.790 -17.047
213 HB3 ALA 29 3HB ALA 29 27.617 12.151 -16.189
214 H ALA 30 H ALA 30 24.044 11.989 -17.216
215 HA ALA 30 HA ALA 30 23.099 12.622 -14.678
216 HB1 ALA 30 1HB ALA 30 22.281 13.728 -16.672
217 HB2 ALA 30 2HB ALA 30 21.527 12.231 -17.222
218 HB3 ALA 30 3HB ALA 30 20.933 13.035 -15.769
219 H PHE 31 H PHE 31 22.629 9.733 -16.618
220 HA PHE 31 HA PHE 31 20.532 8.595 -15.118
221 HB2 PHE 31 2HB PHE 31 22.378 7.732 -17.217
222 HB3 PHE 31 3HB PHE 31 21.941 6.438 -16.107
223 HD1 PHE 31 HD2 PHE 31 19.796 9.277 -17.107
224 HD2 PHE 31 HD1 PHE 31 20.598 5.116 -17.508
225 HE1 PHE 31 HE2 PHE 31 17.662 8.984 -18.295
226 HE2 PHE 31 HE1 PHE 31 18.466 4.816 -18.698
227 HZ PHE 31 HZ PHE 31 16.994 6.751 -19.092
228 H GLU 32 H GLU 32 24.050 8.077 -14.972
229 HA GLU 32 HA GLU 32 24.067 6.221 -12.890
230 HB2 GLU 32 2HB GLU 32 26.013 6.833 -14.347
231 HB3 GLU 32 3HB GLU 32 26.177 8.317 -13.419
232 HG2 GLU 32 2HG GLU 32 26.091 5.928 -11.757
233 HG3 GLU 32 3HG GLU 32 27.436 5.943 -12.895
234 H LYS 33 H LYS 33 24.330 9.762 -12.765
235 HA LYS 33 HA LYS 33 24.635 10.022 -10.001
236 HB2 LYS 33 2HB LYS 33 23.439 11.862 -12.069
237 HB3 LYS 33 3HB LYS 33 23.619 12.329 -10.383
238 HG2 LYS 33 2HG LYS 33 25.814 12.696 -10.593
239 HG3 LYS 33 3HG LYS 33 26.059 11.258 -11.586
240 HD2 LYS 33 2HD LYS 33 26.559 13.005 -13.041
241 HD3 LYS 33 3HD LYS 33 24.886 12.611 -13.443
242 HE2 LYS 33 2HE LYS 33 24.360 14.438 -11.632
243 HE3 LYS 33 3HE LYS 33 25.994 14.980 -12.011
244 HZ1 LYS 33 3HZ LYS 33 25.192 15.987 -13.794
245 HZ2 LYS 33 1HZ LYS 33 23.632 15.428 -13.454
246 HZ3 LYS 33 2HZ LYS 33 24.669 14.505 -14.420
247 H GLU 34 H GLU 34 21.669 10.133 -11.966
248 HA GLU 34 HA GLU 34 19.831 10.581 -9.946
249 HB2 GLU 34 2HB GLU 34 19.740 9.912 -12.671
250 HB3 GLU 34 3HB GLU 34 18.785 8.682 -11.855
251 HG2 GLU 34 2HG GLU 34 17.558 10.561 -10.711
252 HG3 GLU 34 3HG GLU 34 18.379 11.657 -11.821
253 H ILE 35 H ILE 35 21.056 7.471 -11.153
254 HA ILE 35 HA ILE 35 19.542 5.807 -9.493
255 HB ILE 35 HB ILE 35 22.287 5.364 -10.666
256 HG12 ILE 35 2HG1 ILE 35 20.436 5.711 -12.283
257 HG13 ILE 35 3HG1 ILE 35 21.115 4.089 -12.368
258 HG21 ILE 35 1HG2 ILE 35 21.352 2.882 -10.320
259 HG22 ILE 35 2HG2 ILE 35 22.345 3.709 -9.122
260 HG23 ILE 35 3HG2 ILE 35 20.591 3.669 -8.938
261 HD11 ILE 35 3HD1 ILE 35 18.430 4.835 -12.032
262 HD12 ILE 35 1HD1 ILE 35 19.118 3.211 -12.029
263 HD13 ILE 35 2HD1 ILE 35 18.949 4.100 -10.515
264 H ALA 36 H ALA 36 22.750 7.237 -8.997
265 HA ALA 36 HA ALA 36 23.403 6.020 -6.586
266 HB1 ALA 36 1HB ALA 36 24.505 8.494 -6.302
267 HB2 ALA 36 2HB ALA 36 25.215 7.172 -7.229
268 HB3 ALA 36 3HB ALA 36 24.261 8.409 -8.047
269 H ALA 37 H ALA 37 21.652 9.065 -7.144
270 HA ALA 37 HA ALA 37 21.235 9.636 -4.398
271 HB1 ALA 37 1HB ALA 37 21.039 11.502 -5.742
272 HB2 ALA 37 2HB ALA 37 20.074 10.659 -6.954
273 HB3 ALA 37 3HB ALA 37 19.351 11.114 -5.411
274 H PHE 38 H PHE 38 19.494 7.742 -6.763
275 HA PHE 38 HA PHE 38 17.025 7.551 -5.432
276 HB2 PHE 38 2HB PHE 38 18.278 6.372 -7.728
277 HB3 PHE 38 3HB PHE 38 17.495 5.109 -6.785
278 HD1 PHE 38 HD2 PHE 38 16.686 8.623 -7.761
279 HD2 PHE 38 HD1 PHE 38 15.401 4.572 -7.522
280 HE1 PHE 38 HE2 PHE 38 14.512 9.259 -8.722
281 HE2 PHE 38 HE1 PHE 38 13.226 5.202 -8.484
282 HZ PHE 38 HZ PHE 38 12.779 7.548 -9.084
283 H GLU 39 H GLU 39 19.782 5.291 -5.456
284 HA GLU 39 HA GLU 39 18.688 3.555 -3.508
285 HB2 GLU 39 2HB GLU 39 20.990 2.638 -3.358
286 HB3 GLU 39 3HB GLU 39 20.401 2.760 -5.010
287 HG2 GLU 39 2HG GLU 39 21.678 4.837 -5.295
288 HG3 GLU 39 3HG GLU 39 22.301 4.661 -3.656
289 H SER 40 H SER 40 20.827 6.346 -3.325
290 HA SER 40 HA SER 40 21.482 6.052 -0.577
291 HB2 SER 40 2HB SER 40 22.997 7.427 -1.649
292 HB3 SER 40 3HB SER 40 21.753 8.224 -2.611
293 HG SER 40 HG SER 40 22.670 9.527 -0.895
294 H GLU 41 H GLU 41 18.809 7.471 -2.288
295 HA GLU 41 HA GLU 41 17.829 8.929 0.006
296 HB2 GLU 41 2HB GLU 41 16.873 8.490 -2.798
297 HB3 GLU 41 3HB GLU 41 15.756 9.105 -1.587
298 HG2 GLU 41 2HG GLU 41 18.394 10.437 -1.871
299 HG3 GLU 41 3HG GLU 41 17.173 10.714 -3.112
300 H LEU 42 H LEU 42 17.193 5.881 -1.608
301 HA LEU 42 HA LEU 42 14.835 5.295 -0.075
302 HB2 LEU 42 2HB LEU 42 16.575 3.582 -1.839
303 HB3 LEU 42 3HB LEU 42 15.090 3.021 -1.073
304 HG LEU 42 HG LEU 42 14.959 5.425 -2.826
305 HD11 LEU 42 1HD1 LEU 42 15.528 4.394 -4.703
306 HD12 LEU 42 2HD1 LEU 42 14.454 3.043 -4.342
307 HD13 LEU 42 3HD1 LEU 42 16.110 3.039 -3.737
308 HD21 LEU 42 3HD2 LEU 42 12.839 5.078 -2.203
309 HD22 LEU 42 1HD2 LEU 42 13.167 3.429 -1.669
310 HD23 LEU 42 2HD2 LEU 42 12.858 3.759 -3.374
311 H GLN 43 H GLN 43 18.254 4.715 0.226
312 HA GLN 43 HA GLN 43 18.037 2.672 2.217
313 HB2 GLN 43 2HB GLN 43 20.378 2.726 2.331
314 HB3 GLN 43 3HB GLN 43 20.022 3.137 0.659
315 HG2 GLN 43 2HG GLN 43 21.442 4.823 0.990
316 HG3 GLN 43 3HG GLN 43 20.083 5.595 1.806
317 HE21 GLN 43 1HE2 GLN 43 23.136 4.016 2.184
318 HE22 GLN 43 2HE2 GLN 43 23.346 4.365 3.863
319 H ALA 44 H ALA 44 17.913 6.108 2.223
320 HA ALA 44 HA ALA 44 18.676 6.481 4.959
321 HB1 ALA 44 1HB ALA 44 18.355 8.726 4.608
322 HB2 ALA 44 2HB ALA 44 18.657 8.175 2.960
323 HB3 ALA 44 3HB ALA 44 17.005 8.473 3.502
324 H TYR 45 H TYR 45 15.787 5.576 3.331
325 HA TYR 45 HA TYR 45 13.779 6.505 4.973
326 HB2 TYR 45 2HB TYR 45 14.111 4.074 3.281
327 HB3 TYR 45 3HB TYR 45 12.745 4.124 4.390
328 HD1 TYR 45 HD2 TYR 45 11.783 6.811 4.313
329 HD2 TYR 45 HD1 TYR 45 13.385 4.486 1.131
330 HE1 TYR 45 HE2 TYR 45 10.515 8.162 2.696
331 HE2 TYR 45 HE1 TYR 45 12.122 5.830 -0.496
332 HH TYR 45 HH TYR 45 10.834 7.628 -0.794
333 H LYS 46 H LYS 46 15.352 3.315 5.269
334 HA LYS 46 HA LYS 46 15.681 3.475 8.065
335 HB2 LYS 46 2HB LYS 46 13.229 3.292 8.068
336 HB3 LYS 46 3HB LYS 46 13.337 1.803 7.138
337 HG2 LYS 46 2HG LYS 46 13.407 0.679 9.040
338 HG3 LYS 46 3HG LYS 46 14.969 1.425 9.385
339 HD2 LYS 46 2HD LYS 46 13.740 1.999 11.257
340 HD3 LYS 46 3HD LYS 46 13.528 3.420 10.232
341 HE2 LYS 46 2HE LYS 46 11.334 2.953 9.805
342 HE3 LYS 46 3HE LYS 46 11.561 1.212 9.963
343 HZ1 LYS 46 3HZ LYS 46 10.256 2.069 11.788
344 HZ2 LYS 46 1HZ LYS 46 11.477 3.168 12.196
345 HZ3 LYS 46 2HZ LYS 46 11.743 1.506 12.366
346 H GLY 47 H GLY 47 14.745 0.969 5.694
347 HA2 GLY 47 2HA GLY 47 16.120 -0.685 4.775
348 HA3 GLY 47 3HA GLY 47 17.405 -0.192 5.869
349 H LYS 48 H LYS 48 16.695 -0.571 8.295
350 HA LYS 48 HA LYS 48 16.704 -3.292 8.758
351 HB2 LYS 48 2HB LYS 48 17.351 -1.665 10.455
352 HB3 LYS 48 3HB LYS 48 15.693 -1.091 10.569
353 HG2 LYS 48 2HG LYS 48 15.038 -3.381 11.325
354 HG3 LYS 48 3HG LYS 48 16.756 -3.782 11.391
355 HD2 LYS 48 2HD LYS 48 16.018 -1.298 12.773
356 HD3 LYS 48 3HD LYS 48 15.318 -2.762 13.465
357 HE2 LYS 48 2HE LYS 48 18.175 -2.916 12.758
358 HE3 LYS 48 3HE LYS 48 17.773 -1.820 14.079
359 HZ1 LYS 48 3HZ LYS 48 16.643 -3.645 15.195
360 HZ2 LYS 48 1HZ LYS 48 18.262 -4.035 14.896
361 HZ3 LYS 48 2HZ LYS 48 17.041 -4.695 13.929
362 H GLY 49 H GLY 49 13.916 -1.204 9.546
363 HA2 GLY 49 2HA GLY 49 12.131 -3.452 9.578
364 HA3 GLY 49 3HA GLY 49 11.685 -1.762 9.768
365 H ASN 50 H ASN 50 13.214 -1.268 7.154
366 HA ASN 50 HA ASN 50 11.040 -2.156 5.373
367 HB2 ASN 50 2HB ASN 50 12.446 0.442 5.675
368 HB3 ASN 50 3HB ASN 50 12.048 -0.054 4.033
369 HD21 ASN 50 1HD2 ASN 50 10.368 1.153 3.483
370 HD22 ASN 50 2HD2 ASN 50 8.905 1.310 4.388
371 HA PRO 51 HA PRO 51 14.980 -4.109 3.877
372 HB2 PRO 51 2HB PRO 51 13.874 -6.548 3.431
373 HB3 PRO 51 3HB PRO 51 14.526 -6.061 5.001
374 HG2 PRO 51 2HG PRO 51 11.685 -6.097 4.058
375 HG3 PRO 51 3HG PRO 51 12.353 -6.612 5.618
376 HD2 PRO 51 2HD PRO 51 11.129 -4.221 5.276
377 HD3 PRO 51 3HD PRO 51 12.460 -4.457 6.427
378 H GLU 52 H GLU 52 11.789 -3.632 2.681
379 HA GLU 52 HA GLU 52 11.891 -4.764 0.153
380 HB2 GLU 52 2HB GLU 52 10.264 -2.996 -0.506
381 HB3 GLU 52 3HB GLU 52 9.841 -3.822 0.987
382 HG2 GLU 52 2HG GLU 52 11.050 -1.852 2.141
383 HG3 GLU 52 3HG GLU 52 10.842 -1.037 0.592
384 H VAL 53 H VAL 53 13.413 -1.872 1.370
385 HA VAL 53 HA VAL 53 14.025 -0.617 -1.067
386 HB VAL 53 HB VAL 53 15.598 -0.553 1.512
387 HG11 VAL 53 1HG1 VAL 53 15.704 1.123 -0.977
388 HG12 VAL 53 2HG1 VAL 53 16.279 1.724 0.579
389 HG13 VAL 53 3HG1 VAL 53 17.023 0.298 -0.146
390 HG21 VAL 53 3HG2 VAL 53 14.338 1.394 2.089
391 HG22 VAL 53 1HG2 VAL 53 13.535 1.405 0.518
392 HG23 VAL 53 2HG2 VAL 53 13.193 0.118 1.675
393 H GLU 54 H GLU 54 15.306 -3.436 0.417
394 HA GLU 54 HA GLU 54 17.911 -3.537 -0.479
395 HB2 GLU 54 2HB GLU 54 17.808 -5.891 -0.229
396 HB3 GLU 54 3HB GLU 54 16.702 -5.228 0.965
397 HG2 GLU 54 2HG GLU 54 15.418 -6.905 0.129
398 HG3 GLU 54 3HG GLU 54 14.937 -5.593 -0.946
399 H ALA 55 H ALA 55 14.940 -4.118 -2.261
400 HA ALA 55 HA ALA 55 16.116 -5.204 -4.591
401 HB1 ALA 55 1HB ALA 55 13.643 -3.627 -4.907
402 HB2 ALA 55 2HB ALA 55 14.015 -5.274 -5.417
403 HB3 ALA 55 3HB ALA 55 13.581 -4.947 -3.739
404 H LEU 56 H LEU 56 15.026 -1.896 -3.837
405 HA LEU 56 HA LEU 56 15.810 -0.727 -6.258
406 HB2 LEU 56 2HB LEU 56 15.785 0.629 -3.571
407 HB3 LEU 56 3HB LEU 56 15.597 1.383 -5.153
408 HG LEU 56 HG LEU 56 13.577 -0.649 -4.428
409 HD11 LEU 56 1HD1 LEU 56 14.229 1.451 -2.610
410 HD12 LEU 56 2HD1 LEU 56 12.947 0.246 -2.503
411 HD13 LEU 56 3HD1 LEU 56 12.651 1.775 -3.329
412 HD21 LEU 56 3HD2 LEU 56 13.044 2.115 -5.410
413 HD22 LEU 56 1HD2 LEU 56 12.205 0.607 -5.774
414 HD23 LEU 56 2HD2 LEU 56 13.778 0.939 -6.500
415 H ARG 57 H ARG 57 17.584 -1.317 -3.274
416 HA ARG 57 HA ARG 57 19.881 0.196 -3.935
417 HB2 ARG 57 2HB ARG 57 19.012 -1.174 -1.716
418 HB3 ARG 57 3HB ARG 57 20.352 -2.170 -2.269
419 HG2 ARG 57 2HG ARG 57 21.908 -0.594 -1.784
420 HG3 ARG 57 3HG ARG 57 20.814 0.749 -2.118
421 HD2 ARG 57 2HD ARG 57 20.118 0.862 0.011
422 HD3 ARG 57 3HD ARG 57 20.015 -0.891 0.167
423 HE ARG 57 HE ARG 57 22.040 -0.845 1.202
424 HH11 ARG 57 1HH1 ARG 57 21.734 2.029 -0.739
425 HH12 ARG 57 2HH1 ARG 57 23.235 2.708 -0.203
426 HH21 ARG 57 1HH2 ARG 57 24.019 0.039 1.915
427 HH22 ARG 57 2HH2 ARG 57 24.534 1.575 1.306
428 H LYS 58 H LYS 58 19.063 -3.227 -4.358
429 HA LYS 58 HA LYS 58 21.538 -4.051 -5.407
430 HB2 LYS 58 2HB LYS 58 18.750 -5.129 -5.494
431 HB3 LYS 58 3HB LYS 58 19.973 -5.846 -6.534
432 HG2 LYS 58 2HG LYS 58 20.302 -5.544 -3.560
433 HG3 LYS 58 3HG LYS 58 19.628 -6.983 -4.329
434 HD2 LYS 58 2HD LYS 58 22.217 -5.998 -5.375
435 HD3 LYS 58 3HD LYS 58 22.231 -6.714 -3.762
436 HE2 LYS 58 2HE LYS 58 21.133 -8.721 -4.669
437 HE3 LYS 58 3HE LYS 58 21.177 -8.003 -6.278
438 HZ1 LYS 58 3HZ LYS 58 23.403 -8.336 -6.470
439 HZ2 LYS 58 1HZ LYS 58 23.041 -9.636 -5.449
440 HZ3 LYS 58 2HZ LYS 58 23.697 -8.215 -4.808
441 H GLU 59 H GLU 59 18.498 -3.378 -7.156
442 HA GLU 59 HA GLU 59 19.510 -3.547 -9.731
443 HB2 GLU 59 2HB GLU 59 17.232 -1.965 -8.564
444 HB3 GLU 59 3HB GLU 59 17.610 -1.896 -10.280
445 HG2 GLU 59 2HG GLU 59 17.125 -4.179 -10.585
446 HG3 GLU 59 3HG GLU 59 17.109 -4.485 -8.849
447 H ALA 60 H ALA 60 19.182 -0.653 -7.686
448 HA ALA 60 HA ALA 60 20.163 1.250 -9.428
449 HB1 ALA 60 1HB ALA 60 19.222 1.961 -7.374
450 HB2 ALA 60 2HB ALA 60 20.405 1.048 -6.436
451 HB3 ALA 60 3HB ALA 60 20.912 2.467 -7.352
452 H ALA 61 H ALA 61 22.037 -0.642 -7.056
453 HA ALA 61 HA ALA 61 24.558 0.346 -7.654
454 HB1 ALA 61 1HB ALA 61 25.450 -1.631 -6.619
455 HB2 ALA 61 2HB ALA 61 24.006 -1.128 -5.737
456 HB3 ALA 61 3HB ALA 61 23.928 -2.491 -6.855
457 H ALA 62 H ALA 62 22.822 -2.375 -9.129
458 HA ALA 62 HA ALA 62 24.851 -3.258 -10.836
459 HB1 ALA 62 1HB ALA 62 22.028 -3.375 -11.762
460 HB2 ALA 62 2HB ALA 62 23.279 -4.618 -11.783
461 HB3 ALA 62 3HB ALA 62 22.460 -4.217 -10.274
462 H ILE 63 H ILE 63 22.295 -0.853 -11.371
463 HA ILE 63 HA ILE 63 22.879 -0.298 -14.057
464 HB ILE 63 HB ILE 63 21.721 1.562 -11.978
465 HG12 ILE 63 2HG1 ILE 63 19.978 0.315 -14.000
466 HG13 ILE 63 3HG1 ILE 63 20.670 -0.808 -12.834
467 HG21 ILE 63 1HG2 ILE 63 20.783 2.783 -13.877
468 HG22 ILE 63 2HG2 ILE 63 22.545 2.766 -13.929
469 HG23 ILE 63 3HG2 ILE 63 21.621 1.700 -14.988
470 HD11 ILE 63 3HD1 ILE 63 19.737 1.410 -11.376
471 HD12 ILE 63 1HD1 ILE 63 18.475 0.974 -12.527
472 HD13 ILE 63 2HD1 ILE 63 19.096 -0.233 -11.400
473 H ARG 64 H ARG 64 24.075 1.180 -11.065
474 HA ARG 64 HA ARG 64 25.580 3.234 -12.226
475 HB2 ARG 64 2HB ARG 64 25.045 3.079 -9.813
476 HB3 ARG 64 3HB ARG 64 26.164 1.730 -9.670
477 HG2 ARG 64 2HG ARG 64 27.713 3.673 -10.830
478 HG3 ARG 64 3HG ARG 64 26.681 4.592 -9.733
479 HD2 ARG 64 2HD ARG 64 27.420 2.411 -8.224
480 HD3 ARG 64 3HD ARG 64 28.876 2.767 -9.152
481 HE ARG 64 HE ARG 64 27.893 5.163 -8.092
482 HH11 ARG 64 1HH1 ARG 64 29.325 2.175 -7.023
483 HH12 ARG 64 2HH1 ARG 64 30.055 2.876 -5.617
484 HH21 ARG 64 1HH2 ARG 64 28.848 6.097 -6.244
485 HH22 ARG 64 2HH2 ARG 64 29.782 5.107 -5.174
486 H ASP 65 H ASP 65 26.510 -0.074 -11.332
487 HA ASP 65 HA ASP 65 29.215 0.108 -12.040
488 HB2 ASP 65 2HB ASP 65 27.446 -2.343 -12.178
489 HB3 ASP 65 3HB ASP 65 29.205 -2.327 -12.073
490 H GLU 66 H GLU 66 26.383 -0.860 -13.939
491 HA GLU 66 HA GLU 66 27.754 -1.590 -16.277
492 HB2 GLU 66 2HB GLU 66 24.972 -0.425 -16.071
493 HB3 GLU 66 3HB GLU 66 25.611 -1.372 -17.408
494 HG2 GLU 66 2HG GLU 66 25.823 -2.734 -14.846
495 HG3 GLU 66 3HG GLU 66 24.164 -2.338 -15.290
496 H CYS 67 H CYS 67 26.399 1.511 -15.235
497 HA CYS 67 HA CYS 67 26.897 2.942 -17.596
498 HB2 CYS 67 2HB CYS 67 26.703 3.859 -14.724
499 HB3 CYS 67 3HB CYS 67 26.822 4.964 -16.087
500 HG CYS 67 HG CYS 67 24.225 5.162 -15.851
501 H GLN 68 H GLN 68 28.887 2.434 -14.712
502 HA GLN 68 HA GLN 68 31.008 4.130 -15.473
503 HB2 GLN 68 2HB GLN 68 31.056 1.691 -13.687
504 HB3 GLN 68 3HB GLN 68 32.326 2.902 -13.790
505 HG2 GLN 68 2HG GLN 68 29.658 3.967 -13.209
506 HG3 GLN 68 3HG GLN 68 30.325 2.907 -11.968
507 HE21 GLN 68 1HE2 GLN 68 29.850 5.906 -12.266
508 HE22 GLN 68 2HE2 GLN 68 31.342 6.607 -11.749
509 H ALA 69 H ALA 69 30.373 0.706 -16.046
510 HA ALA 69 HA ALA 69 32.879 0.095 -17.210
511 HB1 ALA 69 1HB ALA 69 31.901 -1.867 -16.718
512 HB2 ALA 69 2HB ALA 69 30.271 -1.228 -16.935
513 HB3 ALA 69 3HB ALA 69 31.218 -1.722 -18.338
514 H TYR 70 H TYR 70 29.812 1.221 -18.547
515 HA TYR 70 HA TYR 70 30.417 0.905 -21.264
516 HB2 TYR 70 2HB TYR 70 28.641 2.951 -19.919
517 HB3 TYR 70 3HB TYR 70 28.657 2.614 -21.646
518 HD1 TYR 70 HD2 TYR 70 28.995 -0.431 -21.342
519 HD2 TYR 70 HD1 TYR 70 26.357 2.372 -19.529
520 HE1 TYR 70 HE2 TYR 70 27.335 -2.216 -21.011
521 HE2 TYR 70 HE1 TYR 70 24.690 0.594 -19.192
522 HH TYR 70 HH TYR 70 24.101 -1.561 -20.036
523 H ARG 71 H ARG 71 31.655 3.083 -18.951
524 HA ARG 71 HA ARG 71 32.383 5.161 -20.806
525 HB2 ARG 71 2HB ARG 71 32.029 5.154 -18.136
526 HB3 ARG 71 3HB ARG 71 33.775 4.953 -18.199
527 HG2 ARG 71 2HG ARG 71 33.728 7.204 -18.193
528 HG3 ARG 71 3HG ARG 71 33.515 6.973 -19.930
529 HD2 ARG 71 2HD ARG 71 31.750 8.346 -19.596
530 HD3 ARG 71 3HD ARG 71 30.956 6.836 -19.149
531 HE ARG 71 HE ARG 71 32.030 7.737 -16.816
532 HH11 ARG 71 1HH1 ARG 71 29.901 9.098 -19.210
533 HH12 ARG 71 2HH1 ARG 71 29.058 10.104 -18.079
534 HH21 ARG 71 1HH2 ARG 71 30.928 9.056 -15.316
535 HH22 ARG 71 2HH2 ARG 71 29.644 10.080 -15.864
536 H HIS 72 H HIS 72 33.288 2.448 -21.408
537 HA HIS 72 HA HIS 72 35.124 1.429 -22.287
538 HB2 HIS 72 2HB HIS 72 35.477 3.780 -23.204
539 HB3 HIS 72 3HB HIS 72 36.614 4.021 -21.881
540 HD1 HIS 72 HD1 HIS 72 36.372 0.800 -23.814
541 HD2 HIS 72 HD2 HIS 72 38.881 4.092 -23.458
542 HE1 HIS 72 HE1 HIS 72 38.450 0.204 -25.100
543 H ASN 73 H ASN 73 34.631 1.637 -19.345
544 HA ASN 73 HA ASN 73 37.048 1.818 -17.935
545 HB2 ASN 73 2HB ASN 73 34.412 1.401 -17.264
546 HB3 ASN 73 3HB ASN 73 35.152 -0.147 -16.868
547 HD21 ASN 73 1HD2 ASN 73 35.238 -0.089 -14.715
548 HD22 ASN 73 2HD2 ASN 73 36.039 1.128 -13.787
Start of MODEL 19
1 H1 MET 1 H MET 1 3.093 -2.635 -3.005
2 HA MET 1 HA MET 1 2.160 -0.921 -1.545
3 HB2 MET 1 2HB MET 1 4.350 -2.463 -0.143
4 HB3 MET 1 3HB MET 1 2.972 -1.695 0.635
5 HG2 MET 1 2HG MET 1 1.494 -3.193 -0.729
6 HG3 MET 1 3HG MET 1 2.950 -4.050 -1.229
7 HE1 MET 1 3HE MET 1 0.064 -4.631 1.273
8 HE2 MET 1 1HE MET 1 0.646 -5.418 -0.195
9 HE3 MET 1 2HE MET 1 0.847 -6.209 1.369
10 H GLY 2 H GLY 2 2.504 0.902 -0.220
11 HA2 GLY 2 2HA GLY 2 3.495 2.885 0.374
12 HA3 GLY 2 3HA GLY 2 5.013 2.000 0.399
13 H SER 3 H SER 3 6.376 3.358 -0.616
14 HA SER 3 HA SER 3 5.548 4.555 -3.157
15 HB2 SER 3 2HB SER 3 6.779 5.751 -1.113
16 HB3 SER 3 3HB SER 3 8.208 5.152 -1.954
17 HG SER 3 HG SER 3 7.776 6.423 -3.639
18 H TRP 4 H TRP 4 6.176 1.715 -2.904
19 HA TRP 4 HA TRP 4 8.766 1.316 -4.094
20 HB2 TRP 4 2HB TRP 4 7.490 -0.317 -2.568
21 HB3 TRP 4 3HB TRP 4 6.553 -0.726 -4.003
22 HD1 TRP 4 HD1 TRP 4 9.702 -0.182 -5.514
23 HE1 TRP 4 HE1 TRP 4 11.122 -2.322 -5.682
24 HE3 TRP 4 HE3 TRP 4 7.194 -3.088 -2.137
25 HZ2 TRP 4 HZ2 TRP 4 11.172 -4.901 -4.536
26 HZ3 TRP 4 HZ3 TRP 4 7.992 -5.380 -1.731
27 HH2 TRP 4 HH2 TRP 4 9.940 -6.266 -2.908
28 H ALA 5 H ALA 5 5.397 1.071 -5.200
29 HA ALA 5 HA ALA 5 5.785 0.217 -7.786
30 HB1 ALA 5 1HB ALA 5 3.624 0.834 -8.195
31 HB2 ALA 5 2HB ALA 5 3.616 0.862 -6.431
32 HB3 ALA 5 3HB ALA 5 3.781 2.366 -7.337
33 H GLU 6 H GLU 6 5.768 3.588 -6.634
34 HA GLU 6 HA GLU 6 6.271 4.809 -9.094
35 HB2 GLU 6 2HB GLU 6 6.564 5.583 -6.245
36 HB3 GLU 6 3HB GLU 6 7.464 6.538 -7.416
37 HG2 GLU 6 2HG GLU 6 5.176 6.650 -8.659
38 HG3 GLU 6 3HG GLU 6 4.519 6.243 -7.075
39 H PHE 7 H PHE 7 8.568 3.858 -6.545
40 HA PHE 7 HA PHE 7 10.900 4.659 -7.861
41 HB2 PHE 7 2HB PHE 7 10.223 2.949 -5.572
42 HB3 PHE 7 3HB PHE 7 11.723 2.504 -6.378
43 HD1 PHE 7 HD1 PHE 7 9.951 5.483 -5.017
44 HD2 PHE 7 HD2 PHE 7 13.676 3.573 -5.788
45 HE1 PHE 7 HE1 PHE 7 11.121 7.291 -3.826
46 HE2 PHE 7 HE2 PHE 7 14.851 5.377 -4.598
47 HZ PHE 7 HZ PHE 7 13.574 7.239 -3.614
48 H LYS 8 H LYS 8 9.030 1.694 -8.067
49 HA LYS 8 HA LYS 8 10.910 0.172 -9.527
50 HB2 LYS 8 2HB LYS 8 7.912 0.002 -9.262
51 HB3 LYS 8 3HB LYS 8 8.836 -1.139 -10.229
52 HG2 LYS 8 2HG LYS 8 10.178 -1.153 -7.837
53 HG3 LYS 8 3HG LYS 8 8.493 -0.978 -7.344
54 HD2 LYS 8 2HD LYS 8 9.580 -3.107 -9.188
55 HD3 LYS 8 3HD LYS 8 9.152 -3.334 -7.490
56 HE2 LYS 8 2HE LYS 8 6.843 -2.344 -8.314
57 HE3 LYS 8 3HE LYS 8 7.400 -2.964 -9.868
58 HZ1 LYS 8 3HZ LYS 8 6.826 -4.994 -9.248
59 HZ2 LYS 8 1HZ LYS 8 6.218 -4.386 -7.791
60 HZ3 LYS 8 2HZ LYS 8 7.822 -4.913 -7.883
61 H GLN 9 H GLN 9 8.236 2.267 -10.536
62 HA GLN 9 HA GLN 9 8.433 1.762 -13.298
63 HB2 GLN 9 2HB GLN 9 6.849 3.363 -11.612
64 HB3 GLN 9 3HB GLN 9 7.587 4.465 -12.767
65 HG2 GLN 9 2HG GLN 9 6.459 2.003 -13.910
66 HG3 GLN 9 3HG GLN 9 5.296 3.121 -13.200
67 HE21 GLN 9 1HE2 GLN 9 4.690 4.844 -14.339
68 HE22 GLN 9 2HE2 GLN 9 5.399 5.354 -15.829
69 H ARG 10 H ARG 10 9.584 4.596 -11.456
70 HA ARG 10 HA ARG 10 10.983 5.827 -13.507
71 HB2 ARG 10 2HB ARG 10 11.643 5.800 -10.556
72 HB3 ARG 10 3HB ARG 10 12.285 6.944 -11.727
73 HG2 ARG 10 2HG ARG 10 10.483 8.230 -11.583
74 HG3 ARG 10 3HG ARG 10 9.398 6.857 -11.806
75 HD2 ARG 10 2HD ARG 10 8.789 7.369 -9.691
76 HD3 ARG 10 3HD ARG 10 10.199 6.389 -9.290
77 HE ARG 10 HE ARG 10 11.237 8.273 -8.517
78 HH11 ARG 10 1HH1 ARG 10 8.536 9.204 -10.505
79 HH12 ARG 10 2HH1 ARG 10 8.666 10.889 -10.120
80 HH21 ARG 10 1HH2 ARG 10 11.418 10.487 -8.002
81 HH22 ARG 10 2HH2 ARG 10 10.306 11.617 -8.696
82 H LEU 11 H LEU 11 12.134 3.422 -11.163
83 HA LEU 11 HA LEU 11 14.809 3.361 -12.008
84 HB2 LEU 11 2HB LEU 11 13.040 1.399 -10.596
85 HB3 LEU 11 3HB LEU 11 14.690 0.968 -11.042
86 HG LEU 11 HG LEU 11 14.086 3.388 -9.366
87 HD11 LEU 11 1HD1 LEU 11 13.852 0.584 -8.633
88 HD12 LEU 11 2HD1 LEU 11 13.354 2.031 -7.757
89 HD13 LEU 11 3HD1 LEU 11 15.018 1.459 -7.639
90 HD21 LEU 11 3HD2 LEU 11 16.418 2.905 -8.583
91 HD22 LEU 11 1HD2 LEU 11 16.286 3.378 -10.277
92 HD23 LEU 11 2HD2 LEU 11 16.522 1.683 -9.852
93 H ALA 12 H ALA 12 11.965 1.588 -13.107
94 HA ALA 12 HA ALA 12 13.263 -0.248 -14.787
95 HB1 ALA 12 1HB ALA 12 10.538 0.656 -14.327
96 HB2 ALA 12 2HB ALA 12 10.839 0.222 -16.010
97 HB3 ALA 12 3HB ALA 12 11.147 -0.950 -14.729
98 H ALA 13 H ALA 13 11.898 2.961 -15.479
99 HA ALA 13 HA ALA 13 12.479 2.990 -18.228
100 HB1 ALA 13 1HB ALA 13 12.285 5.344 -16.353
101 HB2 ALA 13 2HB ALA 13 12.136 5.388 -18.111
102 HB3 ALA 13 3HB ALA 13 10.922 4.551 -17.143
103 H ILE 14 H ILE 14 14.340 4.133 -15.434
104 HA ILE 14 HA ILE 14 16.476 5.248 -16.894
105 HB ILE 14 HB ILE 14 16.503 4.100 -14.100
106 HG12 ILE 14 2HG1 ILE 14 16.327 7.011 -14.833
107 HG13 ILE 14 3HG1 ILE 14 14.877 6.020 -14.720
108 HG21 ILE 14 1HG2 ILE 14 18.749 4.284 -14.869
109 HG22 ILE 14 2HG2 ILE 14 18.447 5.880 -15.555
110 HG23 ILE 14 3HG2 ILE 14 18.445 5.658 -13.805
111 HD11 ILE 14 3HD1 ILE 14 14.847 6.576 -12.574
112 HD12 ILE 14 1HD1 ILE 14 16.204 5.468 -12.376
113 HD13 ILE 14 2HD1 ILE 14 16.500 7.189 -12.626
114 H LYS 15 H LYS 15 15.886 2.003 -15.650
115 HA LYS 15 HA LYS 15 18.445 0.941 -16.166
116 HB2 LYS 15 2HB LYS 15 16.022 0.006 -15.107
117 HB3 LYS 15 3HB LYS 15 16.348 -1.024 -16.495
118 HG2 LYS 15 2HG LYS 15 18.788 -0.918 -15.258
119 HG3 LYS 15 3HG LYS 15 17.664 -0.903 -13.897
120 HD2 LYS 15 2HD LYS 15 18.063 -3.176 -14.294
121 HD3 LYS 15 3HD LYS 15 16.509 -2.865 -15.073
122 HE2 LYS 15 2HE LYS 15 17.533 -2.768 -17.230
123 HE3 LYS 15 3HE LYS 15 19.149 -2.807 -16.525
124 HZ1 LYS 15 3HZ LYS 15 17.336 -4.975 -17.085
125 HZ2 LYS 15 1HZ LYS 15 18.032 -5.053 -15.545
126 HZ3 LYS 15 2HZ LYS 15 19.019 -4.988 -16.916
127 H THR 16 H THR 16 15.475 0.992 -18.106
128 HA THR 16 HA THR 16 16.434 -0.507 -20.275
129 HB THR 16 HB THR 16 14.457 1.734 -20.613
130 HG1 THR 16 HG1 THR 16 12.895 0.458 -19.685
131 HG21 THR 16 3HG2 THR 16 13.807 0.645 -22.478
132 HG22 THR 16 1HG2 THR 16 13.976 -0.944 -21.732
133 HG23 THR 16 2HG2 THR 16 15.395 -0.114 -22.370
134 H ARG 17 H ARG 17 16.186 3.035 -19.920
135 HA ARG 17 HA ARG 17 17.478 3.664 -22.333
136 HB2 ARG 17 2HB ARG 17 17.436 5.338 -19.817
137 HB3 ARG 17 3HB ARG 17 17.676 5.911 -21.463
138 HG2 ARG 17 2HG ARG 17 15.439 5.554 -22.037
139 HG3 ARG 17 3HG ARG 17 15.158 4.509 -20.643
140 HD2 ARG 17 2HD ARG 17 14.128 6.536 -20.080
141 HD3 ARG 17 3HD ARG 17 15.667 6.563 -19.219
142 HE ARG 17 HE ARG 17 16.198 7.827 -21.571
143 HH11 ARG 17 1HH1 ARG 17 13.848 8.262 -19.039
144 HH12 ARG 17 2HH1 ARG 17 13.725 9.975 -19.269
145 HH21 ARG 17 1HH2 ARG 17 16.045 10.081 -21.883
146 HH22 ARG 17 2HH2 ARG 17 14.974 11.008 -20.888
147 H CYS 18 H CYS 18 18.704 2.841 -19.177
148 HA CYS 18 HA CYS 18 21.367 3.774 -19.631
149 HB2 CYS 18 2HB CYS 18 20.845 3.611 -17.367
150 HB3 CYS 18 3HB CYS 18 20.047 2.055 -17.560
151 HG CYS 18 HG CYS 18 23.432 2.486 -17.814
152 H GLN 19 H GLN 19 19.742 0.642 -19.876
153 HA GLN 19 HA GLN 19 22.027 -0.896 -20.449
154 HB2 GLN 19 2HB GLN 19 19.135 -1.332 -21.211
155 HB3 GLN 19 3HB GLN 19 20.403 -2.536 -21.403
156 HG2 GLN 19 2HG GLN 19 20.414 -1.537 -18.720
157 HG3 GLN 19 3HG GLN 19 18.792 -2.070 -19.160
158 HE21 GLN 19 1HE2 GLN 19 22.018 -3.016 -18.459
159 HE22 GLN 19 2HE2 GLN 19 21.765 -4.724 -18.520
160 H ALA 20 H ALA 20 19.769 0.846 -22.537
161 HA ALA 20 HA ALA 20 21.218 0.031 -24.924
162 HB1 ALA 20 1HB ALA 20 18.578 1.006 -24.345
163 HB2 ALA 20 2HB ALA 20 19.327 1.976 -25.614
164 HB3 ALA 20 3HB ALA 20 19.190 0.228 -25.806
165 H LEU 21 H LEU 21 21.367 2.505 -22.633
166 HA LEU 21 HA LEU 21 22.602 4.406 -22.470
167 HB2 LEU 21 2HB LEU 21 23.866 3.570 -25.072
168 HB3 LEU 21 3HB LEU 21 24.530 4.671 -23.867
169 HG LEU 21 HG LEU 21 24.019 1.768 -23.272
170 HD11 LEU 21 1HD1 LEU 21 26.037 2.920 -24.997
171 HD12 LEU 21 2HD1 LEU 21 25.644 1.229 -24.689
172 HD13 LEU 21 3HD1 LEU 21 26.748 2.088 -23.615
173 HD21 LEU 21 3HD2 LEU 21 24.932 2.195 -21.281
174 HD22 LEU 21 1HD2 LEU 21 24.662 3.897 -21.656
175 HD23 LEU 21 2HD2 LEU 21 26.230 3.160 -21.985
176 H GLY 22 H GLY 22 20.172 4.040 -24.413
177 HA2 GLY 22 2HA GLY 22 18.961 5.352 -25.869
178 HA3 GLY 22 3HA GLY 22 19.591 6.671 -24.892
179 H GLY 23 H GLY 23 21.704 4.613 -26.758
180 HA2 GLY 23 2HA GLY 23 23.193 5.142 -28.430
181 HA3 GLY 23 3HA GLY 23 21.794 5.876 -29.199
182 H SER 24 H SER 24 23.073 7.016 -26.153
183 HA SER 24 HA SER 24 24.324 9.299 -27.506
184 HB2 SER 24 2HB SER 24 22.523 9.654 -25.109
185 HB3 SER 24 3HB SER 24 23.204 10.906 -26.148
186 HG SER 24 HG SER 24 20.983 9.310 -26.517
187 H GLU 25 H GLU 25 26.308 9.632 -26.768
188 HA GLU 25 HA GLU 25 27.397 8.157 -24.618
189 HB2 GLU 25 2HB GLU 25 29.386 9.673 -24.936
190 HB3 GLU 25 3HB GLU 25 28.861 8.812 -26.376
191 HG2 GLU 25 2HG GLU 25 28.721 10.728 -27.459
192 HG3 GLU 25 3HG GLU 25 27.480 11.270 -26.331
193 H ALA 26 H ALA 26 25.701 11.127 -24.753
194 HA ALA 26 HA ALA 26 26.759 12.148 -22.256
195 HB1 ALA 26 1HB ALA 26 24.308 13.384 -23.242
196 HB2 ALA 26 2HB ALA 26 25.875 14.105 -22.873
197 HB3 ALA 26 3HB ALA 26 25.603 13.339 -24.438
198 H GLU 27 H GLU 27 23.805 10.607 -23.431
199 HA GLU 27 HA GLU 27 22.145 10.889 -21.259
200 HB2 GLU 27 2HB GLU 27 22.484 8.762 -23.324
201 HB3 GLU 27 3HB GLU 27 21.430 8.434 -21.956
202 HG2 GLU 27 2HG GLU 27 21.166 10.799 -23.797
203 HG3 GLU 27 3HG GLU 27 20.238 9.306 -23.929
204 H CYS 28 H CYS 28 24.742 8.534 -21.724
205 HA CYS 28 HA CYS 28 24.345 6.874 -19.570
206 HB2 CYS 28 2HB CYS 28 27.040 7.888 -20.492
207 HB3 CYS 28 3HB CYS 28 26.714 6.379 -19.648
208 HG CYS 28 HG CYS 28 27.347 5.970 -22.405
209 H ALA 29 H ALA 29 26.142 9.943 -19.606
210 HA ALA 29 HA ALA 29 26.970 9.987 -16.961
211 HB1 ALA 29 1HB ALA 29 27.471 12.224 -17.266
212 HB2 ALA 29 2HB ALA 29 27.470 11.611 -18.920
213 HB3 ALA 29 3HB ALA 29 26.076 12.502 -18.310
214 H ALA 30 H ALA 30 23.953 11.263 -18.351
215 HA ALA 30 HA ALA 30 22.839 12.340 -16.054
216 HB1 ALA 30 1HB ALA 30 21.989 11.803 -18.682
217 HB2 ALA 30 2HB ALA 30 20.778 11.107 -17.605
218 HB3 ALA 30 3HB ALA 30 21.200 12.814 -17.471
219 H PHE 31 H PHE 31 22.711 9.009 -17.250
220 HA PHE 31 HA PHE 31 20.938 8.003 -15.316
221 HB2 PHE 31 2HB PHE 31 23.149 6.536 -16.770
222 HB3 PHE 31 3HB PHE 31 21.777 5.791 -15.956
223 HD1 PHE 31 HD2 PHE 31 19.653 7.729 -16.858
224 HD2 PHE 31 HD1 PHE 31 22.798 5.783 -18.965
225 HE1 PHE 31 HE2 PHE 31 18.344 7.871 -18.937
226 HE2 PHE 31 HE1 PHE 31 21.494 5.922 -21.047
227 HZ PHE 31 HZ PHE 31 19.264 6.966 -21.034
228 H GLU 32 H GLU 32 24.486 8.118 -15.394
229 HA GLU 32 HA GLU 32 25.002 6.747 -13.032
230 HB2 GLU 32 2HB GLU 32 26.517 8.064 -14.920
231 HB3 GLU 32 3HB GLU 32 26.776 9.032 -13.475
232 HG2 GLU 32 2HG GLU 32 27.744 7.269 -12.313
233 HG3 GLU 32 3HG GLU 32 27.067 6.057 -13.399
234 H LYS 33 H LYS 33 24.438 10.215 -13.536
235 HA LYS 33 HA LYS 33 24.752 10.954 -10.822
236 HB2 LYS 33 2HB LYS 33 23.625 12.242 -13.265
237 HB3 LYS 33 3HB LYS 33 23.232 12.946 -11.702
238 HG2 LYS 33 2HG LYS 33 25.105 14.130 -12.134
239 HG3 LYS 33 3HG LYS 33 25.866 12.723 -11.388
240 HD2 LYS 33 2HD LYS 33 26.260 11.758 -13.598
241 HD3 LYS 33 3HD LYS 33 25.476 13.148 -14.352
242 HE2 LYS 33 2HE LYS 33 27.791 13.556 -12.505
243 HE3 LYS 33 3HE LYS 33 28.075 13.053 -14.171
244 HZ1 LYS 33 3HZ LYS 33 28.147 15.343 -14.294
245 HZ2 LYS 33 1HZ LYS 33 26.899 15.564 -13.173
246 HZ3 LYS 33 2HZ LYS 33 26.546 15.024 -14.737
247 H GLU 34 H GLU 34 21.781 10.661 -12.782
248 HA GLU 34 HA GLU 34 19.925 11.032 -10.780
249 HB2 GLU 34 2HB GLU 34 19.863 10.258 -13.455
250 HB3 GLU 34 3HB GLU 34 19.093 8.927 -12.603
251 HG2 GLU 34 2HG GLU 34 17.828 10.954 -11.423
252 HG3 GLU 34 3HG GLU 34 18.200 11.719 -12.967
253 H ILE 35 H ILE 35 21.424 7.978 -11.805
254 HA ILE 35 HA ILE 35 20.060 6.308 -10.007
255 HB ILE 35 HB ILE 35 22.749 6.011 -11.335
256 HG12 ILE 35 2HG1 ILE 35 20.666 5.982 -12.736
257 HG13 ILE 35 3HG1 ILE 35 21.608 4.496 -12.813
258 HG21 ILE 35 1HG2 ILE 35 21.335 4.207 -9.415
259 HG22 ILE 35 2HG2 ILE 35 22.356 3.531 -10.683
260 HG23 ILE 35 3HG2 ILE 35 23.042 4.639 -9.495
261 HD11 ILE 35 3HD1 ILE 35 19.230 4.033 -12.684
262 HD12 ILE 35 1HD1 ILE 35 20.067 3.438 -11.251
263 HD13 ILE 35 2HD1 ILE 35 19.126 4.927 -11.168
264 H ALA 36 H ALA 36 23.141 8.031 -9.714
265 HA ALA 36 HA ALA 36 24.011 7.003 -7.287
266 HB1 ALA 36 1HB ALA 36 24.361 9.792 -8.379
267 HB2 ALA 36 2HB ALA 36 25.282 9.101 -7.043
268 HB3 ALA 36 3HB ALA 36 25.420 8.410 -8.660
269 H ALA 37 H ALA 37 21.926 9.823 -7.885
270 HA ALA 37 HA ALA 37 21.567 10.503 -5.167
271 HB1 ALA 37 1HB ALA 37 19.747 11.085 -7.500
272 HB2 ALA 37 2HB ALA 37 19.743 11.908 -5.940
273 HB3 ALA 37 3HB ALA 37 21.134 12.060 -7.014
274 H PHE 38 H PHE 38 19.749 8.430 -7.375
275 HA PHE 38 HA PHE 38 17.500 7.961 -5.808
276 HB2 PHE 38 2HB PHE 38 18.696 6.827 -8.161
277 HB3 PHE 38 3HB PHE 38 18.119 5.532 -7.116
278 HD1 PHE 38 HD2 PHE 38 15.723 6.579 -5.928
279 HD2 PHE 38 HD1 PHE 38 17.203 7.086 -9.887
280 HE1 PHE 38 HE2 PHE 38 13.428 6.951 -6.735
281 HE2 PHE 38 HE1 PHE 38 14.911 7.460 -10.699
282 HZ PHE 38 HZ PHE 38 13.020 7.391 -9.123
283 H GLU 39 H GLU 39 20.437 5.948 -6.036
284 HA GLU 39 HA GLU 39 19.745 4.169 -3.985
285 HB2 GLU 39 2HB GLU 39 22.155 3.602 -3.931
286 HB3 GLU 39 3HB GLU 39 21.498 3.630 -5.561
287 HG2 GLU 39 2HG GLU 39 22.446 5.871 -5.886
288 HG3 GLU 39 3HG GLU 39 23.144 5.793 -4.269
289 H SER 40 H SER 40 21.520 7.220 -3.921
290 HA SER 40 HA SER 40 22.357 7.107 -1.239
291 HB2 SER 40 2HB SER 40 23.430 8.731 -2.555
292 HB3 SER 40 3HB SER 40 21.907 9.369 -3.173
293 HG SER 40 HG SER 40 21.526 10.337 -1.221
294 H GLU 41 H GLU 41 19.338 8.061 -2.720
295 HA GLU 41 HA GLU 41 18.274 9.236 -0.314
296 HB2 GLU 41 2HB GLU 41 17.415 8.901 -3.099
297 HB3 GLU 41 3HB GLU 41 16.107 8.758 -1.933
298 HG2 GLU 41 2HG GLU 41 17.982 11.087 -2.263
299 HG3 GLU 41 3HG GLU 41 16.272 11.031 -2.687
300 H LEU 42 H LEU 42 18.180 6.129 -1.916
301 HA LEU 42 HA LEU 42 16.040 5.047 -0.374
302 HB2 LEU 42 2HB LEU 42 18.196 3.777 -2.044
303 HB3 LEU 42 3HB LEU 42 16.938 2.851 -1.229
304 HG LEU 42 HG LEU 42 16.024 5.025 -3.014
305 HD11 LEU 42 1HD1 LEU 42 16.266 3.532 -4.994
306 HD12 LEU 42 2HD1 LEU 42 17.338 2.514 -4.033
307 HD13 LEU 42 3HD1 LEU 42 17.789 4.182 -4.386
308 HD21 LEU 42 3HD2 LEU 42 15.163 2.285 -2.193
309 HD22 LEU 42 1HD2 LEU 42 14.517 3.007 -3.667
310 HD23 LEU 42 2HD2 LEU 42 14.281 3.811 -2.115
311 H GLN 43 H GLN 43 19.526 5.177 -0.024
312 HA GLN 43 HA GLN 43 19.728 3.272 2.068
313 HB2 GLN 43 2HB GLN 43 21.971 3.967 2.296
314 HB3 GLN 43 3HB GLN 43 21.604 4.148 0.585
315 HG2 GLN 43 2HG GLN 43 22.334 6.229 0.714
316 HG3 GLN 43 3HG GLN 43 20.952 6.601 1.743
317 HE21 GLN 43 1HE2 GLN 43 21.489 7.584 3.542
318 HE22 GLN 43 2HE2 GLN 43 22.948 7.359 4.438
319 H ALA 44 H ALA 44 18.625 6.503 1.959
320 HA ALA 44 HA ALA 44 19.190 7.160 4.698
321 HB1 ALA 44 1HB ALA 44 17.093 8.572 3.116
322 HB2 ALA 44 2HB ALA 44 18.267 9.219 4.263
323 HB3 ALA 44 3HB ALA 44 18.786 8.734 2.649
324 H TYR 45 H TYR 45 16.734 5.431 3.038
325 HA TYR 45 HA TYR 45 14.634 5.825 4.930
326 HB2 TYR 45 2HB TYR 45 15.102 3.928 2.655
327 HB3 TYR 45 3HB TYR 45 13.768 3.650 3.770
328 HD1 TYR 45 HD1 TYR 45 15.195 6.681 2.098
329 HD2 TYR 45 HD2 TYR 45 11.754 4.302 2.870
330 HE1 TYR 45 HE1 TYR 45 13.815 8.278 0.835
331 HE2 TYR 45 HE2 TYR 45 10.365 5.891 1.607
332 HH TYR 45 HH TYR 45 10.416 7.642 0.168
333 H LYS 46 H LYS 46 16.474 2.865 4.165
334 HA LYS 46 HA LYS 46 16.972 1.035 5.432
335 HB2 LYS 46 2HB LYS 46 18.374 3.043 6.396
336 HB3 LYS 46 3HB LYS 46 17.338 2.826 7.800
337 HG2 LYS 46 2HG LYS 46 18.086 0.564 8.077
338 HG3 LYS 46 3HG LYS 46 19.003 0.641 6.570
339 HD2 LYS 46 2HD LYS 46 20.749 1.234 7.833
340 HD3 LYS 46 3HD LYS 46 19.951 2.799 8.003
341 HE2 LYS 46 2HE LYS 46 19.241 0.548 9.838
342 HE3 LYS 46 3HE LYS 46 20.708 1.484 10.122
343 HZ1 LYS 46 3HZ LYS 46 18.038 2.162 10.726
344 HZ2 LYS 46 1HZ LYS 46 18.668 3.304 9.648
345 HZ3 LYS 46 2HZ LYS 46 19.457 2.999 11.112
346 H GLY 47 H GLY 47 14.391 0.978 5.219
347 HA2 GLY 47 2HA GLY 47 13.055 1.129 7.788
348 HA3 GLY 47 3HA GLY 47 12.332 0.650 6.260
349 H LYS 48 H LYS 48 12.981 -0.449 9.228
350 HA LYS 48 HA LYS 48 14.228 -2.898 9.012
351 HB2 LYS 48 2HB LYS 48 12.619 -1.563 10.929
352 HB3 LYS 48 3HB LYS 48 11.968 -3.186 10.747
353 HG2 LYS 48 2HG LYS 48 13.975 -4.189 11.416
354 HG3 LYS 48 3HG LYS 48 14.894 -2.701 11.184
355 HD2 LYS 48 2HD LYS 48 12.666 -2.835 13.185
356 HD3 LYS 48 3HD LYS 48 14.279 -3.428 13.588
357 HE2 LYS 48 2HE LYS 48 15.025 -1.096 12.643
358 HE3 LYS 48 3HE LYS 48 13.360 -0.649 13.009
359 HZ1 LYS 48 3HZ LYS 48 14.541 -0.129 14.928
360 HZ2 LYS 48 1HZ LYS 48 15.473 -1.540 14.871
361 HZ3 LYS 48 2HZ LYS 48 13.838 -1.623 15.297
362 H GLY 49 H GLY 49 10.686 -2.421 8.929
363 HA2 GLY 49 2HA GLY 49 10.409 -5.015 7.609
364 HA3 GLY 49 3HA GLY 49 9.105 -4.047 8.282
365 H ASN 50 H ASN 50 11.503 -2.625 6.198
366 HA ASN 50 HA ASN 50 9.437 -2.340 4.119
367 HB2 ASN 50 2HB ASN 50 11.808 -0.551 4.706
368 HB3 ASN 50 3HB ASN 50 10.619 -0.291 3.432
369 HD21 ASN 50 1HD2 ASN 50 10.769 1.774 4.890
370 HD22 ASN 50 2HD2 ASN 50 9.530 1.887 6.089
371 HA PRO 51 HA PRO 51 12.661 -5.049 2.238
372 HB2 PRO 51 2HB PRO 51 10.885 -6.559 0.848
373 HB3 PRO 51 3HB PRO 51 11.316 -6.889 2.530
374 HG2 PRO 51 2HG PRO 51 8.918 -5.473 1.432
375 HG3 PRO 51 3HG PRO 51 9.011 -6.668 2.739
376 HD2 PRO 51 2HD PRO 51 8.818 -4.008 3.208
377 HD3 PRO 51 3HD PRO 51 9.700 -5.107 4.288
378 H GLU 52 H GLU 52 10.208 -2.945 1.081
379 HA GLU 52 HA GLU 52 10.433 -3.191 -1.678
380 HB2 GLU 52 2HB GLU 52 9.729 -0.793 -1.750
381 HB3 GLU 52 3HB GLU 52 8.715 -1.810 -0.737
382 HG2 GLU 52 2HG GLU 52 9.578 -0.904 1.238
383 HG3 GLU 52 3HG GLU 52 10.964 -0.197 0.409
384 H VAL 53 H VAL 53 12.564 -1.671 0.634
385 HA VAL 53 HA VAL 53 14.121 -0.236 -1.288
386 HB VAL 53 HB VAL 53 14.966 -1.064 1.489
387 HG11 VAL 53 1HG1 VAL 53 15.979 1.446 0.871
388 HG12 VAL 53 2HG1 VAL 53 16.871 -0.077 0.889
389 HG13 VAL 53 3HG1 VAL 53 16.168 0.517 -0.616
390 HG21 VAL 53 3HG2 VAL 53 12.835 0.068 1.646
391 HG22 VAL 53 1HG2 VAL 53 14.116 1.144 2.206
392 HG23 VAL 53 2HG2 VAL 53 13.413 1.368 0.604
393 H GLU 54 H GLU 54 14.013 -3.491 -0.225
394 HA GLU 54 HA GLU 54 16.661 -4.303 -0.559
395 HB2 GLU 54 2HB GLU 54 14.154 -5.886 -1.152
396 HB3 GLU 54 3HB GLU 54 15.758 -6.558 -0.888
397 HG2 GLU 54 2HG GLU 54 15.748 -5.962 1.387
398 HG3 GLU 54 3HG GLU 54 14.352 -4.905 1.183
399 H ALA 55 H ALA 55 13.994 -4.523 -2.919
400 HA ALA 55 HA ALA 55 15.659 -5.304 -5.073
401 HB1 ALA 55 1HB ALA 55 13.035 -3.919 -5.469
402 HB2 ALA 55 2HB ALA 55 13.758 -5.231 -6.400
403 HB3 ALA 55 3HB ALA 55 13.102 -5.547 -4.794
404 H LEU 56 H LEU 56 14.402 -2.178 -4.002
405 HA LEU 56 HA LEU 56 15.214 -0.637 -6.190
406 HB2 LEU 56 2HB LEU 56 14.586 -0.096 -3.338
407 HB3 LEU 56 3HB LEU 56 15.418 1.163 -4.248
408 HG LEU 56 HG LEU 56 13.596 1.591 -5.583
409 HD11 LEU 56 1HD1 LEU 56 11.711 -0.003 -5.883
410 HD12 LEU 56 2HD1 LEU 56 12.623 -1.189 -4.949
411 HD13 LEU 56 3HD1 LEU 56 13.257 -0.601 -6.486
412 HD21 LEU 56 3HD2 LEU 56 12.250 2.356 -3.993
413 HD22 LEU 56 1HD2 LEU 56 13.115 1.350 -2.830
414 HD23 LEU 56 2HD2 LEU 56 11.675 0.726 -3.636
415 H ARG 57 H ARG 57 16.912 -1.336 -3.143
416 HA ARG 57 HA ARG 57 19.240 0.130 -3.759
417 HB2 ARG 57 2HB ARG 57 18.388 -0.928 -1.506
418 HB3 ARG 57 3HB ARG 57 19.351 -2.305 -2.026
419 HG2 ARG 57 2HG ARG 57 21.245 -1.315 -1.427
420 HG3 ARG 57 3HG ARG 57 20.818 0.173 -2.274
421 HD2 ARG 57 2HD ARG 57 20.140 1.178 -0.393
422 HD3 ARG 57 3HD ARG 57 19.272 -0.253 0.161
423 HE ARG 57 HE ARG 57 22.133 -0.453 0.398
424 HH11 ARG 57 1HH1 ARG 57 19.189 0.599 1.929
425 HH12 ARG 57 2HH1 ARG 57 19.838 0.513 3.533
426 HH21 ARG 57 1HH2 ARG 57 22.999 -0.572 2.505
427 HH22 ARG 57 2HH2 ARG 57 22.006 -0.153 3.859
428 H LYS 58 H LYS 58 18.382 -3.272 -4.225
429 HA LYS 58 HA LYS 58 20.883 -4.140 -5.178
430 HB2 LYS 58 2HB LYS 58 18.497 -5.350 -4.590
431 HB3 LYS 58 3HB LYS 58 18.537 -5.473 -6.344
432 HG2 LYS 58 2HG LYS 58 19.901 -7.204 -6.192
433 HG3 LYS 58 3HG LYS 58 21.097 -6.198 -5.371
434 HD2 LYS 58 2HD LYS 58 19.508 -6.644 -3.299
435 HD3 LYS 58 3HD LYS 58 19.084 -8.075 -4.242
436 HE2 LYS 58 2HE LYS 58 21.944 -7.332 -3.723
437 HE3 LYS 58 3HE LYS 58 21.010 -8.253 -2.546
438 HZ1 LYS 58 3HZ LYS 58 21.612 -9.035 -5.345
439 HZ2 LYS 58 1HZ LYS 58 20.555 -9.883 -4.332
440 HZ3 LYS 58 2HZ LYS 58 22.195 -9.767 -3.935
441 H GLU 59 H GLU 59 17.922 -3.399 -7.032
442 HA GLU 59 HA GLU 59 19.049 -3.573 -9.568
443 HB2 GLU 59 2HB GLU 59 16.812 -3.407 -9.834
444 HB3 GLU 59 3HB GLU 59 16.616 -2.408 -8.400
445 HG2 GLU 59 2HG GLU 59 17.059 -0.437 -9.566
446 HG3 GLU 59 3HG GLU 59 17.778 -1.297 -10.926
447 H ALA 60 H ALA 60 18.618 -0.697 -7.517
448 HA ALA 60 HA ALA 60 19.644 1.234 -9.195
449 HB1 ALA 60 1HB ALA 60 18.654 1.931 -7.170
450 HB2 ALA 60 2HB ALA 60 19.778 0.977 -6.202
451 HB3 ALA 60 3HB ALA 60 20.350 2.405 -7.064
452 H ALA 61 H ALA 61 21.471 -0.650 -6.777
453 HA ALA 61 HA ALA 61 23.998 0.351 -7.314
454 HB1 ALA 61 1HB ALA 61 22.955 -2.160 -6.136
455 HB2 ALA 61 2HB ALA 61 24.653 -2.131 -6.613
456 HB3 ALA 61 3HB ALA 61 24.043 -0.951 -5.453
457 H ALA 62 H ALA 62 22.319 -2.380 -8.835
458 HA ALA 62 HA ALA 62 24.389 -3.261 -10.486
459 HB1 ALA 62 1HB ALA 62 22.226 -4.441 -10.059
460 HB2 ALA 62 2HB ALA 62 21.460 -3.319 -11.184
461 HB3 ALA 62 3HB ALA 62 22.725 -4.410 -11.751
462 H ILE 63 H ILE 63 21.835 -0.873 -11.130
463 HA ILE 63 HA ILE 63 22.520 -0.302 -13.780
464 HB ILE 63 HB ILE 63 21.323 1.586 -11.748
465 HG12 ILE 63 2HG1 ILE 63 19.807 -0.006 -13.800
466 HG13 ILE 63 3HG1 ILE 63 20.186 -0.693 -12.224
467 HG21 ILE 63 1HG2 ILE 63 22.143 2.779 -13.681
468 HG22 ILE 63 2HG2 ILE 63 21.328 1.650 -14.761
469 HG23 ILE 63 3HG2 ILE 63 20.381 2.721 -13.729
470 HD11 ILE 63 3HD1 ILE 63 17.945 0.258 -12.289
471 HD12 ILE 63 1HD1 ILE 63 18.973 1.105 -11.134
472 HD13 ILE 63 2HD1 ILE 63 18.622 1.833 -12.702
473 H ARG 64 H ARG 64 23.608 1.194 -10.752
474 HA ARG 64 HA ARG 64 25.158 3.238 -11.848
475 HB2 ARG 64 2HB ARG 64 24.518 2.842 -9.401
476 HB3 ARG 64 3HB ARG 64 25.894 1.749 -9.335
477 HG2 ARG 64 2HG ARG 64 26.444 4.427 -10.425
478 HG3 ARG 64 3HG ARG 64 26.015 4.360 -8.715
479 HD2 ARG 64 2HD ARG 64 27.814 2.261 -9.108
480 HD3 ARG 64 3HD ARG 64 28.473 3.613 -10.026
481 HE ARG 64 HE ARG 64 28.941 4.680 -8.055
482 HH11 ARG 64 1HH1 ARG 64 26.730 2.061 -7.443
483 HH12 ARG 64 2HH1 ARG 64 26.835 2.203 -5.720
484 HH21 ARG 64 1HH2 ARG 64 29.088 4.876 -5.787
485 HH22 ARG 64 2HH2 ARG 64 28.176 3.805 -4.779
486 H ASP 65 H ASP 65 26.097 -0.064 -10.925
487 HA ASP 65 HA ASP 65 28.804 0.113 -11.578
488 HB2 ASP 65 2HB ASP 65 27.069 -2.347 -11.861
489 HB3 ASP 65 3HB ASP 65 28.812 -2.301 -11.611
490 H GLU 66 H GLU 66 26.031 -0.826 -13.579
491 HA GLU 66 HA GLU 66 27.442 -1.530 -15.887
492 HB2 GLU 66 2HB GLU 66 24.707 -0.252 -15.788
493 HB3 GLU 66 3HB GLU 66 25.355 -1.260 -17.074
494 HG2 GLU 66 2HG GLU 66 25.464 -2.646 -14.560
495 HG3 GLU 66 3HG GLU 66 23.832 -2.065 -14.881
496 H CYS 67 H CYS 67 26.071 1.596 -14.908
497 HA CYS 67 HA CYS 67 26.713 3.048 -17.197
498 HB2 CYS 67 2HB CYS 67 26.499 3.923 -14.314
499 HB3 CYS 67 3HB CYS 67 26.685 5.046 -15.655
500 HG CYS 67 HG CYS 67 24.273 4.233 -16.894
501 H GLN 68 H GLN 68 28.623 2.471 -14.266
502 HA GLN 68 HA GLN 68 30.831 4.062 -15.061
503 HB2 GLN 68 2HB GLN 68 30.972 1.716 -13.177
504 HB3 GLN 68 3HB GLN 68 31.971 3.163 -13.185
505 HG2 GLN 68 2HG GLN 68 29.346 4.068 -12.881
506 HG3 GLN 68 3HG GLN 68 29.492 2.660 -11.830
507 HE21 GLN 68 1HE2 GLN 68 29.286 5.591 -11.298
508 HE22 GLN 68 2HE2 GLN 68 30.620 5.945 -10.259
509 H ALA 69 H ALA 69 29.873 0.783 -15.707
510 HA ALA 69 HA ALA 69 32.460 -0.026 -16.698
511 HB1 ALA 69 1HB ALA 69 30.887 -1.614 -15.625
512 HB2 ALA 69 2HB ALA 69 29.809 -1.426 -17.008
513 HB3 ALA 69 3HB ALA 69 31.413 -2.123 -17.229
514 H TYR 70 H TYR 70 30.014 1.878 -17.900
515 HA TYR 70 HA TYR 70 30.451 1.078 -20.685
516 HB2 TYR 70 2HB TYR 70 28.453 3.005 -19.482
517 HB3 TYR 70 3HB TYR 70 28.565 2.602 -21.192
518 HD1 TYR 70 HD1 TYR 70 29.179 -0.398 -20.667
519 HD2 TYR 70 HD2 TYR 70 26.181 2.257 -19.229
520 HE1 TYR 70 HE1 TYR 70 27.665 -2.305 -20.318
521 HE2 TYR 70 HE2 TYR 70 24.660 0.357 -18.875
522 HH TYR 70 HH TYR 70 24.842 -2.419 -20.221
523 H ARG 71 H ARG 71 30.818 3.805 -18.483
524 HA ARG 71 HA ARG 71 32.661 5.028 -20.411
525 HB2 ARG 71 2HB ARG 71 30.193 6.052 -20.129
526 HB3 ARG 71 3HB ARG 71 30.994 6.879 -18.800
527 HG2 ARG 71 2HG ARG 71 32.710 7.681 -20.402
528 HG3 ARG 71 3HG ARG 71 31.770 6.954 -21.707
529 HD2 ARG 71 2HD ARG 71 30.484 8.760 -21.806
530 HD3 ARG 71 3HD ARG 71 30.024 8.540 -20.118
531 HE ARG 71 HE ARG 71 32.576 9.776 -20.354
532 HH11 ARG 71 1HH1 ARG 71 29.155 10.385 -20.569
533 HH12 ARG 71 2HH1 ARG 71 29.295 12.063 -20.161
534 HH21 ARG 71 1HH2 ARG 71 32.774 11.984 -19.816
535 HH22 ARG 71 2HH2 ARG 71 31.355 12.971 -19.733
536 H HIS 72 H HIS 72 33.453 3.466 -18.293
537 HA HIS 72 HA HIS 72 35.263 5.134 -16.951
538 HB2 HIS 72 2HB HIS 72 32.817 5.395 -15.794
539 HB3 HIS 72 3HB HIS 72 33.479 4.057 -14.859
540 HD1 HIS 72 HD1 HIS 72 36.403 4.968 -14.634
541 HD2 HIS 72 HD2 HIS 72 33.135 7.469 -14.063
542 HE1 HIS 72 HE1 HIS 72 37.244 6.858 -13.204
543 H ASN 73 H ASN 73 35.148 2.627 -18.375
544 HA ASN 73 HA ASN 73 36.534 0.969 -16.405
545 HB2 ASN 73 2HB ASN 73 34.454 -0.119 -16.353
546 HB3 ASN 73 3HB ASN 73 34.184 0.119 -18.077
547 HD21 ASN 73 1HD2 ASN 73 35.652 -1.836 -15.653
548 HD22 ASN 73 2HD2 ASN 73 36.176 -3.112 -16.694
Start of MODEL 20
1 H1 MET 1 H MET 1 2.631 -0.700 -6.265
2 HA MET 1 HA MET 1 1.191 -0.028 -4.603
3 HB2 MET 1 2HB MET 1 3.209 -1.804 -3.631
4 HB3 MET 1 3HB MET 1 2.784 -0.685 -2.343
5 HG2 MET 1 2HG MET 1 0.700 -1.520 -2.112
6 HG3 MET 1 3HG MET 1 0.539 -1.890 -3.827
7 HE1 MET 1 3HE MET 1 1.608 -3.527 -5.005
8 HE2 MET 1 1HE MET 1 2.582 -4.874 -4.416
9 HE3 MET 1 2HE MET 1 0.824 -5.011 -4.460
10 H GLY 2 H GLY 2 0.838 2.097 -4.371
11 HA2 GLY 2 2HA GLY 2 1.002 4.229 -3.536
12 HA3 GLY 2 3HA GLY 2 1.992 3.546 -2.254
13 H SER 3 H SER 3 3.825 4.637 -2.080
14 HA SER 3 HA SER 3 4.927 6.189 -4.186
15 HB2 SER 3 2HB SER 3 5.963 5.379 -1.470
16 HB3 SER 3 3HB SER 3 6.905 6.378 -2.577
17 HG SER 3 HG SER 3 4.953 7.125 -0.928
18 H TRP 4 H TRP 4 5.668 3.017 -2.845
19 HA TRP 4 HA TRP 4 8.108 2.502 -4.029
20 HB2 TRP 4 2HB TRP 4 7.217 0.934 -2.460
21 HB3 TRP 4 3HB TRP 4 5.789 0.655 -3.454
22 HD1 TRP 4 HD1 TRP 4 6.164 -0.811 -5.727
23 HE1 TRP 4 HE1 TRP 4 7.899 -2.635 -6.262
24 HE3 TRP 4 HE3 TRP 4 9.568 0.202 -2.049
25 HZ2 TRP 4 HZ2 TRP 4 10.382 -3.527 -5.259
26 HZ3 TRP 4 HZ3 TRP 4 11.596 -1.184 -1.905
27 HH2 TRP 4 HH2 TRP 4 11.992 -3.010 -3.477
28 H ALA 5 H ALA 5 4.866 2.084 -5.405
29 HA ALA 5 HA ALA 5 5.498 0.861 -7.795
30 HB1 ALA 5 1HB ALA 5 3.308 1.076 -8.065
31 HB2 ALA 5 2HB ALA 5 3.251 2.186 -6.694
32 HB3 ALA 5 3HB ALA 5 3.496 2.811 -8.325
33 H GLU 6 H GLU 6 5.381 4.359 -7.127
34 HA GLU 6 HA GLU 6 6.092 5.252 -9.668
35 HB2 GLU 6 2HB GLU 6 5.404 6.499 -7.401
36 HB3 GLU 6 3HB GLU 6 7.143 6.745 -7.322
37 HG2 GLU 6 2HG GLU 6 6.928 7.617 -9.723
38 HG3 GLU 6 3HG GLU 6 5.202 7.718 -9.381
39 H PHE 7 H PHE 7 8.174 4.560 -6.869
40 HA PHE 7 HA PHE 7 10.614 5.214 -8.063
41 HB2 PHE 7 2HB PHE 7 9.722 3.843 -5.660
42 HB3 PHE 7 3HB PHE 7 11.186 3.119 -6.316
43 HD1 PHE 7 HD1 PHE 7 9.772 6.489 -5.570
44 HD2 PHE 7 HD2 PHE 7 13.205 3.974 -5.641
45 HE1 PHE 7 HE1 PHE 7 11.108 8.290 -4.558
46 HE2 PHE 7 HE2 PHE 7 14.546 5.771 -4.628
47 HZ PHE 7 HZ PHE 7 13.499 7.932 -4.084
48 H LYS 8 H LYS 8 8.778 2.203 -8.059
49 HA LYS 8 HA LYS 8 10.741 0.588 -9.283
50 HB2 LYS 8 2HB LYS 8 7.850 0.398 -8.722
51 HB3 LYS 8 3HB LYS 8 8.414 -0.570 -10.076
52 HG2 LYS 8 2HG LYS 8 9.543 -0.665 -7.286
53 HG3 LYS 8 3HG LYS 8 8.395 -1.820 -7.967
54 HD2 LYS 8 2HD LYS 8 10.726 -1.430 -9.662
55 HD3 LYS 8 3HD LYS 8 11.152 -2.008 -8.049
56 HE2 LYS 8 2HE LYS 8 9.289 -3.739 -8.400
57 HE3 LYS 8 3HE LYS 8 9.375 -3.290 -10.102
58 HZ1 LYS 8 3HZ LYS 8 11.844 -3.770 -9.885
59 HZ2 LYS 8 1HZ LYS 8 10.802 -5.103 -9.884
60 HZ3 LYS 8 2HZ LYS 8 11.464 -4.546 -8.431
61 H GLN 9 H GLN 9 8.062 2.489 -10.618
62 HA GLN 9 HA GLN 9 8.375 1.723 -13.298
63 HB2 GLN 9 2HB GLN 9 6.711 3.449 -11.863
64 HB3 GLN 9 3HB GLN 9 7.527 4.481 -13.030
65 HG2 GLN 9 2HG GLN 9 6.687 3.263 -14.854
66 HG3 GLN 9 3HG GLN 9 6.180 1.923 -13.827
67 HE21 GLN 9 1HE2 GLN 9 4.391 2.916 -15.552
68 HE22 GLN 9 2HE2 GLN 9 3.175 3.825 -14.728
69 H ARG 10 H ARG 10 9.451 4.754 -11.748
70 HA ARG 10 HA ARG 10 10.923 5.772 -13.848
71 HB2 ARG 10 2HB ARG 10 10.451 7.062 -11.839
72 HB3 ARG 10 3HB ARG 10 11.481 6.001 -10.886
73 HG2 ARG 10 2HG ARG 10 12.680 7.386 -13.223
74 HG3 ARG 10 3HG ARG 10 12.330 8.330 -11.774
75 HD2 ARG 10 2HD ARG 10 13.525 6.139 -10.704
76 HD3 ARG 10 3HD ARG 10 14.369 6.269 -12.247
77 HE ARG 10 HE ARG 10 14.201 8.751 -10.810
78 HH11 ARG 10 1HH1 ARG 10 16.004 5.803 -11.230
79 HH12 ARG 10 2HH1 ARG 10 17.487 6.472 -10.637
80 HH21 ARG 10 1HH2 ARG 10 16.148 9.644 -10.026
81 HH22 ARG 10 2HH2 ARG 10 17.568 8.657 -9.951
82 H LEU 11 H LEU 11 12.028 3.606 -11.257
83 HA LEU 11 HA LEU 11 14.711 3.447 -11.978
84 HB2 LEU 11 2HB LEU 11 12.824 1.736 -10.467
85 HB3 LEU 11 3HB LEU 11 14.328 0.989 -11.003
86 HG LEU 11 HG LEU 11 14.528 3.577 -9.563
87 HD11 LEU 11 1HD1 LEU 11 12.916 1.632 -8.478
88 HD12 LEU 11 2HD1 LEU 11 13.758 2.898 -7.585
89 HD13 LEU 11 3HD1 LEU 11 14.489 1.302 -7.751
90 HD21 LEU 11 3HD2 LEU 11 16.166 1.240 -8.854
91 HD22 LEU 11 1HD2 LEU 11 16.641 2.906 -9.185
92 HD23 LEU 11 2HD2 LEU 11 16.327 1.797 -10.521
93 H ALA 12 H ALA 12 11.956 1.496 -13.063
94 HA ALA 12 HA ALA 12 13.350 -0.339 -14.637
95 HB1 ALA 12 1HB ALA 12 11.250 -1.089 -14.625
96 HB2 ALA 12 2HB ALA 12 10.589 0.519 -14.327
97 HB3 ALA 12 3HB ALA 12 10.969 0.013 -15.973
98 H ALA 13 H ALA 13 11.985 2.824 -15.497
99 HA ALA 13 HA ALA 13 12.617 2.759 -18.230
100 HB1 ALA 13 1HB ALA 13 12.800 5.435 -17.280
101 HB2 ALA 13 2HB ALA 13 11.487 4.665 -18.171
102 HB3 ALA 13 3HB ALA 13 11.504 4.615 -16.408
103 H ILE 14 H ILE 14 14.460 3.925 -15.439
104 HA ILE 14 HA ILE 14 16.620 5.023 -16.859
105 HB ILE 14 HB ILE 14 16.597 3.811 -14.093
106 HG12 ILE 14 2HG1 ILE 14 15.022 5.721 -14.500
107 HG13 ILE 14 3HG1 ILE 14 16.253 6.050 -13.286
108 HG21 ILE 14 1HG2 ILE 14 18.810 4.042 -14.172
109 HG22 ILE 14 2HG2 ILE 14 18.737 4.905 -15.708
110 HG23 ILE 14 3HG2 ILE 14 18.537 5.784 -14.192
111 HD11 ILE 14 3HD1 ILE 14 16.574 6.888 -16.146
112 HD12 ILE 14 1HD1 ILE 14 15.743 7.887 -14.954
113 HD13 ILE 14 2HD1 ILE 14 17.440 7.467 -14.723
114 H LYS 15 H LYS 15 16.053 1.762 -15.611
115 HA LYS 15 HA LYS 15 18.596 0.716 -16.252
116 HB2 LYS 15 2HB LYS 15 16.245 -0.224 -15.042
117 HB3 LYS 15 3HB LYS 15 16.507 -1.274 -16.428
118 HG2 LYS 15 2HG LYS 15 19.011 -1.090 -15.303
119 HG3 LYS 15 3HG LYS 15 17.936 -1.123 -13.904
120 HD2 LYS 15 2HD LYS 15 17.533 -3.074 -16.133
121 HD3 LYS 15 3HD LYS 15 18.803 -3.356 -14.940
122 HE2 LYS 15 2HE LYS 15 16.614 -2.679 -13.403
123 HE3 LYS 15 3HE LYS 15 15.916 -3.643 -14.704
124 HZ1 LYS 15 3HZ LYS 15 17.626 -5.351 -14.198
125 HZ2 LYS 15 1HZ LYS 15 16.522 -5.098 -12.942
126 HZ3 LYS 15 2HZ LYS 15 18.080 -4.449 -12.841
127 H THR 16 H THR 16 15.536 0.809 -18.029
128 HA THR 16 HA THR 16 16.311 -0.761 -20.217
129 HB THR 16 HB THR 16 14.421 1.574 -20.447
130 HG1 THR 16 HG1 THR 16 12.814 0.094 -19.658
131 HG21 THR 16 3HG2 THR 16 13.229 -0.057 -21.940
132 HG22 THR 16 1HG2 THR 16 14.618 -1.129 -21.773
133 HG23 THR 16 2HG2 THR 16 14.812 0.455 -22.524
134 H ARG 17 H ARG 17 16.221 2.798 -19.949
135 HA ARG 17 HA ARG 17 17.460 3.295 -22.424
136 HB2 ARG 17 2HB ARG 17 16.704 4.846 -20.056
137 HB3 ARG 17 3HB ARG 17 18.126 5.472 -20.878
138 HG2 ARG 17 2HG ARG 17 16.601 6.589 -22.088
139 HG3 ARG 17 3HG ARG 17 16.505 5.074 -22.987
140 HD2 ARG 17 2HD ARG 17 14.471 4.534 -22.127
141 HD3 ARG 17 3HD ARG 17 14.794 5.325 -20.585
142 HE ARG 17 HE ARG 17 13.780 7.195 -21.401
143 HH11 ARG 17 1HH1 ARG 17 14.769 5.210 -24.084
144 HH12 ARG 17 2HH1 ARG 17 14.017 6.218 -25.276
145 HH21 ARG 17 1HH2 ARG 17 12.786 8.531 -22.960
146 HH22 ARG 17 2HH2 ARG 17 12.891 8.108 -24.635
147 H CYS 18 H CYS 18 18.748 2.628 -19.243
148 HA CYS 18 HA CYS 18 21.414 3.453 -19.776
149 HB2 CYS 18 2HB CYS 18 20.829 3.302 -17.496
150 HB3 CYS 18 3HB CYS 18 20.163 1.685 -17.686
151 HG CYS 18 HG CYS 18 22.260 0.606 -16.685
152 H GLN 19 H GLN 19 19.669 0.422 -20.138
153 HA GLN 19 HA GLN 19 21.982 -1.139 -20.755
154 HB2 GLN 19 2HB GLN 19 19.043 -1.658 -21.232
155 HB3 GLN 19 3HB GLN 19 20.317 -2.838 -21.507
156 HG2 GLN 19 2HG GLN 19 20.407 -1.670 -18.845
157 HG3 GLN 19 3HG GLN 19 18.892 -2.503 -19.188
158 HE21 GLN 19 1HE2 GLN 19 18.853 -4.682 -19.263
159 HE22 GLN 19 2HE2 GLN 19 20.228 -5.690 -18.983
160 H ALA 20 H ALA 20 19.451 0.428 -22.676
161 HA ALA 20 HA ALA 20 20.504 -0.469 -25.182
162 HB1 ALA 20 1HB ALA 20 18.702 0.542 -26.147
163 HB2 ALA 20 2HB ALA 20 18.089 0.363 -24.503
164 HB3 ALA 20 3HB ALA 20 18.736 1.914 -25.038
165 H LEU 21 H LEU 21 20.996 2.294 -23.121
166 HA LEU 21 HA LEU 21 22.389 4.088 -23.237
167 HB2 LEU 21 2HB LEU 21 23.947 2.662 -25.358
168 HB3 LEU 21 3HB LEU 21 24.529 3.737 -24.089
169 HG LEU 21 HG LEU 21 23.410 1.541 -22.758
170 HD11 LEU 21 1HD1 LEU 21 23.571 0.462 -25.067
171 HD12 LEU 21 2HD1 LEU 21 24.314 -0.391 -23.714
172 HD13 LEU 21 3HD1 LEU 21 25.319 0.525 -24.837
173 HD21 LEU 21 3HD2 LEU 21 25.986 1.067 -22.483
174 HD22 LEU 21 1HD2 LEU 21 25.233 2.483 -21.747
175 HD23 LEU 21 2HD2 LEU 21 26.128 2.646 -23.259
176 H GLY 22 H GLY 22 20.144 3.727 -25.231
177 HA2 GLY 22 2HA GLY 22 21.057 5.111 -27.597
178 HA3 GLY 22 3HA GLY 22 19.401 4.655 -27.226
179 H GLY 23 H GLY 23 20.042 6.056 -24.493
180 HA2 GLY 23 2HA GLY 23 18.595 8.373 -24.905
181 HA3 GLY 23 3HA GLY 23 19.717 8.136 -23.573
182 H SER 24 H SER 24 22.022 8.593 -24.030
183 HA SER 24 HA SER 24 22.913 9.995 -26.274
184 HB2 SER 24 2HB SER 24 21.413 11.606 -24.335
185 HB3 SER 24 3HB SER 24 23.021 12.242 -24.683
186 HG SER 24 HG SER 24 21.787 13.092 -26.251
187 H GLU 25 H GLU 25 25.088 10.540 -26.131
188 HA GLU 25 HA GLU 25 26.692 9.111 -24.415
189 HB2 GLU 25 2HB GLU 25 28.489 10.823 -25.036
190 HB3 GLU 25 3HB GLU 25 27.715 9.955 -26.354
191 HG2 GLU 25 2HG GLU 25 27.005 11.838 -27.274
192 HG3 GLU 25 3HG GLU 25 26.285 12.378 -25.759
193 H ALA 26 H ALA 26 25.418 12.367 -24.014
194 HA ALA 26 HA ALA 26 26.871 12.778 -21.539
195 HB1 ALA 26 1HB ALA 26 26.469 14.637 -23.117
196 HB2 ALA 26 2HB ALA 26 24.740 14.502 -22.795
197 HB3 ALA 26 3HB ALA 26 25.845 14.959 -21.499
198 H GLU 27 H GLU 27 23.587 12.046 -22.585
199 HA GLU 27 HA GLU 27 22.177 12.436 -20.249
200 HB2 GLU 27 2HB GLU 27 21.872 10.696 -22.617
201 HB3 GLU 27 3HB GLU 27 20.980 10.192 -21.189
202 HG2 GLU 27 2HG GLU 27 20.799 12.876 -22.538
203 HG3 GLU 27 3HG GLU 27 19.609 11.578 -22.628
204 H CYS 28 H CYS 28 24.330 9.808 -21.110
205 HA CYS 28 HA CYS 28 23.686 7.905 -19.224
206 HB2 CYS 28 2HB CYS 28 26.491 8.659 -20.066
207 HB3 CYS 28 3HB CYS 28 25.974 7.109 -19.416
208 HG CYS 28 HG CYS 28 24.044 7.297 -21.862
209 H ALA 29 H ALA 29 25.781 10.739 -18.841
210 HA ALA 29 HA ALA 29 26.698 10.269 -16.262
211 HB1 ALA 29 1HB ALA 29 27.601 12.039 -17.644
212 HB2 ALA 29 2HB ALA 29 26.068 12.909 -17.576
213 HB3 ALA 29 3HB ALA 29 27.031 12.704 -16.113
214 H ALA 30 H ALA 30 23.857 12.193 -17.242
215 HA ALA 30 HA ALA 30 22.926 12.807 -14.693
216 HB1 ALA 30 1HB ALA 30 21.112 13.685 -15.729
217 HB2 ALA 30 2HB ALA 30 22.135 13.484 -17.152
218 HB3 ALA 30 3HB ALA 30 20.895 12.286 -16.780
219 H PHE 31 H PHE 31 22.512 9.907 -16.625
220 HA PHE 31 HA PHE 31 20.450 8.723 -15.109
221 HB2 PHE 31 2HB PHE 31 22.298 7.900 -17.224
222 HB3 PHE 31 3HB PHE 31 21.892 6.597 -16.113
223 HD1 PHE 31 HD1 PHE 31 19.674 9.392 -17.063
224 HD2 PHE 31 HD2 PHE 31 20.578 5.260 -17.538
225 HE1 PHE 31 HE1 PHE 31 17.538 9.063 -18.238
226 HE2 PHE 31 HE2 PHE 31 18.444 4.925 -18.714
227 HZ PHE 31 HZ PHE 31 16.921 6.827 -19.066
228 H GLU 32 H GLU 32 23.980 8.273 -15.003
229 HA GLU 32 HA GLU 32 24.055 6.421 -12.919
230 HB2 GLU 32 2HB GLU 32 26.006 6.881 -14.286
231 HB3 GLU 32 3HB GLU 32 26.074 8.534 -13.689
232 HG2 GLU 32 2HG GLU 32 26.119 6.725 -11.478
233 HG3 GLU 32 3HG GLU 32 27.351 6.260 -12.650
234 H LYS 33 H LYS 33 24.279 9.966 -12.799
235 HA LYS 33 HA LYS 33 24.601 10.229 -10.037
236 HB2 LYS 33 2HB LYS 33 24.348 11.952 -12.210
237 HB3 LYS 33 3HB LYS 33 22.978 12.352 -11.183
238 HG2 LYS 33 2HG LYS 33 24.434 13.704 -10.158
239 HG3 LYS 33 3HG LYS 33 24.972 12.228 -9.353
240 HD2 LYS 33 2HD LYS 33 26.999 12.766 -10.149
241 HD3 LYS 33 3HD LYS 33 26.390 12.152 -11.688
242 HE2 LYS 33 2HE LYS 33 26.096 15.020 -10.821
243 HE3 LYS 33 3HE LYS 33 27.469 14.432 -11.758
244 HZ1 LYS 33 3HZ LYS 33 24.748 13.887 -12.718
245 HZ2 LYS 33 1HZ LYS 33 26.180 14.079 -13.599
246 HZ3 LYS 33 2HZ LYS 33 25.402 15.431 -12.946
247 H GLU 34 H GLU 34 21.616 10.358 -11.976
248 HA GLU 34 HA GLU 34 19.791 10.780 -9.949
249 HB2 GLU 34 2HB GLU 34 19.711 9.946 -12.681
250 HB3 GLU 34 3HB GLU 34 18.627 8.919 -11.753
251 HG2 GLU 34 2HG GLU 34 17.675 11.075 -10.790
252 HG3 GLU 34 3HG GLU 34 18.548 11.896 -12.082
253 H ILE 35 H ILE 35 21.002 7.667 -11.168
254 HA ILE 35 HA ILE 35 19.519 6.011 -9.471
255 HB ILE 35 HB ILE 35 22.242 5.551 -10.691
256 HG12 ILE 35 2HG1 ILE 35 20.341 5.929 -12.266
257 HG13 ILE 35 3HG1 ILE 35 21.053 4.325 -12.400
258 HG21 ILE 35 1HG2 ILE 35 21.342 3.079 -10.349
259 HG22 ILE 35 2HG2 ILE 35 22.276 3.915 -9.110
260 HG23 ILE 35 3HG2 ILE 35 20.518 3.840 -8.988
261 HD11 ILE 35 3HD1 ILE 35 19.097 3.378 -12.009
262 HD12 ILE 35 1HD1 ILE 35 18.906 4.282 -10.507
263 HD13 ILE 35 2HD1 ILE 35 18.363 4.981 -12.033
264 H ALA 36 H ALA 36 22.730 7.453 -9.045
265 HA ALA 36 HA ALA 36 23.459 6.236 -6.661
266 HB1 ALA 36 1HB ALA 36 24.853 7.754 -8.135
267 HB2 ALA 36 2HB ALA 36 24.081 9.106 -7.306
268 HB3 ALA 36 3HB ALA 36 25.054 7.952 -6.394
269 H ALA 37 H ALA 37 21.672 9.278 -7.133
270 HA ALA 37 HA ALA 37 21.298 9.799 -4.375
271 HB1 ALA 37 1HB ALA 37 20.046 10.834 -6.886
272 HB2 ALA 37 2HB ALA 37 19.385 11.275 -5.311
273 HB3 ALA 37 3HB ALA 37 21.056 11.675 -5.709
274 H PHE 38 H PHE 38 19.495 7.953 -6.743
275 HA PHE 38 HA PHE 38 17.073 7.701 -5.352
276 HB2 PHE 38 2HB PHE 38 18.197 6.683 -7.734
277 HB3 PHE 38 3HB PHE 38 17.678 5.287 -6.795
278 HD1 PHE 38 HD1 PHE 38 16.200 8.690 -7.084
279 HD2 PHE 38 HD2 PHE 38 15.741 4.517 -7.785
280 HE1 PHE 38 HE1 PHE 38 13.879 9.070 -7.809
281 HE2 PHE 38 HE2 PHE 38 13.420 4.890 -8.512
282 HZ PHE 38 HZ PHE 38 12.487 7.169 -8.525
283 H GLU 39 H GLU 39 19.852 5.470 -5.477
284 HA GLU 39 HA GLU 39 18.828 3.679 -3.546
285 HB2 GLU 39 2HB GLU 39 21.126 2.787 -3.454
286 HB3 GLU 39 3HB GLU 39 20.558 2.992 -5.105
287 HG2 GLU 39 2HG GLU 39 21.811 5.110 -5.241
288 HG3 GLU 39 3HG GLU 39 22.433 4.816 -3.618
289 H SER 40 H SER 40 20.928 6.502 -3.324
290 HA SER 40 HA SER 40 21.611 6.171 -0.591
291 HB2 SER 40 2HB SER 40 22.771 8.143 -0.805
292 HB3 SER 40 3HB SER 40 22.603 7.732 -2.512
293 HG SER 40 HG SER 40 21.479 9.786 -1.075
294 H GLU 41 H GLU 41 18.875 7.545 -2.235
295 HA GLU 41 HA GLU 41 17.888 8.944 0.089
296 HB2 GLU 41 2HB GLU 41 16.968 8.541 -2.717
297 HB3 GLU 41 3HB GLU 41 15.766 8.974 -1.510
298 HG2 GLU 41 2HG GLU 41 16.966 10.989 -0.969
299 HG3 GLU 41 3HG GLU 41 18.279 10.536 -2.054
300 H LEU 42 H LEU 42 17.315 5.888 -1.539
301 HA LEU 42 HA LEU 42 15.005 5.207 0.013
302 HB2 LEU 42 2HB LEU 42 16.815 3.595 -1.771
303 HB3 LEU 42 3HB LEU 42 15.409 2.917 -0.953
304 HG LEU 42 HG LEU 42 15.119 5.269 -2.786
305 HD11 LEU 42 1HD1 LEU 42 15.914 2.576 -3.523
306 HD12 LEU 42 2HD1 LEU 42 15.846 4.044 -4.497
307 HD13 LEU 42 3HD1 LEU 42 14.396 3.065 -4.275
308 HD21 LEU 42 3HD2 LEU 42 13.376 3.300 -1.446
309 HD22 LEU 42 1HD2 LEU 42 12.933 3.742 -3.095
310 HD23 LEU 42 2HD2 LEU 42 13.079 4.990 -1.857
311 H GLN 43 H GLN 43 18.451 4.716 0.287
312 HA GLN 43 HA GLN 43 18.305 2.710 2.317
313 HB2 GLN 43 2HB GLN 43 20.647 2.840 2.420
314 HB3 GLN 43 3HB GLN 43 20.265 3.198 0.741
315 HG2 GLN 43 2HG GLN 43 21.599 4.957 0.992
316 HG3 GLN 43 3HG GLN 43 20.257 5.682 1.877
317 HE21 GLN 43 1HE2 GLN 43 22.813 3.305 2.542
318 HE22 GLN 43 2HE2 GLN 43 23.314 4.010 4.038
319 H ALA 44 H ALA 44 18.047 6.132 2.275
320 HA ALA 44 HA ALA 44 18.819 6.557 5.010
321 HB1 ALA 44 1HB ALA 44 18.848 8.238 3.039
322 HB2 ALA 44 2HB ALA 44 17.149 8.483 3.446
323 HB3 ALA 44 3HB ALA 44 18.399 8.804 4.648
324 H TYR 45 H TYR 45 15.960 5.576 3.380
325 HA TYR 45 HA TYR 45 13.925 6.503 4.993
326 HB2 TYR 45 2HB TYR 45 14.303 4.037 3.356
327 HB3 TYR 45 3HB TYR 45 12.916 4.115 4.436
328 HD1 TYR 45 HD1 TYR 45 14.457 6.892 2.505
329 HD2 TYR 45 HD2 TYR 45 11.115 4.296 2.948
330 HE1 TYR 45 HE1 TYR 45 13.227 8.198 0.822
331 HE2 TYR 45 HE2 TYR 45 9.876 5.594 1.266
332 HH TYR 45 HH TYR 45 10.117 7.148 -0.405
333 H LYS 46 H LYS 46 15.531 3.335 5.344
334 HA LYS 46 HA LYS 46 15.938 3.506 8.103
335 HB2 LYS 46 2HB LYS 46 13.258 3.226 7.604
336 HB3 LYS 46 3HB LYS 46 13.760 1.554 7.819
337 HG2 LYS 46 2HG LYS 46 14.281 1.844 10.020
338 HG3 LYS 46 3HG LYS 46 14.663 3.556 9.819
339 HD2 LYS 46 2HD LYS 46 12.633 3.372 11.087
340 HD3 LYS 46 3HD LYS 46 12.234 3.993 9.484
341 HE2 LYS 46 2HE LYS 46 11.006 2.187 8.964
342 HE3 LYS 46 3HE LYS 46 12.165 1.073 9.689
343 HZ1 LYS 46 3HZ LYS 46 10.488 0.808 11.154
344 HZ2 LYS 46 1HZ LYS 46 9.818 2.334 10.862
345 HZ3 LYS 46 2HZ LYS 46 11.167 2.182 11.871
346 H GLY 47 H GLY 47 14.725 1.038 5.819
347 HA2 GLY 47 2HA GLY 47 15.955 -0.719 4.879
348 HA3 GLY 47 3HA GLY 47 17.289 -0.332 5.955
349 H LYS 48 H LYS 48 16.416 -0.565 8.413
350 HA LYS 48 HA LYS 48 16.319 -3.271 8.946
351 HB2 LYS 48 2HB LYS 48 15.710 -0.814 10.503
352 HB3 LYS 48 3HB LYS 48 15.149 -2.342 11.170
353 HG2 LYS 48 2HG LYS 48 17.356 -3.202 11.285
354 HG3 LYS 48 3HG LYS 48 17.996 -1.862 10.331
355 HD2 LYS 48 2HD LYS 48 18.171 -0.536 12.126
356 HD3 LYS 48 3HD LYS 48 16.567 -0.981 12.714
357 HE2 LYS 48 2HE LYS 48 17.380 -2.833 13.878
358 HE3 LYS 48 3HE LYS 48 18.883 -2.870 12.957
359 HZ1 LYS 48 3HZ LYS 48 19.171 -0.524 14.062
360 HZ2 LYS 48 1HZ LYS 48 19.608 -1.937 14.884
361 HZ3 LYS 48 2HZ LYS 48 18.134 -1.180 15.226
362 H GLY 49 H GLY 49 13.551 -1.169 9.719
363 HA2 GLY 49 2HA GLY 49 11.723 -3.367 9.565
364 HA3 GLY 49 3HA GLY 49 11.304 -1.680 9.820
365 H ASN 50 H ASN 50 12.989 -1.198 7.253
366 HA ASN 50 HA ASN 50 10.799 -1.847 5.393
367 HB2 ASN 50 2HB ASN 50 12.722 0.489 5.349
368 HB3 ASN 50 3HB ASN 50 11.518 0.153 4.108
369 HD21 ASN 50 1HD2 ASN 50 11.143 2.487 4.947
370 HD22 ASN 50 2HD2 ASN 50 9.917 2.635 6.155
371 HA PRO 51 HA PRO 51 14.557 -4.160 3.954
372 HB2 PRO 51 2HB PRO 51 13.215 -6.454 3.398
373 HB3 PRO 51 3HB PRO 51 13.859 -6.083 5.001
374 HG2 PRO 51 2HG PRO 51 11.065 -5.788 3.967
375 HG3 PRO 51 3HG PRO 51 11.619 -6.415 5.531
376 HD2 PRO 51 2HD PRO 51 10.669 -3.898 5.224
377 HD3 PRO 51 3HD PRO 51 11.926 -4.306 6.409
378 H GLU 52 H GLU 52 11.479 -3.312 2.672
379 HA GLU 52 HA GLU 52 11.539 -4.378 0.117
380 HB2 GLU 52 2HB GLU 52 10.042 -2.596 -0.533
381 HB3 GLU 52 3HB GLU 52 9.633 -3.127 1.093
382 HG2 GLU 52 2HG GLU 52 11.078 -1.187 1.902
383 HG3 GLU 52 3HG GLU 52 11.004 -0.603 0.241
384 H VAL 53 H VAL 53 13.247 -1.607 1.426
385 HA VAL 53 HA VAL 53 14.112 -0.421 -0.950
386 HB VAL 53 HB VAL 53 15.568 -0.562 1.694
387 HG11 VAL 53 1HG1 VAL 53 17.193 0.167 0.216
388 HG12 VAL 53 2HG1 VAL 53 16.031 1.020 -0.802
389 HG13 VAL 53 3HG1 VAL 53 16.481 1.683 0.770
390 HG21 VAL 53 3HG2 VAL 53 13.896 0.708 2.441
391 HG22 VAL 53 1HG2 VAL 53 14.465 1.967 1.344
392 HG23 VAL 53 2HG2 VAL 53 13.199 0.853 0.828
393 H GLU 54 H GLU 54 15.047 -3.376 0.537
394 HA GLU 54 HA GLU 54 17.654 -3.744 -0.257
395 HB2 GLU 54 2HB GLU 54 15.355 -5.682 -0.086
396 HB3 GLU 54 3HB GLU 54 16.980 -6.205 -0.507
397 HG2 GLU 54 2HG GLU 54 16.580 -4.586 1.957
398 HG3 GLU 54 3HG GLU 54 16.133 -6.291 1.965
399 H ALA 55 H ALA 55 14.769 -4.680 -2.137
400 HA ALA 55 HA ALA 55 16.021 -5.530 -4.442
401 HB1 ALA 55 1HB ALA 55 13.400 -5.049 -3.647
402 HB2 ALA 55 2HB ALA 55 13.625 -4.049 -5.083
403 HB3 ALA 55 3HB ALA 55 13.932 -5.785 -5.159
404 H LEU 56 H LEU 56 14.880 -2.235 -3.709
405 HA LEU 56 HA LEU 56 15.679 -1.013 -6.076
406 HB2 LEU 56 2HB LEU 56 15.734 0.250 -3.343
407 HB3 LEU 56 3HB LEU 56 15.566 1.073 -4.892
408 HG LEU 56 HG LEU 56 13.498 -0.904 -4.016
409 HD11 LEU 56 1HD1 LEU 56 14.182 1.432 -2.559
410 HD12 LEU 56 2HD1 LEU 56 12.827 0.333 -2.307
411 HD13 LEU 56 3HD1 LEU 56 12.647 1.723 -3.377
412 HD21 LEU 56 3HD2 LEU 56 13.154 1.657 -5.543
413 HD22 LEU 56 1HD2 LEU 56 12.102 0.242 -5.502
414 HD23 LEU 56 2HD2 LEU 56 13.654 0.162 -6.336
415 H ARG 57 H ARG 57 17.498 -1.596 -3.099
416 HA ARG 57 HA ARG 57 19.809 -0.158 -3.773
417 HB2 ARG 57 2HB ARG 57 19.139 -2.329 -1.858
418 HB3 ARG 57 3HB ARG 57 20.842 -2.079 -2.219
419 HG2 ARG 57 2HG ARG 57 20.651 0.256 -1.537
420 HG3 ARG 57 3HG ARG 57 18.939 0.013 -1.185
421 HD2 ARG 57 2HD ARG 57 20.299 -0.087 0.847
422 HD3 ARG 57 3HD ARG 57 19.505 -1.627 0.521
423 HE ARG 57 HE ARG 57 22.112 -1.580 -0.593
424 HH11 ARG 57 1HH1 ARG 57 20.410 -1.881 2.429
425 HH12 ARG 57 2HH1 ARG 57 21.658 -2.812 3.189
426 HH21 ARG 57 1HH2 ARG 57 23.762 -2.805 0.397
427 HH22 ARG 57 2HH2 ARG 57 23.565 -3.336 2.033
428 H LYS 58 H LYS 58 18.953 -3.558 -4.312
429 HA LYS 58 HA LYS 58 21.382 -4.358 -5.468
430 HB2 LYS 58 2HB LYS 58 19.549 -5.874 -4.662
431 HB3 LYS 58 3HB LYS 58 18.641 -5.456 -6.109
432 HG2 LYS 58 2HG LYS 58 19.969 -6.696 -7.472
433 HG3 LYS 58 3HG LYS 58 21.404 -6.466 -6.471
434 HD2 LYS 58 2HD LYS 58 19.112 -8.068 -5.418
435 HD3 LYS 58 3HD LYS 58 20.228 -8.799 -6.574
436 HE2 LYS 58 2HE LYS 58 22.083 -7.970 -5.013
437 HE3 LYS 58 3HE LYS 58 20.800 -7.726 -3.828
438 HZ1 LYS 58 3HZ LYS 58 21.581 -10.284 -5.112
439 HZ2 LYS 58 1HZ LYS 58 20.206 -10.098 -4.144
440 HZ3 LYS 58 2HZ LYS 58 21.745 -9.868 -3.481
441 H GLU 59 H GLU 59 18.315 -3.530 -7.096
442 HA GLU 59 HA GLU 59 19.243 -3.612 -9.706
443 HB2 GLU 59 2HB GLU 59 16.999 -2.218 -8.331
444 HB3 GLU 59 3HB GLU 59 17.395 -1.711 -9.967
445 HG2 GLU 59 2HG GLU 59 17.326 -4.339 -10.370
446 HG3 GLU 59 3HG GLU 59 16.229 -4.247 -8.993
447 H ALA 60 H ALA 60 19.010 -0.769 -7.570
448 HA ALA 60 HA ALA 60 20.040 1.152 -9.256
449 HB1 ALA 60 1HB ALA 60 20.891 2.239 -7.112
450 HB2 ALA 60 2HB ALA 60 19.165 1.888 -7.209
451 HB3 ALA 60 3HB ALA 60 20.228 0.835 -6.276
452 H ALA 61 H ALA 61 21.872 -0.891 -6.981
453 HA ALA 61 HA ALA 61 24.419 0.049 -7.550
454 HB1 ALA 61 1HB ALA 61 23.672 -1.591 -5.740
455 HB2 ALA 61 2HB ALA 61 23.873 -2.844 -6.966
456 HB3 ALA 61 3HB ALA 61 25.252 -1.858 -6.479
457 H ALA 62 H ALA 62 22.594 -2.550 -9.135
458 HA ALA 62 HA ALA 62 24.585 -3.414 -10.894
459 HB1 ALA 62 1HB ALA 62 22.994 -4.879 -11.379
460 HB2 ALA 62 2HB ALA 62 21.823 -3.915 -10.478
461 HB3 ALA 62 3HB ALA 62 22.073 -3.618 -12.199
462 H ILE 63 H ILE 63 22.083 -0.928 -11.320
463 HA ILE 63 HA ILE 63 22.682 -0.264 -13.976
464 HB ILE 63 HB ILE 63 21.577 1.534 -11.815
465 HG12 ILE 63 2HG1 ILE 63 19.778 0.433 -13.863
466 HG13 ILE 63 3HG1 ILE 63 20.468 -0.777 -12.786
467 HG21 ILE 63 1HG2 ILE 63 20.625 2.813 -13.701
468 HG22 ILE 63 2HG2 ILE 63 22.388 2.832 -13.682
469 HG23 ILE 63 3HG2 ILE 63 21.530 1.792 -14.819
470 HD11 ILE 63 3HD1 ILE 63 19.605 1.390 -11.192
471 HD12 ILE 63 1HD1 ILE 63 18.308 0.997 -12.319
472 HD13 ILE 63 2HD1 ILE 63 18.964 -0.252 -11.260
473 H ARG 64 H ARG 64 23.920 1.045 -10.924
474 HA ARG 64 HA ARG 64 25.474 3.112 -11.995
475 HB2 ARG 64 2HB ARG 64 25.013 3.011 -9.626
476 HB3 ARG 64 3HB ARG 64 25.856 1.474 -9.486
477 HG2 ARG 64 2HG ARG 64 27.184 3.338 -8.626
478 HG3 ARG 64 3HG ARG 64 27.964 2.549 -9.998
479 HD2 ARG 64 2HD ARG 64 27.232 4.310 -11.479
480 HD3 ARG 64 3HD ARG 64 26.311 5.064 -10.178
481 HE ARG 64 HE ARG 64 29.088 5.370 -10.696
482 HH11 ARG 64 1HH1 ARG 64 26.751 5.189 -8.122
483 HH12 ARG 64 2HH1 ARG 64 27.698 6.131 -7.019
484 HH21 ARG 64 1HH2 ARG 64 30.345 6.612 -9.253
485 HH22 ARG 64 2HH2 ARG 64 29.742 6.941 -7.664
486 H ASP 65 H ASP 65 26.325 -0.254 -11.249
487 HA ASP 65 HA ASP 65 29.032 -0.110 -11.954
488 HB2 ASP 65 2HB ASP 65 27.131 -2.460 -12.094
489 HB3 ASP 65 3HB ASP 65 28.884 -2.577 -12.218
490 H GLU 66 H GLU 66 26.175 -0.908 -13.895
491 HA GLU 66 HA GLU 66 27.527 -1.562 -16.267
492 HB2 GLU 66 2HB GLU 66 24.776 -0.340 -15.991
493 HB3 GLU 66 3HB GLU 66 25.389 -1.219 -17.385
494 HG2 GLU 66 2HG GLU 66 25.056 -3.230 -16.438
495 HG3 GLU 66 3HG GLU 66 25.488 -2.664 -14.825
496 H CYS 67 H CYS 67 26.199 1.520 -15.118
497 HA CYS 67 HA CYS 67 26.760 3.044 -17.395
498 HB2 CYS 67 2HB CYS 67 26.573 3.834 -14.485
499 HB3 CYS 67 3HB CYS 67 26.723 4.997 -15.797
500 HG CYS 67 HG CYS 67 24.019 4.285 -14.567
501 H GLN 68 H GLN 68 28.733 2.318 -14.553
502 HA GLN 68 HA GLN 68 30.893 4.013 -15.215
503 HB2 GLN 68 2HB GLN 68 30.872 1.485 -13.556
504 HB3 GLN 68 3HB GLN 68 32.179 2.661 -13.599
505 HG2 GLN 68 2HG GLN 68 29.511 3.722 -12.944
506 HG3 GLN 68 3HG GLN 68 30.238 2.648 -11.750
507 HE21 GLN 68 1HE2 GLN 68 30.177 5.771 -13.059
508 HE22 GLN 68 2HE2 GLN 68 31.492 6.437 -12.159
509 H ALA 69 H ALA 69 30.185 0.635 -15.958
510 HA ALA 69 HA ALA 69 32.683 0.059 -17.175
511 HB1 ALA 69 1HB ALA 69 30.085 -1.278 -16.886
512 HB2 ALA 69 2HB ALA 69 30.996 -1.720 -18.330
513 HB3 ALA 69 3HB ALA 69 31.720 -1.922 -16.735
514 H TYR 70 H TYR 70 29.575 1.189 -18.420
515 HA TYR 70 HA TYR 70 30.155 0.987 -21.156
516 HB2 TYR 70 2HB TYR 70 28.336 2.924 -19.710
517 HB3 TYR 70 3HB TYR 70 28.347 2.667 -21.451
518 HD1 TYR 70 HD1 TYR 70 28.756 -0.369 -21.326
519 HD2 TYR 70 HD2 TYR 70 26.089 2.253 -19.297
520 HE1 TYR 70 HE1 TYR 70 27.150 -2.213 -21.065
521 HE2 TYR 70 HE2 TYR 70 24.476 0.415 -19.029
522 HH TYR 70 HH TYR 70 24.151 -1.984 -20.574
523 H ARG 71 H ARG 71 31.383 3.089 -18.778
524 HA ARG 71 HA ARG 71 32.014 5.274 -20.542
525 HB2 ARG 71 2HB ARG 71 31.721 5.150 -17.882
526 HB3 ARG 71 3HB ARG 71 33.464 4.939 -17.972
527 HG2 ARG 71 2HG ARG 71 33.327 7.208 -17.784
528 HG3 ARG 71 3HG ARG 71 33.321 7.035 -19.540
529 HD2 ARG 71 2HD ARG 71 31.228 7.813 -19.722
530 HD3 ARG 71 3HD ARG 71 30.664 6.873 -18.341
531 HE ARG 71 HE ARG 71 31.426 9.618 -18.344
532 HH11 ARG 71 1HH1 ARG 71 31.379 6.732 -16.398
533 HH12 ARG 71 2HH1 ARG 71 31.347 7.590 -14.893
534 HH21 ARG 71 1HH2 ARG 71 31.384 10.760 -16.370
535 HH22 ARG 71 2HH2 ARG 71 31.349 9.881 -14.878
536 H HIS 72 H HIS 72 32.965 2.612 -21.301
537 HA HIS 72 HA HIS 72 34.797 1.689 -22.288
538 HB2 HIS 72 2HB HIS 72 35.074 4.098 -23.078
539 HB3 HIS 72 3HB HIS 72 36.247 4.285 -21.778
540 HD1 HIS 72 HD1 HIS 72 35.778 1.550 -24.392
541 HD2 HIS 72 HD2 HIS 72 38.689 4.116 -22.907
542 HE1 HIS 72 HE1 HIS 72 37.883 0.975 -25.643
543 H ASN 73 H ASN 73 34.375 1.694 -19.339
544 HA ASN 73 HA ASN 73 36.817 1.868 -17.970
545 HB2 ASN 73 2HB ASN 73 34.217 1.336 -17.265
546 HB3 ASN 73 3HB ASN 73 34.995 -0.221 -17.001
547 HD21 ASN 73 1HD2 ASN 73 35.397 3.228 -16.323
548 HD22 ASN 73 2HD2 ASN 73 36.097 3.016 -14.758