NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
25552 |
2k9s   |
16001 | cing | 1-original | 3 | 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 2.080 1.003 -1.639
3 HB2 MET 1 1HB MET 1 3.751 -0.285 0.077
4 HB3 MET 1 2HB MET 1 3.663 -1.453 -1.235
5 HG2 MET 1 1HG MET 1 4.646 -0.026 -2.754
6 HG3 MET 1 2HG MET 1 4.207 1.415 -1.840
7 HE1 MET 1 3HE MET 1 7.542 2.329 -0.641
8 HE2 MET 1 1HE MET 1 6.263 2.636 -1.816
9 HE3 MET 1 2HE MET 1 5.884 2.585 -0.095
10 H ASP 2 H ASP 2 1.078 0.593 -3.486
11 HA ASP 2 HA ASP 2 -0.235 -1.923 -3.963
12 HB2 ASP 2 1HB ASP 2 -0.837 0.571 -4.728
13 HB3 ASP 2 2HB ASP 2 0.066 0.067 -6.153
14 H ASN 3 H ASN 3 0.203 -3.394 -5.628
15 HA ASN 3 HA ASN 3 2.852 -4.089 -6.034
16 HB2 ASN 3 1HB ASN 3 0.286 -4.821 -7.385
17 HB3 ASN 3 2HB ASN 3 1.804 -5.341 -8.112
18 HD21 ASN 3 2HD2 ASN 3 -0.592 -6.364 -6.237
19 HD22 ASN 3 1HD2 ASN 3 0.242 -7.496 -5.232
20 H ARG 4 H ARG 4 0.681 -2.274 -8.176
21 HA ARG 4 HA ARG 4 2.425 -1.993 -10.342
22 HB2 ARG 4 1HB ARG 4 0.203 -0.202 -9.355
23 HB3 ARG 4 2HB ARG 4 1.043 0.045 -10.880
24 HG2 ARG 4 1HG ARG 4 0.352 -2.414 -11.356
25 HG3 ARG 4 2HG ARG 4 -0.842 -2.126 -10.089
26 HD2 ARG 4 1HD ARG 4 -0.536 -0.167 -12.325
27 HD3 ARG 4 2HD ARG 4 -1.441 -1.658 -12.584
28 HE ARG 4 HE ARG 4 -2.298 -0.307 -10.230
29 HH11 ARG 4 2HH1 ARG 4 -2.545 -0.287 -13.703
30 HH12 ARG 4 1HH1 ARG 4 -4.097 0.484 -13.718
31 HH21 ARG 4 2HH2 ARG 4 -4.340 0.708 -10.237
32 HH22 ARG 4 1HH2 ARG 4 -5.117 1.050 -11.746
33 H VAL 5 H VAL 5 1.987 0.016 -7.460
34 HA VAL 5 HA VAL 5 3.816 2.042 -8.240
35 HB VAL 5 HB VAL 5 2.956 1.285 -5.444
36 HG11 VAL 5 1HG1 VAL 5 4.921 3.058 -6.265
37 HG12 VAL 5 2HG1 VAL 5 3.516 4.081 -5.958
38 HG13 VAL 5 3HG1 VAL 5 4.131 3.020 -4.689
39 HG21 VAL 5 3HG2 VAL 5 1.309 3.137 -5.738
40 HG22 VAL 5 1HG2 VAL 5 1.732 3.172 -7.449
41 HG23 VAL 5 2HG2 VAL 5 0.999 1.728 -6.751
42 H ARG 6 H ARG 6 4.125 -0.929 -6.362
43 HA ARG 6 HA ARG 6 6.730 -0.515 -5.400
44 HB2 ARG 6 1HB ARG 6 4.852 -2.742 -5.601
45 HB3 ARG 6 2HB ARG 6 6.529 -3.250 -5.751
46 HG2 ARG 6 1HG ARG 6 6.858 -3.035 -3.571
47 HG3 ARG 6 2HG ARG 6 6.228 -1.386 -3.581
48 HD2 ARG 6 1HD ARG 6 4.079 -2.064 -3.088
49 HD3 ARG 6 2HD ARG 6 4.331 -3.684 -3.735
50 HE ARG 6 HE ARG 6 5.924 -3.143 -1.416
51 HH11 ARG 6 2HH1 ARG 6 2.786 -4.154 -2.534
52 HH12 ARG 6 1HH1 ARG 6 2.405 -5.022 -1.083
53 HH21 ARG 6 2HH2 ARG 6 5.434 -4.282 0.498
54 HH22 ARG 6 1HH2 ARG 6 3.912 -5.094 0.641
55 H GLU 7 H GLU 7 5.526 -1.747 -8.458
56 HA GLU 7 HA GLU 7 7.922 -2.833 -9.442
57 HB2 GLU 7 1HB GLU 7 5.452 -2.906 -10.357
58 HB3 GLU 7 2HB GLU 7 5.976 -1.506 -11.283
59 HG2 GLU 7 1HG GLU 7 6.512 -3.106 -12.778
60 HG3 GLU 7 2HG GLU 7 8.005 -3.131 -11.841
61 H ALA 8 H ALA 8 6.673 0.444 -9.401
62 HA ALA 8 HA ALA 8 8.405 1.631 -11.243
63 HB1 ALA 8 1HB ALA 8 6.438 2.756 -10.320
64 HB2 ALA 8 2HB ALA 8 7.235 2.861 -8.750
65 HB3 ALA 8 3HB ALA 8 7.893 3.736 -10.133
66 H CYS 9 H CYS 9 8.854 0.820 -7.850
67 HA CYS 9 HA CYS 9 11.198 2.265 -7.361
68 HB2 CYS 9 1HB CYS 9 9.988 1.274 -5.531
69 HB3 CYS 9 2HB CYS 9 10.211 -0.341 -6.194
70 HG CYS 9 HG CYS 9 12.906 -0.499 -5.666
71 H GLN 10 H GLN 10 10.671 -0.824 -8.929
72 HA GLN 10 HA GLN 10 13.305 -1.778 -8.921
73 HB2 GLN 10 1HB GLN 10 11.203 -2.211 -11.049
74 HB3 GLN 10 2HB GLN 10 12.619 -3.214 -10.765
75 HG2 GLN 10 1HG GLN 10 10.517 -2.791 -8.668
76 HG3 GLN 10 2HG GLN 10 10.394 -4.059 -9.887
77 HE21 GLN 10 2HE2 GLN 10 10.640 -4.266 -6.988
78 HE22 GLN 10 1HE2 GLN 10 12.052 -5.217 -6.695
79 H TYR 11 H TYR 11 11.595 0.291 -11.232
80 HA TYR 11 HA TYR 11 13.750 0.473 -13.073
81 HB2 TYR 11 1HB TYR 11 11.557 0.948 -13.885
82 HB3 TYR 11 2HB TYR 11 11.285 2.162 -12.640
83 HD1 TYR 11 HD1 TYR 11 13.898 1.521 -15.246
84 HD2 TYR 11 HD2 TYR 11 11.247 4.316 -13.439
85 HE1 TYR 11 HE1 TYR 11 14.701 3.266 -16.782
86 HE2 TYR 11 HE2 TYR 11 12.042 6.068 -14.971
87 HH TYR 11 HH TYR 11 14.601 5.412 -17.344
88 H ILE 12 H ILE 12 12.552 2.660 -10.538
89 HA ILE 12 HA ILE 12 14.452 4.690 -10.911
90 HB ILE 12 HB ILE 12 13.034 3.903 -8.363
91 HG12 ILE 12 1HG1 ILE 12 12.163 6.284 -9.851
92 HG13 ILE 12 2HG1 ILE 12 11.905 4.767 -10.706
93 HG21 ILE 12 1HG2 ILE 12 14.817 6.163 -9.081
94 HG22 ILE 12 2HG2 ILE 12 13.426 6.505 -8.054
95 HG23 ILE 12 3HG2 ILE 12 14.624 5.315 -7.547
96 HD11 ILE 12 3HD1 ILE 12 9.947 4.883 -9.583
97 HD12 ILE 12 1HD1 ILE 12 10.907 4.060 -8.354
98 HD13 ILE 12 2HD1 ILE 12 10.638 5.800 -8.245
99 H SER 13 H SER 13 14.543 1.720 -9.031
100 HA SER 13 HA SER 13 16.797 2.217 -7.472
101 HB2 SER 13 1HB SER 13 15.495 0.279 -6.989
102 HB3 SER 13 2HB SER 13 15.698 -0.350 -8.624
103 HG SER 13 HG SER 13 17.367 -1.354 -7.860
104 H ASP 14 H ASP 14 16.550 0.896 -10.750
105 HA ASP 14 HA ASP 14 19.324 0.421 -11.081
106 HB2 ASP 14 1HB ASP 14 17.227 -0.397 -12.466
107 HB3 ASP 14 2HB ASP 14 17.574 1.039 -13.424
108 H HIS 15 H HIS 15 17.261 3.200 -11.648
109 HA HIS 15 HA HIS 15 19.487 4.694 -12.815
110 HB2 HIS 15 1HB HIS 15 16.534 5.231 -12.567
111 HB3 HIS 15 2HB HIS 15 17.665 6.500 -13.028
112 HD1 HIS 15 HD1 HIS 15 17.619 6.810 -15.469
113 HD2 HIS 15 HD2 HIS 15 17.176 2.813 -14.425
114 HE1 HIS 15 HE1 HIS 15 17.452 5.561 -17.645
115 H LEU 16 H LEU 16 19.075 3.875 -9.887
116 HA LEU 16 HA LEU 16 18.595 6.179 -8.354
117 HB2 LEU 16 1HB LEU 16 18.723 3.742 -7.607
118 HB3 LEU 16 2HB LEU 16 20.470 3.970 -7.560
119 HG LEU 16 HG LEU 16 20.065 5.846 -5.922
120 HD11 LEU 16 1HD1 LEU 16 17.922 6.533 -5.898
121 HD12 LEU 16 2HD1 LEU 16 17.730 5.233 -4.723
122 HD13 LEU 16 3HD1 LEU 16 17.299 4.965 -6.412
123 HD21 LEU 16 3HD2 LEU 16 20.840 3.621 -5.246
124 HD22 LEU 16 1HD2 LEU 16 19.166 3.084 -5.107
125 HD23 LEU 16 2HD2 LEU 16 19.781 4.340 -4.033
126 H ALA 17 H ALA 17 21.380 5.110 -10.118
127 HA ALA 17 HA ALA 17 23.116 7.068 -8.824
128 HB1 ALA 17 1HB ALA 17 23.622 4.897 -10.841
129 HB2 ALA 17 2HB ALA 17 24.845 6.088 -10.396
130 HB3 ALA 17 3HB ALA 17 24.190 4.998 -9.174
131 H ASP 18 H ASP 18 21.169 6.704 -11.628
132 HA ASP 18 HA ASP 18 22.495 8.422 -13.412
133 HB2 ASP 18 1HB ASP 18 20.395 6.836 -13.702
134 HB3 ASP 18 2HB ASP 18 19.511 8.323 -13.370
135 H SER 19 H SER 19 22.235 10.606 -13.880
136 HA SER 19 HA SER 19 21.487 12.234 -11.591
137 HB2 SER 19 1HB SER 19 22.499 13.373 -14.174
138 HB3 SER 19 2HB SER 19 22.769 13.936 -12.525
139 HG SER 19 HG SER 19 24.147 12.066 -14.001
140 H ASN 20 H ASN 20 20.696 12.061 -15.057
141 HA ASN 20 HA ASN 20 18.512 13.923 -14.759
142 HB2 ASN 20 1HB ASN 20 19.109 12.199 -17.165
143 HB3 ASN 20 2HB ASN 20 18.218 13.718 -17.119
144 HD21 ASN 20 2HD2 ASN 20 19.298 15.607 -17.245
145 HD22 ASN 20 1HD2 ASN 20 21.012 15.735 -17.426
146 H PHE 21 H PHE 21 16.820 13.184 -13.618
147 HA PHE 21 HA PHE 21 15.808 10.487 -14.187
148 HB2 PHE 21 1HB PHE 21 16.308 11.019 -11.822
149 HB3 PHE 21 2HB PHE 21 15.136 12.332 -11.886
150 HD1 PHE 21 HD2 PHE 21 14.929 8.872 -13.235
151 HD2 PHE 21 HD1 PHE 21 13.430 11.722 -10.451
152 HE1 PHE 21 HE2 PHE 21 13.144 7.304 -12.596
153 HE2 PHE 21 HE1 PHE 21 11.643 10.158 -9.807
154 HZ PHE 21 HZ PHE 21 11.498 7.946 -10.881
155 H ASP 22 H ASP 22 13.984 10.218 -15.293
156 HA ASP 22 HA ASP 22 12.246 12.564 -15.698
157 HB2 ASP 22 1HB ASP 22 13.457 11.774 -17.737
158 HB3 ASP 22 2HB ASP 22 12.624 10.230 -17.584
159 H ILE 23 H ILE 23 10.474 12.369 -14.501
160 HA ILE 23 HA ILE 23 9.490 10.024 -13.365
161 HB ILE 23 HB ILE 23 8.896 12.345 -12.649
162 HG12 ILE 23 1HG1 ILE 23 6.577 10.479 -13.195
163 HG13 ILE 23 2HG1 ILE 23 7.666 10.392 -11.815
164 HG21 ILE 23 1HG2 ILE 23 7.195 13.580 -13.764
165 HG22 ILE 23 2HG2 ILE 23 8.400 13.141 -14.974
166 HG23 ILE 23 3HG2 ILE 23 6.879 12.253 -14.881
167 HD11 ILE 23 3HD1 ILE 23 5.921 11.484 -10.863
168 HD12 ILE 23 1HD1 ILE 23 6.834 12.870 -11.459
169 HD13 ILE 23 2HD1 ILE 23 5.446 12.271 -12.368
170 H ALA 24 H ALA 24 9.083 11.306 -16.546
171 HA ALA 24 HA ALA 24 6.680 10.107 -17.316
172 HB1 ALA 24 1HB ALA 24 7.274 11.454 -19.003
173 HB2 ALA 24 2HB ALA 24 8.997 11.275 -18.669
174 HB3 ALA 24 3HB ALA 24 8.149 10.049 -19.611
175 H SER 25 H SER 25 10.000 8.858 -17.430
176 HA SER 25 HA SER 25 9.381 6.410 -18.680
177 HB2 SER 25 1HB SER 25 11.676 7.187 -16.869
178 HB3 SER 25 2HB SER 25 11.587 5.656 -17.741
179 HG SER 25 HG SER 25 12.642 6.882 -19.148
180 H VAL 26 H VAL 26 9.193 7.482 -15.372
181 HA VAL 26 HA VAL 26 9.084 4.962 -14.109
182 HB VAL 26 HB VAL 26 7.797 7.546 -13.216
183 HG11 VAL 26 1HG1 VAL 26 8.606 5.126 -11.607
184 HG12 VAL 26 2HG1 VAL 26 7.855 6.598 -10.989
185 HG13 VAL 26 3HG1 VAL 26 6.953 5.533 -12.068
186 HG21 VAL 26 3HG2 VAL 26 10.497 6.431 -12.470
187 HG22 VAL 26 1HG2 VAL 26 10.241 7.699 -13.669
188 HG23 VAL 26 2HG2 VAL 26 9.810 7.980 -11.982
189 H ALA 27 H ALA 27 6.511 7.134 -15.252
190 HA ALA 27 HA ALA 27 4.371 5.442 -14.488
191 HB1 ALA 27 1HB ALA 27 4.637 8.015 -15.538
192 HB2 ALA 27 2HB ALA 27 3.702 7.115 -16.734
193 HB3 ALA 27 3HB ALA 27 3.145 7.203 -15.063
194 H GLN 28 H GLN 28 6.192 5.834 -17.490
195 HA GLN 28 HA GLN 28 4.590 4.189 -19.112
196 HB2 GLN 28 1HB GLN 28 6.231 5.688 -20.079
197 HB3 GLN 28 2HB GLN 28 7.539 4.827 -19.280
198 HG2 GLN 28 1HG GLN 28 7.250 2.924 -20.653
199 HG3 GLN 28 2HG GLN 28 5.720 3.529 -21.285
200 HE21 GLN 28 2HE2 GLN 28 6.174 6.000 -22.060
201 HE22 GLN 28 1HE2 GLN 28 7.423 6.087 -23.251
202 H HIS 29 H HIS 29 7.261 3.471 -16.936
203 HA HIS 29 HA HIS 29 7.762 0.831 -17.686
204 HB2 HIS 29 1HB HIS 29 9.290 1.893 -16.201
205 HB3 HIS 29 2HB HIS 29 8.021 2.239 -15.030
206 HD1 HIS 29 HD1 HIS 29 8.620 -1.136 -16.619
207 HD2 HIS 29 HD2 HIS 29 8.999 0.756 -12.940
208 HE1 HIS 29 HE1 HIS 29 9.188 -2.958 -14.981
209 H VAL 30 H VAL 30 5.270 2.198 -15.626
210 HA VAL 30 HA VAL 30 4.261 -0.471 -14.977
211 HB VAL 30 HB VAL 30 2.721 0.664 -13.451
212 HG11 VAL 30 1HG1 VAL 30 4.632 0.116 -12.305
213 HG12 VAL 30 2HG1 VAL 30 5.654 1.168 -13.286
214 HG13 VAL 30 3HG1 VAL 30 4.595 1.861 -12.057
215 HG21 VAL 30 3HG2 VAL 30 2.736 3.035 -13.122
216 HG22 VAL 30 1HG2 VAL 30 4.071 3.235 -14.257
217 HG23 VAL 30 2HG2 VAL 30 2.486 2.728 -14.840
218 H CYS 31 H CYS 31 4.072 1.098 -17.633
219 HA CYS 31 HA CYS 31 2.564 1.439 -19.306
220 HB2 CYS 31 1HB CYS 31 1.087 -0.781 -17.875
221 HB3 CYS 31 2HB CYS 31 0.838 -0.286 -19.545
222 HG CYS 31 HG CYS 31 3.555 -1.878 -18.229
223 H LEU 32 H LEU 32 2.265 3.153 -17.066
224 HA LEU 32 HA LEU 32 -0.573 3.821 -17.363
225 HB2 LEU 32 1HB LEU 32 0.089 2.607 -15.146
226 HB3 LEU 32 2HB LEU 32 0.741 4.184 -14.706
227 HG LEU 32 HG LEU 32 -1.502 5.165 -15.014
228 HD11 LEU 32 1HD1 LEU 32 -2.524 3.754 -16.600
229 HD12 LEU 32 2HD1 LEU 32 -3.417 3.513 -15.099
230 HD13 LEU 32 3HD1 LEU 32 -2.234 2.314 -15.623
231 HD21 LEU 32 3HD2 LEU 32 -1.703 2.823 -13.147
232 HD22 LEU 32 1HD2 LEU 32 -2.358 4.449 -12.956
233 HD23 LEU 32 2HD2 LEU 32 -0.619 4.179 -12.829
234 H SER 33 H SER 33 -1.038 6.081 -16.678
235 HA SER 33 HA SER 33 0.890 7.848 -17.832
236 HB2 SER 33 1HB SER 33 -1.864 8.107 -16.725
237 HB3 SER 33 2HB SER 33 -0.884 9.570 -16.825
238 HG SER 33 HG SER 33 -2.268 8.646 -18.738
239 HA PRO 34 HA PRO 34 3.099 9.278 -14.324
240 HB2 PRO 34 1HB PRO 34 3.349 11.932 -14.837
241 HB3 PRO 34 2HB PRO 34 4.232 10.693 -15.735
242 HG2 PRO 34 1HG PRO 34 1.732 12.157 -16.488
243 HG3 PRO 34 2HG PRO 34 3.143 11.765 -17.488
244 HD2 PRO 34 1HD PRO 34 0.847 10.333 -17.582
245 HD3 PRO 34 2HD PRO 34 2.442 9.599 -17.850
246 H SER 35 H SER 35 0.282 11.275 -15.154
247 HA SER 35 HA SER 35 0.047 12.509 -12.615
248 HB2 SER 35 1HB SER 35 -1.744 12.214 -14.999
249 HB3 SER 35 2HB SER 35 -2.417 12.824 -13.487
250 HG SER 35 HG SER 35 -1.680 14.551 -14.713
251 H ARG 36 H ARG 36 -1.594 9.724 -14.088
252 HA ARG 36 HA ARG 36 -3.261 9.157 -11.882
253 HB2 ARG 36 1HB ARG 36 -3.459 8.304 -14.289
254 HB3 ARG 36 2HB ARG 36 -2.255 7.104 -13.843
255 HG2 ARG 36 1HG ARG 36 -4.341 6.050 -13.606
256 HG3 ARG 36 2HG ARG 36 -3.806 6.429 -11.968
257 HD2 ARG 36 1HD ARG 36 -6.184 6.946 -12.315
258 HD3 ARG 36 2HD ARG 36 -5.240 8.381 -11.919
259 HE ARG 36 HE ARG 36 -5.545 7.958 -14.741
260 HH11 ARG 36 2HH1 ARG 36 -7.001 9.313 -11.885
261 HH12 ARG 36 1HH1 ARG 36 -7.957 10.464 -12.759
262 HH21 ARG 36 2HH2 ARG 36 -6.798 9.468 -15.904
263 HH22 ARG 36 1HH2 ARG 36 -7.841 10.550 -15.046
264 H LEU 37 H LEU 37 -0.071 7.946 -12.831
265 HA LEU 37 HA LEU 37 0.157 6.070 -10.714
266 HB2 LEU 37 1HB LEU 37 1.498 5.819 -12.685
267 HB3 LEU 37 2HB LEU 37 2.222 7.409 -12.450
268 HG LEU 37 HG LEU 37 3.122 6.381 -10.236
269 HD11 LEU 37 1HD1 LEU 37 1.920 4.082 -11.566
270 HD12 LEU 37 2HD1 LEU 37 2.429 4.288 -9.890
271 HD13 LEU 37 3HD1 LEU 37 3.609 3.835 -11.121
272 HD21 LEU 37 3HD2 LEU 37 4.177 6.798 -12.730
273 HD22 LEU 37 1HD2 LEU 37 4.565 5.105 -12.428
274 HD23 LEU 37 2HD2 LEU 37 5.093 6.346 -11.291
275 H SER 38 H SER 38 1.306 9.396 -11.141
276 HA SER 38 HA SER 38 2.761 9.608 -8.761
277 HB2 SER 38 1HB SER 38 2.511 12.044 -9.036
278 HB3 SER 38 2HB SER 38 2.920 11.265 -10.564
279 HG SER 38 HG SER 38 1.196 12.821 -10.714
280 H HIS 39 H HIS 39 -0.661 10.144 -9.441
281 HA HIS 39 HA HIS 39 -1.404 11.261 -6.987
282 HB2 HIS 39 1HB HIS 39 -2.858 11.207 -8.989
283 HB3 HIS 39 2HB HIS 39 -3.059 9.470 -8.778
284 HD1 HIS 39 HD1 HIS 39 -4.473 12.674 -7.784
285 HD2 HIS 39 HD2 HIS 39 -4.461 8.792 -6.303
286 HE1 HIS 39 HE1 HIS 39 -6.365 12.579 -6.130
287 H LEU 40 H LEU 40 -1.405 7.862 -8.033
288 HA LEU 40 HA LEU 40 -2.269 6.864 -5.507
289 HB2 LEU 40 1HB LEU 40 -0.858 5.410 -7.738
290 HB3 LEU 40 2HB LEU 40 -1.749 4.671 -6.409
291 HG LEU 40 HG LEU 40 -2.897 6.302 -8.672
292 HD11 LEU 40 1HD1 LEU 40 -3.967 3.656 -8.245
293 HD12 LEU 40 2HD1 LEU 40 -2.227 3.608 -8.529
294 HD13 LEU 40 3HD1 LEU 40 -3.292 4.377 -9.706
295 HD21 LEU 40 3HD2 LEU 40 -4.235 5.092 -6.255
296 HD22 LEU 40 1HD2 LEU 40 -5.085 5.720 -7.668
297 HD23 LEU 40 2HD2 LEU 40 -4.124 6.805 -6.663
298 H PHE 41 H PHE 41 0.835 7.521 -6.967
299 HA PHE 41 HA PHE 41 2.483 6.019 -5.281
300 HB2 PHE 41 1HB PHE 41 2.895 7.699 -7.401
301 HB3 PHE 41 2HB PHE 41 3.556 8.642 -6.069
302 HD1 PHE 41 HD2 PHE 41 5.479 7.835 -4.808
303 HD2 PHE 41 HD1 PHE 41 3.941 5.671 -8.135
304 HE1 PHE 41 HE2 PHE 41 7.555 6.519 -4.908
305 HE2 PHE 41 HE1 PHE 41 6.014 4.351 -8.239
306 HZ PHE 41 HZ PHE 41 7.825 4.775 -6.625
307 H ARG 42 H ARG 42 1.429 9.406 -4.990
308 HA ARG 42 HA ARG 42 2.712 9.847 -2.499
309 HB2 ARG 42 1HB ARG 42 2.002 11.638 -4.101
310 HB3 ARG 42 2HB ARG 42 0.336 11.328 -3.633
311 HG2 ARG 42 1HG ARG 42 0.624 12.215 -1.520
312 HG3 ARG 42 2HG ARG 42 2.374 11.991 -1.554
313 HD2 ARG 42 1HD ARG 42 2.213 14.262 -1.869
314 HD3 ARG 42 2HD ARG 42 2.254 13.691 -3.536
315 HE ARG 42 HE ARG 42 0.110 14.442 -3.807
316 HH11 ARG 42 2HH1 ARG 42 0.837 14.273 -0.406
317 HH12 ARG 42 1HH1 ARG 42 -0.627 15.061 0.079
318 HH21 ARG 42 2HH2 ARG 42 -1.822 15.481 -3.180
319 HH22 ARG 42 1HH2 ARG 42 -2.140 15.747 -1.499
320 H GLN 43 H GLN 43 -0.315 8.439 -3.413
321 HA GLN 43 HA GLN 43 -1.553 8.714 -0.835
322 HB2 GLN 43 1HB GLN 43 -2.733 8.469 -3.097
323 HB3 GLN 43 2HB GLN 43 -2.359 6.755 -2.975
324 HG2 GLN 43 1HG GLN 43 -4.456 6.782 -2.092
325 HG3 GLN 43 2HG GLN 43 -3.497 6.994 -0.628
326 HE21 GLN 43 2HE2 GLN 43 -5.367 7.926 0.332
327 HE22 GLN 43 1HE2 GLN 43 -5.792 9.569 0.011
328 H GLN 44 H GLN 44 0.162 6.167 -2.580
329 HA GLN 44 HA GLN 44 -0.198 4.253 -0.452
330 HB2 GLN 44 1HB GLN 44 1.488 4.184 -2.958
331 HB3 GLN 44 2HB GLN 44 1.337 2.842 -1.831
332 HG2 GLN 44 1HG GLN 44 -1.070 4.067 -3.121
333 HG3 GLN 44 2HG GLN 44 -0.112 2.835 -3.940
334 HE21 GLN 44 2HE2 GLN 44 -2.566 2.108 -3.620
335 HE22 GLN 44 1HE2 GLN 44 -2.784 1.013 -2.301
336 H LEU 45 H LEU 45 2.386 6.333 -1.655
337 HA LEU 45 HA LEU 45 4.233 5.369 0.370
338 HB2 LEU 45 1HB LEU 45 4.517 6.471 -2.165
339 HB3 LEU 45 2HB LEU 45 5.076 7.735 -1.072
340 HG LEU 45 HG LEU 45 6.134 4.946 -0.818
341 HD11 LEU 45 1HD1 LEU 45 7.938 5.500 -2.347
342 HD12 LEU 45 2HD1 LEU 45 7.183 7.053 -2.703
343 HD13 LEU 45 3HD1 LEU 45 6.383 5.555 -3.178
344 HD21 LEU 45 3HD2 LEU 45 7.601 7.521 -0.399
345 HD22 LEU 45 1HD2 LEU 45 7.889 5.938 0.325
346 HD23 LEU 45 2HD2 LEU 45 6.502 6.901 0.835
347 H GLY 46 H GLY 46 1.891 7.817 0.017
348 HA2 GLY 46 1HA GLY 46 1.189 9.455 1.468
349 HA3 GLY 46 2HA GLY 46 2.288 8.774 2.658
350 H ILE 47 H ILE 47 3.928 9.507 -0.171
351 HA ILE 47 HA ILE 47 4.456 12.283 0.517
352 HB ILE 47 HB ILE 47 6.835 12.029 0.751
353 HG12 ILE 47 1HG1 ILE 47 6.353 9.067 0.366
354 HG13 ILE 47 2HG1 ILE 47 7.163 10.140 -0.770
355 HG21 ILE 47 1HG2 ILE 47 5.507 11.803 2.779
356 HG22 ILE 47 2HG2 ILE 47 5.383 10.064 2.517
357 HG23 ILE 47 3HG2 ILE 47 6.951 10.795 2.862
358 HD11 ILE 47 3HD1 ILE 47 8.120 9.140 1.880
359 HD12 ILE 47 1HD1 ILE 47 8.896 9.029 0.301
360 HD13 ILE 47 2HD1 ILE 47 8.815 10.580 1.138
361 H SER 48 H SER 48 6.187 13.182 -1.040
362 HA SER 48 HA SER 48 5.299 12.588 -3.705
363 HB2 SER 48 1HB SER 48 7.628 14.386 -3.118
364 HB3 SER 48 2HB SER 48 6.379 14.546 -4.353
365 HG SER 48 HG SER 48 6.373 15.878 -2.236
366 H VAL 49 H VAL 49 6.514 11.796 -5.423
367 HA VAL 49 HA VAL 49 8.215 9.665 -4.937
368 HB VAL 49 HB VAL 49 8.208 11.332 -7.454
369 HG11 VAL 49 1HG1 VAL 49 8.861 9.258 -8.552
370 HG12 VAL 49 2HG1 VAL 49 10.025 9.696 -7.300
371 HG13 VAL 49 3HG1 VAL 49 8.845 8.419 -7.002
372 HG21 VAL 49 3HG2 VAL 49 6.124 9.728 -6.256
373 HG22 VAL 49 1HG2 VAL 49 6.064 10.775 -7.674
374 HG23 VAL 49 2HG2 VAL 49 6.590 9.099 -7.836
375 H LEU 50 H LEU 50 8.999 13.040 -5.626
376 HA LEU 50 HA LEU 50 11.777 12.736 -5.907
377 HB2 LEU 50 1HB LEU 50 10.341 15.137 -4.794
378 HB3 LEU 50 2HB LEU 50 11.925 15.106 -5.565
379 HG LEU 50 HG LEU 50 9.247 14.693 -6.886
380 HD11 LEU 50 1HD1 LEU 50 10.215 16.671 -8.241
381 HD12 LEU 50 2HD1 LEU 50 11.274 16.891 -6.849
382 HD13 LEU 50 3HD1 LEU 50 9.524 16.978 -6.647
383 HD21 LEU 50 3HD2 LEU 50 12.009 14.524 -8.087
384 HD22 LEU 50 1HD2 LEU 50 10.485 14.454 -8.973
385 HD23 LEU 50 2HD2 LEU 50 10.906 13.170 -7.839
386 H SER 51 H SER 51 9.736 13.192 -3.074
387 HA SER 51 HA SER 51 11.896 13.565 -1.246
388 HB2 SER 51 1HB SER 51 9.773 14.439 -0.598
389 HB3 SER 51 2HB SER 51 8.977 12.888 -0.864
390 HG SER 51 HG SER 51 9.970 13.775 1.380
391 H TRP 52 H TRP 52 9.886 10.804 -2.180
392 HA TRP 52 HA TRP 52 10.863 8.949 -0.335
393 HB2 TRP 52 1HB TRP 52 8.903 8.415 -1.601
394 HB3 TRP 52 2HB TRP 52 9.768 8.585 -3.126
395 HD1 TRP 52 HD1 TRP 52 9.850 6.279 -0.002
396 HE1 TRP 52 HE1 TRP 52 10.521 3.920 -0.782
397 HE3 TRP 52 HE3 TRP 52 10.663 7.260 -4.954
398 HZ2 TRP 52 HZ2 TRP 52 11.294 2.643 -3.178
399 HZ3 TRP 52 HZ3 TRP 52 11.366 5.415 -6.422
400 HH2 TRP 52 HH2 TRP 52 11.675 3.155 -5.550
401 H ARG 53 H ARG 53 12.046 9.829 -3.554
402 HA ARG 53 HA ARG 53 14.044 7.881 -3.780
403 HB2 ARG 53 1HB ARG 53 13.267 9.308 -5.645
404 HB3 ARG 53 2HB ARG 53 14.058 10.690 -4.897
405 HG2 ARG 53 1HG ARG 53 16.171 9.932 -5.409
406 HG3 ARG 53 2HG ARG 53 15.650 8.250 -5.535
407 HD2 ARG 53 1HD ARG 53 15.287 8.460 -7.719
408 HD3 ARG 53 2HD ARG 53 14.277 9.883 -7.466
409 HE ARG 53 HE ARG 53 17.011 9.838 -8.314
410 HH11 ARG 53 2HH1 ARG 53 14.592 11.706 -6.646
411 HH12 ARG 53 1HH1 ARG 53 15.355 13.227 -6.972
412 HH21 ARG 53 2HH2 ARG 53 18.025 11.834 -8.749
413 HH22 ARG 53 1HH2 ARG 53 17.307 13.299 -8.169
414 H GLU 54 H GLU 54 14.196 11.189 -2.491
415 HA GLU 54 HA GLU 54 16.948 11.125 -1.854
416 HB2 GLU 54 1HB GLU 54 15.668 13.215 -2.066
417 HB3 GLU 54 2HB GLU 54 14.743 12.793 -0.632
418 HG2 GLU 54 1HG GLU 54 16.697 12.958 0.749
419 HG3 GLU 54 2HG GLU 54 17.723 13.202 -0.664
420 H ASP 55 H ASP 55 14.038 10.436 0.044
421 HA ASP 55 HA ASP 55 15.204 10.072 2.538
422 HB2 ASP 55 1HB ASP 55 12.718 10.066 1.892
423 HB3 ASP 55 2HB ASP 55 12.941 8.356 1.534
424 H GLN 56 H GLN 56 14.648 7.665 -0.022
425 HA GLN 56 HA GLN 56 15.812 5.503 1.378
426 HB2 GLN 56 1HB GLN 56 15.375 5.952 -1.577
427 HB3 GLN 56 2HB GLN 56 15.932 4.433 -0.888
428 HG2 GLN 56 1HG GLN 56 13.316 5.774 -0.243
429 HG3 GLN 56 2HG GLN 56 13.528 4.436 -1.371
430 HE21 GLN 56 2HE2 GLN 56 14.104 2.391 -0.561
431 HE22 GLN 56 1HE2 GLN 56 13.827 1.969 1.091
432 H ARG 57 H ARG 57 17.118 7.961 -0.762
433 HA ARG 57 HA ARG 57 19.614 6.821 -1.292
434 HB2 ARG 57 1HB ARG 57 18.571 9.625 -1.217
435 HB3 ARG 57 2HB ARG 57 20.301 9.357 -1.391
436 HG2 ARG 57 1HG ARG 57 20.026 8.234 -3.440
437 HG3 ARG 57 2HG ARG 57 18.287 8.060 -3.199
438 HD2 ARG 57 1HD ARG 57 17.850 10.232 -3.777
439 HD3 ARG 57 2HD ARG 57 19.434 10.802 -3.254
440 HE ARG 57 HE ARG 57 19.659 9.092 -5.508
441 HH11 ARG 57 2HH1 ARG 57 18.757 12.319 -4.564
442 HH12 ARG 57 1HH1 ARG 57 19.148 13.018 -6.100
443 HH21 ARG 57 2HH2 ARG 57 20.177 10.000 -7.535
444 HH22 ARG 57 1HH2 ARG 57 19.955 11.698 -7.790
445 H ILE 58 H ILE 58 18.578 8.936 1.363
446 HA ILE 58 HA ILE 58 21.136 9.034 2.609
447 HB ILE 58 HB ILE 58 18.415 9.572 3.806
448 HG12 ILE 58 1HG1 ILE 58 18.895 11.010 1.879
449 HG13 ILE 58 2HG1 ILE 58 18.935 11.936 3.376
450 HG21 ILE 58 1HG2 ILE 58 19.508 9.700 5.739
451 HG22 ILE 58 2HG2 ILE 58 21.070 9.520 4.942
452 HG23 ILE 58 3HG2 ILE 58 20.336 11.116 5.092
453 HD11 ILE 58 3HD1 ILE 58 20.972 11.584 1.388
454 HD12 ILE 58 1HD1 ILE 58 20.912 12.700 2.752
455 HD13 ILE 58 2HD1 ILE 58 21.554 11.072 2.972
456 H SER 59 H SER 59 18.194 7.141 3.209
457 HA SER 59 HA SER 59 19.069 5.789 5.494
458 HB2 SER 59 1HB SER 59 16.721 5.805 4.666
459 HB3 SER 59 2HB SER 59 17.206 4.730 3.355
460 HG SER 59 HG SER 59 17.501 3.112 4.764
461 H GLN 60 H GLN 60 19.525 5.082 2.072
462 HA GLN 60 HA GLN 60 20.712 2.525 2.472
463 HB2 GLN 60 1HB GLN 60 19.636 3.436 0.336
464 HB3 GLN 60 2HB GLN 60 21.147 4.297 0.075
465 HG2 GLN 60 1HG GLN 60 21.106 2.229 -1.181
466 HG3 GLN 60 2HG GLN 60 22.358 2.181 0.059
467 HE21 GLN 60 2HE2 GLN 60 22.145 0.788 1.790
468 HE22 GLN 60 1HE2 GLN 60 20.979 -0.486 1.821
469 H ALA 61 H ALA 61 21.963 5.801 2.123
470 HA ALA 61 HA ALA 61 24.692 5.140 1.896
471 HB1 ALA 61 1HB ALA 61 23.402 7.410 1.575
472 HB2 ALA 61 2HB ALA 61 23.872 7.656 3.258
473 HB3 ALA 61 3HB ALA 61 25.107 7.386 2.028
474 H LYS 62 H LYS 62 22.696 5.945 4.722
475 HA LYS 62 HA LYS 62 24.827 5.686 6.594
476 HB2 LYS 62 1HB LYS 62 23.050 5.760 8.298
477 HB3 LYS 62 2HB LYS 62 22.872 7.042 7.107
478 HG2 LYS 62 1HG LYS 62 21.206 5.555 5.934
479 HG3 LYS 62 2HG LYS 62 21.261 4.520 7.364
480 HD2 LYS 62 1HD LYS 62 20.524 7.448 7.344
481 HD3 LYS 62 2HD LYS 62 19.383 6.104 7.443
482 HE2 LYS 62 1HE LYS 62 21.522 6.808 9.449
483 HE3 LYS 62 2HE LYS 62 19.783 7.016 9.649
484 HZ1 LYS 62 3HZ LYS 62 20.368 5.049 10.780
485 HZ2 LYS 62 1HZ LYS 62 21.297 4.474 9.488
486 HZ3 LYS 62 2HZ LYS 62 19.613 4.545 9.352
487 H LEU 63 H LEU 63 22.433 3.499 5.271
488 HA LEU 63 HA LEU 63 22.796 1.402 7.143
489 HB2 LEU 63 1HB LEU 63 20.848 1.645 5.621
490 HB3 LEU 63 2HB LEU 63 21.894 1.203 4.274
491 HG LEU 63 HG LEU 63 21.649 -0.679 6.573
492 HD11 LEU 63 1HD1 LEU 63 19.727 -1.676 5.073
493 HD12 LEU 63 2HD1 LEU 63 19.495 0.019 4.646
494 HD13 LEU 63 3HD1 LEU 63 19.387 -0.488 6.331
495 HD21 LEU 63 3HD2 LEU 63 21.526 -2.022 4.161
496 HD22 LEU 63 1HD2 LEU 63 22.961 -1.794 5.160
497 HD23 LEU 63 2HD2 LEU 63 22.621 -0.677 3.838
498 H LEU 64 H LEU 64 24.105 1.930 3.875
499 HA LEU 64 HA LEU 64 25.758 -0.381 3.913
500 HB2 LEU 64 1HB LEU 64 26.615 0.364 1.863
501 HB3 LEU 64 2HB LEU 64 24.931 0.883 1.885
502 HG LEU 64 HG LEU 64 26.045 3.124 2.794
503 HD11 LEU 64 1HD1 LEU 64 28.256 1.558 1.683
504 HD12 LEU 64 2HD1 LEU 64 28.277 2.948 2.769
505 HD13 LEU 64 3HD1 LEU 64 28.114 3.190 1.029
506 HD21 LEU 64 3HD2 LEU 64 24.617 2.719 0.752
507 HD22 LEU 64 1HD2 LEU 64 26.117 2.454 -0.138
508 HD23 LEU 64 2HD2 LEU 64 25.804 4.017 0.616
509 H LEU 65 H LEU 65 26.266 3.006 4.734
510 HA LEU 65 HA LEU 65 29.038 3.021 4.968
511 HB2 LEU 65 1HB LEU 65 26.816 4.592 6.147
512 HB3 LEU 65 2HB LEU 65 28.404 4.741 6.897
513 HG LEU 65 HG LEU 65 28.065 5.157 3.949
514 HD11 LEU 65 1HD1 LEU 65 27.408 7.352 4.175
515 HD12 LEU 65 2HD1 LEU 65 27.929 7.449 5.857
516 HD13 LEU 65 3HD1 LEU 65 26.460 6.567 5.439
517 HD21 LEU 65 3HD2 LEU 65 30.049 5.970 6.052
518 HD22 LEU 65 1HD2 LEU 65 29.975 6.763 4.478
519 HD23 LEU 65 2HD2 LEU 65 30.320 5.037 4.580
520 H SER 66 H SER 66 26.601 1.703 7.073
521 HA SER 66 HA SER 66 28.291 1.425 9.364
522 HB2 SER 66 1HB SER 66 26.463 0.469 10.417
523 HB3 SER 66 2HB SER 66 25.662 1.424 9.170
524 HG SER 66 HG SER 66 24.789 -0.427 8.674
525 H THR 67 H THR 67 27.452 -0.579 6.614
526 HA THR 67 HA THR 67 29.031 -2.800 7.689
527 HB THR 67 HB THR 67 26.846 -3.406 6.792
528 HG1 THR 67 HG1 THR 67 27.910 -5.148 6.252
529 HG21 THR 67 3HG2 THR 67 26.792 -3.256 4.143
530 HG22 THR 67 1HG2 THR 67 27.813 -1.851 4.448
531 HG23 THR 67 2HG2 THR 67 26.201 -1.941 5.158
532 H THR 68 H THR 68 29.789 -0.095 6.208
533 HA THR 68 HA THR 68 31.906 -1.357 4.605
534 HB THR 68 HB THR 68 31.736 0.352 2.895
535 HG1 THR 68 HG1 THR 68 30.488 2.081 3.119
536 HG21 THR 68 3HG2 THR 68 28.949 -0.202 2.724
537 HG22 THR 68 1HG2 THR 68 29.754 -1.615 3.405
538 HG23 THR 68 2HG2 THR 68 30.277 -0.966 1.851
539 H ARG 69 H ARG 69 33.800 0.012 4.287
540 HA ARG 69 HA ARG 69 34.111 2.012 6.430
541 HB2 ARG 69 1HB ARG 69 36.436 1.293 6.678
542 HB3 ARG 69 2HB ARG 69 35.330 -0.043 6.968
543 HG2 ARG 69 1HG ARG 69 36.757 -1.147 5.629
544 HG3 ARG 69 2HG ARG 69 35.800 -0.400 4.348
545 HD2 ARG 69 1HD ARG 69 37.553 0.769 3.636
546 HD3 ARG 69 2HD ARG 69 37.851 1.401 5.255
547 HE ARG 69 HE ARG 69 38.768 -1.293 4.910
548 HH11 ARG 69 2HH1 ARG 69 39.565 2.065 4.450
549 HH12 ARG 69 1HH1 ARG 69 41.276 1.797 4.476
550 HH21 ARG 69 2HH2 ARG 69 41.019 -1.658 4.946
551 HH22 ARG 69 1HH2 ARG 69 42.102 -0.321 4.757
552 H MET 70 H MET 70 33.521 2.094 3.423
553 HA MET 70 HA MET 70 35.808 3.318 2.225
554 HB2 MET 70 1HB MET 70 32.900 3.209 1.421
555 HB3 MET 70 2HB MET 70 34.139 3.992 0.449
556 HG2 MET 70 1HG MET 70 35.321 1.884 0.220
557 HG3 MET 70 2HG MET 70 34.125 1.089 1.241
558 HE1 MET 70 3HE MET 70 31.594 0.994 0.665
559 HE2 MET 70 1HE MET 70 31.387 2.627 0.031
560 HE3 MET 70 2HE MET 70 30.909 1.236 -0.942
561 HA PRO 71 HA PRO 71 35.424 7.480 3.563
562 HB2 PRO 71 1HB PRO 71 36.226 8.833 1.351
563 HB3 PRO 71 2HB PRO 71 37.340 7.918 2.373
564 HG2 PRO 71 1HG PRO 71 36.067 7.130 -0.219
565 HG3 PRO 71 2HG PRO 71 37.739 6.896 0.323
566 HD2 PRO 71 1HD PRO 71 35.893 4.917 0.399
567 HD3 PRO 71 2HD PRO 71 37.202 5.047 1.591
568 H ILE 72 H ILE 72 34.295 9.503 3.214
569 HA ILE 72 HA ILE 72 31.625 9.202 2.482
570 HB ILE 72 HB ILE 72 33.159 11.802 2.566
571 HG12 ILE 72 1HG1 ILE 72 33.491 10.559 4.638
572 HG13 ILE 72 2HG1 ILE 72 32.418 11.925 4.922
573 HG21 ILE 72 1HG2 ILE 72 30.476 11.980 3.510
574 HG22 ILE 72 2HG2 ILE 72 31.224 12.796 2.138
575 HG23 ILE 72 3HG2 ILE 72 30.473 11.215 1.921
576 HD11 ILE 72 3HD1 ILE 72 31.912 9.045 5.127
577 HD12 ILE 72 1HD1 ILE 72 31.186 10.396 5.996
578 HD13 ILE 72 2HD1 ILE 72 30.623 9.986 4.375
579 H ALA 73 H ALA 73 34.403 10.159 0.595
580 HA ALA 73 HA ALA 73 33.041 11.292 -1.602
581 HB1 ALA 73 1HB ALA 73 35.305 11.791 -1.524
582 HB2 ALA 73 2HB ALA 73 35.768 10.114 -1.235
583 HB3 ALA 73 3HB ALA 73 35.206 10.611 -2.831
584 H THR 74 H THR 74 34.234 7.997 -1.008
585 HA THR 74 HA THR 74 33.310 6.955 -3.488
586 HB THR 74 HB THR 74 33.932 5.442 -0.944
587 HG1 THR 74 HG1 THR 74 35.561 6.331 -3.096
588 HG21 THR 74 3HG2 THR 74 32.715 4.053 -2.480
589 HG22 THR 74 1HG2 THR 74 34.413 3.582 -2.542
590 HG23 THR 74 2HG2 THR 74 33.725 4.575 -3.828
591 H VAL 75 H VAL 75 32.016 6.903 -0.185
592 HA VAL 75 HA VAL 75 29.802 5.277 -0.611
593 HB VAL 75 HB VAL 75 30.009 7.644 1.256
594 HG11 VAL 75 1HG1 VAL 75 28.242 6.555 2.534
595 HG12 VAL 75 2HG1 VAL 75 27.696 6.925 0.897
596 HG13 VAL 75 3HG1 VAL 75 28.144 5.274 1.327
597 HG21 VAL 75 3HG2 VAL 75 31.415 6.424 2.468
598 HG22 VAL 75 1HG2 VAL 75 30.224 5.127 2.565
599 HG23 VAL 75 2HG2 VAL 75 31.381 5.164 1.235
600 H GLY 76 H GLY 76 30.190 8.757 -1.120
601 HA2 GLY 76 1HA GLY 76 27.537 9.433 -1.639
602 HA3 GLY 76 2HA GLY 76 28.933 10.259 -2.315
603 H ARG 77 H ARG 77 29.993 8.136 -3.833
604 HA ARG 77 HA ARG 77 28.595 8.424 -6.228
605 HB2 ARG 77 1HB ARG 77 30.743 6.571 -5.279
606 HB3 ARG 77 2HB ARG 77 29.977 6.269 -6.833
607 HG2 ARG 77 1HG ARG 77 30.881 8.127 -7.800
608 HG3 ARG 77 2HG ARG 77 30.981 9.007 -6.273
609 HD2 ARG 77 1HD ARG 77 33.187 8.319 -7.222
610 HD3 ARG 77 2HD ARG 77 32.882 7.742 -5.585
611 HE ARG 77 HE ARG 77 32.934 5.593 -6.371
612 HH11 ARG 77 2HH1 ARG 77 32.589 7.783 -9.055
613 HH12 ARG 77 1HH1 ARG 77 32.806 6.552 -10.255
614 HH21 ARG 77 2HH2 ARG 77 33.220 3.964 -7.942
615 HH22 ARG 77 1HH2 ARG 77 33.164 4.380 -9.621
616 H ASN 78 H ASN 78 28.364 5.982 -3.720
617 HA ASN 78 HA ASN 78 26.872 4.068 -5.133
618 HB2 ASN 78 1HB ASN 78 26.944 4.718 -2.180
619 HB3 ASN 78 2HB ASN 78 26.141 3.305 -2.857
620 HD21 ASN 78 2HD2 ASN 78 29.231 4.902 -2.429
621 HD22 ASN 78 1HD2 ASN 78 30.201 3.482 -2.600
622 H VAL 79 H VAL 79 25.954 7.033 -3.527
623 HA VAL 79 HA VAL 79 23.114 6.464 -3.977
624 HB VAL 79 HB VAL 79 22.658 8.436 -2.609
625 HG11 VAL 79 1HG1 VAL 79 22.717 6.578 -1.256
626 HG12 VAL 79 2HG1 VAL 79 24.429 6.277 -1.560
627 HG13 VAL 79 3HG1 VAL 79 23.940 7.591 -0.490
628 HG21 VAL 79 3HG2 VAL 79 24.738 9.660 -3.333
629 HG22 VAL 79 1HG2 VAL 79 24.356 9.764 -1.615
630 HG23 VAL 79 2HG2 VAL 79 25.628 8.675 -2.171
631 H GLY 80 H GLY 80 25.276 7.301 -5.999
632 HA2 GLY 80 1HA GLY 80 25.176 8.442 -8.001
633 HA3 GLY 80 2HA GLY 80 23.563 8.981 -7.556
634 H PHE 81 H PHE 81 25.647 9.715 -5.073
635 HA PHE 81 HA PHE 81 25.592 12.523 -5.757
636 HB2 PHE 81 1HB PHE 81 26.278 10.929 -3.327
637 HB3 PHE 81 2HB PHE 81 26.913 12.565 -3.460
638 HD1 PHE 81 HD2 PHE 81 23.631 11.186 -4.535
639 HD2 PHE 81 HD1 PHE 81 25.722 13.820 -1.926
640 HE1 PHE 81 HE2 PHE 81 21.487 12.079 -3.725
641 HE2 PHE 81 HE1 PHE 81 23.581 14.717 -1.111
642 HZ PHE 81 HZ PHE 81 21.460 13.848 -2.011
643 H ASP 82 H ASP 82 27.120 13.451 -6.931
644 HA ASP 82 HA ASP 82 29.702 12.181 -7.273
645 HB2 ASP 82 1HB ASP 82 28.263 14.461 -8.574
646 HB3 ASP 82 2HB ASP 82 30.011 14.335 -8.752
647 H ASP 83 H ASP 83 28.334 14.949 -5.643
648 HA ASP 83 HA ASP 83 30.981 15.942 -4.911
649 HB2 ASP 83 1HB ASP 83 28.193 17.032 -4.675
650 HB3 ASP 83 2HB ASP 83 29.494 17.706 -3.697
651 H GLN 84 H GLN 84 31.942 15.246 -3.130
652 HA GLN 84 HA GLN 84 30.734 13.539 -1.256
653 HB2 GLN 84 1HB GLN 84 32.796 13.882 0.077
654 HB3 GLN 84 2HB GLN 84 33.125 13.497 -1.607
655 HG2 GLN 84 1HG GLN 84 33.136 16.161 -1.772
656 HG3 GLN 84 2HG GLN 84 33.632 15.978 -0.091
657 HE21 GLN 84 2HE2 GLN 84 35.464 14.518 0.308
658 HE22 GLN 84 1HE2 GLN 84 36.737 14.461 -0.859
659 H LEU 85 H LEU 85 31.380 17.012 -1.193
660 HA LEU 85 HA LEU 85 30.547 17.415 1.490
661 HB2 LEU 85 1HB LEU 85 31.180 19.118 -0.845
662 HB3 LEU 85 2HB LEU 85 30.162 19.834 0.404
663 HG LEU 85 HG LEU 85 32.486 20.435 0.744
664 HD11 LEU 85 1HD1 LEU 85 30.851 19.814 2.660
665 HD12 LEU 85 2HD1 LEU 85 32.559 20.058 3.020
666 HD13 LEU 85 3HD1 LEU 85 31.914 18.423 2.878
667 HD21 LEU 85 3HD2 LEU 85 33.326 17.700 1.454
668 HD22 LEU 85 1HD2 LEU 85 34.231 19.008 0.690
669 HD23 LEU 85 2HD2 LEU 85 33.126 18.023 -0.269
670 H TYR 86 H TYR 86 28.884 17.363 -1.590
671 HA TYR 86 HA TYR 86 26.488 18.597 -0.839
672 HB2 TYR 86 1HB TYR 86 26.951 18.179 -3.163
673 HB3 TYR 86 2HB TYR 86 27.036 16.443 -2.886
674 HD1 TYR 86 HD2 TYR 86 24.485 18.801 -1.577
675 HD2 TYR 86 HD1 TYR 86 25.338 15.649 -4.304
676 HE1 TYR 86 HE2 TYR 86 22.088 18.606 -2.092
677 HE2 TYR 86 HE1 TYR 86 22.944 15.446 -4.829
678 HH TYR 86 HH TYR 86 20.604 17.753 -3.650
679 H PHE 87 H PHE 87 27.531 15.226 -0.605
680 HA PHE 87 HA PHE 87 25.061 14.197 0.313
681 HB2 PHE 87 1HB PHE 87 26.667 12.673 -0.599
682 HB3 PHE 87 2HB PHE 87 27.892 13.176 0.561
683 HD1 PHE 87 HD1 PHE 87 24.485 11.671 0.448
684 HD2 PHE 87 HD2 PHE 87 28.244 11.886 2.433
685 HE1 PHE 87 HE1 PHE 87 23.785 9.861 1.961
686 HE2 PHE 87 HE2 PHE 87 27.551 10.077 3.949
687 HZ PHE 87 HZ PHE 87 25.320 9.061 3.714
688 H SER 88 H SER 88 27.982 15.276 2.013
689 HA SER 88 HA SER 88 27.062 14.674 4.613
690 HB2 SER 88 1HB SER 88 28.878 16.183 5.372
691 HB3 SER 88 2HB SER 88 29.431 15.031 4.157
692 HG SER 88 HG SER 88 29.885 17.490 4.012
693 H ARG 89 H ARG 89 26.799 17.542 2.585
694 HA ARG 89 HA ARG 89 25.797 19.303 4.535
695 HB2 ARG 89 1HB ARG 89 25.657 19.208 1.540
696 HB3 ARG 89 2HB ARG 89 24.743 20.421 2.428
697 HG2 ARG 89 1HG ARG 89 26.840 21.192 3.472
698 HG3 ARG 89 2HG ARG 89 27.727 20.026 2.488
699 HD2 ARG 89 1HD ARG 89 27.929 21.874 1.165
700 HD3 ARG 89 2HD ARG 89 26.420 21.220 0.529
701 HE ARG 89 HE ARG 89 25.811 22.973 2.622
702 HH11 ARG 89 2HH1 ARG 89 27.133 23.043 -0.598
703 HH12 ARG 89 1HH1 ARG 89 26.578 24.650 -0.932
704 HH21 ARG 89 2HH2 ARG 89 25.075 25.090 2.194
705 HH22 ARG 89 1HH2 ARG 89 25.408 25.814 0.658
706 H VAL 90 H VAL 90 24.094 17.294 2.139
707 HA VAL 90 HA VAL 90 21.496 17.992 3.057
708 HB VAL 90 HB VAL 90 22.390 15.612 1.426
709 HG11 VAL 90 1HG1 VAL 90 20.304 14.980 2.226
710 HG12 VAL 90 2HG1 VAL 90 19.682 16.631 2.196
711 HG13 VAL 90 3HG1 VAL 90 19.919 15.749 0.687
712 HG21 VAL 90 3HG2 VAL 90 21.622 16.906 -0.493
713 HG22 VAL 90 1HG2 VAL 90 21.202 18.250 0.570
714 HG23 VAL 90 2HG2 VAL 90 22.888 17.770 0.378
715 H PHE 91 H PHE 91 23.572 15.156 3.573
716 HA PHE 91 HA PHE 91 21.779 13.697 5.161
717 HB2 PHE 91 1HB PHE 91 23.780 12.693 4.165
718 HB3 PHE 91 2HB PHE 91 24.804 13.682 5.202
719 HD1 PHE 91 HD2 PHE 91 24.964 13.222 7.594
720 HD2 PHE 91 HD1 PHE 91 22.664 10.750 5.003
721 HE1 PHE 91 HE2 PHE 91 24.908 11.470 9.321
722 HE2 PHE 91 HE1 PHE 91 22.602 8.995 6.726
723 HZ PHE 91 HZ PHE 91 23.726 9.353 8.888
724 H LYS 92 H LYS 92 24.066 16.237 5.948
725 HA LYS 92 HA LYS 92 24.155 15.982 8.718
726 HB2 LYS 92 1HB LYS 92 25.675 17.519 7.899
727 HB3 LYS 92 2HB LYS 92 24.503 18.261 6.818
728 HG2 LYS 92 1HG LYS 92 23.724 19.677 8.406
729 HG3 LYS 92 2HG LYS 92 24.014 18.538 9.723
730 HD2 LYS 92 1HD LYS 92 26.387 19.622 8.311
731 HD3 LYS 92 2HD LYS 92 25.497 20.726 9.362
732 HE2 LYS 92 1HE LYS 92 25.642 18.654 11.015
733 HE3 LYS 92 2HE LYS 92 27.063 18.293 10.037
734 HZ1 LYS 92 3HZ LYS 92 27.379 20.912 10.537
735 HZ2 LYS 92 1HZ LYS 92 28.082 19.673 11.451
736 HZ3 LYS 92 2HZ LYS 92 26.643 20.396 11.970
737 H LYS 93 H LYS 93 21.907 17.877 6.716
738 HA LYS 93 HA LYS 93 20.346 18.722 8.967
739 HB2 LYS 93 1HB LYS 93 20.030 18.924 5.986
740 HB3 LYS 93 2HB LYS 93 18.709 19.370 7.058
741 HG2 LYS 93 1HG LYS 93 19.720 21.395 6.767
742 HG3 LYS 93 2HG LYS 93 20.553 20.828 8.217
743 HD2 LYS 93 1HD LYS 93 22.314 21.549 6.906
744 HD3 LYS 93 2HD LYS 93 22.255 19.828 6.518
745 HE2 LYS 93 1HE LYS 93 22.497 21.058 4.475
746 HE3 LYS 93 2HE LYS 93 20.867 20.389 4.531
747 HZ1 LYS 93 3HZ LYS 93 21.291 23.101 5.554
748 HZ2 LYS 93 1HZ LYS 93 19.933 22.435 4.795
749 HZ3 LYS 93 2HZ LYS 93 21.285 22.873 3.878
750 H CYS 94 H CYS 94 20.340 16.005 6.823
751 HA CYS 94 HA CYS 94 17.696 15.163 6.980
752 HB2 CYS 94 1HB CYS 94 19.662 14.190 5.618
753 HB3 CYS 94 2HB CYS 94 20.003 13.232 7.054
754 HG CYS 94 HG CYS 94 16.872 13.147 5.744
755 H THR 95 H THR 95 20.414 14.351 9.127
756 HA THR 95 HA THR 95 18.468 13.329 11.086
757 HB THR 95 HB THR 95 20.388 12.176 12.148
758 HG1 THR 95 HG1 THR 95 21.833 13.033 9.844
759 HG21 THR 95 3HG2 THR 95 18.936 11.187 10.274
760 HG22 THR 95 1HG2 THR 95 20.461 10.383 10.640
761 HG23 THR 95 2HG2 THR 95 20.338 11.442 9.235
762 H GLY 96 H GLY 96 20.456 15.952 10.408
763 HA2 GLY 96 1HA GLY 96 20.466 17.916 11.732
764 HA3 GLY 96 2HA GLY 96 20.128 16.932 13.149
765 H ALA 97 H ALA 97 22.425 15.220 11.686
766 HA ALA 97 HA ALA 97 24.681 16.794 12.705
767 HB1 ALA 97 1HB ALA 97 24.702 13.890 13.308
768 HB2 ALA 97 2HB ALA 97 25.402 15.240 14.202
769 HB3 ALA 97 3HB ALA 97 23.669 14.924 14.296
770 H SER 98 H SER 98 26.687 16.320 11.762
771 HA SER 98 HA SER 98 26.593 15.506 9.061
772 HB2 SER 98 1HB SER 98 28.662 16.402 8.958
773 HB3 SER 98 2HB SER 98 28.378 16.907 10.624
774 HG SER 98 HG SER 98 30.038 15.702 11.058
775 HA PRO 99 HA PRO 99 27.308 11.179 9.125
776 HB2 PRO 99 1HB PRO 99 29.111 10.834 7.126
777 HB3 PRO 99 2HB PRO 99 27.419 11.250 6.831
778 HG2 PRO 99 1HG PRO 99 29.827 13.028 6.872
779 HG3 PRO 99 2HG PRO 99 28.466 13.013 5.735
780 HD2 PRO 99 1HD PRO 99 28.654 14.802 7.760
781 HD3 PRO 99 2HD PRO 99 27.096 14.193 7.164
782 H SER 100 H SER 100 30.212 13.186 9.162
783 HA SER 100 HA SER 100 32.010 11.148 9.956
784 HB2 SER 100 1HB SER 100 32.992 13.082 9.017
785 HB3 SER 100 2HB SER 100 32.104 14.158 10.096
786 HG SER 100 HG SER 100 33.451 13.673 11.720
787 H GLU 101 H GLU 101 29.901 13.327 11.714
788 HA GLU 101 HA GLU 101 31.015 12.771 14.288
789 HB2 GLU 101 1HB GLU 101 29.740 14.847 13.716
790 HB3 GLU 101 2HB GLU 101 28.278 13.873 13.635
791 HG2 GLU 101 1HG GLU 101 28.017 13.923 15.835
792 HG3 GLU 101 2HG GLU 101 29.692 13.455 16.119
793 H PHE 102 H PHE 102 28.105 11.689 12.560
794 HA PHE 102 HA PHE 102 27.098 10.023 14.576
795 HB2 PHE 102 1HB PHE 102 25.798 10.730 12.598
796 HB3 PHE 102 2HB PHE 102 26.808 9.709 11.580
797 HD1 PHE 102 HD2 PHE 102 25.286 9.042 14.910
798 HD2 PHE 102 HD1 PHE 102 25.436 8.037 10.776
799 HE1 PHE 102 HE2 PHE 102 23.775 7.145 15.320
800 HE2 PHE 102 HE1 PHE 102 23.923 6.138 11.180
801 HZ PHE 102 HZ PHE 102 23.092 5.689 13.454
802 H ARG 103 H ARG 103 29.226 9.289 11.828
803 HA ARG 103 HA ARG 103 29.473 6.533 12.332
804 HB2 ARG 103 1HB ARG 103 30.118 7.742 10.215
805 HB3 ARG 103 2HB ARG 103 31.558 8.303 11.054
806 HG2 ARG 103 1HG ARG 103 31.903 5.743 11.511
807 HG3 ARG 103 2HG ARG 103 30.859 5.577 10.098
808 HD2 ARG 103 1HD ARG 103 32.389 7.023 8.825
809 HD3 ARG 103 2HD ARG 103 33.440 7.132 10.236
810 HE ARG 103 HE ARG 103 33.097 4.435 9.683
811 HH11 ARG 103 2HH1 ARG 103 34.453 7.244 8.137
812 HH12 ARG 103 1HH1 ARG 103 35.636 6.344 7.247
813 HH21 ARG 103 2HH2 ARG 103 34.651 3.239 8.517
814 HH22 ARG 103 1HH2 ARG 103 35.747 4.066 7.463
815 H ALA 104 H ALA 104 31.271 9.321 13.516
816 HA ALA 104 HA ALA 104 33.328 7.833 14.798
817 HB1 ALA 104 1HB ALA 104 32.430 10.658 14.785
818 HB2 ALA 104 2HB ALA 104 33.420 10.124 16.144
819 HB3 ALA 104 3HB ALA 104 34.029 9.973 14.496
820 H GLY 105 H GLY 105 30.095 8.747 15.680
821 HA2 GLY 105 1HA GLY 105 28.814 7.900 17.422
822 HA3 GLY 105 2HA GLY 105 30.246 7.094 18.045
823 H CYS 106 H CYS 106 30.784 10.367 17.397
824 HA CYS 106 HA CYS 106 31.110 10.954 20.182
825 HB2 CYS 106 1HB CYS 106 32.460 11.848 18.140
826 HB3 CYS 106 2HB CYS 106 31.169 13.037 18.021
827 HG CYS 106 HG CYS 106 31.589 14.079 20.584
828 H GLU 107 H GLU 107 29.819 12.086 21.524
829 HA GLU 107 HA GLU 107 27.087 12.461 20.804
830 HB2 GLU 107 1HB GLU 107 28.599 13.342 23.269
831 HB3 GLU 107 2HB GLU 107 26.851 13.387 23.088
832 HG2 GLU 107 1HG GLU 107 26.675 11.055 23.090
833 HG3 GLU 107 2HG GLU 107 28.398 10.839 22.785
Start of MODEL 2
1 H1 MET 1 H MET 1 3.603 -0.893 -0.171
2 HA MET 1 HA MET 1 1.775 1.310 -0.844
3 HB2 MET 1 1HB MET 1 3.121 1.596 -2.964
4 HB3 MET 1 2HB MET 1 3.909 2.132 -1.486
5 HG2 MET 1 1HG MET 1 4.421 -0.647 -2.362
6 HG3 MET 1 2HG MET 1 5.132 0.651 -3.319
7 HE1 MET 1 3HE MET 1 7.552 2.266 -1.862
8 HE2 MET 1 1HE MET 1 5.861 2.729 -2.061
9 HE3 MET 1 2HE MET 1 6.603 2.767 -0.461
10 H ASP 2 H ASP 2 1.345 0.971 -3.434
11 HA ASP 2 HA ASP 2 -0.146 -1.487 -3.532
12 HB2 ASP 2 1HB ASP 2 -1.072 0.601 -4.447
13 HB3 ASP 2 2HB ASP 2 0.226 0.655 -5.637
14 H ASN 3 H ASN 3 0.092 -3.171 -5.025
15 HA ASN 3 HA ASN 3 2.663 -4.087 -5.496
16 HB2 ASN 3 1HB ASN 3 0.825 -5.629 -5.526
17 HB3 ASN 3 2HB ASN 3 0.065 -4.784 -6.871
18 HD21 ASN 3 2HD2 ASN 3 2.021 -7.329 -5.984
19 HD22 ASN 3 1HD2 ASN 3 2.663 -7.726 -7.538
20 H ARG 4 H ARG 4 0.464 -2.402 -7.714
21 HA ARG 4 HA ARG 4 2.102 -2.496 -9.988
22 HB2 ARG 4 1HB ARG 4 -0.141 -0.723 -9.098
23 HB3 ARG 4 2HB ARG 4 0.774 -0.302 -10.539
24 HG2 ARG 4 1HG ARG 4 0.175 -2.370 -11.596
25 HG3 ARG 4 2HG ARG 4 -0.599 -2.946 -10.118
26 HD2 ARG 4 1HD ARG 4 -1.478 -0.433 -11.510
27 HD3 ARG 4 2HD ARG 4 -2.111 -2.017 -11.952
28 HE ARG 4 HE ARG 4 -2.457 -1.865 -9.246
29 HH11 ARG 4 2HH1 ARG 4 -3.422 0.071 -11.974
30 HH12 ARG 4 1HH1 ARG 4 -4.880 0.633 -11.225
31 HH21 ARG 4 2HH2 ARG 4 -4.374 -1.132 -8.250
32 HH22 ARG 4 1HH2 ARG 4 -5.420 -0.051 -9.107
33 H VAL 5 H VAL 5 1.870 -0.106 -7.385
34 HA VAL 5 HA VAL 5 3.727 1.724 -8.499
35 HB VAL 5 HB VAL 5 2.914 1.346 -5.614
36 HG11 VAL 5 1HG1 VAL 5 4.434 2.876 -5.092
37 HG12 VAL 5 2HG1 VAL 5 4.943 2.971 -6.779
38 HG13 VAL 5 3HG1 VAL 5 3.650 4.015 -6.187
39 HG21 VAL 5 3HG2 VAL 5 1.219 2.907 -5.955
40 HG22 VAL 5 1HG2 VAL 5 1.927 3.488 -7.462
41 HG23 VAL 5 2HG2 VAL 5 1.147 1.906 -7.405
42 H ARG 6 H ARG 6 4.036 -1.009 -6.296
43 HA ARG 6 HA ARG 6 6.628 -0.630 -5.392
44 HB2 ARG 6 1HB ARG 6 4.714 -2.736 -5.392
45 HB3 ARG 6 2HB ARG 6 6.253 -3.412 -5.907
46 HG2 ARG 6 1HG ARG 6 7.056 -3.354 -3.842
47 HG3 ARG 6 2HG ARG 6 6.596 -1.662 -3.641
48 HD2 ARG 6 1HD ARG 6 5.326 -2.675 -2.010
49 HD3 ARG 6 2HD ARG 6 4.196 -2.646 -3.363
50 HE ARG 6 HE ARG 6 5.734 -5.057 -3.253
51 HH11 ARG 6 2HH1 ARG 6 2.934 -3.423 -1.983
52 HH12 ARG 6 1HH1 ARG 6 2.101 -4.887 -1.579
53 HH21 ARG 6 2HH2 ARG 6 4.646 -6.992 -2.726
54 HH22 ARG 6 1HH2 ARG 6 3.076 -6.917 -2.001
55 H GLU 7 H GLU 7 5.482 -1.879 -8.465
56 HA GLU 7 HA GLU 7 7.899 -2.957 -9.405
57 HB2 GLU 7 1HB GLU 7 5.401 -2.957 -10.356
58 HB3 GLU 7 2HB GLU 7 6.055 -1.658 -11.343
59 HG2 GLU 7 1HG GLU 7 6.226 -3.738 -12.528
60 HG3 GLU 7 2HG GLU 7 7.839 -3.164 -12.109
61 H ALA 8 H ALA 8 6.578 0.309 -9.525
62 HA ALA 8 HA ALA 8 8.417 1.460 -11.286
63 HB1 ALA 8 1HB ALA 8 6.487 2.704 -10.745
64 HB2 ALA 8 2HB ALA 8 6.827 2.624 -9.016
65 HB3 ALA 8 3HB ALA 8 7.845 3.605 -10.070
66 H CYS 9 H CYS 9 8.627 0.795 -7.842
67 HA CYS 9 HA CYS 9 10.879 2.329 -7.223
68 HB2 CYS 9 1HB CYS 9 9.589 1.357 -5.451
69 HB3 CYS 9 2HB CYS 9 9.872 -0.270 -6.060
70 HG CYS 9 HG CYS 9 12.813 0.928 -5.547
71 H GLN 10 H GLN 10 10.580 -0.820 -8.733
72 HA GLN 10 HA GLN 10 13.253 -1.651 -8.505
73 HB2 GLN 10 1HB GLN 10 11.137 -2.943 -9.302
74 HB3 GLN 10 2HB GLN 10 11.567 -2.328 -10.892
75 HG2 GLN 10 1HG GLN 10 12.439 -4.563 -10.561
76 HG3 GLN 10 2HG GLN 10 13.750 -3.396 -10.725
77 HE21 GLN 10 2HE2 GLN 10 15.337 -4.315 -9.586
78 HE22 GLN 10 1HE2 GLN 10 15.233 -4.755 -7.919
79 H TYR 11 H TYR 11 11.586 0.161 -11.060
80 HA TYR 11 HA TYR 11 13.871 0.397 -12.732
81 HB2 TYR 11 1HB TYR 11 11.705 0.630 -13.729
82 HB3 TYR 11 2HB TYR 11 11.270 1.929 -12.624
83 HD1 TYR 11 HD2 TYR 11 13.941 1.154 -15.128
84 HD2 TYR 11 HD1 TYR 11 11.328 4.072 -13.465
85 HE1 TYR 11 HE2 TYR 11 14.755 2.805 -16.760
86 HE2 TYR 11 HE1 TYR 11 12.134 5.730 -15.093
87 HH TYR 11 HH TYR 11 13.998 4.887 -17.805
88 H ILE 12 H ILE 12 12.297 2.635 -10.463
89 HA ILE 12 HA ILE 12 14.054 4.789 -10.826
90 HB ILE 12 HB ILE 12 12.486 4.042 -8.355
91 HG12 ILE 12 1HG1 ILE 12 11.825 5.919 -10.636
92 HG13 ILE 12 2HG1 ILE 12 11.091 4.343 -10.361
93 HG21 ILE 12 1HG2 ILE 12 14.264 5.602 -7.821
94 HG22 ILE 12 2HG2 ILE 12 13.764 6.656 -9.142
95 HG23 ILE 12 3HG2 ILE 12 12.701 6.416 -7.756
96 HD11 ILE 12 3HD1 ILE 12 10.828 6.816 -8.680
97 HD12 ILE 12 1HD1 ILE 12 9.569 5.972 -9.582
98 HD13 ILE 12 2HD1 ILE 12 10.286 5.222 -8.155
99 H SER 13 H SER 13 14.223 1.964 -8.739
100 HA SER 13 HA SER 13 16.386 2.817 -7.139
101 HB2 SER 13 1HB SER 13 15.201 0.992 -6.272
102 HB3 SER 13 2HB SER 13 15.219 0.128 -7.809
103 HG SER 13 HG SER 13 16.715 -0.823 -6.457
104 H ASP 14 H ASP 14 16.231 1.007 -10.172
105 HA ASP 14 HA ASP 14 19.001 0.450 -10.345
106 HB2 ASP 14 1HB ASP 14 17.382 -0.820 -11.644
107 HB3 ASP 14 2HB ASP 14 16.900 0.634 -12.513
108 H HIS 15 H HIS 15 17.093 3.245 -11.075
109 HA HIS 15 HA HIS 15 19.382 4.506 -12.423
110 HB2 HIS 15 1HB HIS 15 16.438 5.170 -12.409
111 HB3 HIS 15 2HB HIS 15 17.657 6.268 -13.050
112 HD1 HIS 15 HD1 HIS 15 17.473 6.150 -15.512
113 HD2 HIS 15 HD2 HIS 15 17.208 2.392 -13.761
114 HE1 HIS 15 HE1 HIS 15 17.348 4.524 -17.426
115 H LEU 16 H LEU 16 18.768 4.086 -9.446
116 HA LEU 16 HA LEU 16 18.202 6.535 -8.230
117 HB2 LEU 16 1HB LEU 16 18.347 4.255 -7.154
118 HB3 LEU 16 2HB LEU 16 20.097 4.463 -7.148
119 HG LEU 16 HG LEU 16 19.514 6.665 -5.838
120 HD11 LEU 16 1HD1 LEU 16 17.031 5.013 -5.633
121 HD12 LEU 16 2HD1 LEU 16 17.204 6.754 -5.854
122 HD13 LEU 16 3HD1 LEU 16 17.542 6.027 -4.284
123 HD21 LEU 16 3HD2 LEU 16 19.666 5.378 -3.729
124 HD22 LEU 16 1HD2 LEU 16 20.858 4.883 -4.931
125 HD23 LEU 16 2HD2 LEU 16 19.426 3.894 -4.651
126 H ALA 17 H ALA 17 21.082 5.378 -9.767
127 HA ALA 17 HA ALA 17 22.709 7.530 -8.657
128 HB1 ALA 17 1HB ALA 17 24.037 6.020 -10.707
129 HB2 ALA 17 2HB ALA 17 24.417 6.153 -8.990
130 HB3 ALA 17 3HB ALA 17 23.269 4.935 -9.547
131 H ASP 18 H ASP 18 20.856 6.797 -11.453
132 HA ASP 18 HA ASP 18 22.179 8.380 -13.368
133 HB2 ASP 18 1HB ASP 18 20.233 6.657 -13.633
134 HB3 ASP 18 2HB ASP 18 19.197 8.056 -13.366
135 H SER 19 H SER 19 21.868 10.492 -14.046
136 HA SER 19 HA SER 19 21.028 12.322 -11.977
137 HB2 SER 19 1HB SER 19 21.675 14.013 -13.886
138 HB3 SER 19 2HB SER 19 22.933 13.123 -13.028
139 HG SER 19 HG SER 19 23.436 12.747 -15.087
140 H ASN 20 H ASN 20 20.087 11.679 -15.350
141 HA ASN 20 HA ASN 20 17.839 13.452 -15.232
142 HB2 ASN 20 1HB ASN 20 19.219 12.691 -17.305
143 HB3 ASN 20 2HB ASN 20 18.154 11.288 -17.291
144 HD21 ASN 20 2HD2 ASN 20 17.886 14.814 -16.957
145 HD22 ASN 20 1HD2 ASN 20 16.528 14.979 -18.012
146 H PHE 21 H PHE 21 16.213 12.957 -13.897
147 HA PHE 21 HA PHE 21 15.149 10.210 -13.982
148 HB2 PHE 21 1HB PHE 21 16.065 10.688 -11.785
149 HB3 PHE 21 2HB PHE 21 15.139 12.182 -11.689
150 HD1 PHE 21 HD2 PHE 21 14.054 8.812 -12.815
151 HD2 PHE 21 HD1 PHE 21 13.721 11.878 -9.881
152 HE1 PHE 21 HE2 PHE 21 12.202 7.590 -11.754
153 HE2 PHE 21 HE1 PHE 21 11.868 10.660 -8.815
154 HZ PHE 21 HZ PHE 21 11.105 8.514 -9.751
155 H ASP 22 H ASP 22 13.397 10.209 -15.230
156 HA ASP 22 HA ASP 22 11.478 12.428 -14.942
157 HB2 ASP 22 1HB ASP 22 10.957 12.320 -17.206
158 HB3 ASP 22 2HB ASP 22 12.690 12.005 -17.211
159 H ILE 23 H ILE 23 9.446 11.959 -14.349
160 HA ILE 23 HA ILE 23 8.817 9.360 -13.392
161 HB ILE 23 HB ILE 23 7.903 11.444 -12.400
162 HG12 ILE 23 1HG1 ILE 23 5.502 9.914 -13.276
163 HG13 ILE 23 2HG1 ILE 23 6.781 9.020 -12.462
164 HG21 ILE 23 1HG2 ILE 23 6.500 12.868 -13.474
165 HG22 ILE 23 2HG2 ILE 23 7.374 12.261 -14.880
166 HG23 ILE 23 3HG2 ILE 23 5.792 11.597 -14.471
167 HD11 ILE 23 3HD1 ILE 23 4.948 9.859 -10.988
168 HD12 ILE 23 1HD1 ILE 23 6.574 10.344 -10.508
169 HD13 ILE 23 2HD1 ILE 23 5.514 11.494 -11.325
170 H ALA 24 H ALA 24 8.392 10.944 -16.421
171 HA ALA 24 HA ALA 24 6.172 9.597 -17.450
172 HB1 ALA 24 1HB ALA 24 6.697 11.187 -18.940
173 HB2 ALA 24 2HB ALA 24 8.414 11.134 -18.541
174 HB3 ALA 24 3HB ALA 24 7.731 9.949 -19.654
175 H SER 25 H SER 25 9.610 8.718 -17.511
176 HA SER 25 HA SER 25 9.261 6.344 -19.019
177 HB2 SER 25 1HB SER 25 11.430 7.620 -18.671
178 HB3 SER 25 2HB SER 25 11.506 6.884 -17.070
179 HG SER 25 HG SER 25 11.372 5.475 -19.533
180 H VAL 26 H VAL 26 9.069 7.092 -15.614
181 HA VAL 26 HA VAL 26 9.188 4.419 -14.655
182 HB VAL 26 HB VAL 26 7.857 6.776 -13.316
183 HG11 VAL 26 1HG1 VAL 26 7.462 4.426 -12.441
184 HG12 VAL 26 2HG1 VAL 26 9.176 4.403 -12.024
185 HG13 VAL 26 3HG1 VAL 26 8.105 5.598 -11.291
186 HG21 VAL 26 3HG2 VAL 26 10.150 6.840 -12.112
187 HG22 VAL 26 1HG2 VAL 26 10.735 5.984 -13.539
188 HG23 VAL 26 2HG2 VAL 26 10.000 7.579 -13.706
189 H ALA 27 H ALA 27 6.525 6.592 -15.506
190 HA ALA 27 HA ALA 27 4.439 4.862 -14.693
191 HB1 ALA 27 1HB ALA 27 4.602 7.457 -15.603
192 HB2 ALA 27 2HB ALA 27 3.747 6.623 -16.902
193 HB3 ALA 27 3HB ALA 27 3.117 6.569 -15.255
194 H GLN 28 H GLN 28 6.074 5.368 -17.792
195 HA GLN 28 HA GLN 28 4.432 3.721 -19.358
196 HB2 GLN 28 1HB GLN 28 6.011 5.273 -20.358
197 HB3 GLN 28 2HB GLN 28 7.364 4.387 -19.666
198 HG2 GLN 28 1HG GLN 28 6.950 2.509 -21.071
199 HG3 GLN 28 2HG GLN 28 5.429 3.199 -21.635
200 HE21 GLN 28 2HE2 GLN 28 5.620 3.788 -23.667
201 HE22 GLN 28 1HE2 GLN 28 6.971 4.602 -24.372
202 H HIS 29 H HIS 29 7.217 2.999 -17.332
203 HA HIS 29 HA HIS 29 7.720 0.384 -18.164
204 HB2 HIS 29 1HB HIS 29 9.307 1.422 -16.733
205 HB3 HIS 29 2HB HIS 29 8.093 1.751 -15.501
206 HD1 HIS 29 HD1 HIS 29 8.686 -1.596 -17.164
207 HD2 HIS 29 HD2 HIS 29 9.117 0.241 -13.462
208 HE1 HIS 29 HE1 HIS 29 9.323 -3.435 -15.571
209 H VAL 30 H VAL 30 5.308 1.666 -15.961
210 HA VAL 30 HA VAL 30 4.364 -1.037 -15.345
211 HB VAL 30 HB VAL 30 2.902 0.032 -13.691
212 HG11 VAL 30 1HG1 VAL 30 5.268 -0.612 -13.167
213 HG12 VAL 30 2HG1 VAL 30 5.712 1.080 -13.402
214 HG13 VAL 30 3HG1 VAL 30 4.588 0.631 -12.118
215 HG21 VAL 30 3HG2 VAL 30 4.229 2.635 -14.428
216 HG22 VAL 30 1HG2 VAL 30 2.627 2.159 -14.992
217 HG23 VAL 30 2HG2 VAL 30 2.926 2.379 -13.268
218 H CYS 31 H CYS 31 4.024 0.507 -17.948
219 HA CYS 31 HA CYS 31 2.426 0.884 -19.529
220 HB2 CYS 31 1HB CYS 31 0.944 -1.258 -17.990
221 HB3 CYS 31 2HB CYS 31 0.651 -0.788 -19.660
222 HG CYS 31 HG CYS 31 2.063 -2.783 -20.464
223 H LEU 32 H LEU 32 2.324 2.623 -17.285
224 HA LEU 32 HA LEU 32 -0.514 3.362 -17.392
225 HB2 LEU 32 1HB LEU 32 0.584 2.272 -15.153
226 HB3 LEU 32 2HB LEU 32 0.841 3.992 -14.865
227 HG LEU 32 HG LEU 32 -1.885 3.186 -15.686
228 HD11 LEU 32 1HD1 LEU 32 -2.403 2.607 -13.292
229 HD12 LEU 32 2HD1 LEU 32 -0.666 2.431 -13.041
230 HD13 LEU 32 3HD1 LEU 32 -1.500 1.388 -14.193
231 HD21 LEU 32 3HD2 LEU 32 -1.997 5.360 -15.141
232 HD22 LEU 32 1HD2 LEU 32 -0.527 5.297 -14.169
233 HD23 LEU 32 2HD2 LEU 32 -2.062 4.767 -13.481
234 H SER 33 H SER 33 -0.871 5.654 -16.738
235 HA SER 33 HA SER 33 1.105 7.322 -18.027
236 HB2 SER 33 1HB SER 33 -1.701 7.678 -17.073
237 HB3 SER 33 2HB SER 33 -0.702 9.118 -17.269
238 HG SER 33 HG SER 33 -1.087 8.959 -19.317
239 HA PRO 34 HA PRO 34 3.121 8.980 -14.502
240 HB2 PRO 34 1HB PRO 34 3.426 11.589 -15.185
241 HB3 PRO 34 2HB PRO 34 4.349 10.284 -15.941
242 HG2 PRO 34 1HG PRO 34 1.912 11.706 -16.941
243 HG3 PRO 34 2HG PRO 34 3.375 11.235 -17.826
244 HD2 PRO 34 1HD PRO 34 1.074 9.813 -17.954
245 HD3 PRO 34 2HD PRO 34 2.674 9.054 -18.075
246 H SER 35 H SER 35 0.327 10.845 -15.626
247 HA SER 35 HA SER 35 -0.037 12.331 -13.247
248 HB2 SER 35 1HB SER 35 -1.036 13.061 -15.345
249 HB3 SER 35 2HB SER 35 -2.017 11.598 -15.417
250 HG SER 35 HG SER 35 -3.113 13.488 -14.575
251 H ARG 36 H ARG 36 -1.533 9.343 -14.448
252 HA ARG 36 HA ARG 36 -3.188 8.982 -12.156
253 HB2 ARG 36 1HB ARG 36 -2.465 7.369 -14.553
254 HB3 ARG 36 2HB ARG 36 -3.136 6.518 -13.167
255 HG2 ARG 36 1HG ARG 36 -4.494 8.926 -14.322
256 HG3 ARG 36 2HG ARG 36 -4.739 7.313 -14.994
257 HD2 ARG 36 1HD ARG 36 -5.789 6.534 -13.086
258 HD3 ARG 36 2HD ARG 36 -5.053 7.764 -12.058
259 HE ARG 36 HE ARG 36 -6.776 9.187 -12.576
260 HH11 ARG 36 2HH1 ARG 36 -6.802 6.488 -14.776
261 HH12 ARG 36 1HH1 ARG 36 -8.333 6.904 -15.473
262 HH21 ARG 36 2HH2 ARG 36 -8.792 9.745 -13.487
263 HH22 ARG 36 1HH2 ARG 36 -9.463 8.757 -14.740
264 H LEU 37 H LEU 37 -0.019 7.785 -13.135
265 HA LEU 37 HA LEU 37 0.281 5.934 -11.004
266 HB2 LEU 37 1HB LEU 37 1.627 5.636 -12.928
267 HB3 LEU 37 2HB LEU 37 2.236 7.288 -12.843
268 HG LEU 37 HG LEU 37 2.984 6.006 -10.438
269 HD11 LEU 37 1HD1 LEU 37 3.955 4.406 -12.778
270 HD12 LEU 37 2HD1 LEU 37 2.519 3.929 -11.872
271 HD13 LEU 37 3HD1 LEU 37 4.078 4.045 -11.056
272 HD21 LEU 37 3HD2 LEU 37 5.278 6.190 -11.778
273 HD22 LEU 37 1HD2 LEU 37 4.453 7.600 -11.111
274 HD23 LEU 37 2HD2 LEU 37 4.277 7.202 -12.821
275 H SER 38 H SER 38 1.357 9.280 -11.479
276 HA SER 38 HA SER 38 2.812 9.541 -9.099
277 HB2 SER 38 1HB SER 38 2.913 11.159 -10.974
278 HB3 SER 38 2HB SER 38 1.283 11.699 -10.574
279 HG SER 38 HG SER 38 2.510 13.089 -9.478
280 H HIS 39 H HIS 39 -0.609 10.080 -9.804
281 HA HIS 39 HA HIS 39 -1.359 11.207 -7.357
282 HB2 HIS 39 1HB HIS 39 -2.798 11.152 -9.375
283 HB3 HIS 39 2HB HIS 39 -3.020 9.420 -9.146
284 HD1 HIS 39 HD1 HIS 39 -4.467 12.619 -8.271
285 HD2 HIS 39 HD2 HIS 39 -4.378 8.819 -6.595
286 HE1 HIS 39 HE1 HIS 39 -6.352 12.574 -6.607
287 H LEU 40 H LEU 40 -1.362 7.806 -8.396
288 HA LEU 40 HA LEU 40 -2.264 6.811 -5.884
289 HB2 LEU 40 1HB LEU 40 -0.825 5.379 -8.112
290 HB3 LEU 40 2HB LEU 40 -1.681 4.614 -6.775
291 HG LEU 40 HG LEU 40 -2.914 6.250 -8.990
292 HD11 LEU 40 1HD1 LEU 40 -3.939 3.609 -8.752
293 HD12 LEU 40 2HD1 LEU 40 -2.181 3.522 -8.838
294 HD13 LEU 40 3HD1 LEU 40 -3.086 4.346 -10.108
295 HD21 LEU 40 3HD2 LEU 40 -4.366 6.688 -7.281
296 HD22 LEU 40 1HD2 LEU 40 -3.975 5.201 -6.417
297 HD23 LEU 40 2HD2 LEU 40 -5.016 5.146 -7.839
298 H PHE 41 H PHE 41 0.866 7.473 -7.286
299 HA PHE 41 HA PHE 41 2.499 5.979 -5.592
300 HB2 PHE 41 1HB PHE 41 2.934 7.699 -7.666
301 HB3 PHE 41 2HB PHE 41 3.533 8.643 -6.306
302 HD1 PHE 41 HD2 PHE 41 5.468 7.918 -5.044
303 HD2 PHE 41 HD1 PHE 41 4.025 5.661 -8.351
304 HE1 PHE 41 HE2 PHE 41 7.580 6.658 -5.101
305 HE2 PHE 41 HE1 PHE 41 6.134 4.396 -8.413
306 HZ PHE 41 HZ PHE 41 7.916 4.895 -6.787
307 H ARG 42 H ARG 42 1.386 9.341 -5.242
308 HA ARG 42 HA ARG 42 2.613 9.745 -2.717
309 HB2 ARG 42 1HB ARG 42 1.750 11.491 -4.417
310 HB3 ARG 42 2HB ARG 42 0.183 11.241 -3.659
311 HG2 ARG 42 1HG ARG 42 2.260 11.694 -1.697
312 HG3 ARG 42 2HG ARG 42 2.148 13.016 -2.861
313 HD2 ARG 42 1HD ARG 42 -0.383 11.953 -1.734
314 HD3 ARG 42 2HD ARG 42 0.645 12.910 -0.668
315 HE ARG 42 HE ARG 42 0.492 14.451 -2.869
316 HH11 ARG 42 2HH1 ARG 42 -1.926 12.853 -0.941
317 HH12 ARG 42 1HH1 ARG 42 -3.151 14.036 -1.261
318 HH21 ARG 42 2HH2 ARG 42 -1.112 16.015 -3.298
319 HH22 ARG 42 1HH2 ARG 42 -2.687 15.834 -2.603
320 H GLN 43 H GLN 43 -0.363 8.293 -3.719
321 HA GLN 43 HA GLN 43 -1.661 8.491 -1.164
322 HB2 GLN 43 1HB GLN 43 -2.778 8.253 -3.464
323 HB3 GLN 43 2HB GLN 43 -2.379 6.545 -3.345
324 HG2 GLN 43 1HG GLN 43 -3.828 6.195 -1.575
325 HG3 GLN 43 2HG GLN 43 -3.875 7.904 -1.146
326 HE21 GLN 43 2HE2 GLN 43 -5.439 5.409 -2.739
327 HE22 GLN 43 1HE2 GLN 43 -6.611 6.343 -3.599
328 H GLN 44 H GLN 44 0.136 6.007 -2.922
329 HA GLN 44 HA GLN 44 -0.217 4.054 -0.830
330 HB2 GLN 44 1HB GLN 44 1.488 4.067 -3.323
331 HB3 GLN 44 2HB GLN 44 1.392 2.709 -2.210
332 HG2 GLN 44 1HG GLN 44 -0.945 3.878 -3.703
333 HG3 GLN 44 2HG GLN 44 -0.040 2.448 -4.195
334 HE21 GLN 44 2HE2 GLN 44 -2.850 2.681 -3.550
335 HE22 GLN 44 1HE2 GLN 44 -3.144 1.601 -2.234
336 H LEU 45 H LEU 45 2.340 6.208 -1.956
337 HA LEU 45 HA LEU 45 4.180 5.247 0.077
338 HB2 LEU 45 1HB LEU 45 4.474 6.406 -2.431
339 HB3 LEU 45 2HB LEU 45 4.986 7.661 -1.306
340 HG LEU 45 HG LEU 45 6.108 4.895 -1.083
341 HD11 LEU 45 1HD1 LEU 45 7.956 5.603 -2.557
342 HD12 LEU 45 2HD1 LEU 45 7.034 7.045 -2.982
343 HD13 LEU 45 3HD1 LEU 45 6.419 5.449 -3.409
344 HD21 LEU 45 3HD2 LEU 45 7.797 5.899 0.123
345 HD22 LEU 45 1HD2 LEU 45 6.405 6.882 0.577
346 HD23 LEU 45 2HD2 LEU 45 7.546 7.474 -0.630
347 H GLY 46 H GLY 46 1.787 7.648 -0.262
348 HA2 GLY 46 1HA GLY 46 1.026 9.238 1.214
349 HA3 GLY 46 2HA GLY 46 2.127 8.561 2.404
350 H ILE 47 H ILE 47 3.796 9.382 -0.379
351 HA ILE 47 HA ILE 47 4.238 12.160 0.356
352 HB ILE 47 HB ILE 47 6.625 11.957 0.625
353 HG12 ILE 47 1HG1 ILE 47 6.207 8.982 0.259
354 HG13 ILE 47 2HG1 ILE 47 7.000 10.059 -0.885
355 HG21 ILE 47 1HG2 ILE 47 5.247 11.710 2.623
356 HG22 ILE 47 2HG2 ILE 47 5.183 9.967 2.372
357 HG23 ILE 47 3HG2 ILE 47 6.720 10.747 2.746
358 HD11 ILE 47 3HD1 ILE 47 8.694 8.892 0.279
359 HD12 ILE 47 1HD1 ILE 47 8.691 10.543 0.898
360 HD13 ILE 47 2HD1 ILE 47 7.957 9.246 1.842
361 H SER 48 H SER 48 5.945 13.143 -1.155
362 HA SER 48 HA SER 48 5.151 12.533 -3.846
363 HB2 SER 48 1HB SER 48 7.047 14.373 -4.234
364 HB3 SER 48 2HB SER 48 5.436 14.803 -3.660
365 HG SER 48 HG SER 48 6.562 15.693 -2.106
366 H VAL 49 H VAL 49 6.438 11.808 -5.539
367 HA VAL 49 HA VAL 49 8.223 9.753 -5.027
368 HB VAL 49 HB VAL 49 8.897 9.920 -7.398
369 HG11 VAL 49 1HG1 VAL 49 7.035 8.658 -7.429
370 HG12 VAL 49 2HG1 VAL 49 6.114 9.809 -6.458
371 HG13 VAL 49 3HG1 VAL 49 6.313 10.074 -8.191
372 HG21 VAL 49 3HG2 VAL 49 9.033 12.089 -8.068
373 HG22 VAL 49 1HG2 VAL 49 7.400 11.741 -8.636
374 HG23 VAL 49 2HG2 VAL 49 7.640 12.590 -7.109
375 H LEU 50 H LEU 50 8.855 13.172 -5.610
376 HA LEU 50 HA LEU 50 11.650 13.010 -5.862
377 HB2 LEU 50 1HB LEU 50 9.674 15.132 -5.293
378 HB3 LEU 50 2HB LEU 50 11.336 15.459 -4.808
379 HG LEU 50 HG LEU 50 12.081 15.150 -7.109
380 HD11 LEU 50 1HD1 LEU 50 10.183 15.085 -8.854
381 HD12 LEU 50 2HD1 LEU 50 9.211 14.422 -7.542
382 HD13 LEU 50 3HD1 LEU 50 10.668 13.582 -8.070
383 HD21 LEU 50 3HD2 LEU 50 10.120 16.999 -7.903
384 HD22 LEU 50 1HD2 LEU 50 11.727 17.335 -7.259
385 HD23 LEU 50 2HD2 LEU 50 10.345 17.225 -6.168
386 H SER 51 H SER 51 9.550 13.323 -3.049
387 HA SER 51 HA SER 51 11.673 13.722 -1.183
388 HB2 SER 51 1HB SER 51 9.665 14.521 -0.351
389 HB3 SER 51 2HB SER 51 8.740 13.159 -0.986
390 HG SER 51 HG SER 51 8.866 12.768 1.151
391 H TRP 52 H TRP 52 9.763 10.925 -2.210
392 HA TRP 52 HA TRP 52 10.760 9.059 -0.388
393 HB2 TRP 52 1HB TRP 52 8.835 8.523 -1.728
394 HB3 TRP 52 2HB TRP 52 9.759 8.701 -3.217
395 HD1 TRP 52 HD1 TRP 52 9.825 6.423 -0.068
396 HE1 TRP 52 HE1 TRP 52 10.527 4.063 -0.820
397 HE3 TRP 52 HE3 TRP 52 10.632 7.358 -5.029
398 HZ2 TRP 52 HZ2 TRP 52 11.318 2.770 -3.201
399 HZ3 TRP 52 HZ3 TRP 52 11.360 5.506 -6.475
400 HH2 TRP 52 HH2 TRP 52 11.696 3.260 -5.579
401 H ARG 53 H ARG 53 11.979 10.047 -3.561
402 HA ARG 53 HA ARG 53 14.042 8.164 -3.782
403 HB2 ARG 53 1HB ARG 53 13.352 9.482 -5.688
404 HB3 ARG 53 2HB ARG 53 13.829 10.970 -4.882
405 HG2 ARG 53 1HG ARG 53 16.094 10.542 -5.156
406 HG3 ARG 53 2HG ARG 53 15.833 8.818 -5.424
407 HD2 ARG 53 1HD ARG 53 15.713 9.140 -7.618
408 HD3 ARG 53 2HD ARG 53 14.408 10.306 -7.403
409 HE ARG 53 HE ARG 53 17.192 10.877 -7.876
410 HH11 ARG 53 2HH1 ARG 53 14.172 12.090 -6.640
411 HH12 ARG 53 1HH1 ARG 53 14.602 13.755 -6.858
412 HH21 ARG 53 2HH2 ARG 53 17.769 13.064 -8.167
413 HH22 ARG 53 1HH2 ARG 53 16.648 14.307 -7.727
414 H GLU 54 H GLU 54 14.061 11.457 -2.444
415 HA GLU 54 HA GLU 54 16.802 11.468 -1.753
416 HB2 GLU 54 1HB GLU 54 15.575 13.544 -1.952
417 HB3 GLU 54 2HB GLU 54 14.481 13.064 -0.662
418 HG2 GLU 54 1HG GLU 54 16.077 13.384 0.988
419 HG3 GLU 54 2HG GLU 54 17.416 13.300 -0.154
420 H ASP 55 H ASP 55 13.876 10.766 0.132
421 HA ASP 55 HA ASP 55 15.061 10.351 2.612
422 HB2 ASP 55 1HB ASP 55 12.539 10.340 1.830
423 HB3 ASP 55 2HB ASP 55 12.794 8.599 1.758
424 H GLN 56 H GLN 56 14.530 8.057 -0.039
425 HA GLN 56 HA GLN 56 15.601 5.816 1.339
426 HB2 GLN 56 1HB GLN 56 15.056 6.388 -1.566
427 HB3 GLN 56 2HB GLN 56 15.787 4.877 -1.041
428 HG2 GLN 56 1HG GLN 56 13.150 5.893 -0.017
429 HG3 GLN 56 2HG GLN 56 13.315 4.807 -1.396
430 HE21 GLN 56 2HE2 GLN 56 13.863 2.680 -1.064
431 HE22 GLN 56 1HE2 GLN 56 13.881 1.947 0.500
432 H ARG 57 H ARG 57 16.970 8.280 -0.757
433 HA ARG 57 HA ARG 57 19.461 7.068 -1.233
434 HB2 ARG 57 1HB ARG 57 18.446 9.882 -1.304
435 HB3 ARG 57 2HB ARG 57 20.175 9.588 -1.441
436 HG2 ARG 57 1HG ARG 57 19.910 8.363 -3.437
437 HG3 ARG 57 2HG ARG 57 18.163 8.242 -3.217
438 HD2 ARG 57 1HD ARG 57 18.158 9.959 -4.688
439 HD3 ARG 57 2HD ARG 57 18.425 10.909 -3.226
440 HE ARG 57 HE ARG 57 20.933 10.327 -4.012
441 HH11 ARG 57 2HH1 ARG 57 18.180 11.637 -5.694
442 HH12 ARG 57 1HH1 ARG 57 19.135 12.575 -6.795
443 HH21 ARG 57 2HH2 ARG 57 22.200 11.556 -5.456
444 HH22 ARG 57 1HH2 ARG 57 21.421 12.527 -6.659
445 H ILE 58 H ILE 58 18.408 9.328 1.294
446 HA ILE 58 HA ILE 58 20.920 9.526 2.577
447 HB ILE 58 HB ILE 58 18.164 9.939 3.744
448 HG12 ILE 58 1HG1 ILE 58 18.638 11.370 1.791
449 HG13 ILE 58 2HG1 ILE 58 18.537 12.307 3.277
450 HG21 ILE 58 1HG2 ILE 58 19.586 9.732 5.581
451 HG22 ILE 58 2HG2 ILE 58 20.917 10.547 4.761
452 HG23 ILE 58 3HG2 ILE 58 19.515 11.471 5.299
453 HD11 ILE 58 3HD1 ILE 58 20.565 13.119 2.954
454 HD12 ILE 58 1HD1 ILE 58 21.244 11.498 2.815
455 HD13 ILE 58 2HD1 ILE 58 20.594 12.307 1.389
456 H SER 59 H SER 59 18.095 7.463 3.158
457 HA SER 59 HA SER 59 19.148 6.177 5.452
458 HB2 SER 59 1HB SER 59 16.714 6.247 4.750
459 HB3 SER 59 2HB SER 59 17.108 5.022 3.543
460 HG SER 59 HG SER 59 18.047 3.904 5.534
461 H GLN 60 H GLN 60 19.449 5.611 2.021
462 HA GLN 60 HA GLN 60 20.459 2.965 2.178
463 HB2 GLN 60 1HB GLN 60 19.518 3.896 0.111
464 HB3 GLN 60 2HB GLN 60 20.840 5.052 0.024
465 HG2 GLN 60 1HG GLN 60 21.426 3.376 -1.480
466 HG3 GLN 60 2HG GLN 60 22.386 3.032 -0.041
467 HE21 GLN 60 2HE2 GLN 60 22.016 1.184 1.108
468 HE22 GLN 60 1HE2 GLN 60 20.955 -0.071 0.575
469 H ALA 61 H ALA 61 22.012 6.145 2.001
470 HA ALA 61 HA ALA 61 24.663 5.301 1.806
471 HB1 ALA 61 1HB ALA 61 23.573 7.684 1.703
472 HB2 ALA 61 2HB ALA 61 24.001 7.721 3.414
473 HB3 ALA 61 3HB ALA 61 25.255 7.483 2.197
474 H LYS 62 H LYS 62 22.653 5.871 4.668
475 HA LYS 62 HA LYS 62 24.727 5.324 6.543
476 HB2 LYS 62 1HB LYS 62 21.732 5.218 6.941
477 HB3 LYS 62 2HB LYS 62 22.945 5.302 8.212
478 HG2 LYS 62 1HG LYS 62 23.282 7.516 7.933
479 HG3 LYS 62 2HG LYS 62 23.029 7.446 6.188
480 HD2 LYS 62 1HD LYS 62 21.115 8.530 6.746
481 HD3 LYS 62 2HD LYS 62 20.545 6.879 6.997
482 HE2 LYS 62 1HE LYS 62 21.053 7.054 9.374
483 HE3 LYS 62 2HE LYS 62 21.673 8.687 9.133
484 HZ1 LYS 62 3HZ LYS 62 19.374 8.615 9.990
485 HZ2 LYS 62 1HZ LYS 62 18.880 7.862 8.558
486 HZ3 LYS 62 2HZ LYS 62 19.502 9.434 8.516
487 H LEU 63 H LEU 63 22.304 3.388 4.914
488 HA LEU 63 HA LEU 63 22.550 1.076 6.533
489 HB2 LEU 63 1HB LEU 63 20.613 1.214 5.229
490 HB3 LEU 63 2HB LEU 63 21.521 1.586 3.765
491 HG LEU 63 HG LEU 63 22.294 -0.709 3.626
492 HD11 LEU 63 1HD1 LEU 63 22.533 -1.713 5.624
493 HD12 LEU 63 2HD1 LEU 63 20.875 -2.237 5.337
494 HD13 LEU 63 3HD1 LEU 63 21.190 -0.830 6.351
495 HD21 LEU 63 3HD2 LEU 63 20.343 -1.603 2.805
496 HD22 LEU 63 1HD2 LEU 63 19.924 0.109 2.873
497 HD23 LEU 63 2HD2 LEU 63 19.368 -0.985 4.140
498 H LEU 64 H LEU 64 23.969 1.940 3.385
499 HA LEU 64 HA LEU 64 25.544 -0.414 3.183
500 HB2 LEU 64 1HB LEU 64 26.483 0.541 1.263
501 HB3 LEU 64 2HB LEU 64 24.824 1.133 1.311
502 HG LEU 64 HG LEU 64 26.007 3.188 2.520
503 HD11 LEU 64 1HD1 LEU 64 28.128 3.093 0.635
504 HD12 LEU 64 2HD1 LEU 64 28.200 1.634 1.622
505 HD13 LEU 64 3HD1 LEU 64 28.217 3.221 2.392
506 HD21 LEU 64 3HD2 LEU 64 26.047 2.796 -0.470
507 HD22 LEU 64 1HD2 LEU 64 25.986 4.330 0.398
508 HD23 LEU 64 2HD2 LEU 64 24.617 3.219 0.472
509 H LEU 65 H LEU 65 26.137 2.822 4.439
510 HA LEU 65 HA LEU 65 28.918 2.608 4.780
511 HB2 LEU 65 1HB LEU 65 26.771 4.296 5.971
512 HB3 LEU 65 2HB LEU 65 28.373 4.313 6.705
513 HG LEU 65 HG LEU 65 27.980 4.877 3.782
514 HD11 LEU 65 1HD1 LEU 65 27.349 6.591 6.099
515 HD12 LEU 65 2HD1 LEU 65 26.722 6.627 4.451
516 HD13 LEU 65 3HD1 LEU 65 28.297 7.333 4.810
517 HD21 LEU 65 3HD2 LEU 65 30.068 6.306 4.410
518 HD22 LEU 65 1HD2 LEU 65 30.231 4.567 4.168
519 HD23 LEU 65 2HD2 LEU 65 30.152 5.227 5.802
520 H SER 66 H SER 66 26.238 1.416 6.650
521 HA SER 66 HA SER 66 27.746 0.883 9.026
522 HB2 SER 66 1HB SER 66 25.186 1.189 8.788
523 HB3 SER 66 2HB SER 66 25.176 -0.506 8.298
524 HG SER 66 HG SER 66 24.871 -0.089 10.600
525 H THR 67 H THR 67 27.288 -0.709 6.023
526 HA THR 67 HA THR 67 28.423 -3.200 7.110
527 HB THR 67 HB THR 67 26.325 -3.633 6.019
528 HG1 THR 67 HG1 THR 67 27.150 -4.970 4.229
529 HG21 THR 67 3HG2 THR 67 27.483 -2.265 3.588
530 HG22 THR 67 1HG2 THR 67 26.227 -1.604 4.634
531 HG23 THR 67 2HG2 THR 67 25.910 -3.056 3.684
532 H THR 68 H THR 68 29.384 -0.446 5.663
533 HA THR 68 HA THR 68 31.645 -1.791 4.350
534 HB THR 68 HB THR 68 31.665 -0.225 2.533
535 HG1 THR 68 HG1 THR 68 29.363 0.985 3.702
536 HG21 THR 68 3HG2 THR 68 29.601 -2.071 2.949
537 HG22 THR 68 1HG2 THR 68 30.147 -1.411 1.408
538 HG23 THR 68 2HG2 THR 68 28.823 -0.637 2.279
539 H ARG 69 H ARG 69 33.536 -0.325 4.064
540 HA ARG 69 HA ARG 69 33.669 1.669 6.229
541 HB2 ARG 69 1HB ARG 69 35.983 1.016 6.625
542 HB3 ARG 69 2HB ARG 69 34.915 -0.369 6.809
543 HG2 ARG 69 1HG ARG 69 36.166 0.074 4.156
544 HG3 ARG 69 2HG ARG 69 37.184 -0.518 5.471
545 HD2 ARG 69 1HD ARG 69 34.558 -1.836 5.049
546 HD3 ARG 69 2HD ARG 69 35.833 -2.155 3.874
547 HE ARG 69 HE ARG 69 36.744 -2.467 6.559
548 HH11 ARG 69 2HH1 ARG 69 34.980 -4.026 3.995
549 HH12 ARG 69 1HH1 ARG 69 35.328 -5.629 4.553
550 HH21 ARG 69 2HH2 ARG 69 37.209 -4.572 7.305
551 HH22 ARG 69 1HH2 ARG 69 36.595 -5.938 6.437
552 H MET 70 H MET 70 33.243 1.747 3.195
553 HA MET 70 HA MET 70 35.524 2.960 2.041
554 HB2 MET 70 1HB MET 70 32.601 3.032 1.299
555 HB3 MET 70 2HB MET 70 33.851 3.807 0.336
556 HG2 MET 70 1HG MET 70 34.953 1.628 0.053
557 HG3 MET 70 2HG MET 70 33.647 0.872 0.963
558 HE1 MET 70 3HE MET 70 31.093 0.820 0.106
559 HE2 MET 70 1HE MET 70 31.155 2.576 -0.049
560 HE3 MET 70 2HE MET 70 30.570 1.593 -1.391
561 HA PRO 71 HA PRO 71 35.410 7.084 3.537
562 HB2 PRO 71 1HB PRO 71 36.233 8.474 1.355
563 HB3 PRO 71 2HB PRO 71 37.318 7.460 2.314
564 HG2 PRO 71 1HG PRO 71 35.940 6.844 -0.271
565 HG3 PRO 71 2HG PRO 71 37.609 6.496 0.218
566 HD2 PRO 71 1HD PRO 71 35.655 4.622 0.269
567 HD3 PRO 71 2HD PRO 71 36.999 4.633 1.430
568 H ILE 72 H ILE 72 34.458 9.239 3.187
569 HA ILE 72 HA ILE 72 31.731 9.089 2.522
570 HB ILE 72 HB ILE 72 33.386 11.605 2.724
571 HG12 ILE 72 1HG1 ILE 72 31.973 10.042 4.896
572 HG13 ILE 72 2HG1 ILE 72 33.716 10.198 4.705
573 HG21 ILE 72 1HG2 ILE 72 31.069 11.761 1.767
574 HG22 ILE 72 2HG2 ILE 72 30.465 11.202 3.326
575 HG23 ILE 72 3HG2 ILE 72 31.349 12.725 3.217
576 HD11 ILE 72 3HD1 ILE 72 33.474 12.641 5.048
577 HD12 ILE 72 1HD1 ILE 72 31.764 12.379 5.392
578 HD13 ILE 72 2HD1 ILE 72 32.994 11.669 6.439
579 H ALA 73 H ALA 73 34.547 10.004 0.672
580 HA ALA 73 HA ALA 73 33.244 11.339 -1.443
581 HB1 ALA 73 1HB ALA 73 35.772 11.170 -0.840
582 HB2 ALA 73 2HB ALA 73 35.736 9.757 -1.896
583 HB3 ALA 73 3HB ALA 73 35.280 11.340 -2.525
584 H THR 74 H THR 74 34.237 7.948 -1.056
585 HA THR 74 HA THR 74 33.239 7.110 -3.583
586 HB THR 74 HB THR 74 33.846 5.474 -1.112
587 HG1 THR 74 HG1 THR 74 35.394 5.911 -3.467
588 HG21 THR 74 3HG2 THR 74 34.035 3.593 -2.750
589 HG22 THR 74 1HG2 THR 74 33.326 4.652 -3.969
590 HG23 THR 74 2HG2 THR 74 32.394 4.204 -2.540
591 H VAL 75 H VAL 75 31.954 6.933 -0.278
592 HA VAL 75 HA VAL 75 29.635 5.488 -0.796
593 HB VAL 75 HB VAL 75 30.029 7.697 1.228
594 HG11 VAL 75 1HG1 VAL 75 28.179 6.621 2.445
595 HG12 VAL 75 2HG1 VAL 75 27.669 7.260 0.881
596 HG13 VAL 75 3HG1 VAL 75 27.938 5.528 1.082
597 HG21 VAL 75 3HG2 VAL 75 31.291 5.231 1.038
598 HG22 VAL 75 1HG2 VAL 75 31.199 6.262 2.466
599 HG23 VAL 75 2HG2 VAL 75 30.012 4.979 2.225
600 H GLY 76 H GLY 76 30.253 8.961 -1.074
601 HA2 GLY 76 1HA GLY 76 27.650 9.847 -1.525
602 HA3 GLY 76 2HA GLY 76 29.096 10.621 -2.155
603 H ARG 77 H ARG 77 30.038 8.650 -3.863
604 HA ARG 77 HA ARG 77 28.584 9.147 -6.189
605 HB2 ARG 77 1HB ARG 77 30.817 7.363 -5.421
606 HB3 ARG 77 2HB ARG 77 29.930 6.904 -6.869
607 HG2 ARG 77 1HG ARG 77 30.668 9.738 -6.733
608 HG3 ARG 77 2HG ARG 77 32.028 8.616 -6.815
609 HD2 ARG 77 1HD ARG 77 29.681 8.498 -8.696
610 HD3 ARG 77 2HD ARG 77 31.132 9.443 -9.029
611 HE ARG 77 HE ARG 77 31.910 6.830 -8.413
612 HH11 ARG 77 2HH1 ARG 77 30.190 8.567 -10.892
613 HH12 ARG 77 1HH1 ARG 77 30.620 7.456 -12.150
614 HH21 ARG 77 2HH2 ARG 77 32.482 5.361 -10.061
615 HH22 ARG 77 1HH2 ARG 77 31.923 5.632 -11.676
616 H ASN 78 H ASN 78 28.373 6.522 -3.875
617 HA ASN 78 HA ASN 78 26.841 4.727 -5.390
618 HB2 ASN 78 1HB ASN 78 27.688 4.998 -2.647
619 HB3 ASN 78 2HB ASN 78 26.005 4.482 -2.711
620 HD21 ASN 78 2HD2 ASN 78 29.064 3.397 -2.550
621 HD22 ASN 78 1HD2 ASN 78 28.871 1.834 -3.262
622 H VAL 79 H VAL 79 25.967 7.590 -3.586
623 HA VAL 79 HA VAL 79 23.118 7.082 -4.053
624 HB VAL 79 HB VAL 79 22.698 8.974 -2.556
625 HG11 VAL 79 1HG1 VAL 79 22.834 6.816 -1.532
626 HG12 VAL 79 2HG1 VAL 79 24.597 6.889 -1.493
627 HG13 VAL 79 3HG1 VAL 79 23.645 7.973 -0.477
628 HG21 VAL 79 3HG2 VAL 79 24.827 10.179 -3.201
629 HG22 VAL 79 1HG2 VAL 79 24.415 10.201 -1.486
630 HG23 VAL 79 2HG2 VAL 79 25.667 9.109 -2.078
631 H GLY 80 H GLY 80 25.292 8.046 -6.016
632 HA2 GLY 80 1HA GLY 80 25.122 9.284 -7.966
633 HA3 GLY 80 2HA GLY 80 23.577 9.900 -7.398
634 H PHE 81 H PHE 81 25.692 10.370 -4.932
635 HA PHE 81 HA PHE 81 25.898 13.194 -5.518
636 HB2 PHE 81 1HB PHE 81 26.438 11.473 -3.128
637 HB3 PHE 81 2HB PHE 81 27.130 13.090 -3.199
638 HD1 PHE 81 HD2 PHE 81 23.818 11.745 -4.257
639 HD2 PHE 81 HD1 PHE 81 25.960 14.449 -1.764
640 HE1 PHE 81 HE2 PHE 81 21.691 12.686 -3.456
641 HE2 PHE 81 HE1 PHE 81 23.836 15.394 -0.958
642 HZ PHE 81 HZ PHE 81 21.698 14.513 -1.806
643 H ASP 82 H ASP 82 27.530 14.023 -6.624
644 HA ASP 82 HA ASP 82 29.996 12.539 -6.958
645 HB2 ASP 82 1HB ASP 82 28.868 13.735 -8.852
646 HB3 ASP 82 2HB ASP 82 29.273 15.258 -8.065
647 H ASP 83 H ASP 83 28.841 15.366 -5.264
648 HA ASP 83 HA ASP 83 31.543 16.108 -4.451
649 HB2 ASP 83 1HB ASP 83 28.842 17.397 -4.152
650 HB3 ASP 83 2HB ASP 83 30.218 17.945 -3.197
651 H GLN 84 H GLN 84 32.423 15.240 -2.704
652 HA GLN 84 HA GLN 84 31.038 13.579 -0.905
653 HB2 GLN 84 1HB GLN 84 33.425 13.329 -1.285
654 HB3 GLN 84 2HB GLN 84 33.726 14.934 -0.631
655 HG2 GLN 84 1HG GLN 84 32.753 14.101 1.540
656 HG3 GLN 84 2HG GLN 84 32.804 12.484 0.839
657 HE21 GLN 84 2HE2 GLN 84 34.222 13.632 3.144
658 HE22 GLN 84 1HE2 GLN 84 35.902 13.382 2.830
659 H LEU 85 H LEU 85 32.055 16.957 -0.691
660 HA LEU 85 HA LEU 85 31.250 17.329 2.006
661 HB2 LEU 85 1HB LEU 85 31.968 19.124 -0.264
662 HB3 LEU 85 2HB LEU 85 31.200 19.814 1.164
663 HG LEU 85 HG LEU 85 33.783 18.255 1.183
664 HD11 LEU 85 1HD1 LEU 85 34.318 20.851 1.930
665 HD12 LEU 85 2HD1 LEU 85 33.200 21.037 0.579
666 HD13 LEU 85 3HD1 LEU 85 34.691 20.119 0.369
667 HD21 LEU 85 3HD2 LEU 85 32.982 18.023 3.322
668 HD22 LEU 85 1HD2 LEU 85 32.102 19.551 3.276
669 HD23 LEU 85 2HD2 LEU 85 33.856 19.550 3.461
670 H TYR 86 H TYR 86 29.619 17.588 -1.078
671 HA TYR 86 HA TYR 86 27.370 19.056 -0.289
672 HB2 TYR 86 1HB TYR 86 27.752 18.713 -2.619
673 HB3 TYR 86 2HB TYR 86 27.744 16.963 -2.432
674 HD1 TYR 86 HD2 TYR 86 25.303 19.281 -0.900
675 HD2 TYR 86 HD1 TYR 86 26.025 16.435 -3.979
676 HE1 TYR 86 HE2 TYR 86 22.899 19.240 -1.417
677 HE2 TYR 86 HE1 TYR 86 23.623 16.387 -4.506
678 HH TYR 86 HH TYR 86 21.357 17.052 -2.825
679 H PHE 87 H PHE 87 27.894 15.540 -0.374
680 HA PHE 87 HA PHE 87 25.357 14.798 0.566
681 HB2 PHE 87 1HB PHE 87 26.756 13.138 -0.448
682 HB3 PHE 87 2HB PHE 87 28.032 13.407 0.735
683 HD1 PHE 87 HD2 PHE 87 24.437 12.420 0.604
684 HD2 PHE 87 HD1 PHE 87 28.231 11.916 2.467
685 HE1 PHE 87 HE2 PHE 87 23.506 10.628 2.009
686 HE2 PHE 87 HE1 PHE 87 27.306 10.123 3.874
687 HZ PHE 87 HZ PHE 87 24.940 9.477 3.647
688 H SER 88 H SER 88 28.399 15.359 2.307
689 HA SER 88 HA SER 88 27.398 14.744 4.873
690 HB2 SER 88 1HB SER 88 29.618 16.721 4.432
691 HB3 SER 88 2HB SER 88 29.445 15.515 5.706
692 HG SER 88 HG SER 88 30.943 14.731 4.283
693 H ARG 89 H ARG 89 27.505 17.717 2.997
694 HA ARG 89 HA ARG 89 26.791 19.507 5.044
695 HB2 ARG 89 1HB ARG 89 26.737 19.542 2.071
696 HB3 ARG 89 2HB ARG 89 25.762 20.743 2.908
697 HG2 ARG 89 1HG ARG 89 27.633 21.726 3.914
698 HG3 ARG 89 2HG ARG 89 28.661 20.338 3.553
699 HD2 ARG 89 1HD ARG 89 29.312 21.939 1.987
700 HD3 ARG 89 2HD ARG 89 28.211 20.893 1.091
701 HE ARG 89 HE ARG 89 26.824 22.681 0.817
702 HH11 ARG 89 2HH1 ARG 89 28.955 23.326 3.493
703 HH12 ARG 89 1HH1 ARG 89 28.402 24.954 3.710
704 HH21 ARG 89 2HH2 ARG 89 26.088 24.823 1.093
705 HH22 ARG 89 1HH2 ARG 89 26.771 25.804 2.345
706 H VAL 90 H VAL 90 24.768 17.888 2.599
707 HA VAL 90 HA VAL 90 22.318 18.865 3.673
708 HB VAL 90 HB VAL 90 22.481 18.192 1.332
709 HG11 VAL 90 1HG1 VAL 90 22.672 15.343 2.286
710 HG12 VAL 90 2HG1 VAL 90 22.775 15.941 0.629
711 HG13 VAL 90 3HG1 VAL 90 24.068 16.292 1.777
712 HG21 VAL 90 3HG2 VAL 90 20.380 17.754 2.995
713 HG22 VAL 90 1HG2 VAL 90 20.323 17.571 1.242
714 HG23 VAL 90 2HG2 VAL 90 20.579 16.160 2.268
715 H PHE 91 H PHE 91 24.139 15.861 4.022
716 HA PHE 91 HA PHE 91 22.179 14.449 5.487
717 HB2 PHE 91 1HB PHE 91 24.111 13.371 4.367
718 HB3 PHE 91 2HB PHE 91 25.184 14.102 5.556
719 HD1 PHE 91 HD1 PHE 91 21.913 12.327 5.824
720 HD2 PHE 91 HD2 PHE 91 26.011 12.492 6.962
721 HE1 PHE 91 HE1 PHE 91 21.575 10.395 7.309
722 HE2 PHE 91 HE2 PHE 91 25.680 10.559 8.448
723 HZ PHE 91 HZ PHE 91 23.460 9.507 8.623
724 H LYS 92 H LYS 92 24.750 16.652 6.423
725 HA LYS 92 HA LYS 92 24.794 16.191 9.171
726 HB2 LYS 92 1HB LYS 92 26.453 17.580 8.036
727 HB3 LYS 92 2HB LYS 92 25.223 18.784 7.676
728 HG2 LYS 92 1HG LYS 92 24.908 18.912 10.228
729 HG3 LYS 92 2HG LYS 92 26.473 18.099 10.306
730 HD2 LYS 92 1HD LYS 92 27.274 20.208 10.266
731 HD3 LYS 92 2HD LYS 92 27.029 20.050 8.525
732 HE2 LYS 92 1HE LYS 92 24.890 21.143 8.679
733 HE3 LYS 92 2HE LYS 92 24.985 21.169 10.439
734 HZ1 LYS 92 3HZ LYS 92 25.935 23.077 8.633
735 HZ2 LYS 92 1HZ LYS 92 27.279 22.402 9.407
736 HZ3 LYS 92 2HZ LYS 92 26.037 23.096 10.321
737 H LYS 93 H LYS 93 22.820 18.483 7.304
738 HA LYS 93 HA LYS 93 21.373 19.379 9.612
739 HB2 LYS 93 1HB LYS 93 21.031 19.795 6.649
740 HB3 LYS 93 2HB LYS 93 19.867 20.416 7.812
741 HG2 LYS 93 1HG LYS 93 21.291 22.008 8.602
742 HG3 LYS 93 2HG LYS 93 22.733 21.059 8.236
743 HD2 LYS 93 1HD LYS 93 22.604 22.980 6.761
744 HD3 LYS 93 2HD LYS 93 22.382 21.493 5.836
745 HE2 LYS 93 1HE LYS 93 20.122 21.883 5.509
746 HE3 LYS 93 2HE LYS 93 20.006 22.967 6.895
747 HZ1 LYS 93 3HZ LYS 93 20.171 24.617 5.441
748 HZ2 LYS 93 1HZ LYS 93 20.584 23.576 4.173
749 HZ3 LYS 93 2HZ LYS 93 21.787 24.176 5.200
750 H CYS 94 H CYS 94 21.024 16.835 7.292
751 HA CYS 94 HA CYS 94 18.277 16.351 7.450
752 HB2 CYS 94 1HB CYS 94 20.672 14.722 6.751
753 HB3 CYS 94 2HB CYS 94 19.167 13.866 7.067
754 HG CYS 94 HG CYS 94 19.501 14.173 4.298
755 H THR 95 H THR 95 20.931 14.964 9.372
756 HA THR 95 HA THR 95 18.941 13.951 11.284
757 HB THR 95 HB THR 95 20.817 12.577 12.193
758 HG1 THR 95 HG1 THR 95 22.760 12.550 11.136
759 HG21 THR 95 3HG2 THR 95 20.541 12.076 9.243
760 HG22 THR 95 1HG2 THR 95 19.187 11.848 10.349
761 HG23 THR 95 2HG2 THR 95 20.662 10.903 10.555
762 H GLY 96 H GLY 96 21.119 16.468 10.829
763 HA2 GLY 96 1HA GLY 96 21.308 18.279 12.342
764 HA3 GLY 96 2HA GLY 96 20.909 17.187 13.660
765 H ALA 97 H ALA 97 23.017 15.402 12.071
766 HA ALA 97 HA ALA 97 25.427 16.709 13.114
767 HB1 ALA 97 1HB ALA 97 25.131 13.788 13.591
768 HB2 ALA 97 2HB ALA 97 26.053 14.994 14.490
769 HB3 ALA 97 3HB ALA 97 24.301 14.908 14.671
770 H SER 98 H SER 98 27.362 16.099 12.105
771 HA SER 98 HA SER 98 27.145 15.422 9.374
772 HB2 SER 98 1HB SER 98 29.797 15.026 9.938
773 HB3 SER 98 2HB SER 98 29.071 16.592 9.574
774 HG SER 98 HG SER 98 30.257 16.681 11.507
775 HA PRO 99 HA PRO 99 27.456 11.050 9.223
776 HB2 PRO 99 1HB PRO 99 29.198 10.633 7.184
777 HB3 PRO 99 2HB PRO 99 27.550 11.219 6.934
778 HG2 PRO 99 1HG PRO 99 30.115 12.759 7.022
779 HG3 PRO 99 2HG PRO 99 28.748 12.927 5.905
780 HD2 PRO 99 1HD PRO 99 29.123 14.591 8.008
781 HD3 PRO 99 2HD PRO 99 27.509 14.160 7.408
782 H SER 100 H SER 100 30.524 12.783 9.339
783 HA SER 100 HA SER 100 32.144 10.554 9.991
784 HB2 SER 100 1HB SER 100 33.107 12.624 9.110
785 HB3 SER 100 2HB SER 100 32.582 13.499 10.548
786 HG SER 100 HG SER 100 34.029 12.348 11.767
787 H GLU 101 H GLU 101 30.250 12.805 11.900
788 HA GLU 101 HA GLU 101 31.320 11.984 14.423
789 HB2 GLU 101 1HB GLU 101 30.251 14.208 13.986
790 HB3 GLU 101 2HB GLU 101 28.700 13.387 13.879
791 HG2 GLU 101 1HG GLU 101 28.581 13.962 16.048
792 HG3 GLU 101 2HG GLU 101 29.502 12.473 16.258
793 H PHE 102 H PHE 102 28.305 11.311 12.668
794 HA PHE 102 HA PHE 102 27.121 9.649 14.573
795 HB2 PHE 102 1HB PHE 102 26.177 10.631 12.349
796 HB3 PHE 102 2HB PHE 102 26.787 9.143 11.634
797 HD1 PHE 102 HD1 PHE 102 24.503 10.481 14.219
798 HD2 PHE 102 HD2 PHE 102 25.596 7.135 11.827
799 HE1 PHE 102 HE1 PHE 102 22.457 9.311 14.926
800 HE2 PHE 102 HE2 PHE 102 23.551 5.960 12.528
801 HZ PHE 102 HZ PHE 102 21.978 7.049 14.079
802 H ARG 103 H ARG 103 29.435 8.932 12.012
803 HA ARG 103 HA ARG 103 29.351 6.129 12.186
804 HB2 ARG 103 1HB ARG 103 30.998 8.136 10.900
805 HB3 ARG 103 2HB ARG 103 31.977 6.804 11.501
806 HG2 ARG 103 1HG ARG 103 30.881 5.238 10.161
807 HG3 ARG 103 2HG ARG 103 29.517 6.317 9.861
808 HD2 ARG 103 1HD ARG 103 30.509 7.152 8.057
809 HD3 ARG 103 2HD ARG 103 31.954 7.550 8.985
810 HE ARG 103 HE ARG 103 31.586 5.308 7.239
811 HH11 ARG 103 2HH1 ARG 103 33.303 6.484 10.030
812 HH12 ARG 103 1HH1 ARG 103 34.645 5.408 9.820
813 HH21 ARG 103 2HH2 ARG 103 33.347 3.887 6.952
814 HH22 ARG 103 1HH2 ARG 103 34.670 3.932 8.068
815 H ALA 104 H ALA 104 31.190 8.544 13.971
816 HA ALA 104 HA ALA 104 32.964 6.813 15.289
817 HB1 ALA 104 1HB ALA 104 32.449 9.553 15.277
818 HB2 ALA 104 2HB ALA 104 32.215 9.046 16.950
819 HB3 ALA 104 3HB ALA 104 33.743 8.715 16.134
820 H GLY 105 H GLY 105 29.665 7.802 16.032
821 HA2 GLY 105 1HA GLY 105 28.120 6.587 17.297
822 HA3 GLY 105 2HA GLY 105 29.430 5.565 17.872
823 H CYS 106 H CYS 106 30.717 8.441 18.343
824 HA CYS 106 HA CYS 106 30.512 8.444 21.107
825 HB2 CYS 106 1HB CYS 106 31.476 10.683 21.038
826 HB3 CYS 106 2HB CYS 106 32.259 9.649 19.850
827 HG CYS 106 HG CYS 106 31.296 12.564 19.296
828 H GLU 107 H GLU 107 29.169 9.351 22.579
829 HA GLU 107 HA GLU 107 26.613 10.321 21.596
830 HB2 GLU 107 1HB GLU 107 26.643 8.635 23.373
831 HB3 GLU 107 2HB GLU 107 27.552 9.728 24.407
832 HG2 GLU 107 1HG GLU 107 25.690 11.255 24.502
833 HG3 GLU 107 2HG GLU 107 24.783 10.266 23.360
Start of MODEL 3
1 H1 MET 1 H MET 1 1.708 -0.817 1.228
2 HA MET 1 HA MET 1 1.764 0.701 -0.998
3 HB2 MET 1 1HB MET 1 3.613 -0.773 0.174
4 HB3 MET 1 2HB MET 1 3.246 -1.890 -1.134
5 HG2 MET 1 1HG MET 1 4.191 -0.580 -2.707
6 HG3 MET 1 2HG MET 1 3.712 0.915 -1.908
7 HE1 MET 1 3HE MET 1 6.249 1.440 -3.031
8 HE2 MET 1 1HE MET 1 5.738 2.429 -1.662
9 HE3 MET 1 2HE MET 1 7.380 1.789 -1.722
10 H ASP 2 H ASP 2 1.355 0.515 -3.176
11 HA ASP 2 HA ASP 2 -0.498 -1.622 -3.916
12 HB2 ASP 2 1HB ASP 2 -0.438 1.132 -4.431
13 HB3 ASP 2 2HB ASP 2 -0.066 0.367 -5.973
14 H ASN 3 H ASN 3 -0.235 -2.888 -5.773
15 HA ASN 3 HA ASN 3 2.407 -3.708 -6.323
16 HB2 ASN 3 1HB ASN 3 0.190 -5.029 -6.543
17 HB3 ASN 3 2HB ASN 3 0.086 -4.299 -8.142
18 HD21 ASN 3 2HD2 ASN 3 0.756 -5.612 -9.660
19 HD22 ASN 3 1HD2 ASN 3 2.065 -6.734 -9.540
20 H ARG 4 H ARG 4 0.275 -1.413 -7.845
21 HA ARG 4 HA ARG 4 1.683 -1.213 -10.311
22 HB2 ARG 4 1HB ARG 4 -0.292 0.587 -8.916
23 HB3 ARG 4 2HB ARG 4 0.426 1.004 -10.466
24 HG2 ARG 4 1HG ARG 4 -1.223 -1.451 -9.897
25 HG3 ARG 4 2HG ARG 4 -1.778 0.001 -10.733
26 HD2 ARG 4 1HD ARG 4 0.139 -0.420 -12.366
27 HD3 ARG 4 2HD ARG 4 0.252 -2.021 -11.636
28 HE ARG 4 HE ARG 4 -2.392 -1.315 -12.533
29 HH11 ARG 4 2HH1 ARG 4 0.667 -2.726 -13.411
30 HH12 ARG 4 1HH1 ARG 4 0.010 -3.658 -14.716
31 HH21 ARG 4 2HH2 ARG 4 -3.269 -2.537 -14.248
32 HH22 ARG 4 1HH2 ARG 4 -2.228 -3.549 -15.192
33 H VAL 5 H VAL 5 1.647 0.796 -7.373
34 HA VAL 5 HA VAL 5 3.658 2.586 -8.286
35 HB VAL 5 HB VAL 5 3.784 3.336 -5.935
36 HG11 VAL 5 1HG1 VAL 5 1.247 3.127 -7.446
37 HG12 VAL 5 2HG1 VAL 5 1.143 3.691 -5.777
38 HG13 VAL 5 3HG1 VAL 5 2.152 4.553 -6.939
39 HG21 VAL 5 3HG2 VAL 5 1.903 1.029 -5.461
40 HG22 VAL 5 1HG2 VAL 5 3.505 1.267 -4.763
41 HG23 VAL 5 2HG2 VAL 5 2.177 2.335 -4.308
42 H ARG 6 H ARG 6 3.696 -0.359 -6.350
43 HA ARG 6 HA ARG 6 6.332 -0.240 -5.430
44 HB2 ARG 6 1HB ARG 6 4.505 -1.874 -4.749
45 HB3 ARG 6 2HB ARG 6 4.902 -2.781 -6.202
46 HG2 ARG 6 1HG ARG 6 6.753 -3.654 -5.298
47 HG3 ARG 6 2HG ARG 6 7.209 -2.137 -4.520
48 HD2 ARG 6 1HD ARG 6 5.646 -2.536 -2.728
49 HD3 ARG 6 2HD ARG 6 5.032 -3.977 -3.537
50 HE ARG 6 HE ARG 6 7.351 -3.798 -1.898
51 HH11 ARG 6 2HH1 ARG 6 6.021 -5.420 -4.676
52 HH12 ARG 6 1HH1 ARG 6 6.999 -6.837 -4.480
53 HH21 ARG 6 2HH2 ARG 6 8.645 -5.657 -1.629
54 HH22 ARG 6 1HH2 ARG 6 8.491 -6.971 -2.746
55 H GLU 7 H GLU 7 5.001 -1.382 -8.486
56 HA GLU 7 HA GLU 7 7.321 -2.604 -9.494
57 HB2 GLU 7 1HB GLU 7 4.779 -2.406 -10.367
58 HB3 GLU 7 2HB GLU 7 5.542 -1.219 -11.416
59 HG2 GLU 7 1HG GLU 7 5.519 -3.303 -12.557
60 HG3 GLU 7 2HG GLU 7 7.183 -2.960 -12.089
61 H ALA 8 H ALA 8 6.113 0.717 -9.790
62 HA ALA 8 HA ALA 8 8.068 1.703 -11.524
63 HB1 ALA 8 1HB ALA 8 5.993 2.793 -9.844
64 HB2 ALA 8 2HB ALA 8 7.429 3.818 -9.827
65 HB3 ALA 8 3HB ALA 8 6.655 3.410 -11.358
66 H CYS 9 H CYS 9 8.096 1.257 -8.036
67 HA CYS 9 HA CYS 9 10.374 2.757 -7.418
68 HB2 CYS 9 1HB CYS 9 9.252 0.271 -6.113
69 HB3 CYS 9 2HB CYS 9 10.551 1.238 -5.425
70 HG CYS 9 HG CYS 9 7.975 1.688 -4.200
71 H GLN 10 H GLN 10 10.018 -0.488 -8.698
72 HA GLN 10 HA GLN 10 12.635 -1.405 -8.279
73 HB2 GLN 10 1HB GLN 10 10.478 -2.629 -9.140
74 HB3 GLN 10 2HB GLN 10 11.099 -2.187 -10.725
75 HG2 GLN 10 1HG GLN 10 12.811 -3.615 -8.727
76 HG3 GLN 10 2HG GLN 10 11.696 -4.487 -9.778
77 HE21 GLN 10 2HE2 GLN 10 14.702 -4.306 -9.564
78 HE22 GLN 10 1HE2 GLN 10 15.223 -3.988 -11.180
79 H TYR 11 H TYR 11 11.196 0.380 -10.976
80 HA TYR 11 HA TYR 11 13.533 0.367 -12.590
81 HB2 TYR 11 1HB TYR 11 11.439 0.743 -13.670
82 HB3 TYR 11 2HB TYR 11 11.054 2.089 -12.604
83 HD1 TYR 11 HD1 TYR 11 13.874 1.141 -14.879
84 HD2 TYR 11 HD2 TYR 11 11.162 4.158 -13.598
85 HE1 TYR 11 HE1 TYR 11 14.850 2.702 -16.510
86 HE2 TYR 11 HE2 TYR 11 12.130 5.728 -15.226
87 HH TYR 11 HH TYR 11 14.906 4.816 -17.230
88 H ILE 12 H ILE 12 12.140 2.735 -10.348
89 HA ILE 12 HA ILE 12 14.038 4.767 -10.766
90 HB ILE 12 HB ILE 12 12.467 4.189 -8.252
91 HG12 ILE 12 1HG1 ILE 12 11.783 6.135 -10.456
92 HG13 ILE 12 2HG1 ILE 12 11.158 4.490 -10.413
93 HG21 ILE 12 1HG2 ILE 12 14.281 5.699 -7.793
94 HG22 ILE 12 2HG2 ILE 12 13.876 6.677 -9.203
95 HG23 ILE 12 3HG2 ILE 12 12.774 6.615 -7.828
96 HD11 ILE 12 3HD1 ILE 12 9.535 6.029 -9.517
97 HD12 ILE 12 1HD1 ILE 12 10.122 4.964 -8.240
98 HD13 ILE 12 2HD1 ILE 12 10.708 6.625 -8.342
99 H SER 13 H SER 13 13.923 2.108 -8.425
100 HA SER 13 HA SER 13 16.174 2.797 -6.924
101 HB2 SER 13 1HB SER 13 14.972 0.094 -7.549
102 HB3 SER 13 2HB SER 13 16.277 0.331 -6.386
103 HG SER 13 HG SER 13 13.788 0.462 -5.835
104 H ASP 14 H ASP 14 15.887 0.898 -9.892
105 HA ASP 14 HA ASP 14 18.597 0.110 -10.038
106 HB2 ASP 14 1HB ASP 14 16.418 0.350 -12.108
107 HB3 ASP 14 2HB ASP 14 18.041 -0.200 -12.518
108 H HIS 15 H HIS 15 16.865 2.955 -11.151
109 HA HIS 15 HA HIS 15 19.292 4.005 -12.401
110 HB2 HIS 15 1HB HIS 15 16.391 4.758 -12.508
111 HB3 HIS 15 2HB HIS 15 17.620 5.933 -12.966
112 HD1 HIS 15 HD1 HIS 15 18.055 5.946 -15.389
113 HD2 HIS 15 HD2 HIS 15 16.908 2.180 -14.059
114 HE1 HIS 15 HE1 HIS 15 18.011 4.493 -17.441
115 H LEU 16 H LEU 16 18.638 3.748 -9.416
116 HA LEU 16 HA LEU 16 18.298 6.301 -8.312
117 HB2 LEU 16 1HB LEU 16 18.160 4.069 -7.140
118 HB3 LEU 16 2HB LEU 16 19.922 4.078 -7.098
119 HG LEU 16 HG LEU 16 19.688 6.305 -5.845
120 HD11 LEU 16 1HD1 LEU 16 17.206 5.596 -4.628
121 HD12 LEU 16 2HD1 LEU 16 16.967 5.788 -6.365
122 HD13 LEU 16 3HD1 LEU 16 17.666 7.103 -5.421
123 HD21 LEU 16 3HD2 LEU 16 20.064 3.787 -5.006
124 HD22 LEU 16 1HD2 LEU 16 18.568 4.161 -4.150
125 HD23 LEU 16 2HD2 LEU 16 19.995 5.170 -3.913
126 H ALA 17 H ALA 17 21.081 4.732 -9.676
127 HA ALA 17 HA ALA 17 22.928 6.707 -8.610
128 HB1 ALA 17 1HB ALA 17 24.207 5.147 -10.573
129 HB2 ALA 17 2HB ALA 17 24.356 5.023 -8.819
130 HB3 ALA 17 3HB ALA 17 23.148 4.062 -9.672
131 H ASP 18 H ASP 18 21.020 6.194 -11.418
132 HA ASP 18 HA ASP 18 22.555 7.638 -13.302
133 HB2 ASP 18 1HB ASP 18 19.722 6.728 -13.111
134 HB3 ASP 18 2HB ASP 18 20.109 7.970 -14.298
135 H SER 19 H SER 19 22.556 9.769 -13.892
136 HA SER 19 HA SER 19 21.706 11.648 -11.878
137 HB2 SER 19 1HB SER 19 23.881 11.872 -13.064
138 HB3 SER 19 2HB SER 19 23.002 12.182 -14.562
139 HG SER 19 HG SER 19 22.616 14.151 -13.921
140 H ASN 20 H ASN 20 21.014 11.156 -15.336
141 HA ASN 20 HA ASN 20 18.906 13.110 -15.330
142 HB2 ASN 20 1HB ASN 20 20.140 11.288 -17.333
143 HB3 ASN 20 2HB ASN 20 18.498 11.840 -17.648
144 HD21 ASN 20 2HD2 ASN 20 21.479 12.436 -18.514
145 HD22 ASN 20 1HD2 ASN 20 21.449 14.152 -18.709
146 H PHE 21 H PHE 21 17.101 12.674 -14.232
147 HA PHE 21 HA PHE 21 15.934 9.981 -14.479
148 HB2 PHE 21 1HB PHE 21 16.543 10.624 -12.172
149 HB3 PHE 21 2HB PHE 21 15.490 12.030 -12.297
150 HD1 PHE 21 HD2 PHE 21 14.948 8.511 -13.379
151 HD2 PHE 21 HD1 PHE 21 13.771 11.682 -10.794
152 HE1 PHE 21 HE2 PHE 21 13.054 7.157 -12.586
153 HE2 PHE 21 HE1 PHE 21 11.876 10.331 -9.996
154 HZ PHE 21 HZ PHE 21 11.514 8.066 -10.892
155 H ASP 22 H ASP 22 14.100 9.794 -15.576
156 HA ASP 22 HA ASP 22 12.501 12.224 -16.050
157 HB2 ASP 22 1HB ASP 22 13.606 11.323 -18.082
158 HB3 ASP 22 2HB ASP 22 12.752 9.801 -17.844
159 H ILE 23 H ILE 23 10.714 12.193 -14.864
160 HA ILE 23 HA ILE 23 9.617 9.996 -13.568
161 HB ILE 23 HB ILE 23 9.111 12.396 -13.065
162 HG12 ILE 23 1HG1 ILE 23 6.732 10.566 -13.453
163 HG13 ILE 23 2HG1 ILE 23 7.811 10.574 -12.062
164 HG21 ILE 23 1HG2 ILE 23 7.459 13.586 -14.296
165 HG22 ILE 23 2HG2 ILE 23 8.646 12.994 -15.456
166 HG23 ILE 23 3HG2 ILE 23 7.093 12.175 -15.288
167 HD11 ILE 23 3HD1 ILE 23 6.129 11.819 -11.212
168 HD12 ILE 23 1HD1 ILE 23 7.047 13.114 -11.982
169 HD13 ILE 23 2HD1 ILE 23 5.634 12.433 -12.789
170 H ALA 24 H ALA 24 9.246 11.056 -16.845
171 HA ALA 24 HA ALA 24 6.817 9.832 -17.510
172 HB1 ALA 24 1HB ALA 24 7.402 11.097 -19.268
173 HB2 ALA 24 2HB ALA 24 9.128 10.899 -18.965
174 HB3 ALA 24 3HB ALA 24 8.234 9.643 -19.821
175 H SER 25 H SER 25 10.125 8.568 -17.508
176 HA SER 25 HA SER 25 9.550 6.071 -18.667
177 HB2 SER 25 1HB SER 25 11.758 6.927 -16.786
178 HB3 SER 25 2HB SER 25 11.700 5.347 -17.567
179 HG SER 25 HG SER 25 11.917 6.321 -19.541
180 H VAL 26 H VAL 26 9.198 7.282 -15.422
181 HA VAL 26 HA VAL 26 8.986 4.794 -14.087
182 HB VAL 26 HB VAL 26 7.817 7.473 -13.322
183 HG11 VAL 26 1HG1 VAL 26 6.713 5.636 -12.160
184 HG12 VAL 26 2HG1 VAL 26 8.280 5.003 -11.653
185 HG13 VAL 26 3HG1 VAL 26 7.722 6.565 -11.052
186 HG21 VAL 26 3HG2 VAL 26 9.921 8.074 -12.926
187 HG22 VAL 26 1HG2 VAL 26 9.999 6.815 -11.694
188 HG23 VAL 26 2HG2 VAL 26 10.510 6.466 -13.345
189 H ALA 27 H ALA 27 6.510 7.056 -15.285
190 HA ALA 27 HA ALA 27 4.306 5.421 -14.587
191 HB1 ALA 27 1HB ALA 27 4.668 7.997 -15.591
192 HB2 ALA 27 2HB ALA 27 3.740 7.145 -16.826
193 HB3 ALA 27 3HB ALA 27 3.141 7.221 -15.169
194 H GLN 28 H GLN 28 6.156 5.829 -17.576
195 HA GLN 28 HA GLN 28 4.543 4.224 -19.223
196 HB2 GLN 28 1HB GLN 28 6.161 5.683 -20.221
197 HB3 GLN 28 2HB GLN 28 7.480 4.903 -19.357
198 HG2 GLN 28 1HG GLN 28 7.475 3.060 -20.733
199 HG3 GLN 28 2HG GLN 28 5.801 3.303 -21.228
200 HE21 GLN 28 2HE2 GLN 28 5.628 5.716 -22.200
201 HE22 GLN 28 1HE2 GLN 28 6.728 5.985 -23.504
202 H HIS 29 H HIS 29 7.200 3.446 -17.052
203 HA HIS 29 HA HIS 29 7.674 0.811 -17.839
204 HB2 HIS 29 1HB HIS 29 9.212 1.830 -16.336
205 HB3 HIS 29 2HB HIS 29 7.945 2.181 -15.165
206 HD1 HIS 29 HD1 HIS 29 8.516 -1.182 -16.793
207 HD2 HIS 29 HD2 HIS 29 8.882 0.659 -13.086
208 HE1 HIS 29 HE1 HIS 29 9.050 -3.030 -15.174
209 H VAL 30 H VAL 30 5.194 2.175 -15.764
210 HA VAL 30 HA VAL 30 4.151 -0.494 -15.166
211 HB VAL 30 HB VAL 30 2.603 0.662 -13.633
212 HG11 VAL 30 1HG1 VAL 30 4.725 1.839 -12.354
213 HG12 VAL 30 2HG1 VAL 30 4.296 0.129 -12.272
214 HG13 VAL 30 3HG1 VAL 30 5.512 0.680 -13.424
215 HG21 VAL 30 3HG2 VAL 30 2.626 2.983 -13.275
216 HG22 VAL 30 1HG2 VAL 30 4.122 3.193 -14.186
217 HG23 VAL 30 2HG2 VAL 30 2.624 2.799 -15.028
218 H CYS 31 H CYS 31 3.980 1.119 -17.788
219 HA CYS 31 HA CYS 31 2.475 1.516 -19.452
220 HB2 CYS 31 1HB CYS 31 1.251 -0.825 -18.007
221 HB3 CYS 31 2HB CYS 31 0.507 -0.147 -19.449
222 HG CYS 31 HG CYS 31 1.765 -1.938 -20.828
223 H LEU 32 H LEU 32 2.220 3.199 -17.177
224 HA LEU 32 HA LEU 32 -0.606 3.927 -17.449
225 HB2 LEU 32 1HB LEU 32 0.568 2.892 -15.103
226 HB3 LEU 32 2HB LEU 32 0.312 4.614 -14.828
227 HG LEU 32 HG LEU 32 -1.977 3.111 -15.944
228 HD11 LEU 32 1HD1 LEU 32 -1.701 1.449 -14.437
229 HD12 LEU 32 2HD1 LEU 32 -2.435 2.630 -13.352
230 HD13 LEU 32 3HD1 LEU 32 -0.683 2.426 -13.378
231 HD21 LEU 32 3HD2 LEU 32 -1.436 5.552 -14.525
232 HD22 LEU 32 1HD2 LEU 32 -2.657 4.602 -13.677
233 HD23 LEU 32 2HD2 LEU 32 -2.901 5.045 -15.366
234 H SER 33 H SER 33 -1.022 6.191 -16.744
235 HA SER 33 HA SER 33 0.942 7.926 -17.898
236 HB2 SER 33 1HB SER 33 -1.283 9.147 -16.384
237 HB3 SER 33 2HB SER 33 -0.740 9.450 -18.035
238 HG SER 33 HG SER 33 -2.738 8.461 -18.125
239 HA PRO 34 HA PRO 34 3.149 9.281 -14.357
240 HB2 PRO 34 1HB PRO 34 3.534 11.911 -14.910
241 HB3 PRO 34 2HB PRO 34 4.379 10.616 -15.766
242 HG2 PRO 34 1HG PRO 34 1.967 12.180 -16.602
243 HG3 PRO 34 2HG PRO 34 3.380 11.705 -17.562
244 HD2 PRO 34 1HD PRO 34 1.022 10.379 -17.685
245 HD3 PRO 34 2HD PRO 34 2.587 9.568 -17.903
246 H SER 35 H SER 35 0.451 11.395 -15.288
247 HA SER 35 HA SER 35 0.215 12.681 -12.774
248 HB2 SER 35 1HB SER 35 -1.765 12.336 -15.035
249 HB3 SER 35 2HB SER 35 -2.055 13.349 -13.621
250 HG SER 35 HG SER 35 -0.309 13.727 -15.763
251 H ARG 36 H ARG 36 -1.525 9.957 -14.246
252 HA ARG 36 HA ARG 36 -3.252 9.508 -12.050
253 HB2 ARG 36 1HB ARG 36 -3.212 8.605 -14.577
254 HB3 ARG 36 2HB ARG 36 -2.488 7.217 -13.776
255 HG2 ARG 36 1HG ARG 36 -5.081 8.431 -12.872
256 HG3 ARG 36 2HG ARG 36 -4.992 7.163 -14.096
257 HD2 ARG 36 1HD ARG 36 -3.659 5.828 -12.393
258 HD3 ARG 36 2HD ARG 36 -4.166 7.030 -11.208
259 HE ARG 36 HE ARG 36 -6.203 6.015 -11.145
260 HH11 ARG 36 2HH1 ARG 36 -4.636 5.163 -14.135
261 HH12 ARG 36 1HH1 ARG 36 -5.879 4.059 -14.623
262 HH21 ARG 36 2HH2 ARG 36 -7.847 4.565 -11.777
263 HH22 ARG 36 1HH2 ARG 36 -7.705 3.721 -13.282
264 H LEU 37 H LEU 37 -0.124 8.139 -12.975
265 HA LEU 37 HA LEU 37 -0.019 6.224 -10.883
266 HB2 LEU 37 1HB LEU 37 1.331 5.938 -12.846
267 HB3 LEU 37 2HB LEU 37 2.138 7.480 -12.568
268 HG LEU 37 HG LEU 37 2.930 6.347 -10.354
269 HD11 LEU 37 1HD1 LEU 37 1.758 4.117 -11.881
270 HD12 LEU 37 2HD1 LEU 37 2.013 4.300 -10.146
271 HD13 LEU 37 3HD1 LEU 37 3.354 3.826 -11.189
272 HD21 LEU 37 3HD2 LEU 37 3.996 6.602 -12.965
273 HD22 LEU 37 1HD2 LEU 37 4.503 5.037 -12.329
274 HD23 LEU 37 2HD2 LEU 37 4.862 6.512 -11.431
275 H SER 38 H SER 38 1.306 9.492 -11.252
276 HA SER 38 HA SER 38 2.736 9.597 -8.849
277 HB2 SER 38 1HB SER 38 2.627 12.044 -9.099
278 HB3 SER 38 2HB SER 38 3.003 11.264 -10.635
279 HG SER 38 HG SER 38 1.413 12.813 -10.962
280 H HIS 39 H HIS 39 -0.645 10.294 -9.569
281 HA HIS 39 HA HIS 39 -1.371 11.437 -7.121
282 HB2 HIS 39 1HB HIS 39 -2.848 11.534 -9.044
283 HB3 HIS 39 2HB HIS 39 -3.014 9.780 -9.045
284 HD1 HIS 39 HD1 HIS 39 -4.495 12.823 -7.681
285 HD2 HIS 39 HD2 HIS 39 -4.474 8.779 -6.729
286 HE1 HIS 39 HE1 HIS 39 -6.423 12.494 -6.100
287 H LEU 40 H LEU 40 -1.518 8.044 -8.180
288 HA LEU 40 HA LEU 40 -2.449 7.082 -5.663
289 HB2 LEU 40 1HB LEU 40 -1.036 5.465 -7.766
290 HB3 LEU 40 2HB LEU 40 -2.202 4.907 -6.567
291 HG LEU 40 HG LEU 40 -2.995 6.843 -8.718
292 HD11 LEU 40 1HD1 LEU 40 -3.774 4.155 -9.324
293 HD12 LEU 40 2HD1 LEU 40 -2.018 4.258 -9.203
294 HD13 LEU 40 3HD1 LEU 40 -2.888 5.313 -10.317
295 HD21 LEU 40 3HD2 LEU 40 -4.332 5.156 -6.689
296 HD22 LEU 40 1HD2 LEU 40 -5.125 5.296 -8.259
297 HD23 LEU 40 2HD2 LEU 40 -4.772 6.745 -7.317
298 H PHE 41 H PHE 41 0.695 7.571 -7.111
299 HA PHE 41 HA PHE 41 2.258 5.989 -5.423
300 HB2 PHE 41 1HB PHE 41 2.762 7.667 -7.526
301 HB3 PHE 41 2HB PHE 41 3.462 8.563 -6.182
302 HD1 PHE 41 HD1 PHE 41 5.356 7.683 -4.949
303 HD2 PHE 41 HD2 PHE 41 3.691 5.566 -8.246
304 HE1 PHE 41 HE1 PHE 41 7.366 6.268 -5.052
305 HE2 PHE 41 HE2 PHE 41 5.698 4.147 -8.352
306 HZ PHE 41 HZ PHE 41 7.538 4.496 -6.754
307 H ARG 42 H ARG 42 1.356 9.417 -5.106
308 HA ARG 42 HA ARG 42 2.650 9.784 -2.610
309 HB2 ARG 42 1HB ARG 42 1.500 11.446 -4.458
310 HB3 ARG 42 2HB ARG 42 0.328 11.503 -3.148
311 HG2 ARG 42 1HG ARG 42 2.644 11.820 -1.779
312 HG3 ARG 42 2HG ARG 42 3.038 12.607 -3.309
313 HD2 ARG 42 1HD ARG 42 0.412 13.234 -2.083
314 HD3 ARG 42 2HD ARG 42 1.849 13.888 -1.298
315 HE ARG 42 HE ARG 42 2.073 14.447 -4.007
316 HH11 ARG 42 2HH1 ARG 42 -0.037 15.253 -1.358
317 HH12 ARG 42 1HH1 ARG 42 -0.464 16.804 -1.999
318 HH21 ARG 42 2HH2 ARG 42 1.519 16.488 -4.862
319 HH22 ARG 42 1HH2 ARG 42 0.421 17.506 -3.993
320 H GLN 43 H GLN 43 -0.431 8.505 -3.537
321 HA GLN 43 HA GLN 43 -1.658 8.807 -0.957
322 HB2 GLN 43 1HB GLN 43 -2.409 7.264 -3.435
323 HB3 GLN 43 2HB GLN 43 -3.359 7.194 -1.957
324 HG2 GLN 43 1HG GLN 43 -2.705 9.826 -3.207
325 HG3 GLN 43 2HG GLN 43 -4.030 8.842 -3.827
326 HE21 GLN 43 2HE2 GLN 43 -5.386 7.909 -1.881
327 HE22 GLN 43 1HE2 GLN 43 -5.907 9.109 -0.753
328 H GLN 44 H GLN 44 -0.046 6.207 -2.725
329 HA GLN 44 HA GLN 44 -0.482 4.292 -0.613
330 HB2 GLN 44 1HB GLN 44 1.321 4.105 -3.031
331 HB3 GLN 44 2HB GLN 44 0.839 2.773 -1.989
332 HG2 GLN 44 1HG GLN 44 -1.217 4.403 -3.419
333 HG3 GLN 44 2HG GLN 44 -0.355 3.109 -4.249
334 HE21 GLN 44 2HE2 GLN 44 -3.131 3.164 -3.800
335 HE22 GLN 44 1HE2 GLN 44 -3.533 1.847 -2.758
336 H LEU 45 H LEU 45 2.182 6.279 -1.798
337 HA LEU 45 HA LEU 45 3.992 5.223 0.215
338 HB2 LEU 45 1HB LEU 45 4.314 6.344 -2.309
339 HB3 LEU 45 2HB LEU 45 4.927 7.570 -1.201
340 HG LEU 45 HG LEU 45 5.869 4.733 -0.997
341 HD11 LEU 45 1HD1 LEU 45 6.913 6.839 -2.883
342 HD12 LEU 45 2HD1 LEU 45 6.196 5.289 -3.320
343 HD13 LEU 45 3HD1 LEU 45 7.746 5.337 -2.481
344 HD21 LEU 45 3HD2 LEU 45 7.624 5.612 0.209
345 HD22 LEU 45 1HD2 LEU 45 6.306 6.685 0.677
346 HD23 LEU 45 2HD2 LEU 45 7.478 7.206 -0.533
347 H GLY 46 H GLY 46 1.746 7.763 -0.110
348 HA2 GLY 46 1HA GLY 46 1.111 9.417 1.355
349 HA3 GLY 46 2HA GLY 46 2.176 8.676 2.541
350 H ILE 47 H ILE 47 3.846 9.379 -0.284
351 HA ILE 47 HA ILE 47 4.497 12.116 0.454
352 HB ILE 47 HB ILE 47 6.861 11.756 0.673
353 HG12 ILE 47 1HG1 ILE 47 6.256 8.827 0.211
354 HG13 ILE 47 2HG1 ILE 47 7.106 9.896 -0.899
355 HG21 ILE 47 1HG2 ILE 47 5.542 11.532 2.703
356 HG22 ILE 47 2HG2 ILE 47 5.332 9.809 2.395
357 HG23 ILE 47 3HG2 ILE 47 6.935 10.453 2.749
358 HD11 ILE 47 3HD1 ILE 47 8.033 8.915 1.784
359 HD12 ILE 47 1HD1 ILE 47 8.730 8.573 0.200
360 HD13 ILE 47 2HD1 ILE 47 8.841 10.197 0.881
361 H SER 48 H SER 48 6.245 12.979 -1.098
362 HA SER 48 HA SER 48 5.321 12.470 -3.767
363 HB2 SER 48 1HB SER 48 7.265 14.168 -4.261
364 HB3 SER 48 2HB SER 48 5.793 14.722 -3.461
365 HG SER 48 HG SER 48 8.354 14.596 -2.517
366 H VAL 49 H VAL 49 6.546 11.737 -5.531
367 HA VAL 49 HA VAL 49 8.122 9.496 -5.122
368 HB VAL 49 HB VAL 49 8.250 11.287 -7.550
369 HG11 VAL 49 1HG1 VAL 49 9.987 9.607 -7.529
370 HG12 VAL 49 2HG1 VAL 49 8.805 8.346 -7.173
371 HG13 VAL 49 3HG1 VAL 49 8.766 9.179 -8.727
372 HG21 VAL 49 3HG2 VAL 49 6.172 9.392 -6.587
373 HG22 VAL 49 1HG2 VAL 49 6.001 10.900 -7.486
374 HG23 VAL 49 2HG2 VAL 49 6.522 9.433 -8.315
375 H LEU 50 H LEU 50 9.134 12.831 -5.792
376 HA LEU 50 HA LEU 50 11.891 12.355 -5.938
377 HB2 LEU 50 1HB LEU 50 10.146 14.695 -5.520
378 HB3 LEU 50 2HB LEU 50 11.806 14.864 -4.953
379 HG LEU 50 HG LEU 50 12.640 14.419 -7.192
380 HD11 LEU 50 1HD1 LEU 50 10.800 14.477 -9.032
381 HD12 LEU 50 2HD1 LEU 50 9.759 13.867 -7.746
382 HD13 LEU 50 3HD1 LEU 50 11.192 12.958 -8.226
383 HD21 LEU 50 3HD2 LEU 50 11.871 16.447 -8.277
384 HD22 LEU 50 1HD2 LEU 50 12.083 16.725 -6.548
385 HD23 LEU 50 2HD2 LEU 50 10.464 16.509 -7.213
386 H SER 51 H SER 51 9.750 12.803 -3.206
387 HA SER 51 HA SER 51 11.812 13.173 -1.267
388 HB2 SER 51 1HB SER 51 9.486 13.944 -0.909
389 HB3 SER 51 2HB SER 51 8.951 12.265 -0.864
390 HG SER 51 HG SER 51 9.302 13.126 1.233
391 H TRP 52 H TRP 52 9.835 10.403 -2.272
392 HA TRP 52 HA TRP 52 10.818 8.543 -0.432
393 HB2 TRP 52 1HB TRP 52 8.854 8.025 -1.713
394 HB3 TRP 52 2HB TRP 52 9.738 8.172 -3.229
395 HD1 TRP 52 HD1 TRP 52 9.574 5.859 -0.132
396 HE1 TRP 52 HE1 TRP 52 10.314 3.503 -0.857
397 HE3 TRP 52 HE3 TRP 52 10.915 6.879 -4.959
398 HZ2 TRP 52 HZ2 TRP 52 11.333 2.244 -3.169
399 HZ3 TRP 52 HZ3 TRP 52 11.764 5.043 -6.360
400 HH2 TRP 52 HH2 TRP 52 11.968 2.774 -5.481
401 H ARG 53 H ARG 53 11.965 9.380 -3.683
402 HA ARG 53 HA ARG 53 13.987 7.459 -3.883
403 HB2 ARG 53 1HB ARG 53 13.075 9.036 -5.687
404 HB3 ARG 53 2HB ARG 53 14.194 10.229 -5.044
405 HG2 ARG 53 1HG ARG 53 16.019 8.508 -5.422
406 HG3 ARG 53 2HG ARG 53 14.825 7.610 -6.363
407 HD2 ARG 53 1HD ARG 53 14.699 9.243 -8.002
408 HD3 ARG 53 2HD ARG 53 15.317 10.503 -6.934
409 HE ARG 53 HE ARG 53 17.243 8.451 -7.445
410 HH11 ARG 53 2HH1 ARG 53 15.811 11.361 -8.712
411 HH12 ARG 53 1HH1 ARG 53 17.188 11.772 -9.680
412 HH21 ARG 53 2HH2 ARG 53 19.062 8.983 -8.715
413 HH22 ARG 53 1HH2 ARG 53 19.036 10.419 -9.681
414 H GLU 54 H GLU 54 14.112 10.794 -2.661
415 HA GLU 54 HA GLU 54 16.870 10.773 -2.046
416 HB2 GLU 54 1HB GLU 54 15.245 12.774 -2.251
417 HB3 GLU 54 2HB GLU 54 14.848 12.439 -0.571
418 HG2 GLU 54 1HG GLU 54 17.248 12.685 -0.007
419 HG3 GLU 54 2HG GLU 54 17.552 13.157 -1.678
420 H ASP 55 H ASP 55 13.985 10.020 -0.148
421 HA ASP 55 HA ASP 55 15.177 9.738 2.357
422 HB2 ASP 55 1HB ASP 55 12.668 9.651 1.634
423 HB3 ASP 55 2HB ASP 55 12.955 7.920 1.489
424 H GLN 56 H GLN 56 14.707 7.340 -0.217
425 HA GLN 56 HA GLN 56 15.887 5.194 1.227
426 HB2 GLN 56 1HB GLN 56 15.423 5.569 -1.736
427 HB3 GLN 56 2HB GLN 56 15.958 4.066 -0.997
428 HG2 GLN 56 1HG GLN 56 13.443 5.371 -0.063
429 HG3 GLN 56 2HG GLN 56 13.451 4.423 -1.549
430 HE21 GLN 56 2HE2 GLN 56 14.606 2.242 -1.266
431 HE22 GLN 56 1HE2 GLN 56 14.166 1.345 0.144
432 H ARG 57 H ARG 57 17.110 7.594 -1.036
433 HA ARG 57 HA ARG 57 19.616 6.488 -1.561
434 HB2 ARG 57 1HB ARG 57 18.575 9.302 -1.515
435 HB3 ARG 57 2HB ARG 57 20.280 8.991 -1.809
436 HG2 ARG 57 1HG ARG 57 19.830 7.816 -3.798
437 HG3 ARG 57 2HG ARG 57 18.110 7.692 -3.424
438 HD2 ARG 57 1HD ARG 57 18.007 9.427 -4.883
439 HD3 ARG 57 2HD ARG 57 18.334 10.345 -3.413
440 HE ARG 57 HE ARG 57 20.805 9.794 -4.387
441 HH11 ARG 57 2HH1 ARG 57 17.943 11.245 -5.737
442 HH12 ARG 57 1HH1 ARG 57 18.818 12.267 -6.829
443 HH21 ARG 57 2HH2 ARG 57 21.969 11.136 -5.819
444 HH22 ARG 57 1HH2 ARG 57 21.108 12.204 -6.875
445 H ILE 58 H ILE 58 18.608 8.701 1.027
446 HA ILE 58 HA ILE 58 21.172 8.895 2.224
447 HB ILE 58 HB ILE 58 18.457 9.366 3.461
448 HG12 ILE 58 1HG1 ILE 58 18.864 10.784 1.504
449 HG13 ILE 58 2HG1 ILE 58 18.899 11.737 2.983
450 HG21 ILE 58 1HG2 ILE 58 21.102 9.373 4.582
451 HG22 ILE 58 2HG2 ILE 58 20.395 10.985 4.666
452 HG23 ILE 58 3HG2 ILE 58 19.548 9.613 5.380
453 HD11 ILE 58 3HD1 ILE 58 21.206 10.878 1.271
454 HD12 ILE 58 1HD1 ILE 58 20.676 12.514 1.661
455 HD13 ILE 58 2HD1 ILE 58 21.414 11.506 2.906
456 H SER 59 H SER 59 18.396 6.785 2.749
457 HA SER 59 HA SER 59 19.330 5.555 5.112
458 HB2 SER 59 1HB SER 59 17.530 4.095 4.896
459 HB3 SER 59 2HB SER 59 16.971 5.494 3.979
460 HG SER 59 HG SER 59 17.793 2.980 3.082
461 H GLN 60 H GLN 60 19.855 4.888 1.704
462 HA GLN 60 HA GLN 60 21.099 2.360 2.060
463 HB2 GLN 60 1HB GLN 60 20.098 3.286 -0.083
464 HB3 GLN 60 2HB GLN 60 21.558 4.254 -0.242
465 HG2 GLN 60 1HG GLN 60 21.696 2.242 -1.585
466 HG3 GLN 60 2HG GLN 60 22.907 2.229 -0.304
467 HE21 GLN 60 2HE2 GLN 60 23.075 0.437 0.833
468 HE22 GLN 60 1HE2 GLN 60 21.871 -0.792 0.978
469 H ALA 61 H ALA 61 22.305 5.670 1.852
470 HA ALA 61 HA ALA 61 25.053 5.045 1.755
471 HB1 ALA 61 1HB ALA 61 23.748 7.302 1.385
472 HB2 ALA 61 2HB ALA 61 24.133 7.540 3.090
473 HB3 ALA 61 3HB ALA 61 25.429 7.295 1.919
474 H LYS 62 H LYS 62 22.900 5.803 4.477
475 HA LYS 62 HA LYS 62 24.933 5.557 6.457
476 HB2 LYS 62 1HB LYS 62 23.090 5.630 8.068
477 HB3 LYS 62 2HB LYS 62 22.913 6.883 6.846
478 HG2 LYS 62 1HG LYS 62 21.274 5.486 5.669
479 HG3 LYS 62 2HG LYS 62 21.433 4.260 6.929
480 HD2 LYS 62 1HD LYS 62 19.466 5.627 7.328
481 HD3 LYS 62 2HD LYS 62 20.664 5.900 8.595
482 HE2 LYS 62 1HE LYS 62 21.199 8.013 7.811
483 HE3 LYS 62 2HE LYS 62 20.599 7.673 6.189
484 HZ1 LYS 62 3HZ LYS 62 19.253 8.922 8.281
485 HZ2 LYS 62 1HZ LYS 62 18.481 7.439 8.021
486 HZ3 LYS 62 2HZ LYS 62 18.655 8.536 6.746
487 H LEU 63 H LEU 63 22.642 3.350 4.992
488 HA LEU 63 HA LEU 63 22.929 1.245 6.867
489 HB2 LEU 63 1HB LEU 63 21.045 1.400 5.319
490 HB3 LEU 63 2HB LEU 63 22.138 1.151 3.959
491 HG LEU 63 HG LEU 63 22.001 -0.943 6.073
492 HD11 LEU 63 1HD1 LEU 63 20.056 -1.944 5.201
493 HD12 LEU 63 2HD1 LEU 63 19.998 -0.829 3.836
494 HD13 LEU 63 3HD1 LEU 63 19.641 -0.249 5.463
495 HD21 LEU 63 3HD2 LEU 63 21.951 -1.712 3.273
496 HD22 LEU 63 1HD2 LEU 63 23.081 -2.160 4.551
497 HD23 LEU 63 2HD2 LEU 63 23.310 -0.656 3.660
498 H LEU 64 H LEU 64 24.410 1.815 3.681
499 HA LEU 64 HA LEU 64 26.086 -0.477 3.792
500 HB2 LEU 64 1HB LEU 64 27.045 0.295 1.799
501 HB3 LEU 64 2HB LEU 64 25.358 0.802 1.733
502 HG LEU 64 HG LEU 64 26.403 3.042 2.723
503 HD11 LEU 64 1HD1 LEU 64 28.572 3.091 1.047
504 HD12 LEU 64 2HD1 LEU 64 28.688 1.494 1.787
505 HD13 LEU 64 3HD1 LEU 64 28.630 2.935 2.803
506 HD21 LEU 64 3HD2 LEU 64 26.264 3.955 0.551
507 HD22 LEU 64 1HD2 LEU 64 25.102 2.629 0.590
508 HD23 LEU 64 2HD2 LEU 64 26.660 2.412 -0.207
509 H LEU 65 H LEU 65 26.506 2.907 4.672
510 HA LEU 65 HA LEU 65 29.263 2.943 5.066
511 HB2 LEU 65 1HB LEU 65 26.962 4.497 6.104
512 HB3 LEU 65 2HB LEU 65 28.493 4.650 6.963
513 HG LEU 65 HG LEU 65 28.376 5.072 4.001
514 HD11 LEU 65 1HD1 LEU 65 26.918 6.738 4.312
515 HD12 LEU 65 2HD1 LEU 65 28.279 7.595 5.034
516 HD13 LEU 65 3HD1 LEU 65 27.135 6.732 6.062
517 HD21 LEU 65 3HD2 LEU 65 30.564 4.924 4.991
518 HD22 LEU 65 1HD2 LEU 65 30.127 6.102 6.229
519 HD23 LEU 65 2HD2 LEU 65 30.251 6.601 4.542
520 H SER 66 H SER 66 26.714 1.598 7.015
521 HA SER 66 HA SER 66 28.244 1.335 9.412
522 HB2 SER 66 1HB SER 66 25.598 0.366 8.441
523 HB3 SER 66 2HB SER 66 26.336 -0.489 9.796
524 HG SER 66 HG SER 66 24.946 1.659 9.977
525 H THR 67 H THR 67 27.934 -0.496 6.501
526 HA THR 67 HA THR 67 29.418 -2.734 7.707
527 HB THR 67 HB THR 67 27.348 -3.467 6.688
528 HG1 THR 67 HG1 THR 67 28.273 -4.946 5.161
529 HG21 THR 67 3HG2 THR 67 26.856 -1.750 5.125
530 HG22 THR 67 1HG2 THR 67 27.093 -3.220 4.180
531 HG23 THR 67 2HG2 THR 67 28.371 -2.007 4.259
532 H THR 68 H THR 68 30.057 0.022 6.170
533 HA THR 68 HA THR 68 32.393 -1.120 4.797
534 HB THR 68 HB THR 68 32.205 0.409 2.961
535 HG1 THR 68 HG1 THR 68 29.738 1.414 3.869
536 HG21 THR 68 3HG2 THR 68 30.752 -0.911 1.902
537 HG22 THR 68 1HG2 THR 68 29.400 -0.259 2.827
538 HG23 THR 68 2HG2 THR 68 30.337 -1.609 3.467
539 H ARG 69 H ARG 69 34.153 0.460 4.484
540 HA ARG 69 HA ARG 69 34.145 2.530 6.581
541 HB2 ARG 69 1HB ARG 69 35.606 0.340 6.829
542 HB3 ARG 69 2HB ARG 69 36.689 1.207 5.748
543 HG2 ARG 69 1HG ARG 69 37.492 1.778 7.831
544 HG3 ARG 69 2HG ARG 69 36.445 3.144 7.442
545 HD2 ARG 69 1HD ARG 69 35.891 2.609 9.647
546 HD3 ARG 69 2HD ARG 69 34.618 1.856 8.688
547 HE ARG 69 HE ARG 69 36.441 -0.124 8.964
548 HH11 ARG 69 2HH1 ARG 69 34.837 1.989 11.219
549 HH12 ARG 69 1HH1 ARG 69 34.862 0.839 12.514
550 HH21 ARG 69 2HH2 ARG 69 36.480 -1.646 10.662
551 HH22 ARG 69 1HH2 ARG 69 35.797 -1.228 12.197
552 H MET 70 H MET 70 33.698 2.474 3.549
553 HA MET 70 HA MET 70 35.880 3.839 2.358
554 HB2 MET 70 1HB MET 70 32.976 3.849 1.520
555 HB3 MET 70 2HB MET 70 34.349 4.295 0.517
556 HG2 MET 70 1HG MET 70 35.170 2.041 0.541
557 HG3 MET 70 2HG MET 70 33.926 1.560 1.692
558 HE1 MET 70 3HE MET 70 31.341 0.972 0.928
559 HE2 MET 70 1HE MET 70 31.405 2.735 0.948
560 HE3 MET 70 2HE MET 70 30.670 1.895 -0.418
561 HA PRO 71 HA PRO 71 35.345 7.978 3.721
562 HB2 PRO 71 1HB PRO 71 36.149 9.358 1.526
563 HB3 PRO 71 2HB PRO 71 37.270 8.477 2.571
564 HG2 PRO 71 1HG PRO 71 36.076 7.653 -0.047
565 HG3 PRO 71 2HG PRO 71 37.743 7.470 0.529
566 HD2 PRO 71 1HD PRO 71 35.957 5.435 0.566
567 HD3 PRO 71 2HD PRO 71 37.238 5.604 1.784
568 H ILE 72 H ILE 72 34.230 10.027 3.246
569 HA ILE 72 HA ILE 72 31.557 9.649 2.532
570 HB ILE 72 HB ILE 72 33.039 12.279 2.509
571 HG12 ILE 72 1HG1 ILE 72 33.433 11.145 4.624
572 HG13 ILE 72 2HG1 ILE 72 32.305 12.474 4.869
573 HG21 ILE 72 1HG2 ILE 72 30.741 12.199 1.505
574 HG22 ILE 72 2HG2 ILE 72 30.136 11.740 3.095
575 HG23 ILE 72 3HG2 ILE 72 30.921 13.302 2.869
576 HD11 ILE 72 3HD1 ILE 72 31.979 9.667 5.392
577 HD12 ILE 72 1HD1 ILE 72 30.981 11.031 5.895
578 HD13 ILE 72 2HD1 ILE 72 30.705 10.266 4.330
579 H ALA 73 H ALA 73 34.328 10.578 0.621
580 HA ALA 73 HA ALA 73 32.952 11.600 -1.623
581 HB1 ALA 73 1HB ALA 73 35.254 12.108 -1.417
582 HB2 ALA 73 2HB ALA 73 35.694 10.403 -1.315
583 HB3 ALA 73 3HB ALA 73 35.099 11.070 -2.835
584 H THR 74 H THR 74 34.219 8.359 -0.898
585 HA THR 74 HA THR 74 33.388 7.182 -3.335
586 HB THR 74 HB THR 74 33.948 5.875 -0.666
587 HG1 THR 74 HG1 THR 74 35.941 5.341 -1.978
588 HG21 THR 74 3HG2 THR 74 34.288 3.823 -2.005
589 HG22 THR 74 1HG2 THR 74 33.698 4.680 -3.428
590 HG23 THR 74 2HG2 THR 74 32.622 4.398 -2.059
591 H VAL 75 H VAL 75 31.951 7.178 -0.080
592 HA VAL 75 HA VAL 75 29.733 5.588 -0.614
593 HB VAL 75 HB VAL 75 29.774 7.949 1.268
594 HG11 VAL 75 1HG1 VAL 75 28.223 5.373 1.459
595 HG12 VAL 75 2HG1 VAL 75 28.061 6.807 2.475
596 HG13 VAL 75 3HG1 VAL 75 27.570 6.865 0.782
597 HG21 VAL 75 3HG2 VAL 75 30.240 5.522 2.637
598 HG22 VAL 75 1HG2 VAL 75 31.373 5.588 1.287
599 HG23 VAL 75 2HG2 VAL 75 31.325 6.901 2.463
600 H GLY 76 H GLY 76 30.186 9.070 -1.053
601 HA2 GLY 76 1HA GLY 76 27.565 9.790 -1.668
602 HA3 GLY 76 2HA GLY 76 28.998 10.607 -2.275
603 H ARG 77 H ARG 77 30.109 8.559 -3.811
604 HA ARG 77 HA ARG 77 28.778 8.876 -6.237
605 HB2 ARG 77 1HB ARG 77 30.893 6.978 -5.277
606 HB3 ARG 77 2HB ARG 77 30.208 6.792 -6.886
607 HG2 ARG 77 1HG ARG 77 30.965 8.955 -7.541
608 HG3 ARG 77 2HG ARG 77 31.449 9.343 -5.889
609 HD2 ARG 77 1HD ARG 77 33.161 7.629 -5.959
610 HD3 ARG 77 2HD ARG 77 32.639 7.140 -7.570
611 HE ARG 77 HE ARG 77 33.329 9.886 -7.536
612 HH11 ARG 77 2HH1 ARG 77 34.730 6.699 -7.493
613 HH12 ARG 77 1HH1 ARG 77 36.213 7.199 -8.237
614 HH21 ARG 77 2HH2 ARG 77 35.277 10.557 -8.515
615 HH22 ARG 77 1HH2 ARG 77 36.524 9.394 -8.817
616 H ASN 78 H ASN 78 28.494 6.385 -3.786
617 HA ASN 78 HA ASN 78 27.057 4.493 -5.297
618 HB2 ASN 78 1HB ASN 78 27.007 5.029 -2.319
619 HB3 ASN 78 2HB ASN 78 26.340 3.597 -3.096
620 HD21 ASN 78 2HD2 ASN 78 28.543 4.008 -1.130
621 HD22 ASN 78 1HD2 ASN 78 29.905 3.198 -1.817
622 H VAL 79 H VAL 79 26.084 7.389 -3.600
623 HA VAL 79 HA VAL 79 23.257 6.808 -4.102
624 HB VAL 79 HB VAL 79 22.768 8.745 -2.694
625 HG11 VAL 79 1HG1 VAL 79 23.550 7.851 -0.577
626 HG12 VAL 79 2HG1 VAL 79 23.083 6.537 -1.659
627 HG13 VAL 79 3HG1 VAL 79 24.789 6.911 -1.408
628 HG21 VAL 79 3HG2 VAL 79 24.444 10.068 -1.657
629 HG22 VAL 79 1HG2 VAL 79 25.730 9.001 -2.221
630 HG23 VAL 79 2HG2 VAL 79 24.846 10.002 -3.373
631 H GLY 80 H GLY 80 25.417 7.700 -6.092
632 HA2 GLY 80 1HA GLY 80 25.325 8.887 -8.067
633 HA3 GLY 80 2HA GLY 80 23.705 9.403 -7.623
634 H PHE 81 H PHE 81 25.774 10.097 -5.113
635 HA PHE 81 HA PHE 81 25.695 12.919 -5.731
636 HB2 PHE 81 1HB PHE 81 26.384 11.276 -3.336
637 HB3 PHE 81 2HB PHE 81 27.007 12.920 -3.429
638 HD1 PHE 81 HD2 PHE 81 23.741 11.558 -4.566
639 HD2 PHE 81 HD1 PHE 81 25.799 14.113 -1.854
640 HE1 PHE 81 HE2 PHE 81 21.587 12.415 -3.745
641 HE2 PHE 81 HE1 PHE 81 23.647 14.974 -1.028
642 HZ PHE 81 HZ PHE 81 21.538 14.126 -1.974
643 H ASP 82 H ASP 82 27.219 13.887 -6.879
644 HA ASP 82 HA ASP 82 29.799 12.645 -7.276
645 HB2 ASP 82 1HB ASP 82 28.439 15.081 -8.401
646 HB3 ASP 82 2HB ASP 82 30.155 14.793 -8.679
647 H ASP 83 H ASP 83 28.451 15.323 -5.485
648 HA ASP 83 HA ASP 83 31.113 16.233 -4.687
649 HB2 ASP 83 1HB ASP 83 28.361 17.388 -4.546
650 HB3 ASP 83 2HB ASP 83 29.563 17.934 -3.379
651 H GLN 84 H GLN 84 32.029 15.432 -2.928
652 HA GLN 84 HA GLN 84 30.751 13.673 -1.150
653 HB2 GLN 84 1HB GLN 84 32.796 13.859 0.207
654 HB3 GLN 84 2HB GLN 84 33.159 13.621 -1.497
655 HG2 GLN 84 1HG GLN 84 34.604 15.296 -1.168
656 HG3 GLN 84 2HG GLN 84 33.178 16.312 -1.373
657 HE21 GLN 84 2HE2 GLN 84 35.664 16.730 0.154
658 HE22 GLN 84 1HE2 GLN 84 35.161 17.064 1.773
659 H LEU 85 H LEU 85 31.464 17.124 -0.934
660 HA LEU 85 HA LEU 85 30.620 17.435 1.757
661 HB2 LEU 85 1HB LEU 85 31.226 19.249 -0.517
662 HB3 LEU 85 2HB LEU 85 30.308 19.901 0.839
663 HG LEU 85 HG LEU 85 33.046 18.645 1.032
664 HD11 LEU 85 1HD1 LEU 85 33.922 20.832 1.267
665 HD12 LEU 85 2HD1 LEU 85 32.312 21.547 1.329
666 HD13 LEU 85 3HD1 LEU 85 32.909 20.849 -0.177
667 HD21 LEU 85 3HD2 LEU 85 31.036 19.256 2.993
668 HD22 LEU 85 1HD2 LEU 85 32.473 20.245 3.257
669 HD23 LEU 85 2HD2 LEU 85 32.610 18.487 3.203
670 H TYR 86 H TYR 86 28.978 17.547 -1.334
671 HA TYR 86 HA TYR 86 26.595 18.782 -0.537
672 HB2 TYR 86 1HB TYR 86 27.057 18.484 -2.875
673 HB3 TYR 86 2HB TYR 86 27.138 16.735 -2.693
674 HD1 TYR 86 HD1 TYR 86 24.580 19.004 -1.250
675 HD2 TYR 86 HD2 TYR 86 25.448 16.040 -4.177
676 HE1 TYR 86 HE1 TYR 86 22.186 18.842 -1.787
677 HE2 TYR 86 HE2 TYR 86 23.056 15.871 -4.723
678 HH TYR 86 HH TYR 86 20.623 17.681 -2.902
679 H PHE 87 H PHE 87 27.587 15.389 -0.467
680 HA PHE 87 HA PHE 87 25.096 14.348 0.376
681 HB2 PHE 87 1HB PHE 87 26.676 12.840 -0.590
682 HB3 PHE 87 2HB PHE 87 27.913 13.284 0.582
683 HD1 PHE 87 HD2 PHE 87 24.348 12.216 0.875
684 HD2 PHE 87 HD1 PHE 87 28.406 11.517 1.952
685 HE1 PHE 87 HE2 PHE 87 23.641 10.354 2.319
686 HE2 PHE 87 HE1 PHE 87 27.705 9.653 3.397
687 HZ PHE 87 HZ PHE 87 25.320 9.071 3.583
688 H SER 88 H SER 88 27.998 15.347 2.147
689 HA SER 88 HA SER 88 27.069 14.609 4.710
690 HB2 SER 88 1HB SER 88 29.006 15.566 5.523
691 HB3 SER 88 2HB SER 88 29.467 15.319 3.839
692 HG SER 88 HG SER 88 28.919 17.673 5.213
693 H ARG 89 H ARG 89 26.783 17.564 2.818
694 HA ARG 89 HA ARG 89 25.765 19.228 4.844
695 HB2 ARG 89 1HB ARG 89 25.713 19.262 1.857
696 HB3 ARG 89 2HB ARG 89 24.660 20.367 2.731
697 HG2 ARG 89 1HG ARG 89 26.701 21.160 3.970
698 HG3 ARG 89 2HG ARG 89 27.659 20.220 2.824
699 HD2 ARG 89 1HD ARG 89 27.664 22.270 1.798
700 HD3 ARG 89 2HD ARG 89 26.248 21.534 1.048
701 HE ARG 89 HE ARG 89 25.193 22.804 3.175
702 HH11 ARG 89 2HH1 ARG 89 27.360 23.829 0.651
703 HH12 ARG 89 1HH1 ARG 89 26.818 25.474 0.674
704 HH21 ARG 89 2HH2 ARG 89 24.470 24.967 3.215
705 HH22 ARG 89 1HH2 ARG 89 25.175 26.121 2.133
706 H VAL 90 H VAL 90 24.075 17.320 2.356
707 HA VAL 90 HA VAL 90 21.474 17.946 3.325
708 HB VAL 90 HB VAL 90 22.368 15.665 1.556
709 HG11 VAL 90 1HG1 VAL 90 19.685 16.612 2.451
710 HG12 VAL 90 2HG1 VAL 90 19.869 15.937 0.831
711 HG13 VAL 90 3HG1 VAL 90 20.287 14.968 2.244
712 HG21 VAL 90 3HG2 VAL 90 22.824 17.406 0.188
713 HG22 VAL 90 1HG2 VAL 90 21.080 17.377 -0.073
714 HG23 VAL 90 2HG2 VAL 90 21.781 18.517 1.076
715 H PHE 91 H PHE 91 23.595 15.120 3.676
716 HA PHE 91 HA PHE 91 21.827 13.534 5.168
717 HB2 PHE 91 1HB PHE 91 23.943 12.745 4.082
718 HB3 PHE 91 2HB PHE 91 24.843 13.541 5.369
719 HD1 PHE 91 HD1 PHE 91 24.564 12.752 7.721
720 HD2 PHE 91 HD2 PHE 91 22.976 10.624 4.394
721 HE1 PHE 91 HE1 PHE 91 24.355 10.735 9.115
722 HE2 PHE 91 HE2 PHE 91 22.764 8.604 5.783
723 HZ PHE 91 HZ PHE 91 23.453 8.658 8.146
724 H LYS 92 H LYS 92 24.077 16.056 6.117
725 HA LYS 92 HA LYS 92 24.139 15.639 8.870
726 HB2 LYS 92 1HB LYS 92 25.637 17.219 7.853
727 HB3 LYS 92 2HB LYS 92 24.296 18.194 7.267
728 HG2 LYS 92 1HG LYS 92 23.692 18.713 9.600
729 HG3 LYS 92 2HG LYS 92 25.102 17.799 10.142
730 HD2 LYS 92 1HD LYS 92 26.237 19.716 9.996
731 HD3 LYS 92 2HD LYS 92 26.130 19.530 8.244
732 HE2 LYS 92 1HE LYS 92 23.926 20.743 8.366
733 HE3 LYS 92 2HE LYS 92 24.299 21.098 10.051
734 HZ1 LYS 92 3HZ LYS 92 25.679 22.052 7.621
735 HZ2 LYS 92 1HZ LYS 92 26.455 22.063 9.124
736 HZ3 LYS 92 2HZ LYS 92 25.037 22.956 8.899
737 H LYS 93 H LYS 93 21.847 17.506 6.913
738 HA LYS 93 HA LYS 93 20.284 18.320 9.175
739 HB2 LYS 93 1HB LYS 93 19.935 18.500 6.197
740 HB3 LYS 93 2HB LYS 93 18.613 18.914 7.279
741 HG2 LYS 93 1HG LYS 93 19.506 20.971 7.117
742 HG3 LYS 93 2HG LYS 93 20.571 20.371 8.390
743 HD2 LYS 93 1HD LYS 93 22.366 20.219 7.002
744 HD3 LYS 93 2HD LYS 93 21.379 19.822 5.593
745 HE2 LYS 93 1HE LYS 93 22.124 21.946 5.076
746 HE3 LYS 93 2HE LYS 93 20.555 22.277 5.809
747 HZ1 LYS 93 3HZ LYS 93 22.874 22.222 7.581
748 HZ2 LYS 93 1HZ LYS 93 21.497 23.203 7.631
749 HZ3 LYS 93 2HZ LYS 93 22.739 23.543 6.534
750 H CYS 94 H CYS 94 20.336 15.595 7.042
751 HA CYS 94 HA CYS 94 17.701 14.692 7.286
752 HB2 CYS 94 1HB CYS 94 19.416 13.787 5.705
753 HB3 CYS 94 2HB CYS 94 20.178 12.972 7.065
754 HG CYS 94 HG CYS 94 17.210 12.270 5.563
755 H THR 95 H THR 95 20.565 13.885 9.236
756 HA THR 95 HA THR 95 18.794 12.675 11.244
757 HB THR 95 HB THR 95 20.726 11.556 12.148
758 HG1 THR 95 HG1 THR 95 22.164 13.189 10.317
759 HG21 THR 95 3HG2 THR 95 20.785 11.388 9.132
760 HG22 THR 95 1HG2 THR 95 19.661 10.526 10.182
761 HG23 THR 95 2HG2 THR 95 21.386 10.168 10.255
762 H GLY 96 H GLY 96 20.503 15.499 10.596
763 HA2 GLY 96 1HA GLY 96 20.370 17.415 11.981
764 HA3 GLY 96 2HA GLY 96 20.158 16.363 13.373
765 H ALA 97 H ALA 97 22.550 14.864 11.893
766 HA ALA 97 HA ALA 97 24.693 16.634 12.833
767 HB1 ALA 97 1HB ALA 97 24.919 13.745 13.497
768 HB2 ALA 97 2HB ALA 97 25.591 15.152 14.321
769 HB3 ALA 97 3HB ALA 97 23.882 14.758 14.503
770 H SER 98 H SER 98 26.702 16.317 11.844
771 HA SER 98 HA SER 98 26.620 15.430 9.167
772 HB2 SER 98 1HB SER 98 28.628 16.585 10.983
773 HB3 SER 98 2HB SER 98 29.297 15.549 9.723
774 HG SER 98 HG SER 98 29.117 17.694 9.000
775 HA PRO 99 HA PRO 99 27.697 11.181 9.305
776 HB2 PRO 99 1HB PRO 99 29.487 10.942 7.278
777 HB3 PRO 99 2HB PRO 99 27.761 11.210 7.008
778 HG2 PRO 99 1HG PRO 99 30.013 13.182 6.965
779 HG3 PRO 99 2HG PRO 99 28.638 13.029 5.855
780 HD2 PRO 99 1HD PRO 99 28.712 14.871 7.839
781 HD3 PRO 99 2HD PRO 99 27.200 14.123 7.287
782 H SER 100 H SER 100 30.410 13.434 9.271
783 HA SER 100 HA SER 100 32.399 11.575 10.052
784 HB2 SER 100 1HB SER 100 33.713 13.612 10.666
785 HB3 SER 100 2HB SER 100 33.045 13.673 9.035
786 HG SER 100 HG SER 100 32.483 15.593 9.839
787 H GLU 101 H GLU 101 30.131 13.576 11.827
788 HA GLU 101 HA GLU 101 31.329 13.130 14.388
789 HB2 GLU 101 1HB GLU 101 29.881 15.094 13.819
790 HB3 GLU 101 2HB GLU 101 28.502 14.005 13.778
791 HG2 GLU 101 1HG GLU 101 28.275 14.688 15.907
792 HG3 GLU 101 2HG GLU 101 29.448 13.406 16.205
793 H PHE 102 H PHE 102 28.484 11.814 12.715
794 HA PHE 102 HA PHE 102 27.612 10.100 14.738
795 HB2 PHE 102 1HB PHE 102 26.482 10.739 12.498
796 HB3 PHE 102 2HB PHE 102 27.389 9.388 11.826
797 HD1 PHE 102 HD1 PHE 102 25.367 10.009 14.905
798 HD2 PHE 102 HD2 PHE 102 26.163 7.476 11.579
799 HE1 PHE 102 HE1 PHE 102 23.616 8.459 15.670
800 HE2 PHE 102 HE2 PHE 102 24.412 5.923 12.338
801 HZ PHE 102 HZ PHE 102 23.135 6.414 14.386
802 H ARG 103 H ARG 103 29.988 9.606 12.172
803 HA ARG 103 HA ARG 103 30.416 6.866 12.527
804 HB2 ARG 103 1HB ARG 103 31.265 8.248 10.623
805 HB3 ARG 103 2HB ARG 103 32.477 8.918 11.708
806 HG2 ARG 103 1HG ARG 103 33.345 6.623 12.071
807 HG3 ARG 103 2HG ARG 103 32.202 6.045 10.856
808 HD2 ARG 103 1HD ARG 103 33.314 7.084 9.124
809 HD3 ARG 103 2HD ARG 103 34.050 8.288 10.181
810 HE ARG 103 HE ARG 103 34.973 5.626 10.701
811 HH11 ARG 103 2HH1 ARG 103 35.394 8.434 8.687
812 HH12 ARG 103 1HH1 ARG 103 37.043 8.072 8.302
813 HH21 ARG 103 2HH2 ARG 103 37.144 5.138 10.201
814 HH22 ARG 103 1HH2 ARG 103 38.038 6.196 9.162
815 H ALA 104 H ALA 104 31.822 9.659 14.159
816 HA ALA 104 HA ALA 104 33.787 8.246 15.621
817 HB1 ALA 104 1HB ALA 104 32.497 10.930 15.924
818 HB2 ALA 104 2HB ALA 104 33.598 10.315 17.158
819 HB3 ALA 104 3HB ALA 104 34.162 10.532 15.501
820 H GLY 105 H GLY 105 30.378 8.741 16.091
821 HA2 GLY 105 1HA GLY 105 28.998 7.481 17.497
822 HA3 GLY 105 2HA GLY 105 30.427 6.889 18.331
823 H CYS 106 H CYS 106 30.461 10.245 17.935
824 HA CYS 106 HA CYS 106 30.000 10.615 20.776
825 HB2 CYS 106 1HB CYS 106 31.879 11.686 19.312
826 HB3 CYS 106 2HB CYS 106 30.630 12.844 18.869
827 HG CYS 106 HG CYS 106 32.523 12.782 21.536
828 H GLU 107 H GLU 107 28.208 11.424 21.661
829 HA GLU 107 HA GLU 107 25.976 11.964 21.762
830 HB2 GLU 107 1HB GLU 107 25.563 14.235 21.206
831 HB3 GLU 107 2HB GLU 107 27.256 14.142 21.669
832 HG2 GLU 107 1HG GLU 107 27.951 14.225 19.381
833 HG3 GLU 107 2HG GLU 107 26.283 14.108 18.824
Start of MODEL 4
1 H1 MET 1 H MET 1 1.135 -1.221 -0.233
2 HA MET 1 HA MET 1 2.691 0.514 -1.762
3 HB2 MET 1 1HB MET 1 4.292 -1.428 -0.602
4 HB3 MET 1 2HB MET 1 3.999 -2.051 -2.220
5 HG2 MET 1 1HG MET 1 5.872 -0.816 -2.592
6 HG3 MET 1 2HG MET 1 4.633 0.389 -2.932
7 HE1 MET 1 3HE MET 1 7.482 0.973 -2.558
8 HE2 MET 1 1HE MET 1 6.679 2.527 -2.332
9 HE3 MET 1 2HE MET 1 7.867 1.969 -1.154
10 H ASP 2 H ASP 2 1.760 0.566 -3.699
11 HA ASP 2 HA ASP 2 -0.147 -1.459 -4.434
12 HB2 ASP 2 1HB ASP 2 -0.104 1.182 -4.863
13 HB3 ASP 2 2HB ASP 2 0.638 0.657 -6.372
14 H ASN 3 H ASN 3 -0.107 -2.763 -6.285
15 HA ASN 3 HA ASN 3 2.276 -4.045 -6.873
16 HB2 ASN 3 1HB ASN 3 -0.334 -3.877 -8.370
17 HB3 ASN 3 2HB ASN 3 1.009 -4.849 -8.964
18 HD21 ASN 3 2HD2 ASN 3 1.983 -6.293 -7.191
19 HD22 ASN 3 1HD2 ASN 3 0.839 -7.173 -6.241
20 H ARG 4 H ARG 4 0.634 -1.474 -8.684
21 HA ARG 4 HA ARG 4 2.556 -1.377 -10.778
22 HB2 ARG 4 1HB ARG 4 0.209 0.214 -9.935
23 HB3 ARG 4 2HB ARG 4 1.421 1.077 -10.873
24 HG2 ARG 4 1HG ARG 4 0.013 0.309 -12.516
25 HG3 ARG 4 2HG ARG 4 1.240 -0.959 -12.480
26 HD2 ARG 4 1HD ARG 4 -1.020 -1.893 -12.567
27 HD3 ARG 4 2HD ARG 4 -0.194 -2.330 -11.072
28 HE ARG 4 HE ARG 4 -1.701 0.004 -10.649
29 HH11 ARG 4 2HH1 ARG 4 -2.123 -3.404 -11.217
30 HH12 ARG 4 1HH1 ARG 4 -3.629 -3.493 -10.365
31 HH21 ARG 4 2HH2 ARG 4 -3.683 -0.099 -9.525
32 HH22 ARG 4 1HH2 ARG 4 -4.516 -1.612 -9.404
33 H VAL 5 H VAL 5 2.098 0.441 -7.781
34 HA VAL 5 HA VAL 5 4.103 2.366 -8.201
35 HB VAL 5 HB VAL 5 3.097 1.236 -5.585
36 HG11 VAL 5 1HG1 VAL 5 3.937 3.946 -5.395
37 HG12 VAL 5 2HG1 VAL 5 4.578 2.531 -4.557
38 HG13 VAL 5 3HG1 VAL 5 5.243 3.009 -6.120
39 HG21 VAL 5 3HG2 VAL 5 1.441 2.313 -7.217
40 HG22 VAL 5 1HG2 VAL 5 1.478 2.926 -5.564
41 HG23 VAL 5 2HG2 VAL 5 2.269 3.827 -6.857
42 H ARG 6 H ARG 6 4.201 -0.874 -6.809
43 HA ARG 6 HA ARG 6 6.832 -0.770 -5.812
44 HB2 ARG 6 1HB ARG 6 4.883 -2.551 -5.546
45 HB3 ARG 6 2HB ARG 6 5.734 -3.333 -6.871
46 HG2 ARG 6 1HG ARG 6 7.224 -4.166 -5.468
47 HG3 ARG 6 2HG ARG 6 7.624 -2.550 -4.883
48 HD2 ARG 6 1HD ARG 6 6.264 -2.722 -3.068
49 HD3 ARG 6 2HD ARG 6 5.106 -3.760 -3.899
50 HE ARG 6 HE ARG 6 7.631 -5.030 -3.385
51 HH11 ARG 6 2HH1 ARG 6 4.491 -4.275 -2.086
52 HH12 ARG 6 1HH1 ARG 6 4.497 -5.590 -0.957
53 HH21 ARG 6 2HH2 ARG 6 7.652 -6.764 -1.903
54 HH22 ARG 6 1HH2 ARG 6 6.296 -7.005 -0.854
55 H GLU 7 H GLU 7 5.528 -1.603 -8.977
56 HA GLU 7 HA GLU 7 7.878 -2.647 -10.109
57 HB2 GLU 7 1HB GLU 7 5.391 -2.564 -10.980
58 HB3 GLU 7 2HB GLU 7 5.941 -1.095 -11.774
59 HG2 GLU 7 1HG GLU 7 7.833 -2.500 -12.721
60 HG3 GLU 7 2HG GLU 7 6.917 -3.902 -12.170
61 H ALA 8 H ALA 8 6.725 0.638 -9.702
62 HA ALA 8 HA ALA 8 8.489 1.943 -11.450
63 HB1 ALA 8 1HB ALA 8 6.690 3.215 -10.668
64 HB2 ALA 8 2HB ALA 8 7.037 2.835 -8.981
65 HB3 ALA 8 3HB ALA 8 8.100 3.920 -9.876
66 H CYS 9 H CYS 9 8.875 0.829 -8.139
67 HA CYS 9 HA CYS 9 11.225 2.189 -7.479
68 HB2 CYS 9 1HB CYS 9 9.982 1.035 -5.773
69 HB3 CYS 9 2HB CYS 9 10.196 -0.508 -6.590
70 HG CYS 9 HG CYS 9 12.568 -1.086 -5.675
71 H GLN 10 H GLN 10 10.697 -0.732 -9.343
72 HA GLN 10 HA GLN 10 13.372 -1.632 -9.404
73 HB2 GLN 10 1HB GLN 10 10.893 -2.189 -10.931
74 HB3 GLN 10 2HB GLN 10 12.409 -2.605 -11.718
75 HG2 GLN 10 1HG GLN 10 11.798 -3.503 -8.927
76 HG3 GLN 10 2HG GLN 10 11.231 -4.400 -10.334
77 HE21 GLN 10 2HE2 GLN 10 12.928 -4.996 -11.925
78 HE22 GLN 10 1HE2 GLN 10 14.470 -5.476 -11.312
79 H TYR 11 H TYR 11 11.508 0.425 -11.612
80 HA TYR 11 HA TYR 11 13.621 0.779 -13.478
81 HB2 TYR 11 1HB TYR 11 11.388 1.147 -14.238
82 HB3 TYR 11 2HB TYR 11 11.076 2.320 -12.964
83 HD1 TYR 11 HD1 TYR 11 13.772 1.913 -15.529
84 HD2 TYR 11 HD2 TYR 11 10.809 4.441 -13.817
85 HE1 TYR 11 HE1 TYR 11 14.456 3.728 -17.041
86 HE2 TYR 11 HE2 TYR 11 11.484 6.263 -15.325
87 HH TYR 11 HH TYR 11 13.564 5.765 -17.993
88 H ILE 12 H ILE 12 12.341 2.823 -10.865
89 HA ILE 12 HA ILE 12 14.114 4.969 -11.207
90 HB ILE 12 HB ILE 12 12.775 4.027 -8.669
91 HG12 ILE 12 1HG1 ILE 12 11.826 6.390 -10.197
92 HG13 ILE 12 2HG1 ILE 12 11.504 4.810 -10.901
93 HG21 ILE 12 1HG2 ILE 12 14.687 6.112 -9.147
94 HG22 ILE 12 2HG2 ILE 12 13.149 6.804 -8.633
95 HG23 ILE 12 3HG2 ILE 12 13.952 5.597 -7.629
96 HD11 ILE 12 3HD1 ILE 12 10.486 4.172 -8.685
97 HD12 ILE 12 1HD1 ILE 12 10.585 5.879 -8.254
98 HD13 ILE 12 2HD1 ILE 12 9.608 5.372 -9.632
99 H SER 13 H SER 13 14.360 2.025 -9.266
100 HA SER 13 HA SER 13 16.664 2.635 -7.827
101 HB2 SER 13 1HB SER 13 15.428 0.689 -7.215
102 HB3 SER 13 2HB SER 13 15.587 -0.003 -8.830
103 HG SER 13 HG SER 13 17.628 0.367 -6.897
104 H ASP 14 H ASP 14 16.312 1.198 -11.044
105 HA ASP 14 HA ASP 14 19.077 0.757 -11.475
106 HB2 ASP 14 1HB ASP 14 16.625 0.770 -13.163
107 HB3 ASP 14 2HB ASP 14 18.177 0.915 -13.985
108 H HIS 15 H HIS 15 17.096 3.560 -11.631
109 HA HIS 15 HA HIS 15 19.123 5.028 -13.161
110 HB2 HIS 15 1HB HIS 15 16.225 5.465 -12.589
111 HB3 HIS 15 2HB HIS 15 17.239 6.871 -12.898
112 HD1 HIS 15 HD1 HIS 15 16.975 7.561 -15.247
113 HD2 HIS 15 HD2 HIS 15 16.931 3.425 -14.851
114 HE1 HIS 15 HE1 HIS 15 16.753 6.664 -17.586
115 H LEU 16 H LEU 16 19.130 4.152 -10.221
116 HA LEU 16 HA LEU 16 18.912 6.401 -8.569
117 HB2 LEU 16 1HB LEU 16 19.137 4.003 -7.857
118 HB3 LEU 16 2HB LEU 16 20.858 4.129 -8.217
119 HG LEU 16 HG LEU 16 19.832 6.174 -6.372
120 HD11 LEU 16 1HD1 LEU 16 20.194 4.156 -4.596
121 HD12 LEU 16 2HD1 LEU 16 19.352 3.320 -5.900
122 HD13 LEU 16 3HD1 LEU 16 18.623 4.738 -5.147
123 HD21 LEU 16 3HD2 LEU 16 22.037 4.396 -5.614
124 HD22 LEU 16 1HD2 LEU 16 21.956 6.157 -5.652
125 HD23 LEU 16 2HD2 LEU 16 22.275 5.257 -7.135
126 H ALA 17 H ALA 17 21.464 5.337 -10.698
127 HA ALA 17 HA ALA 17 23.298 7.373 -9.692
128 HB1 ALA 17 1HB ALA 17 24.507 6.198 -11.877
129 HB2 ALA 17 2HB ALA 17 24.747 5.753 -10.187
130 HB3 ALA 17 3HB ALA 17 23.565 4.886 -11.168
131 H ASP 18 H ASP 18 21.030 6.875 -12.222
132 HA ASP 18 HA ASP 18 22.085 8.557 -14.210
133 HB2 ASP 18 1HB ASP 18 19.367 7.515 -13.547
134 HB3 ASP 18 2HB ASP 18 19.497 8.828 -14.713
135 H SER 19 H SER 19 21.576 10.713 -14.766
136 HA SER 19 HA SER 19 21.043 12.396 -12.431
137 HB2 SER 19 1HB SER 19 22.105 13.210 -15.145
138 HB3 SER 19 2HB SER 19 22.069 14.200 -13.686
139 HG SER 19 HG SER 19 23.555 12.793 -12.745
140 H ASN 20 H ASN 20 20.114 12.162 -15.861
141 HA ASN 20 HA ASN 20 17.953 14.030 -15.542
142 HB2 ASN 20 1HB ASN 20 18.545 12.161 -17.848
143 HB3 ASN 20 2HB ASN 20 17.452 13.541 -17.881
144 HD21 ASN 20 2HD2 ASN 20 18.239 15.396 -18.571
145 HD22 ASN 20 1HD2 ASN 20 19.914 15.799 -18.703
146 H PHE 21 H PHE 21 16.281 13.420 -14.315
147 HA PHE 21 HA PHE 21 15.164 10.726 -14.725
148 HB2 PHE 21 1HB PHE 21 15.961 11.230 -12.420
149 HB3 PHE 21 2HB PHE 21 14.794 12.545 -12.337
150 HD1 PHE 21 HD2 PHE 21 14.421 9.110 -13.710
151 HD2 PHE 21 HD1 PHE 21 13.262 11.913 -10.725
152 HE1 PHE 21 HE2 PHE 21 12.712 7.536 -12.902
153 HE2 PHE 21 HE1 PHE 21 11.551 10.343 -9.910
154 HZ PHE 21 HZ PHE 21 11.273 8.152 -11.000
155 H ASP 22 H ASP 22 13.262 10.581 -15.703
156 HA ASP 22 HA ASP 22 11.554 12.982 -15.806
157 HB2 ASP 22 1HB ASP 22 12.547 12.291 -17.993
158 HB3 ASP 22 2HB ASP 22 11.693 10.757 -17.850
159 H ILE 23 H ILE 23 9.879 12.759 -14.484
160 HA ILE 23 HA ILE 23 8.954 10.404 -13.345
161 HB ILE 23 HB ILE 23 8.413 12.698 -12.536
162 HG12 ILE 23 1HG1 ILE 23 6.039 10.880 -13.005
163 HG13 ILE 23 2HG1 ILE 23 7.204 10.732 -11.694
164 HG21 ILE 23 1HG2 ILE 23 6.146 12.764 -14.482
165 HG22 ILE 23 2HG2 ILE 23 6.868 14.081 -13.558
166 HG23 ILE 23 3HG2 ILE 23 7.727 13.399 -14.939
167 HD11 ILE 23 3HD1 ILE 23 4.822 12.279 -11.812
168 HD12 ILE 23 1HD1 ILE 23 5.932 12.047 -10.461
169 HD13 ILE 23 2HD1 ILE 23 6.200 13.361 -11.608
170 H ALA 24 H ALA 24 8.275 11.784 -16.452
171 HA ALA 24 HA ALA 24 5.844 10.519 -17.043
172 HB1 ALA 24 1HB ALA 24 6.202 11.990 -18.694
173 HB2 ALA 24 2HB ALA 24 7.957 11.877 -18.549
174 HB3 ALA 24 3HB ALA 24 7.068 10.664 -19.471
175 H SER 25 H SER 25 9.191 9.446 -17.481
176 HA SER 25 HA SER 25 8.618 7.063 -18.860
177 HB2 SER 25 1HB SER 25 10.961 7.582 -17.016
178 HB3 SER 25 2HB SER 25 10.882 6.389 -18.312
179 HG SER 25 HG SER 25 10.390 9.054 -18.971
180 H VAL 26 H VAL 26 8.573 7.882 -15.470
181 HA VAL 26 HA VAL 26 8.546 5.223 -14.462
182 HB VAL 26 HB VAL 26 7.503 7.753 -13.180
183 HG11 VAL 26 1HG1 VAL 26 8.252 5.110 -11.933
184 HG12 VAL 26 2HG1 VAL 26 7.713 6.554 -11.074
185 HG13 VAL 26 3HG1 VAL 26 6.609 5.708 -12.158
186 HG21 VAL 26 3HG2 VAL 26 10.190 6.720 -13.636
187 HG22 VAL 26 1HG2 VAL 26 9.661 8.334 -13.161
188 HG23 VAL 26 2HG2 VAL 26 9.861 7.076 -11.941
189 H ALA 27 H ALA 27 6.041 7.506 -15.427
190 HA ALA 27 HA ALA 27 3.838 6.015 -14.454
191 HB1 ALA 27 1HB ALA 27 4.067 8.507 -15.343
192 HB2 ALA 27 2HB ALA 27 3.485 7.755 -16.829
193 HB3 ALA 27 3HB ALA 27 2.529 7.644 -15.351
194 H GLN 28 H GLN 28 5.298 6.273 -17.689
195 HA GLN 28 HA GLN 28 3.551 4.498 -18.981
196 HB2 GLN 28 1HB GLN 28 5.320 4.325 -20.703
197 HB3 GLN 28 2HB GLN 28 4.981 5.988 -20.245
198 HG2 GLN 28 1HG GLN 28 6.959 5.966 -18.784
199 HG3 GLN 28 2HG GLN 28 7.312 4.324 -19.321
200 HE21 GLN 28 2HE2 GLN 28 8.138 3.984 -21.358
201 HE22 GLN 28 1HE2 GLN 28 8.728 5.265 -22.356
202 H HIS 29 H HIS 29 6.528 3.962 -17.183
203 HA HIS 29 HA HIS 29 7.009 1.304 -17.877
204 HB2 HIS 29 1HB HIS 29 8.693 2.478 -16.672
205 HB3 HIS 29 2HB HIS 29 7.589 2.848 -15.350
206 HD1 HIS 29 HD1 HIS 29 8.078 -0.584 -16.853
207 HD2 HIS 29 HD2 HIS 29 8.898 1.498 -13.353
208 HE1 HIS 29 HE1 HIS 29 8.930 -2.306 -15.231
209 H VAL 30 H VAL 30 4.783 2.699 -15.549
210 HA VAL 30 HA VAL 30 3.964 0.033 -14.657
211 HB VAL 30 HB VAL 30 2.648 1.177 -12.950
212 HG11 VAL 30 1HG1 VAL 30 4.563 2.357 -11.779
213 HG12 VAL 30 2HG1 VAL 30 4.857 0.691 -12.280
214 HG13 VAL 30 3HG1 VAL 30 5.519 2.027 -13.223
215 HG21 VAL 30 3HG2 VAL 30 2.648 3.575 -12.709
216 HG22 VAL 30 1HG2 VAL 30 3.719 3.751 -14.099
217 HG23 VAL 30 2HG2 VAL 30 2.073 3.161 -14.323
218 H CYS 31 H CYS 31 3.334 1.563 -17.293
219 HA CYS 31 HA CYS 31 1.583 1.817 -18.728
220 HB2 CYS 31 1HB CYS 31 0.363 -0.421 -17.101
221 HB3 CYS 31 2HB CYS 31 -0.027 0.005 -18.763
222 HG CYS 31 HG CYS 31 2.425 -1.910 -17.581
223 H LEU 32 H LEU 32 1.538 3.531 -16.460
224 HA LEU 32 HA LEU 32 -1.329 4.110 -16.384
225 HB2 LEU 32 1HB LEU 32 -0.347 2.860 -14.287
226 HB3 LEU 32 2HB LEU 32 0.240 4.470 -13.876
227 HG LEU 32 HG LEU 32 -2.090 5.296 -13.940
228 HD11 LEU 32 1HD1 LEU 32 -3.721 3.179 -13.693
229 HD12 LEU 32 2HD1 LEU 32 -2.562 2.532 -14.853
230 HD13 LEU 32 3HD1 LEU 32 -3.439 4.018 -15.218
231 HD21 LEU 32 3HD2 LEU 32 -1.368 4.836 -11.786
232 HD22 LEU 32 1HD2 LEU 32 -1.273 3.099 -12.079
233 HD23 LEU 32 2HD2 LEU 32 -2.846 3.880 -11.911
234 H SER 33 H SER 33 -1.808 6.328 -15.761
235 HA SER 33 HA SER 33 -0.032 8.170 -17.000
236 HB2 SER 33 1HB SER 33 -2.104 9.326 -15.265
237 HB3 SER 33 2HB SER 33 -1.807 9.572 -16.986
238 HG SER 33 HG SER 33 -3.549 8.401 -17.179
239 HA PRO 34 HA PRO 34 2.459 9.590 -13.680
240 HB2 PRO 34 1HB PRO 34 2.638 12.248 -14.200
241 HB3 PRO 34 2HB PRO 34 3.456 11.021 -15.175
242 HG2 PRO 34 1HG PRO 34 0.887 12.462 -15.709
243 HG3 PRO 34 2HG PRO 34 2.213 12.088 -16.826
244 HD2 PRO 34 1HD PRO 34 -0.069 10.632 -16.733
245 HD3 PRO 34 2HD PRO 34 1.505 9.916 -17.137
246 H SER 35 H SER 35 -0.435 11.565 -14.263
247 HA SER 35 HA SER 35 -0.468 12.782 -11.704
248 HB2 SER 35 1HB SER 35 -1.663 13.739 -13.627
249 HB3 SER 35 2HB SER 35 -2.744 12.346 -13.655
250 HG SER 35 HG SER 35 -3.881 13.289 -12.176
251 H ARG 36 H ARG 36 -2.207 9.997 -13.060
252 HA ARG 36 HA ARG 36 -3.644 9.407 -10.685
253 HB2 ARG 36 1HB ARG 36 -4.354 8.638 -12.919
254 HB3 ARG 36 2HB ARG 36 -2.944 7.590 -12.998
255 HG2 ARG 36 1HG ARG 36 -4.898 6.308 -12.409
256 HG3 ARG 36 2HG ARG 36 -3.776 6.350 -11.048
257 HD2 ARG 36 1HD ARG 36 -6.164 6.681 -10.416
258 HD3 ARG 36 2HD ARG 36 -5.096 7.996 -9.924
259 HE ARG 36 HE ARG 36 -6.286 8.517 -12.452
260 HH11 ARG 36 2HH1 ARG 36 -6.919 8.524 -9.029
261 HH12 ARG 36 1HH1 ARG 36 -8.147 9.742 -9.127
262 HH21 ARG 36 2HH2 ARG 36 -7.902 10.120 -12.594
263 HH22 ARG 36 1HH2 ARG 36 -8.707 10.648 -11.155
264 H LEU 37 H LEU 37 -0.599 8.235 -12.043
265 HA LEU 37 HA LEU 37 -0.154 6.232 -10.084
266 HB2 LEU 37 1HB LEU 37 0.988 6.062 -12.160
267 HB3 LEU 37 2HB LEU 37 1.678 7.674 -11.984
268 HG LEU 37 HG LEU 37 2.958 6.743 -9.992
269 HD11 LEU 37 1HD1 LEU 37 3.286 4.139 -10.564
270 HD12 LEU 37 2HD1 LEU 37 1.577 4.324 -10.958
271 HD13 LEU 37 3HD1 LEU 37 2.159 4.736 -9.346
272 HD21 LEU 37 3HD2 LEU 37 3.575 6.920 -12.638
273 HD22 LEU 37 1HD2 LEU 37 3.928 5.224 -12.303
274 HD23 LEU 37 2HD2 LEU 37 4.715 6.491 -11.362
275 H SER 38 H SER 38 0.957 9.581 -10.421
276 HA SER 38 HA SER 38 2.652 9.648 -8.196
277 HB2 SER 38 1HB SER 38 1.074 11.805 -9.597
278 HB3 SER 38 2HB SER 38 2.152 12.155 -8.246
279 HG SER 38 HG SER 38 3.751 10.921 -9.601
280 H HIS 39 H HIS 39 -0.821 10.195 -8.482
281 HA HIS 39 HA HIS 39 -1.306 11.169 -5.905
282 HB2 HIS 39 1HB HIS 39 -2.959 11.208 -7.752
283 HB3 HIS 39 2HB HIS 39 -3.138 9.462 -7.604
284 HD1 HIS 39 HD1 HIS 39 -4.566 12.555 -6.440
285 HD2 HIS 39 HD2 HIS 39 -4.143 8.717 -4.906
286 HE1 HIS 39 HE1 HIS 39 -6.241 12.389 -4.571
287 H LEU 40 H LEU 40 -1.412 7.833 -7.136
288 HA LEU 40 HA LEU 40 -1.999 6.691 -4.591
289 HB2 LEU 40 1HB LEU 40 -0.790 5.314 -6.979
290 HB3 LEU 40 2HB LEU 40 -1.675 4.568 -5.649
291 HG LEU 40 HG LEU 40 -2.899 6.465 -7.649
292 HD11 LEU 40 1HD1 LEU 40 -3.197 4.787 -9.071
293 HD12 LEU 40 2HD1 LEU 40 -3.793 3.727 -7.795
294 HD13 LEU 40 3HD1 LEU 40 -2.061 3.850 -8.101
295 HD21 LEU 40 3HD2 LEU 40 -4.340 6.561 -5.885
296 HD22 LEU 40 1HD2 LEU 40 -3.884 4.968 -5.280
297 HD23 LEU 40 2HD2 LEU 40 -4.954 5.107 -6.676
298 H PHE 41 H PHE 41 0.929 7.441 -6.342
299 HA PHE 41 HA PHE 41 2.747 5.860 -4.922
300 HB2 PHE 41 1HB PHE 41 2.928 7.649 -6.988
301 HB3 PHE 41 2HB PHE 41 3.743 8.516 -5.690
302 HD1 PHE 41 HD2 PHE 41 5.783 7.627 -4.691
303 HD2 PHE 41 HD1 PHE 41 3.870 5.669 -7.950
304 HE1 PHE 41 HE2 PHE 41 7.823 6.312 -5.094
305 HE2 PHE 41 HE1 PHE 41 5.906 4.350 -8.358
306 HZ PHE 41 HZ PHE 41 7.887 4.671 -6.930
307 H ARG 42 H ARG 42 1.747 9.228 -4.357
308 HA ARG 42 HA ARG 42 3.293 9.548 -2.000
309 HB2 ARG 42 1HB ARG 42 1.088 11.071 -3.321
310 HB3 ARG 42 2HB ARG 42 1.501 11.459 -1.656
311 HG2 ARG 42 1HG ARG 42 3.321 12.575 -2.270
312 HG3 ARG 42 2HG ARG 42 3.851 11.273 -3.338
313 HD2 ARG 42 1HD ARG 42 3.468 12.825 -4.936
314 HD3 ARG 42 2HD ARG 42 1.813 12.235 -4.788
315 HE ARG 42 HE ARG 42 2.129 14.288 -2.941
316 HH11 ARG 42 2HH1 ARG 42 2.187 13.863 -6.396
317 HH12 ARG 42 1HH1 ARG 42 1.636 15.470 -6.734
318 HH21 ARG 42 2HH2 ARG 42 1.403 16.407 -3.373
319 HH22 ARG 42 1HH2 ARG 42 1.192 16.917 -5.014
320 H GLN 43 H GLN 43 0.179 8.184 -2.650
321 HA GLN 43 HA GLN 43 -0.776 8.338 0.056
322 HB2 GLN 43 1HB GLN 43 -2.229 8.230 -2.017
323 HB3 GLN 43 2HB GLN 43 -1.797 6.529 -2.132
324 HG2 GLN 43 1HG GLN 43 -3.796 6.421 -1.022
325 HG3 GLN 43 2HG GLN 43 -2.651 6.422 0.319
326 HE21 GLN 43 2HE2 GLN 43 -2.491 8.225 1.633
327 HE22 GLN 43 1HE2 GLN 43 -3.671 9.486 1.625
328 H GLN 44 H GLN 44 0.721 5.871 -1.983
329 HA GLN 44 HA GLN 44 0.584 3.863 0.082
330 HB2 GLN 44 1HB GLN 44 2.012 3.891 -2.581
331 HB3 GLN 44 2HB GLN 44 1.914 2.497 -1.514
332 HG2 GLN 44 1HG GLN 44 -0.558 3.857 -2.508
333 HG3 GLN 44 2HG GLN 44 0.284 2.657 -3.486
334 HE21 GLN 44 2HE2 GLN 44 -2.370 2.476 -2.445
335 HE22 GLN 44 1HE2 GLN 44 -2.413 1.109 -1.390
336 H LEU 45 H LEU 45 3.033 5.992 -1.303
337 HA LEU 45 HA LEU 45 5.089 4.930 0.455
338 HB2 LEU 45 1HB LEU 45 5.097 6.147 -2.041
339 HB3 LEU 45 2HB LEU 45 5.776 7.363 -0.960
340 HG LEU 45 HG LEU 45 6.845 4.563 -0.977
341 HD11 LEU 45 1HD1 LEU 45 8.527 5.295 -2.612
342 HD12 LEU 45 2HD1 LEU 45 7.638 6.801 -2.835
343 HD13 LEU 45 3HD1 LEU 45 6.900 5.266 -3.293
344 HD21 LEU 45 3HD2 LEU 45 8.688 5.469 0.078
345 HD22 LEU 45 1HD2 LEU 45 7.373 6.431 0.752
346 HD23 LEU 45 2HD2 LEU 45 8.377 7.092 -0.539
347 H GLY 46 H GLY 46 2.741 7.399 0.479
348 HA2 GLY 46 1HA GLY 46 2.214 8.966 2.077
349 HA3 GLY 46 2HA GLY 46 3.434 8.227 3.103
350 H ILE 47 H ILE 47 4.763 9.087 0.152
351 HA ILE 47 HA ILE 47 5.379 11.828 0.904
352 HB ILE 47 HB ILE 47 7.769 11.558 0.864
353 HG12 ILE 47 1HG1 ILE 47 7.226 8.615 0.412
354 HG13 ILE 47 2HG1 ILE 47 7.913 9.733 -0.762
355 HG21 ILE 47 1HG2 ILE 47 8.105 10.243 2.898
356 HG22 ILE 47 2HG2 ILE 47 6.660 11.246 3.012
357 HG23 ILE 47 3HG2 ILE 47 6.511 9.518 2.693
358 HD11 ILE 47 3HD1 ILE 47 9.681 8.436 0.151
359 HD12 ILE 47 1HD1 ILE 47 9.826 10.071 0.796
360 HD13 ILE 47 2HD1 ILE 47 9.160 8.782 1.800
361 H SER 48 H SER 48 6.969 12.774 -0.790
362 HA SER 48 HA SER 48 5.780 12.329 -3.364
363 HB2 SER 48 1HB SER 48 7.834 14.235 -2.283
364 HB3 SER 48 2HB SER 48 7.592 14.087 -4.023
365 HG SER 48 HG SER 48 5.866 15.073 -2.055
366 H VAL 49 H VAL 49 6.785 11.606 -5.245
367 HA VAL 49 HA VAL 49 8.472 9.417 -5.051
368 HB VAL 49 HB VAL 49 8.239 11.214 -7.467
369 HG11 VAL 49 1HG1 VAL 49 10.018 9.539 -7.600
370 HG12 VAL 49 2HG1 VAL 49 8.851 8.269 -7.226
371 HG13 VAL 49 3HG1 VAL 49 8.712 9.181 -8.729
372 HG21 VAL 49 3HG2 VAL 49 6.087 10.674 -7.579
373 HG22 VAL 49 1HG2 VAL 49 6.543 8.974 -7.696
374 HG23 VAL 49 2HG2 VAL 49 6.225 9.696 -6.118
375 H LEU 50 H LEU 50 9.278 12.792 -5.775
376 HA LEU 50 HA LEU 50 12.011 12.407 -6.289
377 HB2 LEU 50 1HB LEU 50 10.385 14.497 -6.512
378 HB3 LEU 50 2HB LEU 50 11.117 14.907 -4.962
379 HG LEU 50 HG LEU 50 12.240 16.039 -6.805
380 HD11 LEU 50 1HD1 LEU 50 13.424 14.846 -4.723
381 HD12 LEU 50 2HD1 LEU 50 14.305 15.792 -5.922
382 HD13 LEU 50 3HD1 LEU 50 14.268 14.033 -6.041
383 HD21 LEU 50 3HD2 LEU 50 12.521 15.025 -8.757
384 HD22 LEU 50 1HD2 LEU 50 11.965 13.499 -8.071
385 HD23 LEU 50 2HD2 LEU 50 13.675 13.923 -8.006
386 H SER 51 H SER 51 10.220 12.804 -3.304
387 HA SER 51 HA SER 51 12.507 13.208 -1.643
388 HB2 SER 51 1HB SER 51 9.637 12.473 -1.074
389 HB3 SER 51 2HB SER 51 10.843 12.593 0.207
390 HG SER 51 HG SER 51 9.477 14.553 -0.966
391 H TRP 52 H TRP 52 10.485 10.405 -2.431
392 HA TRP 52 HA TRP 52 11.691 8.554 -0.722
393 HB2 TRP 52 1HB TRP 52 9.621 7.995 -1.797
394 HB3 TRP 52 2HB TRP 52 10.335 8.186 -3.396
395 HD1 TRP 52 HD1 TRP 52 10.605 5.839 -0.327
396 HE1 TRP 52 HE1 TRP 52 11.304 3.509 -1.168
397 HE3 TRP 52 HE3 TRP 52 11.288 6.932 -5.275
398 HZ2 TRP 52 HZ2 TRP 52 12.046 2.295 -3.606
399 HZ3 TRP 52 HZ3 TRP 52 11.993 5.130 -6.794
400 HH2 TRP 52 HH2 TRP 52 12.365 2.860 -5.975
401 H ARG 53 H ARG 53 12.522 9.514 -4.025
402 HA ARG 53 HA ARG 53 14.511 7.621 -4.523
403 HB2 ARG 53 1HB ARG 53 13.579 9.103 -6.250
404 HB3 ARG 53 2HB ARG 53 14.366 10.481 -5.493
405 HG2 ARG 53 1HG ARG 53 16.528 9.032 -5.858
406 HG3 ARG 53 2HG ARG 53 15.535 8.276 -7.105
407 HD2 ARG 53 1HD ARG 53 15.041 10.826 -7.689
408 HD3 ARG 53 2HD ARG 53 16.625 11.030 -6.943
409 HE ARG 53 HE ARG 53 17.547 10.150 -8.829
410 HH11 ARG 53 2HH1 ARG 53 14.233 9.103 -8.633
411 HH12 ARG 53 1HH1 ARG 53 14.260 8.298 -10.168
412 HH21 ARG 53 2HH2 ARG 53 17.596 9.094 -10.850
413 HH22 ARG 53 1HH2 ARG 53 16.174 8.293 -11.427
414 H GLU 54 H GLU 54 14.772 10.864 -3.091
415 HA GLU 54 HA GLU 54 17.572 10.785 -2.715
416 HB2 GLU 54 1HB GLU 54 15.341 12.457 -1.635
417 HB3 GLU 54 2HB GLU 54 16.926 12.563 -0.883
418 HG2 GLU 54 1HG GLU 54 17.868 13.055 -3.150
419 HG3 GLU 54 2HG GLU 54 16.210 13.168 -3.737
420 H ASP 55 H ASP 55 14.847 9.879 -0.667
421 HA ASP 55 HA ASP 55 16.350 9.380 1.678
422 HB2 ASP 55 1HB ASP 55 13.745 9.603 1.267
423 HB3 ASP 55 2HB ASP 55 13.847 7.851 1.113
424 H GLN 56 H GLN 56 15.507 7.416 -1.106
425 HA GLN 56 HA GLN 56 16.302 4.922 -0.027
426 HB2 GLN 56 1HB GLN 56 15.693 5.983 -2.737
427 HB3 GLN 56 2HB GLN 56 16.622 4.493 -2.646
428 HG2 GLN 56 1HG GLN 56 14.053 4.823 -1.144
429 HG3 GLN 56 2HG GLN 56 14.079 4.329 -2.837
430 HE21 GLN 56 2HE2 GLN 56 15.776 2.522 -3.229
431 HE22 GLN 56 1HE2 GLN 56 15.699 1.200 -2.121
432 H ARG 57 H ARG 57 17.985 7.316 -2.033
433 HA ARG 57 HA ARG 57 20.403 5.822 -2.208
434 HB2 ARG 57 1HB ARG 57 21.374 7.956 -3.042
435 HB3 ARG 57 2HB ARG 57 19.910 7.476 -3.890
436 HG2 ARG 57 1HG ARG 57 18.629 9.057 -2.479
437 HG3 ARG 57 2HG ARG 57 20.152 9.594 -1.766
438 HD2 ARG 57 1HD ARG 57 19.282 11.030 -3.630
439 HD3 ARG 57 2HD ARG 57 20.927 10.434 -3.849
440 HE ARG 57 HE ARG 57 18.989 8.727 -5.066
441 HH11 ARG 57 2HH1 ARG 57 20.789 11.678 -5.480
442 HH12 ARG 57 1HH1 ARG 57 20.726 11.628 -7.210
443 HH21 ARG 57 2HH2 ARG 57 18.900 8.649 -7.344
444 HH22 ARG 57 1HH2 ARG 57 19.650 9.905 -8.270
445 H ILE 58 H ILE 58 19.306 8.489 -0.151
446 HA ILE 58 HA ILE 58 21.741 8.857 1.228
447 HB ILE 58 HB ILE 58 18.899 9.508 1.993
448 HG12 ILE 58 1HG1 ILE 58 19.947 10.747 0.094
449 HG13 ILE 58 2HG1 ILE 58 19.516 11.779 1.452
450 HG21 ILE 58 1HG2 ILE 58 21.337 9.563 3.608
451 HG22 ILE 58 2HG2 ILE 58 20.455 11.089 3.582
452 HG23 ILE 58 3HG2 ILE 58 19.645 9.612 4.103
453 HD11 ILE 58 3HD1 ILE 58 21.965 11.638 0.161
454 HD12 ILE 58 1HD1 ILE 58 21.607 12.468 1.675
455 HD13 ILE 58 2HD1 ILE 58 22.218 10.813 1.699
456 H SER 59 H SER 59 18.892 6.870 1.911
457 HA SER 59 HA SER 59 19.818 5.939 4.434
458 HB2 SER 59 1HB SER 59 17.428 5.921 3.773
459 HB3 SER 59 2HB SER 59 17.787 4.674 2.578
460 HG SER 59 HG SER 59 17.570 3.291 4.129
461 H GLN 60 H GLN 60 20.215 4.865 1.133
462 HA GLN 60 HA GLN 60 21.209 2.270 1.746
463 HB2 GLN 60 1HB GLN 60 20.259 2.947 -0.464
464 HB3 GLN 60 2HB GLN 60 21.703 3.911 -0.743
465 HG2 GLN 60 1HG GLN 60 21.713 1.691 -1.857
466 HG3 GLN 60 2HG GLN 60 23.084 1.977 -0.786
467 HE21 GLN 60 2HE2 GLN 60 23.265 0.811 1.112
468 HE22 GLN 60 1HE2 GLN 60 22.321 -0.601 1.428
469 H ALA 61 H ALA 61 22.707 5.415 1.207
470 HA ALA 61 HA ALA 61 25.388 4.492 1.179
471 HB1 ALA 61 1HB ALA 61 24.021 7.093 1.275
472 HB2 ALA 61 2HB ALA 61 25.630 7.059 1.999
473 HB3 ALA 61 3HB ALA 61 25.408 6.570 0.319
474 H LYS 62 H LYS 62 23.337 5.858 3.736
475 HA LYS 62 HA LYS 62 25.348 5.699 5.751
476 HB2 LYS 62 1HB LYS 62 23.642 6.353 7.286
477 HB3 LYS 62 2HB LYS 62 23.361 7.239 5.793
478 HG2 LYS 62 1HG LYS 62 21.664 5.494 5.190
479 HG3 LYS 62 2HG LYS 62 21.851 4.852 6.823
480 HD2 LYS 62 1HD LYS 62 21.048 7.685 6.162
481 HD3 LYS 62 2HD LYS 62 19.927 6.394 6.600
482 HE2 LYS 62 1HE LYS 62 22.183 7.402 8.332
483 HE3 LYS 62 2HE LYS 62 20.490 7.865 8.502
484 HZ1 LYS 62 3HZ LYS 62 21.787 5.634 9.578
485 HZ2 LYS 62 1HZ LYS 62 20.642 5.070 8.468
486 HZ3 LYS 62 2HZ LYS 62 20.163 6.077 9.739
487 H LEU 63 H LEU 63 22.832 3.555 4.599
488 HA LEU 63 HA LEU 63 22.720 1.753 6.725
489 HB2 LEU 63 1HB LEU 63 21.102 1.646 4.976
490 HB3 LEU 63 2HB LEU 63 22.348 1.352 3.766
491 HG LEU 63 HG LEU 63 22.095 -0.653 5.930
492 HD11 LEU 63 1HD1 LEU 63 20.230 -1.769 4.797
493 HD12 LEU 63 2HD1 LEU 63 20.057 -0.379 3.725
494 HD13 LEU 63 3HD1 LEU 63 19.758 -0.202 5.454
495 HD21 LEU 63 3HD2 LEU 63 23.236 -0.413 3.320
496 HD22 LEU 63 1HD2 LEU 63 22.095 -1.758 3.340
497 HD23 LEU 63 2HD2 LEU 63 23.421 -1.710 4.502
498 H LEU 64 H LEU 64 24.749 1.644 3.801
499 HA LEU 64 HA LEU 64 26.178 -0.676 4.614
500 HB2 LEU 64 1HB LEU 64 27.437 -0.416 2.683
501 HB3 LEU 64 2HB LEU 64 25.877 0.284 2.258
502 HG LEU 64 HG LEU 64 27.105 2.518 3.011
503 HD11 LEU 64 1HD1 LEU 64 29.242 0.540 2.711
504 HD12 LEU 64 2HD1 LEU 64 29.245 2.105 3.523
505 HD13 LEU 64 3HD1 LEU 64 29.479 2.018 1.777
506 HD21 LEU 64 3HD2 LEU 64 27.289 3.042 0.764
507 HD22 LEU 64 1HD2 LEU 64 26.120 1.722 0.749
508 HD23 LEU 64 2HD2 LEU 64 27.802 1.414 0.319
509 H LEU 65 H LEU 65 26.724 2.784 4.933
510 HA LEU 65 HA LEU 65 29.383 2.787 5.739
511 HB2 LEU 65 1HB LEU 65 27.483 4.680 5.407
512 HB3 LEU 65 2HB LEU 65 27.595 4.643 7.166
513 HG LEU 65 HG LEU 65 30.147 4.855 5.681
514 HD11 LEU 65 1HD1 LEU 65 28.759 7.422 6.074
515 HD12 LEU 65 2HD1 LEU 65 28.178 6.430 4.737
516 HD13 LEU 65 3HD1 LEU 65 29.873 6.911 4.806
517 HD21 LEU 65 3HD2 LEU 65 29.707 6.787 7.741
518 HD22 LEU 65 1HD2 LEU 65 30.839 5.435 7.706
519 HD23 LEU 65 2HD2 LEU 65 29.200 5.197 8.313
520 H SER 66 H SER 66 26.509 1.875 7.476
521 HA SER 66 HA SER 66 27.648 1.971 10.087
522 HB2 SER 66 1HB SER 66 25.350 2.002 10.226
523 HB3 SER 66 2HB SER 66 25.147 0.880 8.881
524 HG SER 66 HG SER 66 24.691 0.073 11.086
525 H THR 67 H THR 67 27.494 -0.427 7.551
526 HA THR 67 HA THR 67 28.767 -2.410 9.303
527 HB THR 67 HB THR 67 26.817 -3.248 8.124
528 HG1 THR 67 HG1 THR 67 28.411 -4.787 8.360
529 HG21 THR 67 3HG2 THR 67 26.517 -1.999 6.204
530 HG22 THR 67 1HG2 THR 67 27.160 -3.501 5.541
531 HG23 THR 67 2HG2 THR 67 28.216 -2.103 5.744
532 H THR 68 H THR 68 29.776 0.022 7.481
533 HA THR 68 HA THR 68 32.199 -1.412 6.635
534 HB THR 68 HB THR 68 32.362 -0.101 4.604
535 HG1 THR 68 HG1 THR 68 31.320 1.798 5.215
536 HG21 THR 68 3HG2 THR 68 31.117 -1.606 3.528
537 HG22 THR 68 1HG2 THR 68 29.628 -0.853 4.098
538 HG23 THR 68 2HG2 THR 68 30.430 -2.077 5.083
539 H ARG 69 H ARG 69 34.028 0.157 6.187
540 HA ARG 69 HA ARG 69 33.904 2.417 8.075
541 HB2 ARG 69 1HB ARG 69 36.393 1.966 8.406
542 HB3 ARG 69 2HB ARG 69 35.275 0.824 9.140
543 HG2 ARG 69 1HG ARG 69 36.267 0.211 6.415
544 HG3 ARG 69 2HG ARG 69 37.396 0.046 7.761
545 HD2 ARG 69 1HD ARG 69 34.688 -1.133 8.066
546 HD3 ARG 69 2HD ARG 69 35.819 -1.943 6.982
547 HE ARG 69 HE ARG 69 35.916 -1.881 9.841
548 HH11 ARG 69 2HH1 ARG 69 37.838 -2.136 6.950
549 HH12 ARG 69 1HH1 ARG 69 39.131 -2.989 7.728
550 HH21 ARG 69 2HH2 ARG 69 37.610 -3.004 10.877
551 HH22 ARG 69 1HH2 ARG 69 38.999 -3.482 9.961
552 H MET 70 H MET 70 33.647 2.074 5.039
553 HA MET 70 HA MET 70 35.910 3.318 3.865
554 HB2 MET 70 1HB MET 70 33.064 3.244 2.847
555 HB3 MET 70 2HB MET 70 34.500 3.597 1.895
556 HG2 MET 70 1HG MET 70 35.321 1.296 2.480
557 HG3 MET 70 2HG MET 70 33.724 0.985 3.156
558 HE1 MET 70 3HE MET 70 31.553 0.164 1.309
559 HE2 MET 70 1HE MET 70 31.671 1.835 1.863
560 HE3 MET 70 2HE MET 70 31.400 1.490 0.155
561 HA PRO 71 HA PRO 71 35.313 7.568 4.791
562 HB2 PRO 71 1HB PRO 71 36.265 8.732 2.531
563 HB3 PRO 71 2HB PRO 71 37.311 7.955 3.726
564 HG2 PRO 71 1HG PRO 71 36.283 6.884 1.126
565 HG3 PRO 71 2HG PRO 71 37.908 6.758 1.824
566 HD2 PRO 71 1HD PRO 71 36.112 4.735 1.939
567 HD3 PRO 71 2HD PRO 71 37.312 5.020 3.216
568 H ILE 72 H ILE 72 34.239 9.560 4.057
569 HA ILE 72 HA ILE 72 31.623 9.079 3.152
570 HB ILE 72 HB ILE 72 33.056 11.736 3.157
571 HG12 ILE 72 1HG1 ILE 72 31.513 10.365 5.371
572 HG13 ILE 72 2HG1 ILE 72 33.252 10.637 5.341
573 HG21 ILE 72 1HG2 ILE 72 30.896 12.728 3.279
574 HG22 ILE 72 2HG2 ILE 72 30.866 11.572 1.949
575 HG23 ILE 72 3HG2 ILE 72 30.121 11.159 3.493
576 HD11 ILE 72 3HD1 ILE 72 32.444 12.315 6.719
577 HD12 ILE 72 1HD1 ILE 72 32.653 13.123 5.165
578 HD13 ILE 72 2HD1 ILE 72 31.045 12.622 5.690
579 H ALA 73 H ALA 73 34.547 9.987 1.472
580 HA ALA 73 HA ALA 73 33.386 10.902 -0.929
581 HB1 ALA 73 1HB ALA 73 35.688 11.381 -0.438
582 HB2 ALA 73 2HB ALA 73 36.084 9.662 -0.408
583 HB3 ALA 73 3HB ALA 73 35.611 10.432 -1.923
584 H THR 74 H THR 74 34.578 7.695 0.034
585 HA THR 74 HA THR 74 33.996 6.414 -2.415
586 HB THR 74 HB THR 74 34.233 5.224 0.355
587 HG1 THR 74 HG1 THR 74 36.364 4.649 -0.588
588 HG21 THR 74 3HG2 THR 74 33.075 3.668 -1.066
589 HG22 THR 74 1HG2 THR 74 34.740 3.119 -0.889
590 HG23 THR 74 2HG2 THR 74 34.231 3.928 -2.371
591 H VAL 75 H VAL 75 32.204 6.551 0.657
592 HA VAL 75 HA VAL 75 30.039 4.961 -0.063
593 HB VAL 75 HB VAL 75 29.910 7.392 1.724
594 HG11 VAL 75 1HG1 VAL 75 28.299 4.858 1.898
595 HG12 VAL 75 2HG1 VAL 75 28.022 6.389 2.730
596 HG13 VAL 75 3HG1 VAL 75 27.762 6.270 0.989
597 HG21 VAL 75 3HG2 VAL 75 31.428 4.987 2.010
598 HG22 VAL 75 1HG2 VAL 75 31.303 6.359 3.111
599 HG23 VAL 75 2HG2 VAL 75 30.158 5.022 3.234
600 H GLY 76 H GLY 76 30.586 8.418 -0.586
601 HA2 GLY 76 1HA GLY 76 28.046 9.105 -1.535
602 HA3 GLY 76 2HA GLY 76 29.539 9.929 -1.959
603 H ARG 77 H ARG 77 30.847 7.804 -3.266
604 HA ARG 77 HA ARG 77 29.899 8.090 -5.868
605 HB2 ARG 77 1HB ARG 77 31.854 6.281 -4.532
606 HB3 ARG 77 2HB ARG 77 31.333 5.869 -6.160
607 HG2 ARG 77 1HG ARG 77 31.940 8.333 -6.701
608 HG3 ARG 77 2HG ARG 77 32.883 8.236 -5.213
609 HD2 ARG 77 1HD ARG 77 34.422 7.618 -6.832
610 HD3 ARG 77 2HD ARG 77 33.836 6.064 -6.240
611 HE ARG 77 HE ARG 77 32.227 6.735 -8.382
612 HH11 ARG 77 2HH1 ARG 77 35.607 6.122 -7.818
613 HH12 ARG 77 1HH1 ARG 77 35.897 5.513 -9.414
614 HH21 ARG 77 2HH2 ARG 77 32.596 5.935 -10.486
615 HH22 ARG 77 1HH2 ARG 77 34.183 5.407 -10.931
616 H ASN 78 H ASN 78 29.191 5.664 -3.436
617 HA ASN 78 HA ASN 78 27.952 3.762 -5.094
618 HB2 ASN 78 1HB ASN 78 28.202 4.267 -2.236
619 HB3 ASN 78 2HB ASN 78 26.627 3.597 -2.655
620 HD21 ASN 78 2HD2 ASN 78 29.687 2.832 -1.778
621 HD22 ASN 78 1HD2 ASN 78 29.770 1.215 -2.383
622 H VAL 79 H VAL 79 26.803 6.739 -3.670
623 HA VAL 79 HA VAL 79 24.079 6.202 -4.613
624 HB VAL 79 HB VAL 79 23.416 8.185 -3.341
625 HG11 VAL 79 1HG1 VAL 79 23.339 6.110 -2.162
626 HG12 VAL 79 2HG1 VAL 79 25.071 6.172 -1.828
627 HG13 VAL 79 3HG1 VAL 79 23.982 7.328 -1.061
628 HG21 VAL 79 3HG2 VAL 79 25.615 9.370 -3.666
629 HG22 VAL 79 1HG2 VAL 79 24.933 9.471 -2.042
630 HG23 VAL 79 2HG2 VAL 79 26.263 8.361 -2.373
631 H GLY 80 H GLY 80 26.559 7.005 -6.232
632 HA2 GLY 80 1HA GLY 80 26.824 8.153 -8.214
633 HA3 GLY 80 2HA GLY 80 25.169 8.719 -8.049
634 H PHE 81 H PHE 81 26.807 9.413 -5.242
635 HA PHE 81 HA PHE 81 26.910 12.222 -5.906
636 HB2 PHE 81 1HB PHE 81 27.176 10.607 -3.407
637 HB3 PHE 81 2HB PHE 81 27.834 12.240 -3.425
638 HD1 PHE 81 HD2 PHE 81 24.774 10.941 -5.080
639 HD2 PHE 81 HD1 PHE 81 26.405 13.440 -2.045
640 HE1 PHE 81 HE2 PHE 81 22.531 11.845 -4.624
641 HE2 PHE 81 HE1 PHE 81 24.165 14.347 -1.583
642 HZ PHE 81 HZ PHE 81 22.225 13.550 -2.874
643 H ASP 82 H ASP 82 28.621 13.133 -6.810
644 HA ASP 82 HA ASP 82 31.219 11.835 -6.672
645 HB2 ASP 82 1HB ASP 82 31.899 13.561 -8.319
646 HB3 ASP 82 2HB ASP 82 30.490 12.642 -8.843
647 H ASP 83 H ASP 83 29.593 14.677 -5.458
648 HA ASP 83 HA ASP 83 32.070 15.740 -4.339
649 HB2 ASP 83 1HB ASP 83 30.577 17.357 -5.354
650 HB3 ASP 83 2HB ASP 83 29.243 16.815 -4.340
651 H GLN 84 H GLN 84 32.733 15.143 -2.395
652 HA GLN 84 HA GLN 84 31.267 13.494 -0.665
653 HB2 GLN 84 1HB GLN 84 33.654 13.466 -0.551
654 HB3 GLN 84 2HB GLN 84 33.720 15.190 -0.212
655 HG2 GLN 84 1HG GLN 84 32.625 14.787 1.951
656 HG3 GLN 84 2HG GLN 84 32.634 13.057 1.612
657 HE21 GLN 84 2HE2 GLN 84 34.521 15.817 2.499
658 HE22 GLN 84 1HE2 GLN 84 35.964 14.961 2.912
659 H LEU 85 H LEU 85 31.799 16.986 -0.666
660 HA LEU 85 HA LEU 85 30.545 17.502 1.816
661 HB2 LEU 85 1HB LEU 85 30.820 19.340 -0.557
662 HB3 LEU 85 2HB LEU 85 30.493 19.821 1.107
663 HG LEU 85 HG LEU 85 33.029 18.410 0.322
664 HD11 LEU 85 1HD1 LEU 85 32.895 21.371 0.657
665 HD12 LEU 85 2HD1 LEU 85 32.504 20.651 -0.905
666 HD13 LEU 85 3HD1 LEU 85 34.091 20.385 -0.184
667 HD21 LEU 85 3HD2 LEU 85 32.171 20.083 2.676
668 HD22 LEU 85 1HD2 LEU 85 33.838 19.597 2.372
669 HD23 LEU 85 2HD2 LEU 85 32.603 18.373 2.668
670 H TYR 86 H TYR 86 29.347 17.169 -1.457
671 HA TYR 86 HA TYR 86 26.804 18.297 -1.115
672 HB2 TYR 86 1HB TYR 86 27.654 17.798 -3.325
673 HB3 TYR 86 2HB TYR 86 27.725 16.079 -2.953
674 HD1 TYR 86 HD1 TYR 86 24.951 18.378 -2.093
675 HD2 TYR 86 HD2 TYR 86 26.289 15.235 -4.629
676 HE1 TYR 86 HE1 TYR 86 22.662 18.103 -2.950
677 HE2 TYR 86 HE2 TYR 86 24.004 14.952 -5.494
678 HH TYR 86 HH TYR 86 21.286 16.641 -4.089
679 H PHE 87 H PHE 87 27.977 14.997 -0.602
680 HA PHE 87 HA PHE 87 25.469 13.854 0.012
681 HB2 PHE 87 1HB PHE 87 27.288 12.408 -0.583
682 HB3 PHE 87 2HB PHE 87 28.284 13.027 0.730
683 HD1 PHE 87 HD2 PHE 87 25.107 11.209 0.081
684 HD2 PHE 87 HD1 PHE 87 28.334 11.924 2.762
685 HE1 PHE 87 HE2 PHE 87 24.284 9.411 1.545
686 HE2 PHE 87 HE1 PHE 87 27.517 10.126 4.230
687 HZ PHE 87 HZ PHE 87 25.489 8.868 3.623
688 H SER 88 H SER 88 28.048 15.161 2.072
689 HA SER 88 HA SER 88 26.770 14.619 4.531
690 HB2 SER 88 1HB SER 88 28.706 16.887 4.072
691 HB3 SER 88 2HB SER 88 28.461 15.941 5.540
692 HG SER 88 HG SER 88 29.806 14.506 4.808
693 H ARG 89 H ARG 89 26.687 17.377 2.345
694 HA ARG 89 HA ARG 89 25.342 19.177 4.034
695 HB2 ARG 89 1HB ARG 89 25.618 18.928 1.056
696 HB3 ARG 89 2HB ARG 89 24.554 20.144 1.750
697 HG2 ARG 89 1HG ARG 89 26.315 21.299 2.740
698 HG3 ARG 89 2HG ARG 89 27.412 19.923 2.610
699 HD2 ARG 89 1HD ARG 89 27.818 21.812 0.988
700 HD3 ARG 89 2HD ARG 89 27.645 20.209 0.274
701 HE ARG 89 HE ARG 89 25.175 21.652 0.371
702 HH11 ARG 89 2HH1 ARG 89 28.126 21.209 -1.422
703 HH12 ARG 89 1HH1 ARG 89 27.445 21.735 -2.926
704 HH21 ARG 89 2HH2 ARG 89 24.267 22.346 -1.603
705 HH22 ARG 89 1HH2 ARG 89 25.250 22.382 -3.027
706 H VAL 90 H VAL 90 24.078 16.982 1.529
707 HA VAL 90 HA VAL 90 21.349 17.587 2.062
708 HB VAL 90 HB VAL 90 22.564 15.209 0.649
709 HG11 VAL 90 1HG1 VAL 90 20.388 14.559 1.288
710 HG12 VAL 90 2HG1 VAL 90 19.718 16.147 0.908
711 HG13 VAL 90 3HG1 VAL 90 20.255 15.081 -0.391
712 HG21 VAL 90 3HG2 VAL 90 21.510 16.628 -1.323
713 HG22 VAL 90 1HG2 VAL 90 21.802 17.953 -0.197
714 HG23 VAL 90 2HG2 VAL 90 23.142 16.937 -0.728
715 H PHE 91 H PHE 91 23.476 14.897 2.976
716 HA PHE 91 HA PHE 91 21.558 13.378 4.346
717 HB2 PHE 91 1HB PHE 91 23.646 12.361 3.758
718 HB3 PHE 91 2HB PHE 91 24.555 13.564 4.666
719 HD1 PHE 91 HD1 PHE 91 24.666 13.471 7.092
720 HD2 PHE 91 HD2 PHE 91 22.570 10.516 4.859
721 HE1 PHE 91 HE1 PHE 91 24.632 12.007 9.069
722 HE2 PHE 91 HE2 PHE 91 22.532 9.047 6.832
723 HZ PHE 91 HZ PHE 91 23.563 9.792 8.941
724 H LYS 92 H LYS 92 23.577 16.065 5.364
725 HA LYS 92 HA LYS 92 23.236 15.900 8.125
726 HB2 LYS 92 1HB LYS 92 24.840 17.429 7.211
727 HB3 LYS 92 2HB LYS 92 23.594 18.294 6.320
728 HG2 LYS 92 1HG LYS 92 22.656 19.152 8.358
729 HG3 LYS 92 2HG LYS 92 23.762 18.172 9.324
730 HD2 LYS 92 1HD LYS 92 25.592 19.487 8.800
731 HD3 LYS 92 2HD LYS 92 24.853 20.106 7.322
732 HE2 LYS 92 1HE LYS 92 23.433 21.558 8.526
733 HE3 LYS 92 2HE LYS 92 23.777 20.751 10.055
734 HZ1 LYS 92 3HZ LYS 92 24.960 23.003 9.279
735 HZ2 LYS 92 1HZ LYS 92 26.072 21.876 8.681
736 HZ3 LYS 92 2HZ LYS 92 25.681 21.887 10.327
737 H LYS 93 H LYS 93 21.268 17.613 5.711
738 HA LYS 93 HA LYS 93 19.344 18.488 7.648
739 HB2 LYS 93 1HB LYS 93 19.170 18.413 4.629
740 HB3 LYS 93 2HB LYS 93 18.063 19.266 5.697
741 HG2 LYS 93 1HG LYS 93 19.456 20.997 5.961
742 HG3 LYS 93 2HG LYS 93 20.881 19.963 6.079
743 HD2 LYS 93 1HD LYS 93 21.372 20.878 4.073
744 HD3 LYS 93 2HD LYS 93 20.270 19.635 3.474
745 HE2 LYS 93 1HE LYS 93 19.636 22.524 4.052
746 HE3 LYS 93 2HE LYS 93 19.663 21.729 2.479
747 HZ1 LYS 93 3HZ LYS 93 17.697 21.416 4.661
748 HZ2 LYS 93 1HZ LYS 93 17.855 20.246 3.450
749 HZ3 LYS 93 2HZ LYS 93 17.424 21.830 3.044
750 H CYS 94 H CYS 94 19.771 15.688 5.657
751 HA CYS 94 HA CYS 94 17.138 14.760 5.495
752 HB2 CYS 94 1HB CYS 94 19.834 13.502 5.341
753 HB3 CYS 94 2HB CYS 94 18.448 12.440 5.549
754 HG CYS 94 HG CYS 94 19.150 14.484 2.915
755 H THR 95 H THR 95 19.646 14.057 7.919
756 HA THR 95 HA THR 95 17.576 12.894 9.649
757 HB THR 95 HB THR 95 19.480 11.999 10.984
758 HG1 THR 95 HG1 THR 95 21.416 12.723 10.564
759 HG21 THR 95 3HG2 THR 95 18.417 10.612 9.278
760 HG22 THR 95 1HG2 THR 95 20.146 10.279 9.362
761 HG23 THR 95 2HG2 THR 95 19.501 11.269 8.053
762 H GLY 96 H GLY 96 19.350 15.717 9.192
763 HA2 GLY 96 1HA GLY 96 18.971 17.679 10.463
764 HA3 GLY 96 2HA GLY 96 18.537 16.674 11.838
765 H ALA 97 H ALA 97 21.154 15.156 10.836
766 HA ALA 97 HA ALA 97 23.097 16.986 12.053
767 HB1 ALA 97 1HB ALA 97 23.228 14.128 12.858
768 HB2 ALA 97 2HB ALA 97 23.741 15.575 13.727
769 HB3 ALA 97 3HB ALA 97 22.029 15.162 13.635
770 H SER 98 H SER 98 25.246 16.656 11.429
771 HA SER 98 HA SER 98 25.620 15.671 8.812
772 HB2 SER 98 1HB SER 98 28.164 15.836 9.871
773 HB3 SER 98 2HB SER 98 27.285 17.161 9.109
774 HG SER 98 HG SER 98 27.898 17.889 11.095
775 HA PRO 99 HA PRO 99 26.685 11.443 9.292
776 HB2 PRO 99 1HB PRO 99 28.791 11.152 7.605
777 HB3 PRO 99 2HB PRO 99 27.133 11.388 7.040
778 HG2 PRO 99 1HG PRO 99 29.348 13.385 7.298
779 HG3 PRO 99 2HG PRO 99 28.181 13.174 5.981
780 HD2 PRO 99 1HD PRO 99 27.909 15.089 7.875
781 HD3 PRO 99 2HD PRO 99 26.516 14.301 7.107
782 H SER 100 H SER 100 29.349 13.728 9.629
783 HA SER 100 HA SER 100 31.191 11.924 10.802
784 HB2 SER 100 1HB SER 100 31.114 14.910 11.253
785 HB3 SER 100 2HB SER 100 32.518 13.845 11.310
786 HG SER 100 HG SER 100 32.468 13.649 9.126
787 H GLU 101 H GLU 101 28.644 13.957 12.094
788 HA GLU 101 HA GLU 101 29.397 13.624 14.834
789 HB2 GLU 101 1HB GLU 101 28.056 15.547 13.972
790 HB3 GLU 101 2HB GLU 101 26.713 14.442 13.711
791 HG2 GLU 101 1HG GLU 101 26.108 14.516 15.846
792 HG3 GLU 101 2HG GLU 101 27.761 14.273 16.407
793 H PHE 102 H PHE 102 26.884 12.205 12.760
794 HA PHE 102 HA PHE 102 25.745 10.533 14.706
795 HB2 PHE 102 1HB PHE 102 24.837 11.133 12.386
796 HB3 PHE 102 2HB PHE 102 25.884 9.857 11.772
797 HD1 PHE 102 HD1 PHE 102 23.562 10.214 14.676
798 HD2 PHE 102 HD2 PHE 102 24.746 7.936 11.281
799 HE1 PHE 102 HE1 PHE 102 21.824 8.550 15.191
800 HE2 PHE 102 HE2 PHE 102 23.010 6.269 11.790
801 HZ PHE 102 HZ PHE 102 21.546 6.574 13.746
802 H ARG 103 H ARG 103 28.314 9.929 12.335
803 HA ARG 103 HA ARG 103 28.711 7.214 12.970
804 HB2 ARG 103 1HB ARG 103 29.549 8.388 10.916
805 HB3 ARG 103 2HB ARG 103 30.780 9.146 11.917
806 HG2 ARG 103 1HG ARG 103 31.551 6.835 12.535
807 HG3 ARG 103 2HG ARG 103 30.462 6.225 11.288
808 HD2 ARG 103 1HD ARG 103 32.617 6.406 10.304
809 HD3 ARG 103 2HD ARG 103 31.642 7.727 9.661
810 HE ARG 103 HE ARG 103 33.074 9.208 10.650
811 HH11 ARG 103 2HH1 ARG 103 33.519 6.071 12.094
812 HH12 ARG 103 1HH1 ARG 103 34.899 6.552 13.025
813 HH21 ARG 103 2HH2 ARG 103 34.890 9.852 11.871
814 HH22 ARG 103 1HH2 ARG 103 35.677 8.703 12.898
815 H ALA 104 H ALA 104 29.867 10.169 14.419
816 HA ALA 104 HA ALA 104 31.907 8.917 16.002
817 HB1 ALA 104 1HB ALA 104 30.867 11.628 15.610
818 HB2 ALA 104 2HB ALA 104 31.431 11.289 17.246
819 HB3 ALA 104 3HB ALA 104 32.519 11.070 15.876
820 H GLY 105 H GLY 105 28.541 9.835 16.463
821 HA2 GLY 105 1HA GLY 105 27.055 8.874 17.989
822 HA3 GLY 105 2HA GLY 105 28.418 8.129 18.812
823 H CYS 106 H CYS 106 28.915 11.416 18.206
824 HA CYS 106 HA CYS 106 28.926 12.052 20.977
825 HB2 CYS 106 1HB CYS 106 30.349 13.079 19.092
826 HB3 CYS 106 2HB CYS 106 28.945 14.085 18.756
827 HG CYS 106 HG CYS 106 31.034 15.366 20.322
828 H GLU 107 H GLU 107 27.332 12.758 22.232
829 HA GLU 107 HA GLU 107 24.793 13.504 20.967
830 HB2 GLU 107 1HB GLU 107 23.762 13.028 23.125
831 HB3 GLU 107 2HB GLU 107 24.722 11.657 22.586
832 HG2 GLU 107 1HG GLU 107 25.376 11.743 24.754
833 HG3 GLU 107 2HG GLU 107 26.578 12.822 24.049
Start of MODEL 5
1 H1 MET 1 H MET 1 2.739 -0.880 1.083
2 HA MET 1 HA MET 1 2.456 0.670 -1.191
3 HB2 MET 1 1HB MET 1 4.511 -0.690 -0.048
4 HB3 MET 1 2HB MET 1 4.228 -1.673 -1.478
5 HG2 MET 1 1HG MET 1 4.935 -0.061 -2.901
6 HG3 MET 1 2HG MET 1 4.376 1.253 -1.868
7 HE1 MET 1 3HE MET 1 7.556 2.614 -0.649
8 HE2 MET 1 1HE MET 1 6.323 2.829 -1.892
9 HE3 MET 1 2HE MET 1 5.847 2.544 -0.218
10 H ASP 2 H ASP 2 1.544 0.402 -3.132
11 HA ASP 2 HA ASP 2 -0.026 -1.956 -3.632
12 HB2 ASP 2 1HB ASP 2 0.260 0.734 -4.833
13 HB3 ASP 2 2HB ASP 2 -0.226 -0.550 -5.937
14 H ASN 3 H ASN 3 0.191 -3.399 -5.361
15 HA ASN 3 HA ASN 3 2.740 -4.321 -5.927
16 HB2 ASN 3 1HB ASN 3 0.122 -4.715 -7.373
17 HB3 ASN 3 2HB ASN 3 1.599 -5.542 -7.858
18 HD21 ASN 3 2HD2 ASN 3 2.733 -6.700 -6.035
19 HD22 ASN 3 1HD2 ASN 3 1.730 -7.585 -4.941
20 H ARG 4 H ARG 4 0.647 -2.236 -7.891
21 HA ARG 4 HA ARG 4 2.413 -2.028 -10.089
22 HB2 ARG 4 1HB ARG 4 0.181 -0.226 -9.143
23 HB3 ARG 4 2HB ARG 4 1.042 0.002 -10.659
24 HG2 ARG 4 1HG ARG 4 0.046 -1.783 -11.658
25 HG3 ARG 4 2HG ARG 4 -0.160 -2.659 -10.139
26 HD2 ARG 4 1HD ARG 4 -1.713 -0.184 -10.875
27 HD3 ARG 4 2HD ARG 4 -2.283 -1.824 -11.181
28 HE ARG 4 HE ARG 4 -1.566 -1.487 -8.456
29 HH11 ARG 4 2HH1 ARG 4 -4.052 -0.733 -10.774
30 HH12 ARG 4 1HH1 ARG 4 -5.312 -0.643 -9.588
31 HH21 ARG 4 2HH2 ARG 4 -3.217 -1.371 -6.886
32 HH22 ARG 4 1HH2 ARG 4 -4.836 -1.006 -7.377
33 H VAL 5 H VAL 5 1.834 0.092 -7.295
34 HA VAL 5 HA VAL 5 3.642 2.114 -7.982
35 HB VAL 5 HB VAL 5 2.842 1.197 -5.216
36 HG11 VAL 5 1HG1 VAL 5 4.761 3.111 -6.043
37 HG12 VAL 5 2HG1 VAL 5 3.382 3.983 -5.371
38 HG13 VAL 5 3HG1 VAL 5 4.202 2.752 -4.409
39 HG21 VAL 5 3HG2 VAL 5 0.953 1.812 -6.704
40 HG22 VAL 5 1HG2 VAL 5 1.130 2.887 -5.317
41 HG23 VAL 5 2HG2 VAL 5 1.680 3.405 -6.911
42 H ARG 6 H ARG 6 4.107 -0.911 -6.220
43 HA ARG 6 HA ARG 6 6.742 -0.441 -5.358
44 HB2 ARG 6 1HB ARG 6 4.987 -2.363 -4.823
45 HB3 ARG 6 2HB ARG 6 5.890 -3.205 -6.076
46 HG2 ARG 6 1HG ARG 6 7.574 -3.633 -4.695
47 HG3 ARG 6 2HG ARG 6 7.651 -1.955 -4.155
48 HD2 ARG 6 1HD ARG 6 6.320 -2.330 -2.351
49 HD3 ARG 6 2HD ARG 6 5.386 -3.583 -3.167
50 HE ARG 6 HE ARG 6 7.660 -3.964 -1.502
51 HH11 ARG 6 2HH1 ARG 6 6.016 -5.223 -4.300
52 HH12 ARG 6 1HH1 ARG 6 6.624 -6.832 -4.095
53 HH21 ARG 6 2HH2 ARG 6 8.467 -6.079 -1.221
54 HH22 ARG 6 1HH2 ARG 6 8.017 -7.318 -2.343
55 H GLU 7 H GLU 7 5.430 -1.659 -8.378
56 HA GLU 7 HA GLU 7 7.809 -2.661 -9.488
57 HB2 GLU 7 1HB GLU 7 5.130 -1.956 -10.447
58 HB3 GLU 7 2HB GLU 7 6.387 -1.757 -11.659
59 HG2 GLU 7 1HG GLU 7 5.734 -4.265 -10.133
60 HG3 GLU 7 2HG GLU 7 5.432 -3.951 -11.841
61 H ALA 8 H ALA 8 6.291 0.541 -9.748
62 HA ALA 8 HA ALA 8 8.160 1.704 -11.473
63 HB1 ALA 8 1HB ALA 8 6.028 2.640 -9.708
64 HB2 ALA 8 2HB ALA 8 7.332 3.806 -9.934
65 HB3 ALA 8 3HB ALA 8 6.471 3.164 -11.332
66 H CYS 9 H CYS 9 8.176 1.297 -7.979
67 HA CYS 9 HA CYS 9 10.292 3.016 -7.351
68 HB2 CYS 9 1HB CYS 9 9.354 0.468 -6.026
69 HB3 CYS 9 2HB CYS 9 10.585 1.520 -5.338
70 HG CYS 9 HG CYS 9 8.838 2.810 -3.976
71 H GLN 10 H GLN 10 10.264 -0.289 -8.538
72 HA GLN 10 HA GLN 10 12.967 -0.908 -8.084
73 HB2 GLN 10 1HB GLN 10 11.158 -2.533 -8.708
74 HB3 GLN 10 2HB GLN 10 11.248 -1.919 -10.353
75 HG2 GLN 10 1HG GLN 10 12.599 -3.744 -10.520
76 HG3 GLN 10 2HG GLN 10 13.787 -2.509 -10.105
77 HE21 GLN 10 2HE2 GLN 10 14.956 -4.533 -9.497
78 HE22 GLN 10 1HE2 GLN 10 14.757 -5.108 -7.880
79 H TYR 11 H TYR 11 11.339 0.658 -10.798
80 HA TYR 11 HA TYR 11 13.626 0.777 -12.478
81 HB2 TYR 11 1HB TYR 11 11.492 0.973 -13.516
82 HB3 TYR 11 2HB TYR 11 11.020 2.297 -12.458
83 HD1 TYR 11 HD1 TYR 11 13.516 1.418 -15.085
84 HD2 TYR 11 HD2 TYR 11 11.271 4.492 -13.183
85 HE1 TYR 11 HE1 TYR 11 14.319 3.032 -16.758
86 HE2 TYR 11 HE2 TYR 11 12.068 6.114 -14.852
87 HH TYR 11 HH TYR 11 13.598 5.201 -17.719
88 H ILE 12 H ILE 12 12.106 3.113 -10.281
89 HA ILE 12 HA ILE 12 13.864 5.249 -10.794
90 HB ILE 12 HB ILE 12 12.343 4.660 -8.251
91 HG12 ILE 12 1HG1 ILE 12 11.535 6.517 -10.486
92 HG13 ILE 12 2HG1 ILE 12 11.031 4.831 -10.439
93 HG21 ILE 12 1HG2 ILE 12 12.533 7.066 -7.833
94 HG22 ILE 12 2HG2 ILE 12 14.114 6.290 -7.908
95 HG23 ILE 12 3HG2 ILE 12 13.530 7.234 -9.279
96 HD11 ILE 12 3HD1 ILE 12 9.393 6.519 -9.544
97 HD12 ILE 12 1HD1 ILE 12 9.770 5.163 -8.481
98 HD13 ILE 12 2HD1 ILE 12 10.500 6.743 -8.189
99 H SER 13 H SER 13 14.031 2.535 -8.564
100 HA SER 13 HA SER 13 16.223 3.464 -7.039
101 HB2 SER 13 1HB SER 13 16.313 1.289 -6.105
102 HB3 SER 13 2HB SER 13 14.610 1.555 -6.478
103 HG SER 13 HG SER 13 16.424 -0.205 -7.609
104 H ASP 14 H ASP 14 16.005 1.411 -9.915
105 HA ASP 14 HA ASP 14 18.775 0.844 -10.087
106 HB2 ASP 14 1HB ASP 14 16.469 0.660 -11.999
107 HB3 ASP 14 2HB ASP 14 18.114 0.401 -12.573
108 H HIS 15 H HIS 15 16.795 3.501 -11.171
109 HA HIS 15 HA HIS 15 19.002 4.629 -12.722
110 HB2 HIS 15 1HB HIS 15 16.073 5.219 -12.501
111 HB3 HIS 15 2HB HIS 15 17.165 6.465 -13.100
112 HD1 HIS 15 HD1 HIS 15 16.617 6.492 -15.535
113 HD2 HIS 15 HD2 HIS 15 17.293 2.648 -14.110
114 HE1 HIS 15 HE1 HIS 15 16.620 5.012 -17.568
115 H LEU 16 H LEU 16 18.727 4.432 -9.672
116 HA LEU 16 HA LEU 16 18.413 7.016 -8.616
117 HB2 LEU 16 1HB LEU 16 18.453 4.837 -7.355
118 HB3 LEU 16 2HB LEU 16 20.208 4.863 -7.518
119 HG LEU 16 HG LEU 16 19.920 7.232 -6.372
120 HD11 LEU 16 1HD1 LEU 16 17.985 6.296 -4.575
121 HD12 LEU 16 2HD1 LEU 16 17.299 6.085 -6.185
122 HD13 LEU 16 3HD1 LEU 16 17.865 7.673 -5.670
123 HD21 LEU 16 3HD2 LEU 16 19.732 4.664 -4.802
124 HD22 LEU 16 1HD2 LEU 16 20.422 6.195 -4.263
125 HD23 LEU 16 2HD2 LEU 16 21.209 5.277 -5.548
126 H ALA 17 H ALA 17 21.042 5.507 -10.284
127 HA ALA 17 HA ALA 17 22.944 7.559 -9.468
128 HB1 ALA 17 1HB ALA 17 24.200 6.061 -11.394
129 HB2 ALA 17 2HB ALA 17 24.281 5.779 -9.655
130 HB3 ALA 17 3HB ALA 17 23.114 4.895 -10.638
131 H ASP 18 H ASP 18 20.768 6.869 -12.033
132 HA ASP 18 HA ASP 18 22.026 8.222 -14.153
133 HB2 ASP 18 1HB ASP 18 19.211 7.431 -13.530
134 HB3 ASP 18 2HB ASP 18 19.503 8.545 -14.863
135 H SER 19 H SER 19 21.826 10.318 -14.932
136 HA SER 19 HA SER 19 21.332 12.316 -12.889
137 HB2 SER 19 1HB SER 19 23.321 12.346 -14.478
138 HB3 SER 19 2HB SER 19 22.185 12.816 -15.743
139 HG SER 19 HG SER 19 22.414 14.765 -15.022
140 H ASN 20 H ASN 20 20.182 11.644 -16.191
141 HA ASN 20 HA ASN 20 18.089 13.616 -15.978
142 HB2 ASN 20 1HB ASN 20 18.724 11.560 -18.103
143 HB3 ASN 20 2HB ASN 20 17.417 12.734 -18.229
144 HD21 ASN 20 2HD2 ASN 20 17.888 14.874 -18.611
145 HD22 ASN 20 1HD2 ASN 20 19.459 15.415 -19.085
146 H PHE 21 H PHE 21 16.415 13.191 -14.690
147 HA PHE 21 HA PHE 21 15.290 10.471 -14.703
148 HB2 PHE 21 1HB PHE 21 16.096 11.308 -12.503
149 HB3 PHE 21 2HB PHE 21 14.936 12.628 -12.612
150 HD1 PHE 21 HD2 PHE 21 14.880 8.918 -13.044
151 HD2 PHE 21 HD1 PHE 21 13.067 12.364 -11.326
152 HE1 PHE 21 HE2 PHE 21 13.167 7.492 -12.000
153 HE2 PHE 21 HE1 PHE 21 11.352 10.944 -10.278
154 HZ PHE 21 HZ PHE 21 11.400 8.505 -10.616
155 H ASP 22 H ASP 22 13.495 10.236 -15.842
156 HA ASP 22 HA ASP 22 11.690 12.549 -16.121
157 HB2 ASP 22 1HB ASP 22 12.803 11.801 -18.233
158 HB3 ASP 22 2HB ASP 22 12.000 10.244 -18.053
159 H ILE 23 H ILE 23 9.884 12.333 -14.994
160 HA ILE 23 HA ILE 23 9.042 10.002 -13.714
161 HB ILE 23 HB ILE 23 8.333 12.320 -13.108
162 HG12 ILE 23 1HG1 ILE 23 6.072 10.358 -13.553
163 HG13 ILE 23 2HG1 ILE 23 7.204 10.312 -12.205
164 HG21 ILE 23 1HG2 ILE 23 6.576 13.420 -14.270
165 HG22 ILE 23 2HG2 ILE 23 7.785 12.968 -15.470
166 HG23 ILE 23 3HG2 ILE 23 6.305 12.023 -15.312
167 HD11 ILE 23 3HD1 ILE 23 5.132 11.291 -11.493
168 HD12 ILE 23 1HD1 ILE 23 6.389 12.527 -11.497
169 HD13 ILE 23 2HD1 ILE 23 5.200 12.475 -12.798
170 H ALA 24 H ALA 24 8.528 11.100 -16.951
171 HA ALA 24 HA ALA 24 6.188 9.721 -17.618
172 HB1 ALA 24 1HB ALA 24 6.664 11.031 -19.372
173 HB2 ALA 24 2HB ALA 24 8.401 10.976 -19.067
174 HB3 ALA 24 3HB ALA 24 7.616 9.659 -19.939
175 H SER 25 H SER 25 9.581 8.688 -17.751
176 HA SER 25 HA SER 25 9.107 6.154 -18.885
177 HB2 SER 25 1HB SER 25 11.368 5.588 -18.076
178 HB3 SER 25 2HB SER 25 11.336 7.174 -18.847
179 HG SER 25 HG SER 25 12.296 7.716 -17.037
180 H VAL 26 H VAL 26 8.892 7.349 -15.621
181 HA VAL 26 HA VAL 26 8.960 4.874 -14.262
182 HB VAL 26 HB VAL 26 7.591 7.445 -13.457
183 HG11 VAL 26 1HG1 VAL 26 7.702 6.564 -11.178
184 HG12 VAL 26 2HG1 VAL 26 6.727 5.526 -12.221
185 HG13 VAL 26 3HG1 VAL 26 8.372 5.054 -11.793
186 HG21 VAL 26 3HG2 VAL 26 10.357 6.373 -12.930
187 HG22 VAL 26 1HG2 VAL 26 9.917 7.857 -13.776
188 HG23 VAL 26 2HG2 VAL 26 9.643 7.718 -12.040
189 H ALA 27 H ALA 27 6.236 6.870 -15.387
190 HA ALA 27 HA ALA 27 4.220 5.074 -14.532
191 HB1 ALA 27 1HB ALA 27 4.313 7.633 -15.655
192 HB2 ALA 27 2HB ALA 27 3.384 6.648 -16.787
193 HB3 ALA 27 3HB ALA 27 2.887 6.756 -15.098
194 H GLN 28 H GLN 28 6.052 5.409 -17.511
195 HA GLN 28 HA GLN 28 4.480 3.705 -19.116
196 HB2 GLN 28 1HB GLN 28 6.107 5.226 -20.092
197 HB3 GLN 28 2HB GLN 28 7.421 4.380 -19.285
198 HG2 GLN 28 1HG GLN 28 7.332 3.754 -21.609
199 HG3 GLN 28 2HG GLN 28 6.920 2.372 -20.596
200 HE21 GLN 28 2HE2 GLN 28 5.835 1.343 -22.267
201 HE22 GLN 28 1HE2 GLN 28 4.293 1.876 -22.832
202 H HIS 29 H HIS 29 7.151 3.104 -16.905
203 HA HIS 29 HA HIS 29 7.666 0.435 -17.594
204 HB2 HIS 29 1HB HIS 29 9.250 1.552 -16.218
205 HB3 HIS 29 2HB HIS 29 8.028 1.964 -15.019
206 HD1 HIS 29 HD1 HIS 29 8.611 -1.483 -16.467
207 HD2 HIS 29 HD2 HIS 29 9.025 0.576 -12.882
208 HE1 HIS 29 HE1 HIS 29 9.221 -3.224 -14.758
209 H VAL 30 H VAL 30 5.250 1.879 -15.498
210 HA VAL 30 HA VAL 30 4.299 -0.748 -14.649
211 HB VAL 30 HB VAL 30 2.721 0.505 -13.224
212 HG11 VAL 30 1HG1 VAL 30 5.659 0.862 -13.076
213 HG12 VAL 30 2HG1 VAL 30 4.669 1.804 -11.959
214 HG13 VAL 30 3HG1 VAL 30 4.558 0.044 -11.968
215 HG21 VAL 30 3HG2 VAL 30 4.139 3.020 -14.052
216 HG22 VAL 30 1HG2 VAL 30 2.654 2.483 -14.838
217 HG23 VAL 30 2HG2 VAL 30 2.657 2.849 -13.113
218 H CYS 31 H CYS 31 4.009 0.704 -17.404
219 HA CYS 31 HA CYS 31 2.457 0.888 -19.061
220 HB2 CYS 31 1HB CYS 31 1.124 -1.357 -17.533
221 HB3 CYS 31 2HB CYS 31 0.859 -0.953 -19.224
222 HG CYS 31 HG CYS 31 3.849 -1.375 -19.520
223 H LEU 32 H LEU 32 2.085 2.685 -16.919
224 HA LEU 32 HA LEU 32 -0.788 3.166 -17.191
225 HB2 LEU 32 1HB LEU 32 0.673 2.638 -14.696
226 HB3 LEU 32 2HB LEU 32 -0.372 4.056 -14.661
227 HG LEU 32 HG LEU 32 -1.244 1.239 -15.301
228 HD11 LEU 32 1HD1 LEU 32 -0.967 1.139 -13.039
229 HD12 LEU 32 2HD1 LEU 32 -2.594 1.813 -13.110
230 HD13 LEU 32 3HD1 LEU 32 -1.214 2.871 -12.817
231 HD21 LEU 32 3HD2 LEU 32 -2.758 3.835 -15.116
232 HD22 LEU 32 1HD2 LEU 32 -3.527 2.248 -15.080
233 HD23 LEU 32 2HD2 LEU 32 -2.624 2.759 -16.507
234 H SER 33 H SER 33 -1.377 5.413 -16.553
235 HA SER 33 HA SER 33 0.410 7.260 -17.787
236 HB2 SER 33 1HB SER 33 -2.282 7.453 -16.488
237 HB3 SER 33 2HB SER 33 -1.378 8.931 -16.819
238 HG SER 33 HG SER 33 -1.579 8.607 -18.929
239 HA PRO 34 HA PRO 34 2.707 8.823 -14.392
240 HB2 PRO 34 1HB PRO 34 2.883 11.462 -15.004
241 HB3 PRO 34 2HB PRO 34 3.766 10.211 -15.886
242 HG2 PRO 34 1HG PRO 34 1.213 11.595 -16.612
243 HG3 PRO 34 2HG PRO 34 2.602 11.197 -17.640
244 HD2 PRO 34 1HD PRO 34 0.336 9.715 -17.615
245 HD3 PRO 34 2HD PRO 34 1.938 9.006 -17.906
246 H SER 35 H SER 35 -0.176 10.732 -15.205
247 HA SER 35 HA SER 35 -0.363 12.049 -12.704
248 HB2 SER 35 1HB SER 35 -2.520 11.497 -14.757
249 HB3 SER 35 2HB SER 35 -2.647 12.645 -13.424
250 HG SER 35 HG SER 35 -0.489 12.859 -15.198
251 H ARG 36 H ARG 36 -1.983 9.180 -14.030
252 HA ARG 36 HA ARG 36 -3.570 8.657 -11.753
253 HB2 ARG 36 1HB ARG 36 -3.948 7.724 -14.050
254 HB3 ARG 36 2HB ARG 36 -2.580 6.651 -13.783
255 HG2 ARG 36 1HG ARG 36 -4.427 5.334 -13.292
256 HG3 ARG 36 2HG ARG 36 -3.855 5.859 -11.707
257 HD2 ARG 36 1HD ARG 36 -5.534 7.788 -11.973
258 HD3 ARG 36 2HD ARG 36 -6.237 6.811 -13.262
259 HE ARG 36 HE ARG 36 -6.530 6.403 -10.465
260 HH11 ARG 36 2HH1 ARG 36 -6.269 4.723 -13.503
261 HH12 ARG 36 1HH1 ARG 36 -7.149 3.333 -12.959
262 HH21 ARG 36 2HH2 ARG 36 -7.691 4.579 -9.737
263 HH22 ARG 36 1HH2 ARG 36 -7.959 3.253 -10.817
264 H LEU 37 H LEU 37 -0.390 7.478 -12.770
265 HA LEU 37 HA LEU 37 -0.055 5.671 -10.608
266 HB2 LEU 37 1HB LEU 37 1.226 5.388 -12.615
267 HB3 LEU 37 2HB LEU 37 1.926 6.997 -12.449
268 HG LEU 37 HG LEU 37 2.932 6.068 -10.249
269 HD11 LEU 37 1HD1 LEU 37 3.418 3.495 -10.972
270 HD12 LEU 37 2HD1 LEU 37 1.734 3.682 -11.458
271 HD13 LEU 37 3HD1 LEU 37 2.209 3.997 -9.790
272 HD21 LEU 37 3HD2 LEU 37 4.810 6.147 -11.432
273 HD22 LEU 37 1HD2 LEU 37 3.829 6.237 -12.895
274 HD23 LEU 37 2HD2 LEU 37 4.384 4.672 -12.301
275 H SER 38 H SER 38 1.021 9.002 -11.173
276 HA SER 38 HA SER 38 2.540 9.308 -8.842
277 HB2 SER 38 1HB SER 38 2.719 10.937 -10.605
278 HB3 SER 38 2HB SER 38 1.008 11.341 -10.476
279 HG SER 38 HG SER 38 2.677 12.741 -9.384
280 H HIS 39 H HIS 39 -0.907 9.751 -9.442
281 HA HIS 39 HA HIS 39 -1.608 10.955 -7.017
282 HB2 HIS 39 1HB HIS 39 -3.101 10.752 -9.001
283 HB3 HIS 39 2HB HIS 39 -3.287 9.037 -8.646
284 HD1 HIS 39 HD1 HIS 39 -4.661 12.320 -7.844
285 HD2 HIS 39 HD2 HIS 39 -4.639 8.544 -6.111
286 HE1 HIS 39 HE1 HIS 39 -6.510 12.351 -6.140
287 H LEU 40 H LEU 40 -1.570 7.514 -7.919
288 HA LEU 40 HA LEU 40 -2.327 6.613 -5.322
289 HB2 LEU 40 1HB LEU 40 -0.982 5.092 -7.551
290 HB3 LEU 40 2HB LEU 40 -1.790 4.389 -6.151
291 HG LEU 40 HG LEU 40 -3.147 5.987 -8.322
292 HD11 LEU 40 1HD1 LEU 40 -2.712 4.039 -9.425
293 HD12 LEU 40 2HD1 LEU 40 -4.203 3.585 -8.600
294 HD13 LEU 40 3HD1 LEU 40 -2.644 3.083 -7.945
295 HD21 LEU 40 3HD2 LEU 40 -4.141 4.593 -5.853
296 HD22 LEU 40 1HD2 LEU 40 -5.193 4.943 -7.225
297 HD23 LEU 40 2HD2 LEU 40 -4.406 6.262 -6.358
298 H PHE 41 H PHE 41 0.713 7.235 -6.933
299 HA PHE 41 HA PHE 41 2.454 5.836 -5.265
300 HB2 PHE 41 1HB PHE 41 2.749 7.467 -7.439
301 HB3 PHE 41 2HB PHE 41 3.430 8.465 -6.158
302 HD1 PHE 41 HD1 PHE 41 5.434 7.781 -4.978
303 HD2 PHE 41 HD2 PHE 41 3.807 5.414 -8.120
304 HE1 PHE 41 HE1 PHE 41 7.541 6.519 -5.114
305 HE2 PHE 41 HE2 PHE 41 5.912 4.147 -8.260
306 HZ PHE 41 HZ PHE 41 7.782 4.699 -6.756
307 H ARG 42 H ARG 42 1.320 9.199 -5.011
308 HA ARG 42 HA ARG 42 2.690 9.745 -2.591
309 HB2 ARG 42 1HB ARG 42 1.673 11.384 -4.325
310 HB3 ARG 42 2HB ARG 42 0.177 11.159 -3.428
311 HG2 ARG 42 1HG ARG 42 2.480 11.773 -1.740
312 HG3 ARG 42 2HG ARG 42 2.074 13.042 -2.897
313 HD2 ARG 42 1HD ARG 42 -0.131 11.794 -1.341
314 HD3 ARG 42 2HD ARG 42 0.944 12.915 -0.508
315 HE ARG 42 HE ARG 42 0.075 14.059 -2.931
316 HH11 ARG 42 2HH1 ARG 42 -1.093 13.213 0.238
317 HH12 ARG 42 1HH1 ARG 42 -2.306 14.450 0.263
318 HH21 ARG 42 2HH2 ARG 42 -1.519 15.691 -2.909
319 HH22 ARG 42 1HH2 ARG 42 -2.549 15.858 -1.528
320 H GLN 43 H GLN 43 -0.320 8.206 -3.332
321 HA GLN 43 HA GLN 43 -1.454 8.505 -0.710
322 HB2 GLN 43 1HB GLN 43 -2.188 6.957 -3.171
323 HB3 GLN 43 2HB GLN 43 -2.988 6.611 -1.643
324 HG2 GLN 43 1HG GLN 43 -3.475 9.125 -1.554
325 HG3 GLN 43 2HG GLN 43 -3.047 9.126 -3.264
326 HE21 GLN 43 2HE2 GLN 43 -5.609 9.442 -1.603
327 HE22 GLN 43 1HE2 GLN 43 -6.743 8.431 -2.425
328 H GLN 44 H GLN 44 0.283 5.977 -2.460
329 HA GLN 44 HA GLN 44 0.088 4.110 -0.270
330 HB2 GLN 44 1HB GLN 44 1.619 4.052 -2.871
331 HB3 GLN 44 2HB GLN 44 1.667 2.750 -1.690
332 HG2 GLN 44 1HG GLN 44 -0.805 3.747 -3.088
333 HG3 GLN 44 2HG GLN 44 0.104 2.298 -3.515
334 HE21 GLN 44 2HE2 GLN 44 -2.615 2.309 -2.851
335 HE22 GLN 44 1HE2 GLN 44 -2.821 1.424 -1.382
336 H LEU 45 H LEU 45 2.533 6.256 -1.634
337 HA LEU 45 HA LEU 45 4.503 5.418 0.331
338 HB2 LEU 45 1HB LEU 45 4.633 6.467 -2.240
339 HB3 LEU 45 2HB LEU 45 5.188 7.778 -1.202
340 HG LEU 45 HG LEU 45 6.366 5.039 -0.927
341 HD11 LEU 45 1HD1 LEU 45 7.200 7.126 -2.937
342 HD12 LEU 45 2HD1 LEU 45 6.507 5.546 -3.301
343 HD13 LEU 45 3HD1 LEU 45 8.095 5.659 -2.543
344 HD21 LEU 45 3HD2 LEU 45 8.117 6.123 0.122
345 HD22 LEU 45 1HD2 LEU 45 6.727 7.076 0.642
346 HD23 LEU 45 2HD2 LEU 45 7.766 7.668 -0.655
347 H GLY 46 H GLY 46 2.054 7.767 0.017
348 HA2 GLY 46 1HA GLY 46 1.348 9.413 1.458
349 HA3 GLY 46 2HA GLY 46 2.521 8.804 2.617
350 H ILE 47 H ILE 47 4.007 9.532 -0.301
351 HA ILE 47 HA ILE 47 4.463 12.338 0.311
352 HB ILE 47 HB ILE 47 6.856 12.176 0.434
353 HG12 ILE 47 1HG1 ILE 47 6.468 9.193 0.102
354 HG13 ILE 47 2HG1 ILE 47 7.189 10.283 -1.077
355 HG21 ILE 47 1HG2 ILE 47 5.636 11.925 2.527
356 HG22 ILE 47 2HG2 ILE 47 5.572 10.179 2.293
357 HG23 ILE 47 3HG2 ILE 47 7.123 10.977 2.552
358 HD11 ILE 47 3HD1 ILE 47 8.969 9.164 -0.026
359 HD12 ILE 47 1HD1 ILE 47 8.947 10.790 0.655
360 HD13 ILE 47 2HD1 ILE 47 8.293 9.438 1.580
361 H SER 48 H SER 48 6.091 13.264 -1.345
362 HA SER 48 HA SER 48 5.090 12.598 -3.951
363 HB2 SER 48 1HB SER 48 6.782 14.421 -4.643
364 HB3 SER 48 2HB SER 48 5.426 14.904 -3.623
365 HG SER 48 HG SER 48 7.829 15.446 -3.097
366 H VAL 49 H VAL 49 6.261 11.846 -5.729
367 HA VAL 49 HA VAL 49 8.027 9.755 -5.307
368 HB VAL 49 HB VAL 49 7.855 11.427 -7.817
369 HG11 VAL 49 1HG1 VAL 49 8.743 8.585 -7.343
370 HG12 VAL 49 2HG1 VAL 49 8.514 9.319 -8.931
371 HG13 VAL 49 3HG1 VAL 49 9.755 9.940 -7.842
372 HG21 VAL 49 3HG2 VAL 49 6.323 9.236 -8.285
373 HG22 VAL 49 1HG2 VAL 49 5.983 9.533 -6.580
374 HG23 VAL 49 2HG2 VAL 49 5.694 10.801 -7.771
375 H LEU 50 H LEU 50 8.731 13.127 -6.147
376 HA LEU 50 HA LEU 50 11.507 12.853 -6.452
377 HB2 LEU 50 1HB LEU 50 9.592 15.043 -6.110
378 HB3 LEU 50 2HB LEU 50 11.210 15.398 -5.508
379 HG LEU 50 HG LEU 50 12.149 14.961 -7.706
380 HD11 LEU 50 1HD1 LEU 50 10.973 13.402 -8.849
381 HD12 LEU 50 2HD1 LEU 50 10.214 14.835 -9.543
382 HD13 LEU 50 3HD1 LEU 50 9.417 13.961 -8.235
383 HD21 LEU 50 3HD2 LEU 50 11.067 17.201 -7.024
384 HD22 LEU 50 1HD2 LEU 50 9.802 16.762 -8.171
385 HD23 LEU 50 2HD2 LEU 50 11.468 16.937 -8.721
386 H SER 51 H SER 51 9.497 13.295 -3.616
387 HA SER 51 HA SER 51 11.642 13.880 -1.827
388 HB2 SER 51 1HB SER 51 9.426 14.600 -1.225
389 HB3 SER 51 2HB SER 51 8.803 12.955 -1.347
390 HG SER 51 HG SER 51 9.160 13.324 0.796
391 H TRP 52 H TRP 52 9.801 10.954 -2.608
392 HA TRP 52 HA TRP 52 10.974 9.242 -0.738
393 HB2 TRP 52 1HB TRP 52 8.990 8.569 -1.934
394 HB3 TRP 52 2HB TRP 52 9.836 8.660 -3.477
395 HD1 TRP 52 HD1 TRP 52 10.148 6.633 -0.174
396 HE1 TRP 52 HE1 TRP 52 10.875 4.241 -0.786
397 HE3 TRP 52 HE3 TRP 52 10.625 7.199 -5.232
398 HZ2 TRP 52 HZ2 TRP 52 11.560 2.786 -3.106
399 HZ3 TRP 52 HZ3 TRP 52 11.321 5.259 -6.576
400 HH2 TRP 52 HH2 TRP 52 11.778 3.099 -5.533
401 H ARG 53 H ARG 53 11.979 10.109 -4.015
402 HA ARG 53 HA ARG 53 14.087 8.277 -4.269
403 HB2 ARG 53 1HB ARG 53 13.123 9.619 -6.131
404 HB3 ARG 53 2HB ARG 53 13.910 11.045 -5.469
405 HG2 ARG 53 1HG ARG 53 16.097 9.858 -5.748
406 HG3 ARG 53 2HG ARG 53 15.221 8.595 -6.616
407 HD2 ARG 53 1HD ARG 53 15.938 9.938 -8.347
408 HD3 ARG 53 2HD ARG 53 14.325 10.580 -8.043
409 HE ARG 53 HE ARG 53 16.045 12.055 -6.470
410 HH11 ARG 53 2HH1 ARG 53 15.620 11.409 -9.865
411 HH12 ARG 53 1HH1 ARG 53 16.248 12.942 -10.369
412 HH21 ARG 53 2HH2 ARG 53 16.874 14.078 -7.122
413 HH22 ARG 53 1HH2 ARG 53 16.962 14.460 -8.808
414 H GLU 54 H GLU 54 14.068 11.630 -3.091
415 HA GLU 54 HA GLU 54 16.841 11.766 -2.564
416 HB2 GLU 54 1HB GLU 54 14.454 13.388 -1.922
417 HB3 GLU 54 2HB GLU 54 15.818 13.574 -0.829
418 HG2 GLU 54 1HG GLU 54 17.149 14.524 -2.420
419 HG3 GLU 54 2HG GLU 54 16.326 13.713 -3.751
420 H ASP 55 H ASP 55 14.057 11.056 -0.478
421 HA ASP 55 HA ASP 55 15.495 10.746 1.916
422 HB2 ASP 55 1HB ASP 55 12.796 10.398 1.025
423 HB3 ASP 55 2HB ASP 55 13.270 8.985 1.964
424 H GLN 56 H GLN 56 14.726 8.486 -0.672
425 HA GLN 56 HA GLN 56 15.589 6.142 0.648
426 HB2 GLN 56 1HB GLN 56 14.990 6.913 -2.161
427 HB3 GLN 56 2HB GLN 56 15.954 5.464 -1.911
428 HG2 GLN 56 1HG GLN 56 13.270 5.955 -0.645
429 HG3 GLN 56 2HG GLN 56 13.524 5.042 -2.131
430 HE21 GLN 56 2HE2 GLN 56 15.395 3.358 -1.809
431 HE22 GLN 56 1HE2 GLN 56 15.211 2.353 -0.417
432 H ARG 57 H ARG 57 17.243 8.499 -1.390
433 HA ARG 57 HA ARG 57 19.653 7.129 -1.750
434 HB2 ARG 57 1HB ARG 57 19.056 10.085 -1.607
435 HB3 ARG 57 2HB ARG 57 20.634 9.441 -2.040
436 HG2 ARG 57 1HG ARG 57 19.910 8.651 -4.070
437 HG3 ARG 57 2HG ARG 57 18.231 8.521 -3.540
438 HD2 ARG 57 1HD ARG 57 17.960 10.404 -4.740
439 HD3 ARG 57 2HD ARG 57 18.630 11.187 -3.308
440 HE ARG 57 HE ARG 57 20.554 11.632 -4.482
441 HH11 ARG 57 2HH1 ARG 57 18.602 9.360 -6.256
442 HH12 ARG 57 1HH1 ARG 57 19.565 9.454 -7.693
443 HH21 ARG 57 2HH2 ARG 57 21.830 11.766 -6.368
444 HH22 ARG 57 1HH2 ARG 57 21.401 10.823 -7.755
445 H ILE 58 H ILE 58 18.605 9.304 0.841
446 HA ILE 58 HA ILE 58 21.074 9.313 2.233
447 HB ILE 58 HB ILE 58 18.292 9.840 3.287
448 HG12 ILE 58 1HG1 ILE 58 18.892 11.354 1.469
449 HG13 ILE 58 2HG1 ILE 58 18.900 12.218 3.003
450 HG21 ILE 58 1HG2 ILE 58 20.810 9.621 4.625
451 HG22 ILE 58 2HG2 ILE 58 20.237 11.285 4.718
452 HG23 ILE 58 3HG2 ILE 58 19.218 9.968 5.299
453 HD11 ILE 58 3HD1 ILE 58 21.049 11.755 1.105
454 HD12 ILE 58 1HD1 ILE 58 20.888 12.978 2.365
455 HD13 ILE 58 2HD1 ILE 58 21.497 11.372 2.767
456 H SER 59 H SER 59 18.109 7.401 2.592
457 HA SER 59 HA SER 59 18.968 5.952 4.867
458 HB2 SER 59 1HB SER 59 16.664 5.868 4.561
459 HB3 SER 59 2HB SER 59 16.802 5.587 2.825
460 HG SER 59 HG SER 59 16.461 3.586 3.392
461 H GLN 60 H GLN 60 19.430 5.525 1.434
462 HA GLN 60 HA GLN 60 20.316 2.822 1.550
463 HB2 GLN 60 1HB GLN 60 19.485 4.222 -0.483
464 HB3 GLN 60 2HB GLN 60 21.162 4.742 -0.594
465 HG2 GLN 60 1HG GLN 60 21.187 2.963 -2.014
466 HG3 GLN 60 2HG GLN 60 21.641 2.169 -0.506
467 HE21 GLN 60 2HE2 GLN 60 20.444 0.527 0.196
468 HE22 GLN 60 1HE2 GLN 60 18.927 0.039 -0.473
469 H ALA 61 H ALA 61 21.984 5.949 1.480
470 HA ALA 61 HA ALA 61 24.607 5.030 1.334
471 HB1 ALA 61 1HB ALA 61 23.602 7.447 1.283
472 HB2 ALA 61 2HB ALA 61 23.970 7.413 3.008
473 HB3 ALA 61 3HB ALA 61 25.258 7.176 1.827
474 H LYS 62 H LYS 62 22.456 5.351 4.099
475 HA LYS 62 HA LYS 62 24.348 4.966 6.138
476 HB2 LYS 62 1HB LYS 62 21.385 4.527 5.942
477 HB3 LYS 62 2HB LYS 62 22.260 4.038 7.387
478 HG2 LYS 62 1HG LYS 62 23.096 6.369 7.597
479 HG3 LYS 62 2HG LYS 62 22.051 6.814 6.245
480 HD2 LYS 62 1HD LYS 62 20.156 5.775 7.646
481 HD3 LYS 62 2HD LYS 62 21.286 5.893 8.997
482 HE2 LYS 62 1HE LYS 62 20.018 7.868 9.086
483 HE3 LYS 62 2HE LYS 62 21.550 8.341 8.353
484 HZ1 LYS 62 3HZ LYS 62 19.030 7.777 6.887
485 HZ2 LYS 62 1HZ LYS 62 20.501 8.213 6.176
486 HZ3 LYS 62 2HZ LYS 62 19.687 9.309 7.174
487 H LEU 63 H LEU 63 22.457 2.672 4.231
488 HA LEU 63 HA LEU 63 23.145 0.347 5.654
489 HB2 LEU 63 1HB LEU 63 21.320 0.306 4.117
490 HB3 LEU 63 2HB LEU 63 22.364 0.779 2.779
491 HG LEU 63 HG LEU 63 23.523 -1.420 2.996
492 HD11 LEU 63 1HD1 LEU 63 22.909 -3.025 4.480
493 HD12 LEU 63 2HD1 LEU 63 21.237 -2.472 4.561
494 HD13 LEU 63 3HD1 LEU 63 22.495 -1.603 5.438
495 HD21 LEU 63 3HD2 LEU 63 20.558 -1.422 2.448
496 HD22 LEU 63 1HD2 LEU 63 21.657 -2.730 2.010
497 HD23 LEU 63 2HD2 LEU 63 21.857 -1.133 1.290
498 H LEU 64 H LEU 64 24.671 1.941 2.883
499 HA LEU 64 HA LEU 64 26.693 -0.026 2.528
500 HB2 LEU 64 1HB LEU 64 26.793 2.869 1.708
501 HB3 LEU 64 2HB LEU 64 27.721 1.535 1.026
502 HG LEU 64 HG LEU 64 24.826 1.174 0.822
503 HD11 LEU 64 1HD1 LEU 64 25.091 2.859 -1.266
504 HD12 LEU 64 2HD1 LEU 64 26.071 3.690 -0.058
505 HD13 LEU 64 3HD1 LEU 64 24.383 3.313 0.285
506 HD21 LEU 64 3HD2 LEU 64 25.840 1.045 -1.679
507 HD22 LEU 64 1HD2 LEU 64 25.847 -0.300 -0.538
508 HD23 LEU 64 2HD2 LEU 64 27.285 0.705 -0.725
509 H LEU 65 H LEU 65 26.595 3.103 4.190
510 HA LEU 65 HA LEU 65 29.314 3.094 4.984
511 HB2 LEU 65 1HB LEU 65 26.959 4.722 5.418
512 HB3 LEU 65 2HB LEU 65 27.927 4.576 6.883
513 HG LEU 65 HG LEU 65 28.969 5.544 4.222
514 HD11 LEU 65 1HD1 LEU 65 27.267 7.030 5.326
515 HD12 LEU 65 2HD1 LEU 65 28.857 7.751 5.074
516 HD13 LEU 65 3HD1 LEU 65 28.391 7.183 6.677
517 HD21 LEU 65 3HD2 LEU 65 30.648 4.484 5.676
518 HD22 LEU 65 1HD2 LEU 65 30.209 5.598 6.971
519 HD23 LEU 65 2HD2 LEU 65 30.926 6.215 5.482
520 H SER 66 H SER 66 26.467 1.580 6.239
521 HA SER 66 HA SER 66 27.714 0.992 8.804
522 HB2 SER 66 1HB SER 66 25.382 1.524 8.932
523 HB3 SER 66 2HB SER 66 24.986 0.369 7.660
524 HG SER 66 HG SER 66 26.076 -0.312 10.192
525 H THR 67 H THR 67 27.111 -0.500 5.737
526 HA THR 67 HA THR 67 27.804 -3.152 6.745
527 HB THR 67 HB THR 67 25.930 -2.727 5.042
528 HG1 THR 67 HG1 THR 67 26.622 -4.687 3.865
529 HG21 THR 67 3HG2 THR 67 26.389 -2.075 2.933
530 HG22 THR 67 1HG2 THR 67 27.894 -2.992 2.869
531 HG23 THR 67 2HG2 THR 67 27.857 -1.410 3.648
532 H THR 68 H THR 68 29.316 -0.448 5.407
533 HA THR 68 HA THR 68 31.704 -2.053 4.797
534 HB THR 68 HB THR 68 32.209 -0.877 2.844
535 HG1 THR 68 HG1 THR 68 31.758 1.180 2.671
536 HG21 THR 68 3HG2 THR 68 29.322 -0.671 2.330
537 HG22 THR 68 1HG2 THR 68 29.848 -2.224 2.978
538 HG23 THR 68 2HG2 THR 68 30.560 -1.603 1.489
539 H ARG 69 H ARG 69 33.679 -0.512 4.603
540 HA ARG 69 HA ARG 69 33.519 1.464 6.785
541 HB2 ARG 69 1HB ARG 69 35.878 0.899 7.297
542 HB3 ARG 69 2HB ARG 69 34.784 -0.458 7.524
543 HG2 ARG 69 1HG ARG 69 36.098 -0.225 4.885
544 HG3 ARG 69 2HG ARG 69 37.112 -0.676 6.258
545 HD2 ARG 69 1HD ARG 69 34.566 -2.064 5.425
546 HD3 ARG 69 2HD ARG 69 36.199 -2.636 5.088
547 HE ARG 69 HE ARG 69 36.165 -2.365 7.785
548 HH11 ARG 69 2HH1 ARG 69 34.125 -4.019 5.500
549 HH12 ARG 69 1HH1 ARG 69 33.679 -5.274 6.609
550 HH21 ARG 69 2HH2 ARG 69 35.586 -4.011 9.254
551 HH22 ARG 69 1HH2 ARG 69 34.510 -5.268 8.744
552 H MET 70 H MET 70 33.382 1.599 3.726
553 HA MET 70 HA MET 70 35.708 2.901 2.800
554 HB2 MET 70 1HB MET 70 32.867 3.162 1.800
555 HB3 MET 70 2HB MET 70 34.313 3.643 0.922
556 HG2 MET 70 1HG MET 70 35.059 1.317 0.880
557 HG3 MET 70 2HG MET 70 33.605 0.839 1.752
558 HE1 MET 70 3HE MET 70 31.225 0.567 0.644
559 HE2 MET 70 1HE MET 70 31.282 2.330 0.641
560 HE3 MET 70 2HE MET 70 30.774 1.462 -0.807
561 HA PRO 71 HA PRO 71 35.400 6.961 4.441
562 HB2 PRO 71 1HB PRO 71 36.445 8.427 2.410
563 HB3 PRO 71 2HB PRO 71 37.427 7.386 3.447
564 HG2 PRO 71 1HG PRO 71 36.343 6.851 0.708
565 HG3 PRO 71 2HG PRO 71 37.952 6.495 1.364
566 HD2 PRO 71 1HD PRO 71 36.020 4.611 1.141
567 HD3 PRO 71 2HD PRO 71 37.229 4.589 2.440
568 H ILE 72 H ILE 72 34.421 9.079 4.128
569 HA ILE 72 HA ILE 72 31.802 8.959 3.167
570 HB ILE 72 HB ILE 72 33.441 11.459 3.592
571 HG12 ILE 72 1HG1 ILE 72 31.736 9.894 5.542
572 HG13 ILE 72 2HG1 ILE 72 33.493 10.003 5.568
573 HG21 ILE 72 1HG2 ILE 72 31.343 12.582 3.905
574 HG22 ILE 72 2HG2 ILE 72 31.301 11.734 2.360
575 HG23 ILE 72 3HG2 ILE 72 30.458 11.064 3.756
576 HD11 ILE 72 3HD1 ILE 72 32.392 11.451 7.227
577 HD12 ILE 72 1HD1 ILE 72 33.386 12.347 6.077
578 HD13 ILE 72 2HD1 ILE 72 31.630 12.339 5.908
579 H ALA 73 H ALA 73 34.774 9.915 1.603
580 HA ALA 73 HA ALA 73 33.670 11.281 -0.602
581 HB1 ALA 73 1HB ALA 73 35.989 11.545 -0.129
582 HB2 ALA 73 2HB ALA 73 36.278 9.810 -0.277
583 HB3 ALA 73 3HB ALA 73 35.858 10.759 -1.703
584 H THR 74 H THR 74 34.630 7.885 -0.182
585 HA THR 74 HA THR 74 33.848 7.100 -2.806
586 HB THR 74 HB THR 74 34.291 5.405 -0.341
587 HG1 THR 74 HG1 THR 74 36.008 5.994 -2.543
588 HG21 THR 74 3HG2 THR 74 34.544 3.539 -1.898
589 HG22 THR 74 1HG2 THR 74 34.164 4.604 -3.251
590 HG23 THR 74 2HG2 THR 74 32.937 4.253 -2.034
591 H VAL 75 H VAL 75 32.297 6.981 0.368
592 HA VAL 75 HA VAL 75 30.069 5.443 -0.264
593 HB VAL 75 HB VAL 75 30.220 7.773 1.654
594 HG11 VAL 75 1HG1 VAL 75 28.302 6.735 2.763
595 HG12 VAL 75 2HG1 VAL 75 27.914 7.199 1.105
596 HG13 VAL 75 3HG1 VAL 75 28.233 5.509 1.498
597 HG21 VAL 75 3HG2 VAL 75 30.225 5.060 2.731
598 HG22 VAL 75 1HG2 VAL 75 31.634 5.425 1.734
599 HG23 VAL 75 2HG2 VAL 75 31.252 6.439 3.126
600 H GLY 76 H GLY 76 30.619 8.914 -0.682
601 HA2 GLY 76 1HA GLY 76 28.044 9.690 -1.410
602 HA3 GLY 76 2HA GLY 76 29.519 10.478 -1.950
603 H ARG 77 H ARG 77 30.627 8.322 -3.403
604 HA ARG 77 HA ARG 77 29.447 8.701 -5.905
605 HB2 ARG 77 1HB ARG 77 31.469 6.798 -4.805
606 HB3 ARG 77 2HB ARG 77 30.807 6.488 -6.405
607 HG2 ARG 77 1HG ARG 77 31.469 8.855 -6.994
608 HG3 ARG 77 2HG ARG 77 32.371 8.877 -5.477
609 HD2 ARG 77 1HD ARG 77 33.719 7.013 -6.202
610 HD3 ARG 77 2HD ARG 77 32.753 6.841 -7.667
611 HE ARG 77 HE ARG 77 33.960 9.430 -7.396
612 HH11 ARG 77 2HH1 ARG 77 34.443 6.157 -8.479
613 HH12 ARG 77 1HH1 ARG 77 35.681 6.578 -9.616
614 HH21 ARG 77 2HH2 ARG 77 35.589 9.997 -8.890
615 HH22 ARG 77 1HH2 ARG 77 36.333 8.762 -9.848
616 H ASN 78 H ASN 78 28.936 6.228 -3.469
617 HA ASN 78 HA ASN 78 27.515 4.379 -5.028
618 HB2 ASN 78 1HB ASN 78 27.351 5.001 -2.074
619 HB3 ASN 78 2HB ASN 78 26.556 3.625 -2.832
620 HD21 ASN 78 2HD2 ASN 78 29.658 5.098 -2.132
621 HD22 ASN 78 1HD2 ASN 78 30.584 3.643 -2.234
622 H VAL 79 H VAL 79 26.545 7.356 -3.476
623 HA VAL 79 HA VAL 79 23.741 6.878 -4.184
624 HB VAL 79 HB VAL 79 23.226 8.857 -2.843
625 HG11 VAL 79 1HG1 VAL 79 24.541 7.864 -0.674
626 HG12 VAL 79 2HG1 VAL 79 23.049 7.199 -1.341
627 HG13 VAL 79 3HG1 VAL 79 24.605 6.497 -1.786
628 HG21 VAL 79 3HG2 VAL 79 26.150 8.987 -2.137
629 HG22 VAL 79 1HG2 VAL 79 25.401 10.014 -3.359
630 HG23 VAL 79 2HG2 VAL 79 24.873 10.114 -1.679
631 H GLY 80 H GLY 80 26.113 7.678 -5.985
632 HA2 GLY 80 1HA GLY 80 26.224 8.835 -7.978
633 HA3 GLY 80 2HA GLY 80 24.592 9.414 -7.678
634 H PHE 81 H PHE 81 26.446 10.073 -5.003
635 HA PHE 81 HA PHE 81 26.531 12.885 -5.658
636 HB2 PHE 81 1HB PHE 81 26.958 11.254 -3.192
637 HB3 PHE 81 2HB PHE 81 27.629 12.881 -3.251
638 HD1 PHE 81 HD1 PHE 81 24.439 11.576 -4.645
639 HD2 PHE 81 HD2 PHE 81 26.321 14.134 -1.811
640 HE1 PHE 81 HE1 PHE 81 22.244 12.499 -4.025
641 HE2 PHE 81 HE2 PHE 81 24.130 15.060 -1.186
642 HZ PHE 81 HZ PHE 81 22.087 14.243 -2.293
643 H ASP 82 H ASP 82 28.183 13.784 -6.676
644 HA ASP 82 HA ASP 82 30.739 12.446 -6.842
645 HB2 ASP 82 1HB ASP 82 31.346 14.225 -8.398
646 HB3 ASP 82 2HB ASP 82 29.766 13.565 -8.813
647 H ASP 83 H ASP 83 29.347 15.184 -5.180
648 HA ASP 83 HA ASP 83 31.966 15.981 -4.148
649 HB2 ASP 83 1HB ASP 83 30.554 17.790 -4.940
650 HB3 ASP 83 2HB ASP 83 29.242 17.269 -3.886
651 H GLN 84 H GLN 84 32.671 15.158 -2.303
652 HA GLN 84 HA GLN 84 31.140 13.490 -0.640
653 HB2 GLN 84 1HB GLN 84 33.574 13.328 -0.774
654 HB3 GLN 84 2HB GLN 84 33.735 14.925 -0.055
655 HG2 GLN 84 1HG GLN 84 32.477 13.953 1.944
656 HG3 GLN 84 2HG GLN 84 32.819 12.379 1.228
657 HE21 GLN 84 2HE2 GLN 84 34.589 15.403 1.817
658 HE22 GLN 84 1HE2 GLN 84 35.982 14.651 2.508
659 H LEU 85 H LEU 85 32.032 16.898 -0.370
660 HA LEU 85 HA LEU 85 30.981 17.304 2.223
661 HB2 LEU 85 1HB LEU 85 31.494 19.207 -0.052
662 HB3 LEU 85 2HB LEU 85 30.979 19.722 1.553
663 HG LEU 85 HG LEU 85 33.520 18.184 1.049
664 HD11 LEU 85 1HD1 LEU 85 33.650 20.270 -0.174
665 HD12 LEU 85 2HD1 LEU 85 34.676 20.342 1.258
666 HD13 LEU 85 3HD1 LEU 85 33.117 21.166 1.249
667 HD21 LEU 85 3HD2 LEU 85 32.660 19.893 3.380
668 HD22 LEU 85 1HD2 LEU 85 34.125 18.919 3.255
669 HD23 LEU 85 2HD2 LEU 85 32.548 18.133 3.333
670 H TYR 86 H TYR 86 29.566 17.383 -0.978
671 HA TYR 86 HA TYR 86 27.166 18.704 -0.340
672 HB2 TYR 86 1HB TYR 86 27.826 18.421 -2.645
673 HB3 TYR 86 2HB TYR 86 27.787 16.668 -2.487
674 HD1 TYR 86 HD2 TYR 86 25.281 19.122 -1.257
675 HD2 TYR 86 HD1 TYR 86 26.166 16.049 -4.064
676 HE1 TYR 86 HE2 TYR 86 22.930 19.114 -1.981
677 HE2 TYR 86 HE1 TYR 86 23.818 16.034 -4.797
678 HH TYR 86 HH TYR 86 21.779 16.850 -4.463
679 H PHE 87 H PHE 87 28.054 15.278 -0.301
680 HA PHE 87 HA PHE 87 25.483 14.300 0.356
681 HB2 PHE 87 1HB PHE 87 27.072 12.769 -0.560
682 HB3 PHE 87 2HB PHE 87 28.245 13.132 0.701
683 HD1 PHE 87 HD2 PHE 87 25.025 11.481 -0.005
684 HD2 PHE 87 HD1 PHE 87 28.201 12.010 2.779
685 HE1 PHE 87 HE2 PHE 87 24.165 9.600 1.328
686 HE2 PHE 87 HE1 PHE 87 27.347 10.129 4.116
687 HZ PHE 87 HZ PHE 87 25.326 8.922 3.392
688 H SER 88 H SER 88 28.333 15.026 2.351
689 HA SER 88 HA SER 88 27.157 14.305 4.814
690 HB2 SER 88 1HB SER 88 29.017 15.616 5.826
691 HB3 SER 88 2HB SER 88 29.570 14.479 4.596
692 HG SER 88 HG SER 88 29.320 17.286 4.427
693 H ARG 89 H ARG 89 27.277 17.326 3.012
694 HA ARG 89 HA ARG 89 26.272 19.017 5.023
695 HB2 ARG 89 1HB ARG 89 26.417 19.150 2.038
696 HB3 ARG 89 2HB ARG 89 25.447 20.336 2.900
697 HG2 ARG 89 1HG ARG 89 28.366 19.806 3.409
698 HG3 ARG 89 2HG ARG 89 27.731 21.116 2.413
699 HD2 ARG 89 1HD ARG 89 27.349 20.697 5.370
700 HD3 ARG 89 2HD ARG 89 28.212 22.011 4.572
701 HE ARG 89 HE ARG 89 25.371 21.789 4.974
702 HH11 ARG 89 2HH1 ARG 89 27.900 23.242 3.073
703 HH12 ARG 89 1HH1 ARG 89 26.930 24.588 2.574
704 HH21 ARG 89 2HH2 ARG 89 24.084 23.557 4.324
705 HH22 ARG 89 1HH2 ARG 89 24.760 24.767 3.287
706 H VAL 90 H VAL 90 24.602 17.358 2.351
707 HA VAL 90 HA VAL 90 22.005 18.195 3.159
708 HB VAL 90 HB VAL 90 22.824 15.906 1.364
709 HG11 VAL 90 1HG1 VAL 90 20.143 17.152 1.925
710 HG12 VAL 90 2HG1 VAL 90 20.472 16.185 0.486
711 HG13 VAL 90 3HG1 VAL 90 20.615 15.461 2.088
712 HG21 VAL 90 3HG2 VAL 90 23.435 17.567 -0.004
713 HG22 VAL 90 1HG2 VAL 90 21.709 17.880 -0.191
714 HG23 VAL 90 2HG2 VAL 90 22.648 18.792 0.991
715 H PHE 91 H PHE 91 23.817 15.164 3.538
716 HA PHE 91 HA PHE 91 21.806 13.711 4.846
717 HB2 PHE 91 1HB PHE 91 23.727 12.568 3.948
718 HB3 PHE 91 2HB PHE 91 24.816 13.481 4.987
719 HD1 PHE 91 HD1 PHE 91 24.958 12.993 7.375
720 HD2 PHE 91 HD2 PHE 91 22.499 10.689 4.775
721 HE1 PHE 91 HE1 PHE 91 24.801 11.234 9.088
722 HE2 PHE 91 HE2 PHE 91 22.337 8.927 6.484
723 HZ PHE 91 HZ PHE 91 23.489 9.198 8.644
724 H LYS 92 H LYS 92 24.218 15.964 6.046
725 HA LYS 92 HA LYS 92 24.032 15.453 8.779
726 HB2 LYS 92 1HB LYS 92 25.762 16.891 7.968
727 HB3 LYS 92 2HB LYS 92 24.594 18.008 7.274
728 HG2 LYS 92 1HG LYS 92 24.260 17.614 10.144
729 HG3 LYS 92 2HG LYS 92 25.828 18.289 9.696
730 HD2 LYS 92 1HD LYS 92 24.184 19.766 8.135
731 HD3 LYS 92 2HD LYS 92 23.133 19.468 9.522
732 HE2 LYS 92 1HE LYS 92 24.361 21.526 9.849
733 HE3 LYS 92 2HE LYS 92 24.903 20.316 11.012
734 HZ1 LYS 92 3HZ LYS 92 26.955 20.363 10.187
735 HZ2 LYS 92 1HZ LYS 92 26.505 21.779 9.377
736 HZ3 LYS 92 2HZ LYS 92 26.423 20.288 8.582
737 H LYS 93 H LYS 93 21.895 17.197 6.641
738 HA LYS 93 HA LYS 93 20.370 18.434 8.733
739 HB2 LYS 93 1HB LYS 93 19.636 17.993 5.833
740 HB3 LYS 93 2HB LYS 93 18.837 19.092 6.950
741 HG2 LYS 93 1HG LYS 93 21.738 19.485 6.611
742 HG3 LYS 93 2HG LYS 93 20.731 19.849 5.207
743 HD2 LYS 93 1HD LYS 93 19.292 21.076 7.104
744 HD3 LYS 93 2HD LYS 93 20.893 21.199 7.838
745 HE2 LYS 93 1HE LYS 93 21.730 22.486 6.099
746 HE3 LYS 93 2HE LYS 93 20.490 21.946 4.969
747 HZ1 LYS 93 3HZ LYS 93 20.478 24.203 6.682
748 HZ2 LYS 93 1HZ LYS 93 19.148 23.213 7.019
749 HZ3 LYS 93 2HZ LYS 93 19.393 23.794 5.450
750 H CYS 94 H CYS 94 20.333 15.387 7.093
751 HA CYS 94 HA CYS 94 17.655 14.647 7.542
752 HB2 CYS 94 1HB CYS 94 19.157 13.456 5.987
753 HB3 CYS 94 2HB CYS 94 20.097 12.871 7.354
754 HG CYS 94 HG CYS 94 16.852 12.127 7.585
755 H THR 95 H THR 95 20.598 13.961 9.421
756 HA THR 95 HA THR 95 18.928 13.025 11.640
757 HB THR 95 HB THR 95 20.895 12.049 12.593
758 HG1 THR 95 HG1 THR 95 22.262 13.590 10.637
759 HG21 THR 95 3HG2 THR 95 19.941 10.712 10.838
760 HG22 THR 95 1HG2 THR 95 21.696 10.598 10.726
761 HG23 THR 95 2HG2 THR 95 20.807 11.628 9.605
762 H GLY 96 H GLY 96 20.575 15.781 10.594
763 HA2 GLY 96 1HA GLY 96 20.435 17.858 11.719
764 HA3 GLY 96 2HA GLY 96 20.242 16.995 13.238
765 H ALA 97 H ALA 97 22.639 15.331 11.973
766 HA ALA 97 HA ALA 97 24.773 17.233 12.625
767 HB1 ALA 97 1HB ALA 97 25.028 14.486 13.728
768 HB2 ALA 97 2HB ALA 97 25.681 16.012 14.325
769 HB3 ALA 97 3HB ALA 97 23.977 15.627 14.567
770 H SER 98 H SER 98 26.837 16.677 11.783
771 HA SER 98 HA SER 98 26.768 15.500 9.225
772 HB2 SER 98 1HB SER 98 28.804 16.714 10.972
773 HB3 SER 98 2HB SER 98 29.432 15.507 9.850
774 HG SER 98 HG SER 98 27.764 17.669 9.082
775 HA PRO 99 HA PRO 99 27.573 11.233 9.843
776 HB2 PRO 99 1HB PRO 99 29.430 10.672 7.943
777 HB3 PRO 99 2HB PRO 99 27.738 11.015 7.562
778 HG2 PRO 99 1HG PRO 99 30.115 12.830 7.429
779 HG3 PRO 99 2HG PRO 99 28.783 12.645 6.274
780 HD2 PRO 99 1HD PRO 99 28.891 14.679 8.058
781 HD3 PRO 99 2HD PRO 99 27.359 13.969 7.511
782 H SER 100 H SER 100 30.347 13.373 9.856
783 HA SER 100 HA SER 100 32.250 11.506 10.813
784 HB2 SER 100 1HB SER 100 33.445 13.667 11.580
785 HB3 SER 100 2HB SER 100 33.165 13.447 9.853
786 HG SER 100 HG SER 100 32.579 15.556 10.876
787 H GLU 101 H GLU 101 29.903 13.584 12.380
788 HA GLU 101 HA GLU 101 30.934 13.225 15.022
789 HB2 GLU 101 1HB GLU 101 29.343 15.076 14.041
790 HB3 GLU 101 2HB GLU 101 28.078 13.944 14.500
791 HG2 GLU 101 1HG GLU 101 30.010 15.417 16.238
792 HG3 GLU 101 2HG GLU 101 28.252 15.344 16.335
793 H PHE 102 H PHE 102 28.193 11.848 13.228
794 HA PHE 102 HA PHE 102 27.221 10.193 15.262
795 HB2 PHE 102 1HB PHE 102 26.031 10.724 13.130
796 HB3 PHE 102 2HB PHE 102 27.133 9.638 12.291
797 HD1 PHE 102 HD2 PHE 102 24.607 9.748 15.008
798 HD2 PHE 102 HD1 PHE 102 26.668 7.366 12.144
799 HE1 PHE 102 HE2 PHE 102 23.122 7.854 15.519
800 HE2 PHE 102 HE1 PHE 102 25.185 5.468 12.650
801 HZ PHE 102 HZ PHE 102 23.410 5.711 14.341
802 H ARG 103 H ARG 103 29.666 9.603 12.775
803 HA ARG 103 HA ARG 103 30.077 6.881 13.226
804 HB2 ARG 103 1HB ARG 103 31.023 8.411 11.375
805 HB3 ARG 103 2HB ARG 103 32.311 8.766 12.518
806 HG2 ARG 103 1HG ARG 103 33.130 6.594 12.465
807 HG3 ARG 103 2HG ARG 103 31.622 5.940 11.820
808 HD2 ARG 103 1HD ARG 103 33.183 5.935 10.036
809 HD3 ARG 103 2HD ARG 103 32.070 7.268 9.731
810 HE ARG 103 HE ARG 103 33.837 8.699 9.877
811 HH11 ARG 103 2HH1 ARG 103 34.683 5.725 11.476
812 HH12 ARG 103 1HH1 ARG 103 36.322 6.200 11.775
813 HH21 ARG 103 2HH2 ARG 103 35.992 9.336 10.265
814 HH22 ARG 103 1HH2 ARG 103 37.065 8.254 11.087
815 H ALA 104 H ALA 104 31.272 9.696 14.937
816 HA ALA 104 HA ALA 104 33.266 8.380 16.458
817 HB1 ALA 104 1HB ALA 104 32.078 11.017 16.338
818 HB2 ALA 104 2HB ALA 104 32.401 10.517 17.998
819 HB3 ALA 104 3HB ALA 104 33.706 10.532 16.812
820 H GLY 105 H GLY 105 29.812 8.777 16.850
821 HA2 GLY 105 1HA GLY 105 28.395 7.507 18.187
822 HA3 GLY 105 2HA GLY 105 29.805 6.768 18.931
823 H CYS 106 H CYS 106 29.997 10.142 18.869
824 HA CYS 106 HA CYS 106 29.902 10.330 21.701
825 HB2 CYS 106 1HB CYS 106 31.189 11.793 19.975
826 HB3 CYS 106 2HB CYS 106 29.692 12.713 19.885
827 HG CYS 106 HG CYS 106 31.668 12.282 22.641
828 H GLU 107 H GLU 107 28.267 10.790 23.035
829 HA GLU 107 HA GLU 107 25.985 12.314 22.267
830 HB2 GLU 107 1HB GLU 107 25.448 10.153 21.175
831 HB3 GLU 107 2HB GLU 107 25.546 9.361 22.741
832 HG2 GLU 107 1HG GLU 107 23.269 9.684 22.393
833 HG3 GLU 107 2HG GLU 107 23.732 10.983 23.490
Start of MODEL 6
1 H1 MET 1 H MET 1 1.575 -0.359 0.800
2 HA MET 1 HA MET 1 2.568 1.306 -1.420
3 HB2 MET 1 1HB MET 1 4.066 -0.270 0.280
4 HB3 MET 1 2HB MET 1 3.842 -1.309 -1.121
5 HG2 MET 1 1HG MET 1 5.633 -0.266 -1.934
6 HG3 MET 1 2HG MET 1 4.516 1.048 -2.294
7 HE1 MET 1 3HE MET 1 7.224 1.593 -2.388
8 HE2 MET 1 1HE MET 1 6.612 3.195 -1.977
9 HE3 MET 1 2HE MET 1 7.965 2.511 -1.076
10 H ASP 2 H ASP 2 1.423 1.012 -3.206
11 HA ASP 2 HA ASP 2 -0.225 -1.315 -3.582
12 HB2 ASP 2 1HB ASP 2 -0.667 1.152 -4.321
13 HB3 ASP 2 2HB ASP 2 0.294 0.713 -5.730
14 H ASN 3 H ASN 3 -0.058 -2.854 -5.233
15 HA ASN 3 HA ASN 3 2.457 -3.895 -5.740
16 HB2 ASN 3 1HB ASN 3 -0.072 -4.266 -7.361
17 HB3 ASN 3 2HB ASN 3 1.354 -5.295 -7.456
18 HD21 ASN 3 2HD2 ASN 3 1.404 -7.018 -6.203
19 HD22 ASN 3 1HD2 ASN 3 0.403 -7.294 -4.822
20 H ARG 4 H ARG 4 0.512 -1.691 -7.691
21 HA ARG 4 HA ARG 4 2.218 -1.712 -9.959
22 HB2 ARG 4 1HB ARG 4 -0.128 -0.188 -9.044
23 HB3 ARG 4 2HB ARG 4 0.962 0.709 -10.093
24 HG2 ARG 4 1HG ARG 4 -0.350 -0.199 -11.690
25 HG3 ARG 4 2HG ARG 4 0.785 -1.539 -11.514
26 HD2 ARG 4 1HD ARG 4 -1.513 -2.343 -11.514
27 HD3 ARG 4 2HD ARG 4 -0.746 -2.632 -9.953
28 HE ARG 4 HE ARG 4 -2.000 -0.255 -9.610
29 HH11 ARG 4 2HH1 ARG 4 -3.035 -3.382 -10.735
30 HH12 ARG 4 1HH1 ARG 4 -4.658 -3.198 -10.156
31 HH21 ARG 4 2HH2 ARG 4 -4.133 0.000 -8.842
32 HH22 ARG 4 1HH2 ARG 4 -5.281 -1.274 -9.080
33 H VAL 5 H VAL 5 1.886 0.509 -7.206
34 HA VAL 5 HA VAL 5 3.865 2.338 -8.014
35 HB VAL 5 HB VAL 5 2.937 1.665 -5.218
36 HG11 VAL 5 1HG1 VAL 5 3.794 4.356 -5.474
37 HG12 VAL 5 2HG1 VAL 5 4.474 3.078 -4.464
38 HG13 VAL 5 3HG1 VAL 5 5.072 3.319 -6.106
39 HG21 VAL 5 3HG2 VAL 5 1.602 3.786 -5.538
40 HG22 VAL 5 1HG2 VAL 5 2.000 3.676 -7.252
41 HG23 VAL 5 2HG2 VAL 5 1.066 2.394 -6.479
42 H ARG 6 H ARG 6 4.023 -0.617 -6.093
43 HA ARG 6 HA ARG 6 6.656 -0.372 -5.174
44 HB2 ARG 6 1HB ARG 6 4.926 -2.058 -4.429
45 HB3 ARG 6 2HB ARG 6 5.288 -2.964 -5.892
46 HG2 ARG 6 1HG ARG 6 6.935 -3.979 -4.825
47 HG3 ARG 6 2HG ARG 6 7.752 -2.426 -4.641
48 HD2 ARG 6 1HD ARG 6 7.039 -2.149 -2.493
49 HD3 ARG 6 2HD ARG 6 5.548 -3.052 -2.758
50 HE ARG 6 HE ARG 6 7.436 -4.965 -2.936
51 HH11 ARG 6 2HH1 ARG 6 6.798 -2.487 -0.575
52 HH12 ARG 6 1HH1 ARG 6 7.424 -3.408 0.752
53 HH21 ARG 6 2HH2 ARG 6 8.264 -6.187 -1.197
54 HH22 ARG 6 1HH2 ARG 6 8.259 -5.512 0.397
55 H GLU 7 H GLU 7 5.357 -1.681 -8.185
56 HA GLU 7 HA GLU 7 7.755 -2.768 -9.178
57 HB2 GLU 7 1HB GLU 7 5.080 -2.263 -10.160
58 HB3 GLU 7 2HB GLU 7 6.278 -1.902 -11.395
59 HG2 GLU 7 1HG GLU 7 5.873 -4.504 -9.946
60 HG3 GLU 7 2HG GLU 7 5.598 -4.167 -11.655
61 H ALA 8 H ALA 8 6.365 0.461 -9.370
62 HA ALA 8 HA ALA 8 8.068 1.569 -11.286
63 HB1 ALA 8 1HB ALA 8 6.261 2.908 -10.779
64 HB2 ALA 8 2HB ALA 8 6.464 2.706 -9.038
65 HB3 ALA 8 3HB ALA 8 7.570 3.742 -9.941
66 H CYS 9 H CYS 9 8.501 1.073 -7.830
67 HA CYS 9 HA CYS 9 10.779 2.653 -7.450
68 HB2 CYS 9 1HB CYS 9 10.028 0.080 -6.046
69 HB3 CYS 9 2HB CYS 9 11.195 1.262 -5.465
70 HG CYS 9 HG CYS 9 7.807 1.491 -5.557
71 H GLN 10 H GLN 10 10.394 -0.593 -8.717
72 HA GLN 10 HA GLN 10 13.066 -1.429 -8.594
73 HB2 GLN 10 1HB GLN 10 10.906 -2.154 -10.580
74 HB3 GLN 10 2HB GLN 10 12.437 -3.004 -10.415
75 HG2 GLN 10 1HG GLN 10 10.661 -2.687 -8.041
76 HG3 GLN 10 2HG GLN 10 10.297 -3.913 -9.254
77 HE21 GLN 10 2HE2 GLN 10 12.664 -4.889 -9.971
78 HE22 GLN 10 1HE2 GLN 10 13.488 -5.592 -8.625
79 H TYR 11 H TYR 11 11.301 0.362 -11.083
80 HA TYR 11 HA TYR 11 13.445 0.433 -12.945
81 HB2 TYR 11 1HB TYR 11 11.272 0.789 -13.821
82 HB3 TYR 11 2HB TYR 11 10.918 2.049 -12.644
83 HD1 TYR 11 HD2 TYR 11 13.314 1.315 -15.416
84 HD2 TYR 11 HD1 TYR 11 11.063 4.254 -13.319
85 HE1 TYR 11 HE2 TYR 11 14.048 3.020 -17.030
86 HE2 TYR 11 HE1 TYR 11 11.789 5.967 -14.928
87 HH TYR 11 HH TYR 11 13.728 6.307 -16.505
88 H ILE 12 H ILE 12 12.262 2.723 -10.510
89 HA ILE 12 HA ILE 12 14.034 4.820 -11.089
90 HB ILE 12 HB ILE 12 12.795 4.096 -8.430
91 HG12 ILE 12 1HG1 ILE 12 11.834 6.239 -10.304
92 HG13 ILE 12 2HG1 ILE 12 11.322 4.569 -10.524
93 HG21 ILE 12 1HG2 ILE 12 14.059 5.723 -7.595
94 HG22 ILE 12 2HG2 ILE 12 14.656 6.162 -9.194
95 HG23 ILE 12 3HG2 ILE 12 13.148 6.853 -8.596
96 HD11 ILE 12 3HD1 ILE 12 9.640 5.644 -9.271
97 HD12 ILE 12 1HD1 ILE 12 10.526 4.621 -8.141
98 HD13 ILE 12 2HD1 ILE 12 10.817 6.361 -8.170
99 H SER 13 H SER 13 14.363 1.979 -9.033
100 HA SER 13 HA SER 13 16.748 2.719 -7.735
101 HB2 SER 13 1HB SER 13 16.892 0.467 -7.012
102 HB3 SER 13 2HB SER 13 15.165 0.792 -7.156
103 HG SER 13 HG SER 13 16.832 -0.756 -8.807
104 H ASP 14 H ASP 14 16.123 1.141 -10.815
105 HA ASP 14 HA ASP 14 18.806 0.399 -11.357
106 HB2 ASP 14 1HB ASP 14 16.375 0.776 -13.096
107 HB3 ASP 14 2HB ASP 14 17.941 0.339 -13.774
108 H HIS 15 H HIS 15 17.166 3.392 -11.437
109 HA HIS 15 HA HIS 15 19.304 4.587 -13.072
110 HB2 HIS 15 1HB HIS 15 16.435 5.348 -12.624
111 HB3 HIS 15 2HB HIS 15 17.606 6.565 -13.122
112 HD1 HIS 15 HD1 HIS 15 17.601 6.898 -15.560
113 HD2 HIS 15 HD2 HIS 15 16.688 2.973 -14.550
114 HE1 HIS 15 HE1 HIS 15 17.210 5.715 -17.745
115 H LEU 16 H LEU 16 19.101 3.917 -10.085
116 HA LEU 16 HA LEU 16 18.915 6.190 -8.524
117 HB2 LEU 16 1HB LEU 16 19.346 3.701 -7.907
118 HB3 LEU 16 2HB LEU 16 21.046 4.157 -8.003
119 HG LEU 16 HG LEU 16 20.195 4.182 -5.701
120 HD11 LEU 16 1HD1 LEU 16 20.603 7.052 -6.171
121 HD12 LEU 16 2HD1 LEU 16 21.821 5.993 -6.882
122 HD13 LEU 16 3HD1 LEU 16 21.497 5.926 -5.150
123 HD21 LEU 16 3HD2 LEU 16 17.929 5.315 -6.839
124 HD22 LEU 16 1HD2 LEU 16 18.664 6.626 -5.915
125 HD23 LEU 16 2HD2 LEU 16 18.257 5.106 -5.118
126 H ALA 17 H ALA 17 21.640 5.023 -10.436
127 HA ALA 17 HA ALA 17 23.403 7.115 -9.530
128 HB1 ALA 17 1HB ALA 17 24.638 6.115 -11.718
129 HB2 ALA 17 2HB ALA 17 24.754 5.411 -10.105
130 HB3 ALA 17 3HB ALA 17 23.606 4.756 -11.273
131 H ASP 18 H ASP 18 21.047 6.731 -11.998
132 HA ASP 18 HA ASP 18 22.027 8.511 -13.939
133 HB2 ASP 18 1HB ASP 18 19.924 6.870 -13.877
134 HB3 ASP 18 2HB ASP 18 19.091 8.364 -13.457
135 H SER 19 H SER 19 21.383 10.683 -14.405
136 HA SER 19 HA SER 19 20.962 12.252 -11.962
137 HB2 SER 19 1HB SER 19 22.051 13.046 -14.672
138 HB3 SER 19 2HB SER 19 21.817 14.162 -13.328
139 HG SER 19 HG SER 19 23.566 13.422 -12.424
140 H ASN 20 H ASN 20 19.905 12.138 -15.360
141 HA ASN 20 HA ASN 20 17.705 13.938 -14.826
142 HB2 ASN 20 1HB ASN 20 18.040 12.368 -17.366
143 HB3 ASN 20 2HB ASN 20 17.336 13.966 -17.139
144 HD21 ASN 20 2HD2 ASN 20 19.862 12.453 -18.435
145 HD22 ASN 20 1HD2 ASN 20 21.073 13.678 -18.301
146 H PHE 21 H PHE 21 16.028 13.156 -13.722
147 HA PHE 21 HA PHE 21 15.216 10.380 -14.044
148 HB2 PHE 21 1HB PHE 21 15.353 11.394 -11.781
149 HB3 PHE 21 2HB PHE 21 14.076 12.518 -12.234
150 HD1 PHE 21 HD1 PHE 21 14.367 8.886 -12.955
151 HD2 PHE 21 HD2 PHE 21 12.294 11.956 -10.859
152 HE1 PHE 21 HE1 PHE 21 12.678 7.249 -12.234
153 HE2 PHE 21 HE2 PHE 21 10.602 10.324 -10.134
154 HZ PHE 21 HZ PHE 21 10.793 7.966 -10.821
155 H ASP 22 H ASP 22 13.432 9.701 -15.089
156 HA ASP 22 HA ASP 22 11.710 11.765 -16.297
157 HB2 ASP 22 1HB ASP 22 13.261 9.907 -17.615
158 HB3 ASP 22 2HB ASP 22 11.677 9.136 -17.589
159 H ILE 23 H ILE 23 9.949 11.847 -15.028
160 HA ILE 23 HA ILE 23 8.873 9.708 -13.563
161 HB ILE 23 HB ILE 23 8.410 12.129 -13.137
162 HG12 ILE 23 1HG1 ILE 23 5.985 11.764 -12.558
163 HG13 ILE 23 2HG1 ILE 23 6.070 10.237 -13.429
164 HG21 ILE 23 1HG2 ILE 23 6.764 13.304 -14.399
165 HG22 ILE 23 2HG2 ILE 23 7.955 12.674 -15.535
166 HG23 ILE 23 3HG2 ILE 23 6.394 11.872 -15.358
167 HD11 ILE 23 3HD1 ILE 23 7.956 10.851 -11.190
168 HD12 ILE 23 1HD1 ILE 23 6.342 10.207 -10.888
169 HD13 ILE 23 2HD1 ILE 23 7.493 9.286 -11.857
170 H ALA 24 H ALA 24 8.475 10.671 -16.870
171 HA ALA 24 HA ALA 24 6.026 9.437 -17.456
172 HB1 ALA 24 1HB ALA 24 6.625 10.737 -19.206
173 HB2 ALA 24 2HB ALA 24 8.345 10.393 -19.015
174 HB3 ALA 24 3HB ALA 24 7.293 9.219 -19.806
175 H SER 25 H SER 25 9.344 8.187 -17.587
176 HA SER 25 HA SER 25 8.681 5.644 -18.614
177 HB2 SER 25 1HB SER 25 11.051 6.436 -16.904
178 HB3 SER 25 2HB SER 25 10.925 4.971 -17.876
179 HG SER 25 HG SER 25 11.347 6.088 -19.617
180 H VAL 26 H VAL 26 8.638 6.985 -15.401
181 HA VAL 26 HA VAL 26 8.590 4.563 -13.943
182 HB VAL 26 HB VAL 26 7.409 7.240 -13.187
183 HG11 VAL 26 1HG1 VAL 26 7.559 6.451 -10.891
184 HG12 VAL 26 2HG1 VAL 26 6.534 5.379 -11.847
185 HG13 VAL 26 3HG1 VAL 26 8.184 4.899 -11.449
186 HG21 VAL 26 3HG2 VAL 26 9.893 6.473 -11.901
187 HG22 VAL 26 1HG2 VAL 26 10.061 6.595 -13.653
188 HG23 VAL 26 2HG2 VAL 26 9.465 7.972 -12.726
189 H ALA 27 H ALA 27 5.956 6.730 -14.974
190 HA ALA 27 HA ALA 27 3.874 5.056 -14.027
191 HB1 ALA 27 1HB ALA 27 4.078 7.616 -15.159
192 HB2 ALA 27 2HB ALA 27 3.002 6.696 -16.211
193 HB3 ALA 27 3HB ALA 27 2.641 6.842 -14.491
194 H GLN 28 H GLN 28 5.336 5.506 -17.228
195 HA GLN 28 HA GLN 28 3.633 3.789 -18.647
196 HB2 GLN 28 1HB GLN 28 5.086 5.332 -19.808
197 HB3 GLN 28 2HB GLN 28 6.514 4.544 -19.150
198 HG2 GLN 28 1HG GLN 28 6.336 2.737 -20.555
199 HG3 GLN 28 2HG GLN 28 4.603 2.959 -20.794
200 HE21 GLN 28 2HE2 GLN 28 4.190 3.442 -22.819
201 HE22 GLN 28 1HE2 GLN 28 5.107 4.506 -23.825
202 H HIS 29 H HIS 29 6.536 3.171 -16.766
203 HA HIS 29 HA HIS 29 7.085 0.564 -17.574
204 HB2 HIS 29 1HB HIS 29 8.677 1.675 -16.200
205 HB3 HIS 29 2HB HIS 29 7.490 1.963 -14.932
206 HD1 HIS 29 HD1 HIS 29 8.124 -1.372 -16.595
207 HD2 HIS 29 HD2 HIS 29 8.668 0.508 -12.930
208 HE1 HIS 29 HE1 HIS 29 8.888 -3.178 -15.019
209 H VAL 30 H VAL 30 4.700 1.793 -15.312
210 HA VAL 30 HA VAL 30 3.856 -0.935 -14.654
211 HB VAL 30 HB VAL 30 2.449 0.077 -12.935
212 HG11 VAL 30 1HG1 VAL 30 4.489 -0.418 -12.009
213 HG12 VAL 30 2HG1 VAL 30 5.358 0.712 -13.049
214 HG13 VAL 30 3HG1 VAL 30 4.403 1.315 -11.694
215 HG21 VAL 30 3HG2 VAL 30 3.591 2.735 -13.787
216 HG22 VAL 30 1HG2 VAL 30 1.972 2.170 -14.201
217 HG23 VAL 30 2HG2 VAL 30 2.407 2.438 -12.513
218 H CYS 31 H CYS 31 3.386 0.542 -17.254
219 HA CYS 31 HA CYS 31 1.727 0.866 -18.781
220 HB2 CYS 31 1HB CYS 31 0.644 -1.391 -17.108
221 HB3 CYS 31 2HB CYS 31 -0.236 -0.781 -18.504
222 HG CYS 31 HG CYS 31 0.972 -2.277 -20.190
223 H LEU 32 H LEU 32 1.697 2.660 -16.578
224 HA LEU 32 HA LEU 32 -1.152 3.368 -16.583
225 HB2 LEU 32 1HB LEU 32 -0.022 2.343 -14.375
226 HB3 LEU 32 2HB LEU 32 0.394 4.041 -14.154
227 HG LEU 32 HG LEU 32 -2.434 3.471 -14.787
228 HD11 LEU 32 1HD1 LEU 32 -1.850 1.625 -13.257
229 HD12 LEU 32 2HD1 LEU 32 -2.986 2.772 -12.548
230 HD13 LEU 32 3HD1 LEU 32 -1.287 2.811 -12.079
231 HD21 LEU 32 3HD2 LEU 32 -2.220 5.055 -12.531
232 HD22 LEU 32 1HD2 LEU 32 -2.421 5.617 -14.190
233 HD23 LEU 32 2HD2 LEU 32 -0.806 5.493 -13.491
234 H SER 33 H SER 33 -1.510 5.678 -16.000
235 HA SER 33 HA SER 33 0.333 7.324 -17.477
236 HB2 SER 33 1HB SER 33 -2.340 7.762 -16.185
237 HB3 SER 33 2HB SER 33 -1.370 9.148 -16.684
238 HG SER 33 HG SER 33 -1.718 8.673 -18.721
239 HA PRO 34 HA PRO 34 2.693 9.046 -14.205
240 HB2 PRO 34 1HB PRO 34 2.982 11.620 -15.017
241 HB3 PRO 34 2HB PRO 34 3.811 10.268 -15.797
242 HG2 PRO 34 1HG PRO 34 1.320 11.701 -16.635
243 HG3 PRO 34 2HG PRO 34 2.690 11.167 -17.626
244 HD2 PRO 34 1HD PRO 34 0.363 9.789 -17.494
245 HD3 PRO 34 2HD PRO 34 1.933 8.992 -17.725
246 H SER 35 H SER 35 -0.123 10.981 -15.166
247 HA SER 35 HA SER 35 -0.252 12.521 -12.795
248 HB2 SER 35 1HB SER 35 -1.371 13.056 -15.006
249 HB3 SER 35 2HB SER 35 -2.581 11.840 -14.597
250 HG SER 35 HG SER 35 -3.350 13.797 -13.895
251 H ARG 36 H ARG 36 -1.961 9.585 -13.833
252 HA ARG 36 HA ARG 36 -3.474 9.328 -11.439
253 HB2 ARG 36 1HB ARG 36 -2.939 7.631 -13.826
254 HB3 ARG 36 2HB ARG 36 -3.552 6.837 -12.382
255 HG2 ARG 36 1HG ARG 36 -4.884 9.218 -13.646
256 HG3 ARG 36 2HG ARG 36 -5.284 7.546 -14.049
257 HD2 ARG 36 1HD ARG 36 -5.758 7.160 -11.628
258 HD3 ARG 36 2HD ARG 36 -5.533 8.888 -11.362
259 HE ARG 36 HE ARG 36 -7.408 8.701 -13.356
260 HH11 ARG 36 2HH1 ARG 36 -7.112 7.559 -10.080
261 HH12 ARG 36 1HH1 ARG 36 -8.818 7.592 -9.777
262 HH21 ARG 36 2HH2 ARG 36 -9.656 8.749 -12.968
263 HH22 ARG 36 1HH2 ARG 36 -10.264 8.268 -11.420
264 H LEU 37 H LEU 37 -0.409 7.992 -12.563
265 HA LEU 37 HA LEU 37 -0.047 6.204 -10.386
266 HB2 LEU 37 1HB LEU 37 1.172 5.750 -12.346
267 HB3 LEU 37 2HB LEU 37 1.805 7.392 -12.428
268 HG LEU 37 HG LEU 37 2.681 6.168 -9.995
269 HD11 LEU 37 1HD1 LEU 37 2.815 4.478 -12.437
270 HD12 LEU 37 2HD1 LEU 37 2.633 4.012 -10.746
271 HD13 LEU 37 3HD1 LEU 37 4.209 4.513 -11.357
272 HD21 LEU 37 3HD2 LEU 37 4.911 6.467 -11.394
273 HD22 LEU 37 1HD2 LEU 37 4.040 7.845 -10.721
274 HD23 LEU 37 2HD2 LEU 37 3.842 7.424 -12.422
275 H SER 38 H SER 38 1.112 9.487 -11.057
276 HA SER 38 HA SER 38 2.744 9.783 -8.803
277 HB2 SER 38 1HB SER 38 2.813 11.356 -10.673
278 HB3 SER 38 2HB SER 38 1.172 11.889 -10.309
279 HG SER 38 HG SER 38 3.103 13.133 -9.459
280 H HIS 39 H HIS 39 -0.711 10.348 -9.255
281 HA HIS 39 HA HIS 39 -1.254 11.594 -6.810
282 HB2 HIS 39 1HB HIS 39 -2.850 11.465 -8.702
283 HB3 HIS 39 2HB HIS 39 -3.067 9.747 -8.377
284 HD1 HIS 39 HD1 HIS 39 -4.444 12.983 -7.565
285 HD2 HIS 39 HD2 HIS 39 -4.191 9.293 -5.673
286 HE1 HIS 39 HE1 HIS 39 -6.182 13.038 -5.748
287 H LEU 40 H LEU 40 -1.381 8.150 -7.687
288 HA LEU 40 HA LEU 40 -2.070 7.288 -5.059
289 HB2 LEU 40 1HB LEU 40 -0.871 5.727 -7.342
290 HB3 LEU 40 2HB LEU 40 -1.609 5.040 -5.896
291 HG LEU 40 HG LEU 40 -3.012 6.590 -8.072
292 HD11 LEU 40 1HD1 LEU 40 -2.312 3.878 -7.873
293 HD12 LEU 40 2HD1 LEU 40 -3.400 4.633 -9.037
294 HD13 LEU 40 3HD1 LEU 40 -4.040 3.973 -7.532
295 HD21 LEU 40 3HD2 LEU 40 -4.436 7.136 -6.429
296 HD22 LEU 40 1HD2 LEU 40 -3.770 5.938 -5.319
297 HD23 LEU 40 2HD2 LEU 40 -4.952 5.452 -6.534
298 H PHE 41 H PHE 41 0.928 7.809 -6.777
299 HA PHE 41 HA PHE 41 2.673 6.363 -5.142
300 HB2 PHE 41 1HB PHE 41 2.952 7.929 -7.369
301 HB3 PHE 41 2HB PHE 41 3.726 8.922 -6.138
302 HD1 PHE 41 HD1 PHE 41 5.718 8.132 -4.973
303 HD2 PHE 41 HD2 PHE 41 3.914 5.857 -8.085
304 HE1 PHE 41 HE1 PHE 41 7.761 6.773 -5.159
305 HE2 PHE 41 HE2 PHE 41 5.953 4.493 -8.275
306 HZ PHE 41 HZ PHE 41 7.879 4.949 -6.810
307 H ARG 42 H ARG 42 1.701 9.781 -4.947
308 HA ARG 42 HA ARG 42 3.172 10.320 -2.583
309 HB2 ARG 42 1HB ARG 42 2.294 12.007 -4.275
310 HB3 ARG 42 2HB ARG 42 0.722 11.811 -3.513
311 HG2 ARG 42 1HG ARG 42 1.332 12.937 -1.636
312 HG3 ARG 42 2HG ARG 42 3.023 12.447 -1.759
313 HD2 ARG 42 1HD ARG 42 2.803 14.826 -2.179
314 HD3 ARG 42 2HD ARG 42 3.319 13.991 -3.644
315 HE ARG 42 HE ARG 42 0.507 14.231 -3.607
316 HH11 ARG 42 2HH1 ARG 42 3.396 16.122 -4.049
317 HH12 ARG 42 1HH1 ARG 42 2.631 17.290 -5.074
318 HH21 ARG 42 2HH2 ARG 42 -0.512 15.763 -4.955
319 HH22 ARG 42 1HH2 ARG 42 0.408 17.086 -5.588
320 H GLN 43 H GLN 43 0.064 8.925 -3.198
321 HA GLN 43 HA GLN 43 -0.974 9.352 -0.553
322 HB2 GLN 43 1HB GLN 43 -2.375 9.061 -2.634
323 HB3 GLN 43 2HB GLN 43 -1.937 7.358 -2.604
324 HG2 GLN 43 1HG GLN 43 -4.163 7.922 -1.608
325 HG3 GLN 43 2HG GLN 43 -3.077 7.001 -0.569
326 HE21 GLN 43 2HE2 GLN 43 -3.255 10.455 -1.330
327 HE22 GLN 43 1HE2 GLN 43 -3.443 10.983 0.304
328 H GLN 44 H GLN 44 0.567 6.688 -2.286
329 HA GLN 44 HA GLN 44 0.338 4.892 -0.042
330 HB2 GLN 44 1HB GLN 44 1.886 4.640 -2.626
331 HB3 GLN 44 2HB GLN 44 1.683 3.357 -1.441
332 HG2 GLN 44 1HG GLN 44 -0.676 4.689 -2.716
333 HG3 GLN 44 2HG GLN 44 0.172 3.358 -3.502
334 HE21 GLN 44 2HE2 GLN 44 -1.965 2.347 -3.311
335 HE22 GLN 44 1HE2 GLN 44 -2.353 1.512 -1.850
336 H LEU 45 H LEU 45 2.855 6.860 -1.537
337 HA LEU 45 HA LEU 45 4.836 5.964 0.390
338 HB2 LEU 45 1HB LEU 45 4.944 6.935 -2.211
339 HB3 LEU 45 2HB LEU 45 5.599 8.243 -1.228
340 HG LEU 45 HG LEU 45 6.636 5.448 -0.927
341 HD11 LEU 45 1HD1 LEU 45 6.791 5.858 -3.290
342 HD12 LEU 45 2HD1 LEU 45 8.392 6.028 -2.571
343 HD13 LEU 45 3HD1 LEU 45 7.465 7.464 -3.008
344 HD21 LEU 45 3HD2 LEU 45 8.446 6.440 0.096
345 HD22 LEU 45 1HD2 LEU 45 7.133 7.506 0.597
346 HD23 LEU 45 2HD2 LEU 45 8.201 7.984 -0.723
347 H GLY 46 H GLY 46 2.511 8.436 0.088
348 HA2 GLY 46 1HA GLY 46 1.941 10.153 1.507
349 HA3 GLY 46 2HA GLY 46 3.119 9.513 2.642
350 H ILE 47 H ILE 47 4.559 10.072 -0.329
351 HA ILE 47 HA ILE 47 5.170 12.871 0.173
352 HB ILE 47 HB ILE 47 7.553 12.593 0.252
353 HG12 ILE 47 1HG1 ILE 47 7.014 9.624 0.027
354 HG13 ILE 47 2HG1 ILE 47 7.756 10.639 -1.205
355 HG21 ILE 47 1HG2 ILE 47 6.382 12.473 2.379
356 HG22 ILE 47 2HG2 ILE 47 6.210 10.727 2.202
357 HG23 ILE 47 3HG2 ILE 47 7.811 11.440 2.399
358 HD11 ILE 47 3HD1 ILE 47 9.582 11.115 0.458
359 HD12 ILE 47 1HD1 ILE 47 8.886 9.840 1.457
360 HD13 ILE 47 2HD1 ILE 47 9.502 9.462 -0.152
361 H SER 48 H SER 48 6.805 13.653 -1.551
362 HA SER 48 HA SER 48 5.707 12.951 -4.109
363 HB2 SER 48 1HB SER 48 6.503 15.283 -3.262
364 HB3 SER 48 2HB SER 48 8.104 14.728 -3.750
365 HG SER 48 HG SER 48 6.372 15.832 -5.293
366 H VAL 49 H VAL 49 6.825 12.122 -5.902
367 HA VAL 49 HA VAL 49 8.471 9.937 -5.454
368 HB VAL 49 HB VAL 49 8.397 11.554 -8.002
369 HG11 VAL 49 1HG1 VAL 49 10.155 9.891 -7.977
370 HG12 VAL 49 2HG1 VAL 49 9.010 8.650 -7.466
371 HG13 VAL 49 3HG1 VAL 49 8.866 9.380 -9.066
372 HG21 VAL 49 3HG2 VAL 49 6.286 10.178 -6.666
373 HG22 VAL 49 1HG2 VAL 49 6.254 11.016 -8.218
374 HG23 VAL 49 2HG2 VAL 49 6.688 9.308 -8.147
375 H LEU 50 H LEU 50 9.360 13.236 -6.410
376 HA LEU 50 HA LEU 50 12.114 12.789 -6.714
377 HB2 LEU 50 1HB LEU 50 10.679 15.305 -5.879
378 HB3 LEU 50 2HB LEU 50 12.347 15.219 -6.441
379 HG LEU 50 HG LEU 50 9.865 14.657 -8.060
380 HD11 LEU 50 1HD1 LEU 50 10.946 16.585 -9.403
381 HD12 LEU 50 2HD1 LEU 50 11.802 16.930 -7.901
382 HD13 LEU 50 3HD1 LEU 50 10.039 16.961 -7.938
383 HD21 LEU 50 3HD2 LEU 50 11.549 14.524 -9.949
384 HD22 LEU 50 1HD2 LEU 50 11.492 13.145 -8.851
385 HD23 LEU 50 2HD2 LEU 50 12.785 14.336 -8.704
386 H SER 51 H SER 51 10.144 13.404 -3.891
387 HA SER 51 HA SER 51 12.313 13.972 -2.125
388 HB2 SER 51 1HB SER 51 10.040 14.738 -1.628
389 HB3 SER 51 2HB SER 51 9.487 13.067 -1.521
390 HG SER 51 HG SER 51 9.902 13.751 0.544
391 H TRP 52 H TRP 52 10.362 11.084 -2.789
392 HA TRP 52 HA TRP 52 11.515 9.397 -0.882
393 HB2 TRP 52 1HB TRP 52 9.478 8.768 -2.025
394 HB3 TRP 52 2HB TRP 52 10.308 8.750 -3.578
395 HD1 TRP 52 HD1 TRP 52 10.470 6.844 -0.199
396 HE1 TRP 52 HE1 TRP 52 11.128 4.406 -0.699
397 HE3 TRP 52 HE3 TRP 52 11.159 7.210 -5.251
398 HZ2 TRP 52 HZ2 TRP 52 11.844 2.845 -2.939
399 HZ3 TRP 52 HZ3 TRP 52 11.831 5.198 -6.499
400 HH2 TRP 52 HH2 TRP 52 12.166 3.062 -5.365
401 H ARG 53 H ARG 53 12.485 10.132 -4.199
402 HA ARG 53 HA ARG 53 14.510 8.213 -4.453
403 HB2 ARG 53 1HB ARG 53 13.630 9.480 -6.357
404 HB3 ARG 53 2HB ARG 53 14.324 10.958 -5.705
405 HG2 ARG 53 1HG ARG 53 16.529 10.217 -6.111
406 HG3 ARG 53 2HG ARG 53 15.990 8.567 -6.430
407 HD2 ARG 53 1HD ARG 53 15.471 9.026 -8.564
408 HD3 ARG 53 2HD ARG 53 14.741 10.576 -8.149
409 HE ARG 53 HE ARG 53 16.743 11.612 -8.599
410 HH11 ARG 53 2HH1 ARG 53 17.210 8.165 -8.467
411 HH12 ARG 53 1HH1 ARG 53 18.825 8.228 -9.092
412 HH21 ARG 53 2HH2 ARG 53 18.868 11.709 -9.423
413 HH22 ARG 53 1HH2 ARG 53 19.767 10.244 -9.634
414 H GLU 54 H GLU 54 14.645 11.574 -3.314
415 HA GLU 54 HA GLU 54 17.431 11.617 -2.851
416 HB2 GLU 54 1HB GLU 54 16.178 13.680 -3.049
417 HB3 GLU 54 2HB GLU 54 15.205 13.265 -1.645
418 HG2 GLU 54 1HG GLU 54 17.233 13.367 -0.248
419 HG3 GLU 54 2HG GLU 54 18.151 13.877 -1.664
420 H ASP 55 H ASP 55 14.676 11.009 -0.696
421 HA ASP 55 HA ASP 55 16.171 10.655 1.660
422 HB2 ASP 55 1HB ASP 55 13.527 10.795 1.115
423 HB3 ASP 55 2HB ASP 55 13.695 9.059 1.361
424 H GLN 56 H GLN 56 15.220 8.421 -0.890
425 HA GLN 56 HA GLN 56 16.041 6.052 0.427
426 HB2 GLN 56 1HB GLN 56 15.272 6.816 -2.331
427 HB3 GLN 56 2HB GLN 56 16.253 5.366 -2.168
428 HG2 GLN 56 1HG GLN 56 13.590 5.894 -0.873
429 HG3 GLN 56 2HG GLN 56 13.924 4.776 -2.195
430 HE21 GLN 56 2HE2 GLN 56 15.714 3.155 -1.632
431 HE22 GLN 56 1HE2 GLN 56 15.580 2.403 -0.083
432 H ARG 57 H ARG 57 17.696 8.390 -1.598
433 HA ARG 57 HA ARG 57 20.001 6.948 -2.207
434 HB2 ARG 57 1HB ARG 57 19.465 9.884 -1.843
435 HB3 ARG 57 2HB ARG 57 21.081 9.298 -2.213
436 HG2 ARG 57 1HG ARG 57 20.501 8.623 -4.332
437 HG3 ARG 57 2HG ARG 57 18.794 8.446 -3.922
438 HD2 ARG 57 1HD ARG 57 18.505 10.422 -4.920
439 HD3 ARG 57 2HD ARG 57 19.261 11.121 -3.489
440 HE ARG 57 HE ARG 57 21.033 11.690 -4.797
441 HH11 ARG 57 2HH1 ARG 57 19.359 9.040 -6.312
442 HH12 ARG 57 1HH1 ARG 57 20.365 9.039 -7.722
443 HH21 ARG 57 2HH2 ARG 57 22.365 11.699 -6.649
444 HH22 ARG 57 1HH2 ARG 57 22.076 10.551 -7.912
445 H ILE 58 H ILE 58 19.299 9.017 0.594
446 HA ILE 58 HA ILE 58 21.833 8.613 1.827
447 HB ILE 58 HB ILE 58 19.213 9.706 2.806
448 HG12 ILE 58 1HG1 ILE 58 20.690 11.739 3.131
449 HG13 ILE 58 2HG1 ILE 58 21.966 10.847 2.310
450 HG21 ILE 58 1HG2 ILE 58 20.707 10.343 4.867
451 HG22 ILE 58 2HG2 ILE 58 19.869 8.793 4.803
452 HG23 ILE 58 3HG2 ILE 58 21.585 8.885 4.407
453 HD11 ILE 58 3HD1 ILE 58 20.753 10.798 0.286
454 HD12 ILE 58 1HD1 ILE 58 19.281 11.365 1.074
455 HD13 ILE 58 2HD1 ILE 58 20.659 12.451 0.894
456 H SER 59 H SER 59 18.619 7.191 2.314
457 HA SER 59 HA SER 59 19.195 5.590 4.515
458 HB2 SER 59 1HB SER 59 16.921 5.760 3.927
459 HB3 SER 59 2HB SER 59 17.229 5.304 2.252
460 HG SER 59 HG SER 59 17.337 3.232 2.813
461 H GLN 60 H GLN 60 19.727 5.010 1.081
462 HA GLN 60 HA GLN 60 20.537 2.295 1.382
463 HB2 GLN 60 1HB GLN 60 19.683 3.342 -0.742
464 HB3 GLN 60 2HB GLN 60 21.228 4.171 -0.881
465 HG2 GLN 60 1HG GLN 60 20.976 2.068 -2.232
466 HG3 GLN 60 2HG GLN 60 22.400 2.156 -1.197
467 HE21 GLN 60 2HE2 GLN 60 22.605 0.763 0.510
468 HE22 GLN 60 1HE2 GLN 60 21.546 -0.577 0.770
469 H ALA 61 H ALA 61 22.271 5.370 1.109
470 HA ALA 61 HA ALA 61 24.874 4.324 1.034
471 HB1 ALA 61 1HB ALA 61 23.641 6.927 1.372
472 HB2 ALA 61 2HB ALA 61 25.112 6.756 2.329
473 HB3 ALA 61 3HB ALA 61 25.158 6.488 0.586
474 H LYS 62 H LYS 62 22.723 5.059 3.714
475 HA LYS 62 HA LYS 62 24.636 4.828 5.784
476 HB2 LYS 62 1HB LYS 62 21.636 4.489 5.773
477 HB3 LYS 62 2HB LYS 62 22.608 4.441 7.238
478 HG2 LYS 62 1HG LYS 62 23.180 6.696 7.076
479 HG3 LYS 62 2HG LYS 62 22.715 6.786 5.376
480 HD2 LYS 62 1HD LYS 62 20.935 7.836 6.404
481 HD3 LYS 62 2HD LYS 62 20.346 6.177 6.282
482 HE2 LYS 62 1HE LYS 62 21.818 7.089 8.723
483 HE3 LYS 62 2HE LYS 62 20.107 7.461 8.526
484 HZ1 LYS 62 3HZ LYS 62 21.330 5.015 9.286
485 HZ2 LYS 62 1HZ LYS 62 20.357 4.789 7.920
486 HZ3 LYS 62 2HZ LYS 62 19.696 5.451 9.329
487 H LEU 63 H LEU 63 22.679 2.496 4.054
488 HA LEU 63 HA LEU 63 23.014 0.314 5.809
489 HB2 LEU 63 1HB LEU 63 21.340 0.451 3.981
490 HB3 LEU 63 2HB LEU 63 22.647 0.244 2.818
491 HG LEU 63 HG LEU 63 22.308 -1.842 4.908
492 HD11 LEU 63 1HD1 LEU 63 20.463 -2.851 3.985
493 HD12 LEU 63 2HD1 LEU 63 20.643 -2.020 2.441
494 HD13 LEU 63 3HD1 LEU 63 20.026 -1.148 3.844
495 HD21 LEU 63 3HD2 LEU 63 23.795 -1.482 2.547
496 HD22 LEU 63 1HD2 LEU 63 22.617 -2.752 2.214
497 HD23 LEU 63 2HD2 LEU 63 23.724 -2.912 3.578
498 H LEU 64 H LEU 64 24.759 1.178 2.824
499 HA LEU 64 HA LEU 64 26.686 -0.902 3.119
500 HB2 LEU 64 1HB LEU 64 27.709 -0.043 1.201
501 HB3 LEU 64 2HB LEU 64 25.988 0.265 0.978
502 HG LEU 64 HG LEU 64 26.671 2.620 2.010
503 HD11 LEU 64 1HD1 LEU 64 28.873 2.808 2.280
504 HD12 LEU 64 2HD1 LEU 64 28.975 2.876 0.521
505 HD13 LEU 64 3HD1 LEU 64 29.196 1.339 1.357
506 HD21 LEU 64 3HD2 LEU 64 27.081 3.353 -0.397
507 HD22 LEU 64 1HD2 LEU 64 25.565 2.519 -0.057
508 HD23 LEU 64 2HD2 LEU 64 26.895 1.652 -0.825
509 H LEU 65 H LEU 65 26.578 2.514 3.966
510 HA LEU 65 HA LEU 65 29.295 2.800 4.668
511 HB2 LEU 65 1HB LEU 65 27.700 4.662 4.257
512 HB3 LEU 65 2HB LEU 65 26.930 4.289 5.798
513 HG LEU 65 HG LEU 65 29.677 4.662 6.327
514 HD11 LEU 65 1HD1 LEU 65 28.581 6.526 4.283
515 HD12 LEU 65 2HD1 LEU 65 30.217 5.899 4.480
516 HD13 LEU 65 3HD1 LEU 65 29.626 7.170 5.550
517 HD21 LEU 65 3HD2 LEU 65 27.212 6.311 6.849
518 HD22 LEU 65 1HD2 LEU 65 28.791 6.662 7.551
519 HD23 LEU 65 2HD2 LEU 65 27.979 5.141 7.924
520 H SER 66 H SER 66 26.543 1.496 6.350
521 HA SER 66 HA SER 66 27.738 1.556 8.954
522 HB2 SER 66 1HB SER 66 25.396 1.524 9.015
523 HB3 SER 66 2HB SER 66 25.287 0.262 7.787
524 HG SER 66 HG SER 66 25.315 -1.145 9.333
525 H THR 67 H THR 67 27.904 -0.528 6.229
526 HA THR 67 HA THR 67 29.165 -2.638 7.850
527 HB THR 67 HB THR 67 27.319 -3.503 6.561
528 HG1 THR 67 HG1 THR 67 28.439 -5.127 5.507
529 HG21 THR 67 3HG2 THR 67 27.258 -1.735 4.843
530 HG22 THR 67 1HG2 THR 67 27.223 -3.349 4.135
531 HG23 THR 67 2HG2 THR 67 28.716 -2.411 4.115
532 H THR 68 H THR 68 29.995 -0.014 6.101
533 HA THR 68 HA THR 68 32.573 -1.203 5.330
534 HB THR 68 HB THR 68 32.687 0.127 3.327
535 HG1 THR 68 HG1 THR 68 31.516 1.874 3.185
536 HG21 THR 68 3HG2 THR 68 30.044 -0.713 2.660
537 HG22 THR 68 1HG2 THR 68 30.757 -1.906 3.745
538 HG23 THR 68 2HG2 THR 68 31.580 -1.474 2.246
539 H ARG 69 H ARG 69 34.383 0.103 5.592
540 HA ARG 69 HA ARG 69 33.941 2.468 7.278
541 HB2 ARG 69 1HB ARG 69 36.112 0.427 7.102
542 HB3 ARG 69 2HB ARG 69 36.532 2.049 7.637
543 HG2 ARG 69 1HG ARG 69 36.088 1.090 9.647
544 HG3 ARG 69 2HG ARG 69 34.472 1.673 9.243
545 HD2 ARG 69 1HD ARG 69 33.679 -0.428 8.787
546 HD3 ARG 69 2HD ARG 69 35.267 -1.045 8.332
547 HE ARG 69 HE ARG 69 35.383 -0.479 11.038
548 HH11 ARG 69 2HH1 ARG 69 33.585 -2.585 8.928
549 HH12 ARG 69 1HH1 ARG 69 33.362 -3.813 10.130
550 HH21 ARG 69 2HH2 ARG 69 35.095 -2.088 12.629
551 HH22 ARG 69 1HH2 ARG 69 34.220 -3.529 12.235
552 H MET 70 H MET 70 33.995 2.174 4.228
553 HA MET 70 HA MET 70 36.287 3.476 3.241
554 HB2 MET 70 1HB MET 70 33.508 3.056 2.205
555 HB3 MET 70 2HB MET 70 34.607 4.124 1.343
556 HG2 MET 70 1HG MET 70 36.175 2.337 1.016
557 HG3 MET 70 2HG MET 70 35.211 1.258 2.021
558 HE1 MET 70 3HE MET 70 32.995 0.161 1.336
559 HE2 MET 70 1HE MET 70 32.239 1.742 1.134
560 HE3 MET 70 2HE MET 70 32.098 0.528 -0.138
561 HA PRO 71 HA PRO 71 35.732 7.714 4.231
562 HB2 PRO 71 1HB PRO 71 36.603 8.946 1.974
563 HB3 PRO 71 2HB PRO 71 37.690 8.130 3.104
564 HG2 PRO 71 1HG PRO 71 36.561 7.142 0.513
565 HG3 PRO 71 2HG PRO 71 38.211 6.991 1.144
566 HD2 PRO 71 1HD PRO 71 36.413 4.969 1.265
567 HD3 PRO 71 2HD PRO 71 37.662 5.212 2.504
568 H ILE 72 H ILE 72 34.388 9.507 3.944
569 HA ILE 72 HA ILE 72 31.841 9.096 2.969
570 HB ILE 72 HB ILE 72 33.245 11.758 3.222
571 HG12 ILE 72 1HG1 ILE 72 31.558 10.240 5.224
572 HG13 ILE 72 2HG1 ILE 72 33.308 10.409 5.292
573 HG21 ILE 72 1HG2 ILE 72 31.367 12.647 2.444
574 HG22 ILE 72 2HG2 ILE 72 30.621 11.055 2.322
575 HG23 ILE 72 3HG2 ILE 72 30.510 11.967 3.827
576 HD11 ILE 72 3HD1 ILE 72 32.970 12.882 5.433
577 HD12 ILE 72 1HD1 ILE 72 31.244 12.567 5.607
578 HD13 ILE 72 2HD1 ILE 72 32.377 11.963 6.816
579 H ALA 73 H ALA 73 34.683 10.230 1.286
580 HA ALA 73 HA ALA 73 33.421 11.300 -0.997
581 HB1 ALA 73 1HB ALA 73 35.660 11.896 -0.715
582 HB2 ALA 73 2HB ALA 73 36.174 10.224 -0.485
583 HB3 ALA 73 3HB ALA 73 35.683 10.783 -2.084
584 H THR 74 H THR 74 34.729 8.063 -0.330
585 HA THR 74 HA THR 74 34.089 6.976 -2.865
586 HB THR 74 HB THR 74 34.492 5.544 -0.231
587 HG1 THR 74 HG1 THR 74 36.315 6.042 -2.369
588 HG21 THR 74 3HG2 THR 74 33.417 4.025 -1.697
589 HG22 THR 74 1HG2 THR 74 35.135 3.640 -1.782
590 HG23 THR 74 2HG2 THR 74 34.373 4.563 -3.077
591 H VAL 75 H VAL 75 32.467 6.731 0.297
592 HA VAL 75 HA VAL 75 30.304 5.162 -0.546
593 HB VAL 75 HB VAL 75 30.252 7.229 1.655
594 HG11 VAL 75 1HG1 VAL 75 28.713 5.257 2.560
595 HG12 VAL 75 2HG1 VAL 75 28.079 6.562 1.555
596 HG13 VAL 75 3HG1 VAL 75 28.475 5.002 0.831
597 HG21 VAL 75 3HG2 VAL 75 30.665 4.710 2.769
598 HG22 VAL 75 1HG2 VAL 75 31.776 4.789 1.401
599 HG23 VAL 75 2HG2 VAL 75 31.835 6.025 2.658
600 H GLY 76 H GLY 76 30.733 8.675 -0.459
601 HA2 GLY 76 1HA GLY 76 28.132 9.457 -1.079
602 HA3 GLY 76 2HA GLY 76 29.578 10.365 -1.493
603 H ARG 77 H ARG 77 30.670 8.240 -3.171
604 HA ARG 77 HA ARG 77 29.432 8.990 -5.620
605 HB2 ARG 77 1HB ARG 77 31.903 8.213 -5.050
606 HB3 ARG 77 2HB ARG 77 31.255 6.634 -5.476
607 HG2 ARG 77 1HG ARG 77 30.701 8.838 -7.361
608 HG3 ARG 77 2HG ARG 77 32.373 8.285 -7.248
609 HD2 ARG 77 1HD ARG 77 31.253 5.913 -7.429
610 HD3 ARG 77 2HD ARG 77 29.943 6.829 -8.172
611 HE ARG 77 HE ARG 77 32.484 7.465 -9.306
612 HH11 ARG 77 2HH1 ARG 77 29.890 5.144 -9.345
613 HH12 ARG 77 1HH1 ARG 77 30.208 4.621 -10.966
614 HH21 ARG 77 2HH2 ARG 77 32.913 6.784 -11.440
615 HH22 ARG 77 1HH2 ARG 77 31.928 5.554 -12.156
616 H ASN 78 H ASN 78 29.201 6.213 -3.507
617 HA ASN 78 HA ASN 78 27.997 4.390 -5.251
618 HB2 ASN 78 1HB ASN 78 28.436 4.627 -2.402
619 HB3 ASN 78 2HB ASN 78 26.841 3.956 -2.730
620 HD21 ASN 78 2HD2 ASN 78 30.026 3.230 -2.287
621 HD22 ASN 78 1HD2 ASN 78 30.062 1.663 -3.014
622 H VAL 79 H VAL 79 26.690 7.123 -3.515
623 HA VAL 79 HA VAL 79 23.955 6.411 -4.255
624 HB VAL 79 HB VAL 79 23.366 8.512 -2.988
625 HG11 VAL 79 1HG1 VAL 79 23.124 6.376 -1.928
626 HG12 VAL 79 2HG1 VAL 79 24.851 6.305 -1.570
627 HG13 VAL 79 3HG1 VAL 79 23.830 7.495 -0.762
628 HG21 VAL 79 3HG2 VAL 79 26.266 8.391 -2.162
629 HG22 VAL 79 1HG2 VAL 79 25.558 9.610 -3.223
630 HG23 VAL 79 2HG2 VAL 79 25.043 9.499 -1.540
631 H GLY 80 H GLY 80 26.466 7.822 -5.773
632 HA2 GLY 80 1HA GLY 80 26.313 8.808 -7.912
633 HA3 GLY 80 2HA GLY 80 24.676 9.323 -7.532
634 H PHE 81 H PHE 81 26.466 10.053 -4.886
635 HA PHE 81 HA PHE 81 26.626 12.852 -5.665
636 HB2 PHE 81 1HB PHE 81 26.939 11.454 -3.005
637 HB3 PHE 81 2HB PHE 81 27.159 13.187 -3.220
638 HD1 PHE 81 HD1 PHE 81 24.940 13.628 -5.222
639 HD2 PHE 81 HD2 PHE 81 25.083 11.459 -1.563
640 HE1 PHE 81 HE1 PHE 81 22.521 13.973 -4.927
641 HE2 PHE 81 HE2 PHE 81 22.664 11.799 -1.263
642 HZ PHE 81 HZ PHE 81 21.380 13.056 -2.946
643 H ASP 82 H ASP 82 28.433 13.652 -6.480
644 HA ASP 82 HA ASP 82 30.954 12.260 -6.127
645 HB2 ASP 82 1HB ASP 82 31.819 13.967 -7.728
646 HB3 ASP 82 2HB ASP 82 30.449 13.052 -8.351
647 H ASP 83 H ASP 83 29.382 15.187 -5.053
648 HA ASP 83 HA ASP 83 31.805 16.246 -3.861
649 HB2 ASP 83 1HB ASP 83 28.970 17.197 -4.095
650 HB3 ASP 83 2HB ASP 83 30.050 17.940 -2.919
651 H GLN 84 H GLN 84 32.515 15.613 -1.945
652 HA GLN 84 HA GLN 84 31.108 13.880 -0.239
653 HB2 GLN 84 1HB GLN 84 32.933 14.447 1.413
654 HB3 GLN 84 2HB GLN 84 33.482 13.849 -0.147
655 HG2 GLN 84 1HG GLN 84 34.063 16.061 -0.859
656 HG3 GLN 84 2HG GLN 84 33.352 16.760 0.595
657 HE21 GLN 84 2HE2 GLN 84 35.515 14.002 0.064
658 HE22 GLN 84 1HE2 GLN 84 36.764 14.557 1.121
659 H LEU 85 H LEU 85 31.539 17.377 -0.206
660 HA LEU 85 HA LEU 85 30.353 17.810 2.336
661 HB2 LEU 85 1HB LEU 85 31.163 19.474 0.029
662 HB3 LEU 85 2HB LEU 85 29.949 20.158 1.107
663 HG LEU 85 HG LEU 85 32.185 20.922 1.695
664 HD11 LEU 85 1HD1 LEU 85 31.649 20.927 3.856
665 HD12 LEU 85 2HD1 LEU 85 31.790 19.174 3.979
666 HD13 LEU 85 3HD1 LEU 85 30.286 19.899 3.412
667 HD21 LEU 85 3HD2 LEU 85 32.900 18.109 2.449
668 HD22 LEU 85 1HD2 LEU 85 33.952 19.514 2.279
669 HD23 LEU 85 2HD2 LEU 85 33.259 18.753 0.846
670 H TYR 86 H TYR 86 29.096 17.600 -0.934
671 HA TYR 86 HA TYR 86 26.543 18.659 -0.498
672 HB2 TYR 86 1HB TYR 86 27.529 18.145 -2.730
673 HB3 TYR 86 2HB TYR 86 27.279 16.433 -2.408
674 HD1 TYR 86 HD1 TYR 86 24.936 15.570 -2.145
675 HD2 TYR 86 HD2 TYR 86 25.765 19.511 -3.517
676 HE1 TYR 86 HE1 TYR 86 22.655 15.727 -3.051
677 HE2 TYR 86 HE2 TYR 86 23.486 19.680 -4.426
678 HH TYR 86 HH TYR 86 21.145 17.043 -4.020
679 H PHE 87 H PHE 87 27.697 15.304 -0.290
680 HA PHE 87 HA PHE 87 25.224 14.160 0.413
681 HB2 PHE 87 1HB PHE 87 26.999 12.747 -0.382
682 HB3 PHE 87 2HB PHE 87 28.058 13.250 0.931
683 HD1 PHE 87 HD2 PHE 87 24.694 11.708 0.454
684 HD2 PHE 87 HD1 PHE 87 28.309 11.814 2.697
685 HE1 PHE 87 HE2 PHE 87 23.904 9.814 1.812
686 HE2 PHE 87 HE1 PHE 87 27.526 9.920 4.058
687 HZ PHE 87 HZ PHE 87 25.320 8.918 3.616
688 H SER 88 H SER 88 27.879 15.431 2.376
689 HA SER 88 HA SER 88 26.823 14.675 4.883
690 HB2 SER 88 1HB SER 88 28.566 15.894 5.825
691 HB3 SER 88 2HB SER 88 29.209 15.538 4.221
692 HG SER 88 HG SER 88 28.952 17.888 5.291
693 H ARG 89 H ARG 89 26.420 17.546 2.883
694 HA ARG 89 HA ARG 89 25.091 19.151 4.772
695 HB2 ARG 89 1HB ARG 89 25.232 19.109 1.781
696 HB3 ARG 89 2HB ARG 89 24.075 20.168 2.577
697 HG2 ARG 89 1HG ARG 89 25.944 21.175 3.851
698 HG3 ARG 89 2HG ARG 89 27.065 20.181 2.919
699 HD2 ARG 89 1HD ARG 89 25.090 21.987 1.567
700 HD3 ARG 89 2HD ARG 89 26.636 22.601 2.152
701 HE ARG 89 HE ARG 89 27.246 20.387 0.643
702 HH11 ARG 89 2HH1 ARG 89 25.623 23.422 0.118
703 HH12 ARG 89 1HH1 ARG 89 26.068 23.520 -1.554
704 HH21 ARG 89 2HH2 ARG 89 27.839 20.505 -1.557
705 HH22 ARG 89 1HH2 ARG 89 27.328 21.860 -2.505
706 H VAL 90 H VAL 90 23.796 17.029 2.223
707 HA VAL 90 HA VAL 90 21.076 17.432 2.952
708 HB VAL 90 HB VAL 90 22.317 15.184 1.359
709 HG11 VAL 90 1HG1 VAL 90 19.856 15.267 0.413
710 HG12 VAL 90 2HG1 VAL 90 20.258 14.314 1.843
711 HG13 VAL 90 3HG1 VAL 90 19.507 15.900 2.021
712 HG21 VAL 90 3HG2 VAL 90 21.072 16.700 -0.463
713 HG22 VAL 90 1HG2 VAL 90 21.505 17.951 0.703
714 HG23 VAL 90 2HG2 VAL 90 22.760 16.937 -0.010
715 H PHE 91 H PHE 91 23.406 14.828 3.582
716 HA PHE 91 HA PHE 91 21.670 13.134 4.990
717 HB2 PHE 91 1HB PHE 91 23.763 12.267 4.213
718 HB3 PHE 91 2HB PHE 91 24.667 13.474 5.121
719 HD1 PHE 91 HD2 PHE 91 24.941 13.272 7.530
720 HD2 PHE 91 HD1 PHE 91 22.874 10.309 5.279
721 HE1 PHE 91 HE2 PHE 91 25.121 11.712 9.424
722 HE2 PHE 91 HE1 PHE 91 23.050 8.744 7.170
723 HZ PHE 91 HZ PHE 91 24.176 9.445 9.245
724 H LYS 92 H LYS 92 23.610 15.874 6.021
725 HA LYS 92 HA LYS 92 23.463 15.548 8.784
726 HB2 LYS 92 1HB LYS 92 24.924 17.207 7.857
727 HB3 LYS 92 2HB LYS 92 23.581 18.047 7.093
728 HG2 LYS 92 1HG LYS 92 23.303 17.797 9.987
729 HG3 LYS 92 2HG LYS 92 24.725 18.714 9.482
730 HD2 LYS 92 1HD LYS 92 22.844 19.752 7.834
731 HD3 LYS 92 2HD LYS 92 21.862 19.369 9.250
732 HE2 LYS 92 1HE LYS 92 22.702 21.636 9.405
733 HE3 LYS 92 2HE LYS 92 23.433 20.633 10.657
734 HZ1 LYS 92 3HZ LYS 92 25.382 21.346 9.915
735 HZ2 LYS 92 1HZ LYS 92 24.688 22.086 8.560
736 HZ3 LYS 92 2HZ LYS 92 25.126 20.453 8.501
737 H LYS 93 H LYS 93 21.259 17.286 6.602
738 HA LYS 93 HA LYS 93 19.424 17.946 8.704
739 HB2 LYS 93 1HB LYS 93 18.960 18.007 5.718
740 HB3 LYS 93 2HB LYS 93 18.021 18.845 6.946
741 HG2 LYS 93 1HG LYS 93 19.761 20.359 7.398
742 HG3 LYS 93 2HG LYS 93 20.946 19.375 6.535
743 HD2 LYS 93 1HD LYS 93 19.660 19.808 4.436
744 HD3 LYS 93 2HD LYS 93 18.653 20.935 5.349
745 HE2 LYS 93 1HE LYS 93 21.649 21.145 5.070
746 HE3 LYS 93 2HE LYS 93 20.487 22.033 4.085
747 HZ1 LYS 93 3HZ LYS 93 19.827 23.315 5.869
748 HZ2 LYS 93 1HZ LYS 93 21.487 23.156 6.154
749 HZ3 LYS 93 2HZ LYS 93 20.385 22.212 7.024
750 H CYS 94 H CYS 94 19.857 15.292 6.524
751 HA CYS 94 HA CYS 94 17.269 14.238 6.465
752 HB2 CYS 94 1HB CYS 94 20.009 13.111 6.101
753 HB3 CYS 94 2HB CYS 94 18.665 11.990 6.281
754 HG CYS 94 HG CYS 94 17.460 13.921 4.133
755 H THR 95 H THR 95 19.954 13.533 8.690
756 HA THR 95 HA THR 95 18.052 12.171 10.469
757 HB THR 95 HB THR 95 19.980 11.179 11.577
758 HG1 THR 95 HG1 THR 95 22.061 11.670 10.934
759 HG21 THR 95 3HG2 THR 95 20.781 9.762 9.780
760 HG22 THR 95 1HG2 THR 95 20.254 10.939 8.578
761 HG23 THR 95 2HG2 THR 95 19.062 10.083 9.557
762 H GLY 96 H GLY 96 19.662 15.098 10.073
763 HA2 GLY 96 1HA GLY 96 19.279 16.963 11.481
764 HA3 GLY 96 2HA GLY 96 18.984 15.861 12.818
765 H ALA 97 H ALA 97 21.596 14.536 11.561
766 HA ALA 97 HA ALA 97 23.529 16.389 12.759
767 HB1 ALA 97 1HB ALA 97 23.849 13.500 13.381
768 HB2 ALA 97 2HB ALA 97 24.346 14.919 14.303
769 HB3 ALA 97 3HB ALA 97 22.654 14.424 14.292
770 H SER 98 H SER 98 25.642 16.207 11.977
771 HA SER 98 HA SER 98 25.885 15.386 9.288
772 HB2 SER 98 1HB SER 98 28.483 15.631 10.171
773 HB3 SER 98 2HB SER 98 27.483 16.954 9.571
774 HG SER 98 HG SER 98 27.864 17.740 11.492
775 HA PRO 99 HA PRO 99 27.187 11.201 9.454
776 HB2 PRO 99 1HB PRO 99 29.186 11.114 7.620
777 HB3 PRO 99 2HB PRO 99 27.484 11.292 7.178
778 HG2 PRO 99 1HG PRO 99 29.610 13.386 7.406
779 HG3 PRO 99 2HG PRO 99 28.368 13.185 6.157
780 HD2 PRO 99 1HD PRO 99 28.131 14.978 8.173
781 HD3 PRO 99 2HD PRO 99 26.729 14.160 7.453
782 H SER 100 H SER 100 29.748 13.605 9.754
783 HA SER 100 HA SER 100 31.755 11.842 10.696
784 HB2 SER 100 1HB SER 100 31.374 14.811 10.690
785 HB3 SER 100 2HB SER 100 32.650 14.115 11.690
786 HG SER 100 HG SER 100 33.768 13.713 9.956
787 H GLU 101 H GLU 101 29.201 13.658 12.268
788 HA GLU 101 HA GLU 101 30.153 13.212 14.929
789 HB2 GLU 101 1HB GLU 101 28.666 15.107 14.278
790 HB3 GLU 101 2HB GLU 101 27.365 13.951 14.028
791 HG2 GLU 101 1HG GLU 101 26.900 13.844 16.198
792 HG3 GLU 101 2HG GLU 101 28.599 13.689 16.642
793 H PHE 102 H PHE 102 27.579 11.780 12.941
794 HA PHE 102 HA PHE 102 26.630 9.955 14.836
795 HB2 PHE 102 1HB PHE 102 25.461 10.515 12.723
796 HB3 PHE 102 2HB PHE 102 26.689 9.624 11.830
797 HD1 PHE 102 HD2 PHE 102 26.844 7.176 12.046
798 HD2 PHE 102 HD1 PHE 102 23.703 9.398 13.865
799 HE1 PHE 102 HE2 PHE 102 25.545 5.105 12.323
800 HE2 PHE 102 HE1 PHE 102 22.399 7.330 14.146
801 HZ PHE 102 HZ PHE 102 23.319 5.181 13.374
802 H ARG 103 H ARG 103 29.196 9.653 12.419
803 HA ARG 103 HA ARG 103 29.749 6.918 12.922
804 HB2 ARG 103 1HB ARG 103 30.428 8.436 10.912
805 HB3 ARG 103 2HB ARG 103 31.819 8.837 11.910
806 HG2 ARG 103 1HG ARG 103 32.385 6.444 12.040
807 HG3 ARG 103 2HG ARG 103 31.025 6.088 10.972
808 HD2 ARG 103 1HD ARG 103 32.033 7.106 9.144
809 HD3 ARG 103 2HD ARG 103 33.121 8.059 10.151
810 HE ARG 103 HE ARG 103 33.671 5.313 10.480
811 HH11 ARG 103 2HH1 ARG 103 34.010 7.895 8.169
812 HH12 ARG 103 1HH1 ARG 103 35.414 7.212 7.416
813 HH21 ARG 103 2HH2 ARG 103 35.518 4.404 9.497
814 HH22 ARG 103 1HH2 ARG 103 36.270 5.226 8.172
815 H ALA 104 H ALA 104 30.870 9.919 14.336
816 HA ALA 104 HA ALA 104 33.015 8.715 15.816
817 HB1 ALA 104 1HB ALA 104 31.776 11.422 15.695
818 HB2 ALA 104 2HB ALA 104 32.795 11.006 17.073
819 HB3 ALA 104 3HB ALA 104 33.452 10.935 15.438
820 H GLY 105 H GLY 105 29.624 9.233 16.310
821 HA2 GLY 105 1HA GLY 105 28.286 8.237 17.934
822 HA3 GLY 105 2HA GLY 105 29.738 7.716 18.775
823 H CYS 106 H CYS 106 29.820 10.996 17.964
824 HA CYS 106 HA CYS 106 29.701 11.772 20.717
825 HB2 CYS 106 1HB CYS 106 31.247 12.878 19.192
826 HB3 CYS 106 2HB CYS 106 29.906 13.432 18.196
827 HG CYS 106 HG CYS 106 29.690 14.392 21.393
828 H GLU 107 H GLU 107 28.057 12.630 21.838
829 HA GLU 107 HA GLU 107 25.600 13.316 20.363
830 HB2 GLU 107 1HB GLU 107 25.540 11.160 21.718
831 HB3 GLU 107 2HB GLU 107 25.656 12.172 23.151
832 HG2 GLU 107 1HG GLU 107 23.576 13.246 22.632
833 HG3 GLU 107 2HG GLU 107 23.483 12.406 21.085
Start of MODEL 7
1 H1 MET 1 H MET 1 0.008 0.588 -0.061
2 HA MET 1 HA MET 1 2.033 1.500 -1.768
3 HB2 MET 1 1HB MET 1 3.103 0.317 0.504
4 HB3 MET 1 2HB MET 1 3.153 -0.967 -0.697
5 HG2 MET 1 1HG MET 1 5.161 -0.006 -1.105
6 HG3 MET 1 2HG MET 1 4.163 0.955 -2.194
7 HE1 MET 1 3HE MET 1 6.737 1.751 -1.718
8 HE2 MET 1 1HE MET 1 6.123 3.386 -1.966
9 HE3 MET 1 2HE MET 1 7.106 3.020 -0.549
10 H ASP 2 H ASP 2 0.616 0.956 -3.380
11 HA ASP 2 HA ASP 2 -0.543 -1.670 -3.558
12 HB2 ASP 2 1HB ASP 2 -1.349 -0.835 -5.798
13 HB3 ASP 2 2HB ASP 2 -1.851 0.136 -4.416
14 H ASN 3 H ASN 3 -0.115 -3.244 -5.137
15 HA ASN 3 HA ASN 3 2.543 -3.822 -5.643
16 HB2 ASN 3 1HB ASN 3 1.760 -5.564 -7.120
17 HB3 ASN 3 2HB ASN 3 0.650 -5.448 -5.757
18 HD21 ASN 3 2HD2 ASN 3 -1.435 -4.809 -6.091
19 HD22 ASN 3 1HD2 ASN 3 -2.121 -4.592 -7.661
20 H ARG 4 H ARG 4 0.342 -1.813 -7.423
21 HA ARG 4 HA ARG 4 1.750 -1.770 -9.884
22 HB2 ARG 4 1HB ARG 4 -0.538 -0.426 -8.704
23 HB3 ARG 4 2HB ARG 4 0.439 0.680 -9.661
24 HG2 ARG 4 1HG ARG 4 0.030 -0.439 -11.625
25 HG3 ARG 4 2HG ARG 4 -0.309 -1.966 -10.808
26 HD2 ARG 4 1HD ARG 4 -2.343 -0.986 -11.740
27 HD3 ARG 4 2HD ARG 4 -2.418 -1.068 -9.981
28 HE ARG 4 HE ARG 4 -1.432 1.450 -10.761
29 HH11 ARG 4 2HH1 ARG 4 -4.369 -0.420 -10.764
30 HH12 ARG 4 1HH1 ARG 4 -5.406 0.967 -10.695
31 HH21 ARG 4 2HH2 ARG 4 -2.786 3.283 -10.670
32 HH22 ARG 4 1HH2 ARG 4 -4.504 3.072 -10.642
33 H VAL 5 H VAL 5 1.694 0.480 -7.126
34 HA VAL 5 HA VAL 5 3.685 2.205 -8.198
35 HB VAL 5 HB VAL 5 2.653 1.871 -5.382
36 HG11 VAL 5 1HG1 VAL 5 3.781 4.392 -5.591
37 HG12 VAL 5 2HG1 VAL 5 4.447 3.014 -4.713
38 HG13 VAL 5 3HG1 VAL 5 4.953 3.332 -6.372
39 HG21 VAL 5 3HG2 VAL 5 2.192 4.218 -7.182
40 HG22 VAL 5 1HG2 VAL 5 1.197 2.769 -7.324
41 HG23 VAL 5 2HG2 VAL 5 1.240 3.664 -5.805
42 H ARG 6 H ARG 6 3.746 -0.532 -5.974
43 HA ARG 6 HA ARG 6 6.342 -0.325 -5.019
44 HB2 ARG 6 1HB ARG 6 4.423 -2.029 -4.486
45 HB3 ARG 6 2HB ARG 6 5.204 -3.004 -5.723
46 HG2 ARG 6 1HG ARG 6 6.330 -3.805 -3.944
47 HG3 ARG 6 2HG ARG 6 7.347 -2.395 -4.247
48 HD2 ARG 6 1HD ARG 6 6.357 -1.170 -2.511
49 HD3 ARG 6 2HD ARG 6 4.973 -2.258 -2.417
50 HE ARG 6 HE ARG 6 7.502 -2.566 -1.109
51 HH11 ARG 6 2HH1 ARG 6 4.750 -4.262 -2.401
52 HH12 ARG 6 1HH1 ARG 6 4.957 -5.644 -1.377
53 HH21 ARG 6 2HH2 ARG 6 7.785 -4.380 0.245
54 HH22 ARG 6 1HH2 ARG 6 6.683 -5.710 0.128
55 H GLU 7 H GLU 7 5.165 -1.788 -8.019
56 HA GLU 7 HA GLU 7 7.616 -2.872 -8.872
57 HB2 GLU 7 1HB GLU 7 4.991 -2.302 -10.075
58 HB3 GLU 7 2HB GLU 7 6.331 -2.294 -11.212
59 HG2 GLU 7 1HG GLU 7 5.515 -4.546 -9.394
60 HG3 GLU 7 2HG GLU 7 5.359 -4.482 -11.148
61 H ALA 8 H ALA 8 6.071 0.247 -9.582
62 HA ALA 8 HA ALA 8 8.000 1.243 -11.338
63 HB1 ALA 8 1HB ALA 8 6.886 3.331 -9.685
64 HB2 ALA 8 2HB ALA 8 6.637 2.998 -11.400
65 HB3 ALA 8 3HB ALA 8 5.646 2.183 -10.191
66 H CYS 9 H CYS 9 7.880 1.215 -7.824
67 HA CYS 9 HA CYS 9 9.943 3.028 -7.298
68 HB2 CYS 9 1HB CYS 9 8.809 0.692 -5.791
69 HB3 CYS 9 2HB CYS 9 10.211 1.553 -5.168
70 HG CYS 9 HG CYS 9 8.323 2.747 -3.731
71 H GLN 10 H GLN 10 10.017 -0.395 -8.103
72 HA GLN 10 HA GLN 10 12.737 -0.853 -7.517
73 HB2 GLN 10 1HB GLN 10 10.801 -2.226 -9.374
74 HB3 GLN 10 2HB GLN 10 12.455 -2.782 -9.156
75 HG2 GLN 10 1HG GLN 10 10.730 -2.387 -6.762
76 HG3 GLN 10 2HG GLN 10 10.497 -3.814 -7.770
77 HE21 GLN 10 2HE2 GLN 10 11.191 -4.280 -5.265
78 HE22 GLN 10 1HE2 GLN 10 12.844 -4.765 -5.138
79 H TYR 11 H TYR 11 11.084 0.330 -10.387
80 HA TYR 11 HA TYR 11 13.314 0.207 -12.129
81 HB2 TYR 11 1HB TYR 11 11.164 0.359 -13.128
82 HB3 TYR 11 2HB TYR 11 10.749 1.792 -12.193
83 HD1 TYR 11 HD2 TYR 11 12.898 0.545 -14.941
84 HD2 TYR 11 HD1 TYR 11 11.267 3.956 -12.989
85 HE1 TYR 11 HE2 TYR 11 13.680 1.968 -16.787
86 HE2 TYR 11 HE1 TYR 11 12.044 5.389 -14.831
87 HH TYR 11 HH TYR 11 13.816 4.027 -17.595
88 H ILE 12 H ILE 12 12.011 2.746 -10.043
89 HA ILE 12 HA ILE 12 13.692 4.832 -10.872
90 HB ILE 12 HB ILE 12 12.492 4.384 -8.136
91 HG12 ILE 12 1HG1 ILE 12 11.445 6.093 -10.396
92 HG13 ILE 12 2HG1 ILE 12 10.899 4.446 -10.100
93 HG21 ILE 12 1HG2 ILE 12 13.534 6.234 -7.494
94 HG22 ILE 12 2HG2 ILE 12 14.313 6.350 -9.070
95 HG23 ILE 12 3HG2 ILE 12 12.755 7.129 -8.798
96 HD11 ILE 12 3HD1 ILE 12 10.769 6.507 -7.941
97 HD12 ILE 12 1HD1 ILE 12 9.516 6.404 -9.178
98 HD13 ILE 12 2HD1 ILE 12 9.835 5.023 -8.127
99 H SER 13 H SER 13 14.149 2.261 -8.512
100 HA SER 13 HA SER 13 16.433 3.213 -7.229
101 HB2 SER 13 1HB SER 13 15.419 1.328 -6.253
102 HB3 SER 13 2HB SER 13 15.405 0.436 -7.774
103 HG SER 13 HG SER 13 17.491 0.846 -5.961
104 H ASP 14 H ASP 14 16.050 1.586 -10.311
105 HA ASP 14 HA ASP 14 18.789 1.013 -10.754
106 HB2 ASP 14 1HB ASP 14 16.862 -0.033 -11.979
107 HB3 ASP 14 2HB ASP 14 16.665 1.484 -12.852
108 H HIS 15 H HIS 15 16.776 3.818 -11.373
109 HA HIS 15 HA HIS 15 18.955 5.174 -12.762
110 HB2 HIS 15 1HB HIS 15 16.088 5.964 -12.228
111 HB3 HIS 15 2HB HIS 15 17.253 7.010 -13.035
112 HD1 HIS 15 HD1 HIS 15 17.064 6.917 -15.487
113 HD2 HIS 15 HD2 HIS 15 15.987 3.309 -13.730
114 HE1 HIS 15 HE1 HIS 15 16.387 5.418 -17.390
115 H LEU 16 H LEU 16 18.764 4.503 -9.774
116 HA LEU 16 HA LEU 16 18.486 6.871 -8.303
117 HB2 LEU 16 1HB LEU 16 18.603 4.525 -7.411
118 HB3 LEU 16 2HB LEU 16 20.347 4.594 -7.656
119 HG LEU 16 HG LEU 16 20.060 6.766 -6.130
120 HD11 LEU 16 1HD1 LEU 16 18.363 5.539 -4.336
121 HD12 LEU 16 2HD1 LEU 16 17.547 5.336 -5.886
122 HD13 LEU 16 3HD1 LEU 16 17.992 6.949 -5.329
123 HD21 LEU 16 3HD2 LEU 16 20.578 5.281 -4.185
124 HD22 LEU 16 1HD2 LEU 16 21.582 5.005 -5.608
125 HD23 LEU 16 2HD2 LEU 16 20.262 3.897 -5.233
126 H ALA 17 H ALA 17 21.154 5.593 -10.159
127 HA ALA 17 HA ALA 17 22.956 7.675 -9.188
128 HB1 ALA 17 1HB ALA 17 24.298 6.292 -11.164
129 HB2 ALA 17 2HB ALA 17 24.402 5.996 -9.428
130 HB3 ALA 17 3HB ALA 17 23.277 5.064 -10.416
131 H ASP 18 H ASP 18 20.876 6.993 -11.834
132 HA ASP 18 HA ASP 18 22.127 8.499 -13.859
133 HB2 ASP 18 1HB ASP 18 20.068 6.855 -13.920
134 HB3 ASP 18 2HB ASP 18 19.144 8.337 -13.684
135 H SER 19 H SER 19 21.876 10.615 -14.527
136 HA SER 19 HA SER 19 21.154 12.482 -12.429
137 HB2 SER 19 1HB SER 19 22.534 12.728 -15.088
138 HB3 SER 19 2HB SER 19 21.950 14.164 -14.247
139 HG SER 19 HG SER 19 24.072 13.773 -13.639
140 H ASN 20 H ASN 20 20.253 11.932 -15.830
141 HA ASN 20 HA ASN 20 17.988 13.728 -15.576
142 HB2 ASN 20 1HB ASN 20 19.045 12.088 -17.885
143 HB3 ASN 20 2HB ASN 20 17.601 13.091 -17.987
144 HD21 ASN 20 2HD2 ASN 20 21.018 13.013 -17.997
145 HD22 ASN 20 1HD2 ASN 20 21.282 14.702 -18.247
146 H PHE 21 H PHE 21 16.411 12.863 -14.336
147 HA PHE 21 HA PHE 21 15.642 10.081 -14.658
148 HB2 PHE 21 1HB PHE 21 15.670 10.838 -12.399
149 HB3 PHE 21 2HB PHE 21 14.731 12.273 -12.797
150 HD1 PHE 21 HD2 PHE 21 14.427 8.562 -13.053
151 HD2 PHE 21 HD1 PHE 21 12.521 12.271 -12.202
152 HE1 PHE 21 HE2 PHE 21 12.358 7.362 -12.475
153 HE2 PHE 21 HE1 PHE 21 10.450 11.077 -11.621
154 HZ PHE 21 HZ PHE 21 10.366 8.620 -11.759
155 H ASP 22 H ASP 22 13.834 9.349 -15.642
156 HA ASP 22 HA ASP 22 12.097 11.365 -16.911
157 HB2 ASP 22 1HB ASP 22 13.651 9.494 -18.186
158 HB3 ASP 22 2HB ASP 22 12.090 8.681 -18.101
159 H ILE 23 H ILE 23 10.488 11.461 -15.392
160 HA ILE 23 HA ILE 23 9.390 9.334 -13.970
161 HB ILE 23 HB ILE 23 8.992 11.761 -13.505
162 HG12 ILE 23 1HG1 ILE 23 6.628 11.439 -12.774
163 HG13 ILE 23 2HG1 ILE 23 6.572 9.960 -13.727
164 HG21 ILE 23 1HG2 ILE 23 8.440 12.324 -15.884
165 HG22 ILE 23 2HG2 ILE 23 6.873 11.558 -15.633
166 HG23 ILE 23 3HG2 ILE 23 7.321 12.978 -14.688
167 HD11 ILE 23 3HD1 ILE 23 8.439 10.469 -11.424
168 HD12 ILE 23 1HD1 ILE 23 6.946 9.535 -11.346
169 HD13 ILE 23 2HD1 ILE 23 8.287 8.971 -12.342
170 H ALA 24 H ALA 24 8.951 10.276 -17.260
171 HA ALA 24 HA ALA 24 6.434 9.163 -17.793
172 HB1 ALA 24 1HB ALA 24 7.273 10.538 -19.469
173 HB2 ALA 24 2HB ALA 24 8.836 9.720 -19.494
174 HB3 ALA 24 3HB ALA 24 7.413 8.923 -20.164
175 H SER 25 H SER 25 9.678 7.730 -17.940
176 HA SER 25 HA SER 25 8.880 5.212 -18.916
177 HB2 SER 25 1HB SER 25 11.279 5.876 -17.191
178 HB3 SER 25 2HB SER 25 11.079 4.429 -18.179
179 HG SER 25 HG SER 25 11.238 5.646 -20.003
180 H VAL 26 H VAL 26 8.892 6.602 -15.724
181 HA VAL 26 HA VAL 26 8.709 4.214 -14.225
182 HB VAL 26 HB VAL 26 7.658 6.962 -13.537
183 HG11 VAL 26 1HG1 VAL 26 7.738 6.206 -11.220
184 HG12 VAL 26 2HG1 VAL 26 6.646 5.200 -12.174
185 HG13 VAL 26 3HG1 VAL 26 8.253 4.605 -11.751
186 HG21 VAL 26 3HG2 VAL 26 9.870 6.703 -12.057
187 HG22 VAL 26 1HG2 VAL 26 10.341 5.718 -13.443
188 HG23 VAL 26 2HG2 VAL 26 9.880 7.404 -13.675
189 H ALA 27 H ALA 27 6.206 6.451 -15.406
190 HA ALA 27 HA ALA 27 4.021 4.943 -14.412
191 HB1 ALA 27 1HB ALA 27 4.360 7.427 -15.612
192 HB2 ALA 27 2HB ALA 27 3.348 6.520 -16.737
193 HB3 ALA 27 3HB ALA 27 2.844 6.716 -15.058
194 H GLN 28 H GLN 28 5.638 5.075 -17.558
195 HA GLN 28 HA GLN 28 3.866 3.400 -18.951
196 HB2 GLN 28 1HB GLN 28 5.516 4.784 -20.096
197 HB3 GLN 28 2HB GLN 28 6.824 3.854 -19.377
198 HG2 GLN 28 1HG GLN 28 6.553 3.134 -21.626
199 HG3 GLN 28 2HG GLN 28 5.973 1.848 -20.568
200 HE21 GLN 28 2HE2 GLN 28 4.786 1.024 -22.345
201 HE22 GLN 28 1HE2 GLN 28 3.288 1.741 -22.818
202 H HIS 29 H HIS 29 6.658 2.699 -16.928
203 HA HIS 29 HA HIS 29 6.999 0.000 -17.542
204 HB2 HIS 29 1HB HIS 29 8.670 1.083 -16.236
205 HB3 HIS 29 2HB HIS 29 7.503 1.551 -15.003
206 HD1 HIS 29 HD1 HIS 29 7.847 -1.935 -16.415
207 HD2 HIS 29 HD2 HIS 29 8.585 0.155 -12.901
208 HE1 HIS 29 HE1 HIS 29 8.466 -3.679 -14.713
209 H VAL 30 H VAL 30 4.718 1.595 -15.404
210 HA VAL 30 HA VAL 30 3.649 -0.987 -14.532
211 HB VAL 30 HB VAL 30 2.257 0.328 -12.977
212 HG11 VAL 30 1HG1 VAL 30 4.296 1.381 -11.722
213 HG12 VAL 30 2HG1 VAL 30 4.186 -0.368 -11.932
214 HG13 VAL 30 3HG1 VAL 30 5.230 0.585 -12.988
215 HG21 VAL 30 3HG2 VAL 30 3.809 2.763 -13.800
216 HG22 VAL 30 1HG2 VAL 30 2.256 2.360 -14.533
217 HG23 VAL 30 2HG2 VAL 30 2.362 2.662 -12.798
218 H CYS 31 H CYS 31 3.328 0.372 -17.255
219 HA CYS 31 HA CYS 31 1.714 0.693 -18.832
220 HB2 CYS 31 1HB CYS 31 0.164 -1.257 -17.117
221 HB3 CYS 31 2HB CYS 31 -0.113 -0.915 -18.820
222 HG CYS 31 HG CYS 31 1.064 -3.314 -18.983
223 H LEU 32 H LEU 32 1.726 2.598 -16.725
224 HA LEU 32 HA LEU 32 -1.082 3.442 -16.840
225 HB2 LEU 32 1HB LEU 32 -0.465 2.425 -14.604
226 HB3 LEU 32 2HB LEU 32 0.618 3.798 -14.384
227 HG LEU 32 HG LEU 32 -1.279 5.325 -14.440
228 HD11 LEU 32 1HD1 LEU 32 -2.781 2.826 -15.090
229 HD12 LEU 32 2HD1 LEU 32 -2.876 4.420 -15.838
230 HD13 LEU 32 3HD1 LEU 32 -3.586 4.150 -14.246
231 HD21 LEU 32 3HD2 LEU 32 -0.530 4.161 -12.322
232 HD22 LEU 32 1HD2 LEU 32 -1.915 3.088 -12.531
233 HD23 LEU 32 2HD2 LEU 32 -2.166 4.820 -12.309
234 H SER 33 H SER 33 -1.336 5.789 -16.356
235 HA SER 33 HA SER 33 0.617 7.281 -17.844
236 HB2 SER 33 1HB SER 33 -2.064 7.850 -16.661
237 HB3 SER 33 2HB SER 33 -1.013 9.215 -17.035
238 HG SER 33 HG SER 33 -0.860 8.355 -19.181
239 HA PRO 34 HA PRO 34 3.038 8.994 -14.612
240 HB2 PRO 34 1HB PRO 34 3.428 11.539 -15.472
241 HB3 PRO 34 2HB PRO 34 4.202 10.140 -16.227
242 HG2 PRO 34 1HG PRO 34 1.769 11.654 -17.093
243 HG3 PRO 34 2HG PRO 34 3.117 11.047 -18.072
244 HD2 PRO 34 1HD PRO 34 0.737 9.765 -17.915
245 HD3 PRO 34 2HD PRO 34 2.274 8.903 -18.130
246 H SER 35 H SER 35 0.312 11.037 -15.614
247 HA SER 35 HA SER 35 0.244 12.607 -13.258
248 HB2 SER 35 1HB SER 35 -1.861 12.030 -15.351
249 HB3 SER 35 2HB SER 35 -2.087 13.182 -14.034
250 HG SER 35 HG SER 35 -0.802 13.517 -16.367
251 H ARG 36 H ARG 36 -1.596 9.749 -14.285
252 HA ARG 36 HA ARG 36 -3.169 9.588 -11.930
253 HB2 ARG 36 1HB ARG 36 -2.527 7.657 -14.144
254 HB3 ARG 36 2HB ARG 36 -3.473 7.156 -12.749
255 HG2 ARG 36 1HG ARG 36 -4.224 9.529 -14.426
256 HG3 ARG 36 2HG ARG 36 -4.755 7.889 -14.805
257 HD2 ARG 36 1HD ARG 36 -5.748 7.735 -12.543
258 HD3 ARG 36 2HD ARG 36 -5.292 9.414 -12.260
259 HE ARG 36 HE ARG 36 -6.754 9.554 -14.527
260 HH11 ARG 36 2HH1 ARG 36 -7.324 8.120 -11.407
261 HH12 ARG 36 1HH1 ARG 36 -9.040 8.344 -11.472
262 HH21 ARG 36 2HH2 ARG 36 -9.013 9.854 -14.625
263 HH22 ARG 36 1HH2 ARG 36 -10.000 9.329 -13.304
264 H LEU 37 H LEU 37 -0.138 8.074 -12.937
265 HA LEU 37 HA LEU 37 0.102 6.370 -10.681
266 HB2 LEU 37 1HB LEU 37 1.309 5.873 -12.692
267 HB3 LEU 37 2HB LEU 37 2.140 7.426 -12.631
268 HG LEU 37 HG LEU 37 3.044 6.473 -10.346
269 HD11 LEU 37 1HD1 LEU 37 3.468 3.904 -11.181
270 HD12 LEU 37 2HD1 LEU 37 1.782 4.172 -11.623
271 HD13 LEU 37 3HD1 LEU 37 2.303 4.402 -9.954
272 HD21 LEU 37 3HD2 LEU 37 4.510 5.102 -12.405
273 HD22 LEU 37 1HD2 LEU 37 4.954 6.534 -11.477
274 HD23 LEU 37 2HD2 LEU 37 4.014 6.702 -12.960
275 H SER 38 H SER 38 1.420 9.569 -11.456
276 HA SER 38 HA SER 38 3.019 9.885 -9.182
277 HB2 SER 38 1HB SER 38 2.908 12.298 -9.657
278 HB3 SER 38 2HB SER 38 3.168 11.369 -11.134
279 HG SER 38 HG SER 38 0.735 12.505 -10.219
280 H HIS 39 H HIS 39 -0.396 10.596 -9.731
281 HA HIS 39 HA HIS 39 -0.925 11.954 -7.343
282 HB2 HIS 39 1HB HIS 39 -2.496 11.860 -9.243
283 HB3 HIS 39 2HB HIS 39 -2.782 10.153 -8.914
284 HD1 HIS 39 HD1 HIS 39 -3.972 13.483 -8.067
285 HD2 HIS 39 HD2 HIS 39 -4.071 9.715 -6.319
286 HE1 HIS 39 HE1 HIS 39 -5.771 13.602 -6.313
287 H LEU 40 H LEU 40 -1.203 8.491 -8.104
288 HA LEU 40 HA LEU 40 -1.994 7.756 -5.467
289 HB2 LEU 40 1HB LEU 40 -0.818 6.064 -7.667
290 HB3 LEU 40 2HB LEU 40 -1.612 5.459 -6.215
291 HG LEU 40 HG LEU 40 -2.899 6.980 -8.480
292 HD11 LEU 40 1HD1 LEU 40 -3.415 5.005 -9.348
293 HD12 LEU 40 2HD1 LEU 40 -4.043 4.430 -7.804
294 HD13 LEU 40 3HD1 LEU 40 -2.327 4.263 -8.174
295 HD21 LEU 40 3HD2 LEU 40 -4.014 6.034 -5.846
296 HD22 LEU 40 1HD2 LEU 40 -5.011 6.489 -7.228
297 HD23 LEU 40 2HD2 LEU 40 -3.962 7.685 -6.467
298 H PHE 41 H PHE 41 1.066 8.086 -7.119
299 HA PHE 41 HA PHE 41 2.703 6.616 -5.397
300 HB2 PHE 41 1HB PHE 41 3.108 8.102 -7.659
301 HB3 PHE 41 2HB PHE 41 3.892 9.098 -6.437
302 HD1 PHE 41 HD2 PHE 41 5.825 8.267 -5.209
303 HD2 PHE 41 HD1 PHE 41 3.988 5.960 -8.277
304 HE1 PHE 41 HE2 PHE 41 7.810 6.816 -5.301
305 HE2 PHE 41 HE1 PHE 41 5.969 4.504 -8.374
306 HZ PHE 41 HZ PHE 41 7.884 4.932 -6.886
307 H ARG 42 H ARG 42 1.884 10.079 -5.326
308 HA ARG 42 HA ARG 42 3.312 10.615 -2.934
309 HB2 ARG 42 1HB ARG 42 2.749 12.378 -4.539
310 HB3 ARG 42 2HB ARG 42 1.037 12.137 -4.219
311 HG2 ARG 42 1HG ARG 42 2.594 12.668 -1.813
312 HG3 ARG 42 2HG ARG 42 2.653 13.975 -2.997
313 HD2 ARG 42 1HD ARG 42 0.029 13.439 -3.062
314 HD3 ARG 42 2HD ARG 42 0.382 12.946 -1.406
315 HE ARG 42 HE ARG 42 1.551 15.418 -1.714
316 HH11 ARG 42 2HH1 ARG 42 -1.659 14.092 -1.961
317 HH12 ARG 42 1HH1 ARG 42 -2.444 15.561 -1.485
318 HH21 ARG 42 2HH2 ARG 42 0.529 17.359 -1.086
319 HH22 ARG 42 1HH2 ARG 42 -1.198 17.419 -0.988
320 H GLN 43 H GLN 43 0.162 9.351 -3.605
321 HA GLN 43 HA GLN 43 -0.938 9.913 -1.012
322 HB2 GLN 43 1HB GLN 43 -1.822 8.333 -3.397
323 HB3 GLN 43 2HB GLN 43 -2.643 8.112 -1.858
324 HG2 GLN 43 1HG GLN 43 -2.263 10.881 -2.854
325 HG3 GLN 43 2HG GLN 43 -3.468 9.866 -3.643
326 HE21 GLN 43 2HE2 GLN 43 -4.702 11.794 -2.678
327 HE22 GLN 43 1HE2 GLN 43 -5.395 11.528 -1.117
328 H GLN 44 H GLN 44 0.517 7.116 -2.609
329 HA GLN 44 HA GLN 44 0.144 5.418 -0.308
330 HB2 GLN 44 1HB GLN 44 1.803 4.956 -2.792
331 HB3 GLN 44 2HB GLN 44 1.358 3.740 -1.603
332 HG2 GLN 44 1HG GLN 44 -0.829 5.249 -2.915
333 HG3 GLN 44 2HG GLN 44 0.038 4.049 -3.872
334 HE21 GLN 44 2HE2 GLN 44 -2.064 2.997 -3.934
335 HE22 GLN 44 1HE2 GLN 44 -2.524 1.965 -2.627
336 H LEU 45 H LEU 45 2.792 7.202 -1.808
337 HA LEU 45 HA LEU 45 4.681 6.279 0.196
338 HB2 LEU 45 1HB LEU 45 4.896 7.154 -2.432
339 HB3 LEU 45 2HB LEU 45 5.591 8.462 -1.476
340 HG LEU 45 HG LEU 45 6.481 5.628 -1.073
341 HD11 LEU 45 1HD1 LEU 45 6.717 6.001 -3.445
342 HD12 LEU 45 2HD1 LEU 45 8.303 6.067 -2.677
343 HD13 LEU 45 3HD1 LEU 45 7.492 7.559 -3.156
344 HD21 LEU 45 3HD2 LEU 45 8.136 8.109 -0.861
345 HD22 LEU 45 1HD2 LEU 45 8.326 6.561 -0.038
346 HD23 LEU 45 2HD2 LEU 45 7.034 7.662 0.442
347 H GLY 46 H GLY 46 2.486 8.847 -0.241
348 HA2 GLY 46 1HA GLY 46 1.972 10.640 1.103
349 HA3 GLY 46 2HA GLY 46 3.085 9.978 2.291
350 H ILE 47 H ILE 47 4.630 10.364 -0.654
351 HA ILE 47 HA ILE 47 5.367 13.145 -0.235
352 HB ILE 47 HB ILE 47 7.738 12.743 -0.082
353 HG12 ILE 47 1HG1 ILE 47 7.036 9.800 -0.126
354 HG13 ILE 47 2HG1 ILE 47 7.847 10.686 -1.412
355 HG21 ILE 47 1HG2 ILE 47 6.237 11.078 1.935
356 HG22 ILE 47 2HG2 ILE 47 7.865 11.722 2.139
357 HG23 ILE 47 3HG2 ILE 47 6.492 12.821 2.009
358 HD11 ILE 47 3HD1 ILE 47 9.704 11.152 0.167
359 HD12 ILE 47 1HD1 ILE 47 8.907 10.103 1.339
360 HD13 ILE 47 2HD1 ILE 47 9.475 9.441 -0.194
361 H SER 48 H SER 48 7.117 13.762 -1.925
362 HA SER 48 HA SER 48 6.064 13.026 -4.493
363 HB2 SER 48 1HB SER 48 8.005 14.584 -5.260
364 HB3 SER 48 2HB SER 48 6.647 15.286 -4.382
365 HG SER 48 HG SER 48 9.052 15.643 -3.735
366 H VAL 49 H VAL 49 7.140 12.001 -6.185
367 HA VAL 49 HA VAL 49 8.674 9.775 -5.582
368 HB VAL 49 HB VAL 49 8.708 11.233 -8.226
369 HG11 VAL 49 1HG1 VAL 49 9.161 9.050 -9.178
370 HG12 VAL 49 2HG1 VAL 49 10.384 9.448 -7.969
371 HG13 VAL 49 3HG1 VAL 49 9.091 8.312 -7.577
372 HG21 VAL 49 3HG2 VAL 49 6.893 9.071 -8.264
373 HG22 VAL 49 1HG2 VAL 49 6.520 10.038 -6.836
374 HG23 VAL 49 2HG2 VAL 49 6.541 10.791 -8.431
375 H LEU 50 H LEU 50 9.733 12.969 -6.702
376 HA LEU 50 HA LEU 50 12.466 12.368 -6.950
377 HB2 LEU 50 1HB LEU 50 11.288 15.032 -6.186
378 HB3 LEU 50 2HB LEU 50 12.838 14.734 -6.970
379 HG LEU 50 HG LEU 50 10.485 13.763 -8.447
380 HD11 LEU 50 1HD1 LEU 50 9.436 15.736 -7.698
381 HD12 LEU 50 2HD1 LEU 50 10.060 16.104 -9.306
382 HD13 LEU 50 3HD1 LEU 50 10.913 16.682 -7.875
383 HD21 LEU 50 3HD2 LEU 50 12.383 15.628 -9.671
384 HD22 LEU 50 1HD2 LEU 50 11.853 14.031 -10.202
385 HD23 LEU 50 2HD2 LEU 50 13.123 14.180 -8.986
386 H SER 51 H SER 51 10.509 13.307 -4.196
387 HA SER 51 HA SER 51 12.703 13.819 -2.444
388 HB2 SER 51 1HB SER 51 10.416 14.754 -2.106
389 HB3 SER 51 2HB SER 51 9.844 13.130 -1.723
390 HG SER 51 HG SER 51 10.404 13.667 0.233
391 H TRP 52 H TRP 52 10.567 11.049 -2.997
392 HA TRP 52 HA TRP 52 11.498 9.403 -0.943
393 HB2 TRP 52 1HB TRP 52 9.494 8.812 -2.129
394 HB3 TRP 52 2HB TRP 52 10.363 8.716 -3.658
395 HD1 TRP 52 HD1 TRP 52 10.475 6.909 -0.215
396 HE1 TRP 52 HE1 TRP 52 10.968 4.421 -0.651
397 HE3 TRP 52 HE3 TRP 52 10.990 7.062 -5.299
398 HZ2 TRP 52 HZ2 TRP 52 11.505 2.745 -2.858
399 HZ3 TRP 52 HZ3 TRP 52 11.493 4.973 -6.497
400 HH2 TRP 52 HH2 TRP 52 11.746 2.860 -5.300
401 H ARG 53 H ARG 53 12.697 9.876 -4.232
402 HA ARG 53 HA ARG 53 14.594 7.813 -4.259
403 HB2 ARG 53 1HB ARG 53 13.736 9.584 -6.095
404 HB3 ARG 53 2HB ARG 53 15.269 10.332 -5.668
405 HG2 ARG 53 1HG ARG 53 16.384 8.155 -6.147
406 HG3 ARG 53 2HG ARG 53 14.834 7.558 -6.745
407 HD2 ARG 53 1HD ARG 53 16.415 9.888 -7.824
408 HD3 ARG 53 2HD ARG 53 16.188 8.320 -8.597
409 HE ARG 53 HE ARG 53 14.008 8.928 -9.155
410 HH11 ARG 53 2HH1 ARG 53 15.577 11.396 -7.266
411 HH12 ARG 53 1HH1 ARG 53 14.398 12.611 -7.635
412 HH21 ARG 53 2HH2 ARG 53 12.450 10.519 -9.648
413 HH22 ARG 53 1HH2 ARG 53 12.619 12.111 -8.990
414 H GLU 54 H GLU 54 14.910 11.228 -3.330
415 HA GLU 54 HA GLU 54 17.662 11.103 -2.699
416 HB2 GLU 54 1HB GLU 54 16.497 13.220 -3.122
417 HB3 GLU 54 2HB GLU 54 15.536 12.990 -1.668
418 HG2 GLU 54 1HG GLU 54 17.619 13.058 -0.335
419 HG3 GLU 54 2HG GLU 54 18.510 13.421 -1.812
420 H ASP 55 H ASP 55 14.746 10.823 -0.697
421 HA ASP 55 HA ASP 55 16.044 10.563 1.779
422 HB2 ASP 55 1HB ASP 55 13.336 10.027 0.719
423 HB3 ASP 55 2HB ASP 55 13.779 9.127 2.167
424 H GLN 56 H GLN 56 15.121 8.170 -0.646
425 HA GLN 56 HA GLN 56 15.800 5.893 0.901
426 HB2 GLN 56 1HB GLN 56 15.243 6.417 -1.984
427 HB3 GLN 56 2HB GLN 56 16.005 4.895 -1.542
428 HG2 GLN 56 1HG GLN 56 13.384 5.921 -0.475
429 HG3 GLN 56 2HG GLN 56 13.583 4.686 -1.716
430 HE21 GLN 56 2HE2 GLN 56 15.515 3.101 -0.776
431 HE22 GLN 56 1HE2 GLN 56 15.053 2.378 0.723
432 H ARG 57 H ARG 57 17.599 7.969 -1.286
433 HA ARG 57 HA ARG 57 19.864 6.382 -1.667
434 HB2 ARG 57 1HB ARG 57 19.383 9.342 -1.699
435 HB3 ARG 57 2HB ARG 57 21.016 8.713 -1.870
436 HG2 ARG 57 1HG ARG 57 20.489 7.605 -3.881
437 HG3 ARG 57 2HG ARG 57 18.756 7.820 -3.631
438 HD2 ARG 57 1HD ARG 57 19.125 10.289 -3.794
439 HD3 ARG 57 2HD ARG 57 20.794 9.950 -4.252
440 HE ARG 57 HE ARG 57 19.080 8.512 -5.944
441 HH11 ARG 57 2HH1 ARG 57 20.030 11.791 -5.260
442 HH12 ARG 57 1HH1 ARG 57 19.725 12.353 -6.870
443 HH21 ARG 57 2HH2 ARG 57 18.674 9.240 -8.067
444 HH22 ARG 57 1HH2 ARG 57 18.953 10.902 -8.466
445 H ILE 58 H ILE 58 19.128 8.745 0.874
446 HA ILE 58 HA ILE 58 21.602 8.566 2.211
447 HB ILE 58 HB ILE 58 18.935 9.222 3.463
448 HG12 ILE 58 1HG1 ILE 58 19.264 10.607 1.485
449 HG13 ILE 58 2HG1 ILE 58 19.481 11.577 2.937
450 HG21 ILE 58 1HG2 ILE 58 21.770 9.486 4.299
451 HG22 ILE 58 2HG2 ILE 58 20.654 10.773 4.753
452 HG23 ILE 58 3HG2 ILE 58 20.337 9.112 5.255
453 HD11 ILE 58 3HD1 ILE 58 21.884 11.461 2.685
454 HD12 ILE 58 1HD1 ILE 58 21.705 10.419 1.274
455 HD13 ILE 58 2HD1 ILE 58 21.138 12.088 1.215
456 H SER 59 H SER 59 18.577 6.778 2.564
457 HA SER 59 HA SER 59 19.148 5.386 4.906
458 HB2 SER 59 1HB SER 59 16.933 5.386 3.816
459 HB3 SER 59 2HB SER 59 17.583 4.396 2.509
460 HG SER 59 HG SER 59 17.523 3.649 5.248
461 H GLN 60 H GLN 60 19.952 4.602 1.548
462 HA GLN 60 HA GLN 60 21.164 2.098 2.158
463 HB2 GLN 60 1HB GLN 60 20.252 2.827 -0.092
464 HB3 GLN 60 2HB GLN 60 21.701 3.808 -0.270
465 HG2 GLN 60 1HG GLN 60 21.948 1.712 -1.442
466 HG3 GLN 60 2HG GLN 60 23.081 1.799 -0.095
467 HE21 GLN 60 2HE2 GLN 60 22.883 0.391 1.598
468 HE22 GLN 60 1HE2 GLN 60 21.800 -0.955 1.591
469 H ALA 61 H ALA 61 22.362 5.389 1.772
470 HA ALA 61 HA ALA 61 25.105 4.855 1.745
471 HB1 ALA 61 1HB ALA 61 23.748 7.077 1.413
472 HB2 ALA 61 2HB ALA 61 24.091 7.288 3.130
473 HB3 ALA 61 3HB ALA 61 25.417 7.113 1.982
474 H LYS 62 H LYS 62 22.925 5.480 4.478
475 HA LYS 62 HA LYS 62 24.959 5.252 6.458
476 HB2 LYS 62 1HB LYS 62 23.115 5.232 8.064
477 HB3 LYS 62 2HB LYS 62 22.888 6.498 6.864
478 HG2 LYS 62 1HG LYS 62 21.249 5.176 5.704
479 HG3 LYS 62 2HG LYS 62 21.546 3.805 6.775
480 HD2 LYS 62 1HD LYS 62 19.550 4.880 7.519
481 HD3 LYS 62 2HD LYS 62 20.821 5.254 8.686
482 HE2 LYS 62 1HE LYS 62 21.031 7.454 7.923
483 HE3 LYS 62 2HE LYS 62 20.208 7.102 6.404
484 HZ1 LYS 62 3HZ LYS 62 18.289 7.667 7.321
485 HZ2 LYS 62 1HZ LYS 62 19.098 8.111 8.739
486 HZ3 LYS 62 2HZ LYS 62 18.489 6.542 8.568
487 H LEU 63 H LEU 63 22.745 3.007 4.932
488 HA LEU 63 HA LEU 63 23.097 0.867 6.756
489 HB2 LEU 63 1HB LEU 63 21.331 1.266 4.865
490 HB3 LEU 63 2HB LEU 63 22.504 0.410 3.866
491 HG LEU 63 HG LEU 63 20.748 -1.081 4.677
492 HD11 LEU 63 1HD1 LEU 63 23.206 -1.765 4.393
493 HD12 LEU 63 2HD1 LEU 63 22.136 -2.850 5.279
494 HD13 LEU 63 3HD1 LEU 63 23.253 -1.804 6.156
495 HD21 LEU 63 3HD2 LEU 63 21.611 -1.210 7.437
496 HD22 LEU 63 1HD2 LEU 63 19.985 -1.073 6.767
497 HD23 LEU 63 2HD2 LEU 63 20.956 0.376 7.029
498 H LEU 64 H LEU 64 24.566 1.562 3.589
499 HA LEU 64 HA LEU 64 26.319 -0.675 3.656
500 HB2 LEU 64 1HB LEU 64 27.254 0.171 1.680
501 HB3 LEU 64 2HB LEU 64 25.548 0.610 1.620
502 HG LEU 64 HG LEU 64 26.502 2.872 2.652
503 HD11 LEU 64 1HD1 LEU 64 28.851 1.434 1.880
504 HD12 LEU 64 2HD1 LEU 64 28.712 3.024 2.631
505 HD13 LEU 64 3HD1 LEU 64 28.678 2.873 0.874
506 HD21 LEU 64 3HD2 LEU 64 26.711 3.676 0.257
507 HD22 LEU 64 1HD2 LEU 64 25.193 2.892 0.692
508 HD23 LEU 64 2HD2 LEU 64 26.410 2.006 -0.226
509 H LEU 65 H LEU 65 26.620 2.706 4.597
510 HA LEU 65 HA LEU 65 29.369 2.848 4.987
511 HB2 LEU 65 1HB LEU 65 27.009 4.263 6.092
512 HB3 LEU 65 2HB LEU 65 28.542 4.461 6.939
513 HG LEU 65 HG LEU 65 28.205 5.034 4.001
514 HD11 LEU 65 1HD1 LEU 65 27.841 7.309 4.485
515 HD12 LEU 65 2HD1 LEU 65 28.190 7.084 6.198
516 HD13 LEU 65 3HD1 LEU 65 26.710 6.420 5.506
517 HD21 LEU 65 3HD2 LEU 65 30.226 6.497 4.564
518 HD22 LEU 65 1HD2 LEU 65 30.476 4.753 4.484
519 HD23 LEU 65 2HD2 LEU 65 30.336 5.553 6.050
520 H SER 66 H SER 66 26.896 1.335 6.913
521 HA SER 66 HA SER 66 28.458 1.065 9.288
522 HB2 SER 66 1HB SER 66 25.865 -0.061 8.305
523 HB3 SER 66 2HB SER 66 26.647 -0.808 9.698
524 HG SER 66 HG SER 66 25.279 0.798 10.432
525 H THR 67 H THR 67 27.994 -0.836 6.393
526 HA THR 67 HA THR 67 29.640 -2.998 7.499
527 HB THR 67 HB THR 67 27.569 -3.738 6.460
528 HG1 THR 67 HG1 THR 67 29.092 -5.253 6.117
529 HG21 THR 67 3HG2 THR 67 27.544 -3.478 3.854
530 HG22 THR 67 1HG2 THR 67 28.549 -2.067 4.183
531 HG23 THR 67 2HG2 THR 67 26.932 -2.180 4.878
532 H THR 68 H THR 68 30.243 -0.187 6.110
533 HA THR 68 HA THR 68 32.562 -1.229 4.633
534 HB THR 68 HB THR 68 32.347 0.505 2.942
535 HG1 THR 68 HG1 THR 68 31.253 2.202 3.607
536 HG21 THR 68 3HG2 THR 68 29.609 -0.423 2.717
537 HG22 THR 68 1HG2 THR 68 30.705 -1.723 3.183
538 HG23 THR 68 2HG2 THR 68 31.009 -0.797 1.713
539 H ARG 69 H ARG 69 34.333 0.330 4.433
540 HA ARG 69 HA ARG 69 34.332 2.300 6.625
541 HB2 ARG 69 1HB ARG 69 36.684 1.794 7.018
542 HB3 ARG 69 2HB ARG 69 35.707 0.340 7.182
543 HG2 ARG 69 1HG ARG 69 36.931 0.897 4.538
544 HG3 ARG 69 2HG ARG 69 37.983 0.355 5.847
545 HD2 ARG 69 1HD ARG 69 35.449 -1.126 5.412
546 HD3 ARG 69 2HD ARG 69 36.734 -1.342 4.224
547 HE ARG 69 HE ARG 69 36.643 -2.438 6.835
548 HH11 ARG 69 2HH1 ARG 69 38.834 -1.081 4.495
549 HH12 ARG 69 1HH1 ARG 69 40.210 -1.955 5.083
550 HH21 ARG 69 2HH2 ARG 69 38.447 -3.594 7.619
551 HH22 ARG 69 1HH2 ARG 69 39.988 -3.385 6.859
552 H MET 70 H MET 70 33.906 2.393 3.592
553 HA MET 70 HA MET 70 36.122 3.808 2.505
554 HB2 MET 70 1HB MET 70 33.249 3.507 1.647
555 HB3 MET 70 2HB MET 70 34.397 4.487 0.745
556 HG2 MET 70 1HG MET 70 35.776 2.575 0.311
557 HG3 MET 70 2HG MET 70 34.779 1.568 1.358
558 HE1 MET 70 3HE MET 70 32.255 1.046 0.888
559 HE2 MET 70 1HE MET 70 31.800 2.698 0.466
560 HE3 MET 70 2HE MET 70 31.426 1.371 -0.635
561 HA PRO 71 HA PRO 71 35.494 7.901 3.957
562 HB2 PRO 71 1HB PRO 71 36.228 9.368 1.794
563 HB3 PRO 71 2HB PRO 71 37.388 8.485 2.794
564 HG2 PRO 71 1HG PRO 71 36.174 7.709 0.170
565 HG3 PRO 71 2HG PRO 71 37.854 7.553 0.715
566 HD2 PRO 71 1HD PRO 71 36.122 5.471 0.717
567 HD3 PRO 71 2HD PRO 71 37.417 5.637 1.920
568 H ILE 72 H ILE 72 34.282 9.896 3.622
569 HA ILE 72 HA ILE 72 31.626 9.457 2.868
570 HB ILE 72 HB ILE 72 33.030 12.121 3.102
571 HG12 ILE 72 1HG1 ILE 72 31.465 10.639 5.219
572 HG13 ILE 72 2HG1 ILE 72 33.220 10.590 5.101
573 HG21 ILE 72 1HG2 ILE 72 30.841 12.198 1.969
574 HG22 ILE 72 2HG2 ILE 72 30.107 11.438 3.381
575 HG23 ILE 72 3HG2 ILE 72 30.832 13.039 3.519
576 HD11 ILE 72 3HD1 ILE 72 33.466 12.676 5.919
577 HD12 ILE 72 1HD1 ILE 72 31.979 13.265 5.178
578 HD13 ILE 72 2HD1 ILE 72 31.908 12.306 6.657
579 H ALA 73 H ALA 73 34.365 10.645 1.057
580 HA ALA 73 HA ALA 73 32.956 11.778 -1.113
581 HB1 ALA 73 1HB ALA 73 35.172 12.431 -1.008
582 HB2 ALA 73 2HB ALA 73 35.751 10.788 -0.730
583 HB3 ALA 73 3HB ALA 73 35.187 11.265 -2.331
584 H THR 74 H THR 74 34.360 8.548 -0.629
585 HA THR 74 HA THR 74 33.599 7.527 -3.155
586 HB THR 74 HB THR 74 34.148 6.011 -0.596
587 HG1 THR 74 HG1 THR 74 35.939 6.378 -2.759
588 HG21 THR 74 3HG2 THR 74 33.011 4.571 -2.134
589 HG22 THR 74 1HG2 THR 74 34.725 4.159 -2.185
590 HG23 THR 74 2HG2 THR 74 34.011 5.125 -3.476
591 H VAL 75 H VAL 75 32.146 7.162 0.076
592 HA VAL 75 HA VAL 75 29.989 5.557 -0.636
593 HB VAL 75 HB VAL 75 30.054 7.689 1.504
594 HG11 VAL 75 1HG1 VAL 75 27.783 6.941 0.954
595 HG12 VAL 75 2HG1 VAL 75 28.274 5.268 1.231
596 HG13 VAL 75 3HG1 VAL 75 28.272 6.421 2.567
597 HG21 VAL 75 3HG2 VAL 75 31.528 5.291 1.254
598 HG22 VAL 75 1HG2 VAL 75 31.434 6.374 2.643
599 HG23 VAL 75 2HG2 VAL 75 30.307 5.026 2.499
600 H GLY 76 H GLY 76 30.319 9.079 -0.710
601 HA2 GLY 76 1HA GLY 76 27.678 9.772 -1.256
602 HA3 GLY 76 2HA GLY 76 29.082 10.691 -1.777
603 H ARG 77 H ARG 77 30.152 8.513 -3.401
604 HA ARG 77 HA ARG 77 28.784 9.114 -5.822
605 HB2 ARG 77 1HB ARG 77 31.305 8.349 -5.260
606 HB3 ARG 77 2HB ARG 77 30.633 6.800 -5.753
607 HG2 ARG 77 1HG ARG 77 29.742 8.272 -7.777
608 HG3 ARG 77 2HG ARG 77 31.153 9.239 -7.344
609 HD2 ARG 77 1HD ARG 77 32.481 7.084 -7.420
610 HD3 ARG 77 2HD ARG 77 31.063 6.346 -8.163
611 HE ARG 77 HE ARG 77 31.584 8.576 -9.670
612 HH11 ARG 77 2HH1 ARG 77 33.346 5.721 -8.743
613 HH12 ARG 77 1HH1 ARG 77 34.304 5.685 -10.186
614 HH21 ARG 77 2HH2 ARG 77 32.838 8.540 -11.574
615 HH22 ARG 77 1HH2 ARG 77 34.015 7.290 -11.795
616 H ASN 78 H ASN 78 28.747 6.424 -3.584
617 HA ASN 78 HA ASN 78 27.498 4.504 -5.194
618 HB2 ASN 78 1HB ASN 78 27.427 4.947 -2.206
619 HB3 ASN 78 2HB ASN 78 26.701 3.547 -2.990
620 HD21 ASN 78 2HD2 ASN 78 29.002 3.921 -1.098
621 HD22 ASN 78 1HD2 ASN 78 30.311 3.073 -1.840
622 H VAL 79 H VAL 79 26.221 7.246 -3.446
623 HA VAL 79 HA VAL 79 23.467 6.433 -3.963
624 HB VAL 79 HB VAL 79 22.893 8.555 -2.748
625 HG11 VAL 79 1HG1 VAL 79 24.686 6.674 -1.218
626 HG12 VAL 79 2HG1 VAL 79 23.383 7.667 -0.563
627 HG13 VAL 79 3HG1 VAL 79 23.012 6.333 -1.655
628 HG21 VAL 79 3HG2 VAL 79 24.969 9.769 -3.221
629 HG22 VAL 79 1HG2 VAL 79 24.649 9.681 -1.489
630 HG23 VAL 79 2HG2 VAL 79 25.863 8.628 -2.216
631 H GLY 80 H GLY 80 25.813 7.832 -5.733
632 HA2 GLY 80 1HA GLY 80 25.505 8.727 -7.886
633 HA3 GLY 80 2HA GLY 80 23.860 9.160 -7.447
634 H PHE 81 H PHE 81 25.752 10.122 -4.940
635 HA PHE 81 HA PHE 81 25.697 12.885 -5.863
636 HB2 PHE 81 1HB PHE 81 26.188 11.651 -3.149
637 HB3 PHE 81 2HB PHE 81 26.302 13.380 -3.462
638 HD1 PHE 81 HD1 PHE 81 23.992 13.611 -5.383
639 HD2 PHE 81 HD2 PHE 81 24.386 11.611 -1.646
640 HE1 PHE 81 HE1 PHE 81 21.570 13.838 -5.010
641 HE2 PHE 81 HE2 PHE 81 21.965 11.834 -1.268
642 HZ PHE 81 HZ PHE 81 20.554 12.947 -2.951
643 H ASP 82 H ASP 82 27.424 13.738 -6.793
644 HA ASP 82 HA ASP 82 30.021 12.499 -6.540
645 HB2 ASP 82 1HB ASP 82 30.741 14.106 -8.216
646 HB3 ASP 82 2HB ASP 82 29.214 13.380 -8.710
647 H ASP 83 H ASP 83 28.373 15.331 -5.335
648 HA ASP 83 HA ASP 83 30.799 16.489 -4.250
649 HB2 ASP 83 1HB ASP 83 27.900 17.291 -4.241
650 HB3 ASP 83 2HB ASP 83 29.067 18.101 -3.199
651 H GLN 84 H GLN 84 31.648 15.855 -2.391
652 HA GLN 84 HA GLN 84 30.427 14.019 -0.648
653 HB2 GLN 84 1HB GLN 84 32.858 14.265 -0.826
654 HB3 GLN 84 2HB GLN 84 32.755 15.880 -0.138
655 HG2 GLN 84 1HG GLN 84 31.655 14.699 1.876
656 HG3 GLN 84 2HG GLN 84 32.359 13.235 1.192
657 HE21 GLN 84 2HE2 GLN 84 33.368 16.590 1.784
658 HE22 GLN 84 1HE2 GLN 84 34.890 16.186 2.495
659 H LEU 85 H LEU 85 30.658 17.531 -0.584
660 HA LEU 85 HA LEU 85 29.634 17.875 2.037
661 HB2 LEU 85 1HB LEU 85 29.828 19.686 -0.352
662 HB3 LEU 85 2HB LEU 85 29.113 20.215 1.170
663 HG LEU 85 HG LEU 85 31.932 19.177 0.958
664 HD11 LEU 85 1HD1 LEU 85 32.051 21.053 -0.399
665 HD12 LEU 85 2HD1 LEU 85 32.456 21.691 1.194
666 HD13 LEU 85 3HD1 LEU 85 30.838 21.930 0.534
667 HD21 LEU 85 3HD2 LEU 85 31.416 19.098 3.186
668 HD22 LEU 85 1HD2 LEU 85 30.248 20.415 3.077
669 HD23 LEU 85 2HD2 LEU 85 31.976 20.766 3.057
670 H TYR 86 H TYR 86 28.152 17.529 -1.116
671 HA TYR 86 HA TYR 86 25.576 18.439 -0.514
672 HB2 TYR 86 1HB TYR 86 26.455 17.902 -2.801
673 HB3 TYR 86 2HB TYR 86 26.278 16.194 -2.413
674 HD1 TYR 86 HD2 TYR 86 23.919 15.386 -1.753
675 HD2 TYR 86 HD1 TYR 86 24.666 19.086 -3.716
676 HE1 TYR 86 HE2 TYR 86 21.578 15.453 -2.506
677 HE2 TYR 86 HE1 TYR 86 22.328 19.164 -4.473
678 HH TYR 86 HH TYR 86 20.337 18.185 -4.406
679 H PHE 87 H PHE 87 26.959 15.173 -0.305
680 HA PHE 87 HA PHE 87 24.604 13.926 0.639
681 HB2 PHE 87 1HB PHE 87 26.318 12.561 -0.331
682 HB3 PHE 87 2HB PHE 87 27.514 13.140 0.825
683 HD1 PHE 87 HD1 PHE 87 24.231 11.376 0.738
684 HD2 PHE 87 HD2 PHE 87 28.008 11.831 2.648
685 HE1 PHE 87 HE1 PHE 87 23.705 9.484 2.221
686 HE2 PHE 87 HE2 PHE 87 27.488 9.939 4.133
687 HZ PHE 87 HZ PHE 87 25.335 8.763 3.920
688 H SER 88 H SER 88 27.322 15.469 2.256
689 HA SER 88 HA SER 88 26.690 14.643 4.882
690 HB2 SER 88 1HB SER 88 28.215 17.063 3.891
691 HB3 SER 88 2HB SER 88 28.142 16.556 5.579
692 HG SER 88 HG SER 88 29.131 14.604 4.970
693 H ARG 89 H ARG 89 25.684 17.392 2.927
694 HA ARG 89 HA ARG 89 24.419 18.864 4.968
695 HB2 ARG 89 1HB ARG 89 24.167 18.790 1.980
696 HB3 ARG 89 2HB ARG 89 23.047 19.753 2.935
697 HG2 ARG 89 1HG ARG 89 24.871 21.043 3.847
698 HG3 ARG 89 2HG ARG 89 26.044 20.025 3.009
699 HD2 ARG 89 1HD ARG 89 25.701 22.119 1.814
700 HD3 ARG 89 2HD ARG 89 25.135 20.750 0.858
701 HE ARG 89 HE ARG 89 22.949 21.702 2.270
702 HH11 ARG 89 2HH1 ARG 89 25.157 22.860 -0.160
703 HH12 ARG 89 1HH1 ARG 89 24.003 23.931 -0.884
704 HH21 ARG 89 2HH2 ARG 89 21.422 23.109 1.326
705 HH22 ARG 89 1HH2 ARG 89 21.879 24.073 -0.037
706 H VAL 90 H VAL 90 23.092 16.567 2.593
707 HA VAL 90 HA VAL 90 20.450 16.656 3.642
708 HB VAL 90 HB VAL 90 21.745 14.537 1.921
709 HG11 VAL 90 1HG1 VAL 90 19.849 13.395 2.071
710 HG12 VAL 90 2HG1 VAL 90 19.228 14.580 3.222
711 HG13 VAL 90 3HG1 VAL 90 18.945 14.795 1.494
712 HG21 VAL 90 3HG2 VAL 90 21.870 16.546 0.711
713 HG22 VAL 90 1HG2 VAL 90 20.412 15.751 0.116
714 HG23 VAL 90 2HG2 VAL 90 20.284 17.080 1.268
715 H PHE 91 H PHE 91 23.171 14.426 4.052
716 HA PHE 91 HA PHE 91 21.815 12.535 5.642
717 HB2 PHE 91 1HB PHE 91 23.928 11.994 4.566
718 HB3 PHE 91 2HB PHE 91 24.758 13.224 5.514
719 HD1 PHE 91 HD2 PHE 91 25.123 12.894 7.923
720 HD2 PHE 91 HD1 PHE 91 23.424 9.855 5.474
721 HE1 PHE 91 HE2 PHE 91 25.599 11.226 9.668
722 HE2 PHE 91 HE1 PHE 91 23.896 8.182 7.216
723 HZ PHE 91 HZ PHE 91 24.986 8.867 9.316
724 H LYS 92 H LYS 92 23.532 15.501 6.417
725 HA LYS 92 HA LYS 92 23.740 15.206 9.184
726 HB2 LYS 92 1HB LYS 92 24.896 16.989 8.036
727 HB3 LYS 92 2HB LYS 92 23.373 17.695 7.510
728 HG2 LYS 92 1HG LYS 92 22.808 18.135 9.878
729 HG3 LYS 92 2HG LYS 92 24.402 17.532 10.335
730 HD2 LYS 92 1HD LYS 92 25.480 19.290 9.092
731 HD3 LYS 92 2HD LYS 92 23.931 19.835 8.444
732 HE2 LYS 92 1HE LYS 92 24.267 21.336 10.159
733 HE3 LYS 92 2HE LYS 92 23.293 20.103 10.957
734 HZ1 LYS 92 3HZ LYS 92 25.592 19.113 11.557
735 HZ2 LYS 92 1HZ LYS 92 24.993 20.422 12.447
736 HZ3 LYS 92 2HZ LYS 92 26.162 20.676 11.252
737 H LYS 93 H LYS 93 21.129 16.639 7.247
738 HA LYS 93 HA LYS 93 19.486 17.180 9.530
739 HB2 LYS 93 1HB LYS 93 18.050 18.201 8.070
740 HB3 LYS 93 2HB LYS 93 19.515 18.241 7.098
741 HG2 LYS 93 1HG LYS 93 18.619 15.931 6.230
742 HG3 LYS 93 2HG LYS 93 17.072 16.576 6.783
743 HD2 LYS 93 1HD LYS 93 17.351 18.530 5.375
744 HD3 LYS 93 2HD LYS 93 18.952 17.974 4.879
745 HE2 LYS 93 1HE LYS 93 17.693 15.851 4.090
746 HE3 LYS 93 2HE LYS 93 16.259 16.872 4.171
747 HZ1 LYS 93 3HZ LYS 93 16.805 17.802 2.252
748 HZ2 LYS 93 1HZ LYS 93 18.090 16.710 2.105
749 HZ3 LYS 93 2HZ LYS 93 18.343 18.222 2.819
750 H CYS 94 H CYS 94 19.974 14.488 7.416
751 HA CYS 94 HA CYS 94 17.551 13.146 7.625
752 HB2 CYS 94 1HB CYS 94 19.437 12.470 6.152
753 HB3 CYS 94 2HB CYS 94 20.305 11.897 7.571
754 HG CYS 94 HG CYS 94 17.278 10.635 6.601
755 H THR 95 H THR 95 20.403 12.913 9.738
756 HA THR 95 HA THR 95 18.712 11.581 11.748
757 HB THR 95 HB THR 95 20.671 10.604 12.698
758 HG1 THR 95 HG1 THR 95 22.744 11.166 12.010
759 HG21 THR 95 3HG2 THR 95 20.827 10.464 9.686
760 HG22 THR 95 1HG2 THR 95 19.848 9.438 10.734
761 HG23 THR 95 2HG2 THR 95 21.608 9.336 10.794
762 H GLY 96 H GLY 96 20.152 14.508 10.990
763 HA2 GLY 96 1HA GLY 96 19.838 16.455 12.303
764 HA3 GLY 96 2HA GLY 96 19.754 15.443 13.738
765 H ALA 97 H ALA 97 22.272 14.176 12.196
766 HA ALA 97 HA ALA 97 24.228 16.167 13.098
767 HB1 ALA 97 1HB ALA 97 24.833 13.337 13.736
768 HB2 ALA 97 2HB ALA 97 25.281 14.815 14.589
769 HB3 ALA 97 3HB ALA 97 23.650 14.164 14.750
770 H SER 98 H SER 98 26.225 16.092 12.051
771 HA SER 98 HA SER 98 26.181 15.188 9.378
772 HB2 SER 98 1HB SER 98 28.836 15.639 9.862
773 HB3 SER 98 2HB SER 98 27.669 16.893 9.444
774 HG SER 98 HG SER 98 28.736 16.215 11.954
775 HA PRO 99 HA PRO 99 27.769 11.102 9.502
776 HB2 PRO 99 1HB PRO 99 29.511 11.068 7.420
777 HB3 PRO 99 2HB PRO 99 27.758 11.120 7.204
778 HG2 PRO 99 1HG PRO 99 29.749 13.352 7.081
779 HG3 PRO 99 2HG PRO 99 28.370 13.024 6.017
780 HD2 PRO 99 1HD PRO 99 28.279 14.877 7.989
781 HD3 PRO 99 2HD PRO 99 26.853 13.945 7.488
782 H SER 100 H SER 100 30.179 13.672 9.381
783 HA SER 100 HA SER 100 32.407 12.078 10.099
784 HB2 SER 100 1HB SER 100 33.380 14.352 10.797
785 HB3 SER 100 2HB SER 100 32.912 14.161 9.107
786 HG SER 100 HG SER 100 32.047 15.959 10.858
787 H GLU 101 H GLU 101 29.966 13.790 11.945
788 HA GLU 101 HA GLU 101 31.288 13.506 14.466
789 HB2 GLU 101 1HB GLU 101 29.595 15.275 13.949
790 HB3 GLU 101 2HB GLU 101 28.358 14.025 13.939
791 HG2 GLU 101 1HG GLU 101 28.104 14.667 16.076
792 HG3 GLU 101 2HG GLU 101 29.439 13.546 16.338
793 H PHE 102 H PHE 102 28.579 11.840 12.882
794 HA PHE 102 HA PHE 102 27.989 10.040 14.932
795 HB2 PHE 102 1HB PHE 102 26.744 10.532 12.697
796 HB3 PHE 102 2HB PHE 102 27.767 9.257 12.042
797 HD1 PHE 102 HD1 PHE 102 27.498 6.955 12.756
798 HD2 PHE 102 HD2 PHE 102 24.993 10.042 14.274
799 HE1 PHE 102 HE1 PHE 102 25.929 5.260 13.602
800 HE2 PHE 102 HE2 PHE 102 23.419 8.352 15.123
801 HZ PHE 102 HZ PHE 102 23.886 5.958 14.789
802 H ARG 103 H ARG 103 30.379 9.885 12.351
803 HA ARG 103 HA ARG 103 31.142 7.208 12.638
804 HB2 ARG 103 1HB ARG 103 31.840 9.165 10.938
805 HB3 ARG 103 2HB ARG 103 33.249 9.195 11.991
806 HG2 ARG 103 1HG ARG 103 33.688 7.763 10.118
807 HG3 ARG 103 2HG ARG 103 33.563 6.780 11.578
808 HD2 ARG 103 1HD ARG 103 31.785 5.665 10.804
809 HD3 ARG 103 2HD ARG 103 31.013 7.137 10.214
810 HE ARG 103 HE ARG 103 32.539 5.269 8.687
811 HH11 ARG 103 2HH1 ARG 103 31.647 8.624 8.949
812 HH12 ARG 103 1HH1 ARG 103 31.876 8.951 7.263
813 HH21 ARG 103 2HH2 ARG 103 32.843 5.687 6.465
814 HH22 ARG 103 1HH2 ARG 103 32.555 7.280 5.851
815 H ALA 104 H ALA 104 32.257 10.127 14.291
816 HA ALA 104 HA ALA 104 34.285 8.776 15.793
817 HB1 ALA 104 1HB ALA 104 33.149 11.516 15.725
818 HB2 ALA 104 2HB ALA 104 34.000 11.013 17.186
819 HB3 ALA 104 3HB ALA 104 34.827 10.981 15.629
820 H GLY 105 H GLY 105 30.894 9.425 16.222
821 HA2 GLY 105 1HA GLY 105 29.469 8.341 17.721
822 HA3 GLY 105 2HA GLY 105 30.875 7.735 18.584
823 H CYS 106 H CYS 106 31.067 11.053 17.968
824 HA CYS 106 HA CYS 106 30.719 11.640 20.777
825 HB2 CYS 106 1HB CYS 106 32.546 12.592 19.250
826 HB3 CYS 106 2HB CYS 106 31.295 13.646 18.604
827 HG CYS 106 HG CYS 106 33.188 14.202 21.127
828 H GLU 107 H GLU 107 29.044 12.663 21.711
829 HA GLU 107 HA GLU 107 26.907 13.667 19.947
830 HB2 GLU 107 1HB GLU 107 26.484 11.490 21.265
831 HB3 GLU 107 2HB GLU 107 26.401 12.526 22.683
832 HG2 GLU 107 1HG GLU 107 24.487 13.623 21.917
833 HG3 GLU 107 2HG GLU 107 24.711 13.047 20.266
Start of MODEL 8
1 H1 MET 1 H MET 1 1.657 -1.028 0.065
2 HA MET 1 HA MET 1 2.208 0.805 -2.114
3 HB2 MET 1 1HB MET 1 3.805 -0.862 -0.685
4 HB3 MET 1 2HB MET 1 3.497 -1.851 -2.107
5 HG2 MET 1 1HG MET 1 4.915 -0.670 -3.326
6 HG3 MET 1 2HG MET 1 4.142 0.845 -2.867
7 HE1 MET 1 3HE MET 1 6.704 1.304 -3.542
8 HE2 MET 1 1HE MET 1 6.348 2.543 -2.337
9 HE3 MET 1 2HE MET 1 7.857 1.635 -2.248
10 H ASP 2 H ASP 2 1.367 0.666 -4.087
11 HA ASP 2 HA ASP 2 -0.487 -1.440 -4.721
12 HB2 ASP 2 1HB ASP 2 -0.299 1.192 -5.438
13 HB3 ASP 2 2HB ASP 2 0.294 0.388 -6.889
14 H ASN 3 H ASN 3 -0.345 -2.910 -6.438
15 HA ASN 3 HA ASN 3 2.073 -4.211 -6.788
16 HB2 ASN 3 1HB ASN 3 -0.434 -4.209 -8.467
17 HB3 ASN 3 2HB ASN 3 0.936 -5.259 -8.817
18 HD21 ASN 3 2HD2 ASN 3 -1.975 -5.188 -7.403
19 HD22 ASN 3 1HD2 ASN 3 -1.774 -6.428 -6.216
20 H ARG 4 H ARG 4 0.511 -1.820 -8.889
21 HA ARG 4 HA ARG 4 2.525 -1.898 -10.898
22 HB2 ARG 4 1HB ARG 4 0.449 0.208 -10.268
23 HB3 ARG 4 2HB ARG 4 1.454 0.193 -11.711
24 HG2 ARG 4 1HG ARG 4 0.320 -1.553 -12.655
25 HG3 ARG 4 2HG ARG 4 -0.184 -2.210 -11.097
26 HD2 ARG 4 1HD ARG 4 -1.218 0.465 -11.841
27 HD3 ARG 4 2HD ARG 4 -1.852 -0.918 -12.732
28 HE ARG 4 HE ARG 4 -1.899 -1.344 -9.911
29 HH11 ARG 4 2HH1 ARG 4 -3.569 0.204 -12.545
30 HH12 ARG 4 1HH1 ARG 4 -5.109 0.183 -11.752
31 HH21 ARG 4 2HH2 ARG 4 -3.922 -1.377 -8.857
32 HH22 ARG 4 1HH2 ARG 4 -5.309 -0.715 -9.654
33 H VAL 5 H VAL 5 1.921 0.176 -8.100
34 HA VAL 5 HA VAL 5 3.941 2.069 -8.599
35 HB VAL 5 HB VAL 5 2.806 1.183 -5.943
36 HG11 VAL 5 1HG1 VAL 5 4.971 2.917 -6.539
37 HG12 VAL 5 2HG1 VAL 5 3.627 3.901 -5.954
38 HG13 VAL 5 3HG1 VAL 5 4.240 2.569 -4.973
39 HG21 VAL 5 3HG2 VAL 5 1.023 2.501 -6.303
40 HG22 VAL 5 1HG2 VAL 5 1.984 3.750 -7.095
41 HG23 VAL 5 2HG2 VAL 5 1.451 2.336 -8.006
42 H ARG 6 H ARG 6 3.969 -1.019 -6.889
43 HA ARG 6 HA ARG 6 6.500 -0.848 -5.724
44 HB2 ARG 6 1HB ARG 6 4.606 -2.653 -5.521
45 HB3 ARG 6 2HB ARG 6 5.493 -3.447 -6.815
46 HG2 ARG 6 1HG ARG 6 6.779 -4.362 -5.264
47 HG3 ARG 6 2HG ARG 6 7.427 -2.754 -4.933
48 HD2 ARG 6 1HD ARG 6 6.219 -2.514 -3.035
49 HD3 ARG 6 2HD ARG 6 4.834 -3.394 -3.679
50 HE ARG 6 HE ARG 6 6.971 -4.462 -2.112
51 HH11 ARG 6 2HH1 ARG 6 4.638 -5.215 -4.584
52 HH12 ARG 6 1HH1 ARG 6 4.602 -6.908 -4.217
53 HH21 ARG 6 2HH2 ARG 6 6.932 -6.689 -1.619
54 HH22 ARG 6 1HH2 ARG 6 5.906 -7.745 -2.529
55 H GLU 7 H GLU 7 5.521 -1.827 -8.967
56 HA GLU 7 HA GLU 7 8.005 -2.822 -9.832
57 HB2 GLU 7 1HB GLU 7 5.509 -1.891 -11.136
58 HB3 GLU 7 2HB GLU 7 6.953 -1.924 -12.138
59 HG2 GLU 7 1HG GLU 7 6.213 -4.021 -12.533
60 HG3 GLU 7 2HG GLU 7 7.169 -4.347 -11.089
61 H ALA 8 H ALA 8 6.642 0.428 -9.817
62 HA ALA 8 HA ALA 8 8.548 1.716 -11.400
63 HB1 ALA 8 1HB ALA 8 6.668 2.988 -10.935
64 HB2 ALA 8 2HB ALA 8 6.733 2.640 -9.207
65 HB3 ALA 8 3HB ALA 8 7.903 3.745 -9.928
66 H CYS 9 H CYS 9 8.605 0.820 -8.001
67 HA CYS 9 HA CYS 9 10.809 2.331 -7.180
68 HB2 CYS 9 1HB CYS 9 9.450 1.246 -5.532
69 HB3 CYS 9 2HB CYS 9 9.765 -0.338 -6.229
70 HG CYS 9 HG CYS 9 11.086 0.099 -3.706
71 H GLN 10 H GLN 10 10.610 -0.725 -8.886
72 HA GLN 10 HA GLN 10 13.308 -1.500 -8.591
73 HB2 GLN 10 1HB GLN 10 11.297 -2.163 -10.747
74 HB3 GLN 10 2HB GLN 10 12.862 -2.947 -10.577
75 HG2 GLN 10 1HG GLN 10 10.649 -2.978 -8.536
76 HG3 GLN 10 2HG GLN 10 11.066 -4.294 -9.633
77 HE21 GLN 10 2HE2 GLN 10 13.407 -4.987 -9.493
78 HE22 GLN 10 1HE2 GLN 10 14.075 -5.128 -7.906
79 H TYR 11 H TYR 11 11.626 0.372 -11.082
80 HA TYR 11 HA TYR 11 13.895 0.680 -12.763
81 HB2 TYR 11 1HB TYR 11 11.733 0.958 -13.741
82 HB3 TYR 11 2HB TYR 11 11.287 2.188 -12.564
83 HD1 TYR 11 HD1 TYR 11 13.517 1.496 -15.444
84 HD2 TYR 11 HD2 TYR 11 11.759 4.466 -12.956
85 HE1 TYR 11 HE1 TYR 11 14.303 3.244 -16.986
86 HE2 TYR 11 HE2 TYR 11 12.539 6.222 -14.491
87 HH TYR 11 HH TYR 11 14.154 5.422 -17.530
88 H ILE 12 H ILE 12 12.342 2.823 -10.389
89 HA ILE 12 HA ILE 12 14.117 4.982 -10.680
90 HB ILE 12 HB ILE 12 12.526 4.169 -8.244
91 HG12 ILE 12 1HG1 ILE 12 11.891 6.116 -10.473
92 HG13 ILE 12 2HG1 ILE 12 11.142 4.540 -10.244
93 HG21 ILE 12 1HG2 ILE 12 12.905 6.967 -8.401
94 HG22 ILE 12 2HG2 ILE 12 13.501 5.850 -7.175
95 HG23 ILE 12 3HG2 ILE 12 14.484 6.206 -8.595
96 HD11 ILE 12 3HD1 ILE 12 10.844 7.015 -8.589
97 HD12 ILE 12 1HD1 ILE 12 9.599 6.058 -9.391
98 HD13 ILE 12 2HD1 ILE 12 10.416 5.423 -7.962
99 H SER 13 H SER 13 14.170 2.176 -8.525
100 HA SER 13 HA SER 13 16.385 2.955 -6.977
101 HB2 SER 13 1HB SER 13 14.924 1.161 -6.242
102 HB3 SER 13 2HB SER 13 15.350 0.191 -7.652
103 HG SER 13 HG SER 13 16.765 -0.583 -6.273
104 H ASP 14 H ASP 14 16.142 1.110 -9.982
105 HA ASP 14 HA ASP 14 18.882 0.428 -10.159
106 HB2 ASP 14 1HB ASP 14 16.523 0.320 -11.928
107 HB3 ASP 14 2HB ASP 14 18.072 0.442 -12.757
108 H HIS 15 H HIS 15 17.058 3.262 -11.050
109 HA HIS 15 HA HIS 15 19.384 4.408 -12.413
110 HB2 HIS 15 1HB HIS 15 16.475 5.173 -12.300
111 HB3 HIS 15 2HB HIS 15 17.695 6.294 -12.896
112 HD1 HIS 15 HD1 HIS 15 17.295 6.321 -15.350
113 HD2 HIS 15 HD2 HIS 15 17.386 2.459 -13.821
114 HE1 HIS 15 HE1 HIS 15 17.176 4.802 -17.351
115 H LEU 16 H LEU 16 18.885 4.027 -9.409
116 HA LEU 16 HA LEU 16 18.517 6.493 -8.164
117 HB2 LEU 16 1HB LEU 16 18.565 4.280 -7.039
118 HB3 LEU 16 2HB LEU 16 20.316 4.256 -7.245
119 HG LEU 16 HG LEU 16 20.399 6.350 -5.846
120 HD11 LEU 16 1HD1 LEU 16 17.528 5.976 -5.999
121 HD12 LEU 16 2HD1 LEU 16 18.461 7.382 -5.488
122 HD13 LEU 16 3HD1 LEU 16 18.099 6.098 -4.335
123 HD21 LEU 16 3HD2 LEU 16 20.176 5.145 -3.742
124 HD22 LEU 16 1HD2 LEU 16 20.958 4.137 -4.961
125 HD23 LEU 16 2HD2 LEU 16 19.262 3.872 -4.553
126 H ALA 17 H ALA 17 21.235 5.229 -9.888
127 HA ALA 17 HA ALA 17 23.152 7.078 -8.797
128 HB1 ALA 17 1HB ALA 17 23.653 5.733 -11.393
129 HB2 ALA 17 2HB ALA 17 24.721 5.960 -10.007
130 HB3 ALA 17 3HB ALA 17 23.472 4.716 -9.963
131 H ASP 18 H ASP 18 20.795 7.134 -11.293
132 HA ASP 18 HA ASP 18 21.992 9.092 -12.968
133 HB2 ASP 18 1HB ASP 18 19.925 7.462 -13.335
134 HB3 ASP 18 2HB ASP 18 19.024 8.869 -12.775
135 H SER 19 H SER 19 21.430 11.309 -13.190
136 HA SER 19 HA SER 19 20.806 12.563 -10.624
137 HB2 SER 19 1HB SER 19 22.862 13.283 -11.754
138 HB3 SER 19 2HB SER 19 21.927 13.757 -13.172
139 HG SER 19 HG SER 19 21.290 14.830 -10.654
140 H ASN 20 H ASN 20 19.897 12.864 -14.054
141 HA ASN 20 HA ASN 20 17.638 14.542 -13.406
142 HB2 ASN 20 1HB ASN 20 18.628 13.344 -15.997
143 HB3 ASN 20 2HB ASN 20 17.176 14.334 -15.887
144 HD21 ASN 20 2HD2 ASN 20 19.675 14.792 -17.330
145 HD22 ASN 20 1HD2 ASN 20 20.278 16.308 -16.762
146 H PHE 21 H PHE 21 15.922 13.631 -12.479
147 HA PHE 21 HA PHE 21 15.217 10.876 -12.973
148 HB2 PHE 21 1HB PHE 21 14.986 11.872 -10.724
149 HB3 PHE 21 2HB PHE 21 13.777 12.987 -11.353
150 HD1 PHE 21 HD1 PHE 21 14.210 9.356 -12.015
151 HD2 PHE 21 HD2 PHE 21 11.813 12.409 -10.268
152 HE1 PHE 21 HE1 PHE 21 12.449 7.702 -11.548
153 HE2 PHE 21 HE2 PHE 21 10.049 10.759 -9.797
154 HZ PHE 21 HZ PHE 21 10.366 8.402 -10.436
155 H ASP 22 H ASP 22 13.642 10.117 -14.263
156 HA ASP 22 HA ASP 22 12.010 12.097 -15.714
157 HB2 ASP 22 1HB ASP 22 13.830 10.435 -16.840
158 HB3 ASP 22 2HB ASP 22 12.389 9.424 -16.922
159 H ILE 23 H ILE 23 10.195 12.065 -14.445
160 HA ILE 23 HA ILE 23 9.013 9.776 -13.327
161 HB ILE 23 HB ILE 23 8.514 12.127 -12.645
162 HG12 ILE 23 1HG1 ILE 23 5.871 10.950 -13.328
163 HG13 ILE 23 2HG1 ILE 23 6.981 9.939 -12.408
164 HG21 ILE 23 1HG2 ILE 23 6.957 13.458 -13.884
165 HG22 ILE 23 2HG2 ILE 23 8.266 12.990 -14.968
166 HG23 ILE 23 3HG2 ILE 23 6.710 12.165 -15.057
167 HD11 ILE 23 3HD1 ILE 23 6.551 12.717 -11.474
168 HD12 ILE 23 1HD1 ILE 23 5.248 11.552 -11.243
169 HD13 ILE 23 2HD1 ILE 23 6.841 11.240 -10.555
170 H ALA 24 H ALA 24 8.883 11.114 -16.520
171 HA ALA 24 HA ALA 24 6.481 9.909 -17.399
172 HB1 ALA 24 1HB ALA 24 7.588 11.773 -18.570
173 HB2 ALA 24 2HB ALA 24 8.886 10.678 -19.047
174 HB3 ALA 24 3HB ALA 24 7.246 10.411 -19.638
175 H SER 25 H SER 25 9.864 8.861 -17.497
176 HA SER 25 HA SER 25 9.402 6.484 -18.961
177 HB2 SER 25 1HB SER 25 11.648 7.161 -17.046
178 HB3 SER 25 2HB SER 25 11.652 5.818 -18.189
179 HG SER 25 HG SER 25 11.453 7.394 -19.869
180 H VAL 26 H VAL 26 9.167 7.299 -15.581
181 HA VAL 26 HA VAL 26 9.169 4.653 -14.554
182 HB VAL 26 HB VAL 26 7.970 7.168 -13.385
183 HG11 VAL 26 1HG1 VAL 26 8.343 4.406 -12.292
184 HG12 VAL 26 2HG1 VAL 26 8.353 5.808 -11.220
185 HG13 VAL 26 3HG1 VAL 26 6.932 5.459 -12.205
186 HG21 VAL 26 3HG2 VAL 26 10.474 5.968 -12.351
187 HG22 VAL 26 1HG2 VAL 26 10.561 6.806 -13.901
188 HG23 VAL 26 2HG2 VAL 26 9.990 7.660 -12.467
189 H ALA 27 H ALA 27 6.551 6.909 -15.389
190 HA ALA 27 HA ALA 27 4.432 5.180 -14.687
191 HB1 ALA 27 1HB ALA 27 4.659 7.803 -15.534
192 HB2 ALA 27 2HB ALA 27 3.771 7.011 -16.836
193 HB3 ALA 27 3HB ALA 27 3.161 6.941 -15.183
194 H GLN 28 H GLN 28 6.150 5.743 -17.726
195 HA GLN 28 HA GLN 28 4.498 4.190 -19.383
196 HB2 GLN 28 1HB GLN 28 6.127 5.744 -20.300
197 HB3 GLN 28 2HB GLN 28 7.448 4.808 -19.614
198 HG2 GLN 28 1HG GLN 28 7.183 4.422 -22.013
199 HG3 GLN 28 2HG GLN 28 6.942 2.952 -21.071
200 HE21 GLN 28 2HE2 GLN 28 5.760 1.982 -22.713
201 HE22 GLN 28 1HE2 GLN 28 4.144 2.460 -23.092
202 H HIS 29 H HIS 29 7.234 3.345 -17.336
203 HA HIS 29 HA HIS 29 7.696 0.749 -18.246
204 HB2 HIS 29 1HB HIS 29 9.278 1.723 -16.757
205 HB3 HIS 29 2HB HIS 29 8.050 2.007 -15.527
206 HD1 HIS 29 HD1 HIS 29 8.574 -1.277 -17.318
207 HD2 HIS 29 HD2 HIS 29 9.100 0.409 -13.558
208 HE1 HIS 29 HE1 HIS 29 9.191 -3.188 -15.805
209 H VAL 30 H VAL 30 5.280 2.009 -16.035
210 HA VAL 30 HA VAL 30 4.276 -0.690 -15.510
211 HB VAL 30 HB VAL 30 2.802 0.362 -13.858
212 HG11 VAL 30 1HG1 VAL 30 4.749 1.434 -12.459
213 HG12 VAL 30 2HG1 VAL 30 4.739 -0.294 -12.818
214 HG13 VAL 30 3HG1 VAL 30 5.747 0.799 -13.767
215 HG21 VAL 30 3HG2 VAL 30 4.173 2.960 -14.529
216 HG22 VAL 30 1HG2 VAL 30 2.564 2.518 -15.101
217 HG23 VAL 30 2HG2 VAL 30 2.866 2.702 -13.373
218 H CYS 31 H CYS 31 4.008 0.966 -18.071
219 HA CYS 31 HA CYS 31 2.445 1.414 -19.667
220 HB2 CYS 31 1HB CYS 31 2.171 -1.135 -19.052
221 HB3 CYS 31 2HB CYS 31 0.615 -0.601 -18.426
222 HG CYS 31 HG CYS 31 -0.612 -0.433 -20.685
223 H LEU 32 H LEU 32 2.301 3.058 -17.355
224 HA LEU 32 HA LEU 32 -0.530 3.815 -17.493
225 HB2 LEU 32 1HB LEU 32 0.057 2.560 -15.363
226 HB3 LEU 32 2HB LEU 32 1.048 3.954 -14.937
227 HG LEU 32 HG LEU 32 -0.934 5.374 -14.917
228 HD11 LEU 32 1HD1 LEU 32 -2.341 4.426 -16.548
229 HD12 LEU 32 2HD1 LEU 32 -3.178 4.201 -15.012
230 HD13 LEU 32 3HD1 LEU 32 -2.328 2.848 -15.758
231 HD21 LEU 32 3HD2 LEU 32 -2.136 3.507 -13.187
232 HD22 LEU 32 1HD2 LEU 32 -1.028 4.815 -12.773
233 HD23 LEU 32 2HD2 LEU 32 -0.399 3.206 -13.129
234 H SER 33 H SER 33 -0.895 6.078 -16.754
235 HA SER 33 HA SER 33 1.104 7.792 -17.933
236 HB2 SER 33 1HB SER 33 -1.708 8.107 -16.998
237 HB3 SER 33 2HB SER 33 -0.705 9.555 -17.072
238 HG SER 33 HG SER 33 -0.216 8.840 -19.290
239 HA PRO 34 HA PRO 34 3.115 9.267 -14.326
240 HB2 PRO 34 1HB PRO 34 3.433 11.906 -14.876
241 HB3 PRO 34 2HB PRO 34 4.352 10.637 -15.694
242 HG2 PRO 34 1HG PRO 34 1.923 12.116 -16.628
243 HG3 PRO 34 2HG PRO 34 3.387 11.685 -17.531
244 HD2 PRO 34 1HD PRO 34 1.081 10.280 -17.736
245 HD3 PRO 34 2HD PRO 34 2.679 9.522 -17.892
246 H SER 35 H SER 35 0.315 11.169 -15.360
247 HA SER 35 HA SER 35 -0.045 12.550 -12.914
248 HB2 SER 35 1HB SER 35 -2.477 12.749 -13.871
249 HB3 SER 35 2HB SER 35 -1.147 13.566 -14.692
250 HG SER 35 HG SER 35 -2.585 11.288 -15.451
251 H ARG 36 H ARG 36 -1.531 9.616 -14.251
252 HA ARG 36 HA ARG 36 -3.191 9.147 -11.982
253 HB2 ARG 36 1HB ARG 36 -3.353 8.249 -14.450
254 HB3 ARG 36 2HB ARG 36 -2.350 6.947 -13.826
255 HG2 ARG 36 1HG ARG 36 -4.363 6.018 -13.415
256 HG3 ARG 36 2HG ARG 36 -4.232 6.967 -11.934
257 HD2 ARG 36 1HD ARG 36 -6.416 7.292 -12.901
258 HD3 ARG 36 2HD ARG 36 -5.491 8.787 -13.030
259 HE ARG 36 HE ARG 36 -5.600 8.613 -15.307
260 HH11 ARG 36 2HH1 ARG 36 -6.405 5.535 -13.894
261 HH12 ARG 36 1HH1 ARG 36 -6.882 4.822 -15.399
262 HH21 ARG 36 2HH2 ARG 36 -6.225 7.685 -17.295
263 HH22 ARG 36 1HH2 ARG 36 -6.779 6.045 -17.333
264 H LEU 37 H LEU 37 -0.011 8.016 -12.998
265 HA LEU 37 HA LEU 37 0.288 6.074 -10.947
266 HB2 LEU 37 1HB LEU 37 1.642 5.839 -12.864
267 HB3 LEU 37 2HB LEU 37 2.227 7.497 -12.746
268 HG LEU 37 HG LEU 37 2.987 6.124 -10.375
269 HD11 LEU 37 1HD1 LEU 37 3.510 4.627 -12.928
270 HD12 LEU 37 2HD1 LEU 37 2.812 4.021 -11.427
271 HD13 LEU 37 3HD1 LEU 37 4.521 4.452 -11.493
272 HD21 LEU 37 3HD2 LEU 37 4.299 7.460 -12.690
273 HD22 LEU 37 1HD2 LEU 37 5.290 6.503 -11.589
274 HD23 LEU 37 2HD2 LEU 37 4.350 7.863 -10.973
275 H SER 38 H SER 38 1.368 9.436 -11.288
276 HA SER 38 HA SER 38 2.816 9.602 -8.895
277 HB2 SER 38 1HB SER 38 2.581 12.033 -9.125
278 HB3 SER 38 2HB SER 38 2.953 11.295 -10.683
279 HG SER 38 HG SER 38 0.909 12.844 -10.084
280 H HIS 39 H HIS 39 -0.601 10.179 -9.590
281 HA HIS 39 HA HIS 39 -1.355 11.208 -7.100
282 HB2 HIS 39 1HB HIS 39 -2.806 11.274 -9.086
283 HB3 HIS 39 2HB HIS 39 -2.993 9.525 -9.009
284 HD1 HIS 39 HD1 HIS 39 -4.427 12.640 -7.768
285 HD2 HIS 39 HD2 HIS 39 -4.437 8.643 -6.634
286 HE1 HIS 39 HE1 HIS 39 -6.342 12.403 -6.154
287 H LEU 40 H LEU 40 -1.358 7.854 -8.278
288 HA LEU 40 HA LEU 40 -2.279 6.757 -5.816
289 HB2 LEU 40 1HB LEU 40 -0.838 5.433 -8.109
290 HB3 LEU 40 2HB LEU 40 -1.660 4.595 -6.795
291 HG LEU 40 HG LEU 40 -2.945 6.295 -8.931
292 HD11 LEU 40 1HD1 LEU 40 -3.798 3.531 -8.587
293 HD12 LEU 40 2HD1 LEU 40 -2.108 3.687 -9.065
294 HD13 LEU 40 3HD1 LEU 40 -3.375 4.416 -10.053
295 HD21 LEU 40 3HD2 LEU 40 -4.392 6.681 -7.215
296 HD22 LEU 40 1HD2 LEU 40 -3.949 5.204 -6.359
297 HD23 LEU 40 2HD2 LEU 40 -5.016 5.124 -7.761
298 H PHE 41 H PHE 41 0.861 7.479 -7.163
299 HA PHE 41 HA PHE 41 2.465 5.914 -5.489
300 HB2 PHE 41 1HB PHE 41 2.938 7.652 -7.542
301 HB3 PHE 41 2HB PHE 41 3.548 8.567 -6.168
302 HD1 PHE 41 HD2 PHE 41 5.450 7.771 -4.886
303 HD2 PHE 41 HD1 PHE 41 4.010 5.626 -8.269
304 HE1 PHE 41 HE2 PHE 41 7.540 6.474 -4.949
305 HE2 PHE 41 HE1 PHE 41 6.097 4.325 -8.337
306 HZ PHE 41 HZ PHE 41 7.866 4.749 -6.677
307 H ARG 42 H ARG 42 1.390 9.285 -5.109
308 HA ARG 42 HA ARG 42 2.613 9.649 -2.576
309 HB2 ARG 42 1HB ARG 42 1.317 11.271 -4.425
310 HB3 ARG 42 2HB ARG 42 0.262 11.305 -3.019
311 HG2 ARG 42 1HG ARG 42 2.605 11.705 -1.799
312 HG3 ARG 42 2HG ARG 42 2.981 12.394 -3.380
313 HD2 ARG 42 1HD ARG 42 0.790 13.684 -3.142
314 HD3 ARG 42 2HD ARG 42 0.830 13.204 -1.446
315 HE ARG 42 HE ARG 42 3.295 14.321 -1.990
316 HH11 ARG 42 2HH1 ARG 42 -0.035 15.335 -2.052
317 HH12 ARG 42 1HH1 ARG 42 0.327 16.991 -1.695
318 HH21 ARG 42 2HH2 ARG 42 3.784 16.499 -1.520
319 HH22 ARG 42 1HH2 ARG 42 2.500 17.652 -1.393
320 H GLN 43 H GLN 43 -0.394 8.269 -3.607
321 HA GLN 43 HA GLN 43 -1.679 8.441 -1.043
322 HB2 GLN 43 1HB GLN 43 -2.824 8.296 -3.327
323 HB3 GLN 43 2HB GLN 43 -2.443 6.580 -3.285
324 HG2 GLN 43 1HG GLN 43 -3.879 7.821 -0.988
325 HG3 GLN 43 2HG GLN 43 -4.758 7.442 -2.468
326 HE21 GLN 43 2HE2 GLN 43 -4.192 5.156 -3.312
327 HE22 GLN 43 1HE2 GLN 43 -4.248 3.903 -2.125
328 H GLN 44 H GLN 44 0.083 5.976 -2.854
329 HA GLN 44 HA GLN 44 -0.327 3.966 -0.827
330 HB2 GLN 44 1HB GLN 44 1.453 4.006 -3.268
331 HB3 GLN 44 2HB GLN 44 1.225 2.611 -2.222
332 HG2 GLN 44 1HG GLN 44 -1.181 3.889 -3.399
333 HG3 GLN 44 2HG GLN 44 -0.146 2.922 -4.448
334 HE21 GLN 44 2HE2 GLN 44 -2.218 1.688 -4.546
335 HE22 GLN 44 1HE2 GLN 44 -2.456 0.444 -3.372
336 H LEU 45 H LEU 45 2.282 6.104 -1.862
337 HA LEU 45 HA LEU 45 4.072 5.058 0.174
338 HB2 LEU 45 1HB LEU 45 4.427 6.267 -2.305
339 HB3 LEU 45 2HB LEU 45 4.957 7.480 -1.141
340 HG LEU 45 HG LEU 45 6.004 4.686 -0.952
341 HD11 LEU 45 1HD1 LEU 45 6.271 5.375 -3.305
342 HD12 LEU 45 2HD1 LEU 45 7.810 5.219 -2.459
343 HD13 LEU 45 3HD1 LEU 45 7.129 6.817 -2.762
344 HD21 LEU 45 3HD2 LEU 45 6.353 6.639 0.727
345 HD22 LEU 45 1HD2 LEU 45 7.499 7.230 -0.477
346 HD23 LEU 45 2HD2 LEU 45 7.728 5.641 0.253
347 H GLY 46 H GLY 46 1.729 7.505 -0.138
348 HA2 GLY 46 1HA GLY 46 0.984 9.086 1.354
349 HA3 GLY 46 2HA GLY 46 2.049 8.358 2.547
350 H ILE 47 H ILE 47 3.755 9.220 -0.214
351 HA ILE 47 HA ILE 47 4.264 11.960 0.615
352 HB ILE 47 HB ILE 47 6.647 11.689 0.872
353 HG12 ILE 47 1HG1 ILE 47 6.146 8.741 0.402
354 HG13 ILE 47 2HG1 ILE 47 6.984 9.835 -0.693
355 HG21 ILE 47 1HG2 ILE 47 5.152 9.685 2.558
356 HG22 ILE 47 2HG2 ILE 47 6.711 10.405 2.952
357 HG23 ILE 47 3HG2 ILE 47 5.270 11.417 2.865
358 HD11 ILE 47 3HD1 ILE 47 7.885 8.823 1.980
359 HD12 ILE 47 1HD1 ILE 47 8.660 8.627 0.408
360 HD13 ILE 47 2HD1 ILE 47 8.638 10.208 1.190
361 H SER 48 H SER 48 5.985 12.959 -0.864
362 HA SER 48 HA SER 48 5.180 12.457 -3.572
363 HB2 SER 48 1HB SER 48 6.975 14.453 -2.229
364 HB3 SER 48 2HB SER 48 7.004 14.286 -3.984
365 HG SER 48 HG SER 48 5.231 15.391 -4.041
366 H VAL 49 H VAL 49 6.472 11.795 -5.299
367 HA VAL 49 HA VAL 49 8.190 9.666 -4.874
368 HB VAL 49 HB VAL 49 8.948 10.021 -7.238
369 HG11 VAL 49 1HG1 VAL 49 6.505 9.888 -8.150
370 HG12 VAL 49 2HG1 VAL 49 7.131 8.611 -7.106
371 HG13 VAL 49 3HG1 VAL 49 6.076 9.858 -6.439
372 HG21 VAL 49 3HG2 VAL 49 7.202 12.461 -6.972
373 HG22 VAL 49 1HG2 VAL 49 8.905 12.392 -7.426
374 HG23 VAL 49 2HG2 VAL 49 7.675 11.767 -8.523
375 H LEU 50 H LEU 50 8.953 13.083 -5.376
376 HA LEU 50 HA LEU 50 11.745 12.820 -5.541
377 HB2 LEU 50 1HB LEU 50 10.195 15.153 -4.431
378 HB3 LEU 50 2HB LEU 50 11.840 15.185 -5.062
379 HG LEU 50 HG LEU 50 9.311 14.738 -6.644
380 HD11 LEU 50 1HD1 LEU 50 11.310 16.982 -6.812
381 HD12 LEU 50 2HD1 LEU 50 9.817 17.067 -5.879
382 HD13 LEU 50 3HD1 LEU 50 9.752 16.858 -7.629
383 HD21 LEU 50 3HD2 LEU 50 10.663 13.556 -7.991
384 HD22 LEU 50 1HD2 LEU 50 12.130 14.185 -7.240
385 HD23 LEU 50 2HD2 LEU 50 11.288 15.138 -8.462
386 H SER 51 H SER 51 9.567 13.084 -2.798
387 HA SER 51 HA SER 51 11.620 13.450 -0.848
388 HB2 SER 51 1HB SER 51 9.190 14.095 -0.567
389 HB3 SER 51 2HB SER 51 8.834 12.380 -0.364
390 HG SER 51 HG SER 51 10.282 14.111 1.309
391 H TRP 52 H TRP 52 9.746 10.664 -1.981
392 HA TRP 52 HA TRP 52 10.732 8.766 -0.183
393 HB2 TRP 52 1HB TRP 52 8.823 8.247 -1.551
394 HB3 TRP 52 2HB TRP 52 9.758 8.463 -3.028
395 HD1 TRP 52 HD1 TRP 52 9.682 6.085 0.037
396 HE1 TRP 52 HE1 TRP 52 10.454 3.759 -0.748
397 HE3 TRP 52 HE3 TRP 52 10.833 7.207 -4.816
398 HZ2 TRP 52 HZ2 TRP 52 11.423 2.558 -3.111
399 HZ3 TRP 52 HZ3 TRP 52 11.678 5.413 -6.272
400 HH2 TRP 52 HH2 TRP 52 11.966 3.137 -5.436
401 H ARG 53 H ARG 53 11.963 9.790 -3.345
402 HA ARG 53 HA ARG 53 14.051 7.929 -3.547
403 HB2 ARG 53 1HB ARG 53 13.258 9.320 -5.425
404 HB3 ARG 53 2HB ARG 53 13.939 10.743 -4.647
405 HG2 ARG 53 1HG ARG 53 15.715 10.333 -5.937
406 HG3 ARG 53 2HG ARG 53 16.099 9.098 -4.736
407 HD2 ARG 53 1HD ARG 53 15.117 7.387 -6.056
408 HD3 ARG 53 2HD ARG 53 14.385 8.561 -7.149
409 HE ARG 53 HE ARG 53 17.098 7.591 -7.200
410 HH11 ARG 53 2HH1 ARG 53 14.927 10.138 -8.158
411 HH12 ARG 53 1HH1 ARG 53 15.917 10.663 -9.480
412 HH21 ARG 53 2HH2 ARG 53 18.411 8.273 -8.937
413 HH22 ARG 53 1HH2 ARG 53 17.898 9.601 -9.922
414 H GLU 54 H GLU 54 13.993 11.212 -2.196
415 HA GLU 54 HA GLU 54 16.735 11.299 -1.518
416 HB2 GLU 54 1HB GLU 54 14.956 13.206 -1.660
417 HB3 GLU 54 2HB GLU 54 14.650 12.804 0.024
418 HG2 GLU 54 1HG GLU 54 16.828 13.401 0.673
419 HG3 GLU 54 2HG GLU 54 17.401 13.433 -0.993
420 H ASP 55 H ASP 55 13.845 10.390 0.314
421 HA ASP 55 HA ASP 55 15.053 10.015 2.807
422 HB2 ASP 55 1HB ASP 55 12.516 9.882 1.947
423 HB3 ASP 55 2HB ASP 55 12.869 8.158 2.026
424 H GLN 56 H GLN 56 14.553 7.731 0.138
425 HA GLN 56 HA GLN 56 15.729 5.519 1.481
426 HB2 GLN 56 1HB GLN 56 15.021 6.096 -1.380
427 HB3 GLN 56 2HB GLN 56 15.909 4.640 -0.952
428 HG2 GLN 56 1HG GLN 56 13.211 5.422 0.129
429 HG3 GLN 56 2HG GLN 56 13.507 4.239 -1.143
430 HE21 GLN 56 2HE2 GLN 56 14.638 2.306 -0.597
431 HE22 GLN 56 1HE2 GLN 56 14.602 1.700 1.021
432 H ARG 57 H ARG 57 16.959 8.045 -0.622
433 HA ARG 57 HA ARG 57 19.446 6.959 -1.262
434 HB2 ARG 57 1HB ARG 57 18.357 9.729 -1.053
435 HB3 ARG 57 2HB ARG 57 20.097 9.529 -1.206
436 HG2 ARG 57 1HG ARG 57 19.877 8.445 -3.304
437 HG3 ARG 57 2HG ARG 57 18.129 8.296 -3.113
438 HD2 ARG 57 1HD ARG 57 17.766 10.555 -3.505
439 HD3 ARG 57 2HD ARG 57 19.425 10.991 -3.098
440 HE ARG 57 HE ARG 57 19.392 9.338 -5.386
441 HH11 ARG 57 2HH1 ARG 57 18.626 12.573 -4.351
442 HH12 ARG 57 1HH1 ARG 57 18.902 13.277 -5.909
443 HH21 ARG 57 2HH2 ARG 57 19.758 10.254 -7.443
444 HH22 ARG 57 1HH2 ARG 57 19.545 11.957 -7.668
445 H ILE 58 H ILE 58 18.437 8.848 1.557
446 HA ILE 58 HA ILE 58 21.037 8.947 2.726
447 HB ILE 58 HB ILE 58 18.336 9.348 4.017
448 HG12 ILE 58 1HG1 ILE 58 18.818 10.918 2.168
449 HG13 ILE 58 2HG1 ILE 58 18.767 11.730 3.729
450 HG21 ILE 58 1HG2 ILE 58 20.284 10.819 5.370
451 HG22 ILE 58 2HG2 ILE 58 19.445 9.378 5.942
452 HG23 ILE 58 3HG2 ILE 58 20.995 9.225 5.116
453 HD11 ILE 58 3HD1 ILE 58 20.772 11.884 1.819
454 HD12 ILE 58 1HD1 ILE 58 20.832 12.482 3.477
455 HD13 ILE 58 2HD1 ILE 58 21.441 10.871 3.097
456 H SER 59 H SER 59 18.157 6.951 3.291
457 HA SER 59 HA SER 59 19.150 5.471 5.451
458 HB2 SER 59 1HB SER 59 16.755 5.551 4.585
459 HB3 SER 59 2HB SER 59 17.258 4.385 3.362
460 HG SER 59 HG SER 59 16.524 3.168 5.018
461 H GLN 60 H GLN 60 19.435 4.977 1.970
462 HA GLN 60 HA GLN 60 20.697 2.429 2.163
463 HB2 GLN 60 1HB GLN 60 19.496 3.652 0.142
464 HB3 GLN 60 2HB GLN 60 21.132 4.198 -0.200
465 HG2 GLN 60 1HG GLN 60 20.986 2.288 -1.466
466 HG3 GLN 60 2HG GLN 60 21.745 1.692 0.009
467 HE21 GLN 60 2HE2 GLN 60 20.737 0.171 1.192
468 HE22 GLN 60 1HE2 GLN 60 19.195 -0.506 0.805
469 H ALA 61 H ALA 61 21.885 5.738 1.708
470 HA ALA 61 HA ALA 61 24.604 5.100 1.399
471 HB1 ALA 61 1HB ALA 61 23.293 7.346 1.065
472 HB2 ALA 61 2HB ALA 61 23.797 7.640 2.730
473 HB3 ALA 61 3HB ALA 61 25.007 7.356 1.479
474 H LYS 62 H LYS 62 22.729 5.963 4.290
475 HA LYS 62 HA LYS 62 24.917 5.815 6.086
476 HB2 LYS 62 1HB LYS 62 23.298 5.991 7.834
477 HB3 LYS 62 2HB LYS 62 22.747 7.008 6.510
478 HG2 LYS 62 1HG LYS 62 21.178 5.271 5.819
479 HG3 LYS 62 2HG LYS 62 21.736 4.242 7.141
480 HD2 LYS 62 1HD LYS 62 20.429 6.947 7.440
481 HD3 LYS 62 2HD LYS 62 19.647 5.388 7.711
482 HE2 LYS 62 1HE LYS 62 21.985 6.519 9.246
483 HE3 LYS 62 2HE LYS 62 20.326 6.372 9.823
484 HZ1 LYS 62 3HZ LYS 62 20.850 3.854 9.118
485 HZ2 LYS 62 1HZ LYS 62 21.096 4.461 10.679
486 HZ3 LYS 62 2HZ LYS 62 22.393 4.353 9.599
487 H LEU 63 H LEU 63 22.625 3.465 4.867
488 HA LEU 63 HA LEU 63 23.061 1.419 6.735
489 HB2 LEU 63 1HB LEU 63 21.216 1.422 5.129
490 HB3 LEU 63 2HB LEU 63 22.363 1.201 3.810
491 HG LEU 63 HG LEU 63 22.317 -0.841 5.970
492 HD11 LEU 63 1HD1 LEU 63 20.055 -0.946 5.738
493 HD12 LEU 63 2HD1 LEU 63 20.526 -1.955 4.371
494 HD13 LEU 63 3HD1 LEU 63 20.076 -0.270 4.109
495 HD21 LEU 63 3HD2 LEU 63 23.373 -0.521 3.326
496 HD22 LEU 63 1HD2 LEU 63 22.318 -1.933 3.382
497 HD23 LEU 63 2HD2 LEU 63 23.675 -1.801 4.502
498 H LEU 64 H LEU 64 24.597 2.013 3.581
499 HA LEU 64 HA LEU 64 26.409 -0.166 3.795
500 HB2 LEU 64 1HB LEU 64 26.710 2.310 2.109
501 HB3 LEU 64 2HB LEU 64 27.481 0.747 1.852
502 HG LEU 64 HG LEU 64 24.565 0.605 1.858
503 HD11 LEU 64 1HD1 LEU 64 25.637 1.864 -0.599
504 HD12 LEU 64 2HD1 LEU 64 25.333 2.913 0.785
505 HD13 LEU 64 3HD1 LEU 64 24.024 1.944 0.110
506 HD21 LEU 64 3HD2 LEU 64 25.443 -1.291 0.993
507 HD22 LEU 64 1HD2 LEU 64 26.888 -0.478 0.389
508 HD23 LEU 64 2HD2 LEU 64 25.374 -0.366 -0.508
509 H LEU 65 H LEU 65 26.634 3.286 4.508
510 HA LEU 65 HA LEU 65 29.390 3.360 5.073
511 HB2 LEU 65 1HB LEU 65 27.079 5.101 5.424
512 HB3 LEU 65 2HB LEU 65 28.280 5.281 6.702
513 HG LEU 65 HG LEU 65 28.996 5.467 3.786
514 HD11 LEU 65 1HD1 LEU 65 28.163 7.695 5.638
515 HD12 LEU 65 2HD1 LEU 65 27.292 7.140 4.209
516 HD13 LEU 65 3HD1 LEU 65 28.872 7.904 4.037
517 HD21 LEU 65 3HD2 LEU 65 30.820 5.072 5.373
518 HD22 LEU 65 1HD2 LEU 65 30.326 6.495 6.291
519 HD23 LEU 65 2HD2 LEU 65 30.928 6.675 4.643
520 H SER 66 H SER 66 26.676 2.228 6.890
521 HA SER 66 HA SER 66 28.156 2.198 9.398
522 HB2 SER 66 1HB SER 66 25.761 2.793 9.421
523 HB3 SER 66 2HB SER 66 25.365 1.203 8.770
524 HG SER 66 HG SER 66 25.614 1.852 11.287
525 H THR 67 H THR 67 27.242 0.065 6.818
526 HA THR 67 HA THR 67 28.057 -2.303 8.322
527 HB THR 67 HB THR 67 26.012 -2.207 6.743
528 HG1 THR 67 HG1 THR 67 27.846 -4.325 6.264
529 HG21 THR 67 3HG2 THR 67 26.288 -2.168 4.499
530 HG22 THR 67 1HG2 THR 67 27.797 -3.078 4.562
531 HG23 THR 67 2HG2 THR 67 27.796 -1.348 4.903
532 H THR 68 H THR 68 29.490 0.033 6.437
533 HA THR 68 HA THR 68 31.747 -1.753 5.834
534 HB THR 68 HB THR 68 32.108 -0.838 3.691
535 HG1 THR 68 HG1 THR 68 30.471 1.218 4.642
536 HG21 THR 68 3HG2 THR 68 30.410 -1.864 2.638
537 HG22 THR 68 1HG2 THR 68 29.202 -0.793 3.349
538 HG23 THR 68 2HG2 THR 68 29.788 -2.188 4.256
539 H ARG 69 H ARG 69 33.734 -0.347 5.208
540 HA ARG 69 HA ARG 69 33.862 1.934 7.070
541 HB2 ARG 69 1HB ARG 69 36.088 0.013 6.362
542 HB3 ARG 69 2HB ARG 69 36.200 1.360 7.487
543 HG2 ARG 69 1HG ARG 69 34.106 -0.668 8.004
544 HG3 ARG 69 2HG ARG 69 35.785 -1.136 8.282
545 HD2 ARG 69 1HD ARG 69 34.580 1.379 9.411
546 HD3 ARG 69 2HD ARG 69 34.542 -0.164 10.264
547 HE ARG 69 HE ARG 69 36.798 1.582 9.943
548 HH11 ARG 69 2HH1 ARG 69 35.788 -1.707 10.477
549 HH12 ARG 69 1HH1 ARG 69 37.267 -2.173 11.250
550 HH21 ARG 69 2HH2 ARG 69 38.750 0.981 10.959
551 HH22 ARG 69 1HH2 ARG 69 38.951 -0.643 11.525
552 H MET 70 H MET 70 33.386 1.631 4.057
553 HA MET 70 HA MET 70 35.632 2.712 2.720
554 HB2 MET 70 1HB MET 70 32.701 2.570 2.055
555 HB3 MET 70 2HB MET 70 33.844 3.383 0.994
556 HG2 MET 70 1HG MET 70 35.111 1.315 0.761
557 HG3 MET 70 2HG MET 70 33.981 0.498 1.840
558 HE1 MET 70 3HE MET 70 31.655 0.065 1.453
559 HE2 MET 70 1HE MET 70 30.967 1.504 0.701
560 HE3 MET 70 2HE MET 70 30.852 -0.056 -0.113
561 HA PRO 71 HA PRO 71 35.501 6.993 3.673
562 HB2 PRO 71 1HB PRO 71 36.214 8.110 1.303
563 HB3 PRO 71 2HB PRO 71 37.353 7.237 2.334
564 HG2 PRO 71 1HG PRO 71 35.885 6.285 -0.095
565 HG3 PRO 71 2HG PRO 71 37.577 6.022 0.364
566 HD2 PRO 71 1HD PRO 71 35.660 4.145 0.729
567 HD3 PRO 71 2HD PRO 71 37.048 4.318 1.823
568 H ILE 72 H ILE 72 34.428 9.021 3.228
569 HA ILE 72 HA ILE 72 31.705 8.728 2.582
570 HB ILE 72 HB ILE 72 33.314 11.281 2.717
571 HG12 ILE 72 1HG1 ILE 72 33.496 10.007 4.788
572 HG13 ILE 72 2HG1 ILE 72 32.470 11.415 5.038
573 HG21 ILE 72 1HG2 ILE 72 31.434 12.233 1.996
574 HG22 ILE 72 2HG2 ILE 72 30.527 10.730 2.149
575 HG23 ILE 72 3HG2 ILE 72 30.723 11.787 3.547
576 HD11 ILE 72 3HD1 ILE 72 30.519 9.809 4.591
577 HD12 ILE 72 1HD1 ILE 72 31.700 8.532 4.876
578 HD13 ILE 72 2HD1 ILE 72 31.354 9.712 6.141
579 H ALA 73 H ALA 73 34.484 9.656 0.681
580 HA ALA 73 HA ALA 73 33.120 10.820 -1.499
581 HB1 ALA 73 1HB ALA 73 35.393 11.292 -1.426
582 HB2 ALA 73 2HB ALA 73 35.836 9.605 -1.162
583 HB3 ALA 73 3HB ALA 73 35.269 10.130 -2.747
584 H THR 74 H THR 74 34.282 7.509 -0.935
585 HA THR 74 HA THR 74 33.412 6.460 -3.408
586 HB THR 74 HB THR 74 33.871 5.034 -0.781
587 HG1 THR 74 HG1 THR 74 35.900 4.544 -1.784
588 HG21 THR 74 3HG2 THR 74 33.608 3.946 -3.586
589 HG22 THR 74 1HG2 THR 74 32.490 3.678 -2.249
590 HG23 THR 74 2HG2 THR 74 34.122 3.013 -2.180
591 H VAL 75 H VAL 75 31.940 6.350 -0.166
592 HA VAL 75 HA VAL 75 29.629 4.939 -0.876
593 HB VAL 75 HB VAL 75 29.874 7.027 1.293
594 HG11 VAL 75 1HG1 VAL 75 27.638 5.662 0.402
595 HG12 VAL 75 2HG1 VAL 75 28.169 4.739 1.810
596 HG13 VAL 75 3HG1 VAL 75 27.824 6.462 1.962
597 HG21 VAL 75 3HG2 VAL 75 31.343 5.661 2.256
598 HG22 VAL 75 1HG2 VAL 75 30.052 4.468 2.398
599 HG23 VAL 75 2HG2 VAL 75 31.122 4.447 0.996
600 H GLY 76 H GLY 76 30.318 8.411 -0.881
601 HA2 GLY 76 1HA GLY 76 27.755 9.379 -1.381
602 HA3 GLY 76 2HA GLY 76 29.240 10.164 -1.896
603 H ARG 77 H ARG 77 30.073 7.933 -3.582
604 HA ARG 77 HA ARG 77 28.737 8.721 -5.971
605 HB2 ARG 77 1HB ARG 77 30.911 6.789 -5.282
606 HB3 ARG 77 2HB ARG 77 30.134 6.662 -6.855
607 HG2 ARG 77 1HG ARG 77 30.866 8.784 -7.516
608 HG3 ARG 77 2HG ARG 77 31.266 9.254 -5.863
609 HD2 ARG 77 1HD ARG 77 33.025 7.478 -5.871
610 HD3 ARG 77 2HD ARG 77 32.690 7.232 -7.584
611 HE ARG 77 HE ARG 77 33.257 9.960 -7.018
612 HH11 ARG 77 2HH1 ARG 77 34.747 6.845 -7.462
613 HH12 ARG 77 1HH1 ARG 77 36.261 7.500 -7.993
614 HH21 ARG 77 2HH2 ARG 77 35.245 10.834 -7.716
615 HH22 ARG 77 1HH2 ARG 77 36.543 9.769 -8.136
616 H ASN 78 H ASN 78 28.489 5.992 -3.795
617 HA ASN 78 HA ASN 78 27.062 4.225 -5.431
618 HB2 ASN 78 1HB ASN 78 27.655 4.493 -2.588
619 HB3 ASN 78 2HB ASN 78 26.064 3.795 -2.877
620 HD21 ASN 78 2HD2 ASN 78 28.849 2.808 -2.003
621 HD22 ASN 78 1HD2 ASN 78 29.058 1.364 -2.929
622 H VAL 79 H VAL 79 26.041 7.026 -3.607
623 HA VAL 79 HA VAL 79 23.223 6.469 -4.103
624 HB VAL 79 HB VAL 79 22.851 8.617 -2.861
625 HG11 VAL 79 1HG1 VAL 79 24.184 7.451 -0.739
626 HG12 VAL 79 2HG1 VAL 79 22.541 7.085 -1.270
627 HG13 VAL 79 3HG1 VAL 79 23.894 6.107 -1.843
628 HG21 VAL 79 3HG2 VAL 79 24.702 9.609 -1.646
629 HG22 VAL 79 1HG2 VAL 79 25.819 8.440 -2.349
630 HG23 VAL 79 2HG2 VAL 79 25.033 9.638 -3.378
631 H GLY 80 H GLY 80 25.666 7.690 -5.885
632 HA2 GLY 80 1HA GLY 80 25.380 8.609 -8.040
633 HA3 GLY 80 2HA GLY 80 23.807 9.218 -7.546
634 H PHE 81 H PHE 81 25.864 9.942 -5.093
635 HA PHE 81 HA PHE 81 26.094 12.701 -5.999
636 HB2 PHE 81 1HB PHE 81 26.527 11.401 -3.306
637 HB3 PHE 81 2HB PHE 81 26.809 13.111 -3.616
638 HD1 PHE 81 HD2 PHE 81 24.470 13.561 -5.481
639 HD2 PHE 81 HD1 PHE 81 24.785 11.565 -1.735
640 HE1 PHE 81 HE2 PHE 81 22.097 14.032 -5.035
641 HE2 PHE 81 HE1 PHE 81 22.412 12.032 -1.283
642 HZ PHE 81 HZ PHE 81 21.065 13.268 -2.933
643 H ASP 82 H ASP 82 27.880 13.368 -6.968
644 HA ASP 82 HA ASP 82 30.341 11.851 -6.735
645 HB2 ASP 82 1HB ASP 82 31.182 13.453 -8.452
646 HB3 ASP 82 2HB ASP 82 29.723 12.599 -8.945
647 H ASP 83 H ASP 83 29.010 14.895 -5.659
648 HA ASP 83 HA ASP 83 31.580 15.792 -4.623
649 HB2 ASP 83 1HB ASP 83 28.857 17.031 -4.863
650 HB3 ASP 83 2HB ASP 83 30.050 17.725 -3.769
651 H GLN 84 H GLN 84 32.258 15.192 -2.685
652 HA GLN 84 HA GLN 84 30.699 13.739 -0.852
653 HB2 GLN 84 1HB GLN 84 32.588 13.826 0.610
654 HB3 GLN 84 2HB GLN 84 33.200 13.683 -1.033
655 HG2 GLN 84 1HG GLN 84 34.568 15.334 -0.379
656 HG3 GLN 84 2HG GLN 84 33.188 16.355 -0.779
657 HE21 GLN 84 2HE2 GLN 84 34.817 14.685 1.853
658 HE22 GLN 84 1HE2 GLN 84 34.267 15.737 3.108
659 H LEU 85 H LEU 85 31.429 17.157 -1.134
660 HA LEU 85 HA LEU 85 30.466 17.918 1.425
661 HB2 LEU 85 1HB LEU 85 31.066 19.356 -1.123
662 HB3 LEU 85 2HB LEU 85 30.215 20.194 0.173
663 HG LEU 85 HG LEU 85 32.960 18.958 0.379
664 HD11 LEU 85 1HD1 LEU 85 32.342 21.248 -0.914
665 HD12 LEU 85 2HD1 LEU 85 33.867 20.963 -0.076
666 HD13 LEU 85 3HD1 LEU 85 32.573 21.851 0.728
667 HD21 LEU 85 3HD2 LEU 85 31.082 19.569 2.386
668 HD22 LEU 85 1HD2 LEU 85 32.312 20.832 2.439
669 HD23 LEU 85 2HD2 LEU 85 32.781 19.138 2.582
670 H TYR 86 H TYR 86 28.969 17.540 -1.730
671 HA TYR 86 HA TYR 86 26.519 18.806 -1.142
672 HB2 TYR 86 1HB TYR 86 27.276 18.271 -3.436
673 HB3 TYR 86 2HB TYR 86 27.049 16.559 -3.098
674 HD1 TYR 86 HD2 TYR 86 24.721 15.716 -2.617
675 HD2 TYR 86 HD1 TYR 86 25.468 19.629 -4.114
676 HE1 TYR 86 HE2 TYR 86 22.377 15.881 -3.342
677 HE2 TYR 86 HE1 TYR 86 23.126 19.804 -4.841
678 HH TYR 86 HH TYR 86 20.919 18.765 -4.210
679 H PHE 87 H PHE 87 27.488 15.388 -1.014
680 HA PHE 87 HA PHE 87 24.995 14.428 -0.085
681 HB2 PHE 87 1HB PHE 87 26.507 12.879 -1.107
682 HB3 PHE 87 2HB PHE 87 27.780 13.269 0.045
683 HD1 PHE 87 HD2 PHE 87 24.186 12.316 0.382
684 HD2 PHE 87 HD1 PHE 87 28.233 11.486 1.406
685 HE1 PHE 87 HE2 PHE 87 23.438 10.469 1.826
686 HE2 PHE 87 HE1 PHE 87 27.492 9.637 2.851
687 HZ PHE 87 HZ PHE 87 25.092 9.127 3.063
688 H SER 88 H SER 88 27.992 15.316 1.589
689 HA SER 88 HA SER 88 27.120 14.617 4.181
690 HB2 SER 88 1HB SER 88 29.301 16.384 3.113
691 HB3 SER 88 2HB SER 88 28.961 16.342 4.843
692 HG SER 88 HG SER 88 30.491 14.791 4.436
693 H ARG 89 H ARG 89 26.885 17.581 2.296
694 HA ARG 89 HA ARG 89 25.997 19.281 4.353
695 HB2 ARG 89 1HB ARG 89 25.882 19.320 1.373
696 HB3 ARG 89 2HB ARG 89 24.857 20.443 2.256
697 HG2 ARG 89 1HG ARG 89 26.661 21.592 3.147
698 HG3 ARG 89 2HG ARG 89 27.774 20.249 2.876
699 HD2 ARG 89 1HD ARG 89 27.308 20.648 0.377
700 HD3 ARG 89 2HD ARG 89 26.658 22.203 0.894
701 HE ARG 89 HE ARG 89 29.301 21.635 1.888
702 HH11 ARG 89 2HH1 ARG 89 27.432 22.991 -0.717
703 HH12 ARG 89 1HH1 ARG 89 28.713 24.014 -1.278
704 HH21 ARG 89 2HH2 ARG 89 30.996 22.976 1.159
705 HH22 ARG 89 1HH2 ARG 89 30.740 24.004 -0.210
706 H VAL 90 H VAL 90 24.161 17.430 1.928
707 HA VAL 90 HA VAL 90 21.615 18.159 2.966
708 HB VAL 90 HB VAL 90 22.367 15.822 1.204
709 HG11 VAL 90 1HG1 VAL 90 19.799 16.785 2.291
710 HG12 VAL 90 2HG1 VAL 90 19.811 16.371 0.575
711 HG13 VAL 90 3HG1 VAL 90 20.282 15.169 1.776
712 HG21 VAL 90 3HG2 VAL 90 20.947 17.990 -0.068
713 HG22 VAL 90 1HG2 VAL 90 22.452 18.553 0.659
714 HG23 VAL 90 2HG2 VAL 90 22.477 17.235 -0.513
715 H PHE 91 H PHE 91 23.632 15.254 3.284
716 HA PHE 91 HA PHE 91 21.849 13.760 4.851
717 HB2 PHE 91 1HB PHE 91 23.750 12.703 3.788
718 HB3 PHE 91 2HB PHE 91 24.869 13.689 4.723
719 HD1 PHE 91 HD1 PHE 91 25.225 13.254 7.097
720 HD2 PHE 91 HD2 PHE 91 22.680 10.786 4.742
721 HE1 PHE 91 HE1 PHE 91 25.291 11.523 8.845
722 HE2 PHE 91 HE2 PHE 91 22.740 9.052 6.487
723 HZ PHE 91 HZ PHE 91 24.047 9.420 8.542
724 H LYS 92 H LYS 92 24.247 16.182 5.701
725 HA LYS 92 HA LYS 92 24.358 15.790 8.459
726 HB2 LYS 92 1HB LYS 92 25.929 17.261 7.411
727 HB3 LYS 92 2HB LYS 92 24.644 18.296 6.801
728 HG2 LYS 92 1HG LYS 92 24.795 17.950 9.733
729 HG3 LYS 92 2HG LYS 92 26.083 18.883 8.966
730 HD2 LYS 92 1HD LYS 92 23.872 19.914 7.757
731 HD3 LYS 92 2HD LYS 92 23.250 19.542 9.367
732 HE2 LYS 92 1HE LYS 92 25.709 20.707 9.859
733 HE3 LYS 92 2HE LYS 92 25.069 21.639 8.506
734 HZ1 LYS 92 3HZ LYS 92 23.652 21.131 11.066
735 HZ2 LYS 92 1HZ LYS 92 23.060 22.045 9.772
736 HZ3 LYS 92 2HZ LYS 92 24.412 22.579 10.636
737 H LYS 93 H LYS 93 22.097 17.691 6.513
738 HA LYS 93 HA LYS 93 20.663 18.695 8.782
739 HB2 LYS 93 1HB LYS 93 19.839 18.594 5.874
740 HB3 LYS 93 2HB LYS 93 19.069 19.552 7.132
741 HG2 LYS 93 1HG LYS 93 20.919 20.989 7.319
742 HG3 LYS 93 2HG LYS 93 21.962 19.893 6.409
743 HD2 LYS 93 1HD LYS 93 20.795 20.353 4.377
744 HD3 LYS 93 2HD LYS 93 19.535 21.242 5.236
745 HE2 LYS 93 1HE LYS 93 22.364 22.149 5.476
746 HE3 LYS 93 2HE LYS 93 21.481 22.500 3.991
747 HZ1 LYS 93 3HZ LYS 93 19.689 23.375 5.602
748 HZ2 LYS 93 1HZ LYS 93 21.047 24.335 5.290
749 HZ3 LYS 93 2HZ LYS 93 20.949 23.449 6.727
750 H CYS 94 H CYS 94 20.513 15.853 6.812
751 HA CYS 94 HA CYS 94 17.870 15.065 7.149
752 HB2 CYS 94 1HB CYS 94 19.670 13.970 5.719
753 HB3 CYS 94 2HB CYS 94 20.209 13.160 7.185
754 HG CYS 94 HG CYS 94 17.480 12.104 7.538
755 H THR 95 H THR 95 20.682 14.337 9.203
756 HA THR 95 HA THR 95 18.824 13.472 11.317
757 HB THR 95 HB THR 95 20.617 12.209 12.297
758 HG1 THR 95 HG1 THR 95 22.303 13.197 10.222
759 HG21 THR 95 3HG2 THR 95 19.398 11.265 10.297
760 HG22 THR 95 1HG2 THR 95 20.976 10.550 10.628
761 HG23 THR 95 2HG2 THR 95 20.796 11.727 9.327
762 H GLY 96 H GLY 96 20.784 16.022 10.378
763 HA2 GLY 96 1HA GLY 96 20.892 18.055 11.589
764 HA3 GLY 96 2HA GLY 96 20.647 17.152 13.077
765 H ALA 97 H ALA 97 22.825 15.329 11.591
766 HA ALA 97 HA ALA 97 25.158 16.944 12.337
767 HB1 ALA 97 1HB ALA 97 25.200 14.093 13.149
768 HB2 ALA 97 2HB ALA 97 25.966 15.497 13.893
769 HB3 ALA 97 3HB ALA 97 24.242 15.207 14.126
770 H SER 98 H SER 98 27.074 16.411 11.272
771 HA SER 98 HA SER 98 26.786 15.375 8.663
772 HB2 SER 98 1HB SER 98 29.464 15.335 8.990
773 HB3 SER 98 2HB SER 98 28.555 16.812 8.674
774 HG SER 98 HG SER 98 29.423 17.448 10.481
775 HA PRO 99 HA PRO 99 27.537 11.069 9.026
776 HB2 PRO 99 1HB PRO 99 29.188 10.564 6.931
777 HB3 PRO 99 2HB PRO 99 27.475 10.952 6.733
778 HG2 PRO 99 1HG PRO 99 29.865 12.731 6.446
779 HG3 PRO 99 2HG PRO 99 28.423 12.621 5.420
780 HD2 PRO 99 1HD PRO 99 28.748 14.569 7.272
781 HD3 PRO 99 2HD PRO 99 27.155 13.911 6.848
782 H SER 100 H SER 100 30.404 13.096 8.718
783 HA SER 100 HA SER 100 32.290 11.137 9.508
784 HB2 SER 100 1HB SER 100 33.086 13.080 8.352
785 HB3 SER 100 2HB SER 100 32.376 14.159 9.553
786 HG SER 100 HG SER 100 34.373 14.054 10.286
787 H GLU 101 H GLU 101 30.279 13.405 11.272
788 HA GLU 101 HA GLU 101 31.577 13.010 13.791
789 HB2 GLU 101 1HB GLU 101 30.256 15.048 13.184
790 HB3 GLU 101 2HB GLU 101 28.797 14.071 13.268
791 HG2 GLU 101 1HG GLU 101 28.722 14.860 15.366
792 HG3 GLU 101 2HG GLU 101 29.837 13.531 15.679
793 H PHE 102 H PHE 102 28.555 11.828 12.343
794 HA PHE 102 HA PHE 102 27.689 10.294 14.517
795 HB2 PHE 102 1HB PHE 102 26.370 10.912 12.438
796 HB3 PHE 102 2HB PHE 102 27.213 9.603 11.617
797 HD1 PHE 102 HD2 PHE 102 24.962 10.362 14.457
798 HD2 PHE 102 HD1 PHE 102 26.483 7.391 11.816
799 HE1 PHE 102 HE2 PHE 102 23.285 8.767 15.292
800 HE2 PHE 102 HE1 PHE 102 24.807 5.791 12.645
801 HZ PHE 102 HZ PHE 102 23.207 6.478 14.386
802 H ARG 103 H ARG 103 29.675 9.395 11.715
803 HA ARG 103 HA ARG 103 29.953 6.676 12.304
804 HB2 ARG 103 1HB ARG 103 30.594 7.603 10.146
805 HB3 ARG 103 2HB ARG 103 31.871 8.545 10.903
806 HG2 ARG 103 1HG ARG 103 32.866 6.655 9.852
807 HG3 ARG 103 2HG ARG 103 32.945 6.410 11.598
808 HD2 ARG 103 1HD ARG 103 30.695 5.146 11.242
809 HD3 ARG 103 2HD ARG 103 31.228 5.048 9.564
810 HE ARG 103 HE ARG 103 33.372 4.159 10.964
811 HH11 ARG 103 2HH1 ARG 103 30.000 3.295 10.912
812 HH12 ARG 103 1HH1 ARG 103 30.284 1.638 11.331
813 HH21 ARG 103 2HH2 ARG 103 33.759 1.980 11.516
814 HH22 ARG 103 1HH2 ARG 103 32.423 0.891 11.675
815 H ALA 104 H ALA 104 31.827 9.474 13.372
816 HA ALA 104 HA ALA 104 33.859 8.023 14.700
817 HB1 ALA 104 1HB ALA 104 32.889 10.848 14.819
818 HB2 ALA 104 2HB ALA 104 34.079 10.266 15.985
819 HB3 ALA 104 3HB ALA 104 34.438 10.217 14.259
820 H GLY 105 H GLY 105 30.651 9.053 15.636
821 HA2 GLY 105 1HA GLY 105 29.391 8.065 17.358
822 HA3 GLY 105 2HA GLY 105 30.876 7.433 18.053
823 H CYS 106 H CYS 106 31.761 10.440 17.484
824 HA CYS 106 HA CYS 106 31.754 11.282 20.130
825 HB2 CYS 106 1HB CYS 106 33.211 12.186 18.313
826 HB3 CYS 106 2HB CYS 106 31.823 13.074 17.696
827 HG CYS 106 HG CYS 106 31.987 15.097 19.284
828 H GLU 107 H GLU 107 30.171 11.931 21.416
829 HA GLU 107 HA GLU 107 27.519 12.274 20.609
830 HB2 GLU 107 1HB GLU 107 27.109 13.127 22.859
831 HB3 GLU 107 2HB GLU 107 28.163 11.721 22.909
832 HG2 GLU 107 1HG GLU 107 29.400 14.422 22.839
833 HG3 GLU 107 2HG GLU 107 28.665 13.862 24.340
Start of MODEL 9
1 H1 MET 1 H MET 1 1.006 -1.199 0.414
2 HA MET 1 HA MET 1 1.824 0.391 -1.842
3 HB2 MET 1 1HB MET 1 3.227 -0.911 0.035
4 HB3 MET 1 2HB MET 1 3.218 -2.154 -1.209
5 HG2 MET 1 1HG MET 1 4.644 -1.034 -2.521
6 HG3 MET 1 2HG MET 1 3.906 0.526 -2.166
7 HE1 MET 1 3HE MET 1 6.236 2.179 0.127
8 HE2 MET 1 1HE MET 1 5.958 2.143 -1.615
9 HE3 MET 1 2HE MET 1 4.589 2.130 -0.503
10 H ASP 2 H ASP 2 0.867 0.093 -3.746
11 HA ASP 2 HA ASP 2 -0.277 -2.433 -4.508
12 HB2 ASP 2 1HB ASP 2 -0.944 0.080 -5.135
13 HB3 ASP 2 2HB ASP 2 0.094 -0.268 -6.515
14 H ASN 3 H ASN 3 0.355 -3.751 -6.239
15 HA ASN 3 HA ASN 3 3.056 -4.305 -6.482
16 HB2 ASN 3 1HB ASN 3 0.736 -4.956 -8.299
17 HB3 ASN 3 2HB ASN 3 2.362 -5.572 -8.581
18 HD21 ASN 3 2HD2 ASN 3 0.629 -7.461 -8.322
19 HD22 ASN 3 1HD2 ASN 3 0.659 -8.200 -6.760
20 H ARG 4 H ARG 4 0.984 -2.370 -8.607
21 HA ARG 4 HA ARG 4 2.877 -1.860 -10.610
22 HB2 ARG 4 1HB ARG 4 0.334 -0.602 -9.722
23 HB3 ARG 4 2HB ARG 4 1.383 0.354 -10.760
24 HG2 ARG 4 1HG ARG 4 0.153 -0.657 -12.364
25 HG3 ARG 4 2HG ARG 4 1.389 -1.901 -12.167
26 HD2 ARG 4 1HD ARG 4 -1.035 -2.006 -10.441
27 HD3 ARG 4 2HD ARG 4 -1.179 -2.496 -12.128
28 HE ARG 4 HE ARG 4 0.098 -3.943 -10.021
29 HH11 ARG 4 2HH1 ARG 4 0.127 -3.344 -13.450
30 HH12 ARG 4 1HH1 ARG 4 0.853 -4.868 -13.842
31 HH21 ARG 4 2HH2 ARG 4 1.054 -5.952 -10.524
32 HH22 ARG 4 1HH2 ARG 4 1.379 -6.351 -12.177
33 H VAL 5 H VAL 5 2.165 -0.175 -7.589
34 HA VAL 5 HA VAL 5 3.907 2.019 -8.050
35 HB VAL 5 HB VAL 5 2.985 0.931 -5.387
36 HG11 VAL 5 1HG1 VAL 5 3.386 3.812 -5.735
37 HG12 VAL 5 2HG1 VAL 5 3.872 2.747 -4.414
38 HG13 VAL 5 3HG1 VAL 5 4.858 2.851 -5.872
39 HG21 VAL 5 3HG2 VAL 5 1.112 2.435 -5.540
40 HG22 VAL 5 1HG2 VAL 5 1.686 3.055 -7.088
41 HG23 VAL 5 2HG2 VAL 5 1.118 1.390 -6.961
42 H ARG 6 H ARG 6 4.296 -1.116 -6.481
43 HA ARG 6 HA ARG 6 6.868 -0.621 -5.404
44 HB2 ARG 6 1HB ARG 6 5.100 -2.549 -4.973
45 HB3 ARG 6 2HB ARG 6 6.051 -3.378 -6.197
46 HG2 ARG 6 1HG ARG 6 7.301 -4.057 -4.478
47 HG3 ARG 6 2HG ARG 6 7.994 -2.435 -4.540
48 HD2 ARG 6 1HD ARG 6 6.645 -1.671 -2.783
49 HD3 ARG 6 2HD ARG 6 5.532 -3.030 -2.932
50 HE ARG 6 HE ARG 6 8.006 -2.966 -1.468
51 HH11 ARG 6 2HH1 ARG 6 5.663 -4.992 -3.056
52 HH12 ARG 6 1HH1 ARG 6 6.069 -6.404 -2.137
53 HH21 ARG 6 2HH2 ARG 6 8.550 -4.818 -0.252
54 HH22 ARG 6 1HH2 ARG 6 7.710 -6.304 -0.543
55 H GLU 7 H GLU 7 5.732 -1.810 -8.505
56 HA GLU 7 HA GLU 7 8.170 -2.797 -9.490
57 HB2 GLU 7 1HB GLU 7 5.595 -1.918 -10.683
58 HB3 GLU 7 2HB GLU 7 6.980 -2.021 -11.760
59 HG2 GLU 7 1HG GLU 7 5.906 -4.250 -10.047
60 HG3 GLU 7 2HG GLU 7 5.679 -4.073 -11.786
61 H ALA 8 H ALA 8 6.773 0.436 -9.486
62 HA ALA 8 HA ALA 8 8.551 1.692 -11.237
63 HB1 ALA 8 1HB ALA 8 6.440 2.474 -9.572
64 HB2 ALA 8 2HB ALA 8 7.824 3.456 -9.090
65 HB3 ALA 8 3HB ALA 8 7.286 3.455 -10.770
66 H CYS 9 H CYS 9 8.843 0.920 -7.818
67 HA CYS 9 HA CYS 9 11.087 2.474 -7.208
68 HB2 CYS 9 1HB CYS 9 9.825 1.442 -5.439
69 HB3 CYS 9 2HB CYS 9 10.148 -0.165 -6.077
70 HG CYS 9 HG CYS 9 13.077 0.950 -5.622
71 H GLN 10 H GLN 10 10.791 -0.650 -8.769
72 HA GLN 10 HA GLN 10 13.487 -1.439 -8.614
73 HB2 GLN 10 1HB GLN 10 11.689 -2.987 -9.219
74 HB3 GLN 10 2HB GLN 10 11.416 -2.102 -10.714
75 HG2 GLN 10 1HG GLN 10 12.670 -3.919 -11.394
76 HG3 GLN 10 2HG GLN 10 13.871 -2.638 -11.238
77 HE21 GLN 10 2HE2 GLN 10 12.474 -5.431 -9.618
78 HE22 GLN 10 1HE2 GLN 10 13.871 -5.815 -8.676
79 H TYR 11 H TYR 11 11.713 0.398 -11.070
80 HA TYR 11 HA TYR 11 13.914 0.662 -12.845
81 HB2 TYR 11 1HB TYR 11 11.717 0.932 -13.742
82 HB3 TYR 11 2HB TYR 11 11.322 2.186 -12.573
83 HD1 TYR 11 HD1 TYR 11 14.037 1.586 -15.082
84 HD2 TYR 11 HD2 TYR 11 11.183 4.298 -13.469
85 HE1 TYR 11 HE1 TYR 11 14.770 3.302 -16.685
86 HE2 TYR 11 HE2 TYR 11 11.907 6.021 -15.068
87 HH TYR 11 HH TYR 11 13.903 6.563 -16.410
88 H ILE 12 H ILE 12 12.469 2.859 -10.452
89 HA ILE 12 HA ILE 12 14.222 5.010 -10.856
90 HB ILE 12 HB ILE 12 12.790 4.227 -8.314
91 HG12 ILE 12 1HG1 ILE 12 11.921 6.306 -10.312
92 HG13 ILE 12 2HG1 ILE 12 11.439 4.621 -10.474
93 HG21 ILE 12 1HG2 ILE 12 12.961 6.878 -8.152
94 HG22 ILE 12 2HG2 ILE 12 14.209 5.809 -7.513
95 HG23 ILE 12 3HG2 ILE 12 14.425 6.573 -9.088
96 HD11 ILE 12 3HD1 ILE 12 10.756 5.072 -7.911
97 HD12 ILE 12 1HD1 ILE 12 10.523 6.681 -8.594
98 HD13 ILE 12 2HD1 ILE 12 9.668 5.299 -9.280
99 H SER 13 H SER 13 14.405 2.233 -8.670
100 HA SER 13 HA SER 13 16.641 2.995 -7.193
101 HB2 SER 13 1HB SER 13 16.891 0.655 -6.626
102 HB3 SER 13 2HB SER 13 15.171 1.034 -6.696
103 HG SER 13 HG SER 13 15.741 -0.930 -7.788
104 H ASP 14 H ASP 14 16.405 1.456 -10.350
105 HA ASP 14 HA ASP 14 19.157 0.852 -10.635
106 HB2 ASP 14 1HB ASP 14 17.265 -0.129 -11.990
107 HB3 ASP 14 2HB ASP 14 17.198 1.396 -12.869
108 H HIS 15 H HIS 15 17.291 3.741 -11.084
109 HA HIS 15 HA HIS 15 19.574 5.077 -12.360
110 HB2 HIS 15 1HB HIS 15 16.650 5.792 -12.165
111 HB3 HIS 15 2HB HIS 15 17.866 6.946 -12.706
112 HD1 HIS 15 HD1 HIS 15 17.908 7.085 -15.162
113 HD2 HIS 15 HD2 HIS 15 17.038 3.236 -13.863
114 HE1 HIS 15 HE1 HIS 15 17.626 5.717 -17.253
115 H LEU 16 H LEU 16 19.069 4.368 -9.419
116 HA LEU 16 HA LEU 16 18.612 6.664 -7.915
117 HB2 LEU 16 1HB LEU 16 18.793 4.310 -7.076
118 HB3 LEU 16 2HB LEU 16 20.543 4.462 -7.213
119 HG LEU 16 HG LEU 16 19.109 6.478 -5.568
120 HD11 LEU 16 1HD1 LEU 16 19.138 3.582 -5.017
121 HD12 LEU 16 2HD1 LEU 16 18.040 4.839 -4.449
122 HD13 LEU 16 3HD1 LEU 16 19.616 4.634 -3.684
123 HD21 LEU 16 3HD2 LEU 16 21.365 5.399 -4.297
124 HD22 LEU 16 1HD2 LEU 16 21.226 6.958 -5.109
125 HD23 LEU 16 2HD2 LEU 16 21.786 5.545 -6.004
126 H ALA 17 H ALA 17 21.419 5.664 -9.700
127 HA ALA 17 HA ALA 17 23.077 7.742 -8.490
128 HB1 ALA 17 1HB ALA 17 24.500 6.542 -10.574
129 HB2 ALA 17 2HB ALA 17 24.666 6.231 -8.845
130 HB3 ALA 17 3HB ALA 17 23.580 5.240 -9.819
131 H ASP 18 H ASP 18 21.131 7.184 -11.264
132 HA ASP 18 HA ASP 18 22.398 8.985 -13.056
133 HB2 ASP 18 1HB ASP 18 19.792 7.561 -12.934
134 HB3 ASP 18 2HB ASP 18 19.880 8.979 -13.976
135 H SER 19 H SER 19 21.810 11.097 -13.640
136 HA SER 19 HA SER 19 20.686 12.640 -11.433
137 HB2 SER 19 1HB SER 19 22.898 13.191 -12.658
138 HB3 SER 19 2HB SER 19 21.863 13.813 -13.943
139 HG SER 19 HG SER 19 22.522 14.947 -11.587
140 H ASN 20 H ASN 20 20.299 12.376 -14.963
141 HA ASN 20 HA ASN 20 17.961 14.006 -15.027
142 HB2 ASN 20 1HB ASN 20 19.067 12.070 -17.073
143 HB3 ASN 20 2HB ASN 20 17.760 13.212 -17.370
144 HD21 ASN 20 2HD2 ASN 20 20.299 13.026 -18.707
145 HD22 ASN 20 1HD2 ASN 20 21.101 14.538 -18.469
146 H PHE 21 H PHE 21 16.197 13.351 -13.959
147 HA PHE 21 HA PHE 21 15.338 10.553 -14.269
148 HB2 PHE 21 1HB PHE 21 15.765 11.302 -11.940
149 HB3 PHE 21 2HB PHE 21 14.526 12.537 -12.135
150 HD1 PHE 21 HD1 PHE 21 14.549 8.974 -13.203
151 HD2 PHE 21 HD2 PHE 21 12.812 11.947 -10.701
152 HE1 PHE 21 HE1 PHE 21 12.836 7.362 -12.482
153 HE2 PHE 21 HE2 PHE 21 11.097 10.340 -9.976
154 HZ PHE 21 HZ PHE 21 11.108 8.043 -10.865
155 H ASP 22 H ASP 22 13.556 10.137 -15.397
156 HA ASP 22 HA ASP 22 11.748 12.382 -16.016
157 HB2 ASP 22 1HB ASP 22 13.004 11.540 -17.977
158 HB3 ASP 22 2HB ASP 22 12.320 9.939 -17.708
159 H ILE 23 H ILE 23 9.992 12.198 -14.783
160 HA ILE 23 HA ILE 23 9.052 9.911 -13.524
161 HB ILE 23 HB ILE 23 8.357 12.252 -12.992
162 HG12 ILE 23 1HG1 ILE 23 6.021 11.651 -12.403
163 HG13 ILE 23 2HG1 ILE 23 6.142 10.242 -13.451
164 HG21 ILE 23 1HG2 ILE 23 6.655 13.349 -14.233
165 HG22 ILE 23 2HG2 ILE 23 7.890 12.850 -15.387
166 HG23 ILE 23 3HG2 ILE 23 6.391 11.931 -15.248
167 HD11 ILE 23 3HD1 ILE 23 6.452 9.836 -10.989
168 HD12 ILE 23 1HD1 ILE 23 7.723 9.213 -12.041
169 HD13 ILE 23 2HD1 ILE 23 7.984 10.699 -11.127
170 H ALA 24 H ALA 24 8.620 10.981 -16.792
171 HA ALA 24 HA ALA 24 6.299 9.593 -17.499
172 HB1 ALA 24 1HB ALA 24 7.096 11.169 -19.042
173 HB2 ALA 24 2HB ALA 24 8.704 10.444 -19.083
174 HB3 ALA 24 3HB ALA 24 7.341 9.607 -19.826
175 H SER 25 H SER 25 9.693 8.555 -17.538
176 HA SER 25 HA SER 25 9.251 6.014 -18.662
177 HB2 SER 25 1HB SER 25 11.459 6.992 -16.837
178 HB3 SER 25 2HB SER 25 11.483 5.447 -17.687
179 HG SER 25 HG SER 25 12.435 7.585 -18.633
180 H VAL 26 H VAL 26 8.928 7.233 -15.418
181 HA VAL 26 HA VAL 26 8.942 4.760 -14.045
182 HB VAL 26 HB VAL 26 7.565 7.339 -13.281
183 HG11 VAL 26 1HG1 VAL 26 8.335 4.967 -11.584
184 HG12 VAL 26 2HG1 VAL 26 7.621 6.472 -11.002
185 HG13 VAL 26 3HG1 VAL 26 6.695 5.406 -12.059
186 HG21 VAL 26 3HG2 VAL 26 9.999 6.647 -11.859
187 HG22 VAL 26 1HG2 VAL 26 10.270 6.856 -13.589
188 HG23 VAL 26 2HG2 VAL 26 9.542 8.157 -12.647
189 H ALA 27 H ALA 27 6.263 6.790 -15.219
190 HA ALA 27 HA ALA 27 4.217 4.994 -14.432
191 HB1 ALA 27 1HB ALA 27 4.333 7.574 -15.460
192 HB2 ALA 27 2HB ALA 27 3.473 6.640 -16.685
193 HB3 ALA 27 3HB ALA 27 2.882 6.670 -15.024
194 H GLN 28 H GLN 28 6.102 5.378 -17.373
195 HA GLN 28 HA GLN 28 4.556 3.727 -19.048
196 HB2 GLN 28 1HB GLN 28 6.202 5.199 -20.002
197 HB3 GLN 28 2HB GLN 28 7.495 4.419 -19.101
198 HG2 GLN 28 1HG GLN 28 7.176 2.376 -20.379
199 HG3 GLN 28 2HG GLN 28 5.849 3.126 -21.264
200 HE21 GLN 28 2HE2 GLN 28 8.384 2.016 -22.220
201 HE22 GLN 28 1HE2 GLN 28 9.162 3.292 -23.087
202 H HIS 29 H HIS 29 7.147 3.029 -16.771
203 HA HIS 29 HA HIS 29 7.680 0.386 -17.485
204 HB2 HIS 29 1HB HIS 29 9.152 1.459 -15.952
205 HB3 HIS 29 2HB HIS 29 7.840 1.812 -14.831
206 HD1 HIS 29 HD1 HIS 29 8.511 -1.572 -16.375
207 HD2 HIS 29 HD2 HIS 29 8.736 0.344 -12.695
208 HE1 HIS 29 HE1 HIS 29 9.020 -3.382 -14.705
209 H VAL 30 H VAL 30 5.113 1.759 -15.526
210 HA VAL 30 HA VAL 30 4.090 -0.904 -14.883
211 HB VAL 30 HB VAL 30 2.489 0.235 -13.435
212 HG11 VAL 30 1HG1 VAL 30 5.404 0.744 -13.186
213 HG12 VAL 30 2HG1 VAL 30 4.325 1.544 -12.042
214 HG13 VAL 30 3HG1 VAL 30 4.330 -0.216 -12.168
215 HG21 VAL 30 3HG2 VAL 30 3.804 2.810 -14.294
216 HG22 VAL 30 1HG2 VAL 30 2.226 2.255 -14.852
217 HG23 VAL 30 2HG2 VAL 30 2.477 2.626 -13.147
218 H CYS 31 H CYS 31 3.997 0.665 -17.562
219 HA CYS 31 HA CYS 31 2.555 0.974 -19.299
220 HB2 CYS 31 1HB CYS 31 1.332 -1.391 -17.883
221 HB3 CYS 31 2HB CYS 31 0.694 -0.780 -19.404
222 HG CYS 31 HG CYS 31 2.274 -2.143 -20.885
223 H LEU 32 H LEU 32 2.114 2.669 -17.063
224 HA LEU 32 HA LEU 32 -0.720 3.275 -17.493
225 HB2 LEU 32 1HB LEU 32 0.024 2.091 -15.204
226 HB3 LEU 32 2HB LEU 32 0.331 3.772 -14.773
227 HG LEU 32 HG LEU 32 -2.124 4.116 -15.638
228 HD11 LEU 32 1HD1 LEU 32 -2.443 1.336 -14.601
229 HD12 LEU 32 2HD1 LEU 32 -2.099 1.601 -16.310
230 HD13 LEU 32 3HD1 LEU 32 -3.543 2.304 -15.582
231 HD21 LEU 32 3HD2 LEU 32 -2.635 4.397 -13.471
232 HD22 LEU 32 1HD2 LEU 32 -0.942 3.988 -13.194
233 HD23 LEU 32 2HD2 LEU 32 -2.184 2.745 -13.046
234 H SER 33 H SER 33 -1.268 5.518 -16.809
235 HA SER 33 HA SER 33 0.656 7.341 -17.864
236 HB2 SER 33 1HB SER 33 -1.106 9.061 -17.074
237 HB3 SER 33 2HB SER 33 -1.573 7.917 -18.331
238 HG SER 33 HG SER 33 -2.289 7.958 -15.609
239 HA PRO 34 HA PRO 34 2.760 8.708 -14.266
240 HB2 PRO 34 1HB PRO 34 3.081 11.354 -14.782
241 HB3 PRO 34 2HB PRO 34 3.978 10.093 -15.636
242 HG2 PRO 34 1HG PRO 34 1.539 11.599 -16.500
243 HG3 PRO 34 2HG PRO 34 2.983 11.174 -17.438
244 HD2 PRO 34 1HD PRO 34 0.667 9.784 -17.621
245 HD3 PRO 34 2HD PRO 34 2.257 9.020 -17.818
246 H SER 35 H SER 35 -0.033 10.667 -15.219
247 HA SER 35 HA SER 35 -0.346 12.012 -12.755
248 HB2 SER 35 1HB SER 35 -2.720 12.380 -13.596
249 HB3 SER 35 2HB SER 35 -1.431 12.946 -14.657
250 HG SER 35 HG SER 35 -2.838 11.815 -15.926
251 H ARG 36 H ARG 36 -1.877 9.092 -14.074
252 HA ARG 36 HA ARG 36 -3.514 8.599 -11.815
253 HB2 ARG 36 1HB ARG 36 -2.538 6.779 -14.019
254 HB3 ARG 36 2HB ARG 36 -3.696 6.286 -12.790
255 HG2 ARG 36 1HG ARG 36 -4.133 8.623 -14.630
256 HG3 ARG 36 2HG ARG 36 -4.681 6.983 -14.983
257 HD2 ARG 36 1HD ARG 36 -6.253 7.002 -13.295
258 HD3 ARG 36 2HD ARG 36 -5.399 8.239 -12.374
259 HE ARG 36 HE ARG 36 -6.593 9.823 -13.498
260 HH11 ARG 36 2HH1 ARG 36 -6.684 6.858 -15.320
261 HH12 ARG 36 1HH1 ARG 36 -7.801 7.463 -16.498
262 HH21 ARG 36 2HH2 ARG 36 -8.064 10.631 -15.043
263 HH22 ARG 36 1HH2 ARG 36 -8.585 9.610 -16.340
264 H LEU 37 H LEU 37 -0.353 7.341 -12.817
265 HA LEU 37 HA LEU 37 -0.030 5.548 -10.663
266 HB2 LEU 37 1HB LEU 37 1.300 5.321 -12.646
267 HB3 LEU 37 2HB LEU 37 1.982 6.931 -12.426
268 HG LEU 37 HG LEU 37 2.907 5.924 -10.200
269 HD11 LEU 37 1HD1 LEU 37 2.363 3.792 -9.874
270 HD12 LEU 37 2HD1 LEU 37 3.480 3.406 -11.182
271 HD13 LEU 37 3HD1 LEU 37 1.762 3.612 -11.522
272 HD21 LEU 37 3HD2 LEU 37 4.455 4.723 -12.334
273 HD22 LEU 37 1HD2 LEU 37 4.858 6.065 -11.262
274 HD23 LEU 37 2HD2 LEU 37 3.934 6.360 -12.735
275 H SER 38 H SER 38 1.040 8.896 -11.143
276 HA SER 38 HA SER 38 2.486 9.171 -8.762
277 HB2 SER 38 1HB SER 38 1.032 11.186 -10.477
278 HB3 SER 38 2HB SER 38 1.979 11.652 -9.064
279 HG SER 38 HG SER 38 3.805 10.993 -10.052
280 H HIS 39 H HIS 39 -0.943 9.600 -9.460
281 HA HIS 39 HA HIS 39 -1.726 10.772 -7.045
282 HB2 HIS 39 1HB HIS 39 -3.186 10.628 -9.023
283 HB3 HIS 39 2HB HIS 39 -3.305 8.884 -8.806
284 HD1 HIS 39 HD1 HIS 39 -4.882 12.016 -7.843
285 HD2 HIS 39 HD2 HIS 39 -4.668 8.158 -6.316
286 HE1 HIS 39 HE1 HIS 39 -6.769 11.842 -6.189
287 H LEU 40 H LEU 40 -1.636 7.341 -7.981
288 HA LEU 40 HA LEU 40 -2.453 6.412 -5.409
289 HB2 LEU 40 1HB LEU 40 -1.000 4.836 -7.519
290 HB3 LEU 40 2HB LEU 40 -2.046 4.219 -6.242
291 HG LEU 40 HG LEU 40 -2.988 5.905 -8.559
292 HD11 LEU 40 1HD1 LEU 40 -3.126 4.080 -9.813
293 HD12 LEU 40 2HD1 LEU 40 -3.944 3.193 -8.527
294 HD13 LEU 40 3HD1 LEU 40 -2.182 3.230 -8.590
295 HD21 LEU 40 3HD2 LEU 40 -4.662 6.214 -7.065
296 HD22 LEU 40 1HD2 LEU 40 -4.263 4.761 -6.149
297 HD23 LEU 40 2HD2 LEU 40 -5.162 4.630 -7.660
298 H PHE 41 H PHE 41 0.614 7.072 -6.944
299 HA PHE 41 HA PHE 41 2.314 5.653 -5.237
300 HB2 PHE 41 1HB PHE 41 2.677 7.226 -7.429
301 HB3 PHE 41 2HB PHE 41 3.306 8.273 -6.160
302 HD1 PHE 41 HD1 PHE 41 5.266 7.628 -4.872
303 HD2 PHE 41 HD2 PHE 41 3.792 5.189 -8.034
304 HE1 PHE 41 HE1 PHE 41 7.391 6.387 -4.901
305 HE2 PHE 41 HE2 PHE 41 5.914 3.944 -8.068
306 HZ PHE 41 HZ PHE 41 7.717 4.542 -6.500
307 H ARG 42 H ARG 42 1.229 9.038 -5.053
308 HA ARG 42 HA ARG 42 2.548 9.597 -2.611
309 HB2 ARG 42 1HB ARG 42 1.839 11.363 -4.157
310 HB3 ARG 42 2HB ARG 42 0.154 10.951 -3.867
311 HG2 ARG 42 1HG ARG 42 0.183 11.817 -1.711
312 HG3 ARG 42 2HG ARG 42 1.944 11.760 -1.610
313 HD2 ARG 42 1HD ARG 42 2.142 13.572 -3.182
314 HD3 ARG 42 2HD ARG 42 0.403 13.563 -3.470
315 HE ARG 42 HE ARG 42 1.784 14.808 -1.294
316 HH11 ARG 42 2HH1 ARG 42 -1.220 13.348 -2.278
317 HH12 ARG 42 1HH1 ARG 42 -2.170 14.209 -1.113
318 HH21 ARG 42 2HH2 ARG 42 0.543 15.948 0.244
319 HH22 ARG 42 1HH2 ARG 42 -1.167 15.688 0.320
320 H GLN 43 H GLN 43 -0.475 8.094 -3.392
321 HA GLN 43 HA GLN 43 -1.633 8.422 -0.781
322 HB2 GLN 43 1HB GLN 43 -3.000 8.184 -2.842
323 HB3 GLN 43 2HB GLN 43 -2.429 6.529 -2.999
324 HG2 GLN 43 1HG GLN 43 -4.688 6.736 -2.003
325 HG3 GLN 43 2HG GLN 43 -3.529 5.879 -0.988
326 HE21 GLN 43 2HE2 GLN 43 -4.965 9.063 -1.524
327 HE22 GLN 43 1HE2 GLN 43 -4.922 9.557 0.130
328 H GLN 44 H GLN 44 0.122 5.898 -2.503
329 HA GLN 44 HA GLN 44 -0.175 3.996 -0.353
330 HB2 GLN 44 1HB GLN 44 1.449 3.966 -2.898
331 HB3 GLN 44 2HB GLN 44 1.447 2.645 -1.737
332 HG2 GLN 44 1HG GLN 44 -0.906 3.668 -3.307
333 HG3 GLN 44 2HG GLN 44 -0.055 2.143 -3.543
334 HE21 GLN 44 2HE2 GLN 44 -2.813 2.358 -3.108
335 HE22 GLN 44 1HE2 GLN 44 -3.186 1.608 -1.597
336 H LEU 45 H LEU 45 2.360 6.110 -1.612
337 HA LEU 45 HA LEU 45 4.222 5.241 0.444
338 HB2 LEU 45 1HB LEU 45 4.399 6.533 -2.116
339 HB3 LEU 45 2HB LEU 45 5.251 7.481 -0.899
340 HG LEU 45 HG LEU 45 6.213 4.999 -0.379
341 HD11 LEU 45 1HD1 LEU 45 6.819 4.036 -2.593
342 HD12 LEU 45 2HD1 LEU 45 5.666 5.143 -3.337
343 HD13 LEU 45 3HD1 LEU 45 5.103 3.918 -2.201
344 HD21 LEU 45 3HD2 LEU 45 8.091 5.805 -2.047
345 HD22 LEU 45 1HD2 LEU 45 7.791 6.644 -0.525
346 HD23 LEU 45 2HD2 LEU 45 7.141 7.291 -2.031
347 H GLY 46 H GLY 46 1.819 7.601 0.038
348 HA2 GLY 46 1HA GLY 46 1.099 9.294 1.415
349 HA3 GLY 46 2HA GLY 46 2.209 8.673 2.628
350 H ILE 47 H ILE 47 3.801 9.357 -0.257
351 HA ILE 47 HA ILE 47 4.316 12.148 0.388
352 HB ILE 47 HB ILE 47 6.705 11.915 0.534
353 HG12 ILE 47 1HG1 ILE 47 6.237 8.945 0.191
354 HG13 ILE 47 2HG1 ILE 47 6.984 10.016 -0.990
355 HG21 ILE 47 1HG2 ILE 47 5.383 9.918 2.365
356 HG22 ILE 47 2HG2 ILE 47 6.912 10.746 2.653
357 HG23 ILE 47 3HG2 ILE 47 5.409 11.665 2.603
358 HD11 ILE 47 3HD1 ILE 47 8.622 8.672 0.234
359 HD12 ILE 47 1HD1 ILE 47 8.849 10.401 0.497
360 HD13 ILE 47 2HD1 ILE 47 8.087 9.411 1.743
361 H SER 48 H SER 48 5.923 13.089 -1.241
362 HA SER 48 HA SER 48 4.971 12.428 -3.868
363 HB2 SER 48 1HB SER 48 5.577 14.768 -2.899
364 HB3 SER 48 2HB SER 48 7.230 14.339 -3.339
365 HG SER 48 HG SER 48 5.549 15.418 -4.915
366 H VAL 49 H VAL 49 6.213 11.755 -5.648
367 HA VAL 49 HA VAL 49 7.979 9.661 -5.221
368 HB VAL 49 HB VAL 49 7.898 11.379 -7.703
369 HG11 VAL 49 1HG1 VAL 49 9.762 9.777 -7.573
370 HG12 VAL 49 2HG1 VAL 49 8.602 8.468 -7.338
371 HG13 VAL 49 3HG1 VAL 49 8.620 9.371 -8.854
372 HG21 VAL 49 3HG2 VAL 49 5.646 10.770 -7.231
373 HG22 VAL 49 1HG2 VAL 49 6.222 9.680 -8.492
374 HG23 VAL 49 2HG2 VAL 49 6.112 9.118 -6.825
375 H LEU 50 H LEU 50 8.691 13.045 -6.027
376 HA LEU 50 HA LEU 50 11.481 12.775 -6.212
377 HB2 LEU 50 1HB LEU 50 9.582 15.020 -5.818
378 HB3 LEU 50 2HB LEU 50 11.278 15.313 -5.439
379 HG LEU 50 HG LEU 50 11.906 14.758 -7.721
380 HD11 LEU 50 1HD1 LEU 50 10.357 13.118 -8.377
381 HD12 LEU 50 2HD1 LEU 50 10.016 14.512 -9.401
382 HD13 LEU 50 3HD1 LEU 50 8.978 14.157 -8.020
383 HD21 LEU 50 3HD2 LEU 50 10.921 17.065 -6.947
384 HD22 LEU 50 1HD2 LEU 50 9.623 16.641 -8.064
385 HD23 LEU 50 2HD2 LEU 50 11.283 16.761 -8.647
386 H SER 51 H SER 51 9.342 13.127 -3.481
387 HA SER 51 HA SER 51 11.357 13.836 -1.588
388 HB2 SER 51 1HB SER 51 8.487 13.274 -1.557
389 HB3 SER 51 2HB SER 51 9.319 12.676 -0.122
390 HG SER 51 HG SER 51 9.315 15.326 -1.133
391 H TRP 52 H TRP 52 9.712 10.800 -2.414
392 HA TRP 52 HA TRP 52 10.954 9.170 -0.513
393 HB2 TRP 52 1HB TRP 52 9.046 8.334 -1.688
394 HB3 TRP 52 2HB TRP 52 9.838 8.544 -3.248
395 HD1 TRP 52 HD1 TRP 52 10.174 6.360 -0.066
396 HE1 TRP 52 HE1 TRP 52 11.166 4.089 -0.763
397 HE3 TRP 52 HE3 TRP 52 11.017 7.327 -5.015
398 HZ2 TRP 52 HZ2 TRP 52 12.173 2.870 -3.101
399 HZ3 TRP 52 HZ3 TRP 52 11.998 5.555 -6.412
400 HH2 TRP 52 HH2 TRP 52 12.564 3.373 -5.473
401 H ARG 53 H ARG 53 11.959 10.090 -3.773
402 HA ARG 53 HA ARG 53 14.142 8.375 -4.048
403 HB2 ARG 53 1HB ARG 53 13.005 10.158 -5.673
404 HB3 ARG 53 2HB ARG 53 14.358 11.140 -5.128
405 HG2 ARG 53 1HG ARG 53 14.998 8.399 -6.017
406 HG3 ARG 53 2HG ARG 53 14.472 9.536 -7.259
407 HD2 ARG 53 1HD ARG 53 16.512 10.461 -5.312
408 HD3 ARG 53 2HD ARG 53 17.018 9.296 -6.535
409 HE ARG 53 HE ARG 53 16.330 12.061 -6.947
410 HH11 ARG 53 2HH1 ARG 53 16.636 8.922 -8.421
411 HH12 ARG 53 1HH1 ARG 53 16.845 9.550 -10.022
412 HH21 ARG 53 2HH2 ARG 53 16.605 12.900 -9.050
413 HH22 ARG 53 1HH2 ARG 53 16.828 11.813 -10.379
414 H GLU 54 H GLU 54 13.994 11.664 -2.709
415 HA GLU 54 HA GLU 54 16.750 11.852 -2.110
416 HB2 GLU 54 1HB GLU 54 15.231 13.802 -2.280
417 HB3 GLU 54 2HB GLU 54 14.438 13.291 -0.797
418 HG2 GLU 54 1HG GLU 54 16.588 13.546 0.394
419 HG3 GLU 54 2HG GLU 54 17.301 14.166 -1.094
420 H ASP 55 H ASP 55 13.943 10.890 -0.174
421 HA ASP 55 HA ASP 55 15.306 10.545 2.263
422 HB2 ASP 55 1HB ASP 55 12.724 10.531 1.632
423 HB3 ASP 55 2HB ASP 55 12.986 8.789 1.605
424 H GLN 56 H GLN 56 14.753 8.384 -0.462
425 HA GLN 56 HA GLN 56 15.727 6.035 0.792
426 HB2 GLN 56 1HB GLN 56 14.977 6.862 -1.938
427 HB3 GLN 56 2HB GLN 56 16.170 5.573 -1.851
428 HG2 GLN 56 1HG GLN 56 13.460 5.556 -0.542
429 HG3 GLN 56 2HG GLN 56 13.906 4.696 -2.015
430 HE21 GLN 56 2HE2 GLN 56 13.702 4.549 1.332
431 HE22 GLN 56 1HE2 GLN 56 14.577 3.080 1.578
432 H ARG 57 H ARG 57 17.244 8.586 -1.102
433 HA ARG 57 HA ARG 57 19.736 7.363 -1.509
434 HB2 ARG 57 1HB ARG 57 18.853 10.235 -1.374
435 HB3 ARG 57 2HB ARG 57 20.543 9.812 -1.617
436 HG2 ARG 57 1HG ARG 57 20.070 8.736 -3.675
437 HG3 ARG 57 2HG ARG 57 18.331 8.810 -3.386
438 HD2 ARG 57 1HD ARG 57 18.398 10.657 -4.652
439 HD3 ARG 57 2HD ARG 57 19.040 11.436 -3.206
440 HE ARG 57 HE ARG 57 21.262 10.485 -4.384
441 HH11 ARG 57 2HH1 ARG 57 18.584 12.356 -5.588
442 HH12 ARG 57 1HH1 ARG 57 19.529 13.181 -6.783
443 HH21 ARG 57 2HH2 ARG 57 22.516 11.565 -5.953
444 HH22 ARG 57 1HH2 ARG 57 21.765 12.730 -6.991
445 H ILE 58 H ILE 58 18.531 9.382 1.137
446 HA ILE 58 HA ILE 58 20.995 9.492 2.547
447 HB ILE 58 HB ILE 58 18.198 9.845 3.632
448 HG12 ILE 58 1HG1 ILE 58 18.619 11.388 1.795
449 HG13 ILE 58 2HG1 ILE 58 18.630 12.262 3.323
450 HG21 ILE 58 1HG2 ILE 58 20.871 10.719 4.719
451 HG22 ILE 58 2HG2 ILE 58 19.302 11.142 5.401
452 HG23 ILE 58 3HG2 ILE 58 19.832 9.460 5.386
453 HD11 ILE 58 3HD1 ILE 58 20.699 11.992 1.329
454 HD12 ILE 58 1HD1 ILE 58 20.554 13.137 2.663
455 HD13 ILE 58 2HD1 ILE 58 21.273 11.549 2.937
456 H SER 59 H SER 59 18.102 7.462 2.871
457 HA SER 59 HA SER 59 19.017 5.999 5.111
458 HB2 SER 59 1HB SER 59 16.639 6.101 4.430
459 HB3 SER 59 2HB SER 59 17.023 5.153 2.993
460 HG SER 59 HG SER 59 16.815 4.365 5.647
461 H GLN 60 H GLN 60 19.498 5.655 1.670
462 HA GLN 60 HA GLN 60 20.470 2.989 1.709
463 HB2 GLN 60 1HB GLN 60 19.634 4.141 -0.328
464 HB3 GLN 60 2HB GLN 60 21.058 5.173 -0.296
465 HG2 GLN 60 1HG GLN 60 21.332 3.395 -1.908
466 HG3 GLN 60 2HG GLN 60 22.485 3.212 -0.587
467 HE21 GLN 60 2HE2 GLN 60 22.792 1.145 -0.203
468 HE22 GLN 60 1HE2 GLN 60 21.568 -0.072 -0.124
469 H ALA 61 H ALA 61 22.058 6.154 1.819
470 HA ALA 61 HA ALA 61 24.709 5.258 1.724
471 HB1 ALA 61 1HB ALA 61 23.677 7.665 1.622
472 HB2 ALA 61 2HB ALA 61 23.999 7.648 3.356
473 HB3 ALA 61 3HB ALA 61 25.320 7.415 2.212
474 H LYS 62 H LYS 62 22.579 5.866 4.499
475 HA LYS 62 HA LYS 62 24.531 5.167 6.453
476 HB2 LYS 62 1HB LYS 62 21.518 5.242 6.701
477 HB3 LYS 62 2HB LYS 62 22.661 5.202 8.036
478 HG2 LYS 62 1HG LYS 62 23.235 7.391 7.797
479 HG3 LYS 62 2HG LYS 62 22.920 7.400 6.060
480 HD2 LYS 62 1HD LYS 62 21.256 8.745 7.163
481 HD3 LYS 62 2HD LYS 62 20.490 7.277 6.551
482 HE2 LYS 62 1HE LYS 62 20.822 6.299 8.859
483 HE3 LYS 62 2HE LYS 62 21.266 7.921 9.387
484 HZ1 LYS 62 3HZ LYS 62 18.673 7.164 8.151
485 HZ2 LYS 62 1HZ LYS 62 19.101 8.713 8.680
486 HZ3 LYS 62 2HZ LYS 62 18.930 7.455 9.798
487 H LEU 63 H LEU 63 22.082 3.402 4.677
488 HA LEU 63 HA LEU 63 22.120 1.051 6.259
489 HB2 LEU 63 1HB LEU 63 20.260 1.322 4.867
490 HB3 LEU 63 2HB LEU 63 21.257 1.666 3.455
491 HG LEU 63 HG LEU 63 21.880 -0.653 3.268
492 HD11 LEU 63 1HD1 LEU 63 20.361 -2.129 4.965
493 HD12 LEU 63 2HD1 LEU 63 20.811 -0.772 5.997
494 HD13 LEU 63 3HD1 LEU 63 22.063 -1.741 5.220
495 HD21 LEU 63 3HD2 LEU 63 19.466 -1.646 3.160
496 HD22 LEU 63 1HD2 LEU 63 19.941 -0.344 2.069
497 HD23 LEU 63 2HD2 LEU 63 18.980 0.015 3.504
498 H LEU 64 H LEU 64 23.737 1.888 3.200
499 HA LEU 64 HA LEU 64 25.189 -0.549 3.034
500 HB2 LEU 64 1HB LEU 64 26.265 0.376 1.171
501 HB3 LEU 64 2HB LEU 64 24.636 1.048 1.150
502 HG LEU 64 HG LEU 64 25.860 3.031 2.435
503 HD11 LEU 64 1HD1 LEU 64 28.013 1.410 1.312
504 HD12 LEU 64 2HD1 LEU 64 28.064 2.678 2.536
505 HD13 LEU 64 3HD1 LEU 64 28.067 3.105 0.825
506 HD21 LEU 64 3HD2 LEU 64 25.844 2.559 -0.542
507 HD22 LEU 64 1HD2 LEU 64 26.148 4.120 0.221
508 HD23 LEU 64 2HD2 LEU 64 24.584 3.330 0.424
509 H LEU 65 H LEU 65 25.894 2.639 4.354
510 HA LEU 65 HA LEU 65 28.637 2.327 4.797
511 HB2 LEU 65 1HB LEU 65 26.489 4.012 5.974
512 HB3 LEU 65 2HB LEU 65 28.037 3.931 6.813
513 HG LEU 65 HG LEU 65 27.868 4.669 3.908
514 HD11 LEU 65 1HD1 LEU 65 26.666 6.456 4.536
515 HD12 LEU 65 2HD1 LEU 65 28.202 7.045 5.171
516 HD13 LEU 65 3HD1 LEU 65 27.053 6.246 6.244
517 HD21 LEU 65 3HD2 LEU 65 29.954 5.966 4.693
518 HD22 LEU 65 1HD2 LEU 65 30.073 4.218 4.491
519 HD23 LEU 65 2HD2 LEU 65 29.893 4.909 6.104
520 H SER 66 H SER 66 25.879 1.102 6.528
521 HA SER 66 HA SER 66 27.260 0.438 8.933
522 HB2 SER 66 1HB SER 66 24.618 -0.423 7.758
523 HB3 SER 66 2HB SER 66 25.220 -1.073 9.283
524 HG SER 66 HG SER 66 24.079 0.652 9.910
525 H THR 67 H THR 67 26.868 -1.080 5.846
526 HA THR 67 HA THR 67 28.108 -3.546 6.872
527 HB THR 67 HB THR 67 25.992 -3.976 5.764
528 HG1 THR 67 HG1 THR 67 26.777 -5.479 4.246
529 HG21 THR 67 3HG2 THR 67 26.021 -3.542 3.187
530 HG22 THR 67 1HG2 THR 67 27.194 -2.293 3.603
531 HG23 THR 67 2HG2 THR 67 25.571 -2.242 4.291
532 H THR 68 H THR 68 29.059 -0.749 5.628
533 HA THR 68 HA THR 68 31.282 -1.984 4.152
534 HB THR 68 HB THR 68 31.305 -0.156 2.542
535 HG1 THR 68 HG1 THR 68 30.378 1.608 3.302
536 HG21 THR 68 3HG2 THR 68 28.584 -0.670 1.993
537 HG22 THR 68 1HG2 THR 68 29.234 -2.120 2.758
538 HG23 THR 68 2HG2 THR 68 29.998 -1.470 1.307
539 H ARG 69 H ARG 69 33.229 -0.657 4.079
540 HA ARG 69 HA ARG 69 33.390 1.233 6.334
541 HB2 ARG 69 1HB ARG 69 35.789 0.431 6.555
542 HB3 ARG 69 2HB ARG 69 34.541 -0.703 7.056
543 HG2 ARG 69 1HG ARG 69 35.493 -0.877 4.257
544 HG3 ARG 69 2HG ARG 69 36.587 -1.418 5.532
545 HD2 ARG 69 1HD ARG 69 33.772 -2.343 5.655
546 HD3 ARG 69 2HD ARG 69 34.797 -3.030 4.396
547 HE ARG 69 HE ARG 69 35.997 -3.082 7.004
548 HH11 ARG 69 2HH1 ARG 69 33.865 -4.741 4.807
549 HH12 ARG 69 1HH1 ARG 69 34.113 -6.294 5.534
550 HH21 ARG 69 2HH2 ARG 69 36.331 -5.121 7.969
551 HH22 ARG 69 1HH2 ARG 69 35.515 -6.509 7.333
552 H MET 70 H MET 70 33.090 1.464 3.293
553 HA MET 70 HA MET 70 35.490 2.603 2.300
554 HB2 MET 70 1HB MET 70 32.621 2.675 1.413
555 HB3 MET 70 2HB MET 70 33.839 3.645 0.596
556 HG2 MET 70 1HG MET 70 35.077 1.686 -0.012
557 HG3 MET 70 2HG MET 70 34.011 0.664 0.950
558 HE1 MET 70 3HE MET 70 31.503 0.192 0.376
559 HE2 MET 70 1HE MET 70 31.128 1.913 0.268
560 HE3 MET 70 2HE MET 70 30.664 0.826 -1.041
561 HA PRO 71 HA PRO 71 35.454 6.689 3.898
562 HB2 PRO 71 1HB PRO 71 36.375 8.124 1.786
563 HB3 PRO 71 2HB PRO 71 37.404 7.046 2.737
564 HG2 PRO 71 1HG PRO 71 36.077 6.556 0.099
565 HG3 PRO 71 2HG PRO 71 37.721 6.143 0.618
566 HD2 PRO 71 1HD PRO 71 35.713 4.328 0.558
567 HD3 PRO 71 2HD PRO 71 37.025 4.261 1.752
568 H ILE 72 H ILE 72 34.552 8.862 3.630
569 HA ILE 72 HA ILE 72 31.849 8.830 2.902
570 HB ILE 72 HB ILE 72 33.635 11.244 3.229
571 HG12 ILE 72 1HG1 ILE 72 31.911 9.779 5.239
572 HG13 ILE 72 2HG1 ILE 72 33.670 9.784 5.201
573 HG21 ILE 72 1HG2 ILE 72 31.533 11.752 2.092
574 HG22 ILE 72 2HG2 ILE 72 30.636 10.990 3.404
575 HG23 ILE 72 3HG2 ILE 72 31.571 12.454 3.709
576 HD11 ILE 72 3HD1 ILE 72 31.912 12.179 5.674
577 HD12 ILE 72 1HD1 ILE 72 32.809 11.287 6.903
578 HD13 ILE 72 2HD1 ILE 72 33.675 12.177 5.651
579 H ALA 73 H ALA 73 34.717 9.681 1.100
580 HA ALA 73 HA ALA 73 33.481 11.088 -1.009
581 HB1 ALA 73 1HB ALA 73 35.850 11.257 -0.690
582 HB2 ALA 73 2HB ALA 73 36.054 9.522 -0.931
583 HB3 ALA 73 3HB ALA 73 35.552 10.546 -2.276
584 H THR 74 H THR 74 34.364 7.664 -0.659
585 HA THR 74 HA THR 74 33.398 6.884 -3.212
586 HB THR 74 HB THR 74 33.721 5.115 -0.783
587 HG1 THR 74 HG1 THR 74 35.685 5.491 -2.784
588 HG21 THR 74 3HG2 THR 74 33.662 4.579 -3.749
589 HG22 THR 74 1HG2 THR 74 32.555 3.968 -2.520
590 HG23 THR 74 2HG2 THR 74 34.226 3.405 -2.561
591 H VAL 75 H VAL 75 32.030 6.563 0.061
592 HA VAL 75 HA VAL 75 29.641 5.314 -0.634
593 HB VAL 75 HB VAL 75 30.122 7.276 1.613
594 HG11 VAL 75 1HG1 VAL 75 27.925 5.242 1.241
595 HG12 VAL 75 2HG1 VAL 75 28.189 6.221 2.686
596 HG13 VAL 75 3HG1 VAL 75 27.744 6.994 1.165
597 HG21 VAL 75 3HG2 VAL 75 31.352 5.676 2.542
598 HG22 VAL 75 1HG2 VAL 75 29.950 4.606 2.518
599 HG23 VAL 75 2HG2 VAL 75 31.071 4.622 1.156
600 H GLY 76 H GLY 76 30.463 8.755 -0.531
601 HA2 GLY 76 1HA GLY 76 27.925 9.833 -0.928
602 HA3 GLY 76 2HA GLY 76 29.426 10.585 -1.448
603 H ARG 77 H ARG 77 30.137 8.390 -3.237
604 HA ARG 77 HA ARG 77 28.781 9.323 -5.562
605 HB2 ARG 77 1HB ARG 77 31.206 8.293 -5.209
606 HB3 ARG 77 2HB ARG 77 30.370 6.803 -5.625
607 HG2 ARG 77 1HG ARG 77 31.291 7.670 -7.624
608 HG3 ARG 77 2HG ARG 77 29.550 7.951 -7.696
609 HD2 ARG 77 1HD ARG 77 30.456 9.970 -8.417
610 HD3 ARG 77 2HD ARG 77 30.098 10.265 -6.716
611 HE ARG 77 HE ARG 77 32.338 10.507 -6.324
612 HH11 ARG 77 2HH1 ARG 77 31.883 8.961 -9.410
613 HH12 ARG 77 1HH1 ARG 77 33.558 9.047 -9.847
614 HH21 ARG 77 2HH2 ARG 77 34.546 10.627 -6.888
615 HH22 ARG 77 1HH2 ARG 77 35.071 9.994 -8.411
616 H ASN 78 H ASN 78 28.475 6.521 -3.488
617 HA ASN 78 HA ASN 78 26.945 4.877 -5.159
618 HB2 ASN 78 1HB ASN 78 27.073 5.138 -2.155
619 HB3 ASN 78 2HB ASN 78 26.078 3.924 -2.956
620 HD21 ASN 78 2HD2 ASN 78 29.367 5.090 -2.552
621 HD22 ASN 78 1HD2 ASN 78 30.140 3.585 -2.901
622 H VAL 79 H VAL 79 26.071 7.627 -3.184
623 HA VAL 79 HA VAL 79 23.225 7.196 -3.600
624 HB VAL 79 HB VAL 79 22.927 9.254 -2.275
625 HG11 VAL 79 1HG1 VAL 79 23.287 8.229 -0.259
626 HG12 VAL 79 2HG1 VAL 79 23.434 6.845 -1.343
627 HG13 VAL 79 3HG1 VAL 79 24.882 7.636 -0.720
628 HG21 VAL 79 3HG2 VAL 79 24.708 10.506 -1.404
629 HG22 VAL 79 1HG2 VAL 79 25.894 9.268 -1.818
630 HG23 VAL 79 2HG2 VAL 79 25.145 10.232 -3.091
631 H GLY 80 H GLY 80 25.668 8.403 -5.428
632 HA2 GLY 80 1HA GLY 80 25.345 9.353 -7.567
633 HA3 GLY 80 2HA GLY 80 23.791 9.974 -7.030
634 H PHE 81 H PHE 81 26.611 10.397 -5.051
635 HA PHE 81 HA PHE 81 26.727 13.226 -5.862
636 HB2 PHE 81 1HB PHE 81 26.931 12.076 -3.073
637 HB3 PHE 81 2HB PHE 81 27.263 13.756 -3.481
638 HD1 PHE 81 HD1 PHE 81 25.025 14.062 -5.524
639 HD2 PHE 81 HD2 PHE 81 25.122 12.429 -1.594
640 HE1 PHE 81 HE1 PHE 81 22.641 14.601 -5.245
641 HE2 PHE 81 HE2 PHE 81 22.738 12.964 -1.309
642 HZ PHE 81 HZ PHE 81 21.494 14.050 -3.136
643 H ASP 82 H ASP 82 28.620 13.690 -6.743
644 HA ASP 82 HA ASP 82 30.924 12.003 -6.306
645 HB2 ASP 82 1HB ASP 82 30.696 12.709 -8.540
646 HB3 ASP 82 2HB ASP 82 30.364 14.374 -8.072
647 H ASP 83 H ASP 83 29.792 15.154 -5.316
648 HA ASP 83 HA ASP 83 32.343 15.910 -4.173
649 HB2 ASP 83 1HB ASP 83 29.678 17.203 -4.498
650 HB3 ASP 83 2HB ASP 83 30.716 17.781 -3.197
651 H GLN 84 H GLN 84 33.011 15.229 -2.258
652 HA GLN 84 HA GLN 84 31.437 13.712 -0.493
653 HB2 GLN 84 1HB GLN 84 33.811 13.420 -0.480
654 HB3 GLN 84 2HB GLN 84 34.079 15.119 -0.117
655 HG2 GLN 84 1HG GLN 84 32.482 13.552 1.820
656 HG3 GLN 84 2HG GLN 84 34.211 13.220 1.729
657 HE21 GLN 84 2HE2 GLN 84 35.667 15.033 2.014
658 HE22 GLN 84 1HE2 GLN 84 35.198 16.341 3.040
659 H LEU 85 H LEU 85 32.356 17.123 -0.484
660 HA LEU 85 HA LEU 85 31.250 17.733 2.052
661 HB2 LEU 85 1HB LEU 85 31.913 19.438 -0.336
662 HB3 LEU 85 2HB LEU 85 31.305 20.102 1.179
663 HG LEU 85 HG LEU 85 33.804 18.442 1.098
664 HD11 LEU 85 1HD1 LEU 85 33.696 21.436 0.804
665 HD12 LEU 85 2HD1 LEU 85 33.984 20.322 -0.532
666 HD13 LEU 85 3HD1 LEU 85 35.128 20.407 0.808
667 HD21 LEU 85 3HD2 LEU 85 32.587 20.433 2.989
668 HD22 LEU 85 1HD2 LEU 85 34.285 19.966 3.078
669 HD23 LEU 85 2HD2 LEU 85 33.024 18.751 3.292
670 H TYR 86 H TYR 86 29.940 17.625 -1.194
671 HA TYR 86 HA TYR 86 27.557 19.040 -0.743
672 HB2 TYR 86 1HB TYR 86 28.434 18.415 -2.985
673 HB3 TYR 86 2HB TYR 86 27.996 16.741 -2.661
674 HD1 TYR 86 HD1 TYR 86 25.548 16.190 -2.285
675 HD2 TYR 86 HD2 TYR 86 26.852 19.931 -3.836
676 HE1 TYR 86 HE1 TYR 86 23.289 16.607 -3.164
677 HE2 TYR 86 HE2 TYR 86 24.596 20.359 -4.718
678 HH TYR 86 HH TYR 86 22.561 18.697 -5.446
679 H PHE 87 H PHE 87 28.250 15.557 -0.561
680 HA PHE 87 HA PHE 87 25.639 14.799 0.218
681 HB2 PHE 87 1HB PHE 87 27.081 13.133 -0.719
682 HB3 PHE 87 2HB PHE 87 28.311 13.424 0.506
683 HD1 PHE 87 HD2 PHE 87 24.692 12.515 0.358
684 HD2 PHE 87 HD1 PHE 87 28.491 11.856 2.161
685 HE1 PHE 87 HE2 PHE 87 23.719 10.735 1.751
686 HE2 PHE 87 HE1 PHE 87 27.525 10.075 3.556
687 HZ PHE 87 HZ PHE 87 25.135 9.513 3.353
688 H SER 88 H SER 88 28.577 15.528 2.050
689 HA SER 88 HA SER 88 27.546 14.865 4.593
690 HB2 SER 88 1HB SER 88 29.524 15.722 5.460
691 HB3 SER 88 2HB SER 88 30.005 15.341 3.807
692 HG SER 88 HG SER 88 30.691 17.400 4.199
693 H ARG 89 H ARG 89 27.505 17.823 2.691
694 HA ARG 89 HA ARG 89 26.585 19.559 4.711
695 HB2 ARG 89 1HB ARG 89 26.589 19.616 1.721
696 HB3 ARG 89 2HB ARG 89 25.639 20.809 2.595
697 HG2 ARG 89 1HG ARG 89 27.487 21.848 3.468
698 HG3 ARG 89 2HG ARG 89 28.487 20.398 3.356
699 HD2 ARG 89 1HD ARG 89 29.325 21.777 1.675
700 HD3 ARG 89 2HD ARG 89 28.249 20.677 0.815
701 HE ARG 89 HE ARG 89 26.990 22.479 0.218
702 HH11 ARG 89 2HH1 ARG 89 28.868 23.324 3.025
703 HH12 ARG 89 1HH1 ARG 89 28.359 24.980 3.028
704 HH21 ARG 89 2HH2 ARG 89 26.313 24.657 0.211
705 HH22 ARG 89 1HH2 ARG 89 26.905 25.737 1.427
706 H VAL 90 H VAL 90 24.816 17.803 2.167
707 HA VAL 90 HA VAL 90 22.247 18.628 3.071
708 HB VAL 90 HB VAL 90 22.587 17.921 0.765
709 HG11 VAL 90 1HG1 VAL 90 22.966 15.122 1.815
710 HG12 VAL 90 2HG1 VAL 90 23.069 15.667 0.139
711 HG13 VAL 90 3HG1 VAL 90 24.290 16.171 1.308
712 HG21 VAL 90 3HG2 VAL 90 20.383 17.574 2.071
713 HG22 VAL 90 1HG2 VAL 90 20.565 16.811 0.492
714 HG23 VAL 90 2HG2 VAL 90 20.774 15.858 1.960
715 H PHE 91 H PHE 91 24.214 15.734 3.578
716 HA PHE 91 HA PHE 91 22.258 14.257 4.984
717 HB2 PHE 91 1HB PHE 91 24.311 13.281 3.957
718 HB3 PHE 91 2HB PHE 91 25.265 14.041 5.227
719 HD1 PHE 91 HD1 PHE 91 25.123 13.249 7.531
720 HD2 PHE 91 HD2 PHE 91 22.990 11.332 4.385
721 HE1 PHE 91 HE1 PHE 91 24.764 11.288 8.974
722 HE2 PHE 91 HE2 PHE 91 22.627 9.369 5.823
723 HZ PHE 91 HZ PHE 91 23.513 9.345 8.121
724 H LYS 92 H LYS 92 24.693 16.585 5.987
725 HA LYS 92 HA LYS 92 24.620 16.175 8.745
726 HB2 LYS 92 1HB LYS 92 26.308 17.582 7.744
727 HB3 LYS 92 2HB LYS 92 25.087 18.705 7.161
728 HG2 LYS 92 1HG LYS 92 24.590 19.434 9.372
729 HG3 LYS 92 2HG LYS 92 25.581 18.155 10.076
730 HD2 LYS 92 1HD LYS 92 27.579 19.170 9.388
731 HD3 LYS 92 2HD LYS 92 26.752 20.210 8.226
732 HE2 LYS 92 1HE LYS 92 25.956 21.634 9.881
733 HE3 LYS 92 2HE LYS 92 26.159 20.429 11.152
734 HZ1 LYS 92 3HZ LYS 92 28.381 21.787 9.725
735 HZ2 LYS 92 1HZ LYS 92 28.538 20.685 10.999
736 HZ3 LYS 92 2HZ LYS 92 27.825 22.195 11.270
737 H LYS 93 H LYS 93 22.674 18.369 6.735
738 HA LYS 93 HA LYS 93 21.088 19.265 8.950
739 HB2 LYS 93 1HB LYS 93 20.526 19.530 5.991
740 HB3 LYS 93 2HB LYS 93 19.784 20.461 7.286
741 HG2 LYS 93 1HG LYS 93 21.738 21.669 7.699
742 HG3 LYS 93 2HG LYS 93 22.745 20.508 6.831
743 HD2 LYS 93 1HD LYS 93 21.055 21.271 4.862
744 HD3 LYS 93 2HD LYS 93 21.130 22.754 5.816
745 HE2 LYS 93 1HE LYS 93 23.730 22.189 5.748
746 HE3 LYS 93 2HE LYS 93 23.248 21.377 4.259
747 HZ1 LYS 93 3HZ LYS 93 23.887 23.621 3.775
748 HZ2 LYS 93 1HZ LYS 93 22.818 24.237 4.933
749 HZ3 LYS 93 2HZ LYS 93 22.217 23.480 3.545
750 H CYS 94 H CYS 94 20.929 16.667 6.667
751 HA CYS 94 HA CYS 94 18.201 16.096 6.684
752 HB2 CYS 94 1HB CYS 94 20.682 14.543 6.168
753 HB3 CYS 94 2HB CYS 94 19.214 13.622 6.470
754 HG CYS 94 HG CYS 94 18.002 15.535 4.404
755 H THR 95 H THR 95 20.764 14.863 8.821
756 HA THR 95 HA THR 95 18.681 13.874 10.647
757 HB THR 95 HB THR 95 20.395 12.461 11.654
758 HG1 THR 95 HG1 THR 95 22.234 13.156 9.641
759 HG21 THR 95 3HG2 THR 95 20.543 12.181 8.655
760 HG22 THR 95 1HG2 THR 95 19.139 11.708 9.611
761 HG23 THR 95 2HG2 THR 95 20.689 10.905 9.864
762 H GLY 96 H GLY 96 20.844 16.403 10.224
763 HA2 GLY 96 1HA GLY 96 20.930 18.262 11.689
764 HA3 GLY 96 2HA GLY 96 20.491 17.202 13.019
765 H ALA 97 H ALA 97 22.699 15.411 11.579
766 HA ALA 97 HA ALA 97 25.036 16.792 12.692
767 HB1 ALA 97 1HB ALA 97 24.775 13.880 13.238
768 HB2 ALA 97 2HB ALA 97 25.625 15.130 14.147
769 HB3 ALA 97 3HB ALA 97 23.869 15.010 14.245
770 H SER 98 H SER 98 27.029 16.177 11.798
771 HA SER 98 HA SER 98 26.953 15.432 9.077
772 HB2 SER 98 1HB SER 98 29.577 15.084 9.766
773 HB3 SER 98 2HB SER 98 28.850 16.636 9.350
774 HG SER 98 HG SER 98 29.391 17.208 11.290
775 HA PRO 99 HA PRO 99 27.310 11.061 9.050
776 HB2 PRO 99 1HB PRO 99 29.144 10.615 7.098
777 HB3 PRO 99 2HB PRO 99 27.501 11.176 6.764
778 HG2 PRO 99 1HG PRO 99 30.044 12.748 6.923
779 HG3 PRO 99 2HG PRO 99 28.724 12.872 5.746
780 HD2 PRO 99 1HD PRO 99 28.991 14.591 7.820
781 HD3 PRO 99 2HD PRO 99 27.409 14.127 7.162
782 H SER 100 H SER 100 30.355 12.831 9.250
783 HA SER 100 HA SER 100 31.966 10.636 10.030
784 HB2 SER 100 1HB SER 100 33.153 12.491 9.211
785 HB3 SER 100 2HB SER 100 32.273 13.623 10.237
786 HG SER 100 HG SER 100 33.436 12.968 11.973
787 H GLU 101 H GLU 101 29.969 12.915 11.793
788 HA GLU 101 HA GLU 101 30.941 12.181 14.381
789 HB2 GLU 101 1HB GLU 101 29.856 14.376 13.826
790 HB3 GLU 101 2HB GLU 101 28.324 13.524 13.698
791 HG2 GLU 101 1HG GLU 101 28.084 14.079 15.845
792 HG3 GLU 101 2HG GLU 101 29.161 12.716 16.144
793 H PHE 102 H PHE 102 28.012 11.415 12.522
794 HA PHE 102 HA PHE 102 26.811 9.762 14.445
795 HB2 PHE 102 1HB PHE 102 25.911 10.748 12.173
796 HB3 PHE 102 2HB PHE 102 26.461 9.205 11.527
797 HD1 PHE 102 HD2 PHE 102 25.527 7.084 12.496
798 HD2 PHE 102 HD1 PHE 102 23.899 10.921 13.360
799 HE1 PHE 102 HE2 PHE 102 23.439 6.024 13.250
800 HE2 PHE 102 HE1 PHE 102 21.808 9.867 14.116
801 HZ PHE 102 HZ PHE 102 21.576 7.416 14.060
802 H ARG 103 H ARG 103 28.974 8.992 11.742
803 HA ARG 103 HA ARG 103 28.961 6.189 12.169
804 HB2 ARG 103 1HB ARG 103 30.707 6.082 10.564
805 HB3 ARG 103 2HB ARG 103 29.651 7.392 10.053
806 HG2 ARG 103 1HG ARG 103 31.213 9.008 11.067
807 HG3 ARG 103 2HG ARG 103 32.289 7.670 11.475
808 HD2 ARG 103 1HD ARG 103 32.237 7.098 8.988
809 HD3 ARG 103 2HD ARG 103 31.517 8.691 8.757
810 HE ARG 103 HE ARG 103 33.734 9.230 10.202
811 HH11 ARG 103 2HH1 ARG 103 33.176 7.425 7.278
812 HH12 ARG 103 1HH1 ARG 103 34.740 7.766 6.614
813 HH21 ARG 103 2HH2 ARG 103 35.796 9.686 9.339
814 HH22 ARG 103 1HH2 ARG 103 36.230 9.051 7.788
815 H ALA 104 H ALA 104 30.865 8.824 13.460
816 HA ALA 104 HA ALA 104 32.996 7.345 14.537
817 HB1 ALA 104 1HB ALA 104 31.777 9.985 15.295
818 HB2 ALA 104 2HB ALA 104 33.175 9.313 16.135
819 HB3 ALA 104 3HB ALA 104 33.273 9.677 14.413
820 H GLY 105 H GLY 105 29.775 8.062 15.768
821 HA2 GLY 105 1HA GLY 105 28.586 6.788 17.326
822 HA3 GLY 105 2HA GLY 105 30.069 5.932 17.723
823 H CYS 106 H CYS 106 31.112 8.940 17.843
824 HA CYS 106 HA CYS 106 31.080 9.062 20.685
825 HB2 CYS 106 1HB CYS 106 32.328 11.133 20.426
826 HB3 CYS 106 2HB CYS 106 32.952 9.921 19.314
827 HG CYS 106 HG CYS 106 31.688 12.913 18.674
828 H GLU 107 H GLU 107 29.891 10.290 22.063
829 HA GLU 107 HA GLU 107 27.322 11.116 21.293
830 HB2 GLU 107 1HB GLU 107 27.241 12.181 23.564
831 HB3 GLU 107 2HB GLU 107 27.702 10.485 23.566
832 HG2 GLU 107 1HG GLU 107 29.916 10.955 24.084
833 HG3 GLU 107 2HG GLU 107 29.781 12.634 23.563
Start of MODEL 10
1 H1 MET 1 H MET 1 0.746 -2.429 -0.032
2 HA MET 1 HA MET 1 1.423 0.056 -1.464
3 HB2 MET 1 1HB MET 1 3.337 -1.323 -0.494
4 HB3 MET 1 2HB MET 1 2.933 -2.543 -1.693
5 HG2 MET 1 1HG MET 1 3.581 -1.198 -3.468
6 HG3 MET 1 2HG MET 1 3.472 0.279 -2.513
7 HE1 MET 1 3HE MET 1 6.736 0.783 -3.344
8 HE2 MET 1 1HE MET 1 5.187 1.401 -2.770
9 HE3 MET 1 2HE MET 1 6.537 1.229 -1.649
10 H ASP 2 H ASP 2 1.443 -0.051 -3.788
11 HA ASP 2 HA ASP 2 -0.546 -1.956 -4.808
12 HB2 ASP 2 1HB ASP 2 -0.393 0.799 -5.045
13 HB3 ASP 2 2HB ASP 2 0.198 0.224 -6.602
14 H ASN 3 H ASN 3 -0.211 -3.076 -6.746
15 HA ASN 3 HA ASN 3 2.419 -4.001 -7.176
16 HB2 ASN 3 1HB ASN 3 -0.066 -4.300 -8.875
17 HB3 ASN 3 2HB ASN 3 1.434 -5.183 -9.140
18 HD21 ASN 3 2HD2 ASN 3 -1.394 -5.920 -8.322
19 HD22 ASN 3 1HD2 ASN 3 -1.173 -6.943 -6.947
20 H ARG 4 H ARG 4 0.532 -1.467 -8.639
21 HA ARG 4 HA ARG 4 2.126 -1.148 -10.975
22 HB2 ARG 4 1HB ARG 4 0.215 0.721 -9.569
23 HB3 ARG 4 2HB ARG 4 0.995 1.097 -11.100
24 HG2 ARG 4 1HG ARG 4 -0.794 -1.279 -10.634
25 HG3 ARG 4 2HG ARG 4 -1.315 0.253 -11.339
26 HD2 ARG 4 1HD ARG 4 0.404 -0.061 -13.116
27 HD3 ARG 4 2HD ARG 4 0.732 -1.660 -12.449
28 HE ARG 4 HE ARG 4 -1.527 -0.875 -14.049
29 HH11 ARG 4 2HH1 ARG 4 -0.306 -3.164 -11.728
30 HH12 ARG 4 1HH1 ARG 4 -1.418 -4.413 -12.179
31 HH21 ARG 4 2HH2 ARG 4 -2.997 -2.512 -14.653
32 HH22 ARG 4 1HH2 ARG 4 -2.947 -4.042 -13.844
33 H VAL 5 H VAL 5 1.989 0.604 -7.880
34 HA VAL 5 HA VAL 5 4.150 2.344 -8.492
35 HB VAL 5 HB VAL 5 4.157 2.861 -6.070
36 HG11 VAL 5 1HG1 VAL 5 1.290 2.936 -6.541
37 HG12 VAL 5 2HG1 VAL 5 2.449 4.259 -6.401
38 HG13 VAL 5 3HG1 VAL 5 2.223 3.443 -7.949
39 HG21 VAL 5 3HG2 VAL 5 2.095 0.666 -5.954
40 HG22 VAL 5 1HG2 VAL 5 3.657 0.710 -5.137
41 HG23 VAL 5 2HG2 VAL 5 2.380 1.829 -4.660
42 H ARG 6 H ARG 6 3.902 -0.757 -6.835
43 HA ARG 6 HA ARG 6 6.427 -0.906 -5.697
44 HB2 ARG 6 1HB ARG 6 4.472 -2.537 -5.477
45 HB3 ARG 6 2HB ARG 6 5.046 -3.260 -6.974
46 HG2 ARG 6 1HG ARG 6 6.891 -4.168 -5.996
47 HG3 ARG 6 2HG ARG 6 6.999 -2.903 -4.769
48 HD2 ARG 6 1HD ARG 6 5.028 -3.848 -3.646
49 HD3 ARG 6 2HD ARG 6 4.960 -5.125 -4.860
50 HE ARG 6 HE ARG 6 6.688 -5.005 -2.593
51 HH11 ARG 6 2HH1 ARG 6 6.428 -6.154 -5.869
52 HH12 ARG 6 1HH1 ARG 6 7.563 -7.444 -5.644
53 HH21 ARG 6 2HH2 ARG 6 8.184 -6.699 -2.285
54 HH22 ARG 6 1HH2 ARG 6 8.560 -7.753 -3.605
55 H GLU 7 H GLU 7 5.395 -1.818 -8.969
56 HA GLU 7 HA GLU 7 7.914 -2.772 -9.821
57 HB2 GLU 7 1HB GLU 7 5.480 -2.948 -10.872
58 HB3 GLU 7 2HB GLU 7 6.031 -1.548 -11.782
59 HG2 GLU 7 1HG GLU 7 6.538 -3.363 -13.144
60 HG3 GLU 7 2HG GLU 7 8.072 -2.950 -12.380
61 H ALA 8 H ALA 8 6.357 0.396 -10.029
62 HA ALA 8 HA ALA 8 8.236 1.682 -11.647
63 HB1 ALA 8 1HB ALA 8 6.334 2.929 -11.380
64 HB2 ALA 8 2HB ALA 8 6.226 2.598 -9.651
65 HB3 ALA 8 3HB ALA 8 7.414 3.753 -10.255
66 H CYS 9 H CYS 9 8.209 1.075 -8.180
67 HA CYS 9 HA CYS 9 10.312 2.767 -7.435
68 HB2 CYS 9 1HB CYS 9 9.447 0.127 -6.237
69 HB3 CYS 9 2HB CYS 9 10.550 1.262 -5.468
70 HG CYS 9 HG CYS 9 8.339 1.810 -4.092
71 H GLN 10 H GLN 10 10.304 -0.475 -8.786
72 HA GLN 10 HA GLN 10 13.019 -1.084 -8.331
73 HB2 GLN 10 1HB GLN 10 11.060 -2.612 -9.094
74 HB3 GLN 10 2HB GLN 10 11.505 -2.098 -10.716
75 HG2 GLN 10 1HG GLN 10 12.554 -4.200 -10.208
76 HG3 GLN 10 2HG GLN 10 13.779 -2.939 -10.342
77 HE21 GLN 10 2HE2 GLN 10 11.614 -3.961 -7.724
78 HE22 GLN 10 1HE2 GLN 10 12.863 -4.214 -6.558
79 H TYR 11 H TYR 11 11.355 0.441 -11.059
80 HA TYR 11 HA TYR 11 13.661 0.661 -12.700
81 HB2 TYR 11 1HB TYR 11 11.529 0.764 -13.765
82 HB3 TYR 11 2HB TYR 11 10.996 2.078 -12.723
83 HD1 TYR 11 HD1 TYR 11 13.509 1.255 -15.346
84 HD2 TYR 11 HD2 TYR 11 11.225 4.289 -13.428
85 HE1 TYR 11 HE1 TYR 11 14.276 2.883 -17.023
86 HE2 TYR 11 HE2 TYR 11 11.984 5.925 -15.100
87 HH TYR 11 HH TYR 11 13.763 6.261 -16.671
88 H ILE 12 H ILE 12 11.973 2.976 -10.595
89 HA ILE 12 HA ILE 12 13.668 5.162 -11.061
90 HB ILE 12 HB ILE 12 12.085 4.525 -8.569
91 HG12 ILE 12 1HG1 ILE 12 11.339 6.321 -10.881
92 HG13 ILE 12 2HG1 ILE 12 10.803 4.651 -10.739
93 HG21 ILE 12 1HG2 ILE 12 13.571 6.954 -9.474
94 HG22 ILE 12 2HG2 ILE 12 12.141 7.120 -8.458
95 HG23 ILE 12 3HG2 ILE 12 13.528 6.195 -7.883
96 HD11 ILE 12 3HD1 ILE 12 9.053 5.420 -9.628
97 HD12 ILE 12 1HD1 ILE 12 10.150 5.801 -8.302
98 HD13 ILE 12 2HD1 ILE 12 9.758 7.031 -9.504
99 H SER 13 H SER 13 13.764 2.637 -8.572
100 HA SER 13 HA SER 13 15.902 3.617 -7.077
101 HB2 SER 13 1HB SER 13 14.434 1.717 -6.405
102 HB3 SER 13 2HB SER 13 15.254 0.705 -7.594
103 HG SER 13 HG SER 13 16.113 1.590 -5.122
104 H ASP 14 H ASP 14 15.858 1.721 -10.037
105 HA ASP 14 HA ASP 14 18.623 1.106 -10.089
106 HB2 ASP 14 1HB ASP 14 16.554 0.200 -11.501
107 HB3 ASP 14 2HB ASP 14 17.118 1.419 -12.641
108 H HIS 15 H HIS 15 16.814 3.937 -10.880
109 HA HIS 15 HA HIS 15 19.028 5.108 -12.380
110 HB2 HIS 15 1HB HIS 15 16.183 5.927 -11.865
111 HB3 HIS 15 2HB HIS 15 17.356 7.095 -12.466
112 HD1 HIS 15 HD1 HIS 15 16.876 7.379 -14.874
113 HD2 HIS 15 HD2 HIS 15 16.703 3.391 -13.724
114 HE1 HIS 15 HE1 HIS 15 16.475 6.086 -16.993
115 H LEU 16 H LEU 16 18.903 4.529 -9.371
116 HA LEU 16 HA LEU 16 18.809 6.912 -7.926
117 HB2 LEU 16 1HB LEU 16 18.852 4.738 -6.857
118 HB3 LEU 16 2HB LEU 16 20.483 4.449 -7.458
119 HG LEU 16 HG LEU 16 20.237 6.861 -5.817
120 HD11 LEU 16 1HD1 LEU 16 18.678 5.704 -4.510
121 HD12 LEU 16 2HD1 LEU 16 20.224 5.429 -3.707
122 HD13 LEU 16 3HD1 LEU 16 19.516 4.165 -4.713
123 HD21 LEU 16 3HD2 LEU 16 22.394 6.418 -5.496
124 HD22 LEU 16 1HD2 LEU 16 22.215 5.102 -6.656
125 HD23 LEU 16 2HD2 LEU 16 22.045 4.784 -4.930
126 H ALA 17 H ALA 17 21.442 5.436 -9.745
127 HA ALA 17 HA ALA 17 23.301 7.528 -8.967
128 HB1 ALA 17 1HB ALA 17 23.757 4.967 -9.466
129 HB2 ALA 17 2HB ALA 17 23.971 5.582 -11.106
130 HB3 ALA 17 3HB ALA 17 24.966 6.210 -9.792
131 H ASP 18 H ASP 18 21.085 6.855 -11.502
132 HA ASP 18 HA ASP 18 22.355 8.528 -13.472
133 HB2 ASP 18 1HB ASP 18 20.711 6.512 -13.814
134 HB3 ASP 18 2HB ASP 18 19.467 7.741 -13.604
135 H SER 19 H SER 19 21.468 10.496 -14.306
136 HA SER 19 HA SER 19 20.205 12.103 -12.206
137 HB2 SER 19 1HB SER 19 22.215 13.118 -12.941
138 HB3 SER 19 2HB SER 19 21.842 12.816 -14.638
139 HG SER 19 HG SER 19 21.433 14.973 -14.149
140 H ASN 20 H ASN 20 19.885 11.255 -15.623
141 HA ASN 20 HA ASN 20 17.675 12.870 -16.223
142 HB2 ASN 20 1HB ASN 20 18.618 10.250 -17.391
143 HB3 ASN 20 2HB ASN 20 17.259 11.155 -18.050
144 HD21 ASN 20 2HD2 ASN 20 17.759 13.496 -18.520
145 HD22 ASN 20 1HD2 ASN 20 19.282 13.825 -19.266
146 H PHE 21 H PHE 21 15.942 12.865 -14.909
147 HA PHE 21 HA PHE 21 14.664 10.268 -14.356
148 HB2 PHE 21 1HB PHE 21 15.518 11.400 -12.322
149 HB3 PHE 21 2HB PHE 21 14.500 12.788 -12.691
150 HD1 PHE 21 HD2 PHE 21 13.747 9.151 -12.879
151 HD2 PHE 21 HD1 PHE 21 12.926 12.881 -11.001
152 HE1 PHE 21 HE2 PHE 21 11.893 8.114 -11.638
153 HE2 PHE 21 HE1 PHE 21 11.071 11.850 -9.756
154 HZ PHE 21 HZ PHE 21 10.551 9.464 -10.075
155 H ASP 22 H ASP 22 12.991 10.016 -15.679
156 HA ASP 22 HA ASP 22 11.270 12.347 -16.220
157 HB2 ASP 22 1HB ASP 22 12.323 11.603 -18.263
158 HB3 ASP 22 2HB ASP 22 11.850 9.936 -17.949
159 H ILE 23 H ILE 23 9.602 12.205 -14.850
160 HA ILE 23 HA ILE 23 8.580 9.916 -13.660
161 HB ILE 23 HB ILE 23 8.070 12.250 -12.953
162 HG12 ILE 23 1HG1 ILE 23 5.434 10.915 -13.386
163 HG13 ILE 23 2HG1 ILE 23 6.668 10.053 -12.475
164 HG21 ILE 23 1HG2 ILE 23 6.002 12.222 -15.139
165 HG22 ILE 23 2HG2 ILE 23 6.398 13.544 -14.042
166 HG23 ILE 23 3HG2 ILE 23 7.555 13.046 -15.276
167 HD11 ILE 23 3HD1 ILE 23 6.763 11.790 -10.841
168 HD12 ILE 23 1HD1 ILE 23 5.706 12.821 -11.804
169 HD13 ILE 23 2HD1 ILE 23 5.074 11.341 -11.081
170 H ALA 24 H ALA 24 8.011 11.221 -16.828
171 HA ALA 24 HA ALA 24 5.587 9.905 -17.420
172 HB1 ALA 24 1HB ALA 24 6.295 11.727 -18.793
173 HB2 ALA 24 2HB ALA 24 7.791 10.895 -19.218
174 HB3 ALA 24 3HB ALA 24 6.244 10.279 -19.798
175 H SER 25 H SER 25 8.973 8.966 -17.861
176 HA SER 25 HA SER 25 8.494 6.581 -19.274
177 HB2 SER 25 1HB SER 25 10.815 7.115 -17.409
178 HB3 SER 25 2HB SER 25 10.779 6.006 -18.781
179 HG SER 25 HG SER 25 11.767 7.845 -19.490
180 H VAL 26 H VAL 26 8.500 7.337 -15.855
181 HA VAL 26 HA VAL 26 8.518 4.653 -14.917
182 HB VAL 26 HB VAL 26 7.476 7.129 -13.534
183 HG11 VAL 26 1HG1 VAL 26 7.816 5.871 -11.470
184 HG12 VAL 26 2HG1 VAL 26 6.664 5.053 -12.528
185 HG13 VAL 26 3HG1 VAL 26 8.322 4.463 -12.404
186 HG21 VAL 26 3HG2 VAL 26 9.586 7.774 -13.282
187 HG22 VAL 26 1HG2 VAL 26 9.985 6.228 -12.532
188 HG23 VAL 26 2HG2 VAL 26 10.113 6.419 -14.281
189 H ALA 27 H ALA 27 5.971 6.941 -15.751
190 HA ALA 27 HA ALA 27 3.805 5.412 -14.758
191 HB1 ALA 27 1HB ALA 27 3.972 7.920 -15.563
192 HB2 ALA 27 2HB ALA 27 3.413 7.221 -17.083
193 HB3 ALA 27 3HB ALA 27 2.449 7.033 -15.619
194 H GLN 28 H GLN 28 5.180 5.749 -18.023
195 HA GLN 28 HA GLN 28 3.411 3.992 -19.310
196 HB2 GLN 28 1HB GLN 28 5.143 3.863 -21.076
197 HB3 GLN 28 2HB GLN 28 4.797 5.514 -20.580
198 HG2 GLN 28 1HG GLN 28 6.808 5.513 -19.187
199 HG3 GLN 28 2HG GLN 28 7.158 3.865 -19.706
200 HE21 GLN 28 2HE2 GLN 28 6.576 7.115 -20.979
201 HE22 GLN 28 1HE2 GLN 28 7.675 6.983 -22.305
202 H HIS 29 H HIS 29 6.438 3.435 -17.602
203 HA HIS 29 HA HIS 29 6.905 0.791 -18.364
204 HB2 HIS 29 1HB HIS 29 8.625 1.947 -17.193
205 HB3 HIS 29 2HB HIS 29 7.564 2.291 -15.830
206 HD1 HIS 29 HD1 HIS 29 8.013 -1.112 -17.411
207 HD2 HIS 29 HD2 HIS 29 8.935 0.908 -13.899
208 HE1 HIS 29 HE1 HIS 29 8.920 -2.861 -15.847
209 H VAL 30 H VAL 30 4.754 2.136 -15.939
210 HA VAL 30 HA VAL 30 3.969 -0.549 -15.073
211 HB VAL 30 HB VAL 30 2.686 0.578 -13.313
212 HG11 VAL 30 1HG1 VAL 30 4.695 1.743 -12.204
213 HG12 VAL 30 2HG1 VAL 30 4.844 0.035 -12.620
214 HG13 VAL 30 3HG1 VAL 30 5.586 1.261 -13.647
215 HG21 VAL 30 3HG2 VAL 30 3.829 3.164 -14.356
216 HG22 VAL 30 1HG2 VAL 30 2.182 2.618 -14.674
217 HG23 VAL 30 2HG2 VAL 30 2.698 2.948 -13.020
218 H CYS 31 H CYS 31 3.259 0.953 -17.673
219 HA CYS 31 HA CYS 31 1.466 1.217 -19.054
220 HB2 CYS 31 1HB CYS 31 0.371 -1.014 -17.328
221 HB3 CYS 31 2HB CYS 31 -0.258 -0.544 -18.902
222 HG CYS 31 HG CYS 31 1.172 -2.913 -19.213
223 H LEU 32 H LEU 32 1.528 3.005 -16.873
224 HA LEU 32 HA LEU 32 -1.328 3.606 -16.665
225 HB2 LEU 32 1HB LEU 32 0.188 2.624 -14.526
226 HB3 LEU 32 2HB LEU 32 0.026 4.354 -14.236
227 HG LEU 32 HG LEU 32 -2.463 2.931 -14.935
228 HD11 LEU 32 1HD1 LEU 32 -1.645 1.225 -13.542
229 HD12 LEU 32 2HD1 LEU 32 -2.677 2.214 -12.509
230 HD13 LEU 32 3HD1 LEU 32 -0.923 2.375 -12.416
231 HD21 LEU 32 3HD2 LEU 32 -3.280 4.814 -14.097
232 HD22 LEU 32 1HD2 LEU 32 -1.645 5.360 -13.726
233 HD23 LEU 32 2HD2 LEU 32 -2.561 4.443 -12.530
234 H SER 33 H SER 33 -1.722 5.867 -15.977
235 HA SER 33 HA SER 33 0.088 7.629 -17.372
236 HB2 SER 33 1HB SER 33 -2.651 7.847 -16.218
237 HB3 SER 33 2HB SER 33 -1.727 9.336 -16.413
238 HG SER 33 HG SER 33 -1.521 8.871 -18.608
239 HA PRO 34 HA PRO 34 2.311 9.322 -13.991
240 HB2 PRO 34 1HB PRO 34 2.432 11.957 -14.630
241 HB3 PRO 34 2HB PRO 34 3.348 10.717 -15.494
242 HG2 PRO 34 1HG PRO 34 0.769 12.037 -16.248
243 HG3 PRO 34 2HG PRO 34 2.172 11.659 -17.265
244 HD2 PRO 34 1HD PRO 34 -0.061 10.127 -17.235
245 HD3 PRO 34 2HD PRO 34 1.557 9.451 -17.511
246 H SER 35 H SER 35 -0.623 11.131 -14.836
247 HA SER 35 HA SER 35 -0.863 12.530 -12.401
248 HB2 SER 35 1HB SER 35 -2.961 11.739 -14.432
249 HB3 SER 35 2HB SER 35 -3.249 12.846 -13.090
250 HG SER 35 HG SER 35 -2.392 13.510 -15.422
251 H ARG 36 H ARG 36 -2.314 9.489 -13.522
252 HA ARG 36 HA ARG 36 -3.725 9.012 -11.089
253 HB2 ARG 36 1HB ARG 36 -4.461 8.047 -13.220
254 HB3 ARG 36 2HB ARG 36 -2.976 7.109 -13.317
255 HG2 ARG 36 1HG ARG 36 -4.777 5.701 -12.576
256 HG3 ARG 36 2HG ARG 36 -3.624 5.921 -11.258
257 HD2 ARG 36 1HD ARG 36 -5.050 7.363 -10.097
258 HD3 ARG 36 2HD ARG 36 -6.038 7.679 -11.523
259 HE ARG 36 HE ARG 36 -6.395 5.034 -11.111
260 HH11 ARG 36 2HH1 ARG 36 -6.659 7.823 -9.043
261 HH12 ARG 36 1HH1 ARG 36 -7.890 7.126 -8.042
262 HH21 ARG 36 2HH2 ARG 36 -8.015 4.106 -9.800
263 HH22 ARG 36 1HH2 ARG 36 -8.660 5.012 -8.473
264 H LEU 37 H LEU 37 -0.696 7.785 -12.467
265 HA LEU 37 HA LEU 37 -0.085 5.961 -10.424
266 HB2 LEU 37 1HB LEU 37 1.065 5.872 -12.524
267 HB3 LEU 37 2HB LEU 37 1.693 7.504 -12.303
268 HG LEU 37 HG LEU 37 2.885 6.482 -10.229
269 HD11 LEU 37 1HD1 LEU 37 1.835 4.108 -11.636
270 HD12 LEU 37 2HD1 LEU 37 2.218 4.344 -9.931
271 HD13 LEU 37 3HD1 LEU 37 3.510 4.027 -11.089
272 HD21 LEU 37 3HD2 LEU 37 3.572 6.762 -12.989
273 HD22 LEU 37 1HD2 LEU 37 4.400 5.356 -12.319
274 HD23 LEU 37 2HD2 LEU 37 4.597 6.938 -11.564
275 H SER 38 H SER 38 0.779 9.375 -10.834
276 HA SER 38 HA SER 38 2.444 9.616 -8.597
277 HB2 SER 38 1HB SER 38 2.051 12.026 -8.773
278 HB3 SER 38 2HB SER 38 2.279 11.325 -10.375
279 HG SER 38 HG SER 38 0.433 12.841 -10.010
280 H HIS 39 H HIS 39 -1.055 9.900 -8.929
281 HA HIS 39 HA HIS 39 -1.639 10.905 -6.384
282 HB2 HIS 39 1HB HIS 39 -3.269 10.772 -8.247
283 HB3 HIS 39 2HB HIS 39 -3.323 9.023 -8.051
284 HD1 HIS 39 HD1 HIS 39 -4.847 12.109 -6.853
285 HD2 HIS 39 HD2 HIS 39 -4.438 8.210 -5.478
286 HE1 HIS 39 HE1 HIS 39 -6.561 11.855 -5.030
287 H LEU 40 H LEU 40 -1.474 7.541 -7.524
288 HA LEU 40 HA LEU 40 -2.022 6.415 -4.967
289 HB2 LEU 40 1HB LEU 40 -0.671 5.128 -7.333
290 HB3 LEU 40 2HB LEU 40 -1.418 4.298 -5.970
291 HG LEU 40 HG LEU 40 -2.874 5.947 -8.037
292 HD11 LEU 40 1HD1 LEU 40 -2.966 4.121 -9.287
293 HD12 LEU 40 2HD1 LEU 40 -3.656 3.211 -7.944
294 HD13 LEU 40 3HD1 LEU 40 -1.906 3.295 -8.144
295 HD21 LEU 40 3HD2 LEU 40 -4.888 5.264 -6.983
296 HD22 LEU 40 1HD2 LEU 40 -3.846 5.913 -5.717
297 HD23 LEU 40 2HD2 LEU 40 -4.029 4.168 -5.900
298 H PHE 41 H PHE 41 0.883 7.362 -6.664
299 HA PHE 41 HA PHE 41 2.740 5.989 -5.030
300 HB2 PHE 41 1HB PHE 41 2.885 7.528 -7.322
301 HB3 PHE 41 2HB PHE 41 3.703 8.524 -6.122
302 HD1 PHE 41 HD2 PHE 41 5.728 7.714 -5.009
303 HD2 PHE 41 HD1 PHE 41 3.832 5.479 -8.096
304 HE1 PHE 41 HE2 PHE 41 7.762 6.355 -5.271
305 HE2 PHE 41 HE1 PHE 41 5.863 4.116 -8.362
306 HZ PHE 41 HZ PHE 41 7.832 4.555 -6.949
307 H ARG 42 H ARG 42 1.646 9.379 -5.006
308 HA ARG 42 HA ARG 42 3.079 10.048 -2.642
309 HB2 ARG 42 1HB ARG 42 1.887 11.503 -4.590
310 HB3 ARG 42 2HB ARG 42 0.677 11.631 -3.320
311 HG2 ARG 42 1HG ARG 42 3.057 12.126 -2.009
312 HG3 ARG 42 2HG ARG 42 3.252 12.928 -3.569
313 HD2 ARG 42 1HD ARG 42 0.668 13.292 -2.165
314 HD3 ARG 42 2HD ARG 42 2.078 14.098 -1.478
315 HE ARG 42 HE ARG 42 1.992 14.610 -4.235
316 HH11 ARG 42 2HH1 ARG 42 0.254 15.375 -1.317
317 HH12 ARG 42 1HH1 ARG 42 -0.310 16.906 -1.899
318 HH21 ARG 42 2HH2 ARG 42 1.255 16.624 -5.012
319 HH22 ARG 42 1HH2 ARG 42 0.259 17.615 -4.002
320 H GLN 43 H GLN 43 -0.042 8.669 -3.278
321 HA GLN 43 HA GLN 43 -1.122 9.212 -0.672
322 HB2 GLN 43 1HB GLN 43 -2.557 8.926 -2.667
323 HB3 GLN 43 2HB GLN 43 -2.052 7.245 -2.771
324 HG2 GLN 43 1HG GLN 43 -4.191 7.302 -1.745
325 HG3 GLN 43 2HG GLN 43 -3.011 6.887 -0.503
326 HE21 GLN 43 2HE2 GLN 43 -4.039 9.968 -1.927
327 HE22 GLN 43 1HE2 GLN 43 -4.467 10.714 -0.430
328 H GLN 44 H GLN 44 0.367 6.440 -2.285
329 HA GLN 44 HA GLN 44 0.067 4.737 0.019
330 HB2 GLN 44 1HB GLN 44 1.601 4.384 -2.560
331 HB3 GLN 44 2HB GLN 44 1.468 3.150 -1.314
332 HG2 GLN 44 1HG GLN 44 -1.034 4.324 -2.397
333 HG3 GLN 44 2HG GLN 44 -0.131 3.194 -3.405
334 HE21 GLN 44 2HE2 GLN 44 -2.076 1.891 -3.194
335 HE22 GLN 44 1HE2 GLN 44 -2.259 0.875 -1.809
336 H LEU 45 H LEU 45 2.649 6.608 -1.486
337 HA LEU 45 HA LEU 45 4.576 5.732 0.505
338 HB2 LEU 45 1HB LEU 45 4.866 7.751 -1.715
339 HB3 LEU 45 2HB LEU 45 6.170 7.098 -0.726
340 HG LEU 45 HG LEU 45 4.744 5.900 -3.032
341 HD11 LEU 45 1HD1 LEU 45 7.023 6.800 -3.201
342 HD12 LEU 45 2HD1 LEU 45 6.963 5.069 -3.535
343 HD13 LEU 45 3HD1 LEU 45 7.557 5.647 -1.978
344 HD21 LEU 45 3HD2 LEU 45 5.588 4.373 -0.593
345 HD22 LEU 45 1HD2 LEU 45 5.614 3.634 -2.194
346 HD23 LEU 45 2HD2 LEU 45 4.098 4.240 -1.528
347 H GLY 46 H GLY 46 2.300 8.227 0.092
348 HA2 GLY 46 1HA GLY 46 1.751 10.019 1.421
349 HA3 GLY 46 2HA GLY 46 2.863 9.373 2.618
350 H ILE 47 H ILE 47 4.366 9.840 -0.362
351 HA ILE 47 HA ILE 47 5.092 12.611 0.137
352 HB ILE 47 HB ILE 47 7.479 12.207 0.189
353 HG12 ILE 47 1HG1 ILE 47 6.762 9.267 0.166
354 HG13 ILE 47 2HG1 ILE 47 7.520 10.149 -1.155
355 HG21 ILE 47 1HG2 ILE 47 6.295 12.284 2.316
356 HG22 ILE 47 2HG2 ILE 47 6.028 10.543 2.242
357 HG23 ILE 47 3HG2 ILE 47 7.665 11.178 2.402
358 HD11 ILE 47 3HD1 ILE 47 8.713 9.692 1.569
359 HD12 ILE 47 1HD1 ILE 47 9.138 8.830 0.091
360 HD13 ILE 47 2HD1 ILE 47 9.477 10.555 0.235
361 H SER 48 H SER 48 6.610 13.422 -1.590
362 HA SER 48 HA SER 48 5.588 12.619 -4.150
363 HB2 SER 48 1HB SER 48 6.312 15.004 -3.266
364 HB3 SER 48 2HB SER 48 7.888 14.513 -3.886
365 HG SER 48 HG SER 48 5.517 15.047 -5.254
366 H VAL 49 H VAL 49 6.957 12.099 -5.996
367 HA VAL 49 HA VAL 49 8.558 9.874 -5.598
368 HB VAL 49 HB VAL 49 9.404 10.276 -7.926
369 HG11 VAL 49 1HG1 VAL 49 7.351 9.736 -8.963
370 HG12 VAL 49 2HG1 VAL 49 7.244 9.103 -7.319
371 HG13 VAL 49 3HG1 VAL 49 6.420 10.605 -7.743
372 HG21 VAL 49 3HG2 VAL 49 9.468 12.656 -8.022
373 HG22 VAL 49 1HG2 VAL 49 8.254 12.120 -9.184
374 HG23 VAL 49 2HG2 VAL 49 7.754 12.779 -7.626
375 H LEU 50 H LEU 50 9.496 13.265 -5.957
376 HA LEU 50 HA LEU 50 12.276 12.872 -6.050
377 HB2 LEU 50 1HB LEU 50 10.773 14.992 -6.439
378 HB3 LEU 50 2HB LEU 50 11.113 15.282 -4.734
379 HG LEU 50 HG LEU 50 13.538 15.258 -5.265
380 HD11 LEU 50 1HD1 LEU 50 12.697 14.116 -7.656
381 HD12 LEU 50 2HD1 LEU 50 14.329 14.642 -7.247
382 HD13 LEU 50 3HD1 LEU 50 13.238 15.736 -8.096
383 HD21 LEU 50 3HD2 LEU 50 13.406 17.424 -6.689
384 HD22 LEU 50 1HD2 LEU 50 12.699 17.403 -5.073
385 HD23 LEU 50 2HD2 LEU 50 11.663 17.239 -6.491
386 H SER 51 H SER 51 10.022 13.088 -3.376
387 HA SER 51 HA SER 51 12.006 13.340 -1.340
388 HB2 SER 51 1HB SER 51 9.067 12.762 -1.381
389 HB3 SER 51 2HB SER 51 9.980 12.486 0.102
390 HG SER 51 HG SER 51 10.032 14.928 -1.336
391 H TRP 52 H TRP 52 10.056 10.626 -2.547
392 HA TRP 52 HA TRP 52 11.164 8.684 -0.820
393 HB2 TRP 52 1HB TRP 52 9.049 8.279 -1.929
394 HB3 TRP 52 2HB TRP 52 9.814 8.393 -3.511
395 HD1 TRP 52 HD1 TRP 52 9.771 6.084 -0.412
396 HE1 TRP 52 HE1 TRP 52 10.386 3.705 -1.179
397 HE3 TRP 52 HE3 TRP 52 10.866 7.067 -5.308
398 HZ2 TRP 52 HZ2 TRP 52 11.225 2.416 -3.546
399 HZ3 TRP 52 HZ3 TRP 52 11.568 5.206 -6.756
400 HH2 TRP 52 HH2 TRP 52 11.744 2.929 -5.891
401 H ARG 53 H ARG 53 11.954 9.649 -4.140
402 HA ARG 53 HA ARG 53 13.904 7.724 -4.665
403 HB2 ARG 53 1HB ARG 53 12.898 9.306 -6.329
404 HB3 ARG 53 2HB ARG 53 13.909 10.578 -5.655
405 HG2 ARG 53 1HG ARG 53 15.873 9.003 -6.187
406 HG3 ARG 53 2HG ARG 53 14.718 8.165 -7.226
407 HD2 ARG 53 1HD ARG 53 15.775 9.699 -8.642
408 HD3 ARG 53 2HD ARG 53 14.236 10.458 -8.240
409 HE ARG 53 HE ARG 53 16.260 11.279 -6.435
410 HH11 ARG 53 2HH1 ARG 53 15.124 11.743 -9.693
411 HH12 ARG 53 1HH1 ARG 53 15.760 13.349 -9.825
412 HH21 ARG 53 2HH2 ARG 53 17.102 13.392 -6.597
413 HH22 ARG 53 1HH2 ARG 53 16.886 14.286 -8.063
414 H GLU 54 H GLU 54 14.248 10.978 -3.275
415 HA GLU 54 HA GLU 54 17.053 10.852 -2.950
416 HB2 GLU 54 1HB GLU 54 16.055 13.002 -2.928
417 HB3 GLU 54 2HB GLU 54 14.914 12.544 -1.672
418 HG2 GLU 54 1HG GLU 54 16.480 12.714 0.007
419 HG3 GLU 54 2HG GLU 54 17.838 12.494 -1.095
420 H ASP 55 H ASP 55 14.351 9.991 -0.859
421 HA ASP 55 HA ASP 55 15.688 9.606 1.540
422 HB2 ASP 55 1HB ASP 55 13.212 9.490 1.207
423 HB3 ASP 55 2HB ASP 55 13.426 7.896 0.489
424 H GLN 56 H GLN 56 15.466 7.507 -1.272
425 HA GLN 56 HA GLN 56 16.639 5.227 -0.043
426 HB2 GLN 56 1HB GLN 56 15.988 6.058 -2.828
427 HB3 GLN 56 2HB GLN 56 17.143 4.749 -2.612
428 HG2 GLN 56 1HG GLN 56 14.490 4.701 -1.231
429 HG3 GLN 56 2HG GLN 56 14.657 4.179 -2.906
430 HE21 GLN 56 2HE2 GLN 56 13.773 2.415 -1.059
431 HE22 GLN 56 1HE2 GLN 56 14.979 1.219 -0.742
432 H ARG 57 H ARG 57 17.905 8.021 -1.739
433 HA ARG 57 HA ARG 57 20.509 7.095 -2.217
434 HB2 ARG 57 1HB ARG 57 19.797 9.952 -1.568
435 HB3 ARG 57 2HB ARG 57 21.107 9.369 -2.586
436 HG2 ARG 57 1HG ARG 57 19.451 8.540 -4.205
437 HG3 ARG 57 2HG ARG 57 18.164 9.202 -3.196
438 HD2 ARG 57 1HD ARG 57 20.309 10.683 -4.693
439 HD3 ARG 57 2HD ARG 57 18.561 10.799 -4.893
440 HE ARG 57 HE ARG 57 19.040 11.565 -2.304
441 HH11 ARG 57 2HH1 ARG 57 20.086 12.615 -5.455
442 HH12 ARG 57 1HH1 ARG 57 20.289 14.269 -4.980
443 HH21 ARG 57 2HH2 ARG 57 19.303 13.739 -1.667
444 HH22 ARG 57 1HH2 ARG 57 19.844 14.907 -2.825
445 H ILE 58 H ILE 58 19.163 8.888 0.540
446 HA ILE 58 HA ILE 58 21.630 8.924 1.982
447 HB ILE 58 HB ILE 58 18.818 9.385 2.985
448 HG12 ILE 58 1HG1 ILE 58 19.462 10.959 1.218
449 HG13 ILE 58 2HG1 ILE 58 19.369 11.771 2.777
450 HG21 ILE 58 1HG2 ILE 58 19.776 9.298 4.999
451 HG22 ILE 58 2HG2 ILE 58 21.401 9.296 4.317
452 HG23 ILE 58 3HG2 ILE 58 20.553 10.821 4.570
453 HD11 ILE 58 3HD1 ILE 58 21.884 10.869 1.395
454 HD12 ILE 58 1HD1 ILE 58 21.294 12.525 1.519
455 HD13 ILE 58 2HD1 ILE 58 21.803 11.660 2.969
456 H SER 59 H SER 59 18.681 6.968 2.145
457 HA SER 59 HA SER 59 19.372 5.459 4.409
458 HB2 SER 59 1HB SER 59 17.096 5.595 3.295
459 HB3 SER 59 2HB SER 59 17.707 4.457 2.095
460 HG SER 59 HG SER 59 16.741 3.948 4.528
461 H GLN 60 H GLN 60 20.097 5.031 0.991
462 HA GLN 60 HA GLN 60 21.235 2.434 1.265
463 HB2 GLN 60 1HB GLN 60 20.343 3.476 -0.868
464 HB3 GLN 60 2HB GLN 60 21.821 4.427 -0.922
465 HG2 GLN 60 1HG GLN 60 21.857 2.394 -2.343
466 HG3 GLN 60 2HG GLN 60 23.160 2.473 -1.159
467 HE21 GLN 60 2HE2 GLN 60 23.436 0.812 0.174
468 HE22 GLN 60 1HE2 GLN 60 22.342 -0.511 0.365
469 H ALA 61 H ALA 61 22.591 5.705 1.097
470 HA ALA 61 HA ALA 61 25.304 4.910 1.209
471 HB1 ALA 61 1HB ALA 61 23.843 7.476 1.631
472 HB2 ALA 61 2HB ALA 61 25.541 7.359 2.096
473 HB3 ALA 61 3HB ALA 61 25.061 7.058 0.426
474 H LYS 62 H LYS 62 23.019 5.972 3.711
475 HA LYS 62 HA LYS 62 24.863 5.818 5.856
476 HB2 LYS 62 1HB LYS 62 23.011 6.178 7.286
477 HB3 LYS 62 2HB LYS 62 22.658 7.076 5.816
478 HG2 LYS 62 1HG LYS 62 21.234 5.196 5.063
479 HG3 LYS 62 2HG LYS 62 21.522 4.405 6.615
480 HD2 LYS 62 1HD LYS 62 20.239 7.109 6.224
481 HD3 LYS 62 2HD LYS 62 19.387 5.609 6.594
482 HE2 LYS 62 1HE LYS 62 21.330 5.747 8.548
483 HE3 LYS 62 2HE LYS 62 20.828 7.426 8.353
484 HZ1 LYS 62 3HZ LYS 62 18.966 5.160 8.816
485 HZ2 LYS 62 1HZ LYS 62 18.565 6.803 8.764
486 HZ3 LYS 62 2HZ LYS 62 19.521 6.206 10.024
487 H LEU 63 H LEU 63 22.726 3.498 4.338
488 HA LEU 63 HA LEU 63 22.797 1.514 6.337
489 HB2 LEU 63 1HB LEU 63 21.143 1.425 4.609
490 HB3 LEU 63 2HB LEU 63 22.383 1.340 3.359
491 HG LEU 63 HG LEU 63 22.314 -0.844 5.370
492 HD11 LEU 63 1HD1 LEU 63 19.917 -0.263 4.558
493 HD12 LEU 63 2HD1 LEU 63 20.468 -1.937 4.521
494 HD13 LEU 63 3HD1 LEU 63 20.451 -0.983 3.039
495 HD21 LEU 63 3HD2 LEU 63 23.735 -1.694 3.895
496 HD22 LEU 63 1HD2 LEU 63 23.504 -0.299 2.841
497 HD23 LEU 63 2HD2 LEU 63 22.457 -1.709 2.679
498 H LEU 64 H LEU 64 24.708 1.858 3.349
499 HA LEU 64 HA LEU 64 26.410 -0.347 3.953
500 HB2 LEU 64 1HB LEU 64 27.576 0.192 1.997
501 HB3 LEU 64 2HB LEU 64 25.898 0.619 1.668
502 HG LEU 64 HG LEU 64 26.761 3.010 2.458
503 HD11 LEU 64 1HD1 LEU 64 29.130 2.822 1.013
504 HD12 LEU 64 2HD1 LEU 64 29.169 1.456 2.128
505 HD13 LEU 64 3HD1 LEU 64 28.960 3.094 2.747
506 HD21 LEU 64 3HD2 LEU 64 27.242 1.863 -0.291
507 HD22 LEU 64 1HD2 LEU 64 27.057 3.570 0.111
508 HD23 LEU 64 2HD2 LEU 64 25.698 2.464 0.316
509 H LEU 65 H LEU 65 26.617 3.139 4.404
510 HA LEU 65 HA LEU 65 29.314 3.305 5.142
511 HB2 LEU 65 1HB LEU 65 27.884 5.237 4.602
512 HB3 LEU 65 2HB LEU 65 27.010 4.990 6.112
513 HG LEU 65 HG LEU 65 29.854 5.276 6.570
514 HD11 LEU 65 1HD1 LEU 65 29.553 7.859 6.060
515 HD12 LEU 65 2HD1 LEU 65 28.508 7.227 4.788
516 HD13 LEU 65 3HD1 LEU 65 30.200 6.737 4.863
517 HD21 LEU 65 3HD2 LEU 65 29.010 7.064 8.086
518 HD22 LEU 65 1HD2 LEU 65 28.249 5.492 8.334
519 HD23 LEU 65 2HD2 LEU 65 27.387 6.761 7.463
520 H SER 66 H SER 66 26.496 2.278 6.906
521 HA SER 66 HA SER 66 27.686 2.452 9.503
522 HB2 SER 66 1HB SER 66 25.363 2.510 9.609
523 HB3 SER 66 2HB SER 66 25.175 1.246 8.393
524 HG SER 66 HG SER 66 26.120 0.894 11.048
525 H THR 67 H THR 67 27.638 0.107 6.955
526 HA THR 67 HA THR 67 28.884 -1.892 8.717
527 HB THR 67 HB THR 67 26.927 -2.732 7.536
528 HG1 THR 67 HG1 THR 67 28.591 -4.229 7.824
529 HG21 THR 67 3HG2 THR 67 28.363 -1.647 5.144
530 HG22 THR 67 1HG2 THR 67 26.668 -1.481 5.600
531 HG23 THR 67 2HG2 THR 67 27.266 -3.016 4.968
532 H THR 68 H THR 68 29.878 0.551 6.920
533 HA THR 68 HA THR 68 32.298 -0.867 6.037
534 HB THR 68 HB THR 68 32.447 0.489 4.030
535 HG1 THR 68 HG1 THR 68 31.429 2.367 4.408
536 HG21 THR 68 3HG2 THR 68 30.420 -1.455 4.519
537 HG22 THR 68 1HG2 THR 68 31.284 -1.119 3.020
538 HG23 THR 68 2HG2 THR 68 29.789 -0.259 3.388
539 H ARG 69 H ARG 69 34.222 0.371 6.057
540 HA ARG 69 HA ARG 69 34.060 2.751 7.781
541 HB2 ARG 69 1HB ARG 69 35.312 0.672 8.581
542 HB3 ARG 69 2HB ARG 69 36.510 1.051 7.351
543 HG2 ARG 69 1HG ARG 69 37.141 3.038 8.413
544 HG3 ARG 69 2HG ARG 69 35.694 3.058 9.422
545 HD2 ARG 69 1HD ARG 69 36.492 1.083 10.614
546 HD3 ARG 69 2HD ARG 69 37.927 1.037 9.592
547 HE ARG 69 HE ARG 69 37.472 2.736 11.852
548 HH11 ARG 69 2HH1 ARG 69 39.154 2.440 8.819
549 HH12 ARG 69 1HH1 ARG 69 40.423 3.531 9.267
550 HH21 ARG 69 2HH2 ARG 69 39.136 4.175 12.454
551 HH22 ARG 69 1HH2 ARG 69 40.413 4.517 11.335
552 H MET 70 H MET 70 33.947 2.408 4.738
553 HA MET 70 HA MET 70 36.314 3.556 3.677
554 HB2 MET 70 1HB MET 70 33.520 3.175 2.655
555 HB3 MET 70 2HB MET 70 34.665 4.150 1.744
556 HG2 MET 70 1HG MET 70 36.224 2.154 1.850
557 HG3 MET 70 2HG MET 70 34.835 1.235 2.424
558 HE1 MET 70 3HE MET 70 32.302 1.482 -0.339
559 HE2 MET 70 1HE MET 70 32.550 2.052 1.311
560 HE3 MET 70 2HE MET 70 32.651 3.185 -0.037
561 HA PRO 71 HA PRO 71 35.861 7.846 4.478
562 HB2 PRO 71 1HB PRO 71 36.768 8.953 2.171
563 HB3 PRO 71 2HB PRO 71 37.832 8.162 3.340
564 HG2 PRO 71 1HG PRO 71 36.685 7.088 0.792
565 HG3 PRO 71 2HG PRO 71 38.329 6.924 1.435
566 HD2 PRO 71 1HD PRO 71 36.482 4.955 1.640
567 HD3 PRO 71 2HD PRO 71 37.733 5.222 2.871
568 H ILE 72 H ILE 72 34.574 9.667 4.092
569 HA ILE 72 HA ILE 72 32.023 9.243 3.074
570 HB ILE 72 HB ILE 72 33.396 11.920 3.333
571 HG12 ILE 72 1HG1 ILE 72 33.591 10.686 5.421
572 HG13 ILE 72 2HG1 ILE 72 32.400 11.970 5.603
573 HG21 ILE 72 1HG2 ILE 72 31.239 11.848 2.073
574 HG22 ILE 72 2HG2 ILE 72 30.467 11.251 3.541
575 HG23 ILE 72 3HG2 ILE 72 31.205 12.852 3.522
576 HD11 ILE 72 3HD1 ILE 72 31.013 10.444 6.396
577 HD12 ILE 72 1HD1 ILE 72 30.943 9.749 4.777
578 HD13 ILE 72 2HD1 ILE 72 32.107 9.134 5.952
579 H ALA 73 H ALA 73 34.922 10.372 1.489
580 HA ALA 73 HA ALA 73 33.707 11.437 -0.834
581 HB1 ALA 73 1HB ALA 73 35.904 12.120 -0.493
582 HB2 ALA 73 2HB ALA 73 36.472 10.477 -0.195
583 HB3 ALA 73 3HB ALA 73 36.036 10.976 -1.829
584 H THR 74 H THR 74 35.112 8.249 -0.127
585 HA THR 74 HA THR 74 34.541 7.164 -2.695
586 HB THR 74 HB THR 74 35.112 5.752 -0.082
587 HG1 THR 74 HG1 THR 74 37.184 5.478 -1.440
588 HG21 THR 74 3HG2 THR 74 33.992 4.246 -1.615
589 HG22 THR 74 1HG2 THR 74 35.702 3.826 -1.522
590 HG23 THR 74 2HG2 THR 74 35.086 4.712 -2.917
591 H VAL 75 H VAL 75 32.914 7.012 0.449
592 HA VAL 75 HA VAL 75 30.920 5.175 -0.169
593 HB VAL 75 HB VAL 75 30.702 7.582 1.645
594 HG11 VAL 75 1HG1 VAL 75 28.520 6.948 1.535
595 HG12 VAL 75 2HG1 VAL 75 28.908 5.285 1.090
596 HG13 VAL 75 3HG1 VAL 75 29.068 5.812 2.766
597 HG21 VAL 75 3HG2 VAL 75 32.131 6.523 2.977
598 HG22 VAL 75 1HG2 VAL 75 30.995 5.179 3.090
599 HG23 VAL 75 2HG2 VAL 75 32.240 5.179 1.841
600 H GLY 76 H GLY 76 31.043 8.665 -0.736
601 HA2 GLY 76 1HA GLY 76 28.406 9.069 -1.557
602 HA3 GLY 76 2HA GLY 76 29.782 10.025 -2.087
603 H ARG 77 H ARG 77 31.208 7.969 -3.413
604 HA ARG 77 HA ARG 77 30.118 8.114 -5.969
605 HB2 ARG 77 1HB ARG 77 32.164 6.267 -4.755
606 HB3 ARG 77 2HB ARG 77 31.716 6.168 -6.453
607 HG2 ARG 77 1HG ARG 77 32.332 8.608 -6.632
608 HG3 ARG 77 2HG ARG 77 33.028 8.456 -5.018
609 HD2 ARG 77 1HD ARG 77 34.726 8.180 -6.757
610 HD3 ARG 77 2HD ARG 77 34.522 6.705 -5.812
611 HE ARG 77 HE ARG 77 32.863 6.522 -8.044
612 HH11 ARG 77 2HH1 ARG 77 36.262 6.664 -7.304
613 HH12 ARG 77 1HH1 ARG 77 36.736 5.743 -8.693
614 HH21 ARG 77 2HH2 ARG 77 33.475 5.308 -9.876
615 HH22 ARG 77 1HH2 ARG 77 35.150 4.973 -10.156
616 H ASN 78 H ASN 78 29.674 5.732 -3.441
617 HA ASN 78 HA ASN 78 28.482 3.717 -5.023
618 HB2 ASN 78 1HB ASN 78 28.895 4.248 -2.181
619 HB3 ASN 78 2HB ASN 78 27.367 3.433 -2.503
620 HD21 ASN 78 2HD2 ASN 78 30.815 3.201 -2.587
621 HD22 ASN 78 1HD2 ASN 78 30.903 1.507 -2.914
622 H VAL 79 H VAL 79 27.323 6.716 -3.808
623 HA VAL 79 HA VAL 79 24.556 5.962 -4.488
624 HB VAL 79 HB VAL 79 23.997 8.113 -3.184
625 HG11 VAL 79 1HG1 VAL 79 23.584 5.750 -2.457
626 HG12 VAL 79 2HG1 VAL 79 25.118 5.818 -1.587
627 HG13 VAL 79 3HG1 VAL 79 23.800 6.903 -1.141
628 HG21 VAL 79 3HG2 VAL 79 25.630 8.667 -1.412
629 HG22 VAL 79 1HG2 VAL 79 26.794 7.591 -2.184
630 HG23 VAL 79 2HG2 VAL 79 26.228 9.031 -3.030
631 H GLY 80 H GLY 80 26.982 7.103 -6.084
632 HA2 GLY 80 1HA GLY 80 27.029 8.298 -8.069
633 HA3 GLY 80 2HA GLY 80 25.363 8.777 -7.781
634 H PHE 81 H PHE 81 26.963 9.459 -5.005
635 HA PHE 81 HA PHE 81 27.072 12.283 -5.653
636 HB2 PHE 81 1HB PHE 81 27.504 10.816 -3.043
637 HB3 PHE 81 2HB PHE 81 27.494 12.567 -3.219
638 HD1 PHE 81 HD2 PHE 81 25.199 12.376 -5.386
639 HD2 PHE 81 HD1 PHE 81 25.697 10.923 -1.416
640 HE1 PHE 81 HE2 PHE 81 22.758 12.391 -5.078
641 HE2 PHE 81 HE1 PHE 81 23.257 10.935 -1.102
642 HZ PHE 81 HZ PHE 81 21.784 11.671 -2.934
643 H ASP 82 H ASP 82 28.854 13.187 -6.417
644 HA ASP 82 HA ASP 82 31.435 11.894 -6.008
645 HB2 ASP 82 1HB ASP 82 30.456 14.074 -7.836
646 HB3 ASP 82 2HB ASP 82 32.178 13.781 -7.609
647 H ASP 83 H ASP 83 29.689 14.780 -5.106
648 HA ASP 83 HA ASP 83 32.040 15.978 -3.878
649 HB2 ASP 83 1HB ASP 83 29.192 16.874 -4.258
650 HB3 ASP 83 2HB ASP 83 30.284 17.736 -3.178
651 H GLN 84 H GLN 84 32.642 15.463 -1.890
652 HA GLN 84 HA GLN 84 31.140 13.830 -0.163
653 HB2 GLN 84 1HB GLN 84 32.872 14.398 1.528
654 HB3 GLN 84 2HB GLN 84 33.545 13.872 -0.010
655 HG2 GLN 84 1HG GLN 84 34.013 16.171 -0.620
656 HG3 GLN 84 2HG GLN 84 33.280 16.735 0.882
657 HE21 GLN 84 2HE2 GLN 84 34.260 15.217 2.791
658 HE22 GLN 84 1HE2 GLN 84 35.984 15.299 2.865
659 H LEU 85 H LEU 85 31.534 17.319 -0.361
660 HA LEU 85 HA LEU 85 30.260 17.935 2.094
661 HB2 LEU 85 1HB LEU 85 30.649 19.567 -0.408
662 HB3 LEU 85 2HB LEU 85 30.012 20.210 1.104
663 HG LEU 85 HG LEU 85 32.726 18.930 0.952
664 HD11 LEU 85 1HD1 LEU 85 33.160 20.588 -0.545
665 HD12 LEU 85 2HD1 LEU 85 33.382 21.491 0.953
666 HD13 LEU 85 3HD1 LEU 85 31.869 21.628 0.058
667 HD21 LEU 85 3HD2 LEU 85 31.168 19.819 3.057
668 HD22 LEU 85 1HD2 LEU 85 32.295 21.146 2.774
669 HD23 LEU 85 2HD2 LEU 85 32.907 19.523 3.092
670 H TYR 86 H TYR 86 29.098 17.364 -1.159
671 HA TYR 86 HA TYR 86 26.498 18.400 -0.851
672 HB2 TYR 86 1HB TYR 86 27.497 17.851 -3.040
673 HB3 TYR 86 2HB TYR 86 27.426 16.139 -2.636
674 HD1 TYR 86 HD2 TYR 86 25.164 15.068 -2.300
675 HD2 TYR 86 HD1 TYR 86 25.627 18.964 -3.948
676 HE1 TYR 86 HE2 TYR 86 22.890 14.940 -3.229
677 HE2 TYR 86 HE1 TYR 86 23.354 18.846 -4.880
678 HH TYR 86 HH TYR 86 21.440 17.689 -4.925
679 H PHE 87 H PHE 87 27.759 15.098 -0.465
680 HA PHE 87 HA PHE 87 25.288 13.948 0.292
681 HB2 PHE 87 1HB PHE 87 26.987 12.483 -0.505
682 HB3 PHE 87 2HB PHE 87 28.148 13.072 0.679
683 HD1 PHE 87 HD2 PHE 87 24.656 11.767 0.881
684 HD2 PHE 87 HD1 PHE 87 28.689 11.454 2.203
685 HE1 PHE 87 HE2 PHE 87 24.010 9.950 2.410
686 HE2 PHE 87 HE1 PHE 87 28.051 9.636 3.733
687 HZ PHE 87 HZ PHE 87 25.708 8.883 3.839
688 H SER 88 H SER 88 28.015 15.217 2.163
689 HA SER 88 HA SER 88 27.000 14.534 4.707
690 HB2 SER 88 1HB SER 88 28.714 15.944 5.604
691 HB3 SER 88 2HB SER 88 29.385 15.182 4.162
692 HG SER 88 HG SER 88 28.616 17.201 3.077
693 H ARG 89 H ARG 89 26.641 17.392 2.675
694 HA ARG 89 HA ARG 89 25.394 19.061 4.557
695 HB2 ARG 89 1HB ARG 89 25.515 18.959 1.576
696 HB3 ARG 89 2HB ARG 89 24.326 20.014 2.328
697 HG2 ARG 89 1HG ARG 89 25.958 21.345 3.326
698 HG3 ARG 89 2HG ARG 89 27.212 20.121 3.118
699 HD2 ARG 89 1HD ARG 89 27.421 22.037 1.554
700 HD3 ARG 89 2HD ARG 89 27.250 20.479 0.746
701 HE ARG 89 HE ARG 89 25.273 21.203 -0.148
702 HH11 ARG 89 2HH1 ARG 89 26.161 23.292 2.491
703 HH12 ARG 89 1HH1 ARG 89 24.900 24.439 2.179
704 HH21 ARG 89 2HH2 ARG 89 23.609 22.705 -0.569
705 HH22 ARG 89 1HH2 ARG 89 23.448 24.103 0.439
706 H VAL 90 H VAL 90 23.977 16.921 2.089
707 HA VAL 90 HA VAL 90 21.290 17.410 2.883
708 HB VAL 90 HB VAL 90 22.433 15.106 1.297
709 HG11 VAL 90 1HG1 VAL 90 19.602 16.010 1.771
710 HG12 VAL 90 2HG1 VAL 90 20.067 14.947 0.441
711 HG13 VAL 90 3HG1 VAL 90 20.311 14.431 2.110
712 HG21 VAL 90 3HG2 VAL 90 21.040 17.580 0.287
713 HG22 VAL 90 1HG2 VAL 90 22.793 17.404 0.363
714 HG23 VAL 90 2HG2 VAL 90 21.843 16.331 -0.665
715 H PHE 91 H PHE 91 23.579 14.772 3.514
716 HA PHE 91 HA PHE 91 21.842 13.139 4.991
717 HB2 PHE 91 1HB PHE 91 23.933 12.261 4.161
718 HB3 PHE 91 2HB PHE 91 24.849 13.425 5.114
719 HD1 PHE 91 HD1 PHE 91 25.036 13.173 7.539
720 HD2 PHE 91 HD2 PHE 91 23.041 10.275 5.143
721 HE1 PHE 91 HE1 PHE 91 25.159 11.560 9.393
722 HE2 PHE 91 HE2 PHE 91 23.160 8.658 6.994
723 HZ PHE 91 HZ PHE 91 24.219 9.300 9.123
724 H LYS 92 H LYS 92 23.866 15.855 5.931
725 HA LYS 92 HA LYS 92 23.752 15.585 8.704
726 HB2 LYS 92 1HB LYS 92 25.229 17.183 7.599
727 HB3 LYS 92 2HB LYS 92 23.842 18.107 7.038
728 HG2 LYS 92 1HG LYS 92 23.286 18.286 9.576
729 HG3 LYS 92 2HG LYS 92 24.995 17.895 9.779
730 HD2 LYS 92 1HD LYS 92 25.234 20.138 9.626
731 HD3 LYS 92 2HD LYS 92 25.177 19.807 7.894
732 HE2 LYS 92 1HE LYS 92 22.838 20.340 7.812
733 HE3 LYS 92 2HE LYS 92 22.762 20.481 9.568
734 HZ1 LYS 92 3HZ LYS 92 24.753 22.210 8.708
735 HZ2 LYS 92 1HZ LYS 92 23.237 22.617 9.338
736 HZ3 LYS 92 2HZ LYS 92 23.442 22.451 7.667
737 H LYS 93 H LYS 93 21.573 17.351 6.519
738 HA LYS 93 HA LYS 93 19.789 18.106 8.632
739 HB2 LYS 93 1HB LYS 93 19.297 18.129 5.650
740 HB3 LYS 93 2HB LYS 93 18.383 19.006 6.870
741 HG2 LYS 93 1HG LYS 93 20.168 20.481 7.296
742 HG3 LYS 93 2HG LYS 93 21.317 19.463 6.423
743 HD2 LYS 93 1HD LYS 93 19.835 19.897 4.371
744 HD3 LYS 93 2HD LYS 93 19.134 21.207 5.324
745 HE2 LYS 93 1HE LYS 93 21.569 21.955 5.690
746 HE3 LYS 93 2HE LYS 93 21.950 20.888 4.340
747 HZ1 LYS 93 3HZ LYS 93 20.450 23.401 4.357
748 HZ2 LYS 93 1HZ LYS 93 19.998 22.219 3.234
749 HZ3 LYS 93 2HZ LYS 93 21.577 22.824 3.235
750 H CYS 94 H CYS 94 20.111 15.398 6.502
751 HA CYS 94 HA CYS 94 17.504 14.417 6.460
752 HB2 CYS 94 1HB CYS 94 19.740 13.589 5.311
753 HB3 CYS 94 2HB CYS 94 19.787 12.505 6.697
754 HG CYS 94 HG CYS 94 17.381 12.656 4.276
755 H THR 95 H THR 95 20.123 13.714 8.763
756 HA THR 95 HA THR 95 18.125 12.539 10.576
757 HB THR 95 HB THR 95 20.002 11.465 11.736
758 HG1 THR 95 HG1 THR 95 22.077 11.596 10.446
759 HG21 THR 95 3HG2 THR 95 18.886 10.370 9.781
760 HG22 THR 95 1HG2 THR 95 20.538 9.828 10.069
761 HG23 THR 95 2HG2 THR 95 20.199 10.967 8.767
762 H GLY 96 H GLY 96 19.934 15.317 10.066
763 HA2 GLY 96 1HA GLY 96 19.703 17.250 11.415
764 HA3 GLY 96 2HA GLY 96 19.364 16.216 12.795
765 H ALA 97 H ALA 97 21.862 14.691 11.507
766 HA ALA 97 HA ALA 97 23.931 16.440 12.631
767 HB1 ALA 97 1HB ALA 97 24.099 13.550 13.294
768 HB2 ALA 97 2HB ALA 97 24.682 14.954 14.188
769 HB3 ALA 97 3HB ALA 97 22.966 14.546 14.208
770 H SER 98 H SER 98 26.012 16.116 11.808
771 HA SER 98 HA SER 98 26.144 15.241 9.129
772 HB2 SER 98 1HB SER 98 28.768 15.343 9.917
773 HB3 SER 98 2HB SER 98 27.826 16.732 9.376
774 HG SER 98 HG SER 98 28.535 17.381 11.304
775 HA PRO 99 HA PRO 99 27.186 10.986 9.336
776 HB2 PRO 99 1HB PRO 99 29.133 10.746 7.459
777 HB3 PRO 99 2HB PRO 99 27.435 11.023 7.052
778 HG2 PRO 99 1HG PRO 99 29.692 12.984 7.198
779 HG3 PRO 99 2HG PRO 99 28.410 12.841 5.981
780 HD2 PRO 99 1HD PRO 99 28.333 14.676 7.971
781 HD3 PRO 99 2HD PRO 99 26.867 13.937 7.296
782 H SER 100 H SER 100 29.906 13.224 9.526
783 HA SER 100 HA SER 100 31.814 11.351 10.459
784 HB2 SER 100 1HB SER 100 32.247 13.676 9.476
785 HB3 SER 100 2HB SER 100 31.854 14.304 11.076
786 HG SER 100 HG SER 100 34.135 13.143 10.201
787 H GLU 101 H GLU 101 29.424 13.362 12.050
788 HA GLU 101 HA GLU 101 30.411 12.912 14.698
789 HB2 GLU 101 1HB GLU 101 29.025 14.882 14.028
790 HB3 GLU 101 2HB GLU 101 27.649 13.802 13.854
791 HG2 GLU 101 1HG GLU 101 27.233 13.837 16.031
792 HG3 GLU 101 2HG GLU 101 28.915 13.496 16.432
793 H PHE 102 H PHE 102 27.705 11.604 12.802
794 HA PHE 102 HA PHE 102 26.683 9.886 14.757
795 HB2 PHE 102 1HB PHE 102 25.479 10.442 12.685
796 HB3 PHE 102 2HB PHE 102 26.662 9.532 11.752
797 HD1 PHE 102 HD1 PHE 102 26.694 7.106 11.808
798 HD2 PHE 102 HD2 PHE 102 23.794 9.329 13.992
799 HE1 PHE 102 HE1 PHE 102 25.352 5.064 12.098
800 HE2 PHE 102 HE2 PHE 102 22.449 7.290 14.287
801 HZ PHE 102 HZ PHE 102 23.227 5.154 13.340
802 H ARG 103 H ARG 103 29.090 9.288 12.215
803 HA ARG 103 HA ARG 103 29.510 6.565 12.873
804 HB2 ARG 103 1HB ARG 103 31.336 6.630 11.356
805 HB3 ARG 103 2HB ARG 103 30.108 7.701 10.695
806 HG2 ARG 103 1HG ARG 103 31.317 9.634 11.563
807 HG3 ARG 103 2HG ARG 103 32.545 8.562 12.239
808 HD2 ARG 103 1HD ARG 103 31.845 8.662 9.311
809 HD3 ARG 103 2HD ARG 103 33.133 9.623 10.037
810 HE ARG 103 HE ARG 103 33.596 6.990 10.761
811 HH11 ARG 103 2HH1 ARG 103 33.423 8.865 7.833
812 HH12 ARG 103 1HH1 ARG 103 34.549 7.868 6.973
813 HH21 ARG 103 2HH2 ARG 103 35.080 5.669 9.640
814 HH22 ARG 103 1HH2 ARG 103 35.490 6.050 8.002
815 H ALA 104 H ALA 104 30.848 9.563 14.056
816 HA ALA 104 HA ALA 104 33.142 8.537 15.328
817 HB1 ALA 104 1HB ALA 104 31.514 11.018 15.620
818 HB2 ALA 104 2HB ALA 104 32.744 10.643 16.828
819 HB3 ALA 104 3HB ALA 104 33.199 10.826 15.134
820 H GLY 105 H GLY 105 29.776 8.591 16.234
821 HA2 GLY 105 1HA GLY 105 28.823 7.139 17.826
822 HA3 GLY 105 2HA GLY 105 30.412 6.923 18.547
823 H CYS 106 H CYS 106 30.380 10.090 18.201
824 HA CYS 106 HA CYS 106 29.586 10.539 20.946
825 HB2 CYS 106 1HB CYS 106 31.631 11.543 19.648
826 HB3 CYS 106 2HB CYS 106 30.455 12.729 19.094
827 HG CYS 106 HG CYS 106 30.738 14.247 21.132
828 H GLU 107 H GLU 107 27.846 11.667 21.657
829 HA GLU 107 HA GLU 107 26.223 13.236 19.866
830 HB2 GLU 107 1HB GLU 107 25.458 10.921 19.402
831 HB3 GLU 107 2HB GLU 107 25.049 10.740 21.102
832 HG2 GLU 107 1HG GLU 107 23.320 12.342 20.956
833 HG3 GLU 107 2HG GLU 107 23.856 12.877 19.364
Start of MODEL 11
1 H1 MET 1 H MET 1 1.848 -2.535 0.792
2 HA MET 1 HA MET 1 1.468 0.051 -0.565
3 HB2 MET 1 1HB MET 1 3.796 -0.604 0.271
4 HB3 MET 1 2HB MET 1 3.789 -1.820 -1.000
5 HG2 MET 1 1HG MET 1 3.723 -0.192 -2.698
6 HG3 MET 1 2HG MET 1 3.319 1.089 -1.558
7 HE1 MET 1 3HE MET 1 6.528 2.768 -1.565
8 HE2 MET 1 1HE MET 1 4.796 2.752 -1.897
9 HE3 MET 1 2HE MET 1 5.378 2.561 -0.244
10 H ASP 2 H ASP 2 1.112 0.092 -2.787
11 HA ASP 2 HA ASP 2 -0.240 -2.221 -3.835
12 HB2 ASP 2 1HB ASP 2 -0.722 0.364 -4.176
13 HB3 ASP 2 2HB ASP 2 0.371 0.151 -5.541
14 H ASN 3 H ASN 3 0.313 -3.411 -5.672
15 HA ASN 3 HA ASN 3 3.027 -4.042 -5.973
16 HB2 ASN 3 1HB ASN 3 2.287 -5.370 -7.942
17 HB3 ASN 3 2HB ASN 3 1.304 -5.660 -6.509
18 HD21 ASN 3 2HD2 ASN 3 1.299 -4.832 -9.761
19 HD22 ASN 3 1HD2 ASN 3 -0.359 -4.368 -9.903
20 H ARG 4 H ARG 4 0.862 -2.095 -8.000
21 HA ARG 4 HA ARG 4 2.656 -1.563 -10.078
22 HB2 ARG 4 1HB ARG 4 0.429 0.186 -9.014
23 HB3 ARG 4 2HB ARG 4 1.221 0.381 -10.572
24 HG2 ARG 4 1HG ARG 4 -0.212 -2.141 -9.795
25 HG3 ARG 4 2HG ARG 4 -1.022 -0.781 -10.575
26 HD2 ARG 4 1HD ARG 4 0.253 -1.004 -12.533
27 HD3 ARG 4 2HD ARG 4 1.451 -2.024 -11.737
28 HE ARG 4 HE ARG 4 0.123 -3.844 -12.147
29 HH11 ARG 4 2HH1 ARG 4 -1.741 -0.940 -12.608
30 HH12 ARG 4 1HH1 ARG 4 -3.110 -1.768 -13.271
31 HH21 ARG 4 2HH2 ARG 4 -1.673 -4.946 -13.020
32 HH22 ARG 4 1HH2 ARG 4 -3.071 -4.047 -13.505
33 H VAL 5 H VAL 5 1.965 0.307 -7.131
34 HA VAL 5 HA VAL 5 3.812 2.376 -7.647
35 HB VAL 5 HB VAL 5 2.868 1.424 -4.941
36 HG11 VAL 5 1HG1 VAL 5 4.781 3.288 -5.536
37 HG12 VAL 5 2HG1 VAL 5 3.326 4.276 -5.387
38 HG13 VAL 5 3HG1 VAL 5 3.831 3.240 -4.052
39 HG21 VAL 5 3HG2 VAL 5 1.070 3.062 -5.165
40 HG22 VAL 5 1HG2 VAL 5 1.611 3.440 -6.801
41 HG23 VAL 5 2HG2 VAL 5 0.973 1.838 -6.431
42 H ARG 6 H ARG 6 4.097 -0.707 -5.956
43 HA ARG 6 HA ARG 6 6.692 -0.256 -4.909
44 HB2 ARG 6 1HB ARG 6 4.860 -2.095 -4.378
45 HB3 ARG 6 2HB ARG 6 5.766 -3.014 -5.573
46 HG2 ARG 6 1HG ARG 6 7.533 -3.308 -4.207
47 HG3 ARG 6 2HG ARG 6 7.366 -1.713 -3.470
48 HD2 ARG 6 1HD ARG 6 6.786 -3.080 -1.714
49 HD3 ARG 6 2HD ARG 6 5.207 -2.745 -2.423
50 HE ARG 6 HE ARG 6 6.368 -5.093 -3.531
51 HH11 ARG 6 2HH1 ARG 6 4.712 -3.867 -0.724
52 HH12 ARG 6 1HH1 ARG 6 4.037 -5.403 -0.291
53 HH21 ARG 6 2HH2 ARG 6 5.485 -7.120 -2.970
54 HH22 ARG 6 1HH2 ARG 6 4.478 -7.252 -1.568
55 H GLU 7 H GLU 7 5.495 -1.550 -7.946
56 HA GLU 7 HA GLU 7 7.894 -2.663 -8.894
57 HB2 GLU 7 1HB GLU 7 5.384 -2.672 -9.811
58 HB3 GLU 7 2HB GLU 7 6.029 -1.395 -10.833
59 HG2 GLU 7 1HG GLU 7 6.449 -3.181 -12.162
60 HG3 GLU 7 2HG GLU 7 7.946 -3.162 -11.232
61 H ALA 8 H ALA 8 6.597 0.608 -9.042
62 HA ALA 8 HA ALA 8 8.399 1.720 -10.864
63 HB1 ALA 8 1HB ALA 8 6.428 2.678 -8.996
64 HB2 ALA 8 2HB ALA 8 7.847 3.727 -9.002
65 HB3 ALA 8 3HB ALA 8 6.988 3.397 -10.507
66 H CYS 9 H CYS 9 8.689 1.123 -7.408
67 HA CYS 9 HA CYS 9 10.996 2.628 -6.906
68 HB2 CYS 9 1HB CYS 9 9.701 1.758 -5.072
69 HB3 CYS 9 2HB CYS 9 9.966 0.102 -5.605
70 HG CYS 9 HG CYS 9 11.757 -0.128 -3.756
71 H GLN 10 H GLN 10 10.565 -0.576 -8.262
72 HA GLN 10 HA GLN 10 13.223 -1.468 -8.067
73 HB2 GLN 10 1HB GLN 10 11.336 -2.954 -8.589
74 HB3 GLN 10 2HB GLN 10 11.139 -2.159 -10.145
75 HG2 GLN 10 1HG GLN 10 12.319 -4.334 -10.257
76 HG3 GLN 10 2HG GLN 10 13.239 -2.981 -10.914
77 HE21 GLN 10 2HE2 GLN 10 13.152 -5.499 -8.631
78 HE22 GLN 10 1HE2 GLN 10 14.661 -5.169 -7.857
79 H TYR 11 H TYR 11 11.530 0.327 -10.607
80 HA TYR 11 HA TYR 11 13.724 0.379 -12.409
81 HB2 TYR 11 1HB TYR 11 11.518 0.724 -13.283
82 HB3 TYR 11 2HB TYR 11 11.236 2.080 -12.197
83 HD1 TYR 11 HD2 TYR 11 13.811 1.101 -14.734
84 HD2 TYR 11 HD1 TYR 11 11.266 4.147 -13.202
85 HE1 TYR 11 HE2 TYR 11 14.631 2.647 -16.462
86 HE2 TYR 11 HE1 TYR 11 12.077 5.701 -14.927
87 HH TYR 11 HH TYR 11 14.376 5.830 -16.353
88 H ILE 12 H ILE 12 12.436 2.754 -10.101
89 HA ILE 12 HA ILE 12 14.285 4.795 -10.629
90 HB ILE 12 HB ILE 12 12.882 4.196 -8.022
91 HG12 ILE 12 1HG1 ILE 12 12.066 6.132 -10.193
92 HG13 ILE 12 2HG1 ILE 12 11.424 4.497 -10.068
93 HG21 ILE 12 1HG2 ILE 12 14.028 5.899 -7.181
94 HG22 ILE 12 2HG2 ILE 12 14.825 6.170 -8.730
95 HG23 ILE 12 3HG2 ILE 12 13.286 6.957 -8.382
96 HD11 ILE 12 3HD1 ILE 12 9.839 5.342 -8.777
97 HD12 ILE 12 1HD1 ILE 12 11.074 5.567 -7.538
98 HD13 ILE 12 2HD1 ILE 12 10.679 6.886 -8.640
99 H SER 13 H SER 13 14.418 2.031 -8.447
100 HA SER 13 HA SER 13 16.703 2.756 -6.998
101 HB2 SER 13 1HB SER 13 16.802 0.491 -6.278
102 HB3 SER 13 2HB SER 13 15.090 0.840 -6.518
103 HG SER 13 HG SER 13 15.130 -0.834 -7.779
104 H ASP 14 H ASP 14 16.346 1.001 -10.047
105 HA ASP 14 HA ASP 14 19.092 0.380 -10.363
106 HB2 ASP 14 1HB ASP 14 16.678 0.344 -12.106
107 HB3 ASP 14 2HB ASP 14 18.251 0.324 -12.897
108 H HIS 15 H HIS 15 17.111 3.129 -11.286
109 HA HIS 15 HA HIS 15 19.359 4.371 -12.675
110 HB2 HIS 15 1HB HIS 15 16.428 4.971 -12.469
111 HB3 HIS 15 2HB HIS 15 17.547 6.229 -12.987
112 HD1 HIS 15 HD1 HIS 15 17.983 6.304 -15.420
113 HD2 HIS 15 HD2 HIS 15 16.675 2.554 -14.198
114 HE1 HIS 15 HE1 HIS 15 17.749 4.953 -17.529
115 H LEU 16 H LEU 16 19.011 3.955 -9.656
116 HA LEU 16 HA LEU 16 18.649 6.428 -8.398
117 HB2 LEU 16 1HB LEU 16 18.769 4.141 -7.333
118 HB3 LEU 16 2HB LEU 16 20.522 4.263 -7.470
119 HG LEU 16 HG LEU 16 20.511 6.202 -5.985
120 HD11 LEU 16 1HD1 LEU 16 17.617 6.003 -6.422
121 HD12 LEU 16 2HD1 LEU 16 18.616 7.401 -6.027
122 HD13 LEU 16 3HD1 LEU 16 18.100 6.298 -4.752
123 HD21 LEU 16 3HD2 LEU 16 19.185 3.679 -5.047
124 HD22 LEU 16 1HD2 LEU 16 19.572 4.991 -3.933
125 HD23 LEU 16 2HD2 LEU 16 20.859 4.196 -4.839
126 H ALA 17 H ALA 17 21.371 5.093 -10.100
127 HA ALA 17 HA ALA 17 23.142 7.222 -9.174
128 HB1 ALA 17 1HB ALA 17 24.594 5.829 -11.008
129 HB2 ALA 17 2HB ALA 17 24.539 5.471 -9.281
130 HB3 ALA 17 3HB ALA 17 23.501 4.585 -10.399
131 H ASP 18 H ASP 18 21.118 6.429 -11.832
132 HA ASP 18 HA ASP 18 22.390 7.840 -13.901
133 HB2 ASP 18 1HB ASP 18 20.263 6.245 -13.853
134 HB3 ASP 18 2HB ASP 18 19.411 7.785 -13.775
135 H SER 19 H SER 19 22.196 9.931 -14.651
136 HA SER 19 HA SER 19 21.471 11.894 -12.640
137 HB2 SER 19 1HB SER 19 22.624 12.366 -15.397
138 HB3 SER 19 2HB SER 19 22.586 13.506 -14.052
139 HG SER 19 HG SER 19 24.364 12.647 -13.364
140 H ASN 20 H ASN 20 20.662 11.239 -16.046
141 HA ASN 20 HA ASN 20 18.492 13.138 -16.006
142 HB2 ASN 20 1HB ASN 20 19.536 11.201 -18.066
143 HB3 ASN 20 2HB ASN 20 18.053 12.115 -18.322
144 HD21 ASN 20 2HD2 ASN 20 20.564 12.211 -19.781
145 HD22 ASN 20 1HD2 ASN 20 21.111 13.847 -19.692
146 H PHE 21 H PHE 21 16.892 12.525 -14.636
147 HA PHE 21 HA PHE 21 15.799 9.814 -14.900
148 HB2 PHE 21 1HB PHE 21 16.318 10.359 -12.626
149 HB3 PHE 21 2HB PHE 21 15.496 11.911 -12.749
150 HD1 PHE 21 HD1 PHE 21 14.396 8.513 -13.789
151 HD2 PHE 21 HD2 PHE 21 13.765 11.849 -11.222
152 HE1 PHE 21 HE1 PHE 21 12.325 7.476 -12.956
153 HE2 PHE 21 HE2 PHE 21 11.695 10.817 -10.384
154 HZ PHE 21 HZ PHE 21 10.973 8.628 -11.251
155 H ASP 22 H ASP 22 13.878 9.460 -15.815
156 HA ASP 22 HA ASP 22 12.196 11.799 -16.437
157 HB2 ASP 22 1HB ASP 22 13.390 10.210 -18.270
158 HB3 ASP 22 2HB ASP 22 11.872 9.343 -18.058
159 H ILE 23 H ILE 23 10.315 11.844 -15.417
160 HA ILE 23 HA ILE 23 9.376 9.765 -13.775
161 HB ILE 23 HB ILE 23 8.810 12.194 -13.516
162 HG12 ILE 23 1HG1 ILE 23 6.480 10.265 -13.623
163 HG13 ILE 23 2HG1 ILE 23 7.605 10.447 -12.281
164 HG21 ILE 23 1HG2 ILE 23 8.259 12.545 -15.923
165 HG22 ILE 23 2HG2 ILE 23 6.761 11.653 -15.657
166 HG23 ILE 23 3HG2 ILE 23 7.047 13.171 -14.805
167 HD11 ILE 23 3HD1 ILE 23 6.672 13.000 -12.652
168 HD12 ILE 23 1HD1 ILE 23 5.254 12.002 -12.974
169 HD13 ILE 23 2HD1 ILE 23 6.107 11.852 -11.437
170 H ALA 24 H ALA 24 8.817 10.523 -17.123
171 HA ALA 24 HA ALA 24 6.436 9.131 -17.572
172 HB1 ALA 24 1HB ALA 24 6.902 10.270 -19.451
173 HB2 ALA 24 2HB ALA 24 8.646 10.139 -19.222
174 HB3 ALA 24 3HB ALA 24 7.745 8.793 -19.920
175 H SER 25 H SER 25 9.793 8.012 -17.570
176 HA SER 25 HA SER 25 9.303 5.402 -18.494
177 HB2 SER 25 1HB SER 25 11.512 6.445 -16.705
178 HB3 SER 25 2HB SER 25 11.511 4.859 -17.478
179 HG SER 25 HG SER 25 11.823 5.773 -19.402
180 H VAL 26 H VAL 26 9.016 6.868 -15.342
181 HA VAL 26 HA VAL 26 8.928 4.494 -13.805
182 HB VAL 26 HB VAL 26 7.636 7.156 -13.195
183 HG11 VAL 26 1HG1 VAL 26 8.476 4.945 -11.324
184 HG12 VAL 26 2HG1 VAL 26 7.682 6.460 -10.886
185 HG13 VAL 26 3HG1 VAL 26 6.818 5.252 -11.839
186 HG21 VAL 26 3HG2 VAL 26 9.749 7.899 -13.165
187 HG22 VAL 26 1HG2 VAL 26 9.904 6.977 -11.670
188 HG23 VAL 26 2HG2 VAL 26 10.419 6.269 -13.200
189 H ALA 27 H ALA 27 6.350 6.543 -15.151
190 HA ALA 27 HA ALA 27 4.215 4.931 -14.224
191 HB1 ALA 27 1HB ALA 27 4.487 7.383 -15.556
192 HB2 ALA 27 2HB ALA 27 3.507 6.360 -16.608
193 HB3 ALA 27 3HB ALA 27 3.006 6.648 -14.941
194 H GLN 28 H GLN 28 5.987 5.061 -17.284
195 HA GLN 28 HA GLN 28 4.390 3.237 -18.705
196 HB2 GLN 28 1HB GLN 28 5.937 4.624 -19.899
197 HB3 GLN 28 2HB GLN 28 7.300 3.988 -18.987
198 HG2 GLN 28 1HG GLN 28 7.194 3.089 -21.260
199 HG3 GLN 28 2HG GLN 28 7.046 1.831 -20.034
200 HE21 GLN 28 2HE2 GLN 28 5.974 0.368 -21.281
201 HE22 GLN 28 1HE2 GLN 28 4.368 0.608 -21.871
202 H HIS 29 H HIS 29 7.117 2.783 -16.529
203 HA HIS 29 HA HIS 29 7.660 0.093 -17.035
204 HB2 HIS 29 1HB HIS 29 9.194 1.321 -15.691
205 HB3 HIS 29 2HB HIS 29 7.941 1.753 -14.532
206 HD1 HIS 29 HD1 HIS 29 8.581 -1.746 -15.805
207 HD2 HIS 29 HD2 HIS 29 8.993 0.496 -12.331
208 HE1 HIS 29 HE1 HIS 29 9.221 -3.392 -14.014
209 H VAL 30 H VAL 30 5.182 1.602 -15.060
210 HA VAL 30 HA VAL 30 4.244 -1.011 -14.136
211 HB VAL 30 HB VAL 30 2.719 0.225 -12.685
212 HG11 VAL 30 1HG1 VAL 30 5.634 0.825 -12.663
213 HG12 VAL 30 2HG1 VAL 30 4.594 1.641 -11.495
214 HG13 VAL 30 3HG1 VAL 30 4.667 -0.121 -11.533
215 HG21 VAL 30 3HG2 VAL 30 2.337 2.121 -14.243
216 HG22 VAL 30 1HG2 VAL 30 2.687 2.629 -12.591
217 HG23 VAL 30 2HG2 VAL 30 3.938 2.736 -13.830
218 H CYS 31 H CYS 31 3.971 0.283 -16.928
219 HA CYS 31 HA CYS 31 2.425 0.427 -18.595
220 HB2 CYS 31 1HB CYS 31 1.186 -1.734 -16.884
221 HB3 CYS 31 2HB CYS 31 0.617 -1.322 -18.497
222 HG CYS 31 HG CYS 31 2.198 -2.931 -19.704
223 H LEU 32 H LEU 32 2.131 2.369 -16.572
224 HA LEU 32 HA LEU 32 -0.721 2.948 -16.874
225 HB2 LEU 32 1HB LEU 32 0.029 1.957 -14.551
226 HB3 LEU 32 2HB LEU 32 0.571 3.610 -14.273
227 HG LEU 32 HG LEU 32 -1.731 4.403 -14.668
228 HD11 LEU 32 1HD1 LEU 32 -3.056 3.057 -15.853
229 HD12 LEU 32 2HD1 LEU 32 -3.310 2.179 -14.345
230 HD13 LEU 32 3HD1 LEU 32 -2.083 1.632 -15.488
231 HD21 LEU 32 3HD2 LEU 32 -0.781 3.666 -12.400
232 HD22 LEU 32 1HD2 LEU 32 -1.813 2.248 -12.584
233 HD23 LEU 32 2HD2 LEU 32 -2.529 3.859 -12.544
234 H SER 33 H SER 33 -1.219 5.252 -16.398
235 HA SER 33 HA SER 33 0.650 6.940 -17.734
236 HB2 SER 33 1HB SER 33 -2.067 7.266 -16.552
237 HB3 SER 33 2HB SER 33 -1.110 8.723 -16.817
238 HG SER 33 HG SER 33 -2.552 7.633 -18.587
239 HA PRO 34 HA PRO 34 2.959 8.678 -14.435
240 HB2 PRO 34 1HB PRO 34 3.163 11.281 -15.178
241 HB3 PRO 34 2HB PRO 34 4.030 9.977 -15.998
242 HG2 PRO 34 1HG PRO 34 1.490 11.352 -16.786
243 HG3 PRO 34 2HG PRO 34 2.872 10.888 -17.797
244 HD2 PRO 34 1HD PRO 34 0.590 9.434 -17.692
245 HD3 PRO 34 2HD PRO 34 2.182 8.694 -17.951
246 H SER 35 H SER 35 0.096 10.577 -15.335
247 HA SER 35 HA SER 35 -0.069 12.017 -12.901
248 HB2 SER 35 1HB SER 35 -2.070 11.443 -15.086
249 HB3 SER 35 2HB SER 35 -2.478 12.407 -13.667
250 HG SER 35 HG SER 35 -1.164 13.150 -15.878
251 H ARG 36 H ARG 36 -1.728 9.109 -14.085
252 HA ARG 36 HA ARG 36 -3.340 8.710 -11.811
253 HB2 ARG 36 1HB ARG 36 -3.607 7.626 -14.083
254 HB3 ARG 36 2HB ARG 36 -2.295 6.545 -13.635
255 HG2 ARG 36 1HG ARG 36 -4.221 5.334 -13.160
256 HG3 ARG 36 2HG ARG 36 -3.717 5.965 -11.591
257 HD2 ARG 36 1HD ARG 36 -5.643 7.518 -13.264
258 HD3 ARG 36 2HD ARG 36 -6.215 6.129 -12.340
259 HE ARG 36 HE ARG 36 -4.800 7.618 -10.540
260 HH11 ARG 36 2HH1 ARG 36 -7.485 8.221 -12.673
261 HH12 ARG 36 1HH1 ARG 36 -8.201 9.418 -11.646
262 HH21 ARG 36 2HH2 ARG 36 -5.733 9.192 -9.179
263 HH22 ARG 36 1HH2 ARG 36 -7.203 9.971 -9.659
264 H LEU 37 H LEU 37 -0.151 7.429 -12.690
265 HA LEU 37 HA LEU 37 0.138 5.803 -10.386
266 HB2 LEU 37 1HB LEU 37 1.438 5.371 -12.365
267 HB3 LEU 37 2HB LEU 37 2.175 6.969 -12.275
268 HG LEU 37 HG LEU 37 3.111 6.147 -10.004
269 HD11 LEU 37 1HD1 LEU 37 3.515 3.503 -10.658
270 HD12 LEU 37 2HD1 LEU 37 1.810 3.759 -11.029
271 HD13 LEU 37 3HD1 LEU 37 2.423 4.112 -9.414
272 HD21 LEU 37 3HD2 LEU 37 5.041 6.016 -11.109
273 HD22 LEU 37 1HD2 LEU 37 4.096 6.225 -12.583
274 HD23 LEU 37 2HD2 LEU 37 4.513 4.605 -12.026
275 H SER 38 H SER 38 1.256 9.069 -11.195
276 HA SER 38 HA SER 38 2.742 9.543 -8.868
277 HB2 SER 38 1HB SER 38 2.824 10.969 -10.901
278 HB3 SER 38 2HB SER 38 1.213 11.573 -10.515
279 HG SER 38 HG SER 38 2.097 12.902 -9.164
280 H HIS 39 H HIS 39 -0.689 9.944 -9.561
281 HA HIS 39 HA HIS 39 -1.426 11.366 -7.267
282 HB2 HIS 39 1HB HIS 39 -2.923 11.060 -9.187
283 HB3 HIS 39 2HB HIS 39 -3.039 9.339 -8.830
284 HD1 HIS 39 HD1 HIS 39 -4.611 12.534 -8.105
285 HD2 HIS 39 HD2 HIS 39 -4.361 8.817 -6.265
286 HE1 HIS 39 HE1 HIS 39 -6.473 12.494 -6.416
287 H LEU 40 H LEU 40 -1.381 7.858 -7.853
288 HA LEU 40 HA LEU 40 -2.189 7.192 -5.203
289 HB2 LEU 40 1HB LEU 40 -1.225 5.722 -7.590
290 HB3 LEU 40 2HB LEU 40 -1.069 4.918 -6.029
291 HG LEU 40 HG LEU 40 -3.659 5.961 -7.174
292 HD11 LEU 40 1HD1 LEU 40 -3.820 3.219 -7.024
293 HD12 LEU 40 2HD1 LEU 40 -2.188 3.494 -7.633
294 HD13 LEU 40 3HD1 LEU 40 -3.574 4.166 -8.492
295 HD21 LEU 40 3HD2 LEU 40 -3.803 5.920 -4.810
296 HD22 LEU 40 1HD2 LEU 40 -2.972 4.368 -4.714
297 HD23 LEU 40 2HD2 LEU 40 -4.602 4.455 -5.383
298 H PHE 41 H PHE 41 0.888 7.663 -6.799
299 HA PHE 41 HA PHE 41 2.561 6.448 -4.904
300 HB2 PHE 41 1HB PHE 41 2.932 7.752 -7.298
301 HB3 PHE 41 2HB PHE 41 3.665 8.863 -6.146
302 HD1 PHE 41 HD1 PHE 41 5.580 8.163 -4.792
303 HD2 PHE 41 HD2 PHE 41 3.912 5.628 -7.776
304 HE1 PHE 41 HE1 PHE 41 7.611 6.774 -4.742
305 HE2 PHE 41 HE2 PHE 41 5.939 4.235 -7.731
306 HZ PHE 41 HZ PHE 41 7.792 4.806 -6.212
307 H ARG 42 H ARG 42 1.526 9.838 -5.213
308 HA ARG 42 HA ARG 42 2.866 10.741 -2.891
309 HB2 ARG 42 1HB ARG 42 0.786 11.821 -4.718
310 HB3 ARG 42 2HB ARG 42 0.916 12.561 -3.128
311 HG2 ARG 42 1HG ARG 42 2.790 13.639 -3.664
312 HG3 ARG 42 2HG ARG 42 3.493 12.216 -4.435
313 HD2 ARG 42 1HD ARG 42 3.265 13.527 -6.277
314 HD3 ARG 42 2HD ARG 42 1.662 12.792 -6.273
315 HE ARG 42 HE ARG 42 0.766 14.844 -5.812
316 HH11 ARG 42 2HH1 ARG 42 4.178 14.918 -5.125
317 HH12 ARG 42 1HH1 ARG 42 4.215 16.625 -4.831
318 HH21 ARG 42 2HH2 ARG 42 0.801 17.092 -5.428
319 HH22 ARG 42 1HH2 ARG 42 2.293 17.860 -5.004
320 H GLN 43 H GLN 43 -0.173 9.153 -3.409
321 HA GLN 43 HA GLN 43 -1.290 9.856 -0.855
322 HB2 GLN 43 1HB GLN 43 -2.486 9.132 -3.082
323 HB3 GLN 43 2HB GLN 43 -2.239 7.510 -2.449
324 HG2 GLN 43 1HG GLN 43 -3.519 9.624 -0.768
325 HG3 GLN 43 2HG GLN 43 -4.455 8.728 -1.963
326 HE21 GLN 43 2HE2 GLN 43 -3.596 8.824 1.192
327 HE22 GLN 43 1HE2 GLN 43 -3.825 7.164 1.613
328 H GLN 44 H GLN 44 0.351 7.051 -2.241
329 HA GLN 44 HA GLN 44 0.114 5.510 0.181
330 HB2 GLN 44 1HB GLN 44 1.315 5.101 -2.511
331 HB3 GLN 44 2HB GLN 44 1.937 4.127 -1.185
332 HG2 GLN 44 1HG GLN 44 -0.926 4.276 -2.099
333 HG3 GLN 44 2HG GLN 44 0.195 2.943 -2.369
334 HE21 GLN 44 2HE2 GLN 44 -2.316 2.729 -1.102
335 HE22 GLN 44 1HE2 GLN 44 -2.047 2.242 0.533
336 H LEU 45 H LEU 45 2.620 7.392 -1.441
337 HA LEU 45 HA LEU 45 4.556 6.781 0.639
338 HB2 LEU 45 1HB LEU 45 4.644 8.335 -1.923
339 HB3 LEU 45 2HB LEU 45 5.945 8.455 -0.740
340 HG LEU 45 HG LEU 45 6.541 6.897 -2.492
341 HD11 LEU 45 1HD1 LEU 45 5.911 5.141 -0.162
342 HD12 LEU 45 2HD1 LEU 45 7.021 6.496 0.035
343 HD13 LEU 45 3HD1 LEU 45 7.376 5.230 -1.140
344 HD21 LEU 45 3HD2 LEU 45 5.291 4.881 -2.919
345 HD22 LEU 45 1HD2 LEU 45 4.234 6.276 -3.130
346 HD23 LEU 45 2HD2 LEU 45 4.121 5.298 -1.666
347 H GLY 46 H GLY 46 2.165 9.115 -0.007
348 HA2 GLY 46 1HA GLY 46 1.499 10.968 1.179
349 HA3 GLY 46 2HA GLY 46 2.646 10.494 2.423
350 H ILE 47 H ILE 47 4.182 10.768 -0.543
351 HA ILE 47 HA ILE 47 4.697 13.621 -0.342
352 HB ILE 47 HB ILE 47 7.099 13.409 -0.166
353 HG12 ILE 47 1HG1 ILE 47 6.602 10.435 0.094
354 HG13 ILE 47 2HG1 ILE 47 7.351 11.237 -1.283
355 HG21 ILE 47 1HG2 ILE 47 7.277 12.636 2.147
356 HG22 ILE 47 2HG2 ILE 47 5.827 13.609 1.904
357 HG23 ILE 47 3HG2 ILE 47 5.703 11.853 2.008
358 HD11 ILE 47 3HD1 ILE 47 9.029 10.203 0.103
359 HD12 ILE 47 1HD1 ILE 47 9.193 11.958 0.168
360 HD13 ILE 47 2HD1 ILE 47 8.451 11.091 1.513
361 H SER 48 H SER 48 6.415 14.235 -2.068
362 HA SER 48 HA SER 48 5.447 13.222 -4.574
363 HB2 SER 48 1HB SER 48 6.149 15.649 -3.993
364 HB3 SER 48 2HB SER 48 7.793 15.084 -4.288
365 HG SER 48 HG SER 48 6.181 15.946 -6.082
366 H VAL 49 H VAL 49 6.742 12.323 -6.257
367 HA VAL 49 HA VAL 49 8.320 10.166 -5.524
368 HB VAL 49 HB VAL 49 8.503 11.628 -8.160
369 HG11 VAL 49 1HG1 VAL 49 9.062 9.399 -9.044
370 HG12 VAL 49 2HG1 VAL 49 10.240 9.965 -7.858
371 HG13 VAL 49 3HG1 VAL 49 9.037 8.758 -7.402
372 HG21 VAL 49 3HG2 VAL 49 6.213 11.244 -7.910
373 HG22 VAL 49 1HG2 VAL 49 6.775 9.846 -8.826
374 HG23 VAL 49 2HG2 VAL 49 6.464 9.701 -7.096
375 H LEU 50 H LEU 50 9.301 13.427 -6.488
376 HA LEU 50 HA LEU 50 12.069 12.978 -6.574
377 HB2 LEU 50 1HB LEU 50 10.496 15.060 -7.175
378 HB3 LEU 50 2HB LEU 50 11.102 15.604 -5.612
379 HG LEU 50 HG LEU 50 13.401 15.420 -6.450
380 HD11 LEU 50 1HD1 LEU 50 12.972 15.303 -9.235
381 HD12 LEU 50 2HD1 LEU 50 12.136 13.923 -8.522
382 HD13 LEU 50 3HD1 LEU 50 13.856 14.165 -8.218
383 HD21 LEU 50 3HD2 LEU 50 12.306 17.556 -6.626
384 HD22 LEU 50 1HD2 LEU 50 11.533 17.079 -8.138
385 HD23 LEU 50 2HD2 LEU 50 13.283 17.291 -8.071
386 H SER 51 H SER 51 9.900 13.728 -3.915
387 HA SER 51 HA SER 51 11.961 14.231 -2.005
388 HB2 SER 51 1HB SER 51 9.000 13.805 -1.876
389 HB3 SER 51 2HB SER 51 9.944 13.724 -0.389
390 HG SER 51 HG SER 51 9.798 15.898 -2.209
391 H TRP 52 H TRP 52 9.861 11.445 -2.680
392 HA TRP 52 HA TRP 52 10.840 9.763 -0.668
393 HB2 TRP 52 1HB TRP 52 8.808 9.169 -1.776
394 HB3 TRP 52 2HB TRP 52 9.596 9.156 -3.352
395 HD1 TRP 52 HD1 TRP 52 9.110 7.025 -0.228
396 HE1 TRP 52 HE1 TRP 52 9.920 4.632 -0.721
397 HE3 TRP 52 HE3 TRP 52 11.263 7.822 -4.796
398 HZ2 TRP 52 HZ2 TRP 52 11.290 3.263 -2.775
399 HZ3 TRP 52 HZ3 TRP 52 12.302 5.918 -5.958
400 HH2 TRP 52 HH2 TRP 52 12.315 3.687 -4.967
401 H ARG 53 H ARG 53 11.937 10.292 -3.985
402 HA ARG 53 HA ARG 53 13.811 8.231 -4.148
403 HB2 ARG 53 1HB ARG 53 13.148 9.503 -6.104
404 HB3 ARG 53 2HB ARG 53 13.840 10.970 -5.423
405 HG2 ARG 53 1HG ARG 53 16.071 9.825 -5.474
406 HG3 ARG 53 2HG ARG 53 15.300 8.528 -6.390
407 HD2 ARG 53 1HD ARG 53 14.893 11.301 -7.351
408 HD3 ARG 53 2HD ARG 53 16.500 10.605 -7.557
409 HE ARG 53 HE ARG 53 14.091 9.865 -8.953
410 HH11 ARG 53 2HH1 ARG 53 17.281 8.865 -7.980
411 HH12 ARG 53 1HH1 ARG 53 17.441 7.693 -9.246
412 HH21 ARG 53 2HH2 ARG 53 14.291 8.325 -10.624
413 HH22 ARG 53 1HH2 ARG 53 15.740 7.387 -10.750
414 H GLU 54 H GLU 54 14.199 11.576 -3.019
415 HA GLU 54 HA GLU 54 16.961 11.379 -2.458
416 HB2 GLU 54 1HB GLU 54 15.341 13.458 -2.623
417 HB3 GLU 54 2HB GLU 54 15.200 13.212 -0.888
418 HG2 GLU 54 1HG GLU 54 17.801 13.589 -2.352
419 HG3 GLU 54 2HG GLU 54 16.917 14.870 -1.525
420 H ASP 55 H ASP 55 14.082 10.970 -0.431
421 HA ASP 55 HA ASP 55 15.326 10.615 2.028
422 HB2 ASP 55 1HB ASP 55 12.768 10.661 1.267
423 HB3 ASP 55 2HB ASP 55 12.963 8.916 1.403
424 H GLN 56 H GLN 56 14.660 8.260 -0.525
425 HA GLN 56 HA GLN 56 15.566 5.996 0.917
426 HB2 GLN 56 1HB GLN 56 14.977 6.592 -1.949
427 HB3 GLN 56 2HB GLN 56 15.871 5.129 -1.560
428 HG2 GLN 56 1HG GLN 56 13.137 5.878 -0.550
429 HG3 GLN 56 2HG GLN 56 13.515 4.650 -1.756
430 HE21 GLN 56 2HE2 GLN 56 12.666 5.060 1.345
431 HE22 GLN 56 1HE2 GLN 56 13.345 3.634 2.045
432 H ARG 57 H ARG 57 17.148 8.295 -1.230
433 HA ARG 57 HA ARG 57 19.567 6.957 -1.610
434 HB2 ARG 57 1HB ARG 57 18.810 9.864 -1.592
435 HB3 ARG 57 2HB ARG 57 20.484 9.373 -1.816
436 HG2 ARG 57 1HG ARG 57 20.017 8.299 -3.842
437 HG3 ARG 57 2HG ARG 57 18.280 8.286 -3.532
438 HD2 ARG 57 1HD ARG 57 18.318 10.055 -4.940
439 HD3 ARG 57 2HD ARG 57 18.719 10.927 -3.461
440 HE ARG 57 HE ARG 57 21.139 10.194 -4.415
441 HH11 ARG 57 2HH1 ARG 57 18.408 11.823 -5.832
442 HH12 ARG 57 1HH1 ARG 57 19.370 12.758 -6.929
443 HH21 ARG 57 2HH2 ARG 57 22.416 11.419 -5.854
444 HH22 ARG 57 1HH2 ARG 57 21.649 12.527 -6.941
445 H ILE 58 H ILE 58 18.527 9.123 0.986
446 HA ILE 58 HA ILE 58 21.011 9.244 2.326
447 HB ILE 58 HB ILE 58 18.241 9.568 3.487
448 HG12 ILE 58 1HG1 ILE 58 18.655 11.107 1.624
449 HG13 ILE 58 2HG1 ILE 58 18.614 11.975 3.154
450 HG21 ILE 58 1HG2 ILE 58 20.197 11.161 4.786
451 HG22 ILE 58 2HG2 ILE 58 19.224 9.852 5.454
452 HG23 ILE 58 3HG2 ILE 58 20.792 9.502 4.727
453 HD11 ILE 58 3HD1 ILE 58 21.010 11.275 1.490
454 HD12 ILE 58 1HD1 ILE 58 20.397 12.875 1.906
455 HD13 ILE 58 2HD1 ILE 58 21.126 11.860 3.150
456 H SER 59 H SER 59 18.174 7.157 2.755
457 HA SER 59 HA SER 59 19.191 5.734 4.979
458 HB2 SER 59 1HB SER 59 16.771 5.840 4.229
459 HB3 SER 59 2HB SER 59 17.196 4.683 2.967
460 HG SER 59 HG SER 59 17.844 3.241 4.617
461 H GLN 60 H GLN 60 19.426 5.263 1.505
462 HA GLN 60 HA GLN 60 20.518 2.655 1.578
463 HB2 GLN 60 1HB GLN 60 19.618 4.292 -0.399
464 HB3 GLN 60 2HB GLN 60 21.356 4.405 -0.644
465 HG2 GLN 60 1HG GLN 60 19.600 1.983 -0.787
466 HG3 GLN 60 2HG GLN 60 20.652 2.661 -2.028
467 HE21 GLN 60 2HE2 GLN 60 22.745 2.051 -2.116
468 HE22 GLN 60 1HE2 GLN 60 23.469 0.901 -1.049
469 H ALA 61 H ALA 61 21.997 5.872 1.469
470 HA ALA 61 HA ALA 61 24.660 5.113 1.189
471 HB1 ALA 61 1HB ALA 61 23.514 7.466 1.220
472 HB2 ALA 61 2HB ALA 61 23.961 7.433 2.926
473 HB3 ALA 61 3HB ALA 61 25.206 7.288 1.686
474 H LYS 62 H LYS 62 22.649 5.345 4.078
475 HA LYS 62 HA LYS 62 24.662 5.007 6.001
476 HB2 LYS 62 1HB LYS 62 21.742 4.230 6.066
477 HB3 LYS 62 2HB LYS 62 22.802 4.193 7.469
478 HG2 LYS 62 1HG LYS 62 23.175 6.605 7.238
479 HG3 LYS 62 2HG LYS 62 22.078 6.631 5.855
480 HD2 LYS 62 1HD LYS 62 20.495 5.429 7.659
481 HD3 LYS 62 2HD LYS 62 21.494 6.397 8.746
482 HE2 LYS 62 1HE LYS 62 20.726 8.387 7.897
483 HE3 LYS 62 2HE LYS 62 20.344 7.692 6.323
484 HZ1 LYS 62 3HZ LYS 62 18.303 8.140 7.385
485 HZ2 LYS 62 1HZ LYS 62 18.801 7.433 8.839
486 HZ3 LYS 62 2HZ LYS 62 18.511 6.464 7.483
487 H LEU 63 H LEU 63 22.763 2.660 4.172
488 HA LEU 63 HA LEU 63 23.588 0.349 5.538
489 HB2 LEU 63 1HB LEU 63 21.781 0.782 3.659
490 HB3 LEU 63 2HB LEU 63 23.092 0.253 2.606
491 HG LEU 63 HG LEU 63 21.587 -1.585 3.124
492 HD11 LEU 63 1HD1 LEU 63 24.133 -2.058 4.642
493 HD12 LEU 63 2HD1 LEU 63 24.104 -1.879 2.889
494 HD13 LEU 63 3HD1 LEU 63 23.210 -3.192 3.655
495 HD21 LEU 63 3HD2 LEU 63 20.939 -0.617 5.382
496 HD22 LEU 63 1HD2 LEU 63 22.419 -1.350 6.002
497 HD23 LEU 63 2HD2 LEU 63 21.158 -2.366 5.302
498 H LEU 64 H LEU 64 24.947 2.003 2.712
499 HA LEU 64 HA LEU 64 27.029 0.114 2.285
500 HB2 LEU 64 1HB LEU 64 26.982 3.007 1.451
501 HB3 LEU 64 2HB LEU 64 27.935 1.707 0.738
502 HG LEU 64 HG LEU 64 25.051 1.229 0.649
503 HD11 LEU 64 1HD1 LEU 64 24.513 3.356 0.136
504 HD12 LEU 64 2HD1 LEU 64 25.147 2.911 -1.448
505 HD13 LEU 64 3HD1 LEU 64 26.166 3.786 -0.304
506 HD21 LEU 64 3HD2 LEU 64 27.464 0.857 -0.994
507 HD22 LEU 64 1HD2 LEU 64 25.970 1.131 -1.889
508 HD23 LEU 64 2HD2 LEU 64 26.079 -0.208 -0.746
509 H LEU 65 H LEU 65 26.876 3.250 3.933
510 HA LEU 65 HA LEU 65 29.620 3.350 4.622
511 HB2 LEU 65 1HB LEU 65 27.169 4.822 5.318
512 HB3 LEU 65 2HB LEU 65 28.435 4.849 6.543
513 HG LEU 65 HG LEU 65 29.123 5.558 3.726
514 HD11 LEU 65 1HD1 LEU 65 28.573 7.918 4.246
515 HD12 LEU 65 2HD1 LEU 65 27.735 7.368 5.696
516 HD13 LEU 65 3HD1 LEU 65 27.154 6.881 4.104
517 HD21 LEU 65 3HD2 LEU 65 30.756 5.287 5.687
518 HD22 LEU 65 1HD2 LEU 65 30.084 6.808 6.277
519 HD23 LEU 65 2HD2 LEU 65 30.877 6.746 4.703
520 H SER 66 H SER 66 26.886 1.733 5.994
521 HA SER 66 HA SER 66 28.254 1.208 8.510
522 HB2 SER 66 1HB SER 66 25.512 0.461 7.481
523 HB3 SER 66 2HB SER 66 26.138 -0.069 9.041
524 HG SER 66 HG SER 66 24.828 2.019 8.801
525 H THR 67 H THR 67 27.590 -0.323 5.475
526 HA THR 67 HA THR 67 28.427 -2.940 6.466
527 HB THR 67 HB THR 67 26.471 -2.596 4.835
528 HG1 THR 67 HG1 THR 67 26.863 -4.610 4.044
529 HG21 THR 67 3HG2 THR 67 26.825 -1.949 2.703
530 HG22 THR 67 1HG2 THR 67 28.364 -2.803 2.592
531 HG23 THR 67 2HG2 THR 67 28.289 -1.217 3.360
532 H THR 68 H THR 68 29.778 -0.187 5.063
533 HA THR 68 HA THR 68 32.201 -1.700 4.361
534 HB THR 68 HB THR 68 32.582 -0.510 2.388
535 HG1 THR 68 HG1 THR 68 30.993 1.325 1.926
536 HG21 THR 68 3HG2 THR 68 29.673 -0.423 1.984
537 HG22 THR 68 1HG2 THR 68 30.284 -1.950 2.618
538 HG23 THR 68 2HG2 THR 68 30.914 -1.310 1.100
539 H ARG 69 H ARG 69 34.107 -0.088 4.089
540 HA ARG 69 HA ARG 69 33.960 1.879 6.280
541 HB2 ARG 69 1HB ARG 69 36.302 1.405 6.766
542 HB3 ARG 69 2HB ARG 69 35.345 -0.068 6.861
543 HG2 ARG 69 1HG ARG 69 36.683 0.568 4.287
544 HG3 ARG 69 2HG ARG 69 37.672 -0.003 5.633
545 HD2 ARG 69 1HD ARG 69 36.774 -2.084 5.587
546 HD3 ARG 69 2HD ARG 69 35.185 -1.503 5.092
547 HE ARG 69 HE ARG 69 37.052 -1.181 2.992
548 HH11 ARG 69 2HH1 ARG 69 35.206 -3.610 4.669
549 HH12 ARG 69 1HH1 ARG 69 35.134 -4.681 3.309
550 HH21 ARG 69 2HH2 ARG 69 36.966 -2.583 1.194
551 HH22 ARG 69 1HH2 ARG 69 36.137 -4.096 1.333
552 H MET 70 H MET 70 33.664 2.024 3.234
553 HA MET 70 HA MET 70 35.883 3.442 2.211
554 HB2 MET 70 1HB MET 70 32.986 3.356 1.368
555 HB3 MET 70 2HB MET 70 34.223 4.228 0.472
556 HG2 MET 70 1HG MET 70 35.458 2.121 0.176
557 HG3 MET 70 2HG MET 70 34.161 1.269 1.010
558 HE1 MET 70 3HE MET 70 31.893 0.737 0.086
559 HE2 MET 70 1HE MET 70 31.464 2.442 -0.063
560 HE3 MET 70 2HE MET 70 31.218 1.349 -1.425
561 HA PRO 71 HA PRO 71 35.431 7.489 3.850
562 HB2 PRO 71 1HB PRO 71 36.234 9.013 1.752
563 HB3 PRO 71 2HB PRO 71 37.351 8.039 2.716
564 HG2 PRO 71 1HG PRO 71 36.113 7.430 0.059
565 HG3 PRO 71 2HG PRO 71 37.783 7.177 0.599
566 HD2 PRO 71 1HD PRO 71 35.963 5.175 0.509
567 HD3 PRO 71 2HD PRO 71 37.260 5.233 1.720
568 H ILE 72 H ILE 72 34.348 9.588 3.537
569 HA ILE 72 HA ILE 72 31.662 9.279 2.763
570 HB ILE 72 HB ILE 72 33.115 11.902 3.099
571 HG12 ILE 72 1HG1 ILE 72 33.551 10.511 5.046
572 HG13 ILE 72 2HG1 ILE 72 32.401 11.775 5.470
573 HG21 ILE 72 1HG2 ILE 72 30.786 11.859 2.112
574 HG22 ILE 72 2HG2 ILE 72 30.235 11.263 3.677
575 HG23 ILE 72 3HG2 ILE 72 30.999 12.848 3.557
576 HD11 ILE 72 3HD1 ILE 72 31.816 9.610 6.442
577 HD12 ILE 72 1HD1 ILE 72 30.576 10.195 5.333
578 HD13 ILE 72 2HD1 ILE 72 31.689 8.925 4.822
579 H ALA 73 H ALA 73 34.474 10.455 1.058
580 HA ALA 73 HA ALA 73 33.135 11.757 -1.065
581 HB1 ALA 73 1HB ALA 73 35.417 12.273 -0.745
582 HB2 ALA 73 2HB ALA 73 35.891 10.576 -0.830
583 HB3 ALA 73 3HB ALA 73 35.325 11.407 -2.279
584 H THR 74 H THR 74 34.446 8.468 -0.745
585 HA THR 74 HA THR 74 33.691 7.615 -3.336
586 HB THR 74 HB THR 74 34.215 5.966 -0.855
587 HG1 THR 74 HG1 THR 74 35.868 6.839 -3.001
588 HG21 THR 74 3HG2 THR 74 32.978 4.644 -2.442
589 HG22 THR 74 1HG2 THR 74 34.667 4.140 -2.489
590 HG23 THR 74 2HG2 THR 74 34.020 5.175 -3.762
591 H VAL 75 H VAL 75 32.165 7.237 -0.151
592 HA VAL 75 HA VAL 75 30.007 5.651 -0.897
593 HB VAL 75 HB VAL 75 30.073 7.810 1.215
594 HG11 VAL 75 1HG1 VAL 75 28.334 5.685 1.896
595 HG12 VAL 75 2HG1 VAL 75 27.929 7.375 1.588
596 HG13 VAL 75 3HG1 VAL 75 27.918 6.209 0.265
597 HG21 VAL 75 3HG2 VAL 75 30.236 4.963 1.952
598 HG22 VAL 75 1HG2 VAL 75 31.645 5.618 1.117
599 HG23 VAL 75 2HG2 VAL 75 31.085 6.360 2.616
600 H GLY 76 H GLY 76 30.388 9.165 -1.028
601 HA2 GLY 76 1HA GLY 76 27.773 9.887 -1.654
602 HA3 GLY 76 2HA GLY 76 29.204 10.773 -2.160
603 H ARG 77 H ARG 77 30.395 8.905 -3.835
604 HA ARG 77 HA ARG 77 29.091 9.374 -6.252
605 HB2 ARG 77 1HB ARG 77 31.527 8.288 -5.458
606 HB3 ARG 77 2HB ARG 77 30.737 6.978 -6.323
607 HG2 ARG 77 1HG ARG 77 30.387 9.351 -7.833
608 HG3 ARG 77 2HG ARG 77 32.087 9.234 -7.374
609 HD2 ARG 77 1HD ARG 77 32.003 6.840 -8.186
610 HD3 ARG 77 2HD ARG 77 30.428 7.225 -8.877
611 HE ARG 77 HE ARG 77 31.476 8.423 -10.534
612 HH11 ARG 77 2HH1 ARG 77 33.755 7.675 -8.011
613 HH12 ARG 77 1HH1 ARG 77 35.132 8.204 -8.919
614 HH21 ARG 77 2HH2 ARG 77 33.282 9.122 -11.740
615 HH22 ARG 77 1HH2 ARG 77 34.862 9.028 -11.039
616 H ASN 78 H ASN 78 28.860 6.686 -4.016
617 HA ASN 78 HA ASN 78 27.532 4.863 -5.698
618 HB2 ASN 78 1HB ASN 78 28.196 5.070 -2.889
619 HB3 ASN 78 2HB ASN 78 26.572 4.421 -3.099
620 HD21 ASN 78 2HD2 ASN 78 29.756 3.639 -2.874
621 HD22 ASN 78 1HD2 ASN 78 29.724 2.084 -3.628
622 H VAL 79 H VAL 79 26.404 7.587 -3.819
623 HA VAL 79 HA VAL 79 23.615 6.940 -4.441
624 HB VAL 79 HB VAL 79 23.021 8.756 -2.910
625 HG11 VAL 79 1HG1 VAL 79 24.403 7.718 -0.864
626 HG12 VAL 79 2HG1 VAL 79 23.058 6.881 -1.641
627 HG13 VAL 79 3HG1 VAL 79 24.719 6.482 -2.082
628 HG21 VAL 79 3HG2 VAL 79 25.089 10.111 -3.421
629 HG22 VAL 79 1HG2 VAL 79 24.622 10.040 -1.722
630 HG23 VAL 79 2HG2 VAL 79 25.958 9.050 -2.312
631 H GLY 80 H GLY 80 25.805 8.078 -6.283
632 HA2 GLY 80 1HA GLY 80 25.692 9.390 -8.180
633 HA3 GLY 80 2HA GLY 80 24.057 9.840 -7.717
634 H PHE 81 H PHE 81 26.013 10.398 -5.110
635 HA PHE 81 HA PHE 81 25.920 13.251 -5.540
636 HB2 PHE 81 1HB PHE 81 26.588 11.461 -3.241
637 HB3 PHE 81 2HB PHE 81 27.144 13.131 -3.204
638 HD1 PHE 81 HD2 PHE 81 23.972 11.691 -4.507
639 HD2 PHE 81 HD1 PHE 81 25.843 14.193 -1.617
640 HE1 PHE 81 HE2 PHE 81 21.761 12.404 -3.698
641 HE2 PHE 81 HE1 PHE 81 23.635 14.910 -0.802
642 HZ PHE 81 HZ PHE 81 21.590 14.016 -1.844
643 H ASP 82 H ASP 82 27.463 14.323 -6.563
644 HA ASP 82 HA ASP 82 30.076 13.148 -6.960
645 HB2 ASP 82 1HB ASP 82 28.794 15.704 -7.928
646 HB3 ASP 82 2HB ASP 82 30.470 15.287 -8.275
647 H ASP 83 H ASP 83 28.621 15.683 -5.048
648 HA ASP 83 HA ASP 83 31.245 16.558 -4.090
649 HB2 ASP 83 1HB ASP 83 29.710 18.336 -4.711
650 HB3 ASP 83 2HB ASP 83 28.478 17.690 -3.630
651 H GLN 84 H GLN 84 32.071 15.657 -2.335
652 HA GLN 84 HA GLN 84 30.692 13.826 -0.709
653 HB2 GLN 84 1HB GLN 84 32.676 13.915 0.746
654 HB3 GLN 84 2HB GLN 84 33.111 13.753 -0.950
655 HG2 GLN 84 1HG GLN 84 33.255 16.376 -0.817
656 HG3 GLN 84 2HG GLN 84 33.494 16.044 0.898
657 HE21 GLN 84 2HE2 GLN 84 35.486 15.644 1.545
658 HE22 GLN 84 1HE2 GLN 84 36.810 15.192 0.532
659 H LEU 85 H LEU 85 31.455 17.247 -0.274
660 HA LEU 85 HA LEU 85 30.517 17.452 2.385
661 HB2 LEU 85 1HB LEU 85 31.224 19.332 0.210
662 HB3 LEU 85 2HB LEU 85 30.190 19.953 1.496
663 HG LEU 85 HG LEU 85 32.532 20.482 1.906
664 HD11 LEU 85 1HD1 LEU 85 32.451 18.661 4.060
665 HD12 LEU 85 2HD1 LEU 85 30.786 19.109 3.691
666 HD13 LEU 85 3HD1 LEU 85 31.977 20.360 4.046
667 HD21 LEU 85 3HD2 LEU 85 34.242 18.963 1.955
668 HD22 LEU 85 1HD2 LEU 85 33.219 18.235 0.717
669 HD23 LEU 85 2HD2 LEU 85 33.183 17.614 2.368
670 H TYR 86 H TYR 86 28.946 17.650 -0.735
671 HA TYR 86 HA TYR 86 26.542 18.857 0.033
672 HB2 TYR 86 1HB TYR 86 27.038 18.613 -2.298
673 HB3 TYR 86 2HB TYR 86 27.156 16.863 -2.151
674 HD1 TYR 86 HD1 TYR 86 24.502 18.914 -0.605
675 HD2 TYR 86 HD2 TYR 86 25.529 16.289 -3.792
676 HE1 TYR 86 HE1 TYR 86 22.123 18.709 -1.195
677 HE2 TYR 86 HE2 TYR 86 23.153 16.078 -4.392
678 HH TYR 86 HH TYR 86 20.667 17.974 -2.747
679 H PHE 87 H PHE 87 27.438 15.422 -0.107
680 HA PHE 87 HA PHE 87 24.965 14.387 0.719
681 HB2 PHE 87 1HB PHE 87 26.580 12.915 -0.270
682 HB3 PHE 87 2HB PHE 87 27.768 13.291 0.974
683 HD1 PHE 87 HD1 PHE 87 24.270 12.003 0.748
684 HD2 PHE 87 HD2 PHE 87 28.092 11.712 2.598
685 HE1 PHE 87 HE1 PHE 87 23.479 10.087 2.073
686 HE2 PHE 87 HE2 PHE 87 27.307 9.795 3.925
687 HZ PHE 87 HZ PHE 87 24.998 8.979 3.664
688 H SER 88 H SER 88 27.859 15.246 2.586
689 HA SER 88 HA SER 88 26.835 14.468 5.101
690 HB2 SER 88 1HB SER 88 28.685 15.771 6.045
691 HB3 SER 88 2HB SER 88 29.242 14.809 4.676
692 HG SER 88 HG SER 88 29.062 17.550 4.963
693 H ARG 89 H ARG 89 26.683 17.468 3.276
694 HA ARG 89 HA ARG 89 25.703 19.126 5.329
695 HB2 ARG 89 1HB ARG 89 25.747 19.231 2.352
696 HB3 ARG 89 2HB ARG 89 24.655 20.322 3.194
697 HG2 ARG 89 1HG ARG 89 26.434 21.389 4.321
698 HG3 ARG 89 2HG ARG 89 27.580 20.134 3.845
699 HD2 ARG 89 1HD ARG 89 27.258 20.806 1.481
700 HD3 ARG 89 2HD ARG 89 26.220 22.122 2.031
701 HE ARG 89 HE ARG 89 28.704 22.275 3.345
702 HH11 ARG 89 2HH1 ARG 89 27.279 22.740 0.203
703 HH12 ARG 89 1HH1 ARG 89 28.440 23.927 -0.292
704 HH21 ARG 89 2HH2 ARG 89 30.239 23.836 2.706
705 HH22 ARG 89 1HH2 ARG 89 30.124 24.549 1.132
706 H VAL 90 H VAL 90 23.975 17.364 2.760
707 HA VAL 90 HA VAL 90 21.389 18.052 3.731
708 HB VAL 90 HB VAL 90 21.727 17.448 1.392
709 HG11 VAL 90 1HG1 VAL 90 22.156 14.605 2.276
710 HG12 VAL 90 2HG1 VAL 90 22.333 15.286 0.658
711 HG13 VAL 90 3HG1 VAL 90 23.488 15.706 1.923
712 HG21 VAL 90 3HG2 VAL 90 20.020 15.201 2.210
713 HG22 VAL 90 1HG2 VAL 90 19.614 16.752 2.946
714 HG23 VAL 90 2HG2 VAL 90 19.655 16.593 1.190
715 H PHE 91 H PHE 91 23.489 15.236 4.106
716 HA PHE 91 HA PHE 91 21.622 13.612 5.470
717 HB2 PHE 91 1HB PHE 91 23.692 12.755 4.401
718 HB3 PHE 91 2HB PHE 91 24.641 13.548 5.654
719 HD1 PHE 91 HD2 PHE 91 24.436 12.783 8.014
720 HD2 PHE 91 HD1 PHE 91 22.664 10.667 4.773
721 HE1 PHE 91 HE2 PHE 91 24.225 10.787 9.436
722 HE2 PHE 91 HE1 PHE 91 22.449 8.668 6.191
723 HZ PHE 91 HZ PHE 91 23.231 8.726 8.526
724 H LYS 92 H LYS 92 23.936 16.029 6.540
725 HA LYS 92 HA LYS 92 23.929 15.516 9.279
726 HB2 LYS 92 1HB LYS 92 25.508 17.068 8.347
727 HB3 LYS 92 2HB LYS 92 24.219 18.113 7.764
728 HG2 LYS 92 1HG LYS 92 23.604 18.669 10.044
729 HG3 LYS 92 2HG LYS 92 24.844 17.574 10.661
730 HD2 LYS 92 1HD LYS 92 26.589 18.927 9.720
731 HD3 LYS 92 2HD LYS 92 25.414 19.944 8.885
732 HE2 LYS 92 1HE LYS 92 26.061 21.181 10.774
733 HE3 LYS 92 2HE LYS 92 24.490 20.496 11.190
734 HZ1 LYS 92 3HZ LYS 92 25.451 19.662 12.988
735 HZ2 LYS 92 1HZ LYS 92 26.992 20.134 12.473
736 HZ3 LYS 92 2HZ LYS 92 26.362 18.639 11.995
737 H LYS 93 H LYS 93 21.809 17.654 7.387
738 HA LYS 93 HA LYS 93 20.202 18.351 9.657
739 HB2 LYS 93 1HB LYS 93 19.994 18.831 6.699
740 HB3 LYS 93 2HB LYS 93 18.653 19.226 7.766
741 HG2 LYS 93 1HG LYS 93 19.762 20.960 8.750
742 HG3 LYS 93 2HG LYS 93 21.353 20.248 8.468
743 HD2 LYS 93 1HD LYS 93 21.035 22.215 7.071
744 HD3 LYS 93 2HD LYS 93 21.146 20.761 6.076
745 HE2 LYS 93 1HE LYS 93 18.884 20.790 5.559
746 HE3 LYS 93 2HE LYS 93 18.477 21.788 6.954
747 HZ1 LYS 93 3HZ LYS 93 20.111 23.404 5.562
748 HZ2 LYS 93 1HZ LYS 93 18.422 23.430 5.458
749 HZ3 LYS 93 2HZ LYS 93 19.326 22.577 4.312
750 H CYS 94 H CYS 94 20.185 15.836 7.281
751 HA CYS 94 HA CYS 94 17.514 15.077 7.269
752 HB2 CYS 94 1HB CYS 94 19.298 14.134 5.801
753 HB3 CYS 94 2HB CYS 94 19.898 13.218 7.178
754 HG CYS 94 HG CYS 94 16.943 12.277 7.267
755 H THR 95 H THR 95 20.117 13.986 9.433
756 HA THR 95 HA THR 95 18.062 12.883 11.230
757 HB THR 95 HB THR 95 19.805 11.486 12.205
758 HG1 THR 95 HG1 THR 95 21.442 13.087 10.596
759 HG21 THR 95 3HG2 THR 95 19.318 9.988 10.632
760 HG22 THR 95 1HG2 THR 95 20.509 10.716 9.555
761 HG23 THR 95 2HG2 THR 95 18.841 11.289 9.542
762 H GLY 96 H GLY 96 20.175 15.462 10.845
763 HA2 GLY 96 1HA GLY 96 20.228 17.297 12.341
764 HA3 GLY 96 2HA GLY 96 19.812 16.207 13.654
765 H ALA 97 H ALA 97 22.080 14.542 12.088
766 HA ALA 97 HA ALA 97 24.366 15.917 13.307
767 HB1 ALA 97 1HB ALA 97 24.262 12.972 13.633
768 HB2 ALA 97 2HB ALA 97 24.980 14.205 14.671
769 HB3 ALA 97 3HB ALA 97 23.235 13.946 14.686
770 H SER 98 H SER 98 26.374 15.460 12.366
771 HA SER 98 HA SER 98 26.322 14.899 9.601
772 HB2 SER 98 1HB SER 98 28.342 15.618 11.606
773 HB3 SER 98 2HB SER 98 28.966 14.611 10.300
774 HG SER 98 HG SER 98 28.699 17.133 10.165
775 HA PRO 99 HA PRO 99 26.877 10.560 9.279
776 HB2 PRO 99 1HB PRO 99 28.723 10.330 7.302
777 HB3 PRO 99 2HB PRO 99 27.056 10.837 7.005
778 HG2 PRO 99 1HG PRO 99 29.526 12.508 7.271
779 HG3 PRO 99 2HG PRO 99 28.199 12.651 6.104
780 HD2 PRO 99 1HD PRO 99 28.394 14.237 8.290
781 HD3 PRO 99 2HD PRO 99 26.832 13.747 7.602
782 H SER 100 H SER 100 29.858 12.434 9.559
783 HA SER 100 HA SER 100 31.551 10.261 10.214
784 HB2 SER 100 1HB SER 100 31.732 13.231 10.369
785 HB3 SER 100 2HB SER 100 32.871 12.293 11.335
786 HG SER 100 HG SER 100 32.458 12.080 8.533
787 H GLU 101 H GLU 101 29.485 12.366 12.107
788 HA GLU 101 HA GLU 101 30.507 11.545 14.648
789 HB2 GLU 101 1HB GLU 101 29.329 13.711 14.235
790 HB3 GLU 101 2HB GLU 101 27.834 12.810 14.026
791 HG2 GLU 101 1HG GLU 101 27.517 12.626 16.217
792 HG3 GLU 101 2HG GLU 101 29.189 12.147 16.504
793 H PHE 102 H PHE 102 27.606 10.732 12.765
794 HA PHE 102 HA PHE 102 26.457 8.958 14.591
795 HB2 PHE 102 1HB PHE 102 25.362 9.885 12.528
796 HB3 PHE 102 2HB PHE 102 26.308 8.741 11.580
797 HD1 PHE 102 HD2 PHE 102 24.230 8.587 14.681
798 HD2 PHE 102 HD1 PHE 102 25.113 6.933 10.860
799 HE1 PHE 102 HE2 PHE 102 22.496 6.876 15.024
800 HE2 PHE 102 HE1 PHE 102 23.380 5.219 11.197
801 HZ PHE 102 HZ PHE 102 22.069 5.189 13.282
802 H ARG 103 H ARG 103 28.797 8.386 11.996
803 HA ARG 103 HA ARG 103 28.901 5.576 12.287
804 HB2 ARG 103 1HB ARG 103 29.705 6.884 10.298
805 HB3 ARG 103 2HB ARG 103 31.095 7.377 11.256
806 HG2 ARG 103 1HG ARG 103 31.814 5.077 11.460
807 HG3 ARG 103 2HG ARG 103 30.379 4.529 10.592
808 HD2 ARG 103 1HD ARG 103 32.125 4.542 9.006
809 HD3 ARG 103 2HD ARG 103 31.156 5.975 8.667
810 HE ARG 103 HE ARG 103 32.958 7.277 9.210
811 HH11 ARG 103 2HH1 ARG 103 33.488 4.046 10.392
812 HH12 ARG 103 1HH1 ARG 103 35.130 4.345 10.857
813 HH21 ARG 103 2HH2 ARG 103 35.118 7.684 9.818
814 HH22 ARG 103 1HH2 ARG 103 36.056 6.415 10.531
815 H ALA 104 H ALA 104 30.668 8.218 13.793
816 HA ALA 104 HA ALA 104 32.668 6.667 15.041
817 HB1 ALA 104 1HB ALA 104 31.516 9.345 15.808
818 HB2 ALA 104 2HB ALA 104 32.966 8.632 16.515
819 HB3 ALA 104 3HB ALA 104 32.934 9.049 14.802
820 H GLY 105 H GLY 105 29.378 7.488 15.944
821 HA2 GLY 105 1HA GLY 105 28.031 6.284 17.430
822 HA3 GLY 105 2HA GLY 105 29.463 5.455 18.022
823 H CYS 106 H CYS 106 30.493 8.469 18.092
824 HA CYS 106 HA CYS 106 30.147 8.739 20.907
825 HB2 CYS 106 1HB CYS 106 32.183 9.498 19.736
826 HB3 CYS 106 2HB CYS 106 31.238 10.728 18.906
827 HG CYS 106 HG CYS 106 30.600 12.122 21.259
828 H GLU 107 H GLU 107 28.665 9.836 22.032
829 HA GLU 107 HA GLU 107 26.324 10.804 20.818
830 HB2 GLU 107 1HB GLU 107 26.815 10.013 23.276
831 HB3 GLU 107 2HB GLU 107 27.141 11.719 23.548
832 HG2 GLU 107 1HG GLU 107 24.955 12.339 23.155
833 HG3 GLU 107 2HG GLU 107 24.600 10.883 22.227
Start of MODEL 12
1 H1 MET 1 H MET 1 0.437 -2.942 -0.806
2 HA MET 1 HA MET 1 1.565 -0.590 -2.175
3 HB2 MET 1 1HB MET 1 3.016 -2.349 -0.822
4 HB3 MET 1 2HB MET 1 2.888 -3.261 -2.320
5 HG2 MET 1 1HG MET 1 4.797 -2.127 -2.753
6 HG3 MET 1 2HG MET 1 3.634 -0.953 -3.365
7 HE1 MET 1 3HE MET 1 6.384 -0.230 -2.951
8 HE2 MET 1 1HE MET 1 5.496 1.294 -2.953
9 HE3 MET 1 2HE MET 1 6.672 0.962 -1.682
10 H ASP 2 H ASP 2 1.180 -0.352 -4.283
11 HA ASP 2 HA ASP 2 -0.491 -2.257 -5.645
12 HB2 ASP 2 1HB ASP 2 -0.484 0.353 -5.819
13 HB3 ASP 2 2HB ASP 2 0.791 0.088 -7.005
14 H ASN 3 H ASN 3 0.013 -3.491 -7.439
15 HA ASN 3 HA ASN 3 2.579 -4.602 -7.562
16 HB2 ASN 3 1HB ASN 3 0.228 -4.693 -9.445
17 HB3 ASN 3 2HB ASN 3 1.730 -5.543 -9.798
18 HD21 ASN 3 2HD2 ASN 3 1.489 -7.611 -9.392
19 HD22 ASN 3 1HD2 ASN 3 0.698 -8.296 -8.016
20 H ARG 4 H ARG 4 1.038 -2.096 -9.514
21 HA ARG 4 HA ARG 4 3.062 -1.866 -11.461
22 HB2 ARG 4 1HB ARG 4 0.892 -0.034 -10.485
23 HB3 ARG 4 2HB ARG 4 2.076 0.531 -11.656
24 HG2 ARG 4 1HG ARG 4 0.399 -0.181 -13.038
25 HG3 ARG 4 2HG ARG 4 1.392 -1.637 -12.947
26 HD2 ARG 4 1HD ARG 4 -0.070 -2.526 -11.200
27 HD3 ARG 4 2HD ARG 4 -1.056 -1.066 -11.280
28 HE ARG 4 HE ARG 4 -0.993 -2.106 -13.840
29 HH11 ARG 4 2HH1 ARG 4 -2.072 -3.124 -10.690
30 HH12 ARG 4 1HH1 ARG 4 -3.343 -4.128 -11.306
31 HH21 ARG 4 2HH2 ARG 4 -2.663 -3.423 -14.663
32 HH22 ARG 4 1HH2 ARG 4 -3.678 -4.298 -13.566
33 H VAL 5 H VAL 5 2.503 -0.112 -8.424
34 HA VAL 5 HA VAL 5 4.606 1.707 -8.610
35 HB VAL 5 HB VAL 5 3.490 0.427 -6.110
36 HG11 VAL 5 1HG1 VAL 5 5.684 2.193 -6.469
37 HG12 VAL 5 2HG1 VAL 5 4.376 3.091 -5.696
38 HG13 VAL 5 3HG1 VAL 5 4.980 1.604 -4.964
39 HG21 VAL 5 3HG2 VAL 5 1.890 1.633 -7.687
40 HG22 VAL 5 1HG2 VAL 5 1.924 2.178 -6.010
41 HG23 VAL 5 2HG2 VAL 5 2.756 3.107 -7.257
42 H ARG 6 H ARG 6 4.560 -1.624 -7.448
43 HA ARG 6 HA ARG 6 7.076 -1.757 -6.281
44 HB2 ARG 6 1HB ARG 6 5.165 -3.530 -6.469
45 HB3 ARG 6 2HB ARG 6 6.027 -4.040 -7.915
46 HG2 ARG 6 1HG ARG 6 7.015 -5.412 -6.409
47 HG3 ARG 6 2HG ARG 6 8.083 -4.016 -6.244
48 HD2 ARG 6 1HD ARG 6 6.898 -3.273 -4.290
49 HD3 ARG 6 2HD ARG 6 5.674 -4.523 -4.506
50 HE ARG 6 HE ARG 6 7.997 -5.915 -4.273
51 HH11 ARG 6 2HH1 ARG 6 6.406 -3.497 -2.339
52 HH12 ARG 6 1HH1 ARG 6 7.041 -4.091 -0.841
53 HH21 ARG 6 2HH2 ARG 6 8.839 -6.707 -2.307
54 HH22 ARG 6 1HH2 ARG 6 8.425 -5.916 -0.823
55 H GLU 7 H GLU 7 6.151 -2.255 -9.672
56 HA GLU 7 HA GLU 7 8.731 -2.912 -10.605
57 HB2 GLU 7 1HB GLU 7 6.165 -2.068 -11.850
58 HB3 GLU 7 2HB GLU 7 7.622 -1.913 -12.821
59 HG2 GLU 7 1HG GLU 7 6.575 -4.429 -11.548
60 HG3 GLU 7 2HG GLU 7 6.551 -4.023 -13.263
61 H ALA 8 H ALA 8 7.071 0.146 -10.143
62 HA ALA 8 HA ALA 8 8.772 1.823 -11.590
63 HB1 ALA 8 1HB ALA 8 6.598 2.516 -10.666
64 HB2 ALA 8 2HB ALA 8 7.294 2.485 -9.045
65 HB3 ALA 8 3HB ALA 8 7.896 3.633 -10.242
66 H CYS 9 H CYS 9 9.055 0.506 -8.339
67 HA CYS 9 HA CYS 9 11.162 2.099 -7.413
68 HB2 CYS 9 1HB CYS 9 9.936 0.709 -5.877
69 HB3 CYS 9 2HB CYS 9 10.402 -0.749 -6.746
70 HG CYS 9 HG CYS 9 11.720 -0.332 -4.174
71 H GLN 10 H GLN 10 11.130 -0.750 -9.456
72 HA GLN 10 HA GLN 10 13.868 -1.375 -9.339
73 HB2 GLN 10 1HB GLN 10 11.963 -1.792 -11.649
74 HB3 GLN 10 2HB GLN 10 13.495 -2.622 -11.405
75 HG2 GLN 10 1HG GLN 10 11.362 -2.782 -9.323
76 HG3 GLN 10 2HG GLN 10 11.272 -3.790 -10.767
77 HE21 GLN 10 2HE2 GLN 10 13.623 -4.715 -11.266
78 HE22 GLN 10 1HE2 GLN 10 14.328 -5.546 -9.925
79 H TYR 11 H TYR 11 12.040 0.667 -11.598
80 HA TYR 11 HA TYR 11 14.299 1.394 -13.159
81 HB2 TYR 11 1HB TYR 11 12.133 1.583 -14.155
82 HB3 TYR 11 2HB TYR 11 11.557 2.622 -12.856
83 HD1 TYR 11 HD2 TYR 11 14.515 2.656 -15.152
84 HD2 TYR 11 HD1 TYR 11 11.194 4.782 -13.555
85 HE1 TYR 11 HE2 TYR 11 15.164 4.638 -16.456
86 HE2 TYR 11 HE1 TYR 11 11.833 6.769 -14.856
87 HH TYR 11 HH TYR 11 14.564 7.430 -15.983
88 H ILE 12 H ILE 12 12.522 3.043 -10.562
89 HA ILE 12 HA ILE 12 14.040 5.401 -10.540
90 HB ILE 12 HB ILE 12 12.600 4.086 -8.233
91 HG12 ILE 12 1HG1 ILE 12 11.616 6.343 -9.974
92 HG13 ILE 12 2HG1 ILE 12 11.281 4.657 -10.349
93 HG21 ILE 12 1HG2 ILE 12 14.066 6.626 -8.511
94 HG22 ILE 12 2HG2 ILE 12 12.494 6.726 -7.718
95 HG23 ILE 12 3HG2 ILE 12 13.738 5.653 -7.077
96 HD11 ILE 12 3HD1 ILE 12 10.385 6.234 -7.959
97 HD12 ILE 12 1HD1 ILE 12 9.394 5.487 -9.212
98 HD13 ILE 12 2HD1 ILE 12 10.261 4.477 -8.055
99 H SER 13 H SER 13 14.502 2.308 -8.915
100 HA SER 13 HA SER 13 16.622 3.125 -7.229
101 HB2 SER 13 1HB SER 13 15.701 0.441 -8.241
102 HB3 SER 13 2HB SER 13 17.129 0.599 -7.218
103 HG SER 13 HG SER 13 15.644 0.429 -5.709
104 H ASP 14 H ASP 14 16.558 1.609 -10.433
105 HA ASP 14 HA ASP 14 19.363 1.367 -10.704
106 HB2 ASP 14 1HB ASP 14 17.073 1.348 -12.652
107 HB3 ASP 14 2HB ASP 14 18.740 1.286 -13.217
108 H HIS 15 H HIS 15 17.068 3.898 -11.577
109 HA HIS 15 HA HIS 15 19.220 5.536 -12.680
110 HB2 HIS 15 1HB HIS 15 16.244 5.598 -12.802
111 HB3 HIS 15 2HB HIS 15 17.103 7.127 -12.963
112 HD1 HIS 15 HD1 HIS 15 17.271 7.689 -15.356
113 HD2 HIS 15 HD2 HIS 15 17.771 3.617 -14.698
114 HE1 HIS 15 HE1 HIS 15 17.739 6.694 -17.618
115 H LEU 16 H LEU 16 18.676 4.865 -9.737
116 HA LEU 16 HA LEU 16 17.866 7.203 -8.405
117 HB2 LEU 16 1HB LEU 16 18.046 4.952 -7.382
118 HB3 LEU 16 2HB LEU 16 19.801 5.104 -7.436
119 HG LEU 16 HG LEU 16 19.169 7.328 -6.041
120 HD11 LEU 16 1HD1 LEU 16 17.389 5.529 -4.598
121 HD12 LEU 16 2HD1 LEU 16 16.741 6.058 -6.150
122 HD13 LEU 16 3HD1 LEU 16 17.227 7.251 -4.946
123 HD21 LEU 16 3HD2 LEU 16 20.285 6.311 -4.358
124 HD22 LEU 16 1HD2 LEU 16 20.594 5.099 -5.601
125 HD23 LEU 16 2HD2 LEU 16 19.296 4.852 -4.434
126 H ALA 17 H ALA 17 20.850 6.319 -9.916
127 HA ALA 17 HA ALA 17 22.327 8.472 -8.620
128 HB1 ALA 17 1HB ALA 17 23.971 7.441 -10.574
129 HB2 ALA 17 2HB ALA 17 23.942 6.955 -8.878
130 HB3 ALA 17 3HB ALA 17 23.014 6.047 -10.072
131 H ASP 18 H ASP 18 20.551 7.872 -11.497
132 HA ASP 18 HA ASP 18 21.798 9.675 -13.259
133 HB2 ASP 18 1HB ASP 18 19.881 7.885 -13.616
134 HB3 ASP 18 2HB ASP 18 18.838 9.280 -13.358
135 H SER 19 H SER 19 21.573 11.830 -13.618
136 HA SER 19 HA SER 19 20.504 13.410 -11.463
137 HB2 SER 19 1HB SER 19 21.518 14.543 -14.058
138 HB3 SER 19 2HB SER 19 21.603 15.238 -12.439
139 HG SER 19 HG SER 19 23.465 13.879 -13.646
140 H ASN 20 H ASN 20 19.845 13.146 -14.953
141 HA ASN 20 HA ASN 20 17.502 14.804 -14.765
142 HB2 ASN 20 1HB ASN 20 18.267 13.033 -17.087
143 HB3 ASN 20 2HB ASN 20 17.282 14.493 -17.117
144 HD21 ASN 20 2HD2 ASN 20 18.248 16.456 -17.240
145 HD22 ASN 20 1HD2 ASN 20 19.952 16.679 -17.420
146 H PHE 21 H PHE 21 15.775 14.032 -13.731
147 HA PHE 21 HA PHE 21 14.951 11.257 -14.279
148 HB2 PHE 21 1HB PHE 21 15.569 11.763 -11.904
149 HB3 PHE 21 2HB PHE 21 14.240 12.917 -11.855
150 HD1 PHE 21 HD2 PHE 21 14.624 9.424 -13.118
151 HD2 PHE 21 HD1 PHE 21 12.477 12.129 -10.630
152 HE1 PHE 21 HE2 PHE 21 13.082 7.613 -12.484
153 HE2 PHE 21 HE1 PHE 21 10.933 10.323 -9.992
154 HZ PHE 21 HZ PHE 21 11.234 8.062 -10.921
155 H ASP 22 H ASP 22 13.105 10.973 -15.338
156 HA ASP 22 HA ASP 22 11.225 13.238 -15.493
157 HB2 ASP 22 1HB ASP 22 12.430 12.588 -17.627
158 HB3 ASP 22 2HB ASP 22 11.545 11.066 -17.566
159 H ILE 23 H ILE 23 9.478 12.872 -14.306
160 HA ILE 23 HA ILE 23 8.686 10.444 -13.223
161 HB ILE 23 HB ILE 23 7.900 12.693 -12.471
162 HG12 ILE 23 1HG1 ILE 23 5.530 11.918 -11.995
163 HG13 ILE 23 2HG1 ILE 23 5.868 10.526 -13.017
164 HG21 ILE 23 1HG2 ILE 23 7.341 13.525 -14.746
165 HG22 ILE 23 2HG2 ILE 23 5.936 12.459 -14.745
166 HG23 ILE 23 3HG2 ILE 23 6.052 13.766 -13.566
167 HD11 ILE 23 3HD1 ILE 23 6.366 10.808 -10.283
168 HD12 ILE 23 1HD1 ILE 23 6.845 9.478 -11.336
169 HD13 ILE 23 2HD1 ILE 23 7.944 10.832 -11.070
170 H ALA 24 H ALA 24 8.029 11.812 -16.354
171 HA ALA 24 HA ALA 24 5.789 10.300 -17.090
172 HB1 ALA 24 1HB ALA 24 6.165 11.973 -18.590
173 HB2 ALA 24 2HB ALA 24 7.916 11.762 -18.559
174 HB3 ALA 24 3HB ALA 24 6.907 10.634 -19.465
175 H SER 25 H SER 25 9.250 9.601 -17.360
176 HA SER 25 HA SER 25 9.014 7.201 -18.808
177 HB2 SER 25 1HB SER 25 11.140 8.370 -17.039
178 HB3 SER 25 2HB SER 25 11.305 6.724 -17.650
179 HG SER 25 HG SER 25 11.941 8.910 -18.902
180 H VAL 26 H VAL 26 8.664 7.939 -15.422
181 HA VAL 26 HA VAL 26 8.885 5.275 -14.449
182 HB VAL 26 HB VAL 26 7.489 7.653 -13.212
183 HG11 VAL 26 1HG1 VAL 26 8.393 5.057 -11.969
184 HG12 VAL 26 2HG1 VAL 26 7.707 6.433 -11.103
185 HG13 VAL 26 3HG1 VAL 26 6.723 5.540 -12.262
186 HG21 VAL 26 3HG2 VAL 26 10.184 7.310 -13.730
187 HG22 VAL 26 1HG2 VAL 26 9.478 8.420 -12.554
188 HG23 VAL 26 2HG2 VAL 26 10.013 6.818 -12.045
189 H ALA 27 H ALA 27 6.183 7.289 -15.500
190 HA ALA 27 HA ALA 27 4.125 5.512 -14.710
191 HB1 ALA 27 1HB ALA 27 4.282 8.063 -15.859
192 HB2 ALA 27 2HB ALA 27 3.367 7.073 -16.996
193 HB3 ALA 27 3HB ALA 27 2.834 7.211 -15.321
194 H GLN 28 H GLN 28 5.707 6.073 -17.849
195 HA GLN 28 HA GLN 28 4.260 4.145 -19.289
196 HB2 GLN 28 1HB GLN 28 6.052 4.297 -20.950
197 HB3 GLN 28 2HB GLN 28 5.579 5.892 -20.381
198 HG2 GLN 28 1HG GLN 28 7.526 5.883 -18.860
199 HG3 GLN 28 2HG GLN 28 8.019 4.339 -19.552
200 HE21 GLN 28 2HE2 GLN 28 9.160 4.322 -21.391
201 HE22 GLN 28 1HE2 GLN 28 9.553 5.723 -22.322
202 H HIS 29 H HIS 29 7.190 3.921 -17.355
203 HA HIS 29 HA HIS 29 8.049 1.380 -18.115
204 HB2 HIS 29 1HB HIS 29 9.508 2.692 -16.777
205 HB3 HIS 29 2HB HIS 29 8.295 2.889 -15.515
206 HD1 HIS 29 HD1 HIS 29 9.330 -0.397 -17.081
207 HD2 HIS 29 HD2 HIS 29 9.589 1.626 -13.461
208 HE1 HIS 29 HE1 HIS 29 10.278 -2.059 -15.448
209 H VAL 30 H VAL 30 5.538 2.373 -15.876
210 HA VAL 30 HA VAL 30 5.019 -0.422 -15.160
211 HB VAL 30 HB VAL 30 3.463 0.499 -13.473
212 HG11 VAL 30 1HG1 VAL 30 5.199 1.529 -12.023
213 HG12 VAL 30 2HG1 VAL 30 5.718 0.027 -12.792
214 HG13 VAL 30 3HG1 VAL 30 6.277 1.579 -13.418
215 HG21 VAL 30 3HG2 VAL 30 3.153 2.787 -13.113
216 HG22 VAL 30 1HG2 VAL 30 4.544 3.225 -14.106
217 HG23 VAL 30 2HG2 VAL 30 3.072 2.621 -14.867
218 H CYS 31 H CYS 31 4.335 1.080 -17.748
219 HA CYS 31 HA CYS 31 2.625 1.215 -19.247
220 HB2 CYS 31 1HB CYS 31 1.699 -1.187 -17.660
221 HB3 CYS 31 2HB CYS 31 1.047 -0.711 -19.223
222 HG CYS 31 HG CYS 31 3.569 -1.021 -20.520
223 H LEU 32 H LEU 32 2.358 2.889 -16.962
224 HA LEU 32 HA LEU 32 -0.561 3.182 -16.939
225 HB2 LEU 32 1HB LEU 32 1.088 2.506 -14.700
226 HB3 LEU 32 2HB LEU 32 0.390 4.105 -14.450
227 HG LEU 32 HG LEU 32 -0.899 2.178 -13.473
228 HD11 LEU 32 1HD1 LEU 32 -1.920 4.353 -13.849
229 HD12 LEU 32 2HD1 LEU 32 -3.072 3.058 -14.174
230 HD13 LEU 32 3HD1 LEU 32 -2.297 3.904 -15.513
231 HD21 LEU 32 3HD2 LEU 32 -2.025 0.653 -14.803
232 HD22 LEU 32 1HD2 LEU 32 -0.467 0.789 -15.618
233 HD23 LEU 32 2HD2 LEU 32 -1.871 1.647 -16.253
234 H SER 33 H SER 33 -1.239 5.378 -16.221
235 HA SER 33 HA SER 33 0.370 7.353 -17.565
236 HB2 SER 33 1HB SER 33 -1.745 8.671 -16.289
237 HB3 SER 33 2HB SER 33 -1.696 8.133 -17.967
238 HG SER 33 HG SER 33 -3.272 6.870 -17.410
239 HA PRO 34 HA PRO 34 2.407 9.217 -14.157
240 HB2 PRO 34 1HB PRO 34 2.256 11.859 -14.764
241 HB3 PRO 34 2HB PRO 34 3.296 10.730 -15.640
242 HG2 PRO 34 1HG PRO 34 0.595 11.786 -16.384
243 HG3 PRO 34 2HG PRO 34 2.030 11.568 -17.402
244 HD2 PRO 34 1HD PRO 34 -0.032 9.813 -17.397
245 HD3 PRO 34 2HD PRO 34 1.647 9.312 -17.677
246 H SER 35 H SER 35 -0.688 10.748 -14.989
247 HA SER 35 HA SER 35 -1.056 12.024 -12.486
248 HB2 SER 35 1HB SER 35 -3.128 11.212 -14.539
249 HB3 SER 35 2HB SER 35 -3.376 12.360 -13.223
250 HG SER 35 HG SER 35 -2.884 13.538 -15.032
251 H ARG 36 H ARG 36 -2.204 8.948 -13.819
252 HA ARG 36 HA ARG 36 -3.721 8.243 -11.509
253 HB2 ARG 36 1HB ARG 36 -3.609 7.322 -14.076
254 HB3 ARG 36 2HB ARG 36 -2.750 6.050 -13.217
255 HG2 ARG 36 1HG ARG 36 -5.363 6.997 -12.151
256 HG3 ARG 36 2HG ARG 36 -5.340 5.933 -13.559
257 HD2 ARG 36 1HD ARG 36 -3.703 4.520 -12.084
258 HD3 ARG 36 2HD ARG 36 -4.459 5.402 -10.757
259 HE ARG 36 HE ARG 36 -5.624 3.305 -12.324
260 HH11 ARG 36 2HH1 ARG 36 -6.302 6.137 -10.416
261 HH12 ARG 36 1HH1 ARG 36 -7.912 5.639 -10.012
262 HH21 ARG 36 2HH2 ARG 36 -7.742 2.639 -11.799
263 HH22 ARG 36 1HH2 ARG 36 -8.730 3.649 -10.799
264 H LEU 37 H LEU 37 -0.514 7.339 -12.728
265 HA LEU 37 HA LEU 37 0.111 5.499 -10.693
266 HB2 LEU 37 1HB LEU 37 1.374 5.521 -12.724
267 HB3 LEU 37 2HB LEU 37 1.861 7.195 -12.462
268 HG LEU 37 HG LEU 37 3.056 6.291 -10.364
269 HD11 LEU 37 1HD1 LEU 37 2.554 4.134 -9.979
270 HD12 LEU 37 2HD1 LEU 37 3.823 3.830 -11.165
271 HD13 LEU 37 3HD1 LEU 37 2.131 3.820 -11.662
272 HD21 LEU 37 3HD2 LEU 37 3.889 6.858 -12.878
273 HD22 LEU 37 1HD2 LEU 37 4.433 5.188 -12.713
274 HD23 LEU 37 2HD2 LEU 37 4.962 6.406 -11.551
275 H SER 38 H SER 38 0.750 8.972 -11.003
276 HA SER 38 HA SER 38 2.282 9.289 -8.683
277 HB2 SER 38 1HB SER 38 2.241 11.083 -10.252
278 HB3 SER 38 2HB SER 38 0.483 11.200 -10.178
279 HG SER 38 HG SER 38 1.490 12.832 -8.939
280 H HIS 39 H HIS 39 -1.208 9.303 -9.178
281 HA HIS 39 HA HIS 39 -1.991 10.217 -6.652
282 HB2 HIS 39 1HB HIS 39 -3.514 9.980 -8.595
283 HB3 HIS 39 2HB HIS 39 -3.436 8.230 -8.418
284 HD1 HIS 39 HD1 HIS 39 -5.271 11.161 -7.280
285 HD2 HIS 39 HD2 HIS 39 -4.591 7.303 -5.896
286 HE1 HIS 39 HE1 HIS 39 -7.040 10.749 -5.541
287 H LEU 40 H LEU 40 -1.509 6.893 -7.824
288 HA LEU 40 HA LEU 40 -2.074 5.692 -5.303
289 HB2 LEU 40 1HB LEU 40 -0.488 4.500 -7.567
290 HB3 LEU 40 2HB LEU 40 -1.359 3.642 -6.297
291 HG LEU 40 HG LEU 40 -2.626 5.269 -8.501
292 HD11 LEU 40 1HD1 LEU 40 -3.332 2.514 -8.529
293 HD12 LEU 40 2HD1 LEU 40 -1.574 2.644 -8.522
294 HD13 LEU 40 3HD1 LEU 40 -2.513 3.460 -9.772
295 HD21 LEU 40 3HD2 LEU 40 -4.696 4.078 -7.658
296 HD22 LEU 40 1HD2 LEU 40 -4.060 5.363 -6.631
297 HD23 LEU 40 2HD2 LEU 40 -3.761 3.674 -6.218
298 H PHE 41 H PHE 41 0.819 6.871 -6.875
299 HA PHE 41 HA PHE 41 2.707 5.622 -5.180
300 HB2 PHE 41 1HB PHE 41 2.825 7.201 -7.448
301 HB3 PHE 41 2HB PHE 41 3.523 8.234 -6.206
302 HD1 PHE 41 HD1 PHE 41 5.565 7.574 -5.042
303 HD2 PHE 41 HD2 PHE 41 3.939 5.218 -8.192
304 HE1 PHE 41 HE1 PHE 41 7.702 6.370 -5.241
305 HE2 PHE 41 HE2 PHE 41 6.072 4.010 -8.395
306 HZ PHE 41 HZ PHE 41 7.957 4.585 -6.918
307 H ARG 42 H ARG 42 1.361 8.920 -5.167
308 HA ARG 42 HA ARG 42 2.646 9.665 -2.741
309 HB2 ARG 42 1HB ARG 42 2.004 11.393 -4.272
310 HB3 ARG 42 2HB ARG 42 0.329 10.859 -4.262
311 HG2 ARG 42 1HG ARG 42 -0.127 11.860 -2.272
312 HG3 ARG 42 2HG ARG 42 1.525 11.682 -1.678
313 HD2 ARG 42 1HD ARG 42 1.150 14.002 -2.061
314 HD3 ARG 42 2HD ARG 42 2.216 13.421 -3.340
315 HE ARG 42 HE ARG 42 -0.305 13.209 -4.380
316 HH11 ARG 42 2HH1 ARG 42 1.608 15.780 -3.019
317 HH12 ARG 42 1HH1 ARG 42 0.865 17.017 -3.977
318 HH21 ARG 42 2HH2 ARG 42 -1.291 14.828 -5.648
319 HH22 ARG 42 1HH2 ARG 42 -0.785 16.475 -5.472
320 H GLN 43 H GLN 43 -0.326 8.052 -3.511
321 HA GLN 43 HA GLN 43 -1.553 8.483 -0.949
322 HB2 GLN 43 1HB GLN 43 -2.873 8.098 -3.009
323 HB3 GLN 43 2HB GLN 43 -2.235 6.462 -3.091
324 HG2 GLN 43 1HG GLN 43 -3.574 7.277 -0.580
325 HG3 GLN 43 2HG GLN 43 -4.585 7.031 -2.003
326 HE21 GLN 43 2HE2 GLN 43 -5.361 5.351 -0.378
327 HE22 GLN 43 1HE2 GLN 43 -4.637 3.787 -0.500
328 H GLN 44 H GLN 44 0.214 5.850 -2.517
329 HA GLN 44 HA GLN 44 -0.038 4.113 -0.231
330 HB2 GLN 44 1HB GLN 44 1.567 3.908 -2.780
331 HB3 GLN 44 2HB GLN 44 1.572 2.672 -1.529
332 HG2 GLN 44 1HG GLN 44 -0.919 3.610 -2.926
333 HG3 GLN 44 2HG GLN 44 0.050 2.239 -3.464
334 HE21 GLN 44 2HE2 GLN 44 -2.647 2.071 -2.730
335 HE22 GLN 44 1HE2 GLN 44 -2.765 1.088 -1.314
336 H LEU 45 H LEU 45 2.445 6.186 -1.637
337 HA LEU 45 HA LEU 45 4.362 5.449 0.418
338 HB2 LEU 45 1HB LEU 45 4.573 7.501 -1.780
339 HB3 LEU 45 2HB LEU 45 5.888 6.940 -0.750
340 HG LEU 45 HG LEU 45 4.637 5.658 -3.111
341 HD11 LEU 45 1HD1 LEU 45 6.930 5.001 -3.539
342 HD12 LEU 45 2HD1 LEU 45 7.424 5.612 -1.961
343 HD13 LEU 45 3HD1 LEU 45 6.845 6.729 -3.196
344 HD21 LEU 45 3HD2 LEU 45 5.498 4.183 -0.648
345 HD22 LEU 45 1HD2 LEU 45 5.661 3.459 -2.247
346 HD23 LEU 45 2HD2 LEU 45 4.070 3.934 -1.654
347 H GLY 46 H GLY 46 1.919 7.770 -0.072
348 HA2 GLY 46 1HA GLY 46 1.182 9.497 1.252
349 HA3 GLY 46 2HA GLY 46 2.309 8.939 2.479
350 H ILE 47 H ILE 47 3.890 9.521 -0.425
351 HA ILE 47 HA ILE 47 4.344 12.350 0.061
352 HB ILE 47 HB ILE 47 6.749 12.165 0.251
353 HG12 ILE 47 1HG1 ILE 47 6.305 9.172 0.222
354 HG13 ILE 47 2HG1 ILE 47 7.054 10.112 -1.063
355 HG21 ILE 47 1HG2 ILE 47 5.379 12.109 2.300
356 HG22 ILE 47 2HG2 ILE 47 5.417 10.347 2.252
357 HG23 ILE 47 3HG2 ILE 47 6.910 11.255 2.486
358 HD11 ILE 47 3HD1 ILE 47 8.910 10.662 0.362
359 HD12 ILE 47 1HD1 ILE 47 8.138 9.864 1.732
360 HD13 ILE 47 2HD1 ILE 47 8.677 8.914 0.346
361 H SER 48 H SER 48 6.003 13.204 -1.580
362 HA SER 48 HA SER 48 5.125 12.371 -4.183
363 HB2 SER 48 1HB SER 48 7.222 14.420 -3.423
364 HB3 SER 48 2HB SER 48 6.476 14.237 -5.011
365 HG SER 48 HG SER 48 5.593 15.622 -2.912
366 H VAL 49 H VAL 49 6.499 11.721 -5.924
367 HA VAL 49 HA VAL 49 8.186 9.594 -5.370
368 HB VAL 49 HB VAL 49 8.315 11.319 -7.846
369 HG11 VAL 49 1HG1 VAL 49 8.985 8.408 -7.423
370 HG12 VAL 49 2HG1 VAL 49 9.092 9.292 -8.946
371 HG13 VAL 49 3HG1 VAL 49 10.155 9.714 -7.603
372 HG21 VAL 49 3HG2 VAL 49 6.775 9.017 -8.317
373 HG22 VAL 49 1HG2 VAL 49 6.171 9.719 -6.816
374 HG23 VAL 49 2HG2 VAL 49 6.228 10.693 -8.285
375 H LEU 50 H LEU 50 9.010 12.974 -6.049
376 HA LEU 50 HA LEU 50 11.799 12.671 -6.076
377 HB2 LEU 50 1HB LEU 50 9.923 14.939 -5.648
378 HB3 LEU 50 2HB LEU 50 11.621 15.171 -5.240
379 HG LEU 50 HG LEU 50 12.273 14.726 -7.524
380 HD11 LEU 50 1HD1 LEU 50 10.894 13.175 -8.464
381 HD12 LEU 50 2HD1 LEU 50 10.208 14.638 -9.170
382 HD13 LEU 50 3HD1 LEU 50 9.435 13.886 -7.774
383 HD21 LEU 50 3HD2 LEU 50 10.738 16.571 -8.623
384 HD22 LEU 50 1HD2 LEU 50 11.914 16.976 -7.372
385 HD23 LEU 50 2HD2 LEU 50 10.210 16.791 -6.954
386 H SER 51 H SER 51 9.521 13.151 -3.442
387 HA SER 51 HA SER 51 11.506 13.602 -1.441
388 HB2 SER 51 1HB SER 51 9.359 14.451 -0.938
389 HB3 SER 51 2HB SER 51 8.569 12.928 -1.346
390 HG SER 51 HG SER 51 8.869 13.433 0.968
391 H TRP 52 H TRP 52 9.599 10.787 -2.444
392 HA TRP 52 HA TRP 52 10.496 8.996 -0.495
393 HB2 TRP 52 1HB TRP 52 8.590 8.500 -1.935
394 HB3 TRP 52 2HB TRP 52 9.644 8.447 -3.346
395 HD1 TRP 52 HD1 TRP 52 9.481 6.585 0.070
396 HE1 TRP 52 HE1 TRP 52 10.001 4.103 -0.367
397 HE3 TRP 52 HE3 TRP 52 10.303 6.804 -4.971
398 HZ2 TRP 52 HZ2 TRP 52 10.671 2.455 -2.559
399 HZ3 TRP 52 HZ3 TRP 52 10.879 4.730 -6.163
400 HH2 TRP 52 HH2 TRP 52 11.060 2.602 -4.980
401 H ARG 53 H ARG 53 11.852 9.846 -3.646
402 HA ARG 53 HA ARG 53 13.853 7.906 -3.785
403 HB2 ARG 53 1HB ARG 53 13.049 9.797 -5.470
404 HB3 ARG 53 2HB ARG 53 14.427 10.652 -4.791
405 HG2 ARG 53 1HG ARG 53 15.827 8.651 -5.375
406 HG3 ARG 53 2HG ARG 53 14.432 8.032 -6.261
407 HD2 ARG 53 1HD ARG 53 15.868 9.157 -7.812
408 HD3 ARG 53 2HD ARG 53 14.421 10.139 -7.586
409 HE ARG 53 HE ARG 53 16.372 11.016 -5.784
410 HH11 ARG 53 2HH1 ARG 53 15.778 10.926 -9.213
411 HH12 ARG 53 1HH1 ARG 53 16.699 12.357 -9.542
412 HH21 ARG 53 2HH2 ARG 53 17.587 12.900 -6.204
413 HH22 ARG 53 1HH2 ARG 53 17.728 13.478 -7.830
414 H GLU 54 H GLU 54 13.952 11.177 -2.398
415 HA GLU 54 HA GLU 54 16.633 11.207 -1.643
416 HB2 GLU 54 1HB GLU 54 14.861 13.091 -1.578
417 HB3 GLU 54 2HB GLU 54 14.485 12.482 0.027
418 HG2 GLU 54 1HG GLU 54 16.495 13.149 0.906
419 HG3 GLU 54 2HG GLU 54 17.313 13.111 -0.655
420 H ASP 55 H ASP 55 13.786 10.123 0.181
421 HA ASP 55 HA ASP 55 15.025 9.496 2.584
422 HB2 ASP 55 1HB ASP 55 12.511 9.434 1.896
423 HB3 ASP 55 2HB ASP 55 12.844 7.756 1.476
424 H GLN 56 H GLN 56 14.696 7.550 -0.350
425 HA GLN 56 HA GLN 56 15.877 5.208 0.746
426 HB2 GLN 56 1HB GLN 56 14.501 5.776 -1.546
427 HB3 GLN 56 2HB GLN 56 16.141 5.599 -2.157
428 HG2 GLN 56 1HG GLN 56 14.871 3.508 -2.252
429 HG3 GLN 56 2HG GLN 56 16.298 3.384 -1.225
430 HE21 GLN 56 2HE2 GLN 56 12.811 3.911 -1.152
431 HE22 GLN 56 1HE2 GLN 56 12.555 3.203 0.403
432 H ARG 57 H ARG 57 17.123 7.931 -1.132
433 HA ARG 57 HA ARG 57 19.697 6.969 -1.615
434 HB2 ARG 57 1HB ARG 57 18.646 9.773 -1.254
435 HB3 ARG 57 2HB ARG 57 20.317 9.437 -1.690
436 HG2 ARG 57 1HG ARG 57 19.794 8.858 -3.807
437 HG3 ARG 57 2HG ARG 57 18.251 8.136 -3.345
438 HD2 ARG 57 1HD ARG 57 18.169 10.266 -4.740
439 HD3 ARG 57 2HD ARG 57 17.167 10.213 -3.290
440 HE ARG 57 HE ARG 57 19.754 11.378 -2.852
441 HH11 ARG 57 2HH1 ARG 57 16.491 11.984 -3.901
442 HH12 ARG 57 1HH1 ARG 57 16.544 13.674 -3.522
443 HH21 ARG 57 2HH2 ARG 57 19.837 13.602 -2.350
444 HH22 ARG 57 1HH2 ARG 57 18.448 14.593 -2.641
445 H ILE 58 H ILE 58 18.459 8.872 1.117
446 HA ILE 58 HA ILE 58 20.959 8.976 2.478
447 HB ILE 58 HB ILE 58 18.193 9.346 3.633
448 HG12 ILE 58 1HG1 ILE 58 18.600 10.855 1.733
449 HG13 ILE 58 2HG1 ILE 58 18.549 11.742 3.253
450 HG21 ILE 58 1HG2 ILE 58 19.760 9.034 5.391
451 HG22 ILE 58 2HG2 ILE 58 20.936 10.095 4.618
452 HG23 ILE 58 3HG2 ILE 58 19.447 10.766 5.284
453 HD11 ILE 58 3HD1 ILE 58 21.238 10.995 2.755
454 HD12 ILE 58 1HD1 ILE 58 20.578 11.719 1.289
455 HD13 ILE 58 2HD1 ILE 58 20.529 12.608 2.811
456 H SER 59 H SER 59 18.045 6.983 2.852
457 HA SER 59 HA SER 59 18.863 5.528 5.095
458 HB2 SER 59 1HB SER 59 16.573 5.400 4.419
459 HB3 SER 59 2HB SER 59 17.012 4.806 2.817
460 HG SER 59 HG SER 59 16.318 3.301 4.705
461 H GLN 60 H GLN 60 19.459 5.006 1.659
462 HA GLN 60 HA GLN 60 20.715 2.468 1.989
463 HB2 GLN 60 1HB GLN 60 19.671 3.576 -0.140
464 HB3 GLN 60 2HB GLN 60 21.275 4.267 -0.340
465 HG2 GLN 60 1HG GLN 60 21.124 2.273 -1.645
466 HG3 GLN 60 2HG GLN 60 22.220 1.985 -0.294
467 HE21 GLN 60 2HE2 GLN 60 21.917 0.199 0.825
468 HE22 GLN 60 1HE2 GLN 60 20.469 -0.743 0.865
469 H ALA 61 H ALA 61 21.916 5.780 1.591
470 HA ALA 61 HA ALA 61 24.655 5.166 1.526
471 HB1 ALA 61 1HB ALA 61 23.254 7.422 1.168
472 HB2 ALA 61 2HB ALA 61 23.859 7.708 2.800
473 HB3 ALA 61 3HB ALA 61 24.990 7.401 1.482
474 H LYS 62 H LYS 62 22.536 6.038 4.241
475 HA LYS 62 HA LYS 62 24.561 5.927 6.218
476 HB2 LYS 62 1HB LYS 62 22.790 6.076 7.822
477 HB3 LYS 62 2HB LYS 62 22.356 7.095 6.456
478 HG2 LYS 62 1HG LYS 62 20.870 5.346 5.619
479 HG3 LYS 62 2HG LYS 62 21.307 4.322 6.988
480 HD2 LYS 62 1HD LYS 62 19.960 7.018 7.156
481 HD3 LYS 62 2HD LYS 62 19.169 5.453 7.361
482 HE2 LYS 62 1HE LYS 62 21.303 6.667 9.110
483 HE3 LYS 62 2HE LYS 62 19.614 6.384 9.530
484 HZ1 LYS 62 3HZ LYS 62 21.832 4.492 9.374
485 HZ2 LYS 62 1HZ LYS 62 20.306 3.929 8.908
486 HZ3 LYS 62 2HZ LYS 62 20.539 4.555 10.462
487 H LEU 63 H LEU 63 22.415 3.536 4.824
488 HA LEU 63 HA LEU 63 22.736 1.508 6.743
489 HB2 LEU 63 1HB LEU 63 21.002 1.472 5.023
490 HB3 LEU 63 2HB LEU 63 22.234 1.272 3.779
491 HG LEU 63 HG LEU 63 22.047 -0.768 5.944
492 HD11 LEU 63 1HD1 LEU 63 19.756 -0.624 5.373
493 HD12 LEU 63 2HD1 LEU 63 20.405 -2.000 4.483
494 HD13 LEU 63 3HD1 LEU 63 20.119 -0.470 3.654
495 HD21 LEU 63 3HD2 LEU 63 22.439 -2.103 3.667
496 HD22 LEU 63 1HD2 LEU 63 23.757 -1.365 4.579
497 HD23 LEU 63 2HD2 LEU 63 23.080 -0.533 3.179
498 H LEU 64 H LEU 64 24.486 2.121 3.707
499 HA LEU 64 HA LEU 64 26.297 -0.043 4.041
500 HB2 LEU 64 1HB LEU 64 26.718 2.445 2.399
501 HB3 LEU 64 2HB LEU 64 27.489 0.875 2.180
502 HG LEU 64 HG LEU 64 24.573 0.783 1.984
503 HD11 LEU 64 1HD1 LEU 64 25.880 2.031 -0.371
504 HD12 LEU 64 2HD1 LEU 64 25.428 3.072 0.978
505 HD13 LEU 64 3HD1 LEU 64 24.201 2.101 0.164
506 HD21 LEU 64 3HD2 LEU 64 25.553 -0.204 -0.320
507 HD22 LEU 64 1HD2 LEU 64 25.448 -1.132 1.176
508 HD23 LEU 64 2HD2 LEU 64 26.971 -0.371 0.716
509 H LEU 65 H LEU 65 26.452 3.413 4.768
510 HA LEU 65 HA LEU 65 29.164 3.433 5.586
511 HB2 LEU 65 1HB LEU 65 26.878 5.267 5.656
512 HB3 LEU 65 2HB LEU 65 28.027 5.488 6.974
513 HG LEU 65 HG LEU 65 28.687 5.598 4.031
514 HD11 LEU 65 1HD1 LEU 65 28.398 7.778 6.092
515 HD12 LEU 65 2HD1 LEU 65 27.367 7.508 4.688
516 HD13 LEU 65 3HD1 LEU 65 29.047 7.998 4.467
517 HD21 LEU 65 3HD2 LEU 65 30.618 4.843 5.140
518 HD22 LEU 65 1HD2 LEU 65 30.345 5.909 6.518
519 HD23 LEU 65 2HD2 LEU 65 30.836 6.585 4.965
520 H SER 66 H SER 66 26.219 2.502 7.143
521 HA SER 66 HA SER 66 27.411 2.551 9.798
522 HB2 SER 66 1HB SER 66 24.658 1.799 8.804
523 HB3 SER 66 2HB SER 66 25.152 1.643 10.490
524 HG SER 66 HG SER 66 25.264 3.799 10.677
525 H THR 67 H THR 67 26.713 0.320 7.237
526 HA THR 67 HA THR 67 27.251 -1.994 8.937
527 HB THR 67 HB THR 67 25.396 -1.946 7.167
528 HG1 THR 67 HG1 THR 67 25.575 -4.095 7.099
529 HG21 THR 67 3HG2 THR 67 27.351 -2.871 5.166
530 HG22 THR 67 1HG2 THR 67 27.357 -1.137 5.483
531 HG23 THR 67 2HG2 THR 67 25.873 -1.932 4.958
532 H THR 68 H THR 68 28.920 0.152 6.943
533 HA THR 68 HA THR 68 31.210 -1.689 6.834
534 HB THR 68 HB THR 68 31.766 -1.167 4.631
535 HG1 THR 68 HG1 THR 68 31.414 0.759 3.822
536 HG21 THR 68 3HG2 THR 68 29.348 -2.286 5.106
537 HG22 THR 68 1HG2 THR 68 30.056 -2.118 3.501
538 HG23 THR 68 2HG2 THR 68 28.881 -0.935 4.075
539 H ARG 69 H ARG 69 33.264 -0.373 6.225
540 HA ARG 69 HA ARG 69 33.231 2.115 7.805
541 HB2 ARG 69 1HB ARG 69 34.600 -0.120 8.446
542 HB3 ARG 69 2HB ARG 69 35.793 0.677 7.428
543 HG2 ARG 69 1HG ARG 69 36.325 2.101 9.041
544 HG3 ARG 69 2HG ARG 69 34.634 2.531 9.306
545 HD2 ARG 69 1HD ARG 69 35.465 -0.114 10.308
546 HD3 ARG 69 2HD ARG 69 36.176 1.275 11.129
547 HE ARG 69 HE ARG 69 33.401 1.659 10.875
548 HH11 ARG 69 2HH1 ARG 69 35.705 -0.298 12.602
549 HH12 ARG 69 1HH1 ARG 69 34.676 -0.528 13.977
550 HH21 ARG 69 2HH2 ARG 69 32.037 1.364 12.680
551 HH22 ARG 69 1HH2 ARG 69 32.590 0.417 14.019
552 H MET 70 H MET 70 32.950 1.498 4.816
553 HA MET 70 HA MET 70 35.237 2.425 3.473
554 HB2 MET 70 1HB MET 70 32.317 2.450 2.711
555 HB3 MET 70 2HB MET 70 33.596 2.965 1.619
556 HG2 MET 70 1HG MET 70 34.614 0.734 1.797
557 HG3 MET 70 2HG MET 70 33.279 0.229 2.829
558 HE1 MET 70 3HE MET 70 30.964 -0.517 1.986
559 HE2 MET 70 1HE MET 70 30.696 1.211 1.759
560 HE3 MET 70 2HE MET 70 30.254 0.076 0.484
561 HA PRO 71 HA PRO 71 35.269 6.768 4.105
562 HB2 PRO 71 1HB PRO 71 36.143 7.659 1.694
563 HB3 PRO 71 2HB PRO 71 37.190 6.822 2.846
564 HG2 PRO 71 1HG PRO 71 35.793 5.744 0.428
565 HG3 PRO 71 2HG PRO 71 37.448 5.445 0.990
566 HD2 PRO 71 1HD PRO 71 35.428 3.689 1.404
567 HD3 PRO 71 2HD PRO 71 36.771 3.888 2.549
568 H ILE 72 H ILE 72 34.327 8.805 3.432
569 HA ILE 72 HA ILE 72 31.622 8.587 2.693
570 HB ILE 72 HB ILE 72 33.373 11.048 2.697
571 HG12 ILE 72 1HG1 ILE 72 31.411 10.265 4.834
572 HG13 ILE 72 2HG1 ILE 72 33.054 9.633 4.852
573 HG21 ILE 72 1HG2 ILE 72 31.596 11.933 1.642
574 HG22 ILE 72 2HG2 ILE 72 30.530 10.610 2.112
575 HG23 ILE 72 3HG2 ILE 72 30.868 11.916 3.248
576 HD11 ILE 72 3HD1 ILE 72 33.281 11.464 6.191
577 HD12 ILE 72 1HD1 ILE 72 33.692 12.162 4.624
578 HD13 ILE 72 2HD1 ILE 72 32.081 12.402 5.302
579 H ALA 73 H ALA 73 34.518 9.195 0.840
580 HA ALA 73 HA ALA 73 33.313 10.225 -1.493
581 HB1 ALA 73 1HB ALA 73 35.618 10.555 -1.324
582 HB2 ALA 73 2HB ALA 73 35.928 8.856 -0.963
583 HB3 ALA 73 3HB ALA 73 35.451 9.338 -2.590
584 H THR 74 H THR 74 34.245 6.916 -0.586
585 HA THR 74 HA THR 74 33.407 5.696 -2.989
586 HB THR 74 HB THR 74 33.662 4.494 -0.225
587 HG1 THR 74 HG1 THR 74 35.693 3.775 -1.112
588 HG21 THR 74 3HG2 THR 74 33.497 3.149 -2.924
589 HG22 THR 74 1HG2 THR 74 32.253 3.117 -1.675
590 HG23 THR 74 2HG2 THR 74 33.811 2.340 -1.389
591 H VAL 75 H VAL 75 31.798 5.982 0.176
592 HA VAL 75 HA VAL 75 29.435 4.649 -0.499
593 HB VAL 75 HB VAL 75 29.708 6.938 1.453
594 HG11 VAL 75 1HG1 VAL 75 27.619 6.520 2.125
595 HG12 VAL 75 2HG1 VAL 75 27.435 5.639 0.607
596 HG13 VAL 75 3HG1 VAL 75 27.863 4.774 2.083
597 HG21 VAL 75 3HG2 VAL 75 31.001 5.623 2.691
598 HG22 VAL 75 1HG2 VAL 75 29.699 4.435 2.762
599 HG23 VAL 75 2HG2 VAL 75 30.904 4.347 1.477
600 H GLY 76 H GLY 76 30.357 8.043 -0.855
601 HA2 GLY 76 1HA GLY 76 27.892 9.130 -1.547
602 HA3 GLY 76 2HA GLY 76 29.444 9.732 -2.113
603 H ARG 77 H ARG 77 30.120 7.241 -3.487
604 HA ARG 77 HA ARG 77 28.978 7.842 -6.008
605 HB2 ARG 77 1HB ARG 77 30.704 5.596 -4.995
606 HB3 ARG 77 2HB ARG 77 30.099 5.610 -6.646
607 HG2 ARG 77 1HG ARG 77 31.151 7.914 -6.849
608 HG3 ARG 77 2HG ARG 77 31.981 7.543 -5.337
609 HD2 ARG 77 1HD ARG 77 33.457 6.962 -7.106
610 HD3 ARG 77 2HD ARG 77 32.838 5.456 -6.430
611 HE ARG 77 HE ARG 77 31.209 6.228 -8.581
612 HH11 ARG 77 2HH1 ARG 77 34.426 5.062 -7.943
613 HH12 ARG 77 1HH1 ARG 77 34.587 4.277 -9.479
614 HH21 ARG 77 2HH2 ARG 77 31.408 5.198 -10.606
615 HH22 ARG 77 1HH2 ARG 77 32.870 4.356 -10.994
616 H ASN 78 H ASN 78 28.246 5.477 -3.529
617 HA ASN 78 HA ASN 78 26.574 3.798 -5.050
618 HB2 ASN 78 1HB ASN 78 27.132 4.246 -2.189
619 HB3 ASN 78 2HB ASN 78 25.534 3.594 -2.538
620 HD21 ASN 78 2HD2 ASN 78 28.399 2.658 -1.577
621 HD22 ASN 78 1HD2 ASN 78 28.530 1.111 -2.334
622 H VAL 79 H VAL 79 26.023 6.849 -3.439
623 HA VAL 79 HA VAL 79 23.146 6.698 -3.902
624 HB VAL 79 HB VAL 79 23.108 8.942 -2.785
625 HG11 VAL 79 1HG1 VAL 79 22.982 7.981 -0.736
626 HG12 VAL 79 2HG1 VAL 79 23.117 6.503 -1.690
627 HG13 VAL 79 3HG1 VAL 79 24.541 7.174 -0.895
628 HG21 VAL 79 3HG2 VAL 79 25.112 9.685 -1.600
629 HG22 VAL 79 1HG2 VAL 79 26.030 8.357 -2.311
630 HG23 VAL 79 2HG2 VAL 79 25.387 9.635 -3.342
631 H GLY 80 H GLY 80 25.588 7.235 -5.869
632 HA2 GLY 80 1HA GLY 80 25.600 8.167 -7.989
633 HA3 GLY 80 2HA GLY 80 24.033 8.884 -7.646
634 H PHE 81 H PHE 81 26.087 9.628 -5.148
635 HA PHE 81 HA PHE 81 26.482 12.322 -6.213
636 HB2 PHE 81 1HB PHE 81 26.639 11.194 -3.416
637 HB3 PHE 81 2HB PHE 81 27.083 12.851 -3.812
638 HD1 PHE 81 HD2 PHE 81 24.937 13.385 -5.858
639 HD2 PHE 81 HD1 PHE 81 24.800 11.572 -2.009
640 HE1 PHE 81 HE2 PHE 81 22.586 14.071 -5.622
641 HE2 PHE 81 HE1 PHE 81 22.449 12.254 -1.767
642 HZ PHE 81 HZ PHE 81 21.339 13.506 -3.574
643 H ASP 82 H ASP 82 28.360 12.804 -7.116
644 HA ASP 82 HA ASP 82 30.698 11.170 -6.665
645 HB2 ASP 82 1HB ASP 82 30.390 11.864 -8.913
646 HB3 ASP 82 2HB ASP 82 30.128 13.540 -8.439
647 H ASP 83 H ASP 83 29.513 14.313 -5.712
648 HA ASP 83 HA ASP 83 32.057 15.122 -4.586
649 HB2 ASP 83 1HB ASP 83 29.346 16.383 -4.817
650 HB3 ASP 83 2HB ASP 83 30.523 17.038 -3.682
651 H GLN 84 H GLN 84 32.727 14.474 -2.660
652 HA GLN 84 HA GLN 84 31.158 12.981 -0.869
653 HB2 GLN 84 1HB GLN 84 33.067 13.343 0.723
654 HB3 GLN 84 2HB GLN 84 33.528 12.690 -0.843
655 HG2 GLN 84 1HG GLN 84 34.341 14.820 -1.565
656 HG3 GLN 84 2HG GLN 84 33.715 15.601 -0.114
657 HE21 GLN 84 2HE2 GLN 84 34.521 14.303 1.945
658 HE22 GLN 84 1HE2 GLN 84 36.234 14.081 1.994
659 H LEU 85 H LEU 85 31.952 16.403 -1.016
660 HA LEU 85 HA LEU 85 30.926 17.081 1.542
661 HB2 LEU 85 1HB LEU 85 31.493 18.678 -0.939
662 HB3 LEU 85 2HB LEU 85 30.835 19.413 0.521
663 HG LEU 85 HG LEU 85 33.394 17.859 0.624
664 HD11 LEU 85 1HD1 LEU 85 33.229 19.820 -1.165
665 HD12 LEU 85 2HD1 LEU 85 34.671 19.548 -0.189
666 HD13 LEU 85 3HD1 LEU 85 33.517 20.797 0.275
667 HD21 LEU 85 3HD2 LEU 85 33.785 19.051 2.594
668 HD22 LEU 85 1HD2 LEU 85 32.063 18.676 2.658
669 HD23 LEU 85 2HD2 LEU 85 32.596 20.291 2.191
670 H TYR 86 H TYR 86 29.509 16.777 -1.645
671 HA TYR 86 HA TYR 86 27.106 18.141 -1.220
672 HB2 TYR 86 1HB TYR 86 27.953 17.289 -3.422
673 HB3 TYR 86 2HB TYR 86 27.474 15.670 -2.923
674 HD1 TYR 86 HD2 TYR 86 24.991 15.325 -2.313
675 HD2 TYR 86 HD1 TYR 86 26.425 18.684 -4.497
676 HE1 TYR 86 HE2 TYR 86 22.722 15.728 -3.171
677 HE2 TYR 86 HE1 TYR 86 24.160 19.097 -5.361
678 HH TYR 86 HH TYR 86 21.534 18.168 -4.153
679 H PHE 87 H PHE 87 27.891 14.706 -0.744
680 HA PHE 87 HA PHE 87 25.329 13.969 0.203
681 HB2 PHE 87 1HB PHE 87 26.774 12.252 -0.629
682 HB3 PHE 87 2HB PHE 87 28.044 12.685 0.510
683 HD1 PHE 87 HD1 PHE 87 24.423 11.785 0.688
684 HD2 PHE 87 HD2 PHE 87 28.353 11.191 2.211
685 HE1 PHE 87 HE1 PHE 87 23.551 10.126 2.282
686 HE2 PHE 87 HE2 PHE 87 27.488 9.530 3.807
687 HZ PHE 87 HZ PHE 87 25.084 8.995 3.844
688 H SER 88 H SER 88 28.293 14.995 1.826
689 HA SER 88 HA SER 88 27.410 14.520 4.467
690 HB2 SER 88 1HB SER 88 29.399 16.637 3.638
691 HB3 SER 88 2HB SER 88 29.316 15.774 5.173
692 HG SER 88 HG SER 88 30.836 14.673 4.121
693 H ARG 89 H ARG 89 27.154 17.298 2.317
694 HA ARG 89 HA ARG 89 26.219 19.164 4.201
695 HB2 ARG 89 1HB ARG 89 25.862 18.947 1.215
696 HB3 ARG 89 2HB ARG 89 25.217 20.292 2.146
697 HG2 ARG 89 1HG ARG 89 28.097 19.615 2.440
698 HG3 ARG 89 2HG ARG 89 27.559 20.440 0.975
699 HD2 ARG 89 1HD ARG 89 26.771 22.296 2.185
700 HD3 ARG 89 2HD ARG 89 26.827 21.424 3.716
701 HE ARG 89 HE ARG 89 29.415 21.454 2.901
702 HH11 ARG 89 2HH1 ARG 89 26.995 23.915 3.355
703 HH12 ARG 89 1HH1 ARG 89 28.140 25.149 3.767
704 HH21 ARG 89 2HH2 ARG 89 30.932 23.069 3.443
705 HH22 ARG 89 1HH2 ARG 89 30.379 24.666 3.816
706 H VAL 90 H VAL 90 24.433 17.071 1.941
707 HA VAL 90 HA VAL 90 21.867 17.852 2.889
708 HB VAL 90 HB VAL 90 22.671 15.382 1.346
709 HG11 VAL 90 1HG1 VAL 90 20.590 14.693 1.741
710 HG12 VAL 90 2HG1 VAL 90 20.143 16.234 2.476
711 HG13 VAL 90 3HG1 VAL 90 20.049 16.030 0.727
712 HG21 VAL 90 3HG2 VAL 90 23.180 17.019 -0.152
713 HG22 VAL 90 1HG2 VAL 90 21.448 16.900 -0.465
714 HG23 VAL 90 2HG2 VAL 90 22.071 18.182 0.574
715 H PHE 91 H PHE 91 23.923 15.017 3.478
716 HA PHE 91 HA PHE 91 22.149 13.640 5.158
717 HB2 PHE 91 1HB PHE 91 24.099 12.550 4.188
718 HB3 PHE 91 2HB PHE 91 25.173 13.604 5.102
719 HD1 PHE 91 HD1 PHE 91 25.501 13.287 7.483
720 HD2 PHE 91 HD2 PHE 91 22.962 10.709 5.242
721 HE1 PHE 91 HE1 PHE 91 25.521 11.665 9.333
722 HE2 PHE 91 HE2 PHE 91 22.977 9.083 7.089
723 HZ PHE 91 HZ PHE 91 24.257 9.560 9.138
724 H LYS 92 H LYS 92 24.492 16.174 5.805
725 HA LYS 92 HA LYS 92 24.598 16.030 8.586
726 HB2 LYS 92 1HB LYS 92 26.130 17.445 7.397
727 HB3 LYS 92 2HB LYS 92 24.814 18.400 6.727
728 HG2 LYS 92 1HG LYS 92 24.260 19.174 9.004
729 HG3 LYS 92 2HG LYS 92 25.656 18.283 9.615
730 HD2 LYS 92 1HD LYS 92 27.171 19.715 8.617
731 HD3 LYS 92 2HD LYS 92 26.015 20.252 7.396
732 HE2 LYS 92 1HE LYS 92 24.861 21.609 8.961
733 HE3 LYS 92 2HE LYS 92 25.714 20.884 10.323
734 HZ1 LYS 92 3HZ LYS 92 26.403 23.194 9.115
735 HZ2 LYS 92 1HZ LYS 92 27.449 22.094 8.369
736 HZ3 LYS 92 2HZ LYS 92 27.444 22.247 10.053
737 H LYS 93 H LYS 93 22.382 17.877 6.510
738 HA LYS 93 HA LYS 93 20.868 18.883 8.728
739 HB2 LYS 93 1HB LYS 93 20.535 18.944 5.744
740 HB3 LYS 93 2HB LYS 93 19.230 19.472 6.798
741 HG2 LYS 93 1HG LYS 93 20.348 21.337 7.484
742 HG3 LYS 93 2HG LYS 93 21.938 20.606 7.249
743 HD2 LYS 93 1HD LYS 93 21.641 22.301 5.582
744 HD3 LYS 93 2HD LYS 93 21.549 20.728 4.786
745 HE2 LYS 93 1HE LYS 93 19.205 20.862 4.573
746 HE3 LYS 93 2HE LYS 93 19.099 22.202 5.714
747 HZ1 LYS 93 3HZ LYS 93 18.834 23.013 3.484
748 HZ2 LYS 93 1HZ LYS 93 20.285 22.294 2.993
749 HZ3 LYS 93 2HZ LYS 93 20.307 23.577 4.095
750 H CYS 94 H CYS 94 20.766 16.062 6.723
751 HA CYS 94 HA CYS 94 18.082 15.324 7.024
752 HB2 CYS 94 1HB CYS 94 20.612 13.808 6.486
753 HB3 CYS 94 2HB CYS 94 19.114 12.931 6.777
754 HG CYS 94 HG CYS 94 18.053 13.278 4.447
755 H THR 95 H THR 95 20.927 14.422 8.961
756 HA THR 95 HA THR 95 19.129 13.363 11.027
757 HB THR 95 HB THR 95 21.267 12.439 12.025
758 HG1 THR 95 HG1 THR 95 23.053 13.097 11.116
759 HG21 THR 95 3HG2 THR 95 19.602 11.410 10.130
760 HG22 THR 95 1HG2 THR 95 20.893 10.510 10.924
761 HG23 THR 95 2HG2 THR 95 21.172 11.243 9.344
762 H GLY 96 H GLY 96 20.949 16.097 10.273
763 HA2 GLY 96 1HA GLY 96 20.895 18.066 11.586
764 HA3 GLY 96 2HA GLY 96 20.639 17.076 13.015
765 H ALA 97 H ALA 97 22.967 15.424 11.600
766 HA ALA 97 HA ALA 97 25.182 17.138 12.473
767 HB1 ALA 97 1HB ALA 97 25.296 14.275 13.255
768 HB2 ALA 97 2HB ALA 97 26.010 15.690 14.029
769 HB3 ALA 97 3HB ALA 97 24.287 15.360 14.212
770 H SER 98 H SER 98 27.161 16.725 11.479
771 HA SER 98 HA SER 98 27.040 15.707 8.852
772 HB2 SER 98 1HB SER 98 29.727 15.777 9.417
773 HB3 SER 98 2HB SER 98 28.774 17.154 8.863
774 HG SER 98 HG SER 98 29.201 18.044 10.704
775 HA PRO 99 HA PRO 99 28.003 11.442 9.198
776 HB2 PRO 99 1HB PRO 99 29.776 11.054 7.179
777 HB3 PRO 99 2HB PRO 99 28.056 11.354 6.903
778 HG2 PRO 99 1HG PRO 99 30.361 13.259 6.753
779 HG3 PRO 99 2HG PRO 99 28.977 13.089 5.657
780 HD2 PRO 99 1HD PRO 99 29.110 15.025 7.545
781 HD3 PRO 99 2HD PRO 99 27.576 14.291 7.037
782 H SER 100 H SER 100 30.753 13.636 9.086
783 HA SER 100 HA SER 100 32.716 11.771 9.918
784 HB2 SER 100 1HB SER 100 33.251 13.933 8.823
785 HB3 SER 100 2HB SER 100 32.711 14.779 10.273
786 HG SER 100 HG SER 100 34.995 14.451 10.210
787 H GLU 101 H GLU 101 30.497 13.877 11.640
788 HA GLU 101 HA GLU 101 31.684 13.463 14.210
789 HB2 GLU 101 1HB GLU 101 30.301 15.455 13.603
790 HB3 GLU 101 2HB GLU 101 28.888 14.410 13.570
791 HG2 GLU 101 1HG GLU 101 28.623 14.632 15.750
792 HG3 GLU 101 2HG GLU 101 30.258 14.045 16.044
793 H PHE 102 H PHE 102 28.798 12.189 12.575
794 HA PHE 102 HA PHE 102 27.917 10.537 14.660
795 HB2 PHE 102 1HB PHE 102 26.703 11.205 12.490
796 HB3 PHE 102 2HB PHE 102 27.561 9.857 11.749
797 HD1 PHE 102 HD2 PHE 102 25.305 10.683 14.585
798 HD2 PHE 102 HD1 PHE 102 26.675 7.721 11.852
799 HE1 PHE 102 HE2 PHE 102 23.565 9.141 15.389
800 HE2 PHE 102 HE1 PHE 102 24.936 6.175 12.651
801 HZ PHE 102 HZ PHE 102 23.379 6.883 14.423
802 H ARG 103 H ARG 103 30.235 9.988 12.067
803 HA ARG 103 HA ARG 103 30.554 7.223 12.361
804 HB2 ARG 103 1HB ARG 103 32.035 9.424 11.104
805 HB3 ARG 103 2HB ARG 103 33.049 8.081 11.613
806 HG2 ARG 103 1HG ARG 103 30.589 7.726 9.926
807 HG3 ARG 103 2HG ARG 103 32.199 7.986 9.251
808 HD2 ARG 103 1HD ARG 103 32.645 5.978 11.051
809 HD3 ARG 103 2HD ARG 103 31.025 5.597 10.469
810 HE ARG 103 HE ARG 103 31.961 4.929 8.504
811 HH11 ARG 103 2HH1 ARG 103 34.179 7.082 10.106
812 HH12 ARG 103 1HH1 ARG 103 35.435 6.872 8.931
813 HH21 ARG 103 2HH2 ARG 103 33.607 4.644 6.951
814 HH22 ARG 103 1HH2 ARG 103 35.109 5.486 7.137
815 H ALA 104 H ALA 104 32.170 9.926 13.975
816 HA ALA 104 HA ALA 104 34.027 8.365 15.429
817 HB1 ALA 104 1HB ALA 104 33.152 11.157 15.387
818 HB2 ALA 104 2HB ALA 104 33.692 10.592 16.968
819 HB3 ALA 104 3HB ALA 104 34.767 10.474 15.575
820 H GLY 105 H GLY 105 30.676 9.129 15.919
821 HA2 GLY 105 1HA GLY 105 29.257 7.893 17.345
822 HA3 GLY 105 2HA GLY 105 30.663 7.395 18.274
823 H CYS 106 H CYS 106 31.274 10.506 17.959
824 HA CYS 106 HA CYS 106 30.461 11.156 20.603
825 HB2 CYS 106 1HB CYS 106 32.457 12.049 19.123
826 HB3 CYS 106 2HB CYS 106 31.281 13.271 18.655
827 HG CYS 106 HG CYS 106 32.926 14.342 20.638
828 H GLU 107 H GLU 107 28.645 12.062 21.320
829 HA GLU 107 HA GLU 107 26.533 12.673 19.459
830 HB2 GLU 107 1HB GLU 107 26.715 12.685 22.467
831 HB3 GLU 107 2HB GLU 107 25.278 13.231 21.614
832 HG2 GLU 107 1HG GLU 107 24.901 10.986 22.238
833 HG3 GLU 107 2HG GLU 107 25.195 10.992 20.501
Start of MODEL 13
1 H1 MET 1 H MET 1 0.351 -0.217 0.728
2 HA MET 1 HA MET 1 0.914 1.147 -1.504
3 HB2 MET 1 1HB MET 1 2.372 -0.506 -0.071
4 HB3 MET 1 2HB MET 1 2.008 -1.634 -1.370
5 HG2 MET 1 1HG MET 1 3.318 -0.562 -2.860
6 HG3 MET 1 2HG MET 1 2.971 1.029 -2.187
7 HE1 MET 1 3HE MET 1 6.266 0.511 -2.899
8 HE2 MET 1 1HE MET 1 5.114 1.811 -2.591
9 HE3 MET 1 2HE MET 1 6.507 1.598 -1.531
10 H ASP 2 H ASP 2 0.376 1.166 -3.592
11 HA ASP 2 HA ASP 2 -1.549 -0.733 -4.576
12 HB2 ASP 2 1HB ASP 2 -1.139 1.886 -5.092
13 HB3 ASP 2 2HB ASP 2 -0.292 1.174 -6.462
14 H ASN 3 H ASN 3 -1.307 -2.134 -6.336
15 HA ASN 3 HA ASN 3 1.058 -3.593 -6.459
16 HB2 ASN 3 1HB ASN 3 -1.232 -3.402 -8.422
17 HB3 ASN 3 2HB ASN 3 0.075 -4.574 -8.569
18 HD21 ASN 3 2HD2 ASN 3 0.332 -6.138 -6.890
19 HD22 ASN 3 1HD2 ASN 3 -1.028 -6.622 -5.940
20 H ARG 4 H ARG 4 -0.167 -1.094 -8.661
21 HA ARG 4 HA ARG 4 1.932 -1.235 -10.529
22 HB2 ARG 4 1HB ARG 4 1.156 0.926 -11.318
23 HB3 ARG 4 2HB ARG 4 -0.221 -0.107 -10.960
24 HG2 ARG 4 1HG ARG 4 -0.973 1.752 -9.939
25 HG3 ARG 4 2HG ARG 4 0.010 1.146 -8.605
26 HD2 ARG 4 1HD ARG 4 0.416 3.524 -9.017
27 HD3 ARG 4 2HD ARG 4 1.862 2.558 -9.308
28 HE ARG 4 HE ARG 4 1.749 3.097 -11.547
29 HH11 ARG 4 2HH1 ARG 4 -1.154 4.123 -9.922
30 HH12 ARG 4 1HH1 ARG 4 -1.726 5.065 -11.260
31 HH21 ARG 4 2HH2 ARG 4 1.007 4.333 -13.314
32 HH22 ARG 4 1HH2 ARG 4 -0.496 5.183 -13.189
33 H VAL 5 H VAL 5 1.584 0.494 -7.496
34 HA VAL 5 HA VAL 5 3.725 2.280 -7.745
35 HB VAL 5 HB VAL 5 2.659 0.968 -5.241
36 HG11 VAL 5 1HG1 VAL 5 3.636 2.927 -4.085
37 HG12 VAL 5 2HG1 VAL 5 4.852 1.885 -4.827
38 HG13 VAL 5 3HG1 VAL 5 4.400 3.404 -5.601
39 HG21 VAL 5 3HG2 VAL 5 1.006 2.503 -5.183
40 HG22 VAL 5 1HG2 VAL 5 2.014 3.770 -5.881
41 HG23 VAL 5 2HG2 VAL 5 1.272 2.558 -6.925
42 H ARG 6 H ARG 6 3.616 -1.081 -6.682
43 HA ARG 6 HA ARG 6 6.287 -1.225 -5.762
44 HB2 ARG 6 1HB ARG 6 4.243 -2.860 -5.457
45 HB3 ARG 6 2HB ARG 6 4.900 -3.615 -6.903
46 HG2 ARG 6 1HG ARG 6 6.537 -4.594 -5.763
47 HG3 ARG 6 2HG ARG 6 6.946 -3.101 -4.915
48 HD2 ARG 6 1HD ARG 6 5.372 -3.503 -3.222
49 HD3 ARG 6 2HD ARG 6 4.532 -4.725 -4.176
50 HE ARG 6 HE ARG 6 6.755 -5.141 -2.456
51 HH11 ARG 6 2HH1 ARG 6 5.315 -6.216 -5.438
52 HH12 ARG 6 1HH1 ARG 6 6.008 -7.801 -5.353
53 HH21 ARG 6 2HH2 ARG 6 7.673 -7.225 -2.333
54 HH22 ARG 6 1HH2 ARG 6 7.349 -8.375 -3.586
55 H GLU 7 H GLU 7 4.782 -1.790 -8.899
56 HA GLU 7 HA GLU 7 7.128 -2.831 -10.141
57 HB2 GLU 7 1HB GLU 7 4.487 -1.818 -11.140
58 HB3 GLU 7 2HB GLU 7 5.790 -2.153 -12.272
59 HG2 GLU 7 1HG GLU 7 5.905 -4.459 -11.405
60 HG3 GLU 7 2HG GLU 7 4.528 -4.106 -10.362
61 H ALA 8 H ALA 8 5.746 0.367 -9.747
62 HA ALA 8 HA ALA 8 7.486 1.659 -11.611
63 HB1 ALA 8 1HB ALA 8 5.813 2.800 -9.376
64 HB2 ALA 8 2HB ALA 8 6.631 3.744 -10.623
65 HB3 ALA 8 3HB ALA 8 5.335 2.632 -11.066
66 H CYS 9 H CYS 9 7.420 1.377 -8.069
67 HA CYS 9 HA CYS 9 9.704 2.938 -7.573
68 HB2 CYS 9 1HB CYS 9 9.601 2.149 -5.359
69 HB3 CYS 9 2HB CYS 9 7.931 2.114 -5.912
70 HG CYS 9 HG CYS 9 9.218 -0.191 -4.330
71 H GLN 10 H GLN 10 9.303 -0.406 -8.489
72 HA GLN 10 HA GLN 10 11.864 -1.347 -7.800
73 HB2 GLN 10 1HB GLN 10 9.994 -2.838 -8.356
74 HB3 GLN 10 2HB GLN 10 10.030 -2.269 -10.020
75 HG2 GLN 10 1HG GLN 10 11.130 -4.344 -10.013
76 HG3 GLN 10 2HG GLN 10 12.395 -3.123 -10.139
77 HE21 GLN 10 2HE2 GLN 10 14.102 -3.902 -9.121
78 HE22 GLN 10 1HE2 GLN 10 14.110 -4.585 -7.534
79 H TYR 11 H TYR 11 10.636 0.292 -10.661
80 HA TYR 11 HA TYR 11 12.962 -0.075 -12.250
81 HB2 TYR 11 1HB TYR 11 10.932 0.439 -13.384
82 HB3 TYR 11 2HB TYR 11 10.664 1.875 -12.402
83 HD1 TYR 11 HD1 TYR 11 13.465 0.569 -14.518
84 HD2 TYR 11 HD2 TYR 11 10.909 3.837 -13.573
85 HE1 TYR 11 HE1 TYR 11 14.594 1.937 -16.221
86 HE2 TYR 11 HE2 TYR 11 12.031 5.213 -15.275
87 HH TYR 11 HH TYR 11 13.803 4.086 -17.677
88 H ILE 12 H ILE 12 11.847 2.516 -10.115
89 HA ILE 12 HA ILE 12 13.872 4.374 -10.673
90 HB ILE 12 HB ILE 12 12.425 3.985 -8.050
91 HG12 ILE 12 1HG1 ILE 12 11.710 5.827 -10.338
92 HG13 ILE 12 2HG1 ILE 12 10.951 4.261 -10.071
93 HG21 ILE 12 1HG2 ILE 12 13.886 6.358 -9.201
94 HG22 ILE 12 2HG2 ILE 12 12.901 6.392 -7.739
95 HG23 ILE 12 3HG2 ILE 12 14.359 5.402 -7.797
96 HD11 ILE 12 3HD1 ILE 12 10.452 6.812 -8.798
97 HD12 ILE 12 1HD1 ILE 12 9.453 5.360 -8.860
98 HD13 ILE 12 2HD1 ILE 12 10.710 5.515 -7.632
99 H SER 13 H SER 13 13.705 1.750 -8.305
100 HA SER 13 HA SER 13 16.040 2.299 -6.888
101 HB2 SER 13 1HB SER 13 15.805 0.196 -5.946
102 HB3 SER 13 2HB SER 13 14.169 0.478 -6.541
103 HG SER 13 HG SER 13 16.185 -1.180 -7.593
104 H ASP 14 H ASP 14 15.562 0.708 -9.975
105 HA ASP 14 HA ASP 14 18.170 -0.365 -10.233
106 HB2 ASP 14 1HB ASP 14 16.357 -1.207 -11.603
107 HB3 ASP 14 2HB ASP 14 16.122 0.380 -12.330
108 H HIS 15 H HIS 15 16.844 2.795 -10.712
109 HA HIS 15 HA HIS 15 19.347 3.689 -11.972
110 HB2 HIS 15 1HB HIS 15 16.597 4.939 -11.920
111 HB3 HIS 15 2HB HIS 15 18.025 5.755 -12.549
112 HD1 HIS 15 HD1 HIS 15 17.932 5.706 -15.011
113 HD2 HIS 15 HD2 HIS 15 16.587 2.142 -13.353
114 HE1 HIS 15 HE1 HIS 15 17.399 4.215 -16.964
115 H LEU 16 H LEU 16 18.598 3.201 -9.038
116 HA LEU 16 HA LEU 16 18.425 5.586 -7.631
117 HB2 LEU 16 1HB LEU 16 18.386 3.117 -6.833
118 HB3 LEU 16 2HB LEU 16 20.126 3.326 -6.653
119 HG LEU 16 HG LEU 16 19.734 5.149 -5.059
120 HD11 LEU 16 1HD1 LEU 16 17.107 5.052 -6.136
121 HD12 LEU 16 2HD1 LEU 16 17.784 6.194 -4.976
122 HD13 LEU 16 3HD1 LEU 16 17.015 4.713 -4.408
123 HD21 LEU 16 3HD2 LEU 16 18.690 2.404 -4.617
124 HD22 LEU 16 1HD2 LEU 16 18.408 3.610 -3.361
125 HD23 LEU 16 2HD2 LEU 16 20.055 3.233 -3.867
126 H ALA 17 H ALA 17 21.281 3.918 -8.884
127 HA ALA 17 HA ALA 17 23.076 5.928 -7.829
128 HB1 ALA 17 1HB ALA 17 24.508 4.389 -9.637
129 HB2 ALA 17 2HB ALA 17 24.417 4.153 -7.891
130 HB3 ALA 17 3HB ALA 17 23.322 3.275 -8.959
131 H ASP 18 H ASP 18 21.288 5.380 -10.709
132 HA ASP 18 HA ASP 18 22.966 7.008 -12.401
133 HB2 ASP 18 1HB ASP 18 20.407 5.511 -12.727
134 HB3 ASP 18 2HB ASP 18 20.746 6.822 -13.853
135 H SER 19 H SER 19 22.800 9.135 -12.773
136 HA SER 19 HA SER 19 21.055 10.703 -11.118
137 HB2 SER 19 1HB SER 19 22.669 11.875 -13.358
138 HB3 SER 19 2HB SER 19 22.325 12.544 -11.763
139 HG SER 19 HG SER 19 24.516 11.470 -12.374
140 H ASN 20 H ASN 20 21.074 9.596 -14.409
141 HA ASN 20 HA ASN 20 19.159 11.475 -15.396
142 HB2 ASN 20 1HB ASN 20 19.744 8.758 -16.571
143 HB3 ASN 20 2HB ASN 20 19.169 10.199 -17.404
144 HD21 ASN 20 2HD2 ASN 20 20.615 11.889 -17.817
145 HD22 ASN 20 1HD2 ASN 20 22.325 11.640 -17.799
146 H PHE 21 H PHE 21 17.343 11.482 -14.119
147 HA PHE 21 HA PHE 21 15.793 8.976 -14.058
148 HB2 PHE 21 1HB PHE 21 16.512 9.724 -11.814
149 HB3 PHE 21 2HB PHE 21 15.692 11.259 -12.076
150 HD1 PHE 21 HD2 PHE 21 14.587 7.794 -12.851
151 HD2 PHE 21 HD1 PHE 21 13.961 11.316 -10.546
152 HE1 PHE 21 HE2 PHE 21 12.509 6.832 -11.952
153 HE2 PHE 21 HE1 PHE 21 11.882 10.360 -9.642
154 HZ PHE 21 HZ PHE 21 11.153 8.115 -10.346
155 H ASP 22 H ASP 22 14.095 9.011 -15.356
156 HA ASP 22 HA ASP 22 12.779 11.594 -15.888
157 HB2 ASP 22 1HB ASP 22 13.884 10.632 -17.874
158 HB3 ASP 22 2HB ASP 22 12.922 9.168 -17.691
159 H ILE 23 H ILE 23 10.942 11.732 -14.787
160 HA ILE 23 HA ILE 23 9.556 9.649 -13.588
161 HB ILE 23 HB ILE 23 9.264 12.077 -13.070
162 HG12 ILE 23 1HG1 ILE 23 6.506 11.153 -13.589
163 HG13 ILE 23 2HG1 ILE 23 7.531 10.014 -12.724
164 HG21 ILE 23 1HG2 ILE 23 9.007 12.718 -15.502
165 HG22 ILE 23 2HG2 ILE 23 7.352 12.122 -15.390
166 HG23 ILE 23 3HG2 ILE 23 7.873 13.470 -14.380
167 HD11 ILE 23 3HD1 ILE 23 7.528 12.812 -11.772
168 HD12 ILE 23 1HD1 ILE 23 6.072 11.857 -11.496
169 HD13 ILE 23 2HD1 ILE 23 7.624 11.301 -10.868
170 H ALA 24 H ALA 24 9.461 10.784 -16.863
171 HA ALA 24 HA ALA 24 6.959 9.757 -17.643
172 HB1 ALA 24 1HB ALA 24 7.904 11.266 -19.138
173 HB2 ALA 24 2HB ALA 24 9.464 10.443 -19.136
174 HB3 ALA 24 3HB ALA 24 8.085 9.715 -19.959
175 H SER 25 H SER 25 10.201 8.323 -17.652
176 HA SER 25 HA SER 25 9.508 5.909 -18.918
177 HB2 SER 25 1HB SER 25 11.762 6.692 -17.079
178 HB3 SER 25 2HB SER 25 11.605 5.046 -17.693
179 HG SER 25 HG SER 25 12.944 6.460 -18.988
180 H VAL 26 H VAL 26 9.249 6.986 -15.608
181 HA VAL 26 HA VAL 26 8.868 4.451 -14.405
182 HB VAL 26 HB VAL 26 7.756 7.077 -13.417
183 HG11 VAL 26 1HG1 VAL 26 7.025 4.913 -12.341
184 HG12 VAL 26 2HG1 VAL 26 8.700 4.701 -11.828
185 HG13 VAL 26 3HG1 VAL 26 7.773 6.092 -11.264
186 HG21 VAL 26 3HG2 VAL 26 10.538 5.987 -13.384
187 HG22 VAL 26 1HG2 VAL 26 9.979 7.633 -13.683
188 HG23 VAL 26 2HG2 VAL 26 9.972 6.983 -12.043
189 H ALA 27 H ALA 27 6.572 6.931 -15.515
190 HA ALA 27 HA ALA 27 4.244 5.465 -14.843
191 HB1 ALA 27 1HB ALA 27 4.798 8.023 -15.767
192 HB2 ALA 27 2HB ALA 27 3.851 7.282 -17.058
193 HB3 ALA 27 3HB ALA 27 3.206 7.347 -15.418
194 H GLN 28 H GLN 28 6.127 5.767 -17.822
195 HA GLN 28 HA GLN 28 4.385 4.326 -19.495
196 HB2 GLN 28 1HB GLN 28 6.150 5.699 -20.422
197 HB3 GLN 28 2HB GLN 28 7.378 4.709 -19.645
198 HG2 GLN 28 1HG GLN 28 6.990 2.901 -21.084
199 HG3 GLN 28 2HG GLN 28 5.461 3.572 -21.648
200 HE21 GLN 28 2HE2 GLN 28 7.226 2.752 -23.490
201 HE22 GLN 28 1HE2 GLN 28 7.950 4.099 -24.294
202 H HIS 29 H HIS 29 6.959 3.306 -17.328
203 HA HIS 29 HA HIS 29 7.253 0.663 -18.160
204 HB2 HIS 29 1HB HIS 29 8.841 1.467 -16.614
205 HB3 HIS 29 2HB HIS 29 7.599 2.001 -15.485
206 HD1 HIS 29 HD1 HIS 29 8.070 -1.436 -17.041
207 HD2 HIS 29 HD2 HIS 29 8.015 0.418 -13.323
208 HE1 HIS 29 HE1 HIS 29 8.265 -3.295 -15.360
209 H VAL 30 H VAL 30 4.804 2.167 -16.160
210 HA VAL 30 HA VAL 30 3.558 -0.442 -15.658
211 HB VAL 30 HB VAL 30 2.038 0.860 -14.137
212 HG11 VAL 30 1HG1 VAL 30 4.069 1.424 -12.527
213 HG12 VAL 30 2HG1 VAL 30 3.614 -0.238 -12.909
214 HG13 VAL 30 3HG1 VAL 30 4.963 0.525 -13.752
215 HG21 VAL 30 3HG2 VAL 30 2.359 3.055 -15.206
216 HG22 VAL 30 1HG2 VAL 30 2.690 3.102 -13.474
217 HG23 VAL 30 2HG2 VAL 30 4.024 3.079 -14.627
218 H CYS 31 H CYS 31 3.555 1.268 -18.208
219 HA CYS 31 HA CYS 31 2.110 1.872 -19.863
220 HB2 CYS 31 1HB CYS 31 0.612 -0.373 -18.517
221 HB3 CYS 31 2HB CYS 31 0.024 0.400 -19.984
222 HG CYS 31 HG CYS 31 1.530 -0.858 -21.660
223 H LEU 32 H LEU 32 2.009 3.560 -17.644
224 HA LEU 32 HA LEU 32 -0.744 4.524 -17.861
225 HB2 LEU 32 1HB LEU 32 0.321 3.326 -15.539
226 HB3 LEU 32 2HB LEU 32 0.216 5.056 -15.221
227 HG LEU 32 HG LEU 32 -2.190 3.796 -16.385
228 HD11 LEU 32 1HD1 LEU 32 -1.954 3.465 -13.467
229 HD12 LEU 32 2HD1 LEU 32 -1.026 2.333 -14.452
230 HD13 LEU 32 3HD1 LEU 32 -2.772 2.462 -14.666
231 HD21 LEU 32 3HD2 LEU 32 -2.298 5.416 -13.936
232 HD22 LEU 32 1HD2 LEU 32 -3.227 5.546 -15.430
233 HD23 LEU 32 2HD2 LEU 32 -1.602 6.226 -15.341
234 H SER 33 H SER 33 -0.952 6.798 -17.085
235 HA SER 33 HA SER 33 1.175 8.373 -18.186
236 HB2 SER 33 1HB SER 33 -1.593 8.823 -17.291
237 HB3 SER 33 2HB SER 33 -0.512 10.191 -17.027
238 HG SER 33 HG SER 33 -0.187 10.371 -19.159
239 HA PRO 34 HA PRO 34 3.437 9.481 -14.595
240 HB2 PRO 34 1HB PRO 34 3.977 12.105 -15.033
241 HB3 PRO 34 2HB PRO 34 4.747 10.801 -15.945
242 HG2 PRO 34 1HG PRO 34 2.433 12.538 -16.712
243 HG3 PRO 34 2HG PRO 34 3.818 12.023 -17.691
244 HD2 PRO 34 1HD PRO 34 1.388 10.844 -17.872
245 HD3 PRO 34 2HD PRO 34 2.902 9.953 -18.125
246 H SER 35 H SER 35 0.807 11.702 -15.430
247 HA SER 35 HA SER 35 0.654 12.993 -12.924
248 HB2 SER 35 1HB SER 35 -1.416 13.908 -13.687
249 HB3 SER 35 2HB SER 35 -0.377 13.777 -15.106
250 HG SER 35 HG SER 35 -2.530 12.104 -14.350
251 H ARG 36 H ARG 36 -1.076 10.206 -14.271
252 HA ARG 36 HA ARG 36 -2.745 9.791 -12.020
253 HB2 ARG 36 1HB ARG 36 -2.022 8.266 -14.463
254 HB3 ARG 36 2HB ARG 36 -2.676 7.343 -13.117
255 HG2 ARG 36 1HG ARG 36 -4.047 9.782 -14.200
256 HG3 ARG 36 2HG ARG 36 -4.320 8.168 -14.859
257 HD2 ARG 36 1HD ARG 36 -5.343 7.411 -12.932
258 HD3 ARG 36 2HD ARG 36 -4.563 8.624 -11.919
259 HE ARG 36 HE ARG 36 -6.244 9.955 -13.699
260 HH11 ARG 36 2HH1 ARG 36 -6.477 7.720 -11.040
261 HH12 ARG 36 1HH1 ARG 36 -8.042 8.272 -10.543
262 HH21 ARG 36 2HH2 ARG 36 -8.305 10.690 -13.055
263 HH22 ARG 36 1HH2 ARG 36 -9.082 9.961 -11.690
264 H LEU 37 H LEU 37 0.390 8.469 -12.983
265 HA LEU 37 HA LEU 37 0.601 6.579 -10.893
266 HB2 LEU 37 1HB LEU 37 2.009 6.267 -12.743
267 HB3 LEU 37 2HB LEU 37 2.598 7.927 -12.679
268 HG LEU 37 HG LEU 37 3.783 7.348 -10.559
269 HD11 LEU 37 1HD1 LEU 37 4.078 5.040 -9.949
270 HD12 LEU 37 2HD1 LEU 37 3.081 4.514 -11.305
271 HD13 LEU 37 3HD1 LEU 37 2.354 5.414 -9.974
272 HD21 LEU 37 3HD2 LEU 37 5.509 7.132 -11.934
273 HD22 LEU 37 1HD2 LEU 37 4.430 6.656 -13.245
274 HD23 LEU 37 2HD2 LEU 37 5.102 5.432 -12.167
275 H SER 38 H SER 38 1.747 9.917 -11.221
276 HA SER 38 HA SER 38 3.158 10.073 -8.809
277 HB2 SER 38 1HB SER 38 3.074 12.461 -9.077
278 HB3 SER 38 2HB SER 38 3.221 11.753 -10.685
279 HG SER 38 HG SER 38 1.313 13.360 -9.748
280 H HIS 39 H HIS 39 -0.254 10.528 -9.537
281 HA HIS 39 HA HIS 39 -1.072 11.645 -7.106
282 HB2 HIS 39 1HB HIS 39 -2.496 11.535 -9.121
283 HB3 HIS 39 2HB HIS 39 -2.634 9.791 -8.917
284 HD1 HIS 39 HD1 HIS 39 -4.159 12.948 -7.909
285 HD2 HIS 39 HD2 HIS 39 -4.074 9.042 -6.497
286 HE1 HIS 39 HE1 HIS 39 -6.079 12.776 -6.294
287 H LEU 40 H LEU 40 -0.976 8.236 -8.125
288 HA LEU 40 HA LEU 40 -1.826 7.243 -5.590
289 HB2 LEU 40 1HB LEU 40 -1.024 6.150 -8.175
290 HB3 LEU 40 2HB LEU 40 -0.524 5.154 -6.810
291 HG LEU 40 HG LEU 40 -3.344 5.982 -7.491
292 HD11 LEU 40 1HD1 LEU 40 -2.844 4.280 -8.967
293 HD12 LEU 40 2HD1 LEU 40 -3.503 3.394 -7.593
294 HD13 LEU 40 3HD1 LEU 40 -1.758 3.474 -7.835
295 HD21 LEU 40 3HD2 LEU 40 -3.890 4.340 -5.638
296 HD22 LEU 40 1HD2 LEU 40 -3.246 5.904 -5.138
297 HD23 LEU 40 2HD2 LEU 40 -2.201 4.484 -5.149
298 H PHE 41 H PHE 41 1.262 7.965 -7.048
299 HA PHE 41 HA PHE 41 2.917 6.510 -5.301
300 HB2 PHE 41 1HB PHE 41 3.311 8.120 -7.505
301 HB3 PHE 41 2HB PHE 41 4.040 9.057 -6.205
302 HD1 PHE 41 HD2 PHE 41 5.950 8.183 -4.961
303 HD2 PHE 41 HD1 PHE 41 4.267 6.053 -8.239
304 HE1 PHE 41 HE2 PHE 41 7.970 6.783 -5.084
305 HE2 PHE 41 HE1 PHE 41 6.284 4.649 -8.367
306 HZ PHE 41 HZ PHE 41 8.139 5.014 -6.789
307 H ARG 42 H ARG 42 1.925 9.930 -5.217
308 HA ARG 42 HA ARG 42 3.178 10.457 -2.720
309 HB2 ARG 42 1HB ARG 42 2.482 12.127 -4.552
310 HB3 ARG 42 2HB ARG 42 0.874 12.031 -3.845
311 HG2 ARG 42 1HG ARG 42 1.520 13.081 -1.898
312 HG3 ARG 42 2HG ARG 42 3.219 12.650 -2.107
313 HD2 ARG 42 1HD ARG 42 3.503 14.270 -3.823
314 HD3 ARG 42 2HD ARG 42 1.766 14.552 -3.931
315 HE ARG 42 HE ARG 42 2.431 15.191 -1.352
316 HH11 ARG 42 2HH1 ARG 42 3.441 16.232 -4.516
317 HH12 ARG 42 1HH1 ARG 42 3.825 17.843 -4.007
318 HH21 ARG 42 2HH2 ARG 42 2.933 17.309 -0.669
319 HH22 ARG 42 1HH2 ARG 42 3.537 18.454 -1.818
320 H GLN 43 H GLN 43 0.100 9.169 -3.654
321 HA GLN 43 HA GLN 43 -1.194 9.650 -1.138
322 HB2 GLN 43 1HB GLN 43 -2.365 9.374 -3.364
323 HB3 GLN 43 2HB GLN 43 -2.004 7.657 -3.253
324 HG2 GLN 43 1HG GLN 43 -3.309 8.803 -0.889
325 HG3 GLN 43 2HG GLN 43 -4.278 8.815 -2.362
326 HE21 GLN 43 2HE2 GLN 43 -4.602 6.785 -3.458
327 HE22 GLN 43 1HE2 GLN 43 -4.614 5.316 -2.550
328 H GLN 44 H GLN 44 0.375 6.888 -2.697
329 HA GLN 44 HA GLN 44 -0.123 5.145 -0.457
330 HB2 GLN 44 1HB GLN 44 1.230 4.904 -3.099
331 HB3 GLN 44 2HB GLN 44 1.679 3.761 -1.841
332 HG2 GLN 44 1HG GLN 44 -0.238 3.213 -3.524
333 HG3 GLN 44 2HG GLN 44 -0.366 2.750 -1.828
334 HE21 GLN 44 2HE2 GLN 44 -2.307 3.085 -1.046
335 HE22 GLN 44 1HE2 GLN 44 -3.365 4.389 -1.451
336 H LEU 45 H LEU 45 2.590 7.005 -1.724
337 HA LEU 45 HA LEU 45 4.357 6.046 0.373
338 HB2 LEU 45 1HB LEU 45 4.824 8.120 -1.764
339 HB3 LEU 45 2HB LEU 45 6.049 7.435 -0.699
340 HG LEU 45 HG LEU 45 4.807 6.316 -3.140
341 HD11 LEU 45 1HD1 LEU 45 7.046 5.443 -3.460
342 HD12 LEU 45 2HD1 LEU 45 7.507 5.976 -1.844
343 HD13 LEU 45 3HD1 LEU 45 7.108 7.165 -3.083
344 HD21 LEU 45 3HD2 LEU 45 3.992 4.637 -1.735
345 HD22 LEU 45 1HD2 LEU 45 5.407 4.701 -0.684
346 HD23 LEU 45 2HD2 LEU 45 5.540 4.007 -2.300
347 H GLY 46 H GLY 46 2.154 8.593 -0.132
348 HA2 GLY 46 1HA GLY 46 1.530 10.347 1.215
349 HA3 GLY 46 2HA GLY 46 2.551 9.653 2.465
350 H ILE 47 H ILE 47 4.302 10.156 -0.352
351 HA ILE 47 HA ILE 47 4.990 12.919 0.226
352 HB ILE 47 HB ILE 47 7.357 12.509 0.516
353 HG12 ILE 47 1HG1 ILE 47 6.645 9.570 0.404
354 HG13 ILE 47 2HG1 ILE 47 7.527 10.460 -0.833
355 HG21 ILE 47 1HG2 ILE 47 5.720 10.822 2.405
356 HG22 ILE 47 2HG2 ILE 47 7.324 11.477 2.729
357 HG23 ILE 47 3HG2 ILE 47 5.955 12.567 2.514
358 HD11 ILE 47 3HD1 ILE 47 9.047 9.164 0.513
359 HD12 ILE 47 1HD1 ILE 47 9.322 10.884 0.786
360 HD13 ILE 47 2HD1 ILE 47 8.444 9.930 1.982
361 H SER 48 H SER 48 6.797 13.648 -1.318
362 HA SER 48 HA SER 48 5.969 12.950 -3.978
363 HB2 SER 48 1HB SER 48 6.705 15.274 -3.066
364 HB3 SER 48 2HB SER 48 8.342 14.690 -3.362
365 HG SER 48 HG SER 48 7.371 15.849 -5.146
366 H VAL 49 H VAL 49 7.335 12.183 -5.662
367 HA VAL 49 HA VAL 49 8.822 9.922 -5.069
368 HB VAL 49 HB VAL 49 9.744 10.122 -7.390
369 HG11 VAL 49 1HG1 VAL 49 7.804 8.893 -7.355
370 HG12 VAL 49 2HG1 VAL 49 6.833 10.239 -6.754
371 HG13 VAL 49 3HG1 VAL 49 7.346 10.204 -8.442
372 HG21 VAL 49 3HG2 VAL 49 8.222 12.721 -7.310
373 HG22 VAL 49 1HG2 VAL 49 9.938 12.482 -7.643
374 HG23 VAL 49 2HG2 VAL 49 8.730 11.933 -8.804
375 H LEU 50 H LEU 50 9.909 13.244 -5.586
376 HA LEU 50 HA LEU 50 12.672 12.743 -5.597
377 HB2 LEU 50 1HB LEU 50 11.326 15.224 -4.551
378 HB3 LEU 50 2HB LEU 50 12.957 15.084 -5.205
379 HG LEU 50 HG LEU 50 10.385 14.818 -6.763
380 HD11 LEU 50 1HD1 LEU 50 12.262 17.045 -6.237
381 HD12 LEU 50 2HD1 LEU 50 10.526 17.069 -6.542
382 HD13 LEU 50 3HD1 LEU 50 11.654 16.875 -7.884
383 HD21 LEU 50 3HD2 LEU 50 12.071 14.953 -8.700
384 HD22 LEU 50 1HD2 LEU 50 11.884 13.413 -7.860
385 HD23 LEU 50 2HD2 LEU 50 13.267 14.450 -7.505
386 H SER 51 H SER 51 10.385 13.240 -2.975
387 HA SER 51 HA SER 51 12.358 13.453 -0.923
388 HB2 SER 51 1HB SER 51 9.457 12.660 -0.602
389 HB3 SER 51 2HB SER 51 10.517 13.352 0.626
390 HG SER 51 HG SER 51 10.100 14.768 -1.754
391 H TRP 52 H TRP 52 10.223 10.832 -2.021
392 HA TRP 52 HA TRP 52 11.048 8.897 -0.176
393 HB2 TRP 52 1HB TRP 52 9.053 8.587 -1.523
394 HB3 TRP 52 2HB TRP 52 10.014 8.565 -2.999
395 HD1 TRP 52 HD1 TRP 52 9.479 6.439 0.189
396 HE1 TRP 52 HE1 TRP 52 9.987 3.985 -0.396
397 HE3 TRP 52 HE3 TRP 52 11.101 7.070 -4.618
398 HZ2 TRP 52 HZ2 TRP 52 10.949 2.511 -2.603
399 HZ3 TRP 52 HZ3 TRP 52 11.797 5.087 -5.897
400 HH2 TRP 52 HH2 TRP 52 11.723 2.855 -4.909
401 H ARG 53 H ARG 53 12.239 9.592 -3.452
402 HA ARG 53 HA ARG 53 14.136 7.552 -3.611
403 HB2 ARG 53 1HB ARG 53 13.315 9.209 -5.420
404 HB3 ARG 53 2HB ARG 53 14.585 10.267 -4.819
405 HG2 ARG 53 1HG ARG 53 16.246 8.528 -5.300
406 HG3 ARG 53 2HG ARG 53 14.963 7.498 -5.938
407 HD2 ARG 53 1HD ARG 53 16.166 8.651 -7.729
408 HD3 ARG 53 2HD ARG 53 14.475 9.146 -7.660
409 HE ARG 53 HE ARG 53 15.824 10.988 -6.143
410 HH11 ARG 53 2HH1 ARG 53 15.998 9.851 -9.429
411 HH12 ARG 53 1HH1 ARG 53 16.568 11.361 -10.059
412 HH21 ARG 53 2HH2 ARG 53 16.574 12.981 -6.960
413 HH22 ARG 53 1HH2 ARG 53 16.896 13.140 -8.654
414 H GLU 54 H GLU 54 14.483 10.891 -2.444
415 HA GLU 54 HA GLU 54 17.234 10.697 -1.828
416 HB2 GLU 54 1HB GLU 54 15.721 12.794 -2.059
417 HB3 GLU 54 2HB GLU 54 15.347 12.518 -0.364
418 HG2 GLU 54 1HG GLU 54 17.643 12.781 0.253
419 HG3 GLU 54 2HG GLU 54 18.136 12.851 -1.437
420 H ASP 55 H ASP 55 14.313 10.273 0.135
421 HA ASP 55 HA ASP 55 15.490 9.919 2.622
422 HB2 ASP 55 1HB ASP 55 12.988 10.026 1.961
423 HB3 ASP 55 2HB ASP 55 13.122 8.282 1.752
424 H GLN 56 H GLN 56 14.842 7.510 0.098
425 HA GLN 56 HA GLN 56 15.856 5.310 1.581
426 HB2 GLN 56 1HB GLN 56 14.927 5.802 -1.175
427 HB3 GLN 56 2HB GLN 56 16.100 4.503 -1.002
428 HG2 GLN 56 1HG GLN 56 13.639 3.887 -0.883
429 HG3 GLN 56 2HG GLN 56 14.697 3.255 0.378
430 HE21 GLN 56 2HE2 GLN 56 12.607 6.034 -0.309
431 HE22 GLN 56 1HE2 GLN 56 11.981 6.179 1.295
432 H ARG 57 H ARG 57 17.276 7.614 -0.653
433 HA ARG 57 HA ARG 57 19.694 6.313 -1.171
434 HB2 ARG 57 1HB ARG 57 18.829 9.179 -1.169
435 HB3 ARG 57 2HB ARG 57 20.531 8.791 -1.374
436 HG2 ARG 57 1HG ARG 57 20.176 7.724 -3.403
437 HG3 ARG 57 2HG ARG 57 18.456 7.487 -3.087
438 HD2 ARG 57 1HD ARG 57 17.941 9.712 -3.553
439 HD3 ARG 57 2HD ARG 57 19.608 10.241 -3.333
440 HE ARG 57 HE ARG 57 19.305 8.424 -5.522
441 HH11 ARG 57 2HH1 ARG 57 18.995 11.751 -4.544
442 HH12 ARG 57 1HH1 ARG 57 19.214 12.378 -6.144
443 HH21 ARG 57 2HH2 ARG 57 19.594 9.237 -7.634
444 HH22 ARG 57 1HH2 ARG 57 19.553 10.947 -7.901
445 H ILE 58 H ILE 58 18.808 8.557 1.430
446 HA ILE 58 HA ILE 58 21.318 8.756 2.643
447 HB ILE 58 HB ILE 58 18.605 8.877 3.964
448 HG12 ILE 58 1HG1 ILE 58 18.885 10.488 2.115
449 HG13 ILE 58 2HG1 ILE 58 18.793 11.296 3.677
450 HG21 ILE 58 1HG2 ILE 58 21.258 8.996 5.045
451 HG22 ILE 58 2HG2 ILE 58 20.445 10.543 5.271
452 HG23 ILE 58 3HG2 ILE 58 19.707 9.063 5.882
453 HD11 ILE 58 3HD1 ILE 58 20.745 11.602 1.709
454 HD12 ILE 58 1HD1 ILE 58 20.748 12.268 3.342
455 HD13 ILE 58 2HD1 ILE 58 21.523 10.716 3.020
456 H SER 59 H SER 59 18.663 6.477 3.234
457 HA SER 59 HA SER 59 19.998 5.082 5.323
458 HB2 SER 59 1HB SER 59 17.648 4.874 5.320
459 HB3 SER 59 2HB SER 59 17.600 4.462 3.606
460 HG SER 59 HG SER 59 17.479 2.507 4.423
461 H GLN 60 H GLN 60 19.908 4.776 1.846
462 HA GLN 60 HA GLN 60 21.016 2.168 1.690
463 HB2 GLN 60 1HB GLN 60 19.846 3.022 -0.212
464 HB3 GLN 60 2HB GLN 60 20.884 4.439 -0.291
465 HG2 GLN 60 1HG GLN 60 21.396 2.800 -2.036
466 HG3 GLN 60 2HG GLN 60 22.761 3.083 -0.956
467 HE21 GLN 60 2HE2 GLN 60 23.809 1.323 -0.413
468 HE22 GLN 60 1HE2 GLN 60 23.141 -0.262 -0.258
469 H ALA 61 H ALA 61 22.403 5.409 1.729
470 HA ALA 61 HA ALA 61 25.065 4.624 1.152
471 HB1 ALA 61 1HB ALA 61 23.671 7.064 1.845
472 HB2 ALA 61 2HB ALA 61 25.246 6.961 2.632
473 HB3 ALA 61 3HB ALA 61 25.127 6.831 0.877
474 H LYS 62 H LYS 62 23.229 4.971 4.132
475 HA LYS 62 HA LYS 62 25.459 4.665 5.882
476 HB2 LYS 62 1HB LYS 62 22.526 4.177 6.437
477 HB3 LYS 62 2HB LYS 62 23.788 4.393 7.643
478 HG2 LYS 62 1HG LYS 62 23.920 6.649 7.306
479 HG3 LYS 62 2HG LYS 62 23.368 6.542 5.632
480 HD2 LYS 62 1HD LYS 62 21.469 7.387 6.544
481 HD3 LYS 62 2HD LYS 62 21.157 5.679 6.862
482 HE2 LYS 62 1HE LYS 62 22.693 7.225 8.883
483 HE3 LYS 62 2HE LYS 62 20.960 7.520 8.758
484 HZ1 LYS 62 3HZ LYS 62 21.231 4.788 8.738
485 HZ2 LYS 62 1HZ LYS 62 20.694 5.740 10.029
486 HZ3 LYS 62 2HZ LYS 62 22.326 5.312 9.916
487 H LEU 63 H LEU 63 23.230 2.468 4.319
488 HA LEU 63 HA LEU 63 23.649 0.172 5.843
489 HB2 LEU 63 1HB LEU 63 22.066 0.695 3.810
490 HB3 LEU 63 2HB LEU 63 23.378 -0.029 2.881
491 HG LEU 63 HG LEU 63 21.613 -1.646 3.363
492 HD11 LEU 63 1HD1 LEU 63 23.004 -3.412 3.985
493 HD12 LEU 63 2HD1 LEU 63 23.980 -2.395 5.044
494 HD13 LEU 63 3HD1 LEU 63 24.108 -2.223 3.294
495 HD21 LEU 63 3HD2 LEU 63 20.956 -0.543 5.541
496 HD22 LEU 63 1HD2 LEU 63 22.328 -1.376 6.273
497 HD23 LEU 63 2HD2 LEU 63 21.014 -2.306 5.552
498 H LEU 64 H LEU 64 25.362 1.252 2.913
499 HA LEU 64 HA LEU 64 27.243 -0.880 2.963
500 HB2 LEU 64 1HB LEU 64 28.238 0.130 1.127
501 HB3 LEU 64 2HB LEU 64 26.546 0.605 0.996
502 HG LEU 64 HG LEU 64 27.446 2.744 2.294
503 HD11 LEU 64 1HD1 LEU 64 29.736 3.019 0.809
504 HD12 LEU 64 2HD1 LEU 64 29.842 1.358 1.390
505 HD13 LEU 64 3HD1 LEU 64 29.662 2.684 2.539
506 HD21 LEU 64 3HD2 LEU 64 27.286 3.882 0.291
507 HD22 LEU 64 1HD2 LEU 64 26.390 2.404 -0.057
508 HD23 LEU 64 2HD2 LEU 64 28.049 2.584 -0.630
509 H LEU 65 H LEU 65 27.215 2.402 4.227
510 HA LEU 65 HA LEU 65 29.941 2.566 4.919
511 HB2 LEU 65 1HB LEU 65 27.812 4.266 4.986
512 HB3 LEU 65 2HB LEU 65 28.062 3.944 6.701
513 HG LEU 65 HG LEU 65 30.432 4.719 5.087
514 HD11 LEU 65 1HD1 LEU 65 28.259 6.214 4.659
515 HD12 LEU 65 2HD1 LEU 65 29.885 6.889 4.763
516 HD13 LEU 65 3HD1 LEU 65 28.816 6.946 6.165
517 HD21 LEU 65 3HD2 LEU 65 31.277 4.843 7.133
518 HD22 LEU 65 1HD2 LEU 65 29.702 4.456 7.828
519 HD23 LEU 65 2HD2 LEU 65 30.140 6.136 7.517
520 H SER 66 H SER 66 27.209 1.059 6.458
521 HA SER 66 HA SER 66 28.329 0.800 9.051
522 HB2 SER 66 1HB SER 66 25.945 0.572 8.774
523 HB3 SER 66 2HB SER 66 26.155 -0.764 7.642
524 HG SER 66 HG SER 66 25.649 -1.550 9.702
525 H THR 67 H THR 67 28.932 -0.785 6.094
526 HA THR 67 HA THR 67 30.451 -2.881 7.506
527 HB THR 67 HB THR 67 28.586 -3.904 6.322
528 HG1 THR 67 HG1 THR 67 30.973 -4.359 4.837
529 HG21 THR 67 3HG2 THR 67 27.994 -2.430 4.611
530 HG22 THR 67 1HG2 THR 67 28.710 -3.788 3.745
531 HG23 THR 67 2HG2 THR 67 29.646 -2.316 4.006
532 H THR 68 H THR 68 30.796 -0.100 5.887
533 HA THR 68 HA THR 68 33.401 -0.910 4.787
534 HB THR 68 HB THR 68 33.153 0.549 2.886
535 HG1 THR 68 HG1 THR 68 31.863 2.199 3.265
536 HG21 THR 68 3HG2 THR 68 31.562 -1.748 3.320
537 HG22 THR 68 1HG2 THR 68 32.145 -1.104 1.786
538 HG23 THR 68 2HG2 THR 68 30.578 -0.598 2.416
539 H ARG 69 H ARG 69 34.916 0.925 4.541
540 HA ARG 69 HA ARG 69 34.407 3.025 6.544
541 HB2 ARG 69 1HB ARG 69 36.767 2.954 7.150
542 HB3 ARG 69 2HB ARG 69 36.029 1.373 7.371
543 HG2 ARG 69 1HG ARG 69 37.370 1.930 4.783
544 HG3 ARG 69 2HG ARG 69 38.379 1.672 6.209
545 HD2 ARG 69 1HD ARG 69 37.779 -0.516 6.406
546 HD3 ARG 69 2HD ARG 69 36.168 -0.245 5.742
547 HE ARG 69 HE ARG 69 36.986 -0.730 3.663
548 HH11 ARG 69 2HH1 ARG 69 39.649 -0.061 5.803
549 HH12 ARG 69 1HH1 ARG 69 40.859 -0.532 4.656
550 HH21 ARG 69 2HH2 ARG 69 38.570 -1.353 2.144
551 HH22 ARG 69 1HH2 ARG 69 40.244 -1.266 2.575
552 H MET 70 H MET 70 34.232 2.818 3.493
553 HA MET 70 HA MET 70 36.254 4.370 2.331
554 HB2 MET 70 1HB MET 70 33.389 3.840 1.591
555 HB3 MET 70 2HB MET 70 34.386 4.927 0.634
556 HG2 MET 70 1HG MET 70 35.961 3.144 0.192
557 HG3 MET 70 2HG MET 70 35.040 2.049 1.220
558 HE1 MET 70 3HE MET 70 32.724 0.890 0.475
559 HE2 MET 70 1HE MET 70 32.143 2.545 0.662
560 HE3 MET 70 2HE MET 70 31.719 1.620 -0.778
561 HA PRO 71 HA PRO 71 35.495 8.498 3.608
562 HB2 PRO 71 1HB PRO 71 36.052 9.893 1.347
563 HB3 PRO 71 2HB PRO 71 37.300 9.114 2.327
564 HG2 PRO 71 1HG PRO 71 36.001 8.159 -0.195
565 HG3 PRO 71 2HG PRO 71 37.711 8.107 0.272
566 HD2 PRO 71 1HD PRO 71 36.085 5.949 0.454
567 HD3 PRO 71 2HD PRO 71 37.426 6.232 1.582
568 H ILE 72 H ILE 72 34.205 10.454 3.179
569 HA ILE 72 HA ILE 72 31.527 9.840 2.589
570 HB ILE 72 HB ILE 72 32.839 12.559 2.705
571 HG12 ILE 72 1HG1 ILE 72 33.157 11.321 4.777
572 HG13 ILE 72 2HG1 ILE 72 31.973 12.599 5.026
573 HG21 ILE 72 1HG2 ILE 72 30.074 11.681 2.267
574 HG22 ILE 72 2HG2 ILE 72 30.271 12.913 3.512
575 HG23 ILE 72 3HG2 ILE 72 30.857 13.212 1.875
576 HD11 ILE 72 3HD1 ILE 72 30.173 10.959 4.827
577 HD12 ILE 72 1HD1 ILE 72 31.369 9.683 4.601
578 HD13 ILE 72 2HD1 ILE 72 31.291 10.558 6.131
579 H ALA 73 H ALA 73 34.129 11.088 0.623
580 HA ALA 73 HA ALA 73 32.591 12.078 -1.524
581 HB1 ALA 73 1HB ALA 73 34.791 12.806 -1.527
582 HB2 ALA 73 2HB ALA 73 35.434 11.188 -1.241
583 HB3 ALA 73 3HB ALA 73 34.779 11.610 -2.823
584 H THR 74 H THR 74 34.129 8.919 -0.987
585 HA THR 74 HA THR 74 33.283 7.782 -3.440
586 HB THR 74 HB THR 74 33.970 6.314 -0.888
587 HG1 THR 74 HG1 THR 74 36.073 6.202 -2.181
588 HG21 THR 74 3HG2 THR 74 32.972 4.814 -2.444
589 HG22 THR 74 1HG2 THR 74 34.714 4.559 -2.542
590 HG23 THR 74 2HG2 THR 74 33.889 5.495 -3.788
591 H VAL 75 H VAL 75 32.027 7.473 -0.122
592 HA VAL 75 HA VAL 75 29.895 5.765 -0.682
593 HB VAL 75 HB VAL 75 30.024 7.919 1.433
594 HG11 VAL 75 1HG1 VAL 75 28.365 6.565 2.620
595 HG12 VAL 75 2HG1 VAL 75 27.747 7.128 1.066
596 HG13 VAL 75 3HG1 VAL 75 28.287 5.459 1.249
597 HG21 VAL 75 3HG2 VAL 75 31.427 5.421 1.118
598 HG22 VAL 75 1HG2 VAL 75 31.624 6.672 2.345
599 HG23 VAL 75 2HG2 VAL 75 30.425 5.399 2.569
600 H GLY 76 H GLY 76 30.094 9.296 -0.804
601 HA2 GLY 76 1HA GLY 76 27.402 9.891 -1.188
602 HA3 GLY 76 2HA GLY 76 28.738 10.852 -1.805
603 H ARG 77 H ARG 77 29.777 8.693 -3.474
604 HA ARG 77 HA ARG 77 28.237 9.221 -5.809
605 HB2 ARG 77 1HB ARG 77 30.717 7.741 -5.155
606 HB3 ARG 77 2HB ARG 77 29.860 7.214 -6.598
607 HG2 ARG 77 1HG ARG 77 31.178 8.777 -7.554
608 HG3 ARG 77 2HG ARG 77 29.856 9.837 -7.060
609 HD2 ARG 77 1HD ARG 77 31.052 10.737 -5.312
610 HD3 ARG 77 2HD ARG 77 32.088 9.320 -5.154
611 HE ARG 77 HE ARG 77 32.522 11.604 -6.839
612 HH11 ARG 77 2HH1 ARG 77 33.202 8.220 -6.384
613 HH12 ARG 77 1HH1 ARG 77 34.671 8.258 -7.302
614 HH21 ARG 77 2HH2 ARG 77 34.454 11.666 -8.050
615 HH22 ARG 77 1HH2 ARG 77 35.382 10.219 -8.249
616 H ASN 78 H ASN 78 28.433 6.562 -3.544
617 HA ASN 78 HA ASN 78 27.165 4.574 -5.051
618 HB2 ASN 78 1HB ASN 78 27.896 4.997 -2.276
619 HB3 ASN 78 2HB ASN 78 26.346 4.171 -2.408
620 HD21 ASN 78 2HD2 ASN 78 29.655 3.805 -2.391
621 HD22 ASN 78 1HD2 ASN 78 29.749 2.195 -3.012
622 H VAL 79 H VAL 79 25.886 7.297 -3.275
623 HA VAL 79 HA VAL 79 23.140 6.378 -3.627
624 HB VAL 79 HB VAL 79 22.562 8.512 -2.421
625 HG11 VAL 79 1HG1 VAL 79 24.388 6.512 -1.098
626 HG12 VAL 79 2HG1 VAL 79 23.423 7.700 -0.219
627 HG13 VAL 79 3HG1 VAL 79 22.627 6.463 -1.193
628 HG21 VAL 79 3HG2 VAL 79 25.543 8.663 -1.984
629 HG22 VAL 79 1HG2 VAL 79 24.616 9.737 -3.032
630 HG23 VAL 79 2HG2 VAL 79 24.322 9.731 -1.293
631 H GLY 80 H GLY 80 25.333 7.829 -5.545
632 HA2 GLY 80 1HA GLY 80 24.854 8.659 -7.700
633 HA3 GLY 80 2HA GLY 80 23.236 9.077 -7.155
634 H PHE 81 H PHE 81 25.275 10.117 -4.802
635 HA PHE 81 HA PHE 81 25.116 12.860 -5.771
636 HB2 PHE 81 1HB PHE 81 25.849 11.709 -3.073
637 HB3 PHE 81 2HB PHE 81 25.840 13.432 -3.439
638 HD1 PHE 81 HD2 PHE 81 23.367 13.391 -5.217
639 HD2 PHE 81 HD1 PHE 81 24.185 11.702 -1.396
640 HE1 PHE 81 HE2 PHE 81 20.973 13.495 -4.662
641 HE2 PHE 81 HE1 PHE 81 21.792 11.803 -0.835
642 HZ PHE 81 HZ PHE 81 20.182 12.702 -2.468
643 H ASP 82 H ASP 82 26.760 13.723 -6.831
644 HA ASP 82 HA ASP 82 29.396 12.532 -6.702
645 HB2 ASP 82 1HB ASP 82 28.140 14.694 -8.370
646 HB3 ASP 82 2HB ASP 82 29.886 14.465 -8.363
647 H ASP 83 H ASP 83 27.757 15.392 -5.548
648 HA ASP 83 HA ASP 83 30.239 16.606 -4.635
649 HB2 ASP 83 1HB ASP 83 27.357 17.500 -4.431
650 HB3 ASP 83 2HB ASP 83 28.722 18.418 -3.802
651 H GLN 84 H GLN 84 31.106 16.081 -2.751
652 HA GLN 84 HA GLN 84 29.857 14.425 -0.851
653 HB2 GLN 84 1HB GLN 84 31.800 15.031 0.605
654 HB3 GLN 84 2HB GLN 84 32.248 14.451 -0.993
655 HG2 GLN 84 1HG GLN 84 32.632 16.735 -1.732
656 HG3 GLN 84 2HG GLN 84 32.143 17.338 -0.150
657 HE21 GLN 84 2HE2 GLN 84 33.446 16.682 1.692
658 HE22 GLN 84 1HE2 GLN 84 35.139 16.418 1.472
659 H LEU 85 H LEU 85 30.278 17.923 -1.020
660 HA LEU 85 HA LEU 85 29.351 18.533 1.566
661 HB2 LEU 85 1HB LEU 85 29.114 20.226 -0.915
662 HB3 LEU 85 2HB LEU 85 29.055 20.789 0.754
663 HG LEU 85 HG LEU 85 31.512 19.397 -0.201
664 HD11 LEU 85 1HD1 LEU 85 31.103 20.954 -1.991
665 HD12 LEU 85 2HD1 LEU 85 32.408 21.566 -0.976
666 HD13 LEU 85 3HD1 LEU 85 30.790 22.253 -0.840
667 HD21 LEU 85 3HD2 LEU 85 31.413 21.849 1.487
668 HD22 LEU 85 1HD2 LEU 85 32.533 20.488 1.536
669 HD23 LEU 85 2HD2 LEU 85 30.903 20.312 2.186
670 H TYR 86 H TYR 86 27.679 18.076 -1.502
671 HA TYR 86 HA TYR 86 25.143 18.985 -0.685
672 HB2 TYR 86 1HB TYR 86 25.611 18.712 -3.028
673 HB3 TYR 86 2HB TYR 86 25.955 17.000 -2.814
674 HD1 TYR 86 HD2 TYR 86 23.114 18.852 -1.324
675 HD2 TYR 86 HD1 TYR 86 24.363 16.071 -4.292
676 HE1 TYR 86 HE2 TYR 86 20.762 18.322 -1.809
677 HE2 TYR 86 HE1 TYR 86 22.014 15.535 -4.787
678 HH TYR 86 HH TYR 86 19.655 15.847 -3.072
679 H PHE 87 H PHE 87 26.593 15.747 -0.689
680 HA PHE 87 HA PHE 87 24.313 14.403 0.308
681 HB2 PHE 87 1HB PHE 87 26.007 13.118 -0.793
682 HB3 PHE 87 2HB PHE 87 27.246 13.686 0.322
683 HD1 PHE 87 HD1 PHE 87 23.908 12.024 0.557
684 HD2 PHE 87 HD2 PHE 87 27.964 12.140 1.844
685 HE1 PHE 87 HE1 PHE 87 23.505 10.066 1.991
686 HE2 PHE 87 HE2 PHE 87 27.567 10.182 3.280
687 HZ PHE 87 HZ PHE 87 25.336 9.142 3.354
688 H SER 88 H SER 88 27.210 15.696 1.897
689 HA SER 88 HA SER 88 26.529 14.851 4.504
690 HB2 SER 88 1HB SER 88 28.796 15.427 4.149
691 HB3 SER 88 2HB SER 88 28.374 16.991 3.451
692 HG SER 88 HG SER 88 27.811 17.728 5.464
693 H ARG 89 H ARG 89 25.831 17.778 2.677
694 HA ARG 89 HA ARG 89 24.787 19.315 4.788
695 HB2 ARG 89 1HB ARG 89 24.533 19.370 1.811
696 HB3 ARG 89 2HB ARG 89 23.444 20.362 2.771
697 HG2 ARG 89 1HG ARG 89 25.236 21.600 3.695
698 HG3 ARG 89 2HG ARG 89 26.432 20.465 3.065
699 HD2 ARG 89 1HD ARG 89 25.855 21.110 0.784
700 HD3 ARG 89 2HD ARG 89 24.631 22.221 1.400
701 HE ARG 89 HE ARG 89 27.469 22.655 1.290
702 HH11 ARG 89 2HH1 ARG 89 24.500 23.529 2.883
703 HH12 ARG 89 1HH1 ARG 89 25.081 25.077 3.403
704 HH21 ARG 89 2HH2 ARG 89 28.247 24.690 1.968
705 HH22 ARG 89 1HH2 ARG 89 27.213 25.736 2.881
706 H VAL 90 H VAL 90 23.139 17.265 2.387
707 HA VAL 90 HA VAL 90 20.555 17.624 3.521
708 HB VAL 90 HB VAL 90 21.557 15.444 1.684
709 HG11 VAL 90 1HG1 VAL 90 19.085 15.312 1.100
710 HG12 VAL 90 2HG1 VAL 90 19.572 14.634 2.654
711 HG13 VAL 90 3HG1 VAL 90 18.796 16.217 2.585
712 HG21 VAL 90 3HG2 VAL 90 21.683 17.105 0.195
713 HG22 VAL 90 1HG2 VAL 90 19.921 17.135 0.247
714 HG23 VAL 90 2HG2 VAL 90 20.852 18.235 1.264
715 H PHE 91 H PHE 91 22.962 15.022 3.717
716 HA PHE 91 HA PHE 91 21.455 13.267 5.303
717 HB2 PHE 91 1HB PHE 91 23.434 12.476 4.181
718 HB3 PHE 91 2HB PHE 91 24.445 13.625 5.051
719 HD1 PHE 91 HD2 PHE 91 24.974 13.277 7.410
720 HD2 PHE 91 HD1 PHE 91 22.712 10.434 5.194
721 HE1 PHE 91 HE2 PHE 91 25.381 11.596 9.159
722 HE2 PHE 91 HE1 PHE 91 23.114 8.748 6.940
723 HZ PHE 91 HZ PHE 91 24.451 9.327 8.926
724 H LYS 92 H LYS 92 23.516 15.988 6.134
725 HA LYS 92 HA LYS 92 23.773 15.570 8.877
726 HB2 LYS 92 1HB LYS 92 25.069 17.273 7.774
727 HB3 LYS 92 2HB LYS 92 23.614 18.138 7.294
728 HG2 LYS 92 1HG LYS 92 23.129 18.562 9.683
729 HG3 LYS 92 2HG LYS 92 24.666 17.797 10.094
730 HD2 LYS 92 1HD LYS 92 25.907 19.538 9.280
731 HD3 LYS 92 2HD LYS 92 24.688 19.990 8.086
732 HE2 LYS 92 1HE LYS 92 24.389 20.396 11.058
733 HE3 LYS 92 2HE LYS 92 24.971 21.632 9.944
734 HZ1 LYS 92 3HZ LYS 92 22.288 20.730 10.436
735 HZ2 LYS 92 1HZ LYS 92 22.670 20.801 8.789
736 HZ3 LYS 92 2HZ LYS 92 22.833 22.179 9.756
737 H LYS 93 H LYS 93 21.225 17.243 7.064
738 HA LYS 93 HA LYS 93 19.730 17.921 9.413
739 HB2 LYS 93 1HB LYS 93 18.713 17.844 6.573
740 HB3 LYS 93 2HB LYS 93 18.077 18.786 7.914
741 HG2 LYS 93 1HG LYS 93 20.539 19.781 7.876
742 HG3 LYS 93 2HG LYS 93 20.426 19.286 6.185
743 HD2 LYS 93 1HD LYS 93 18.430 21.040 7.616
744 HD3 LYS 93 2HD LYS 93 19.711 21.623 6.551
745 HE2 LYS 93 1HE LYS 93 17.522 19.716 5.733
746 HE3 LYS 93 2HE LYS 93 17.502 21.454 5.439
747 HZ1 LYS 93 3HZ LYS 93 18.766 21.184 3.655
748 HZ2 LYS 93 1HZ LYS 93 18.609 19.508 3.830
749 HZ3 LYS 93 2HZ LYS 93 19.928 20.311 4.521
750 H CYS 94 H CYS 94 19.894 15.203 7.276
751 HA CYS 94 HA CYS 94 17.379 14.068 7.613
752 HB2 CYS 94 1HB CYS 94 19.448 13.337 6.166
753 HB3 CYS 94 2HB CYS 94 19.815 12.329 7.560
754 HG CYS 94 HG CYS 94 16.645 12.044 6.578
755 H THR 95 H THR 95 20.316 13.579 9.558
756 HA THR 95 HA THR 95 18.645 12.349 11.646
757 HB THR 95 HB THR 95 20.876 11.557 12.580
758 HG1 THR 95 HG1 THR 95 21.917 13.134 10.899
759 HG21 THR 95 3HG2 THR 95 20.312 10.490 9.824
760 HG22 THR 95 1HG2 THR 95 19.226 10.203 11.182
761 HG23 THR 95 2HG2 THR 95 20.887 9.614 11.242
762 H GLY 96 H GLY 96 20.233 15.191 10.840
763 HA2 GLY 96 1HA GLY 96 20.102 17.143 12.175
764 HA3 GLY 96 2HA GLY 96 20.009 16.127 13.606
765 H ALA 97 H ALA 97 22.372 14.696 11.984
766 HA ALA 97 HA ALA 97 24.492 16.557 12.792
767 HB1 ALA 97 1HB ALA 97 24.910 13.692 13.438
768 HB2 ALA 97 2HB ALA 97 25.519 15.137 14.245
769 HB3 ALA 97 3HB ALA 97 23.850 14.626 14.493
770 H SER 98 H SER 98 26.448 16.323 11.682
771 HA SER 98 HA SER 98 26.240 15.419 9.017
772 HB2 SER 98 1HB SER 98 28.946 15.661 9.441
773 HB3 SER 98 2HB SER 98 27.868 16.984 8.995
774 HG SER 98 HG SER 98 28.507 17.818 10.814
775 HA PRO 99 HA PRO 99 27.520 11.225 9.105
776 HB2 PRO 99 1HB PRO 99 29.186 11.055 6.968
777 HB3 PRO 99 2HB PRO 99 27.435 11.240 6.809
778 HG2 PRO 99 1HG PRO 99 29.585 13.314 6.612
779 HG3 PRO 99 2HG PRO 99 28.151 13.089 5.594
780 HD2 PRO 99 1HD PRO 99 28.265 14.947 7.560
781 HD3 PRO 99 2HD PRO 99 26.757 14.125 7.110
782 H SER 100 H SER 100 30.121 13.597 8.877
783 HA SER 100 HA SER 100 32.237 11.837 9.543
784 HB2 SER 100 1HB SER 100 32.756 13.930 8.475
785 HB3 SER 100 2HB SER 100 31.980 14.843 9.769
786 HG SER 100 HG SER 100 34.478 14.281 9.643
787 H GLU 101 H GLU 101 30.000 13.754 11.444
788 HA GLU 101 HA GLU 101 31.380 13.399 13.925
789 HB2 GLU 101 1HB GLU 101 29.811 15.284 13.444
790 HB3 GLU 101 2HB GLU 101 28.483 14.133 13.481
791 HG2 GLU 101 1HG GLU 101 28.379 14.193 15.693
792 HG3 GLU 101 2HG GLU 101 30.114 13.927 15.852
793 H PHE 102 H PHE 102 28.504 11.922 12.452
794 HA PHE 102 HA PHE 102 27.879 10.183 14.556
795 HB2 PHE 102 1HB PHE 102 26.325 10.643 12.720
796 HB3 PHE 102 2HB PHE 102 27.401 9.827 11.590
797 HD1 PHE 102 HD2 PHE 102 27.655 7.396 11.651
798 HD2 PHE 102 HD1 PHE 102 24.905 9.414 14.198
799 HE1 PHE 102 HE2 PHE 102 26.520 5.262 12.111
800 HE2 PHE 102 HE1 PHE 102 23.767 7.283 14.663
801 HZ PHE 102 HZ PHE 102 24.573 5.203 13.618
802 H ARG 103 H ARG 103 29.948 9.729 11.716
803 HA ARG 103 HA ARG 103 30.560 7.019 12.178
804 HB2 ARG 103 1HB ARG 103 30.978 8.527 10.090
805 HB3 ARG 103 2HB ARG 103 32.503 8.899 10.882
806 HG2 ARG 103 1HG ARG 103 31.647 6.067 10.420
807 HG3 ARG 103 2HG ARG 103 32.453 7.005 9.160
808 HD2 ARG 103 1HD ARG 103 34.155 7.513 11.107
809 HD3 ARG 103 2HD ARG 103 33.502 6.013 11.765
810 HE ARG 103 HE ARG 103 34.205 5.636 9.063
811 HH11 ARG 103 2HH1 ARG 103 35.647 6.094 12.198
812 HH12 ARG 103 1HH1 ARG 103 37.093 5.224 11.804
813 HH21 ARG 103 2HH2 ARG 103 36.103 4.489 8.532
814 HH22 ARG 103 1HH2 ARG 103 37.351 4.312 9.719
815 H ALA 104 H ALA 104 32.109 10.013 13.234
816 HA ALA 104 HA ALA 104 34.404 8.877 14.384
817 HB1 ALA 104 1HB ALA 104 33.093 11.465 14.372
818 HB2 ALA 104 2HB ALA 104 33.861 11.110 15.920
819 HB3 ALA 104 3HB ALA 104 34.810 11.067 14.434
820 H GLY 105 H GLY 105 31.139 9.303 15.602
821 HA2 GLY 105 1HA GLY 105 30.155 8.019 17.301
822 HA3 GLY 105 2HA GLY 105 31.756 7.494 17.801
823 H CYS 106 H CYS 106 32.257 10.629 17.524
824 HA CYS 106 HA CYS 106 31.974 11.093 20.353
825 HB2 CYS 106 1HB CYS 106 33.910 11.848 18.808
826 HB3 CYS 106 2HB CYS 106 32.835 13.165 18.352
827 HG CYS 106 HG CYS 106 32.652 14.244 20.900
828 H GLU 107 H GLU 107 30.524 12.366 21.375
829 HA GLU 107 HA GLU 107 28.490 13.686 19.700
830 HB2 GLU 107 1HB GLU 107 27.639 11.733 20.958
831 HB3 GLU 107 2HB GLU 107 28.138 12.501 22.459
832 HG2 GLU 107 1HG GLU 107 26.620 14.454 21.605
833 HG3 GLU 107 2HG GLU 107 25.882 13.175 20.642
Start of MODEL 14
1 H1 MET 1 H MET 1 1.231 -1.414 -0.053
2 HA MET 1 HA MET 1 2.271 0.193 -2.290
3 HB2 MET 1 1HB MET 1 3.846 -0.915 -0.342
4 HB3 MET 1 2HB MET 1 3.858 -2.173 -1.570
5 HG2 MET 1 1HG MET 1 5.250 -1.025 -2.854
6 HG3 MET 1 2HG MET 1 4.264 0.431 -2.739
7 HE1 MET 1 3HE MET 1 6.844 1.103 -3.222
8 HE2 MET 1 1HE MET 1 6.162 2.453 -2.315
9 HE3 MET 1 2HE MET 1 7.751 1.817 -1.887
10 H ASP 2 H ASP 2 0.934 -0.406 -3.901
11 HA ASP 2 HA ASP 2 -0.003 -3.109 -4.192
12 HB2 ASP 2 1HB ASP 2 -1.387 -1.160 -4.839
13 HB3 ASP 2 2HB ASP 2 -0.226 -0.778 -6.107
14 H ASN 3 H ASN 3 0.478 -4.547 -5.878
15 HA ASN 3 HA ASN 3 3.146 -4.855 -6.544
16 HB2 ASN 3 1HB ASN 3 0.608 -5.966 -7.697
17 HB3 ASN 3 2HB ASN 3 2.153 -6.331 -8.459
18 HD21 ASN 3 2HD2 ASN 3 0.619 -8.334 -7.450
19 HD22 ASN 3 1HD2 ASN 3 1.367 -9.000 -6.042
20 H ARG 4 H ARG 4 0.664 -3.002 -8.134
21 HA ARG 4 HA ARG 4 2.011 -2.666 -10.617
22 HB2 ARG 4 1HB ARG 4 -0.234 -1.184 -9.262
23 HB3 ARG 4 2HB ARG 4 0.415 -0.668 -10.813
24 HG2 ARG 4 1HG ARG 4 -0.073 -3.024 -11.629
25 HG3 ARG 4 2HG ARG 4 -1.016 -3.219 -10.149
26 HD2 ARG 4 1HD ARG 4 -1.511 -0.822 -11.841
27 HD3 ARG 4 2HD ARG 4 -2.120 -2.380 -12.399
28 HE ARG 4 HE ARG 4 -2.815 -1.892 -9.682
29 HH11 ARG 4 2HH1 ARG 4 -3.661 -1.095 -12.964
30 HH12 ARG 4 1HH1 ARG 4 -5.317 -0.749 -12.591
31 HH21 ARG 4 2HH2 ARG 4 -4.994 -1.438 -9.179
32 HH22 ARG 4 1HH2 ARG 4 -6.074 -0.943 -10.438
33 H VAL 5 H VAL 5 1.682 -0.601 -7.739
34 HA VAL 5 HA VAL 5 3.354 1.471 -8.732
35 HB VAL 5 HB VAL 5 2.608 0.816 -5.878
36 HG11 VAL 5 1HG1 VAL 5 3.075 3.556 -6.165
37 HG12 VAL 5 2HG1 VAL 5 4.073 2.386 -5.301
38 HG13 VAL 5 3HG1 VAL 5 4.415 2.762 -6.990
39 HG21 VAL 5 3HG2 VAL 5 0.598 1.257 -6.990
40 HG22 VAL 5 1HG2 VAL 5 1.047 2.810 -6.285
41 HG23 VAL 5 2HG2 VAL 5 1.324 2.506 -8.000
42 H ARG 6 H ARG 6 3.916 -1.369 -6.717
43 HA ARG 6 HA ARG 6 6.482 -0.828 -5.817
44 HB2 ARG 6 1HB ARG 6 4.745 -2.993 -5.730
45 HB3 ARG 6 2HB ARG 6 6.147 -3.616 -6.590
46 HG2 ARG 6 1HG ARG 6 7.327 -3.754 -4.718
47 HG3 ARG 6 2HG ARG 6 6.944 -2.089 -4.278
48 HD2 ARG 6 1HD ARG 6 5.866 -3.078 -2.561
49 HD3 ARG 6 2HD ARG 6 4.582 -3.266 -3.755
50 HE ARG 6 HE ARG 6 6.360 -5.469 -3.844
51 HH11 ARG 6 2HH1 ARG 6 3.794 -4.083 -1.943
52 HH12 ARG 6 1HH1 ARG 6 3.275 -5.604 -1.296
53 HH21 ARG 6 2HH2 ARG 6 5.687 -7.478 -2.998
54 HH22 ARG 6 1HH2 ARG 6 4.353 -7.534 -1.896
55 H GLU 7 H GLU 7 5.392 -1.983 -8.945
56 HA GLU 7 HA GLU 7 7.975 -2.682 -9.924
57 HB2 GLU 7 1HB GLU 7 5.282 -2.263 -11.167
58 HB3 GLU 7 2HB GLU 7 6.702 -2.401 -12.196
59 HG2 GLU 7 1HG GLU 7 6.969 -4.604 -11.775
60 HG3 GLU 7 2HG GLU 7 6.370 -4.475 -10.122
61 H ALA 8 H ALA 8 6.048 0.243 -9.914
62 HA ALA 8 HA ALA 8 7.646 1.674 -11.793
63 HB1 ALA 8 1HB ALA 8 5.646 2.587 -9.735
64 HB2 ALA 8 2HB ALA 8 6.446 3.673 -10.872
65 HB3 ALA 8 3HB ALA 8 5.398 2.387 -11.470
66 H CYS 9 H CYS 9 7.477 1.639 -8.242
67 HA CYS 9 HA CYS 9 9.497 3.571 -7.836
68 HB2 CYS 9 1HB CYS 9 9.400 2.987 -5.544
69 HB3 CYS 9 2HB CYS 9 7.766 2.750 -6.154
70 HG CYS 9 HG CYS 9 9.946 0.137 -5.927
71 H GLN 10 H GLN 10 9.570 0.121 -8.370
72 HA GLN 10 HA GLN 10 12.197 -0.379 -7.482
73 HB2 GLN 10 1HB GLN 10 10.339 -2.056 -8.075
74 HB3 GLN 10 2HB GLN 10 10.875 -1.866 -9.739
75 HG2 GLN 10 1HG GLN 10 11.853 -3.830 -8.651
76 HG3 GLN 10 2HG GLN 10 13.073 -2.668 -9.170
77 HE21 GLN 10 2HE2 GLN 10 14.670 -2.594 -7.774
78 HE22 GLN 10 1HE2 GLN 10 14.527 -2.634 -6.053
79 H TYR 11 H TYR 11 10.898 0.751 -10.544
80 HA TYR 11 HA TYR 11 13.306 0.486 -12.028
81 HB2 TYR 11 1HB TYR 11 11.335 0.628 -13.310
82 HB3 TYR 11 2HB TYR 11 10.767 2.050 -12.441
83 HD1 TYR 11 HD2 TYR 11 13.545 0.941 -14.674
84 HD2 TYR 11 HD1 TYR 11 11.056 4.145 -13.391
85 HE1 TYR 11 HE2 TYR 11 14.516 2.384 -16.413
86 HE2 TYR 11 HE1 TYR 11 12.020 5.597 -15.128
87 HH TYR 11 HH TYR 11 13.562 5.788 -16.721
88 H ILE 12 H ILE 12 11.891 3.071 -10.104
89 HA ILE 12 HA ILE 12 13.621 5.145 -10.863
90 HB ILE 12 HB ILE 12 12.255 4.728 -8.201
91 HG12 ILE 12 1HG1 ILE 12 11.319 6.585 -10.362
92 HG13 ILE 12 2HG1 ILE 12 10.912 4.874 -10.445
93 HG21 ILE 12 1HG2 ILE 12 12.515 7.145 -7.913
94 HG22 ILE 12 2HG2 ILE 12 14.076 6.336 -8.046
95 HG23 ILE 12 3HG2 ILE 12 13.424 7.225 -9.423
96 HD11 ILE 12 3HD1 ILE 12 9.602 6.906 -9.019
97 HD12 ILE 12 1HD1 ILE 12 9.247 5.179 -9.029
98 HD13 ILE 12 2HD1 ILE 12 10.349 5.846 -7.824
99 H SER 13 H SER 13 13.931 2.605 -8.445
100 HA SER 13 HA SER 13 16.153 3.574 -7.061
101 HB2 SER 13 1HB SER 13 16.362 1.423 -6.145
102 HB3 SER 13 2HB SER 13 14.652 1.523 -6.560
103 HG SER 13 HG SER 13 16.669 -0.022 -7.674
104 H ASP 14 H ASP 14 15.919 1.800 -10.086
105 HA ASP 14 HA ASP 14 18.680 1.233 -10.364
106 HB2 ASP 14 1HB ASP 14 16.557 0.316 -11.649
107 HB3 ASP 14 2HB ASP 14 16.944 1.625 -12.763
108 H HIS 15 H HIS 15 16.745 4.042 -10.995
109 HA HIS 15 HA HIS 15 18.966 5.328 -12.418
110 HB2 HIS 15 1HB HIS 15 16.039 5.996 -12.163
111 HB3 HIS 15 2HB HIS 15 17.206 7.158 -12.787
112 HD1 HIS 15 HD1 HIS 15 17.587 7.070 -15.232
113 HD2 HIS 15 HD2 HIS 15 16.041 3.500 -13.774
114 HE1 HIS 15 HE1 HIS 15 17.183 5.635 -17.258
115 H LEU 16 H LEU 16 18.586 4.799 -9.420
116 HA LEU 16 HA LEU 16 18.191 7.233 -8.089
117 HB2 LEU 16 1HB LEU 16 18.157 5.133 -6.909
118 HB3 LEU 16 2HB LEU 16 19.842 4.830 -7.328
119 HG LEU 16 HG LEU 16 19.216 7.264 -5.737
120 HD11 LEU 16 1HD1 LEU 16 18.321 4.707 -4.931
121 HD12 LEU 16 2HD1 LEU 16 18.353 6.202 -3.996
122 HD13 LEU 16 3HD1 LEU 16 19.734 5.107 -3.954
123 HD21 LEU 16 3HD2 LEU 16 21.490 5.496 -6.310
124 HD22 LEU 16 1HD2 LEU 16 21.370 6.039 -4.637
125 HD23 LEU 16 2HD2 LEU 16 21.453 7.221 -5.943
126 H ALA 17 H ALA 17 20.959 5.925 -9.749
127 HA ALA 17 HA ALA 17 22.709 8.027 -8.728
128 HB1 ALA 17 1HB ALA 17 23.656 6.149 -10.813
129 HB2 ALA 17 2HB ALA 17 24.472 6.750 -9.369
130 HB3 ALA 17 3HB ALA 17 23.267 5.470 -9.232
131 H ASP 18 H ASP 18 20.752 7.310 -11.457
132 HA ASP 18 HA ASP 18 22.098 8.810 -13.431
133 HB2 ASP 18 1HB ASP 18 19.340 7.734 -13.088
134 HB3 ASP 18 2HB ASP 18 19.590 8.976 -14.312
135 H SER 19 H SER 19 22.198 10.932 -13.832
136 HA SER 19 HA SER 19 21.211 12.782 -11.893
137 HB2 SER 19 1HB SER 19 22.650 13.130 -14.525
138 HB3 SER 19 2HB SER 19 22.152 14.497 -13.529
139 HG SER 19 HG SER 19 23.952 14.166 -12.509
140 H ASN 20 H ASN 20 20.506 12.256 -15.344
141 HA ASN 20 HA ASN 20 18.237 14.055 -15.219
142 HB2 ASN 20 1HB ASN 20 19.538 12.465 -17.418
143 HB3 ASN 20 2HB ASN 20 17.973 13.238 -17.658
144 HD21 ASN 20 2HD2 ASN 20 17.935 15.595 -16.975
145 HD22 ASN 20 1HD2 ASN 20 19.292 16.550 -17.457
146 H PHE 21 H PHE 21 16.718 13.109 -13.901
147 HA PHE 21 HA PHE 21 15.800 10.410 -14.566
148 HB2 PHE 21 1HB PHE 21 16.208 10.716 -12.225
149 HB3 PHE 21 2HB PHE 21 15.272 12.207 -12.197
150 HD1 PHE 21 HD2 PHE 21 14.483 8.876 -13.658
151 HD2 PHE 21 HD1 PHE 21 13.495 11.845 -10.773
152 HE1 PHE 21 HE2 PHE 21 12.474 7.599 -13.037
153 HE2 PHE 21 HE1 PHE 21 11.485 10.572 -10.146
154 HZ PHE 21 HZ PHE 21 10.971 8.446 -11.279
155 H ASP 22 H ASP 22 13.901 10.017 -15.529
156 HA ASP 22 HA ASP 22 12.107 12.309 -15.995
157 HB2 ASP 22 1HB ASP 22 13.419 11.004 -17.935
158 HB3 ASP 22 2HB ASP 22 12.006 9.960 -17.814
159 H ILE 23 H ILE 23 10.161 12.167 -15.110
160 HA ILE 23 HA ILE 23 9.316 9.863 -13.684
161 HB ILE 23 HB ILE 23 8.687 12.213 -13.096
162 HG12 ILE 23 1HG1 ILE 23 6.407 10.264 -13.498
163 HG13 ILE 23 2HG1 ILE 23 7.509 10.295 -12.126
164 HG21 ILE 23 1HG2 ILE 23 6.927 13.334 -14.256
165 HG22 ILE 23 2HG2 ILE 23 8.148 12.877 -15.444
166 HG23 ILE 23 3HG2 ILE 23 6.659 11.942 -15.306
167 HD11 ILE 23 3HD1 ILE 23 5.080 11.735 -12.526
168 HD12 ILE 23 1HD1 ILE 23 6.101 11.642 -11.091
169 HD13 ILE 23 2HD1 ILE 23 6.414 12.870 -12.318
170 H ALA 24 H ALA 24 8.899 10.923 -16.933
171 HA ALA 24 HA ALA 24 6.497 9.635 -17.602
172 HB1 ALA 24 1HB ALA 24 7.046 10.957 -19.334
173 HB2 ALA 24 2HB ALA 24 8.779 10.771 -19.063
174 HB3 ALA 24 3HB ALA 24 7.883 9.521 -19.924
175 H SER 25 H SER 25 9.850 8.488 -17.645
176 HA SER 25 HA SER 25 9.349 5.981 -18.817
177 HB2 SER 25 1HB SER 25 11.553 7.010 -17.037
178 HB3 SER 25 2HB SER 25 11.531 5.342 -17.610
179 HG SER 25 HG SER 25 12.628 6.352 -19.166
180 H VAL 26 H VAL 26 8.995 7.153 -15.557
181 HA VAL 26 HA VAL 26 8.892 4.655 -14.234
182 HB VAL 26 HB VAL 26 7.585 7.261 -13.440
183 HG11 VAL 26 1HG1 VAL 26 6.662 5.301 -12.278
184 HG12 VAL 26 2HG1 VAL 26 8.289 4.857 -11.758
185 HG13 VAL 26 3HG1 VAL 26 7.558 6.358 -11.188
186 HG21 VAL 26 3HG2 VAL 26 9.719 7.946 -13.292
187 HG22 VAL 26 1HG2 VAL 26 9.765 6.950 -11.837
188 HG23 VAL 26 2HG2 VAL 26 10.355 6.303 -13.367
189 H ALA 27 H ALA 27 6.316 6.805 -15.424
190 HA ALA 27 HA ALA 27 4.187 5.078 -14.710
191 HB1 ALA 27 1HB ALA 27 4.430 7.666 -15.713
192 HB2 ALA 27 2HB ALA 27 3.542 6.775 -16.950
193 HB3 ALA 27 3HB ALA 27 2.939 6.821 -15.294
194 H GLN 28 H GLN 28 5.953 5.602 -17.740
195 HA GLN 28 HA GLN 28 4.414 3.893 -19.350
196 HB2 GLN 28 1HB GLN 28 5.954 5.490 -20.325
197 HB3 GLN 28 2HB GLN 28 7.322 4.684 -19.568
198 HG2 GLN 28 1HG GLN 28 7.205 2.861 -21.003
199 HG3 GLN 28 2HG GLN 28 5.546 3.222 -21.478
200 HE21 GLN 28 2HE2 GLN 28 5.184 5.076 -22.830
201 HE22 GLN 28 1HE2 GLN 28 6.419 5.602 -23.917
202 H HIS 29 H HIS 29 7.150 3.284 -17.226
203 HA HIS 29 HA HIS 29 7.792 0.692 -18.027
204 HB2 HIS 29 1HB HIS 29 9.282 1.763 -16.534
205 HB3 HIS 29 2HB HIS 29 8.003 2.097 -15.370
206 HD1 HIS 29 HD1 HIS 29 8.885 -1.245 -16.940
207 HD2 HIS 29 HD2 HIS 29 8.806 0.624 -13.230
208 HE1 HIS 29 HE1 HIS 29 9.439 -3.042 -15.270
209 H VAL 30 H VAL 30 5.234 1.873 -15.936
210 HA VAL 30 HA VAL 30 4.372 -0.870 -15.369
211 HB VAL 30 HB VAL 30 2.725 0.230 -13.831
212 HG11 VAL 30 1HG1 VAL 30 5.634 0.862 -13.338
213 HG12 VAL 30 2HG1 VAL 30 4.373 0.757 -12.107
214 HG13 VAL 30 3HG1 VAL 30 4.841 -0.680 -13.016
215 HG21 VAL 30 3HG2 VAL 30 2.941 2.548 -13.283
216 HG22 VAL 30 1HG2 VAL 30 4.343 2.721 -14.339
217 HG23 VAL 30 2HG2 VAL 30 2.748 2.424 -15.032
218 H CYS 31 H CYS 31 4.069 0.728 -17.962
219 HA CYS 31 HA CYS 31 2.517 1.069 -19.595
220 HB2 CYS 31 1HB CYS 31 2.368 -1.478 -18.960
221 HB3 CYS 31 2HB CYS 31 0.783 -1.027 -18.344
222 HG CYS 31 HG CYS 31 0.188 0.193 -20.968
223 H LEU 32 H LEU 32 2.244 2.760 -17.344
224 HA LEU 32 HA LEU 32 -0.620 3.357 -17.537
225 HB2 LEU 32 1HB LEU 32 0.745 2.479 -15.191
226 HB3 LEU 32 2HB LEU 32 0.251 4.156 -14.967
227 HG LEU 32 HG LEU 32 -1.556 1.830 -15.620
228 HD11 LEU 32 1HD1 LEU 32 -2.507 2.403 -13.373
229 HD12 LEU 32 2HD1 LEU 32 -1.109 3.448 -13.122
230 HD13 LEU 32 3HD1 LEU 32 -0.885 1.713 -13.343
231 HD21 LEU 32 3HD2 LEU 32 -2.167 4.755 -15.220
232 HD22 LEU 32 1HD2 LEU 32 -3.375 3.472 -15.286
233 HD23 LEU 32 2HD2 LEU 32 -2.381 3.820 -16.700
234 H SER 33 H SER 33 -1.121 5.609 -16.872
235 HA SER 33 HA SER 33 0.755 7.409 -18.084
236 HB2 SER 33 1HB SER 33 -2.016 7.614 -16.997
237 HB3 SER 33 2HB SER 33 -1.080 9.100 -17.158
238 HG SER 33 HG SER 33 -0.691 8.353 -19.388
239 HA PRO 34 HA PRO 34 2.877 8.977 -14.579
240 HB2 PRO 34 1HB PRO 34 3.079 11.619 -15.167
241 HB3 PRO 34 2HB PRO 34 4.004 10.374 -16.013
242 HG2 PRO 34 1HG PRO 34 1.487 11.760 -16.851
243 HG3 PRO 34 2HG PRO 34 2.924 11.370 -17.815
244 HD2 PRO 34 1HD PRO 34 0.661 9.885 -17.905
245 HD3 PRO 34 2HD PRO 34 2.275 9.180 -18.124
246 H SER 35 H SER 35 0.032 10.885 -15.517
247 HA SER 35 HA SER 35 -0.274 12.189 -13.021
248 HB2 SER 35 1HB SER 35 -2.519 12.789 -13.845
249 HB3 SER 35 2HB SER 35 -1.288 13.063 -15.077
250 HG SER 35 HG SER 35 -3.210 11.971 -15.834
251 H ARG 36 H ARG 36 -1.826 9.325 -14.436
252 HA ARG 36 HA ARG 36 -3.500 8.790 -12.216
253 HB2 ARG 36 1HB ARG 36 -3.451 7.863 -14.720
254 HB3 ARG 36 2HB ARG 36 -2.575 6.551 -13.943
255 HG2 ARG 36 1HG ARG 36 -4.658 5.722 -13.704
256 HG3 ARG 36 2HG ARG 36 -4.638 6.733 -12.258
257 HD2 ARG 36 1HD ARG 36 -5.523 7.947 -14.826
258 HD3 ARG 36 2HD ARG 36 -6.621 6.842 -13.999
259 HE ARG 36 HE ARG 36 -6.836 8.379 -12.263
260 HH11 ARG 36 2HH1 ARG 36 -4.533 9.463 -14.638
261 HH12 ARG 36 1HH1 ARG 36 -4.494 11.091 -14.047
262 HH21 ARG 36 2HH2 ARG 36 -6.793 10.519 -11.476
263 HH22 ARG 36 1HH2 ARG 36 -5.779 11.691 -12.248
264 H LEU 37 H LEU 37 -0.289 7.639 -13.149
265 HA LEU 37 HA LEU 37 -0.031 5.764 -11.032
266 HB2 LEU 37 1HB LEU 37 1.322 5.541 -12.998
267 HB3 LEU 37 2HB LEU 37 2.013 7.145 -12.760
268 HG LEU 37 HG LEU 37 2.902 6.111 -10.528
269 HD11 LEU 37 1HD1 LEU 37 2.321 3.980 -10.241
270 HD12 LEU 37 2HD1 LEU 37 3.487 3.605 -11.510
271 HD13 LEU 37 3HD1 LEU 37 1.783 3.814 -11.913
272 HD21 LEU 37 3HD2 LEU 37 4.889 6.183 -11.548
273 HD22 LEU 37 1HD2 LEU 37 3.983 6.630 -12.994
274 HD23 LEU 37 2HD2 LEU 37 4.434 4.946 -12.722
275 H SER 38 H SER 38 1.055 9.112 -11.459
276 HA SER 38 HA SER 38 2.493 9.356 -9.072
277 HB2 SER 38 1HB SER 38 2.577 11.003 -10.923
278 HB3 SER 38 2HB SER 38 0.941 11.519 -10.516
279 HG SER 38 HG SER 38 1.981 12.870 -9.271
280 H HIS 39 H HIS 39 -0.935 9.837 -9.771
281 HA HIS 39 HA HIS 39 -1.708 10.936 -7.317
282 HB2 HIS 39 1HB HIS 39 -3.187 10.926 -9.256
283 HB3 HIS 39 2HB HIS 39 -3.281 9.168 -9.203
284 HD1 HIS 39 HD1 HIS 39 -4.902 12.176 -7.952
285 HD2 HIS 39 HD2 HIS 39 -4.650 8.190 -6.808
286 HE1 HIS 39 HE1 HIS 39 -6.794 11.820 -6.334
287 H LEU 40 H LEU 40 -1.648 7.541 -8.375
288 HA LEU 40 HA LEU 40 -2.515 6.520 -5.859
289 HB2 LEU 40 1HB LEU 40 -1.762 5.471 -8.458
290 HB3 LEU 40 2HB LEU 40 -1.166 4.466 -7.139
291 HG LEU 40 HG LEU 40 -4.051 5.287 -7.339
292 HD11 LEU 40 1HD1 LEU 40 -3.440 4.149 -9.417
293 HD12 LEU 40 2HD1 LEU 40 -4.504 3.157 -8.420
294 HD13 LEU 40 3HD1 LEU 40 -2.777 2.806 -8.485
295 HD21 LEU 40 3HD2 LEU 40 -4.212 3.052 -6.073
296 HD22 LEU 40 1HD2 LEU 40 -3.612 4.465 -5.205
297 HD23 LEU 40 2HD2 LEU 40 -2.481 3.250 -5.799
298 H PHE 41 H PHE 41 0.590 7.229 -7.293
299 HA PHE 41 HA PHE 41 2.248 5.750 -5.597
300 HB2 PHE 41 1HB PHE 41 2.653 7.434 -7.712
301 HB3 PHE 41 2HB PHE 41 3.281 8.394 -6.376
302 HD1 PHE 41 HD1 PHE 41 5.215 7.647 -5.108
303 HD2 PHE 41 HD2 PHE 41 3.738 5.408 -8.412
304 HE1 PHE 41 HE1 PHE 41 7.319 6.373 -5.180
305 HE2 PHE 41 HE2 PHE 41 5.839 4.130 -8.490
306 HZ PHE 41 HZ PHE 41 7.632 4.611 -6.872
307 H ARG 42 H ARG 42 1.145 9.122 -5.309
308 HA ARG 42 HA ARG 42 2.399 9.576 -2.806
309 HB2 ARG 42 1HB ARG 42 1.771 11.413 -4.297
310 HB3 ARG 42 2HB ARG 42 0.071 11.006 -4.101
311 HG2 ARG 42 1HG ARG 42 -0.026 11.845 -1.964
312 HG3 ARG 42 2HG ARG 42 1.706 11.646 -1.694
313 HD2 ARG 42 1HD ARG 42 2.157 13.477 -3.253
314 HD3 ARG 42 2HD ARG 42 0.426 13.673 -3.524
315 HE ARG 42 HE ARG 42 0.750 13.921 -0.817
316 HH11 ARG 42 2HH1 ARG 42 2.036 15.516 -3.631
317 HH12 ARG 42 1HH1 ARG 42 2.242 17.040 -2.834
318 HH21 ARG 42 2HH2 ARG 42 1.017 15.922 0.244
319 HH22 ARG 42 1HH2 ARG 42 1.663 17.270 -0.630
320 H GLN 43 H GLN 43 -0.597 8.122 -3.748
321 HA GLN 43 HA GLN 43 -1.865 8.379 -1.183
322 HB2 GLN 43 1HB GLN 43 -2.498 6.827 -3.682
323 HB3 GLN 43 2HB GLN 43 -3.430 6.610 -2.207
324 HG2 GLN 43 1HG GLN 43 -3.042 9.260 -3.575
325 HG3 GLN 43 2HG GLN 43 -4.422 8.197 -3.846
326 HE21 GLN 43 2HE2 GLN 43 -3.072 10.613 -1.896
327 HE22 GLN 43 1HE2 GLN 43 -4.293 10.650 -0.674
328 H GLN 44 H GLN 44 -0.104 5.849 -2.911
329 HA GLN 44 HA GLN 44 -0.445 3.941 -0.776
330 HB2 GLN 44 1HB GLN 44 1.324 3.851 -3.226
331 HB3 GLN 44 2HB GLN 44 1.033 2.506 -2.131
332 HG2 GLN 44 1HG GLN 44 -1.504 3.238 -2.816
333 HG3 GLN 44 2HG GLN 44 -0.610 3.554 -4.302
334 HE21 GLN 44 2HE2 GLN 44 -1.974 1.195 -2.269
335 HE22 GLN 44 1HE2 GLN 44 -1.477 -0.200 -3.158
336 H LEU 45 H LEU 45 2.113 6.054 -1.974
337 HA LEU 45 HA LEU 45 3.969 5.122 0.057
338 HB2 LEU 45 1HB LEU 45 4.242 6.229 -2.476
339 HB3 LEU 45 2HB LEU 45 4.773 7.505 -1.382
340 HG LEU 45 HG LEU 45 5.882 4.729 -1.152
341 HD11 LEU 45 1HD1 LEU 45 7.752 5.486 -2.597
342 HD12 LEU 45 2HD1 LEU 45 6.791 6.899 -3.034
343 HD13 LEU 45 3HD1 LEU 45 6.227 5.283 -3.460
344 HD21 LEU 45 3HD2 LEU 45 6.178 6.670 0.546
345 HD22 LEU 45 1HD2 LEU 45 7.306 7.309 -0.650
346 HD23 LEU 45 2HD2 LEU 45 7.582 5.719 0.061
347 H GLY 46 H GLY 46 1.588 7.532 -0.303
348 HA2 GLY 46 1HA GLY 46 0.854 9.158 1.147
349 HA3 GLY 46 2HA GLY 46 1.958 8.493 2.341
350 H ILE 47 H ILE 47 3.606 9.251 -0.474
351 HA ILE 47 HA ILE 47 4.082 12.036 0.211
352 HB ILE 47 HB ILE 47 6.471 11.814 0.454
353 HG12 ILE 47 1HG1 ILE 47 6.014 8.839 0.141
354 HG13 ILE 47 2HG1 ILE 47 6.816 9.888 -1.022
355 HG21 ILE 47 1HG2 ILE 47 6.578 10.635 2.594
356 HG22 ILE 47 2HG2 ILE 47 5.124 11.624 2.474
357 HG23 ILE 47 3HG2 ILE 47 5.023 9.877 2.254
358 HD11 ILE 47 3HD1 ILE 47 7.775 9.125 1.720
359 HD12 ILE 47 1HD1 ILE 47 8.489 8.696 0.166
360 HD13 ILE 47 2HD1 ILE 47 8.532 10.369 0.725
361 H SER 48 H SER 48 5.835 12.946 -1.328
362 HA SER 48 HA SER 48 4.978 12.344 -4.000
363 HB2 SER 48 1HB SER 48 7.177 14.223 -3.109
364 HB3 SER 48 2HB SER 48 6.358 14.221 -4.671
365 HG SER 48 HG SER 48 5.673 15.633 -2.649
366 H VAL 49 H VAL 49 6.230 11.581 -5.714
367 HA VAL 49 HA VAL 49 7.921 9.443 -5.215
368 HB VAL 49 HB VAL 49 7.960 11.135 -7.717
369 HG11 VAL 49 1HG1 VAL 49 9.776 9.500 -7.544
370 HG12 VAL 49 2HG1 VAL 49 8.593 8.217 -7.281
371 HG13 VAL 49 3HG1 VAL 49 8.638 9.074 -8.822
372 HG21 VAL 49 3HG2 VAL 49 5.856 10.528 -8.087
373 HG22 VAL 49 1HG2 VAL 49 6.354 8.836 -8.047
374 HG23 VAL 49 2HG2 VAL 49 5.820 9.634 -6.567
375 H LEU 50 H LEU 50 8.757 12.797 -6.019
376 HA LEU 50 HA LEU 50 11.541 12.446 -6.137
377 HB2 LEU 50 1HB LEU 50 9.699 14.744 -5.788
378 HB3 LEU 50 2HB LEU 50 11.391 14.989 -5.361
379 HG LEU 50 HG LEU 50 11.975 14.212 -7.686
380 HD11 LEU 50 1HD1 LEU 50 9.085 13.879 -7.758
381 HD12 LEU 50 2HD1 LEU 50 10.331 13.214 -8.813
382 HD13 LEU 50 3HD1 LEU 50 9.705 14.837 -9.103
383 HD21 LEU 50 3HD2 LEU 50 11.730 16.350 -8.595
384 HD22 LEU 50 1HD2 LEU 50 11.739 16.625 -6.853
385 HD23 LEU 50 2HD2 LEU 50 10.215 16.642 -7.740
386 H SER 51 H SER 51 9.356 12.970 -3.451
387 HA SER 51 HA SER 51 11.387 13.539 -1.527
388 HB2 SER 51 1HB SER 51 9.248 14.337 -0.951
389 HB3 SER 51 2HB SER 51 8.473 12.801 -1.339
390 HG SER 51 HG SER 51 9.703 13.619 0.978
391 H TRP 52 H TRP 52 9.564 10.637 -2.423
392 HA TRP 52 HA TRP 52 10.546 8.922 -0.449
393 HB2 TRP 52 1HB TRP 52 8.676 8.225 -1.767
394 HB3 TRP 52 2HB TRP 52 9.594 8.376 -3.263
395 HD1 TRP 52 HD1 TRP 52 9.544 6.178 -0.073
396 HE1 TRP 52 HE1 TRP 52 10.416 3.841 -0.706
397 HE3 TRP 52 HE3 TRP 52 10.802 7.074 -4.946
398 HZ2 TRP 52 HZ2 TRP 52 11.496 2.548 -2.971
399 HZ3 TRP 52 HZ3 TRP 52 11.749 5.234 -6.277
400 HH2 TRP 52 HH2 TRP 52 12.089 3.019 -5.308
401 H ARG 53 H ARG 53 11.848 9.758 -3.627
402 HA ARG 53 HA ARG 53 13.941 7.892 -3.689
403 HB2 ARG 53 1HB ARG 53 13.103 9.337 -5.597
404 HB3 ARG 53 2HB ARG 53 14.035 10.654 -4.898
405 HG2 ARG 53 1HG ARG 53 15.288 9.640 -6.676
406 HG3 ARG 53 2HG ARG 53 16.078 9.295 -5.136
407 HD2 ARG 53 1HD ARG 53 14.096 7.332 -6.160
408 HD3 ARG 53 2HD ARG 53 15.665 7.415 -6.962
409 HE ARG 53 HE ARG 53 16.350 7.252 -4.367
410 HH11 ARG 53 2HH1 ARG 53 14.166 5.393 -6.340
411 HH12 ARG 53 1HH1 ARG 53 14.397 3.928 -5.445
412 HH21 ARG 53 2HH2 ARG 53 16.663 5.329 -3.181
413 HH22 ARG 53 1HH2 ARG 53 15.817 3.893 -3.648
414 H GLU 54 H GLU 54 13.862 11.244 -2.516
415 HA GLU 54 HA GLU 54 16.571 11.403 -1.784
416 HB2 GLU 54 1HB GLU 54 14.850 13.293 -1.999
417 HB3 GLU 54 2HB GLU 54 14.350 12.864 -0.369
418 HG2 GLU 54 1HG GLU 54 16.463 13.434 0.529
419 HG3 GLU 54 2HG GLU 54 17.184 13.565 -1.074
420 H ASP 55 H ASP 55 13.691 10.541 0.104
421 HA ASP 55 HA ASP 55 14.929 10.201 2.581
422 HB2 ASP 55 1HB ASP 55 12.390 10.092 1.810
423 HB3 ASP 55 2HB ASP 55 12.712 8.360 1.807
424 H GLN 56 H GLN 56 14.500 7.928 -0.093
425 HA GLN 56 HA GLN 56 15.598 5.690 1.272
426 HB2 GLN 56 1HB GLN 56 15.265 6.241 -1.680
427 HB3 GLN 56 2HB GLN 56 15.759 4.693 -1.010
428 HG2 GLN 56 1HG GLN 56 13.199 5.996 -0.173
429 HG3 GLN 56 2HG GLN 56 13.300 5.029 -1.643
430 HE21 GLN 56 2HE2 GLN 56 12.470 4.920 1.498
431 HE22 GLN 56 1HE2 GLN 56 12.709 3.239 1.820
432 H ARG 57 H ARG 57 16.940 8.177 -0.833
433 HA ARG 57 HA ARG 57 19.462 7.069 -1.276
434 HB2 ARG 57 1HB ARG 57 18.464 9.903 -1.161
435 HB3 ARG 57 2HB ARG 57 20.164 9.553 -1.444
436 HG2 ARG 57 1HG ARG 57 19.790 8.708 -3.528
437 HG3 ARG 57 2HG ARG 57 18.154 8.174 -3.139
438 HD2 ARG 57 1HD ARG 57 18.336 10.127 -4.731
439 HD3 ARG 57 2HD ARG 57 17.289 10.363 -3.332
440 HE ARG 57 HE ARG 57 19.968 11.284 -2.900
441 HH11 ARG 57 2HH1 ARG 57 16.859 12.109 -4.231
442 HH12 ARG 57 1HH1 ARG 57 17.098 13.818 -4.071
443 HH21 ARG 57 2HH2 ARG 57 20.295 13.531 -2.685
444 HH22 ARG 57 1HH2 ARG 57 19.054 14.626 -3.193
445 H ILE 58 H ILE 58 18.261 9.044 1.399
446 HA ILE 58 HA ILE 58 20.782 9.278 2.705
447 HB ILE 58 HB ILE 58 18.009 9.583 3.863
448 HG12 ILE 58 1HG1 ILE 58 18.379 11.119 2.004
449 HG13 ILE 58 2HG1 ILE 58 18.390 12.002 3.527
450 HG21 ILE 58 1HG2 ILE 58 20.536 9.521 5.121
451 HG22 ILE 58 2HG2 ILE 58 19.986 11.196 5.134
452 HG23 ILE 58 3HG2 ILE 58 18.974 9.931 5.830
453 HD11 ILE 58 3HD1 ILE 58 20.324 12.882 2.932
454 HD12 ILE 58 1HD1 ILE 58 21.048 11.277 3.039
455 HD13 ILE 58 2HD1 ILE 58 20.400 11.853 1.502
456 H SER 59 H SER 59 17.962 7.173 3.175
457 HA SER 59 HA SER 59 18.941 5.793 5.420
458 HB2 SER 59 1HB SER 59 16.650 5.515 5.041
459 HB3 SER 59 2HB SER 59 16.877 5.167 3.327
460 HG SER 59 HG SER 59 16.731 3.168 3.966
461 H GLN 60 H GLN 60 19.333 5.251 1.963
462 HA GLN 60 HA GLN 60 20.613 2.718 2.221
463 HB2 GLN 60 1HB GLN 60 19.490 3.991 0.146
464 HB3 GLN 60 2HB GLN 60 21.170 4.417 -0.150
465 HG2 GLN 60 1HG GLN 60 20.702 2.462 -1.399
466 HG3 GLN 60 2HG GLN 60 21.725 1.988 -0.044
467 HE21 GLN 60 2HE2 GLN 60 21.032 0.449 1.300
468 HE22 GLN 60 1HE2 GLN 60 19.463 -0.272 1.260
469 H ALA 61 H ALA 61 21.783 6.035 1.780
470 HA ALA 61 HA ALA 61 24.502 5.491 1.511
471 HB1 ALA 61 1HB ALA 61 23.133 7.725 1.346
472 HB2 ALA 61 2HB ALA 61 23.639 7.905 3.027
473 HB3 ALA 61 3HB ALA 61 24.849 7.743 1.754
474 H LYS 62 H LYS 62 22.599 6.091 4.450
475 HA LYS 62 HA LYS 62 24.787 5.856 6.239
476 HB2 LYS 62 1HB LYS 62 23.098 5.738 7.994
477 HB3 LYS 62 2HB LYS 62 22.699 7.004 6.840
478 HG2 LYS 62 1HG LYS 62 21.030 5.608 5.811
479 HG3 LYS 62 2HG LYS 62 21.490 4.246 6.836
480 HD2 LYS 62 1HD LYS 62 19.603 5.097 7.898
481 HD3 LYS 62 2HD LYS 62 20.933 5.829 8.799
482 HE2 LYS 62 1HE LYS 62 19.998 7.361 6.468
483 HE3 LYS 62 2HE LYS 62 18.830 7.202 7.779
484 HZ1 LYS 62 3HZ LYS 62 21.499 7.886 8.637
485 HZ2 LYS 62 1HZ LYS 62 20.011 8.548 9.095
486 HZ3 LYS 62 2HZ LYS 62 20.763 9.064 7.671
487 H LEU 63 H LEU 63 22.544 3.559 4.840
488 HA LEU 63 HA LEU 63 23.002 1.388 6.552
489 HB2 LEU 63 1HB LEU 63 21.301 1.753 4.596
490 HB3 LEU 63 2HB LEU 63 22.556 0.980 3.629
491 HG LEU 63 HG LEU 63 20.838 -0.611 4.329
492 HD11 LEU 63 1HD1 LEU 63 22.309 -2.294 4.687
493 HD12 LEU 63 2HD1 LEU 63 23.154 -1.435 5.974
494 HD13 LEU 63 3HD1 LEU 63 23.473 -1.030 4.287
495 HD21 LEU 63 3HD2 LEU 63 20.675 0.771 6.629
496 HD22 LEU 63 1HD2 LEU 63 21.697 -0.569 7.150
497 HD23 LEU 63 2HD2 LEU 63 20.111 -0.891 6.448
498 H LEU 64 H LEU 64 24.577 2.252 3.480
499 HA LEU 64 HA LEU 64 26.426 0.096 3.554
500 HB2 LEU 64 1HB LEU 64 26.779 2.697 2.085
501 HB3 LEU 64 2HB LEU 64 27.476 1.128 1.688
502 HG LEU 64 HG LEU 64 24.584 1.028 1.681
503 HD11 LEU 64 1HD1 LEU 64 25.266 3.489 0.997
504 HD12 LEU 64 2HD1 LEU 64 23.996 2.607 0.150
505 HD13 LEU 64 3HD1 LEU 64 25.615 2.702 -0.543
506 HD21 LEU 64 3HD2 LEU 64 24.935 -0.324 -0.102
507 HD22 LEU 64 1HD2 LEU 64 26.567 -0.374 0.565
508 HD23 LEU 64 2HD2 LEU 64 26.197 0.707 -0.779
509 H LEU 65 H LEU 65 26.550 3.467 4.586
510 HA LEU 65 HA LEU 65 29.308 3.522 5.209
511 HB2 LEU 65 1HB LEU 65 27.009 5.253 5.509
512 HB3 LEU 65 2HB LEU 65 28.057 5.320 6.925
513 HG LEU 65 HG LEU 65 29.302 5.616 4.238
514 HD11 LEU 65 1HD1 LEU 65 28.685 7.835 3.946
515 HD12 LEU 65 2HD1 LEU 65 28.088 7.991 5.597
516 HD13 LEU 65 3HD1 LEU 65 27.173 7.056 4.414
517 HD21 LEU 65 3HD2 LEU 65 30.860 6.963 5.419
518 HD22 LEU 65 1HD2 LEU 65 30.565 5.534 6.410
519 HD23 LEU 65 2HD2 LEU 65 29.802 7.069 6.827
520 H SER 66 H SER 66 26.534 2.288 6.865
521 HA SER 66 HA SER 66 27.931 2.102 9.413
522 HB2 SER 66 1HB SER 66 25.507 2.692 9.320
523 HB3 SER 66 2HB SER 66 25.177 1.084 8.675
524 HG SER 66 HG SER 66 25.910 1.861 11.249
525 H THR 67 H THR 67 27.129 0.138 6.672
526 HA THR 67 HA THR 67 27.878 -2.323 8.056
527 HB THR 67 HB THR 67 25.901 -2.141 6.415
528 HG1 THR 67 HG1 THR 67 26.563 -4.293 5.521
529 HG21 THR 67 3HG2 THR 67 27.748 -2.823 4.225
530 HG22 THR 67 1HG2 THR 67 27.750 -1.128 4.709
531 HG23 THR 67 2HG2 THR 67 26.248 -1.896 4.197
532 H THR 68 H THR 68 29.329 0.112 6.246
533 HA THR 68 HA THR 68 31.661 -1.608 5.742
534 HB THR 68 HB THR 68 32.054 -0.752 3.601
535 HG1 THR 68 HG1 THR 68 29.968 1.122 3.658
536 HG21 THR 68 3HG2 THR 68 30.330 -1.669 2.470
537 HG22 THR 68 1HG2 THR 68 29.136 -0.628 3.242
538 HG23 THR 68 2HG2 THR 68 29.726 -2.065 4.078
539 H ARG 69 H ARG 69 33.627 -0.144 5.183
540 HA ARG 69 HA ARG 69 33.613 2.155 7.028
541 HB2 ARG 69 1HB ARG 69 35.985 0.384 6.433
542 HB3 ARG 69 2HB ARG 69 35.871 1.639 7.659
543 HG2 ARG 69 1HG ARG 69 34.211 -0.870 7.652
544 HG3 ARG 69 2HG ARG 69 35.719 -0.672 8.547
545 HD2 ARG 69 1HD ARG 69 34.617 1.378 9.598
546 HD3 ARG 69 2HD ARG 69 33.105 0.756 8.938
547 HE ARG 69 HE ARG 69 33.072 -0.780 10.621
548 HH11 ARG 69 2HH1 ARG 69 36.334 0.372 10.236
549 HH12 ARG 69 1HH1 ARG 69 36.941 -0.496 11.607
550 HH21 ARG 69 2HH2 ARG 69 33.859 -1.927 12.428
551 HH22 ARG 69 1HH2 ARG 69 35.532 -1.804 12.853
552 H MET 70 H MET 70 33.280 1.812 4.004
553 HA MET 70 HA MET 70 35.525 2.850 2.688
554 HB2 MET 70 1HB MET 70 32.582 2.916 2.057
555 HB3 MET 70 2HB MET 70 33.770 3.657 0.994
556 HG2 MET 70 1HG MET 70 34.883 1.504 0.727
557 HG3 MET 70 2HG MET 70 33.703 0.759 1.803
558 HE1 MET 70 3HE MET 70 31.327 0.296 1.307
559 HE2 MET 70 1HE MET 70 30.859 1.947 0.897
560 HE3 MET 70 2HE MET 70 30.475 0.623 -0.203
561 HA PRO 71 HA PRO 71 35.670 7.110 3.730
562 HB2 PRO 71 1HB PRO 71 36.433 8.228 1.376
563 HB3 PRO 71 2HB PRO 71 37.523 7.265 2.380
564 HG2 PRO 71 1HG PRO 71 35.980 6.456 -0.054
565 HG3 PRO 71 2HG PRO 71 37.656 6.079 0.385
566 HD2 PRO 71 1HD PRO 71 35.628 4.318 0.730
567 HD3 PRO 71 2HD PRO 71 37.032 4.381 1.814
568 H ILE 72 H ILE 72 34.783 9.254 3.227
569 HA ILE 72 HA ILE 72 32.022 9.158 2.683
570 HB ILE 72 HB ILE 72 33.785 11.608 2.638
571 HG12 ILE 72 1HG1 ILE 72 34.070 10.293 4.716
572 HG13 ILE 72 2HG1 ILE 72 33.285 11.841 5.011
573 HG21 ILE 72 1HG2 ILE 72 31.853 12.541 1.986
574 HG22 ILE 72 2HG2 ILE 72 30.897 11.147 2.486
575 HG23 ILE 72 3HG2 ILE 72 31.384 12.355 3.676
576 HD11 ILE 72 3HD1 ILE 72 31.107 10.679 5.043
577 HD12 ILE 72 1HD1 ILE 72 31.961 9.145 4.874
578 HD13 ILE 72 2HD1 ILE 72 32.210 10.140 6.309
579 H ALA 73 H ALA 73 34.799 9.816 0.671
580 HA ALA 73 HA ALA 73 33.431 11.009 -1.501
581 HB1 ALA 73 1HB ALA 73 35.754 11.344 -1.427
582 HB2 ALA 73 2HB ALA 73 36.083 9.618 -1.270
583 HB3 ALA 73 3HB ALA 73 35.490 10.267 -2.799
584 H THR 74 H THR 74 34.453 7.663 -0.874
585 HA THR 74 HA THR 74 33.432 6.603 -3.293
586 HB THR 74 HB THR 74 34.003 5.212 -0.669
587 HG1 THR 74 HG1 THR 74 35.921 4.578 -1.895
588 HG21 THR 74 3HG2 THR 74 33.557 4.057 -3.424
589 HG22 THR 74 1HG2 THR 74 32.472 3.896 -2.043
590 HG23 THR 74 2HG2 THR 74 34.069 3.150 -2.001
591 H VAL 75 H VAL 75 32.123 6.720 0.009
592 HA VAL 75 HA VAL 75 29.775 5.293 -0.418
593 HB VAL 75 HB VAL 75 30.200 7.637 1.441
594 HG11 VAL 75 1HG1 VAL 75 28.059 7.452 1.992
595 HG12 VAL 75 2HG1 VAL 75 27.846 6.151 0.819
596 HG13 VAL 75 3HG1 VAL 75 28.339 5.779 2.472
597 HG21 VAL 75 3HG2 VAL 75 31.499 5.226 1.454
598 HG22 VAL 75 1HG2 VAL 75 31.262 6.267 2.858
599 HG23 VAL 75 2HG2 VAL 75 30.149 4.934 2.551
600 H GLY 76 H GLY 76 30.467 8.725 -0.935
601 HA2 GLY 76 1HA GLY 76 27.872 9.604 -1.487
602 HA3 GLY 76 2HA GLY 76 29.340 10.337 -2.116
603 H ARG 77 H ARG 77 30.303 8.219 -3.664
604 HA ARG 77 HA ARG 77 28.953 8.618 -6.071
605 HB2 ARG 77 1HB ARG 77 31.021 6.679 -5.129
606 HB3 ARG 77 2HB ARG 77 30.250 6.400 -6.685
607 HG2 ARG 77 1HG ARG 77 30.955 8.623 -7.428
608 HG3 ARG 77 2HG ARG 77 31.744 8.884 -5.871
609 HD2 ARG 77 1HD ARG 77 33.449 8.206 -7.355
610 HD3 ARG 77 2HD ARG 77 33.091 6.799 -6.354
611 HE ARG 77 HE ARG 77 32.446 5.692 -8.240
612 HH11 ARG 77 2HH1 ARG 77 32.360 9.114 -8.874
613 HH12 ARG 77 1HH1 ARG 77 31.998 8.925 -10.558
614 HH21 ARG 77 2HH2 ARG 77 31.969 5.430 -10.455
615 HH22 ARG 77 1HH2 ARG 77 31.775 6.829 -11.456
616 H ASN 78 H ASN 78 28.583 6.135 -3.621
617 HA ASN 78 HA ASN 78 27.043 4.305 -5.085
618 HB2 ASN 78 1HB ASN 78 27.008 4.923 -2.122
619 HB3 ASN 78 2HB ASN 78 26.249 3.516 -2.862
620 HD21 ASN 78 2HD2 ASN 78 28.431 3.770 -0.888
621 HD22 ASN 78 1HD2 ASN 78 29.755 2.880 -1.554
622 H VAL 79 H VAL 79 26.204 7.293 -3.478
623 HA VAL 79 HA VAL 79 23.357 6.845 -4.023
624 HB VAL 79 HB VAL 79 22.939 8.814 -2.633
625 HG11 VAL 79 1HG1 VAL 79 22.851 6.950 -1.302
626 HG12 VAL 79 2HG1 VAL 79 24.543 6.535 -1.582
627 HG13 VAL 79 3HG1 VAL 79 24.127 7.858 -0.492
628 HG21 VAL 79 3HG2 VAL 79 24.660 10.040 -1.549
629 HG22 VAL 79 1HG2 VAL 79 25.897 8.900 -2.080
630 HG23 VAL 79 2HG2 VAL 79 25.102 9.950 -3.254
631 H GLY 80 H GLY 80 25.628 7.641 -5.948
632 HA2 GLY 80 1HA GLY 80 25.633 8.818 -7.932
633 HA3 GLY 80 2HA GLY 80 24.034 9.422 -7.524
634 H PHE 81 H PHE 81 26.052 10.017 -4.959
635 HA PHE 81 HA PHE 81 26.154 12.834 -5.588
636 HB2 PHE 81 1HB PHE 81 26.689 11.165 -3.170
637 HB3 PHE 81 2HB PHE 81 27.396 12.775 -3.250
638 HD1 PHE 81 HD2 PHE 81 24.094 11.530 -4.431
639 HD2 PHE 81 HD1 PHE 81 26.210 14.077 -1.757
640 HE1 PHE 81 HE2 PHE 81 21.963 12.498 -3.672
641 HE2 PHE 81 HE1 PHE 81 24.083 15.048 -0.993
642 HZ PHE 81 HZ PHE 81 21.956 14.260 -1.951
643 H ASP 82 H ASP 82 27.762 13.718 -6.687
644 HA ASP 82 HA ASP 82 30.280 12.334 -7.010
645 HB2 ASP 82 1HB ASP 82 30.736 13.833 -8.744
646 HB3 ASP 82 2HB ASP 82 28.983 13.674 -8.809
647 H ASP 83 H ASP 83 29.029 15.087 -5.265
648 HA ASP 83 HA ASP 83 31.708 15.874 -4.406
649 HB2 ASP 83 1HB ASP 83 28.984 17.123 -4.164
650 HB3 ASP 83 2HB ASP 83 30.319 17.675 -3.156
651 H GLN 84 H GLN 84 32.566 15.020 -2.643
652 HA GLN 84 HA GLN 84 31.189 13.305 -0.895
653 HB2 GLN 84 1HB GLN 84 33.231 13.439 0.510
654 HB3 GLN 84 2HB GLN 84 33.577 13.105 -1.182
655 HG2 GLN 84 1HG GLN 84 33.739 15.805 -1.155
656 HG3 GLN 84 2HG GLN 84 34.289 15.418 0.475
657 HE21 GLN 84 2HE2 GLN 84 36.022 13.809 0.645
658 HE22 GLN 84 1HE2 GLN 84 37.234 13.768 -0.586
659 H LEU 85 H LEU 85 32.081 16.714 -0.624
660 HA LEU 85 HA LEU 85 31.190 17.032 2.053
661 HB2 LEU 85 1HB LEU 85 32.022 18.812 -0.161
662 HB3 LEU 85 2HB LEU 85 31.031 19.529 1.107
663 HG LEU 85 HG LEU 85 33.428 19.890 1.479
664 HD11 LEU 85 1HD1 LEU 85 33.167 19.760 3.698
665 HD12 LEU 85 2HD1 LEU 85 32.854 18.025 3.660
666 HD13 LEU 85 3HD1 LEU 85 31.552 19.162 3.312
667 HD21 LEU 85 3HD2 LEU 85 33.606 16.897 1.795
668 HD22 LEU 85 1HD2 LEU 85 34.912 18.066 1.987
669 HD23 LEU 85 2HD2 LEU 85 34.197 17.797 0.398
670 H TYR 86 H TYR 86 29.645 17.323 -1.082
671 HA TYR 86 HA TYR 86 27.318 18.673 -0.311
672 HB2 TYR 86 1HB TYR 86 27.824 18.416 -2.643
673 HB3 TYR 86 2HB TYR 86 27.802 16.661 -2.512
674 HD1 TYR 86 HD2 TYR 86 25.357 19.114 -1.153
675 HD2 TYR 86 HD1 TYR 86 26.098 16.021 -3.979
676 HE1 TYR 86 HE2 TYR 86 22.973 19.104 -1.758
677 HE2 TYR 86 HE1 TYR 86 23.717 16.003 -4.593
678 HH TYR 86 HH TYR 86 21.526 18.442 -3.528
679 H PHE 87 H PHE 87 28.106 15.226 -0.315
680 HA PHE 87 HA PHE 87 25.534 14.315 0.430
681 HB2 PHE 87 1HB PHE 87 27.009 12.721 -0.529
682 HB3 PHE 87 2HB PHE 87 28.280 13.088 0.633
683 HD1 PHE 87 HD1 PHE 87 24.719 11.963 0.676
684 HD2 PHE 87 HD2 PHE 87 28.645 11.526 2.263
685 HE1 PHE 87 HE1 PHE 87 23.931 10.126 2.110
686 HE2 PHE 87 HE2 PHE 87 27.863 9.687 3.698
687 HZ PHE 87 HZ PHE 87 25.504 8.984 3.623
688 H SER 88 H SER 88 28.450 15.051 2.310
689 HA SER 88 HA SER 88 27.391 14.313 4.821
690 HB2 SER 88 1HB SER 88 29.269 15.663 5.752
691 HB3 SER 88 2HB SER 88 29.789 14.527 4.507
692 HG SER 88 HG SER 88 30.372 16.996 4.525
693 H ARG 89 H ARG 89 27.409 17.346 3.028
694 HA ARG 89 HA ARG 89 26.443 19.010 5.080
695 HB2 ARG 89 1HB ARG 89 26.582 19.158 2.110
696 HB3 ARG 89 2HB ARG 89 25.497 20.273 2.929
697 HG2 ARG 89 1HG ARG 89 27.234 21.337 4.050
698 HG3 ARG 89 2HG ARG 89 28.350 19.996 3.786
699 HD2 ARG 89 1HD ARG 89 28.584 20.530 1.487
700 HD3 ARG 89 2HD ARG 89 27.231 21.660 1.543
701 HE ARG 89 HE ARG 89 29.950 22.191 2.257
702 HH11 ARG 89 2HH1 ARG 89 26.640 23.073 2.877
703 HH12 ARG 89 1HH1 ARG 89 27.031 24.672 3.418
704 HH21 ARG 89 2HH2 ARG 89 30.478 24.293 2.967
705 HH22 ARG 89 1HH2 ARG 89 29.214 25.365 3.468
706 H VAL 90 H VAL 90 24.716 17.326 2.460
707 HA VAL 90 HA VAL 90 22.133 18.130 3.337
708 HB VAL 90 HB VAL 90 22.933 15.838 1.538
709 HG11 VAL 90 1HG1 VAL 90 20.254 17.044 2.180
710 HG12 VAL 90 2HG1 VAL 90 20.548 16.092 0.723
711 HG13 VAL 90 3HG1 VAL 90 20.755 15.358 2.314
712 HG21 VAL 90 3HG2 VAL 90 22.318 17.350 -0.286
713 HG22 VAL 90 1HG2 VAL 90 21.987 18.627 0.885
714 HG23 VAL 90 2HG2 VAL 90 23.629 18.017 0.687
715 H PHE 91 H PHE 91 24.007 15.137 3.700
716 HA PHE 91 HA PHE 91 22.054 13.660 5.069
717 HB2 PHE 91 1HB PHE 91 24.118 12.697 4.068
718 HB3 PHE 91 2HB PHE 91 25.058 13.441 5.356
719 HD1 PHE 91 HD2 PHE 91 24.948 12.593 7.627
720 HD2 PHE 91 HD1 PHE 91 22.744 10.765 4.479
721 HE1 PHE 91 HE2 PHE 91 24.580 10.613 9.040
722 HE2 PHE 91 HE1 PHE 91 22.371 8.782 5.887
723 HZ PHE 91 HZ PHE 91 23.291 8.703 8.170
724 H LYS 92 H LYS 92 24.480 15.942 6.200
725 HA LYS 92 HA LYS 92 24.258 15.444 8.954
726 HB2 LYS 92 1HB LYS 92 26.093 16.748 8.064
727 HB3 LYS 92 2HB LYS 92 24.982 17.976 7.472
728 HG2 LYS 92 1HG LYS 92 24.905 17.387 10.369
729 HG3 LYS 92 2HG LYS 92 26.332 18.223 9.752
730 HD2 LYS 92 1HD LYS 92 23.998 19.397 8.601
731 HD3 LYS 92 2HD LYS 92 23.790 19.307 10.352
732 HE2 LYS 92 1HE LYS 92 25.535 20.725 10.767
733 HE3 LYS 92 2HE LYS 92 26.399 20.267 9.301
734 HZ1 LYS 92 3HZ LYS 92 24.270 21.439 8.247
735 HZ2 LYS 92 1HZ LYS 92 25.684 22.282 8.635
736 HZ3 LYS 92 2HZ LYS 92 24.367 22.308 9.695
737 H LYS 93 H LYS 93 22.208 17.147 6.746
738 HA LYS 93 HA LYS 93 20.780 18.622 8.759
739 HB2 LYS 93 1HB LYS 93 20.147 18.057 5.858
740 HB3 LYS 93 2HB LYS 93 19.200 19.120 6.890
741 HG2 LYS 93 1HG LYS 93 20.898 20.712 7.016
742 HG3 LYS 93 2HG LYS 93 22.131 19.572 6.471
743 HD2 LYS 93 1HD LYS 93 21.576 19.811 4.273
744 HD3 LYS 93 2HD LYS 93 19.876 20.129 4.625
745 HE2 LYS 93 1HE LYS 93 20.342 22.375 5.250
746 HE3 LYS 93 2HE LYS 93 22.080 22.082 5.249
747 HZ1 LYS 93 3HZ LYS 93 22.203 22.387 3.053
748 HZ2 LYS 93 1HZ LYS 93 20.695 23.140 3.198
749 HZ3 LYS 93 2HZ LYS 93 20.788 21.516 2.736
750 H CYS 94 H CYS 94 20.570 15.480 7.328
751 HA CYS 94 HA CYS 94 17.843 15.023 8.170
752 HB2 CYS 94 1HB CYS 94 19.315 13.949 6.183
753 HB3 CYS 94 2HB CYS 94 19.567 12.729 7.426
754 HG CYS 94 HG CYS 94 16.474 13.750 6.375
755 H THR 95 H THR 95 21.086 14.065 9.194
756 HA THR 95 HA THR 95 19.987 12.624 11.483
757 HB THR 95 HB THR 95 22.484 12.180 11.937
758 HG1 THR 95 HG1 THR 95 22.961 13.920 10.234
759 HG21 THR 95 3HG2 THR 95 20.824 10.578 10.930
760 HG22 THR 95 1HG2 THR 95 22.501 10.304 10.462
761 HG23 THR 95 2HG2 THR 95 21.392 11.096 9.344
762 H GLY 96 H GLY 96 21.201 15.701 10.695
763 HA2 GLY 96 1HA GLY 96 21.206 17.572 12.094
764 HA3 GLY 96 2HA GLY 96 21.042 16.506 13.482
765 H ALA 97 H ALA 97 23.419 15.042 11.962
766 HA ALA 97 HA ALA 97 25.561 16.847 12.827
767 HB1 ALA 97 1HB ALA 97 25.663 13.950 13.587
768 HB2 ALA 97 2HB ALA 97 26.592 15.303 14.233
769 HB3 ALA 97 3HB ALA 97 24.881 15.140 14.628
770 H SER 98 H SER 98 27.616 16.403 11.893
771 HA SER 98 HA SER 98 27.501 15.564 9.202
772 HB2 SER 98 1HB SER 98 29.348 16.835 9.217
773 HB3 SER 98 2HB SER 98 29.450 16.748 10.975
774 HG SER 98 HG SER 98 31.281 15.798 10.206
775 HA PRO 99 HA PRO 99 28.341 11.261 9.272
776 HB2 PRO 99 1HB PRO 99 30.142 10.956 7.263
777 HB3 PRO 99 2HB PRO 99 28.437 11.326 6.977
778 HG2 PRO 99 1HG PRO 99 30.797 13.168 6.997
779 HG3 PRO 99 2HG PRO 99 29.431 13.112 5.868
780 HD2 PRO 99 1HD PRO 99 29.582 14.913 7.885
781 HD3 PRO 99 2HD PRO 99 28.038 14.260 7.301
782 H SER 100 H SER 100 31.180 13.354 9.306
783 HA SER 100 HA SER 100 33.045 11.368 10.085
784 HB2 SER 100 1HB SER 100 33.443 13.763 9.126
785 HB3 SER 100 2HB SER 100 33.368 14.263 10.815
786 HG SER 100 HG SER 100 35.191 13.206 11.232
787 H GLU 101 H GLU 101 30.880 13.483 11.855
788 HA GLU 101 HA GLU 101 32.020 12.945 14.424
789 HB2 GLU 101 1HB GLU 101 30.666 14.990 13.806
790 HB3 GLU 101 2HB GLU 101 29.239 13.964 13.844
791 HG2 GLU 101 1HG GLU 101 29.084 14.581 15.976
792 HG3 GLU 101 2HG GLU 101 30.378 13.418 16.256
793 H PHE 102 H PHE 102 29.114 11.823 12.713
794 HA PHE 102 HA PHE 102 28.143 10.133 14.720
795 HB2 PHE 102 1HB PHE 102 26.984 10.884 12.564
796 HB3 PHE 102 2HB PHE 102 27.853 9.573 11.773
797 HD1 PHE 102 HD2 PHE 102 27.386 7.234 12.383
798 HD2 PHE 102 HD1 PHE 102 25.107 10.466 13.958
799 HE1 PHE 102 HE2 PHE 102 25.624 5.656 13.062
800 HE2 PHE 102 HE1 PHE 102 23.341 8.893 14.640
801 HZ PHE 102 HZ PHE 102 23.598 6.485 14.191
802 H ARG 103 H ARG 103 30.359 9.481 12.031
803 HA ARG 103 HA ARG 103 30.635 6.725 12.413
804 HB2 ARG 103 1HB ARG 103 31.477 8.214 10.482
805 HB3 ARG 103 2HB ARG 103 32.893 8.483 11.490
806 HG2 ARG 103 1HG ARG 103 33.301 6.063 11.539
807 HG3 ARG 103 2HG ARG 103 31.905 5.822 10.487
808 HD2 ARG 103 1HD ARG 103 32.960 7.090 8.727
809 HD3 ARG 103 2HD ARG 103 34.311 7.498 9.783
810 HE ARG 103 HE ARG 103 33.893 5.023 8.369
811 HH11 ARG 103 2HH1 ARG 103 35.494 6.580 11.040
812 HH12 ARG 103 1HH1 ARG 103 36.761 5.403 11.137
813 HH21 ARG 103 2HH2 ARG 103 35.556 3.466 8.487
814 HH22 ARG 103 1HH2 ARG 103 36.796 3.632 9.684
815 H ALA 104 H ALA 104 32.404 9.440 13.834
816 HA ALA 104 HA ALA 104 34.301 7.874 15.237
817 HB1 ALA 104 1HB ALA 104 33.523 10.689 15.116
818 HB2 ALA 104 2HB ALA 104 34.119 10.177 16.696
819 HB3 ALA 104 3HB ALA 104 35.121 9.957 15.262
820 H GLY 105 H GLY 105 31.025 8.843 15.920
821 HA2 GLY 105 1HA GLY 105 29.609 7.822 17.482
822 HA3 GLY 105 2HA GLY 105 31.015 7.102 18.252
823 H CYS 106 H CYS 106 32.017 10.112 17.963
824 HA CYS 106 HA CYS 106 31.571 10.756 20.691
825 HB2 CYS 106 1HB CYS 106 33.570 11.428 19.280
826 HB3 CYS 106 2HB CYS 106 32.538 12.650 18.549
827 HG CYS 106 HG CYS 106 34.208 12.758 21.382
828 H GLU 107 H GLU 107 30.169 12.148 21.647
829 HA GLU 107 HA GLU 107 27.964 13.110 19.980
830 HB2 GLU 107 1HB GLU 107 27.722 11.685 22.156
831 HB3 GLU 107 2HB GLU 107 27.978 13.219 22.975
832 HG2 GLU 107 1HG GLU 107 26.076 14.108 21.521
833 HG3 GLU 107 2HG GLU 107 25.727 12.416 21.169
Start of MODEL 15
1 H1 MET 1 H MET 1 1.779 -1.858 1.605
2 HA MET 1 HA MET 1 2.263 0.269 -0.358
3 HB2 MET 1 1HB MET 1 4.088 -0.834 1.182
4 HB3 MET 1 2HB MET 1 4.061 -2.100 -0.039
5 HG2 MET 1 1HG MET 1 5.792 -0.658 -0.670
6 HG3 MET 1 2HG MET 1 4.449 -0.277 -1.745
7 HE1 MET 1 3HE MET 1 6.661 1.301 -1.792
8 HE2 MET 1 1HE MET 1 5.611 2.671 -2.156
9 HE3 MET 1 2HE MET 1 6.785 2.785 -0.845
10 H ASP 2 H ASP 2 1.465 0.026 -2.329
11 HA ASP 2 HA ASP 2 0.369 -2.489 -3.194
12 HB2 ASP 2 1HB ASP 2 -0.356 -1.267 -5.176
13 HB3 ASP 2 2HB ASP 2 -0.734 -0.344 -3.724
14 H ASN 3 H ASN 3 1.047 -3.765 -4.908
15 HA ASN 3 HA ASN 3 3.834 -3.994 -5.279
16 HB2 ASN 3 1HB ASN 3 1.917 -5.763 -5.540
17 HB3 ASN 3 2HB ASN 3 1.880 -5.199 -7.208
18 HD21 ASN 3 2HD2 ASN 3 4.068 -6.421 -4.719
19 HD22 ASN 3 1HD2 ASN 3 5.123 -7.252 -5.806
20 H ARG 4 H ARG 4 1.317 -2.392 -7.101
21 HA ARG 4 HA ARG 4 2.584 -2.042 -9.549
22 HB2 ARG 4 1HB ARG 4 0.498 -0.547 -8.037
23 HB3 ARG 4 2HB ARG 4 1.226 0.243 -9.428
24 HG2 ARG 4 1HG ARG 4 0.573 -1.634 -10.845
25 HG3 ARG 4 2HG ARG 4 -0.151 -2.435 -9.448
26 HD2 ARG 4 1HD ARG 4 -1.806 -0.746 -9.233
27 HD3 ARG 4 2HD ARG 4 -0.979 0.303 -10.384
28 HE ARG 4 HE ARG 4 -1.553 -1.956 -11.805
29 HH11 ARG 4 2HH1 ARG 4 -3.413 0.320 -9.940
30 HH12 ARG 4 1HH1 ARG 4 -4.850 0.120 -10.886
31 HH21 ARG 4 2HH2 ARG 4 -3.439 -2.229 -13.058
32 HH22 ARG 4 1HH2 ARG 4 -4.864 -1.331 -12.659
33 H VAL 5 H VAL 5 2.675 0.070 -6.685
34 HA VAL 5 HA VAL 5 4.506 1.925 -7.823
35 HB VAL 5 HB VAL 5 3.732 1.406 -4.952
36 HG11 VAL 5 1HG1 VAL 5 5.530 2.588 -4.374
37 HG12 VAL 5 2HG1 VAL 5 5.883 3.009 -6.051
38 HG13 VAL 5 3HG1 VAL 5 4.742 3.979 -5.118
39 HG21 VAL 5 3HG2 VAL 5 2.133 2.386 -6.799
40 HG22 VAL 5 1HG2 VAL 5 2.166 3.065 -5.172
41 HG23 VAL 5 2HG2 VAL 5 3.036 3.867 -6.480
42 H ARG 6 H ARG 6 4.855 -0.919 -5.765
43 HA ARG 6 HA ARG 6 7.513 -0.654 -5.017
44 HB2 ARG 6 1HB ARG 6 5.779 -2.433 -4.333
45 HB3 ARG 6 2HB ARG 6 6.308 -3.307 -5.764
46 HG2 ARG 6 1HG ARG 6 7.617 -4.248 -4.133
47 HG3 ARG 6 2HG ARG 6 8.683 -2.985 -4.753
48 HD2 ARG 6 1HD ARG 6 7.941 -1.506 -2.923
49 HD3 ARG 6 2HD ARG 6 6.950 -2.819 -2.290
50 HE ARG 6 HE ARG 6 9.775 -2.493 -1.985
51 HH11 ARG 6 2HH1 ARG 6 7.204 -4.834 -2.170
52 HH12 ARG 6 1HH1 ARG 6 8.060 -6.038 -1.266
53 HH21 ARG 6 2HH2 ARG 6 10.911 -4.071 -0.793
54 HH22 ARG 6 1HH2 ARG 6 10.168 -5.603 -0.482
55 H GLU 7 H GLU 7 6.126 -1.791 -8.040
56 HA GLU 7 HA GLU 7 8.520 -2.823 -9.147
57 HB2 GLU 7 1HB GLU 7 5.793 -2.278 -10.058
58 HB3 GLU 7 2HB GLU 7 7.002 -2.043 -11.312
59 HG2 GLU 7 1HG GLU 7 6.506 -4.542 -9.716
60 HG3 GLU 7 2HG GLU 7 6.182 -4.286 -11.429
61 H ALA 8 H ALA 8 6.961 0.344 -9.280
62 HA ALA 8 HA ALA 8 8.600 1.548 -11.195
63 HB1 ALA 8 1HB ALA 8 6.707 2.768 -10.668
64 HB2 ALA 8 2HB ALA 8 6.959 2.605 -8.930
65 HB3 ALA 8 3HB ALA 8 7.983 3.690 -9.870
66 H CYS 9 H CYS 9 9.062 1.069 -7.740
67 HA CYS 9 HA CYS 9 11.253 2.768 -7.360
68 HB2 CYS 9 1HB CYS 9 10.103 1.843 -5.459
69 HB3 CYS 9 2HB CYS 9 10.483 0.201 -5.965
70 HG CYS 9 HG CYS 9 12.235 0.303 -4.014
71 H GLN 10 H GLN 10 11.039 -0.491 -8.631
72 HA GLN 10 HA GLN 10 13.760 -1.172 -8.513
73 HB2 GLN 10 1HB GLN 10 11.873 -2.745 -8.993
74 HB3 GLN 10 2HB GLN 10 11.767 -2.053 -10.606
75 HG2 GLN 10 1HG GLN 10 13.003 -4.134 -10.636
76 HG3 GLN 10 2HG GLN 10 14.043 -2.781 -11.078
77 HE21 GLN 10 2HE2 GLN 10 15.941 -3.763 -10.511
78 HE22 GLN 10 1HE2 GLN 10 16.372 -4.122 -8.877
79 H TYR 11 H TYR 11 11.865 0.459 -11.021
80 HA TYR 11 HA TYR 11 13.995 0.650 -12.890
81 HB2 TYR 11 1HB TYR 11 11.766 0.825 -13.724
82 HB3 TYR 11 2HB TYR 11 11.382 2.136 -12.614
83 HD1 TYR 11 HD2 TYR 11 14.071 1.480 -15.136
84 HD2 TYR 11 HD1 TYR 11 11.111 4.161 -13.669
85 HE1 TYR 11 HE2 TYR 11 14.708 3.117 -16.858
86 HE2 TYR 11 HE1 TYR 11 11.738 5.804 -15.388
87 HH TYR 11 HH TYR 11 14.061 6.219 -16.777
88 H ILE 12 H ILE 12 12.593 2.967 -10.585
89 HA ILE 12 HA ILE 12 14.296 5.115 -11.188
90 HB ILE 12 HB ILE 12 12.999 4.508 -8.529
91 HG12 ILE 12 1HG1 ILE 12 11.939 6.216 -10.786
92 HG13 ILE 12 2HG1 ILE 12 11.443 4.551 -10.508
93 HG21 ILE 12 1HG2 ILE 12 14.424 6.860 -9.648
94 HG22 ILE 12 2HG2 ILE 12 13.025 7.154 -8.617
95 HG23 ILE 12 3HG2 ILE 12 14.395 6.231 -8.001
96 HD11 ILE 12 3HD1 ILE 12 10.745 7.011 -9.044
97 HD12 ILE 12 1HD1 ILE 12 9.781 5.574 -9.384
98 HD13 ILE 12 2HD1 ILE 12 10.968 5.551 -8.080
99 H SER 13 H SER 13 14.602 2.463 -8.873
100 HA SER 13 HA SER 13 16.847 3.350 -7.482
101 HB2 SER 13 1HB SER 13 15.649 1.455 -6.650
102 HB3 SER 13 2HB SER 13 15.905 0.556 -8.145
103 HG SER 13 HG SER 13 17.749 1.173 -6.106
104 H ASP 14 H ASP 14 16.594 1.604 -10.537
105 HA ASP 14 HA ASP 14 19.365 1.111 -10.855
106 HB2 ASP 14 1HB ASP 14 16.961 1.007 -12.611
107 HB3 ASP 14 2HB ASP 14 18.540 1.060 -13.391
108 H HIS 15 H HIS 15 17.350 3.869 -11.447
109 HA HIS 15 HA HIS 15 19.573 5.228 -12.815
110 HB2 HIS 15 1HB HIS 15 16.605 5.779 -12.799
111 HB3 HIS 15 2HB HIS 15 17.785 6.914 -13.448
112 HD1 HIS 15 HD1 HIS 15 17.835 6.759 -15.904
113 HD2 HIS 15 HD2 HIS 15 17.226 3.043 -14.148
114 HE1 HIS 15 HE1 HIS 15 17.697 5.128 -17.813
115 H LEU 16 H LEU 16 18.975 4.762 -9.844
116 HA LEU 16 HA LEU 16 18.284 7.148 -8.591
117 HB2 LEU 16 1HB LEU 16 18.720 4.794 -7.621
118 HB3 LEU 16 2HB LEU 16 20.394 5.328 -7.491
119 HG LEU 16 HG LEU 16 19.459 7.291 -6.129
120 HD11 LEU 16 1HD1 LEU 16 17.103 5.416 -6.066
121 HD12 LEU 16 2HD1 LEU 16 17.130 7.075 -6.660
122 HD13 LEU 16 3HD1 LEU 16 17.350 6.751 -4.941
123 HD21 LEU 16 3HD2 LEU 16 19.894 6.146 -4.188
124 HD22 LEU 16 1HD2 LEU 16 20.627 5.067 -5.375
125 HD23 LEU 16 2HD2 LEU 16 19.032 4.700 -4.717
126 H ALA 17 H ALA 17 21.213 6.224 -10.193
127 HA ALA 17 HA ALA 17 22.711 8.460 -9.077
128 HB1 ALA 17 1HB ALA 17 24.294 7.355 -11.033
129 HB2 ALA 17 2HB ALA 17 24.329 6.941 -9.319
130 HB3 ALA 17 3HB ALA 17 23.372 5.974 -10.440
131 H ASP 18 H ASP 18 20.825 7.686 -11.840
132 HA ASP 18 HA ASP 18 21.966 9.398 -13.752
133 HB2 ASP 18 1HB ASP 18 20.067 7.583 -13.941
134 HB3 ASP 18 2HB ASP 18 19.007 8.961 -13.662
135 H SER 19 H SER 19 21.399 11.491 -14.423
136 HA SER 19 HA SER 19 20.515 13.204 -12.241
137 HB2 SER 19 1HB SER 19 21.862 13.728 -14.885
138 HB3 SER 19 2HB SER 19 21.204 15.039 -13.907
139 HG SER 19 HG SER 19 22.539 14.052 -12.161
140 H ASN 20 H ASN 20 19.734 12.691 -15.677
141 HA ASN 20 HA ASN 20 17.348 14.304 -15.477
142 HB2 ASN 20 1HB ASN 20 18.622 12.707 -17.689
143 HB3 ASN 20 2HB ASN 20 17.012 13.398 -17.869
144 HD21 ASN 20 2HD2 ASN 20 16.989 15.793 -17.035
145 HD22 ASN 20 1HD2 ASN 20 18.235 16.785 -17.706
146 H PHE 21 H PHE 21 15.701 13.475 -14.350
147 HA PHE 21 HA PHE 21 15.047 10.631 -14.687
148 HB2 PHE 21 1HB PHE 21 15.396 11.310 -12.374
149 HB3 PHE 21 2HB PHE 21 14.207 12.597 -12.547
150 HD1 PHE 21 HD1 PHE 21 14.077 9.045 -13.642
151 HD2 PHE 21 HD2 PHE 21 12.480 12.068 -11.107
152 HE1 PHE 21 HE1 PHE 21 12.304 7.498 -12.920
153 HE2 PHE 21 HE2 PHE 21 10.705 10.526 -10.381
154 HZ PHE 21 HZ PHE 21 10.616 8.238 -11.286
155 H ASP 22 H ASP 22 13.178 9.995 -15.595
156 HA ASP 22 HA ASP 22 11.274 12.102 -16.387
157 HB2 ASP 22 1HB ASP 22 12.712 10.456 -18.057
158 HB3 ASP 22 2HB ASP 22 11.174 9.609 -17.926
159 H ILE 23 H ILE 23 9.393 11.990 -15.374
160 HA ILE 23 HA ILE 23 8.627 9.770 -13.779
161 HB ILE 23 HB ILE 23 7.966 12.137 -13.321
162 HG12 ILE 23 1HG1 ILE 23 5.571 11.545 -12.703
163 HG13 ILE 23 2HG1 ILE 23 5.834 10.008 -13.520
164 HG21 ILE 23 1HG2 ILE 23 5.937 11.694 -15.504
165 HG22 ILE 23 2HG2 ILE 23 6.130 13.135 -14.508
166 HG23 ILE 23 3HG2 ILE 23 7.381 12.691 -15.668
167 HD11 ILE 23 3HD1 ILE 23 6.344 10.587 -10.867
168 HD12 ILE 23 1HD1 ILE 23 6.887 9.168 -11.762
169 HD13 ILE 23 2HD1 ILE 23 7.936 10.580 -11.624
170 H ALA 24 H ALA 24 7.916 10.767 -17.044
171 HA ALA 24 HA ALA 24 5.604 9.256 -17.513
172 HB1 ALA 24 1HB ALA 24 5.925 10.664 -19.253
173 HB2 ALA 24 2HB ALA 24 7.682 10.524 -19.186
174 HB3 ALA 24 3HB ALA 24 6.724 9.253 -19.946
175 H SER 25 H SER 25 9.030 8.412 -17.831
176 HA SER 25 HA SER 25 8.658 5.861 -18.957
177 HB2 SER 25 1HB SER 25 10.913 7.004 -17.300
178 HB3 SER 25 2HB SER 25 10.978 5.413 -18.056
179 HG SER 25 HG SER 25 11.236 6.315 -19.954
180 H VAL 26 H VAL 26 8.488 7.023 -15.677
181 HA VAL 26 HA VAL 26 8.675 4.492 -14.391
182 HB VAL 26 HB VAL 26 7.363 7.015 -13.370
183 HG11 VAL 26 1HG1 VAL 26 7.678 6.088 -11.171
184 HG12 VAL 26 2HG1 VAL 26 6.780 4.932 -12.156
185 HG13 VAL 26 3HG1 VAL 26 8.497 4.677 -11.840
186 HG21 VAL 26 3HG2 VAL 26 9.399 7.901 -13.273
187 HG22 VAL 26 1HG2 VAL 26 9.877 6.608 -12.174
188 HG23 VAL 26 2HG2 VAL 26 10.112 6.420 -13.912
189 H ALA 27 H ALA 27 5.993 6.450 -15.582
190 HA ALA 27 HA ALA 27 3.917 4.868 -14.483
191 HB1 ALA 27 1HB ALA 27 4.099 7.244 -15.947
192 HB2 ALA 27 2HB ALA 27 3.118 6.153 -16.926
193 HB3 ALA 27 3HB ALA 27 2.646 6.511 -15.265
194 H GLN 28 H GLN 28 5.376 4.958 -17.728
195 HA GLN 28 HA GLN 28 3.807 2.924 -18.854
196 HB2 GLN 28 1HB GLN 28 5.564 2.767 -20.565
197 HB3 GLN 28 2HB GLN 28 5.139 4.438 -20.221
198 HG2 GLN 28 1HG GLN 28 7.124 4.615 -18.774
199 HG3 GLN 28 2HG GLN 28 7.563 2.965 -19.214
200 HE21 GLN 28 2HE2 GLN 28 6.469 5.857 -20.964
201 HE22 GLN 28 1HE2 GLN 28 7.725 5.822 -22.149
202 H HIS 29 H HIS 29 6.794 2.819 -16.999
203 HA HIS 29 HA HIS 29 7.521 0.164 -17.447
204 HB2 HIS 29 1HB HIS 29 9.072 1.590 -16.337
205 HB3 HIS 29 2HB HIS 29 7.918 1.969 -15.061
206 HD1 HIS 29 HD1 HIS 29 8.728 -1.523 -16.251
207 HD2 HIS 29 HD2 HIS 29 9.324 0.926 -12.948
208 HE1 HIS 29 HE1 HIS 29 9.711 -3.012 -14.479
209 H VAL 30 H VAL 30 5.143 1.552 -15.270
210 HA VAL 30 HA VAL 30 4.547 -1.089 -14.156
211 HB VAL 30 HB VAL 30 3.113 0.076 -12.562
212 HG11 VAL 30 1HG1 VAL 30 5.948 0.932 -12.911
213 HG12 VAL 30 2HG1 VAL 30 4.983 1.651 -11.620
214 HG13 VAL 30 3HG1 VAL 30 5.225 -0.096 -11.673
215 HG21 VAL 30 3HG2 VAL 30 2.392 1.882 -14.102
216 HG22 VAL 30 1HG2 VAL 30 2.907 2.476 -12.524
217 HG23 VAL 30 2HG2 VAL 30 3.979 2.629 -13.916
218 H CYS 31 H CYS 31 3.836 0.092 -16.925
219 HA CYS 31 HA CYS 31 2.094 0.060 -18.392
220 HB2 CYS 31 1HB CYS 31 2.278 -2.371 -17.479
221 HB3 CYS 31 2HB CYS 31 0.777 -1.994 -16.642
222 HG CYS 31 HG CYS 31 0.874 -3.353 -19.411
223 H LEU 32 H LEU 32 1.892 2.012 -16.341
224 HA LEU 32 HA LEU 32 -1.011 2.378 -16.337
225 HB2 LEU 32 1HB LEU 32 -0.258 1.434 -14.136
226 HB3 LEU 32 2HB LEU 32 0.685 2.905 -13.905
227 HG LEU 32 HG LEU 32 -1.338 4.234 -13.849
228 HD11 LEU 32 1HD1 LEU 32 -3.121 3.516 -14.960
229 HD12 LEU 32 2HD1 LEU 32 -3.410 2.391 -13.634
230 HD13 LEU 32 3HD1 LEU 32 -2.486 1.872 -15.044
231 HD21 LEU 32 3HD2 LEU 32 -2.108 3.591 -11.737
232 HD22 LEU 32 1HD2 LEU 32 -0.465 2.955 -11.812
233 HD23 LEU 32 2HD2 LEU 32 -1.839 1.877 -12.060
234 H SER 33 H SER 33 -1.628 4.642 -15.827
235 HA SER 33 HA SER 33 -0.001 6.448 -17.338
236 HB2 SER 33 1HB SER 33 -2.662 6.558 -16.006
237 HB3 SER 33 2HB SER 33 -1.850 8.091 -16.322
238 HG SER 33 HG SER 33 -1.611 7.271 -18.538
239 HA PRO 34 HA PRO 34 2.346 8.444 -14.216
240 HB2 PRO 34 1HB PRO 34 2.264 11.043 -14.996
241 HB3 PRO 34 2HB PRO 34 3.191 9.810 -15.859
242 HG2 PRO 34 1HG PRO 34 0.491 10.939 -16.491
243 HG3 PRO 34 2HG PRO 34 1.840 10.586 -17.586
244 HD2 PRO 34 1HD PRO 34 -0.289 8.934 -17.317
245 HD3 PRO 34 2HD PRO 34 1.344 8.336 -17.674
246 H SER 35 H SER 35 -0.737 10.050 -14.941
247 HA SER 35 HA SER 35 -0.879 11.530 -12.535
248 HB2 SER 35 1HB SER 35 -3.279 10.606 -14.108
249 HB3 SER 35 2HB SER 35 -3.086 12.090 -13.175
250 HG SER 35 HG SER 35 -1.558 12.775 -14.733
251 H ARG 36 H ARG 36 -2.295 8.422 -13.510
252 HA ARG 36 HA ARG 36 -3.644 7.943 -11.072
253 HB2 ARG 36 1HB ARG 36 -2.906 6.332 -13.460
254 HB3 ARG 36 2HB ARG 36 -3.316 5.454 -11.993
255 HG2 ARG 36 1HG ARG 36 -5.278 7.459 -12.363
256 HG3 ARG 36 2HG ARG 36 -5.049 6.632 -13.905
257 HD2 ARG 36 1HD ARG 36 -5.266 4.988 -11.436
258 HD3 ARG 36 2HD ARG 36 -6.732 5.727 -12.079
259 HE ARG 36 HE ARG 36 -5.377 4.438 -14.168
260 HH11 ARG 36 2HH1 ARG 36 -7.132 3.686 -11.257
261 HH12 ARG 36 1HH1 ARG 36 -7.679 2.145 -11.829
262 HH21 ARG 36 2HH2 ARG 36 -6.091 2.411 -14.933
263 HH22 ARG 36 1HH2 ARG 36 -7.086 1.420 -13.920
264 H LEU 37 H LEU 37 -0.475 6.924 -12.293
265 HA LEU 37 HA LEU 37 0.210 5.335 -10.055
266 HB2 LEU 37 1HB LEU 37 1.385 4.985 -12.082
267 HB3 LEU 37 2HB LEU 37 1.847 6.683 -12.186
268 HG LEU 37 HG LEU 37 3.380 6.404 -10.321
269 HD11 LEU 37 1HD1 LEU 37 2.217 4.743 -9.028
270 HD12 LEU 37 2HD1 LEU 37 3.823 4.137 -9.430
271 HD13 LEU 37 3HD1 LEU 37 2.414 3.549 -10.311
272 HD21 LEU 37 3HD2 LEU 37 3.655 4.408 -12.557
273 HD22 LEU 37 1HD2 LEU 37 4.940 4.748 -11.398
274 HD23 LEU 37 2HD2 LEU 37 4.344 6.028 -12.455
275 H SER 38 H SER 38 0.889 8.710 -10.898
276 HA SER 38 HA SER 38 2.557 9.319 -8.736
277 HB2 SER 38 1HB SER 38 0.728 11.012 -10.432
278 HB3 SER 38 2HB SER 38 1.704 11.709 -9.139
279 HG SER 38 HG SER 38 3.517 10.591 -10.258
280 H HIS 39 H HIS 39 -0.955 9.347 -9.033
281 HA HIS 39 HA HIS 39 -1.573 10.628 -6.623
282 HB2 HIS 39 1HB HIS 39 -3.205 10.144 -8.438
283 HB3 HIS 39 2HB HIS 39 -3.159 8.442 -7.987
284 HD1 HIS 39 HD1 HIS 39 -4.924 11.525 -7.300
285 HD2 HIS 39 HD2 HIS 39 -4.119 8.015 -5.228
286 HE1 HIS 39 HE1 HIS 39 -6.582 11.464 -5.411
287 H LEU 40 H LEU 40 -1.216 7.161 -7.334
288 HA LEU 40 HA LEU 40 -1.650 6.345 -4.639
289 HB2 LEU 40 1HB LEU 40 -0.544 4.975 -7.071
290 HB3 LEU 40 2HB LEU 40 -0.606 4.176 -5.501
291 HG LEU 40 HG LEU 40 -2.973 5.183 -7.080
292 HD11 LEU 40 1HD1 LEU 40 -1.831 3.145 -7.959
293 HD12 LEU 40 2HD1 LEU 40 -3.501 2.887 -7.455
294 HD13 LEU 40 3HD1 LEU 40 -2.176 2.355 -6.420
295 HD21 LEU 40 3HD2 LEU 40 -4.260 3.929 -5.325
296 HD22 LEU 40 1HD2 LEU 40 -3.484 5.413 -4.769
297 HD23 LEU 40 2HD2 LEU 40 -2.767 3.847 -4.389
298 H PHE 41 H PHE 41 1.158 7.221 -6.526
299 HA PHE 41 HA PHE 41 3.146 6.157 -4.841
300 HB2 PHE 41 1HB PHE 41 3.120 7.508 -7.243
301 HB3 PHE 41 2HB PHE 41 3.867 8.673 -6.155
302 HD1 PHE 41 HD2 PHE 41 5.961 8.111 -4.988
303 HD2 PHE 41 HD1 PHE 41 4.252 5.527 -7.908
304 HE1 PHE 41 HE2 PHE 41 8.106 6.922 -5.187
305 HE2 PHE 41 HE1 PHE 41 6.394 4.334 -8.111
306 HZ PHE 41 HZ PHE 41 8.325 5.032 -6.750
307 H ARG 42 H ARG 42 1.745 9.424 -5.001
308 HA ARG 42 HA ARG 42 3.216 10.441 -2.805
309 HB2 ARG 42 1HB ARG 42 1.278 11.413 -4.667
310 HB3 ARG 42 2HB ARG 42 0.757 11.846 -3.044
311 HG2 ARG 42 1HG ARG 42 3.233 12.642 -2.781
312 HG3 ARG 42 2HG ARG 42 3.186 12.689 -4.544
313 HD2 ARG 42 1HD ARG 42 0.808 13.895 -3.634
314 HD3 ARG 42 2HD ARG 42 2.117 14.554 -2.654
315 HE ARG 42 HE ARG 42 2.834 14.569 -5.389
316 HH11 ARG 42 2HH1 ARG 42 0.795 16.198 -3.085
317 HH12 ARG 42 1HH1 ARG 42 0.802 17.702 -3.945
318 HH21 ARG 42 2HH2 ARG 42 2.850 16.544 -6.531
319 HH22 ARG 42 1HH2 ARG 42 1.971 17.897 -5.906
320 H GLN 43 H GLN 43 0.283 8.605 -3.068
321 HA GLN 43 HA GLN 43 -0.635 9.190 -0.405
322 HB2 GLN 43 1HB GLN 43 -2.292 8.653 -2.054
323 HB3 GLN 43 2HB GLN 43 -1.483 7.143 -2.455
324 HG2 GLN 43 1HG GLN 43 -2.240 6.075 -0.573
325 HG3 GLN 43 2HG GLN 43 -2.444 7.576 0.329
326 HE21 GLN 43 2HE2 GLN 43 -4.341 5.462 0.079
327 HE22 GLN 43 1HE2 GLN 43 -5.739 6.114 -0.700
328 H GLN 44 H GLN 44 1.104 6.568 -2.000
329 HA GLN 44 HA GLN 44 1.196 4.952 0.384
330 HB2 GLN 44 1HB GLN 44 2.216 4.712 -2.406
331 HB3 GLN 44 2HB GLN 44 2.995 3.749 -1.158
332 HG2 GLN 44 1HG GLN 44 0.083 3.709 -1.911
333 HG3 GLN 44 2HG GLN 44 1.280 2.454 -2.230
334 HE21 GLN 44 2HE2 GLN 44 -1.245 2.339 -0.753
335 HE22 GLN 44 1HE2 GLN 44 -0.842 1.770 0.828
336 H LEU 45 H LEU 45 3.405 7.058 -1.392
337 HA LEU 45 HA LEU 45 5.538 6.579 0.524
338 HB2 LEU 45 1HB LEU 45 5.315 8.161 -2.013
339 HB3 LEU 45 2HB LEU 45 6.694 8.354 -0.934
340 HG LEU 45 HG LEU 45 7.284 6.866 -2.728
341 HD11 LEU 45 1HD1 LEU 45 6.840 5.045 -0.396
342 HD12 LEU 45 2HD1 LEU 45 7.948 6.411 -0.277
343 HD13 LEU 45 3HD1 LEU 45 8.226 5.153 -1.481
344 HD21 LEU 45 3HD2 LEU 45 4.987 5.121 -1.852
345 HD22 LEU 45 1HD2 LEU 45 6.117 4.804 -3.169
346 HD23 LEU 45 2HD2 LEU 45 4.984 6.151 -3.285
347 H GLY 46 H GLY 46 2.939 8.734 0.082
348 HA2 GLY 46 1HA GLY 46 2.220 10.502 1.368
349 HA3 GLY 46 2HA GLY 46 3.531 10.142 2.482
350 H ILE 47 H ILE 47 4.785 10.522 -0.579
351 HA ILE 47 HA ILE 47 5.005 13.419 -0.467
352 HB ILE 47 HB ILE 47 7.416 13.473 -0.449
353 HG12 ILE 47 1HG1 ILE 47 7.278 10.464 -0.161
354 HG13 ILE 47 2HG1 ILE 47 7.835 11.338 -1.584
355 HG21 ILE 47 1HG2 ILE 47 6.268 13.533 1.707
356 HG22 ILE 47 2HG2 ILE 47 6.381 11.778 1.819
357 HG23 ILE 47 3HG2 ILE 47 7.846 12.759 1.843
358 HD11 ILE 47 3HD1 ILE 47 9.132 11.389 1.131
359 HD12 ILE 47 1HD1 ILE 47 9.691 10.476 -0.270
360 HD13 ILE 47 2HD1 ILE 47 9.699 12.239 -0.306
361 H SER 48 H SER 48 6.591 14.131 -2.317
362 HA SER 48 HA SER 48 5.521 13.012 -4.734
363 HB2 SER 48 1HB SER 48 6.827 14.772 -5.862
364 HB3 SER 48 2HB SER 48 5.885 15.430 -4.524
365 HG SER 48 HG SER 48 8.469 15.651 -4.906
366 H VAL 49 H VAL 49 6.666 12.030 -6.423
367 HA VAL 49 HA VAL 49 8.506 10.075 -5.738
368 HB VAL 49 HB VAL 49 8.242 11.320 -8.477
369 HG11 VAL 49 1HG1 VAL 49 8.988 9.193 -9.311
370 HG12 VAL 49 2HG1 VAL 49 10.154 9.773 -8.120
371 HG13 VAL 49 3HG1 VAL 49 9.000 8.511 -7.685
372 HG21 VAL 49 3HG2 VAL 49 6.735 8.945 -8.287
373 HG22 VAL 49 1HG2 VAL 49 6.295 9.944 -6.901
374 HG23 VAL 49 2HG2 VAL 49 6.145 10.588 -8.536
375 H LEU 50 H LEU 50 9.057 13.340 -6.956
376 HA LEU 50 HA LEU 50 11.811 13.130 -7.436
377 HB2 LEU 50 1HB LEU 50 9.959 15.060 -7.792
378 HB3 LEU 50 2HB LEU 50 10.817 15.702 -6.393
379 HG LEU 50 HG LEU 50 12.914 15.646 -7.663
380 HD11 LEU 50 1HD1 LEU 50 13.126 14.386 -9.471
381 HD12 LEU 50 2HD1 LEU 50 11.926 15.373 -10.303
382 HD13 LEU 50 3HD1 LEU 50 11.418 13.956 -9.385
383 HD21 LEU 50 3HD2 LEU 50 12.510 17.571 -8.915
384 HD22 LEU 50 1HD2 LEU 50 11.235 17.588 -7.697
385 HD23 LEU 50 2HD2 LEU 50 10.875 17.065 -9.343
386 H SER 51 H SER 51 10.009 13.974 -4.515
387 HA SER 51 HA SER 51 12.328 14.572 -2.962
388 HB2 SER 51 1HB SER 51 10.030 15.446 -2.471
389 HB3 SER 51 2HB SER 51 9.572 13.820 -1.963
390 HG SER 51 HG SER 51 11.805 15.129 -0.841
391 H TRP 52 H TRP 52 10.246 11.737 -3.325
392 HA TRP 52 HA TRP 52 11.367 10.154 -1.310
393 HB2 TRP 52 1HB TRP 52 9.309 9.457 -2.295
394 HB3 TRP 52 2HB TRP 52 10.015 9.426 -3.909
395 HD1 TRP 52 HD1 TRP 52 9.865 7.396 -0.667
396 HE1 TRP 52 HE1 TRP 52 10.687 5.006 -1.155
397 HE3 TRP 52 HE3 TRP 52 11.507 8.067 -5.461
398 HZ2 TRP 52 HZ2 TRP 52 11.875 3.593 -3.290
399 HZ3 TRP 52 HZ3 TRP 52 12.474 6.145 -6.657
400 HH2 TRP 52 HH2 TRP 52 12.653 3.956 -5.591
401 H ARG 53 H ARG 53 12.299 10.597 -4.690
402 HA ARG 53 HA ARG 53 14.223 8.584 -4.868
403 HB2 ARG 53 1HB ARG 53 13.245 10.204 -6.675
404 HB3 ARG 53 2HB ARG 53 14.613 11.219 -6.239
405 HG2 ARG 53 1HG ARG 53 16.011 9.073 -6.642
406 HG3 ARG 53 2HG ARG 53 14.592 8.535 -7.543
407 HD2 ARG 53 1HD ARG 53 16.231 9.609 -9.006
408 HD3 ARG 53 2HD ARG 53 14.719 10.515 -8.953
409 HE ARG 53 HE ARG 53 16.520 11.528 -7.031
410 HH11 ARG 53 2HH1 ARG 53 15.981 11.428 -10.469
411 HH12 ARG 53 1HH1 ARG 53 16.788 12.931 -10.771
412 HH21 ARG 53 2HH2 ARG 53 17.585 13.508 -7.415
413 HH22 ARG 53 1HH2 ARG 53 17.701 14.113 -9.033
414 H GLU 54 H GLU 54 14.567 11.979 -3.879
415 HA GLU 54 HA GLU 54 17.355 11.873 -3.434
416 HB2 GLU 54 1HB GLU 54 15.880 13.942 -3.688
417 HB3 GLU 54 2HB GLU 54 15.442 13.709 -2.002
418 HG2 GLU 54 1HG GLU 54 17.539 14.258 -1.237
419 HG3 GLU 54 2HG GLU 54 18.320 13.840 -2.760
420 H ASP 55 H ASP 55 14.576 11.454 -1.276
421 HA ASP 55 HA ASP 55 16.040 11.163 1.111
422 HB2 ASP 55 1HB ASP 55 13.321 11.073 0.326
423 HB3 ASP 55 2HB ASP 55 13.653 9.574 1.191
424 H GLN 56 H GLN 56 15.041 8.852 -1.350
425 HA GLN 56 HA GLN 56 15.660 6.487 0.011
426 HB2 GLN 56 1HB GLN 56 14.600 7.049 -2.410
427 HB3 GLN 56 2HB GLN 56 16.216 6.552 -2.894
428 HG2 GLN 56 1HG GLN 56 15.499 4.602 -1.107
429 HG3 GLN 56 2HG GLN 56 13.979 4.965 -1.923
430 HE21 GLN 56 2HE2 GLN 56 14.740 5.533 -4.441
431 HE22 GLN 56 1HE2 GLN 56 15.485 4.159 -5.177
432 H ARG 57 H ARG 57 17.675 8.621 -1.959
433 HA ARG 57 HA ARG 57 19.970 7.040 -2.087
434 HB2 ARG 57 1HB ARG 57 19.802 10.056 -1.938
435 HB3 ARG 57 2HB ARG 57 21.184 9.131 -2.508
436 HG2 ARG 57 1HG ARG 57 20.181 8.585 -4.490
437 HG3 ARG 57 2HG ARG 57 18.551 8.720 -3.828
438 HD2 ARG 57 1HD ARG 57 18.570 10.640 -5.034
439 HD3 ARG 57 2HD ARG 57 19.316 11.261 -3.561
440 HE ARG 57 HE ARG 57 21.432 10.422 -5.025
441 HH11 ARG 57 2HH1 ARG 57 18.730 12.513 -5.695
442 HH12 ARG 57 1HH1 ARG 57 19.603 13.494 -6.826
443 HH21 ARG 57 2HH2 ARG 57 22.591 11.706 -6.512
444 HH22 ARG 57 1HH2 ARG 57 21.798 13.034 -7.290
445 H ILE 58 H ILE 58 19.013 9.462 0.328
446 HA ILE 58 HA ILE 58 21.323 9.293 1.917
447 HB ILE 58 HB ILE 58 18.519 9.964 2.817
448 HG12 ILE 58 1HG1 ILE 58 19.253 11.373 0.944
449 HG13 ILE 58 2HG1 ILE 58 19.167 12.301 2.437
450 HG21 ILE 58 1HG2 ILE 58 20.414 11.422 4.267
451 HG22 ILE 58 2HG2 ILE 58 19.408 10.096 4.848
452 HG23 ILE 58 3HG2 ILE 58 21.022 9.768 4.218
453 HD11 ILE 58 3HD1 ILE 58 21.228 12.988 2.043
454 HD12 ILE 58 1HD1 ILE 58 21.782 11.335 2.305
455 HD13 ILE 58 2HD1 ILE 58 21.386 11.884 0.676
456 H SER 59 H SER 59 18.222 7.578 2.125
457 HA SER 59 HA SER 59 18.777 6.135 4.468
458 HB2 SER 59 1HB SER 59 16.514 6.337 3.517
459 HB3 SER 59 2HB SER 59 17.002 5.344 2.144
460 HG SER 59 HG SER 59 17.355 3.629 3.590
461 H GLN 60 H GLN 60 19.489 5.478 1.085
462 HA GLN 60 HA GLN 60 20.404 2.813 1.497
463 HB2 GLN 60 1HB GLN 60 19.655 4.033 -0.696
464 HB3 GLN 60 2HB GLN 60 21.345 4.511 -0.784
465 HG2 GLN 60 1HG GLN 60 21.423 2.603 -2.008
466 HG3 GLN 60 2HG GLN 60 21.741 1.937 -0.407
467 HE21 GLN 60 2HE2 GLN 60 20.490 0.344 0.280
468 HE22 GLN 60 1HE2 GLN 60 18.986 -0.133 -0.425
469 H ALA 61 H ALA 61 21.963 5.971 1.401
470 HA ALA 61 HA ALA 61 24.629 5.175 1.333
471 HB1 ALA 61 1HB ALA 61 23.320 7.568 1.488
472 HB2 ALA 61 2HB ALA 61 24.121 7.479 3.058
473 HB3 ALA 61 3HB ALA 61 25.069 7.356 1.576
474 H LYS 62 H LYS 62 22.379 5.375 4.030
475 HA LYS 62 HA LYS 62 24.312 4.957 6.074
476 HB2 LYS 62 1HB LYS 62 21.321 4.515 6.060
477 HB3 LYS 62 2HB LYS 62 22.333 4.438 7.497
478 HG2 LYS 62 1HG LYS 62 22.640 6.700 7.576
479 HG3 LYS 62 2HG LYS 62 22.428 6.900 5.835
480 HD2 LYS 62 1HD LYS 62 20.441 7.767 6.542
481 HD3 LYS 62 2HD LYS 62 19.975 6.068 6.424
482 HE2 LYS 62 1HE LYS 62 21.003 7.330 8.957
483 HE3 LYS 62 2HE LYS 62 19.291 7.250 8.544
484 HZ1 LYS 62 3HZ LYS 62 19.556 5.368 9.798
485 HZ2 LYS 62 1HZ LYS 62 21.132 5.074 9.256
486 HZ3 LYS 62 2HZ LYS 62 19.814 4.738 8.250
487 H LEU 63 H LEU 63 22.171 2.816 4.251
488 HA LEU 63 HA LEU 63 22.632 0.455 5.668
489 HB2 LEU 63 1HB LEU 63 21.085 1.125 3.577
490 HB3 LEU 63 2HB LEU 63 22.361 0.251 2.733
491 HG LEU 63 HG LEU 63 20.526 -1.239 3.182
492 HD11 LEU 63 1HD1 LEU 63 21.733 -3.013 4.020
493 HD12 LEU 63 2HD1 LEU 63 22.549 -2.027 5.232
494 HD13 LEU 63 3HD1 LEU 63 23.016 -1.905 3.535
495 HD21 LEU 63 3HD2 LEU 63 20.907 -0.778 6.127
496 HD22 LEU 63 1HD2 LEU 63 19.605 -1.640 5.307
497 HD23 LEU 63 2HD2 LEU 63 19.719 0.115 5.176
498 H LEU 64 H LEU 64 24.318 1.753 2.818
499 HA LEU 64 HA LEU 64 26.198 -0.365 2.654
500 HB2 LEU 64 1HB LEU 64 26.585 2.441 1.641
501 HB3 LEU 64 2HB LEU 64 27.330 0.962 1.037
502 HG LEU 64 HG LEU 64 24.442 0.845 0.859
503 HD11 LEU 64 1HD1 LEU 64 25.125 3.386 0.605
504 HD12 LEU 64 2HD1 LEU 64 23.916 2.640 -0.440
505 HD13 LEU 64 3HD1 LEU 64 25.568 2.852 -1.017
506 HD21 LEU 64 3HD2 LEU 64 26.288 0.904 -1.478
507 HD22 LEU 64 1HD2 LEU 64 24.891 -0.127 -1.166
508 HD23 LEU 64 2HD2 LEU 64 26.413 -0.427 -0.327
509 H LEU 65 H LEU 65 26.231 2.803 4.209
510 HA LEU 65 HA LEU 65 28.955 2.741 4.989
511 HB2 LEU 65 1HB LEU 65 26.568 4.359 5.649
512 HB3 LEU 65 2HB LEU 65 27.881 4.369 6.824
513 HG LEU 65 HG LEU 65 28.179 5.121 3.917
514 HD11 LEU 65 1HD1 LEU 65 26.848 6.817 4.801
515 HD12 LEU 65 2HD1 LEU 65 28.490 7.435 4.978
516 HD13 LEU 65 3HD1 LEU 65 27.648 6.758 6.372
517 HD21 LEU 65 3HD2 LEU 65 30.251 4.339 4.815
518 HD22 LEU 65 1HD2 LEU 65 30.032 5.284 6.288
519 HD23 LEU 65 2HD2 LEU 65 30.319 6.100 4.751
520 H SER 66 H SER 66 26.076 1.323 6.278
521 HA SER 66 HA SER 66 27.308 0.761 8.856
522 HB2 SER 66 1HB SER 66 25.088 1.165 9.273
523 HB3 SER 66 2HB SER 66 24.569 0.534 7.711
524 HG SER 66 HG SER 66 24.327 -0.700 9.926
525 H THR 67 H THR 67 26.672 -0.786 5.820
526 HA THR 67 HA THR 67 27.322 -3.427 6.886
527 HB THR 67 HB THR 67 25.450 -3.009 5.180
528 HG1 THR 67 HG1 THR 67 25.823 -5.106 5.301
529 HG21 THR 67 3HG2 THR 67 25.914 -2.473 3.027
530 HG22 THR 67 1HG2 THR 67 27.458 -3.323 3.035
531 HG23 THR 67 2HG2 THR 67 27.332 -1.717 3.753
532 H THR 68 H THR 68 28.879 -0.781 5.490
533 HA THR 68 HA THR 68 31.241 -2.437 4.922
534 HB THR 68 HB THR 68 31.755 -1.346 2.925
535 HG1 THR 68 HG1 THR 68 31.343 0.712 2.680
536 HG21 THR 68 3HG2 THR 68 29.389 -2.657 3.102
537 HG22 THR 68 1HG2 THR 68 30.081 -2.069 1.591
538 HG23 THR 68 2HG2 THR 68 28.860 -1.114 2.433
539 H ARG 69 H ARG 69 33.234 -0.926 4.667
540 HA ARG 69 HA ARG 69 33.102 1.129 6.775
541 HB2 ARG 69 1HB ARG 69 35.386 0.547 7.397
542 HB3 ARG 69 2HB ARG 69 34.342 -0.865 7.503
543 HG2 ARG 69 1HG ARG 69 35.833 -0.419 4.975
544 HG3 ARG 69 2HG ARG 69 36.727 -0.979 6.390
545 HD2 ARG 69 1HD ARG 69 34.187 -2.368 5.788
546 HD3 ARG 69 2HD ARG 69 35.516 -2.632 4.661
547 HE ARG 69 HE ARG 69 36.572 -2.990 7.183
548 HH11 ARG 69 2HH1 ARG 69 34.061 -4.430 5.249
549 HH12 ARG 69 1HH1 ARG 69 34.222 -5.996 5.972
550 HH21 ARG 69 2HH2 ARG 69 36.795 -5.048 8.142
551 HH22 ARG 69 1HH2 ARG 69 35.777 -6.346 7.618
552 H MET 70 H MET 70 32.959 1.157 3.715
553 HA MET 70 HA MET 70 35.283 2.355 2.694
554 HB2 MET 70 1HB MET 70 32.393 2.507 1.848
555 HB3 MET 70 2HB MET 70 33.681 3.302 0.952
556 HG2 MET 70 1HG MET 70 34.763 1.158 0.575
557 HG3 MET 70 2HG MET 70 33.503 0.349 1.505
558 HE1 MET 70 3HE MET 70 31.170 -0.026 0.827
559 HE2 MET 70 1HE MET 70 30.732 1.651 0.502
560 HE3 MET 70 2HE MET 70 30.424 0.409 -0.712
561 HA PRO 71 HA PRO 71 35.258 6.464 4.234
562 HB2 PRO 71 1HB PRO 71 36.198 7.852 2.099
563 HB3 PRO 71 2HB PRO 71 37.216 6.790 3.078
564 HG2 PRO 71 1HG PRO 71 35.902 6.253 0.442
565 HG3 PRO 71 2HG PRO 71 37.542 5.843 0.979
566 HD2 PRO 71 1HD PRO 71 35.525 4.036 0.944
567 HD3 PRO 71 2HD PRO 71 36.831 3.987 2.146
568 H ILE 72 H ILE 72 34.391 8.653 3.884
569 HA ILE 72 HA ILE 72 31.683 8.603 3.126
570 HB ILE 72 HB ILE 72 33.411 11.059 3.429
571 HG12 ILE 72 1HG1 ILE 72 31.868 9.512 5.524
572 HG13 ILE 72 2HG1 ILE 72 33.621 9.606 5.395
573 HG21 ILE 72 1HG2 ILE 72 30.459 10.745 3.921
574 HG22 ILE 72 2HG2 ILE 72 31.395 12.238 3.872
575 HG23 ILE 72 3HG2 ILE 72 31.137 11.310 2.395
576 HD11 ILE 72 3HD1 ILE 72 31.800 11.944 5.915
577 HD12 ILE 72 1HD1 ILE 72 32.708 11.063 7.144
578 HD13 ILE 72 2HD1 ILE 72 33.564 11.965 5.893
579 H ALA 73 H ALA 73 34.590 9.454 1.390
580 HA ALA 73 HA ALA 73 33.391 10.856 -0.749
581 HB1 ALA 73 1HB ALA 73 35.685 11.167 -0.563
582 HB2 ALA 73 2HB ALA 73 36.008 9.440 -0.405
583 HB3 ALA 73 3HB ALA 73 35.537 10.110 -1.967
584 H THR 74 H THR 74 34.314 7.443 -0.377
585 HA THR 74 HA THR 74 33.488 6.618 -2.944
586 HB THR 74 HB THR 74 33.660 4.967 -0.415
587 HG1 THR 74 HG1 THR 74 35.739 4.395 -1.510
588 HG21 THR 74 3HG2 THR 74 34.038 3.099 -2.059
589 HG22 THR 74 1HG2 THR 74 33.521 4.205 -3.330
590 HG23 THR 74 2HG2 THR 74 32.402 3.756 -2.043
591 H VAL 75 H VAL 75 31.850 6.414 0.212
592 HA VAL 75 HA VAL 75 29.485 5.224 -0.692
593 HB VAL 75 HB VAL 75 29.781 7.149 1.618
594 HG11 VAL 75 1HG1 VAL 75 27.866 5.006 1.931
595 HG12 VAL 75 2HG1 VAL 75 27.651 6.747 2.126
596 HG13 VAL 75 3HG1 VAL 75 27.489 6.010 0.532
597 HG21 VAL 75 3HG2 VAL 75 31.106 5.599 2.517
598 HG22 VAL 75 1HG2 VAL 75 29.690 4.550 2.592
599 HG23 VAL 75 2HG2 VAL 75 30.780 4.463 1.208
600 H GLY 76 H GLY 76 30.429 8.625 -0.468
601 HA2 GLY 76 1HA GLY 76 27.978 9.827 -0.997
602 HA3 GLY 76 2HA GLY 76 29.539 10.506 -1.436
603 H ARG 77 H ARG 77 30.222 8.278 -3.200
604 HA ARG 77 HA ARG 77 29.059 9.293 -5.589
605 HB2 ARG 77 1HB ARG 77 30.769 6.848 -5.103
606 HB3 ARG 77 2HB ARG 77 30.332 7.458 -6.694
607 HG2 ARG 77 1HG ARG 77 31.652 9.359 -6.466
608 HG3 ARG 77 2HG ARG 77 31.735 9.204 -4.709
609 HD2 ARG 77 1HD ARG 77 33.850 8.538 -5.507
610 HD3 ARG 77 2HD ARG 77 33.003 7.046 -5.099
611 HE ARG 77 HE ARG 77 32.667 7.760 -7.842
612 HH11 ARG 77 2HH1 ARG 77 34.853 6.282 -5.571
613 HH12 ARG 77 1HH1 ARG 77 35.641 5.305 -6.766
614 HH21 ARG 77 2HH2 ARG 77 33.696 6.480 -9.424
615 HH22 ARG 77 1HH2 ARG 77 34.983 5.419 -8.958
616 H ASN 78 H ASN 78 28.458 6.497 -3.564
617 HA ASN 78 HA ASN 78 26.854 5.033 -5.354
618 HB2 ASN 78 1HB ASN 78 27.219 5.072 -2.388
619 HB3 ASN 78 2HB ASN 78 25.847 4.192 -3.056
620 HD21 ASN 78 2HD2 ASN 78 28.334 3.317 -1.677
621 HD22 ASN 78 1HD2 ASN 78 29.036 2.141 -2.731
622 H VAL 79 H VAL 79 26.170 7.730 -3.241
623 HA VAL 79 HA VAL 79 23.301 7.522 -3.695
624 HB VAL 79 HB VAL 79 23.193 9.585 -2.269
625 HG11 VAL 79 1HG1 VAL 79 23.254 7.049 -1.524
626 HG12 VAL 79 2HG1 VAL 79 24.738 7.570 -0.723
627 HG13 VAL 79 3HG1 VAL 79 23.205 8.358 -0.343
628 HG21 VAL 79 3HG2 VAL 79 25.474 10.391 -2.790
629 HG22 VAL 79 1HG2 VAL 79 25.157 10.294 -1.058
630 HG23 VAL 79 2HG2 VAL 79 26.133 9.055 -1.846
631 H GLY 80 H GLY 80 25.564 8.356 -5.691
632 HA2 GLY 80 1HA GLY 80 25.523 9.617 -7.622
633 HA3 GLY 80 2HA GLY 80 23.926 10.185 -7.160
634 H PHE 81 H PHE 81 26.674 10.523 -5.040
635 HA PHE 81 HA PHE 81 26.719 13.410 -5.625
636 HB2 PHE 81 1HB PHE 81 26.900 12.028 -2.943
637 HB3 PHE 81 2HB PHE 81 27.244 13.737 -3.191
638 HD1 PHE 81 HD2 PHE 81 25.047 14.244 -5.233
639 HD2 PHE 81 HD1 PHE 81 25.064 12.243 -1.476
640 HE1 PHE 81 HE2 PHE 81 22.659 14.764 -4.949
641 HE2 PHE 81 HE1 PHE 81 22.675 12.759 -1.187
642 HZ PHE 81 HZ PHE 81 21.470 14.022 -2.924
643 H ASP 82 H ASP 82 28.604 14.006 -6.439
644 HA ASP 82 HA ASP 82 30.957 12.359 -6.106
645 HB2 ASP 82 1HB ASP 82 30.608 14.982 -7.576
646 HB3 ASP 82 2HB ASP 82 32.013 13.923 -7.675
647 H ASP 83 H ASP 83 29.716 15.396 -4.910
648 HA ASP 83 HA ASP 83 32.228 16.158 -3.694
649 HB2 ASP 83 1HB ASP 83 29.491 17.359 -3.856
650 HB3 ASP 83 2HB ASP 83 30.601 17.919 -2.608
651 H GLN 84 H GLN 84 32.917 15.330 -1.845
652 HA GLN 84 HA GLN 84 31.368 13.655 -0.196
653 HB2 GLN 84 1HB GLN 84 33.738 13.368 -0.218
654 HB3 GLN 84 2HB GLN 84 34.009 15.042 0.251
655 HG2 GLN 84 1HG GLN 84 33.066 14.605 2.443
656 HG3 GLN 84 2HG GLN 84 32.723 12.939 1.978
657 HE21 GLN 84 2HE2 GLN 84 34.928 15.001 3.409
658 HE22 GLN 84 1HE2 GLN 84 36.293 13.943 3.446
659 H LEU 85 H LEU 85 32.269 17.061 0.072
660 HA LEU 85 HA LEU 85 31.182 17.463 2.657
661 HB2 LEU 85 1HB LEU 85 32.063 19.220 0.421
662 HB3 LEU 85 2HB LEU 85 31.098 19.924 1.716
663 HG LEU 85 HG LEU 85 32.842 19.045 3.322
664 HD11 LEU 85 1HD1 LEU 85 34.270 18.542 0.722
665 HD12 LEU 85 2HD1 LEU 85 33.929 17.391 2.013
666 HD13 LEU 85 3HD1 LEU 85 35.095 18.688 2.275
667 HD21 LEU 85 3HD2 LEU 85 34.319 20.911 2.961
668 HD22 LEU 85 1HD2 LEU 85 32.667 21.404 2.589
669 HD23 LEU 85 2HD2 LEU 85 33.796 21.050 1.282
670 H TYR 86 H TYR 86 29.865 17.744 -0.596
671 HA TYR 86 HA TYR 86 27.467 19.044 0.026
672 HB2 TYR 86 1HB TYR 86 28.115 18.858 -2.266
673 HB3 TYR 86 2HB TYR 86 28.175 17.102 -2.174
674 HD1 TYR 86 HD1 TYR 86 25.471 19.203 -0.781
675 HD2 TYR 86 HD2 TYR 86 26.658 16.603 -3.933
676 HE1 TYR 86 HE1 TYR 86 23.140 19.088 -1.556
677 HE2 TYR 86 HE2 TYR 86 24.330 16.482 -4.717
678 HH TYR 86 HH TYR 86 22.112 18.449 -4.207
679 H PHE 87 H PHE 87 28.192 15.571 -0.200
680 HA PHE 87 HA PHE 87 25.621 14.641 0.416
681 HB2 PHE 87 1HB PHE 87 27.205 13.111 -0.513
682 HB3 PHE 87 2HB PHE 87 28.343 13.395 0.800
683 HD1 PHE 87 HD2 PHE 87 24.755 12.399 0.498
684 HD2 PHE 87 HD1 PHE 87 28.560 11.644 2.250
685 HE1 PHE 87 HE2 PHE 87 23.807 10.488 1.725
686 HE2 PHE 87 HE1 PHE 87 27.618 9.731 3.479
687 HZ PHE 87 HZ PHE 87 25.239 9.151 3.218
688 H SER 88 H SER 88 28.405 15.305 2.511
689 HA SER 88 HA SER 88 27.179 14.475 4.917
690 HB2 SER 88 1HB SER 88 29.062 15.346 6.013
691 HB3 SER 88 2HB SER 88 29.682 14.930 4.416
692 HG SER 88 HG SER 88 29.508 17.355 5.625
693 H ARG 89 H ARG 89 27.274 17.547 3.210
694 HA ARG 89 HA ARG 89 26.203 19.157 5.259
695 HB2 ARG 89 1HB ARG 89 26.473 19.393 2.298
696 HB3 ARG 89 2HB ARG 89 25.392 20.507 3.125
697 HG2 ARG 89 1HG ARG 89 27.410 20.942 4.678
698 HG3 ARG 89 2HG ARG 89 28.355 20.217 3.376
699 HD2 ARG 89 1HD ARG 89 27.548 21.869 1.814
700 HD3 ARG 89 2HD ARG 89 26.466 22.541 3.033
701 HE ARG 89 HE ARG 89 29.267 23.063 2.736
702 HH11 ARG 89 2HH1 ARG 89 26.627 22.936 5.003
703 HH12 ARG 89 1HH1 ARG 89 27.353 24.054 6.110
704 HH21 ARG 89 2HH2 ARG 89 30.233 24.535 4.186
705 HH22 ARG 89 1HH2 ARG 89 29.404 24.963 5.644
706 H VAL 90 H VAL 90 24.626 17.578 2.482
707 HA VAL 90 HA VAL 90 21.998 18.342 3.257
708 HB VAL 90 HB VAL 90 22.507 17.799 0.936
709 HG11 VAL 90 1HG1 VAL 90 24.150 15.970 1.556
710 HG12 VAL 90 2HG1 VAL 90 22.750 14.912 1.741
711 HG13 VAL 90 3HG1 VAL 90 23.101 15.647 0.176
712 HG21 VAL 90 3HG2 VAL 90 20.654 15.597 1.545
713 HG22 VAL 90 1HG2 VAL 90 20.244 17.150 2.272
714 HG23 VAL 90 2HG2 VAL 90 20.434 17.018 0.524
715 H PHE 91 H PHE 91 23.936 15.420 3.700
716 HA PHE 91 HA PHE 91 21.891 13.846 4.852
717 HB2 PHE 91 1HB PHE 91 23.917 12.837 3.942
718 HB3 PHE 91 2HB PHE 91 24.895 13.658 5.154
719 HD1 PHE 91 HD2 PHE 91 24.809 12.959 7.500
720 HD2 PHE 91 HD1 PHE 91 22.677 10.867 4.468
721 HE1 PHE 91 HE2 PHE 91 24.532 11.045 9.020
722 HE2 PHE 91 HE1 PHE 91 22.396 8.949 5.984
723 HZ PHE 91 HZ PHE 91 23.325 9.036 8.263
724 H LYS 92 H LYS 92 24.227 16.104 6.189
725 HA LYS 92 HA LYS 92 23.972 15.502 8.898
726 HB2 LYS 92 1HB LYS 92 25.697 16.999 8.128
727 HB3 LYS 92 2HB LYS 92 24.503 18.140 7.523
728 HG2 LYS 92 1HG LYS 92 24.408 17.463 10.407
729 HG3 LYS 92 2HG LYS 92 25.742 18.472 9.841
730 HD2 LYS 92 1HD LYS 92 23.244 19.353 8.705
731 HD3 LYS 92 2HD LYS 92 23.140 19.288 10.466
732 HE2 LYS 92 1HE LYS 92 24.713 20.916 10.754
733 HE3 LYS 92 2HE LYS 92 25.572 20.500 9.272
734 HZ1 LYS 92 3HZ LYS 92 23.291 22.279 9.660
735 HZ2 LYS 92 1HZ LYS 92 23.338 21.390 8.222
736 HZ3 LYS 92 2HZ LYS 92 24.613 22.429 8.616
737 H LYS 93 H LYS 93 22.021 17.610 6.835
738 HA LYS 93 HA LYS 93 20.339 18.502 8.977
739 HB2 LYS 93 1HB LYS 93 19.934 18.641 5.983
740 HB3 LYS 93 2HB LYS 93 18.964 19.488 7.181
741 HG2 LYS 93 1HG LYS 93 20.651 20.976 7.692
742 HG3 LYS 93 2HG LYS 93 21.920 19.900 7.101
743 HD2 LYS 93 1HD LYS 93 21.730 21.651 5.514
744 HD3 LYS 93 2HD LYS 93 20.962 20.237 4.789
745 HE2 LYS 93 1HE LYS 93 19.605 22.204 4.403
746 HE3 LYS 93 2HE LYS 93 18.766 21.099 5.491
747 HZ1 LYS 93 3HZ LYS 93 20.359 23.414 6.439
748 HZ2 LYS 93 1HZ LYS 93 19.293 22.457 7.339
749 HZ3 LYS 93 2HZ LYS 93 18.695 23.493 6.143
750 H CYS 94 H CYS 94 20.370 15.810 6.802
751 HA CYS 94 HA CYS 94 17.685 15.090 6.755
752 HB2 CYS 94 1HB CYS 94 19.546 14.030 5.436
753 HB3 CYS 94 2HB CYS 94 20.011 13.165 6.896
754 HG CYS 94 HG CYS 94 16.822 12.856 5.778
755 H THR 95 H THR 95 20.205 14.122 9.072
756 HA THR 95 HA THR 95 18.083 13.166 10.874
757 HB THR 95 HB THR 95 19.714 11.784 11.968
758 HG1 THR 95 HG1 THR 95 21.884 11.899 11.492
759 HG21 THR 95 3HG2 THR 95 20.086 11.584 8.977
760 HG22 THR 95 1HG2 THR 95 18.750 10.889 9.895
761 HG23 THR 95 2HG2 THR 95 20.394 10.302 10.149
762 H GLY 96 H GLY 96 20.199 15.717 10.375
763 HA2 GLY 96 1HA GLY 96 20.198 17.654 11.738
764 HA3 GLY 96 2HA GLY 96 19.748 16.657 13.113
765 H ALA 97 H ALA 97 22.058 14.880 11.772
766 HA ALA 97 HA ALA 97 24.311 16.364 12.924
767 HB1 ALA 97 1HB ALA 97 24.194 13.461 13.515
768 HB2 ALA 97 2HB ALA 97 24.882 14.785 14.457
769 HB3 ALA 97 3HB ALA 97 23.138 14.525 14.444
770 H SER 98 H SER 98 26.330 15.864 12.059
771 HA SER 98 HA SER 98 26.349 15.021 9.367
772 HB2 SER 98 1HB SER 98 28.981 14.857 10.143
773 HB3 SER 98 2HB SER 98 28.175 16.330 9.601
774 HG SER 98 HG SER 98 27.922 16.969 11.672
775 HA PRO 99 HA PRO 99 26.982 10.684 9.502
776 HB2 PRO 99 1HB PRO 99 28.874 10.287 7.596
777 HB3 PRO 99 2HB PRO 99 27.205 10.731 7.216
778 HG2 PRO 99 1HG PRO 99 29.641 12.465 7.359
779 HG3 PRO 99 2HG PRO 99 28.337 12.464 6.157
780 HD2 PRO 99 1HD PRO 99 28.459 14.268 8.173
781 HD3 PRO 99 2HD PRO 99 26.921 13.682 7.507
782 H SER 100 H SER 100 29.899 12.654 9.696
783 HA SER 100 HA SER 100 31.638 10.597 10.569
784 HB2 SER 100 1HB SER 100 32.353 12.816 9.620
785 HB3 SER 100 2HB SER 100 31.894 13.554 11.155
786 HG SER 100 HG SER 100 33.890 11.589 10.710
787 H GLU 101 H GLU 101 29.462 12.788 12.233
788 HA GLU 101 HA GLU 101 30.429 12.184 14.857
789 HB2 GLU 101 1HB GLU 101 29.230 14.293 14.243
790 HB3 GLU 101 2HB GLU 101 27.755 13.352 14.072
791 HG2 GLU 101 1HG GLU 101 27.423 13.975 16.198
792 HG3 GLU 101 2HG GLU 101 28.491 12.617 16.551
793 H PHE 102 H PHE 102 27.592 11.185 12.965
794 HA PHE 102 HA PHE 102 26.430 9.528 14.895
795 HB2 PHE 102 1HB PHE 102 25.449 10.331 12.666
796 HB3 PHE 102 2HB PHE 102 26.308 8.979 11.935
797 HD1 PHE 102 HD1 PHE 102 25.672 6.676 12.455
798 HD2 PHE 102 HD2 PHE 102 23.493 9.992 13.995
799 HE1 PHE 102 HE1 PHE 102 23.801 5.180 13.018
800 HE2 PHE 102 HE2 PHE 102 21.619 8.502 14.561
801 HZ PHE 102 HZ PHE 102 21.771 6.093 14.073
802 H ARG 103 H ARG 103 28.788 8.797 12.352
803 HA ARG 103 HA ARG 103 28.931 6.028 12.772
804 HB2 ARG 103 1HB ARG 103 29.919 7.513 10.872
805 HB3 ARG 103 2HB ARG 103 31.320 7.634 11.928
806 HG2 ARG 103 1HG ARG 103 31.081 5.009 11.973
807 HG3 ARG 103 2HG ARG 103 30.260 5.297 10.438
808 HD2 ARG 103 1HD ARG 103 32.339 6.781 9.924
809 HD3 ARG 103 2HD ARG 103 33.098 5.838 11.206
810 HE ARG 103 HE ARG 103 32.484 4.959 8.554
811 HH11 ARG 103 2HH1 ARG 103 32.889 3.925 11.853
812 HH12 ARG 103 1HH1 ARG 103 33.307 2.298 11.429
813 HH21 ARG 103 2HH2 ARG 103 33.033 2.820 7.983
814 HH22 ARG 103 1HH2 ARG 103 33.390 1.671 9.227
815 H ALA 104 H ALA 104 30.554 8.718 14.344
816 HA ALA 104 HA ALA 104 32.518 7.277 15.735
817 HB1 ALA 104 1HB ALA 104 31.653 9.946 15.594
818 HB2 ALA 104 2HB ALA 104 31.596 9.493 17.298
819 HB3 ALA 104 3HB ALA 104 33.097 9.317 16.389
820 H GLY 105 H GLY 105 29.115 7.772 16.358
821 HA2 GLY 105 1HA GLY 105 27.769 6.437 17.726
822 HA3 GLY 105 2HA GLY 105 29.219 5.753 18.447
823 H CYS 106 H CYS 106 29.930 8.855 18.597
824 HA CYS 106 HA CYS 106 28.999 9.085 21.341
825 HB2 CYS 106 1HB CYS 106 31.053 10.502 19.679
826 HB3 CYS 106 2HB CYS 106 30.463 11.247 21.160
827 HG CYS 106 HG CYS 106 32.989 9.873 21.452
828 H GLU 107 H GLU 107 27.230 10.167 21.873
829 HA GLU 107 HA GLU 107 26.022 11.976 19.923
830 HB2 GLU 107 1HB GLU 107 24.767 10.087 21.152
831 HB3 GLU 107 2HB GLU 107 24.797 11.158 22.545
832 HG2 GLU 107 1HG GLU 107 23.415 12.724 21.534
833 HG3 GLU 107 2HG GLU 107 23.739 12.106 19.915
Start of MODEL 16
1 H1 MET 1 H MET 1 3.445 -2.522 0.322
2 HA MET 1 HA MET 1 2.731 -0.034 -1.087
3 HB2 MET 1 1HB MET 1 5.154 -0.274 -0.800
4 HB3 MET 1 2HB MET 1 5.097 -1.853 -1.573
5 HG2 MET 1 1HG MET 1 5.903 -0.148 -3.101
6 HG3 MET 1 2HG MET 1 4.375 -0.832 -3.653
7 HE1 MET 1 3HE MET 1 5.079 2.206 -0.935
8 HE2 MET 1 1HE MET 1 6.304 2.013 -2.190
9 HE3 MET 1 2HE MET 1 5.227 3.410 -2.216
10 H ASP 2 H ASP 2 1.917 -0.180 -3.172
11 HA ASP 2 HA ASP 2 0.534 -2.629 -3.774
12 HB2 ASP 2 1HB ASP 2 -0.280 -0.193 -4.141
13 HB3 ASP 2 2HB ASP 2 0.674 -0.262 -5.620
14 H ASN 3 H ASN 3 0.800 -3.949 -5.574
15 HA ASN 3 HA ASN 3 3.430 -4.445 -6.399
16 HB2 ASN 3 1HB ASN 3 1.362 -6.003 -6.423
17 HB3 ASN 3 2HB ASN 3 1.037 -5.305 -8.007
18 HD21 ASN 3 2HD2 ASN 3 2.933 -5.342 -9.526
19 HD22 ASN 3 1HD2 ASN 3 3.889 -6.781 -9.543
20 H ARG 4 H ARG 4 0.753 -2.822 -8.072
21 HA ARG 4 HA ARG 4 1.987 -2.377 -10.521
22 HB2 ARG 4 1HB ARG 4 -0.111 -0.848 -9.001
23 HB3 ARG 4 2HB ARG 4 0.458 -0.299 -10.572
24 HG2 ARG 4 1HG ARG 4 -0.107 -2.753 -11.292
25 HG3 ARG 4 2HG ARG 4 -1.150 -2.701 -9.869
26 HD2 ARG 4 1HD ARG 4 -1.921 -0.420 -10.907
27 HD3 ARG 4 2HD ARG 4 -1.296 -1.124 -12.398
28 HE ARG 4 HE ARG 4 -3.069 -2.584 -12.421
29 HH11 ARG 4 2HH1 ARG 4 -2.891 -1.014 -9.319
30 HH12 ARG 4 1HH1 ARG 4 -4.424 -1.616 -8.780
31 HH21 ARG 4 2HH2 ARG 4 -5.089 -3.383 -11.723
32 HH22 ARG 4 1HH2 ARG 4 -5.673 -2.964 -10.148
33 H VAL 5 H VAL 5 1.957 -0.298 -7.634
34 HA VAL 5 HA VAL 5 3.615 1.714 -8.760
35 HB VAL 5 HB VAL 5 3.166 1.100 -5.836
36 HG11 VAL 5 1HG1 VAL 5 4.414 2.879 -5.364
37 HG12 VAL 5 2HG1 VAL 5 4.915 2.898 -7.056
38 HG13 VAL 5 3HG1 VAL 5 3.542 3.874 -6.530
39 HG21 VAL 5 3HG2 VAL 5 1.361 2.705 -5.910
40 HG22 VAL 5 1HG2 VAL 5 1.658 3.007 -7.622
41 HG23 VAL 5 2HG2 VAL 5 1.062 1.433 -7.094
42 H ARG 6 H ARG 6 4.240 -1.152 -6.804
43 HA ARG 6 HA ARG 6 6.886 -0.703 -6.107
44 HB2 ARG 6 1HB ARG 6 5.267 -2.657 -5.510
45 HB3 ARG 6 2HB ARG 6 5.954 -3.433 -6.931
46 HG2 ARG 6 1HG ARG 6 7.840 -3.951 -5.867
47 HG3 ARG 6 2HG ARG 6 7.977 -2.346 -5.145
48 HD2 ARG 6 1HD ARG 6 6.691 -2.928 -3.302
49 HD3 ARG 6 2HD ARG 6 5.943 -4.292 -4.132
50 HE ARG 6 HE ARG 6 8.779 -4.576 -3.738
51 HH11 ARG 6 2HH1 ARG 6 5.623 -5.067 -2.353
52 HH12 ARG 6 1HH1 ARG 6 6.144 -6.329 -1.286
53 HH21 ARG 6 2HH2 ARG 6 9.478 -6.235 -2.337
54 HH22 ARG 6 1HH2 ARG 6 8.337 -6.992 -1.277
55 H GLU 7 H GLU 7 5.516 -1.804 -9.145
56 HA GLU 7 HA GLU 7 7.993 -2.572 -10.327
57 HB2 GLU 7 1HB GLU 7 5.256 -2.692 -11.020
58 HB3 GLU 7 2HB GLU 7 6.055 -1.784 -12.296
59 HG2 GLU 7 1HG GLU 7 6.635 -4.579 -11.370
60 HG3 GLU 7 2HG GLU 7 6.078 -4.047 -12.955
61 H ALA 8 H ALA 8 6.161 0.407 -10.149
62 HA ALA 8 HA ALA 8 7.665 1.797 -12.141
63 HB1 ALA 8 1HB ALA 8 6.464 3.580 -10.244
64 HB2 ALA 8 2HB ALA 8 6.028 3.280 -11.927
65 HB3 ALA 8 3HB ALA 8 5.340 2.282 -10.647
66 H CYS 9 H CYS 9 7.706 1.767 -8.587
67 HA CYS 9 HA CYS 9 9.766 3.663 -8.282
68 HB2 CYS 9 1HB CYS 9 9.808 3.051 -6.004
69 HB3 CYS 9 2HB CYS 9 8.144 2.785 -6.509
70 HG CYS 9 HG CYS 9 8.308 0.582 -5.114
71 H GLN 10 H GLN 10 9.792 0.225 -8.892
72 HA GLN 10 HA GLN 10 12.449 -0.335 -8.182
73 HB2 GLN 10 1HB GLN 10 10.893 -2.130 -8.578
74 HB3 GLN 10 2HB GLN 10 10.644 -1.611 -10.240
75 HG2 GLN 10 1HG GLN 10 12.078 -3.586 -10.082
76 HG3 GLN 10 2HG GLN 10 12.909 -2.212 -10.809
77 HE21 GLN 10 2HE2 GLN 10 12.352 -3.640 -7.608
78 HE22 GLN 10 1HE2 GLN 10 13.968 -3.417 -7.038
79 H TYR 11 H TYR 11 11.036 0.981 -11.117
80 HA TYR 11 HA TYR 11 13.311 0.754 -12.766
81 HB2 TYR 11 1HB TYR 11 11.327 1.176 -13.922
82 HB3 TYR 11 2HB TYR 11 10.847 2.466 -12.825
83 HD1 TYR 11 HD2 TYR 11 13.776 1.755 -15.048
84 HD2 TYR 11 HD1 TYR 11 10.837 4.557 -13.778
85 HE1 TYR 11 HE2 TYR 11 14.693 3.418 -16.612
86 HE2 TYR 11 HE1 TYR 11 11.746 6.227 -15.338
87 HH TYR 11 HH TYR 11 13.623 5.569 -17.846
88 H ILE 12 H ILE 12 12.271 3.196 -10.465
89 HA ILE 12 HA ILE 12 14.125 5.201 -11.174
90 HB ILE 12 HB ILE 12 12.890 4.689 -8.465
91 HG12 ILE 12 1HG1 ILE 12 11.948 6.529 -10.673
92 HG13 ILE 12 2HG1 ILE 12 11.255 4.944 -10.344
93 HG21 ILE 12 1HG2 ILE 12 14.803 6.611 -9.374
94 HG22 ILE 12 2HG2 ILE 12 13.307 7.431 -8.932
95 HG23 ILE 12 3HG2 ILE 12 14.122 6.395 -7.761
96 HD11 ILE 12 3HD1 ILE 12 10.077 5.689 -8.595
97 HD12 ILE 12 1HD1 ILE 12 11.381 6.732 -8.027
98 HD13 ILE 12 2HD1 ILE 12 10.327 7.271 -9.334
99 H SER 13 H SER 13 14.320 2.424 -9.028
100 HA SER 13 HA SER 13 16.671 3.072 -7.663
101 HB2 SER 13 1HB SER 13 16.699 0.860 -6.929
102 HB3 SER 13 2HB SER 13 15.000 1.087 -7.341
103 HG SER 13 HG SER 13 15.226 -0.464 -8.722
104 H ASP 14 H ASP 14 16.193 1.398 -10.748
105 HA ASP 14 HA ASP 14 18.870 0.723 -11.231
106 HB2 ASP 14 1HB ASP 14 16.675 0.047 -12.484
107 HB3 ASP 14 2HB ASP 14 17.021 1.463 -13.472
108 H HIS 15 H HIS 15 17.167 3.729 -11.532
109 HA HIS 15 HA HIS 15 19.484 4.944 -12.875
110 HB2 HIS 15 1HB HIS 15 16.597 5.784 -12.668
111 HB3 HIS 15 2HB HIS 15 17.856 6.895 -13.198
112 HD1 HIS 15 HD1 HIS 15 18.263 6.927 -15.637
113 HD2 HIS 15 HD2 HIS 15 16.528 3.359 -14.404
114 HE1 HIS 15 HE1 HIS 15 17.839 5.622 -17.744
115 H LEU 16 H LEU 16 18.969 4.269 -9.927
116 HA LEU 16 HA LEU 16 18.643 6.600 -8.436
117 HB2 LEU 16 1HB LEU 16 18.694 4.228 -7.598
118 HB3 LEU 16 2HB LEU 16 20.451 4.306 -7.705
119 HG LEU 16 HG LEU 16 20.458 6.116 -6.043
120 HD11 LEU 16 1HD1 LEU 16 18.306 7.108 -6.465
121 HD12 LEU 16 2HD1 LEU 16 18.381 6.578 -4.785
122 HD13 LEU 16 3HD1 LEU 16 17.485 5.628 -5.970
123 HD21 LEU 16 3HD2 LEU 16 18.850 3.839 -4.936
124 HD22 LEU 16 1HD2 LEU 16 20.158 4.745 -4.177
125 HD23 LEU 16 2HD2 LEU 16 20.512 3.616 -5.484
126 H ALA 17 H ALA 17 21.356 5.454 -10.259
127 HA ALA 17 HA ALA 17 23.175 7.377 -9.034
128 HB1 ALA 17 1HB ALA 17 24.075 5.838 -11.379
129 HB2 ALA 17 2HB ALA 17 24.872 6.126 -9.832
130 HB3 ALA 17 3HB ALA 17 23.625 4.887 -9.963
131 H ASP 18 H ASP 18 21.120 7.065 -11.767
132 HA ASP 18 HA ASP 18 22.424 8.769 -13.587
133 HB2 ASP 18 1HB ASP 18 20.327 7.208 -13.865
134 HB3 ASP 18 2HB ASP 18 19.436 8.665 -13.434
135 H SER 19 H SER 19 21.994 10.959 -14.130
136 HA SER 19 HA SER 19 21.391 12.590 -11.783
137 HB2 SER 19 1HB SER 19 22.263 14.455 -13.331
138 HB3 SER 19 2HB SER 19 23.426 13.253 -12.772
139 HG SER 19 HG SER 19 23.725 13.451 -14.949
140 H ASN 20 H ASN 20 20.461 12.336 -15.204
141 HA ASN 20 HA ASN 20 18.278 14.208 -14.821
142 HB2 ASN 20 1HB ASN 20 19.014 12.596 -17.274
143 HB3 ASN 20 2HB ASN 20 17.892 13.952 -17.213
144 HD21 ASN 20 2HD2 ASN 20 20.580 13.355 -18.546
145 HD22 ASN 20 1HD2 ASN 20 21.506 14.779 -18.233
146 H PHE 21 H PHE 21 16.668 13.353 -13.623
147 HA PHE 21 HA PHE 21 15.681 10.675 -14.306
148 HB2 PHE 21 1HB PHE 21 16.168 10.936 -11.960
149 HB3 PHE 21 2HB PHE 21 15.222 12.419 -11.881
150 HD1 PHE 21 HD1 PHE 21 14.412 9.137 -13.433
151 HD2 PHE 21 HD2 PHE 21 13.492 11.989 -10.410
152 HE1 PHE 21 HE1 PHE 21 12.424 7.829 -12.808
153 HE2 PHE 21 HE2 PHE 21 11.504 10.685 -9.780
154 HZ PHE 21 HZ PHE 21 10.968 8.601 -10.978
155 H ASP 22 H ASP 22 13.733 10.361 -15.206
156 HA ASP 22 HA ASP 22 12.019 12.728 -15.594
157 HB2 ASP 22 1HB ASP 22 13.209 11.505 -17.607
158 HB3 ASP 22 2HB ASP 22 11.876 10.368 -17.426
159 H ILE 23 H ILE 23 10.093 12.652 -14.660
160 HA ILE 23 HA ILE 23 9.196 10.365 -13.236
161 HB ILE 23 HB ILE 23 8.679 12.730 -12.602
162 HG12 ILE 23 1HG1 ILE 23 6.310 10.881 -12.965
163 HG13 ILE 23 2HG1 ILE 23 7.451 10.846 -11.625
164 HG21 ILE 23 1HG2 ILE 23 8.095 13.418 -14.948
165 HG22 ILE 23 2HG2 ILE 23 6.559 12.580 -14.732
166 HG23 ILE 23 3HG2 ILE 23 6.966 13.953 -13.704
167 HD11 ILE 23 3HD1 ILE 23 6.678 13.337 -11.334
168 HD12 ILE 23 1HD1 ILE 23 5.257 12.759 -12.202
169 HD13 ILE 23 2HD1 ILE 23 5.731 12.001 -10.681
170 H ALA 24 H ALA 24 8.577 11.622 -16.421
171 HA ALA 24 HA ALA 24 6.166 10.320 -17.002
172 HB1 ALA 24 1HB ALA 24 6.642 11.841 -18.620
173 HB2 ALA 24 2HB ALA 24 8.371 11.488 -18.601
174 HB3 ALA 24 3HB ALA 24 7.257 10.396 -19.424
175 H SER 25 H SER 25 9.518 9.230 -17.263
176 HA SER 25 HA SER 25 9.015 6.809 -18.603
177 HB2 SER 25 1HB SER 25 11.254 7.649 -16.754
178 HB3 SER 25 2HB SER 25 11.238 6.108 -17.611
179 HG SER 25 HG SER 25 12.376 7.821 -18.712
180 H VAL 26 H VAL 26 8.731 7.736 -15.259
181 HA VAL 26 HA VAL 26 8.655 5.108 -14.166
182 HB VAL 26 HB VAL 26 7.512 7.666 -13.034
183 HG11 VAL 26 1HG1 VAL 26 8.233 5.086 -11.648
184 HG12 VAL 26 2HG1 VAL 26 7.592 6.544 -10.886
185 HG13 VAL 26 3HG1 VAL 26 6.594 5.623 -12.013
186 HG21 VAL 26 3HG2 VAL 26 9.612 8.309 -12.697
187 HG22 VAL 26 1HG2 VAL 26 9.872 6.873 -11.706
188 HG23 VAL 26 2HG2 VAL 26 10.212 6.825 -13.436
189 H ALA 27 H ALA 27 6.131 7.448 -15.054
190 HA ALA 27 HA ALA 27 3.954 5.783 -14.333
191 HB1 ALA 27 1HB ALA 27 4.292 8.415 -15.237
192 HB2 ALA 27 2HB ALA 27 3.245 7.625 -16.417
193 HB3 ALA 27 3HB ALA 27 2.798 7.639 -14.711
194 H GLN 28 H GLN 28 5.445 6.527 -17.480
195 HA GLN 28 HA GLN 28 3.779 4.895 -19.034
196 HB2 GLN 28 1HB GLN 28 5.329 5.202 -20.790
197 HB3 GLN 28 2HB GLN 28 5.411 6.674 -19.832
198 HG2 GLN 28 1HG GLN 28 7.627 6.267 -20.162
199 HG3 GLN 28 2HG GLN 28 7.372 5.423 -18.636
200 HE21 GLN 28 2HE2 GLN 28 9.144 4.081 -19.033
201 HE22 GLN 28 1HE2 GLN 28 9.068 2.788 -20.175
202 H HIS 29 H HIS 29 6.697 4.189 -17.214
203 HA HIS 29 HA HIS 29 7.315 1.681 -18.259
204 HB2 HIS 29 1HB HIS 29 8.890 2.698 -16.802
205 HB3 HIS 29 2HB HIS 29 7.704 2.858 -15.510
206 HD1 HIS 29 HD1 HIS 29 8.436 -0.307 -17.451
207 HD2 HIS 29 HD2 HIS 29 8.879 1.259 -13.628
208 HE1 HIS 29 HE1 HIS 29 9.232 -2.222 -16.028
209 H VAL 30 H VAL 30 4.913 2.640 -15.889
210 HA VAL 30 HA VAL 30 4.133 -0.161 -15.501
211 HB VAL 30 HB VAL 30 2.661 0.729 -13.695
212 HG11 VAL 30 1HG1 VAL 30 5.583 1.443 -13.460
213 HG12 VAL 30 2HG1 VAL 30 4.472 1.180 -12.115
214 HG13 VAL 30 3HG1 VAL 30 4.882 -0.153 -13.195
215 HG21 VAL 30 3HG2 VAL 30 2.747 2.977 -12.997
216 HG22 VAL 30 1HG2 VAL 30 4.141 3.325 -14.020
217 HG23 VAL 30 2HG2 VAL 30 2.560 3.044 -14.750
218 H CYS 31 H CYS 31 3.584 1.615 -17.900
219 HA CYS 31 HA CYS 31 1.885 2.087 -19.343
220 HB2 CYS 31 1HB CYS 31 0.857 -0.372 -17.938
221 HB3 CYS 31 2HB CYS 31 -0.023 0.377 -19.264
222 HG CYS 31 HG CYS 31 3.229 -0.437 -19.767
223 H LEU 32 H LEU 32 1.862 3.688 -17.065
224 HA LEU 32 HA LEU 32 -0.993 4.305 -16.897
225 HB2 LEU 32 1HB LEU 32 0.576 3.261 -14.756
226 HB3 LEU 32 2HB LEU 32 0.143 4.928 -14.380
227 HG LEU 32 HG LEU 32 -1.773 2.681 -15.000
228 HD11 LEU 32 1HD1 LEU 32 -0.855 2.405 -12.815
229 HD12 LEU 32 2HD1 LEU 32 -2.476 3.077 -12.639
230 HD13 LEU 32 3HD1 LEU 32 -1.065 4.117 -12.450
231 HD21 LEU 32 3HD2 LEU 32 -3.510 4.323 -14.373
232 HD22 LEU 32 1HD2 LEU 32 -2.648 4.763 -15.847
233 HD23 LEU 32 2HD2 LEU 32 -2.271 5.579 -14.329
234 H SER 33 H SER 33 -1.379 6.517 -16.031
235 HA SER 33 HA SER 33 0.444 8.360 -17.286
236 HB2 SER 33 1HB SER 33 -2.284 8.492 -16.125
237 HB3 SER 33 2HB SER 33 -1.349 9.987 -16.106
238 HG SER 33 HG SER 33 -2.564 8.749 -18.182
239 HA PRO 34 HA PRO 34 2.757 9.714 -13.814
240 HB2 PRO 34 1HB PRO 34 2.968 12.381 -14.272
241 HB3 PRO 34 2HB PRO 34 3.834 11.171 -15.226
242 HG2 PRO 34 1HG PRO 34 1.299 12.629 -15.866
243 HG3 PRO 34 2HG PRO 34 2.681 12.273 -16.918
244 HD2 PRO 34 1HD PRO 34 0.395 10.823 -16.974
245 HD3 PRO 34 2HD PRO 34 1.987 10.111 -17.309
246 H SER 35 H SER 35 -0.114 11.682 -14.507
247 HA SER 35 HA SER 35 -0.280 12.880 -11.949
248 HB2 SER 35 1HB SER 35 -2.801 13.099 -12.740
249 HB3 SER 35 2HB SER 35 -1.525 14.055 -13.494
250 HG SER 35 HG SER 35 -2.859 13.027 -15.044
251 H ARG 36 H ARG 36 -1.909 10.068 -13.380
252 HA ARG 36 HA ARG 36 -3.415 9.446 -11.051
253 HB2 ARG 36 1HB ARG 36 -2.645 7.658 -13.364
254 HB3 ARG 36 2HB ARG 36 -3.898 7.323 -12.178
255 HG2 ARG 36 1HG ARG 36 -3.953 9.732 -13.971
256 HG3 ARG 36 2HG ARG 36 -4.681 8.185 -14.408
257 HD2 ARG 36 1HD ARG 36 -6.311 8.342 -12.781
258 HD3 ARG 36 2HD ARG 36 -5.359 9.446 -11.789
259 HE ARG 36 HE ARG 36 -6.086 10.615 -14.285
260 HH11 ARG 36 2HH1 ARG 36 -7.268 9.856 -11.099
261 HH12 ARG 36 1HH1 ARG 36 -8.448 11.124 -11.093
262 HH21 ARG 36 2HH2 ARG 36 -7.637 12.287 -14.289
263 HH22 ARG 36 1HH2 ARG 36 -8.658 12.506 -12.908
264 H LEU 37 H LEU 37 -0.318 8.339 -12.335
265 HA LEU 37 HA LEU 37 0.095 6.298 -10.409
266 HB2 LEU 37 1HB LEU 37 1.291 6.244 -12.485
267 HB3 LEU 37 2HB LEU 37 2.006 7.823 -12.168
268 HG LEU 37 HG LEU 37 3.021 6.558 -10.083
269 HD11 LEU 37 1HD1 LEU 37 3.613 4.228 -11.438
270 HD12 LEU 37 2HD1 LEU 37 1.882 4.436 -11.701
271 HD13 LEU 37 3HD1 LEU 37 2.525 4.389 -10.059
272 HD21 LEU 37 3HD2 LEU 37 4.524 5.721 -12.407
273 HD22 LEU 37 1HD2 LEU 37 4.920 6.926 -11.182
274 HD23 LEU 37 2HD2 LEU 37 3.936 7.376 -12.575
275 H SER 38 H SER 38 1.159 9.673 -10.632
276 HA SER 38 HA SER 38 2.783 9.717 -8.355
277 HB2 SER 38 1HB SER 38 2.825 11.534 -9.968
278 HB3 SER 38 2HB SER 38 1.147 11.939 -9.602
279 HG SER 38 HG SER 38 3.266 12.020 -7.715
280 H HIS 39 H HIS 39 -0.689 10.239 -8.731
281 HA HIS 39 HA HIS 39 -1.262 11.119 -6.140
282 HB2 HIS 39 1HB HIS 39 -2.875 11.229 -7.995
283 HB3 HIS 39 2HB HIS 39 -3.005 9.473 -7.987
284 HD1 HIS 39 HD1 HIS 39 -4.400 12.486 -6.466
285 HD2 HIS 39 HD2 HIS 39 -4.237 8.434 -5.564
286 HE1 HIS 39 HE1 HIS 39 -6.170 12.115 -4.719
287 H LEU 40 H LEU 40 -1.287 7.825 -7.480
288 HA LEU 40 HA LEU 40 -1.944 6.592 -4.995
289 HB2 LEU 40 1HB LEU 40 -1.154 5.688 -7.703
290 HB3 LEU 40 2HB LEU 40 -0.889 4.561 -6.374
291 HG LEU 40 HG LEU 40 -3.540 5.782 -7.143
292 HD11 LEU 40 1HD1 LEU 40 -3.564 2.982 -7.346
293 HD12 LEU 40 2HD1 LEU 40 -2.104 3.529 -8.169
294 HD13 LEU 40 3HD1 LEU 40 -3.677 4.164 -8.650
295 HD21 LEU 40 3HD2 LEU 40 -4.152 3.710 -5.562
296 HD22 LEU 40 1HD2 LEU 40 -3.934 5.352 -4.958
297 HD23 LEU 40 2HD2 LEU 40 -2.617 4.186 -4.834
298 H PHE 41 H PHE 41 1.029 7.453 -6.610
299 HA PHE 41 HA PHE 41 2.814 5.842 -5.166
300 HB2 PHE 41 1HB PHE 41 3.056 7.648 -7.204
301 HB3 PHE 41 2HB PHE 41 3.801 8.525 -5.871
302 HD1 PHE 41 HD2 PHE 41 5.805 7.651 -4.776
303 HD2 PHE 41 HD1 PHE 41 4.084 5.711 -8.150
304 HE1 PHE 41 HE2 PHE 41 7.885 6.377 -5.099
305 HE2 PHE 41 HE1 PHE 41 6.160 4.432 -8.479
306 HZ PHE 41 HZ PHE 41 8.065 4.765 -6.953
307 H ARG 42 H ARG 42 1.795 9.205 -4.592
308 HA ARG 42 HA ARG 42 3.248 9.485 -2.171
309 HB2 ARG 42 1HB ARG 42 2.533 11.412 -3.518
310 HB3 ARG 42 2HB ARG 42 0.851 11.034 -3.170
311 HG2 ARG 42 1HG ARG 42 0.950 11.875 -1.071
312 HG3 ARG 42 2HG ARG 42 2.639 11.417 -0.848
313 HD2 ARG 42 1HD ARG 42 2.737 13.733 -0.956
314 HD3 ARG 42 2HD ARG 42 3.129 13.243 -2.603
315 HE ARG 42 HE ARG 42 0.443 13.604 -2.671
316 HH11 ARG 42 2HH1 ARG 42 3.117 15.580 -1.637
317 HH12 ARG 42 1HH1 ARG 42 2.334 17.074 -2.032
318 HH21 ARG 42 2HH2 ARG 42 -0.597 15.565 -3.196
319 HH22 ARG 42 1HH2 ARG 42 0.222 17.064 -2.918
320 H GLN 43 H GLN 43 0.145 8.162 -2.962
321 HA GLN 43 HA GLN 43 -0.901 8.274 -0.288
322 HB2 GLN 43 1HB GLN 43 -2.166 8.128 -2.582
323 HB3 GLN 43 2HB GLN 43 -1.944 6.396 -2.373
324 HG2 GLN 43 1HG GLN 43 -3.253 8.187 -0.342
325 HG3 GLN 43 2HG GLN 43 -4.126 7.264 -1.564
326 HE21 GLN 43 2HE2 GLN 43 -3.344 4.868 -1.603
327 HE22 GLN 43 1HE2 GLN 43 -3.303 4.099 -0.057
328 H GLN 44 H GLN 44 0.688 5.861 -2.309
329 HA GLN 44 HA GLN 44 0.427 3.789 -0.317
330 HB2 GLN 44 1HB GLN 44 2.063 3.854 -2.859
331 HB3 GLN 44 2HB GLN 44 1.762 2.433 -1.868
332 HG2 GLN 44 1HG GLN 44 -0.571 3.944 -2.911
333 HG3 GLN 44 2HG GLN 44 0.351 2.940 -4.028
334 HE21 GLN 44 2HE2 GLN 44 -2.399 2.756 -2.806
335 HE22 GLN 44 1HE2 GLN 44 -2.478 1.151 -2.174
336 H LEU 45 H LEU 45 2.968 5.927 -1.521
337 HA LEU 45 HA LEU 45 4.904 4.816 0.341
338 HB2 LEU 45 1HB LEU 45 5.035 6.164 -2.129
339 HB3 LEU 45 2HB LEU 45 5.797 7.219 -0.940
340 HG LEU 45 HG LEU 45 6.614 4.353 -1.052
341 HD11 LEU 45 1HD1 LEU 45 6.566 5.287 -3.404
342 HD12 LEU 45 2HD1 LEU 45 8.122 4.687 -2.832
343 HD13 LEU 45 3HD1 LEU 45 7.809 6.422 -2.876
344 HD21 LEU 45 3HD2 LEU 45 8.566 5.109 -0.075
345 HD22 LEU 45 1HD2 LEU 45 7.363 6.193 0.623
346 HD23 LEU 45 2HD2 LEU 45 8.377 6.743 -0.711
347 H GLY 46 H GLY 46 2.563 7.271 0.291
348 HA2 GLY 46 1HA GLY 46 1.974 8.844 1.859
349 HA3 GLY 46 2HA GLY 46 3.127 8.082 2.944
350 H ILE 47 H ILE 47 4.597 8.981 0.059
351 HA ILE 47 HA ILE 47 5.215 11.695 0.898
352 HB ILE 47 HB ILE 47 7.606 11.391 0.936
353 HG12 ILE 47 1HG1 ILE 47 7.038 8.458 0.454
354 HG13 ILE 47 2HG1 ILE 47 7.764 9.570 -0.702
355 HG21 ILE 47 1HG2 ILE 47 6.415 11.085 3.038
356 HG22 ILE 47 2HG2 ILE 47 6.235 9.365 2.698
357 HG23 ILE 47 3HG2 ILE 47 7.839 10.047 2.969
358 HD11 ILE 47 3HD1 ILE 47 9.438 8.159 0.341
359 HD12 ILE 47 1HD1 ILE 47 9.683 9.851 0.774
360 HD13 ILE 47 2HD1 ILE 47 8.953 8.740 1.934
361 H SER 48 H SER 48 6.849 12.683 -0.708
362 HA SER 48 HA SER 48 5.778 12.283 -3.340
363 HB2 SER 48 1HB SER 48 7.815 14.161 -2.165
364 HB3 SER 48 2HB SER 48 7.556 14.075 -3.907
365 HG SER 48 HG SER 48 5.920 15.336 -3.582
366 H VAL 49 H VAL 49 6.848 11.575 -5.180
367 HA VAL 49 HA VAL 49 8.552 9.405 -4.952
368 HB VAL 49 HB VAL 49 8.309 11.244 -7.338
369 HG11 VAL 49 1HG1 VAL 49 9.167 8.356 -7.170
370 HG12 VAL 49 2HG1 VAL 49 8.999 9.308 -8.646
371 HG13 VAL 49 3HG1 VAL 49 10.232 9.731 -7.459
372 HG21 VAL 49 3HG2 VAL 49 6.836 8.776 -7.515
373 HG22 VAL 49 1HG2 VAL 49 6.335 9.700 -6.098
374 HG23 VAL 49 2HG2 VAL 49 6.268 10.435 -7.700
375 H LEU 50 H LEU 50 9.352 12.793 -5.628
376 HA LEU 50 HA LEU 50 12.107 12.432 -6.033
377 HB2 LEU 50 1HB LEU 50 10.305 14.692 -5.458
378 HB3 LEU 50 2HB LEU 50 11.996 14.932 -5.020
379 HG LEU 50 HG LEU 50 12.673 14.539 -7.319
380 HD11 LEU 50 1HD1 LEU 50 10.596 14.565 -8.965
381 HD12 LEU 50 2HD1 LEU 50 9.831 13.743 -7.606
382 HD13 LEU 50 3HD1 LEU 50 11.281 13.064 -8.344
383 HD21 LEU 50 3HD2 LEU 50 11.614 16.512 -8.357
384 HD22 LEU 50 1HD2 LEU 50 12.137 16.813 -6.700
385 HD23 LEU 50 2HD2 LEU 50 10.430 16.539 -7.049
386 H SER 51 H SER 51 10.191 12.785 -3.125
387 HA SER 51 HA SER 51 12.397 13.228 -1.368
388 HB2 SER 51 1HB SER 51 9.486 12.695 -1.067
389 HB3 SER 51 2HB SER 51 10.517 12.325 0.315
390 HG SER 51 HG SER 51 10.855 14.786 -0.967
391 H TRP 52 H TRP 52 10.460 10.389 -2.238
392 HA TRP 52 HA TRP 52 11.639 8.556 -0.493
393 HB2 TRP 52 1HB TRP 52 9.619 7.970 -1.655
394 HB3 TRP 52 2HB TRP 52 10.401 8.162 -3.221
395 HD1 TRP 52 HD1 TRP 52 10.668 5.862 -0.108
396 HE1 TRP 52 HE1 TRP 52 11.397 3.527 -0.910
397 HE3 TRP 52 HE3 TRP 52 11.315 6.877 -5.077
398 HZ2 TRP 52 HZ2 TRP 52 12.148 2.281 -3.329
399 HZ3 TRP 52 HZ3 TRP 52 12.041 5.058 -6.567
400 HH2 TRP 52 HH2 TRP 52 12.449 2.809 -5.709
401 H ARG 53 H ARG 53 12.595 9.586 -3.736
402 HA ARG 53 HA ARG 53 14.639 7.719 -4.160
403 HB2 ARG 53 1HB ARG 53 13.717 9.175 -5.925
404 HB3 ARG 53 2HB ARG 53 14.470 10.568 -5.159
405 HG2 ARG 53 1HG ARG 53 16.664 9.192 -5.457
406 HG3 ARG 53 2HG ARG 53 15.724 8.334 -6.680
407 HD2 ARG 53 1HD ARG 53 15.358 10.330 -7.917
408 HD3 ARG 53 2HD ARG 53 15.986 11.331 -6.608
409 HE ARG 53 HE ARG 53 18.122 10.880 -7.322
410 HH11 ARG 53 2HH1 ARG 53 15.886 8.726 -8.897
411 HH12 ARG 53 1HH1 ARG 53 17.061 8.111 -10.012
412 HH21 ARG 53 2HH2 ARG 53 19.678 10.079 -8.785
413 HH22 ARG 53 1HH2 ARG 53 19.218 8.881 -9.947
414 H GLU 54 H GLU 54 14.754 10.977 -2.745
415 HA GLU 54 HA GLU 54 17.540 10.986 -2.270
416 HB2 GLU 54 1HB GLU 54 15.703 12.905 -2.203
417 HB3 GLU 54 2HB GLU 54 15.708 12.520 -0.488
418 HG2 GLU 54 1HG GLU 54 18.032 13.038 -0.307
419 HG3 GLU 54 2HG GLU 54 18.178 13.216 -2.054
420 H ASP 55 H ASP 55 14.775 10.213 -0.181
421 HA ASP 55 HA ASP 55 16.155 9.739 2.185
422 HB2 ASP 55 1HB ASP 55 13.578 9.734 1.603
423 HB3 ASP 55 2HB ASP 55 13.834 7.996 1.469
424 H GLN 56 H GLN 56 15.606 7.630 -0.582
425 HA GLN 56 HA GLN 56 16.576 5.252 0.597
426 HB2 GLN 56 1HB GLN 56 16.190 6.175 -2.232
427 HB3 GLN 56 2HB GLN 56 16.990 4.645 -1.898
428 HG2 GLN 56 1HG GLN 56 14.337 5.238 -0.668
429 HG3 GLN 56 2HG GLN 56 14.437 4.709 -2.347
430 HE21 GLN 56 2HE2 GLN 56 16.145 2.801 -2.515
431 HE22 GLN 56 1HE2 GLN 56 15.833 1.498 -1.425
432 H ARG 57 H ARG 57 18.141 7.854 -1.196
433 HA ARG 57 HA ARG 57 20.639 6.675 -1.591
434 HB2 ARG 57 1HB ARG 57 19.941 9.580 -1.128
435 HB3 ARG 57 2HB ARG 57 21.498 9.009 -1.713
436 HG2 ARG 57 1HG ARG 57 20.641 8.379 -3.770
437 HG3 ARG 57 2HG ARG 57 18.986 8.293 -3.164
438 HD2 ARG 57 1HD ARG 57 18.710 10.315 -4.071
439 HD3 ARG 57 2HD ARG 57 19.672 10.919 -2.723
440 HE ARG 57 HE ARG 57 21.364 10.063 -4.816
441 HH11 ARG 57 2HH1 ARG 57 19.164 12.623 -3.960
442 HH12 ARG 57 1HH1 ARG 57 19.951 13.807 -4.950
443 HH21 ARG 57 2HH2 ARG 57 22.408 11.613 -6.123
444 HH22 ARG 57 1HH2 ARG 57 21.796 13.231 -6.181
445 H ILE 58 H ILE 58 19.457 8.634 1.126
446 HA ILE 58 HA ILE 58 21.901 8.457 2.592
447 HB ILE 58 HB ILE 58 19.151 9.137 3.639
448 HG12 ILE 58 1HG1 ILE 58 19.724 10.611 1.789
449 HG13 ILE 58 2HG1 ILE 58 19.841 11.493 3.308
450 HG21 ILE 58 1HG2 ILE 58 21.710 8.865 4.894
451 HG22 ILE 58 2HG2 ILE 58 21.175 10.542 4.990
452 HG23 ILE 58 3HG2 ILE 58 20.149 9.252 5.618
453 HD11 ILE 58 3HD1 ILE 58 21.858 12.133 2.671
454 HD12 ILE 58 1HD1 ILE 58 22.388 10.464 2.879
455 HD13 ILE 58 2HD1 ILE 58 21.840 11.026 1.298
456 H SER 59 H SER 59 18.830 6.715 2.652
457 HA SER 59 HA SER 59 19.267 5.211 4.975
458 HB2 SER 59 1HB SER 59 17.089 5.414 3.742
459 HB3 SER 59 2HB SER 59 17.732 4.310 2.527
460 HG SER 59 HG SER 59 16.440 3.351 4.272
461 H GLN 60 H GLN 60 20.155 4.603 1.609
462 HA GLN 60 HA GLN 60 21.196 1.994 2.080
463 HB2 GLN 60 1HB GLN 60 20.428 3.028 -0.146
464 HB3 GLN 60 2HB GLN 60 22.013 3.787 -0.194
465 HG2 GLN 60 1HG GLN 60 21.622 0.822 0.082
466 HG3 GLN 60 2HG GLN 60 21.779 1.639 -1.472
467 HE21 GLN 60 2HE2 GLN 60 23.439 -0.188 0.518
468 HE22 GLN 60 1HE2 GLN 60 25.032 0.452 0.327
469 H ALA 61 H ALA 61 22.588 5.229 1.987
470 HA ALA 61 HA ALA 61 25.301 4.433 2.115
471 HB1 ALA 61 1HB ALA 61 24.155 6.760 1.596
472 HB2 ALA 61 2HB ALA 61 24.460 7.016 3.314
473 HB3 ALA 61 3HB ALA 61 25.799 6.655 2.226
474 H LYS 62 H LYS 62 22.860 5.084 4.564
475 HA LYS 62 HA LYS 62 24.647 5.022 6.782
476 HB2 LYS 62 1HB LYS 62 21.653 4.632 6.632
477 HB3 LYS 62 2HB LYS 62 22.561 4.783 8.130
478 HG2 LYS 62 1HG LYS 62 22.984 7.021 7.809
479 HG3 LYS 62 2HG LYS 62 22.781 6.917 6.059
480 HD2 LYS 62 1HD LYS 62 20.538 7.180 6.173
481 HD3 LYS 62 2HD LYS 62 20.400 6.257 7.671
482 HE2 LYS 62 1HE LYS 62 21.427 9.084 7.439
483 HE3 LYS 62 2HE LYS 62 19.812 8.624 7.977
484 HZ1 LYS 62 3HZ LYS 62 21.816 7.246 9.449
485 HZ2 LYS 62 1HZ LYS 62 20.570 8.244 10.011
486 HZ3 LYS 62 2HZ LYS 62 22.049 8.919 9.546
487 H LEU 63 H LEU 63 22.795 2.612 5.043
488 HA LEU 63 HA LEU 63 23.051 0.525 6.942
489 HB2 LEU 63 1HB LEU 63 21.515 0.774 4.842
490 HB3 LEU 63 2HB LEU 63 22.861 -0.001 4.009
491 HG LEU 63 HG LEU 63 21.562 -1.236 6.422
492 HD11 LEU 63 1HD1 LEU 63 20.829 -2.242 3.755
493 HD12 LEU 63 2HD1 LEU 63 20.118 -0.695 4.213
494 HD13 LEU 63 3HD1 LEU 63 19.868 -2.115 5.228
495 HD21 LEU 63 3HD2 LEU 63 23.328 -2.579 6.131
496 HD22 LEU 63 1HD2 LEU 63 23.654 -1.956 4.513
497 HD23 LEU 63 2HD2 LEU 63 22.437 -3.211 4.746
498 H LEU 64 H LEU 64 24.864 1.277 3.973
499 HA LEU 64 HA LEU 64 26.734 -0.835 4.299
500 HB2 LEU 64 1HB LEU 64 27.858 0.055 2.448
501 HB3 LEU 64 2HB LEU 64 26.153 0.401 2.166
502 HG LEU 64 HG LEU 64 26.841 2.715 3.288
503 HD11 LEU 64 1HD1 LEU 64 29.053 2.694 3.706
504 HD12 LEU 64 2HD1 LEU 64 29.170 3.097 1.994
505 HD13 LEU 64 3HD1 LEU 64 29.377 1.427 2.522
506 HD21 LEU 64 3HD2 LEU 64 26.873 3.644 1.128
507 HD22 LEU 64 1HD2 LEU 64 25.885 2.189 0.992
508 HD23 LEU 64 2HD2 LEU 64 27.553 2.179 0.417
509 H LEU 65 H LEU 65 26.696 2.561 5.231
510 HA LEU 65 HA LEU 65 29.391 2.745 6.043
511 HB2 LEU 65 1HB LEU 65 26.905 4.292 6.633
512 HB3 LEU 65 2HB LEU 65 28.372 4.616 7.554
513 HG LEU 65 HG LEU 65 28.156 4.811 4.551
514 HD11 LEU 65 1HD1 LEU 65 28.162 7.006 6.617
515 HD12 LEU 65 2HD1 LEU 65 26.763 6.487 5.677
516 HD13 LEU 65 3HD1 LEU 65 28.150 7.215 4.866
517 HD21 LEU 65 3HD2 LEU 65 30.284 6.239 5.083
518 HD22 LEU 65 1HD2 LEU 65 30.396 4.485 4.938
519 HD23 LEU 65 2HD2 LEU 65 30.343 5.235 6.533
520 H SER 66 H SER 66 26.539 1.483 7.584
521 HA SER 66 HA SER 66 27.541 1.482 10.246
522 HB2 SER 66 1HB SER 66 25.220 0.275 8.829
523 HB3 SER 66 2HB SER 66 25.701 -0.462 10.357
524 HG SER 66 HG SER 66 25.538 1.645 11.295
525 H THR 67 H THR 67 28.218 -0.413 7.513
526 HA THR 67 HA THR 67 29.526 -2.442 9.206
527 HB THR 67 HB THR 67 27.695 -3.491 8.009
528 HG1 THR 67 HG1 THR 67 29.145 -5.037 7.938
529 HG21 THR 67 3HG2 THR 67 27.514 -3.489 5.613
530 HG22 THR 67 1HG2 THR 67 29.019 -2.586 5.452
531 HG23 THR 67 2HG2 THR 67 27.599 -1.815 6.158
532 H THR 68 H THR 68 30.109 0.148 7.335
533 HA THR 68 HA THR 68 32.745 -0.875 6.530
534 HB THR 68 HB THR 68 32.694 0.339 4.453
535 HG1 THR 68 HG1 THR 68 31.461 2.113 4.823
536 HG21 THR 68 3HG2 THR 68 31.665 -1.369 3.461
537 HG22 THR 68 1HG2 THR 68 30.089 -0.767 3.973
538 HG23 THR 68 2HG2 THR 68 31.009 -1.839 5.029
539 H ARG 69 H ARG 69 34.356 0.850 6.207
540 HA ARG 69 HA ARG 69 33.783 3.209 7.879
541 HB2 ARG 69 1HB ARG 69 36.199 3.122 8.548
542 HB3 ARG 69 2HB ARG 69 35.227 1.783 9.144
543 HG2 ARG 69 1HG ARG 69 36.688 1.436 6.579
544 HG3 ARG 69 2HG ARG 69 37.603 1.398 8.088
545 HD2 ARG 69 1HD ARG 69 35.684 -0.248 8.819
546 HD3 ARG 69 2HD ARG 69 35.513 -0.470 7.079
547 HE ARG 69 HE ARG 69 38.224 -0.723 7.917
548 HH11 ARG 69 2HH1 ARG 69 35.177 -2.401 7.766
549 HH12 ARG 69 1HH1 ARG 69 35.897 -3.976 7.739
550 HH21 ARG 69 2HH2 ARG 69 39.184 -2.791 7.882
551 HH22 ARG 69 1HH2 ARG 69 38.177 -4.197 7.807
552 H MET 70 H MET 70 33.860 2.612 4.873
553 HA MET 70 HA MET 70 36.053 3.972 3.746
554 HB2 MET 70 1HB MET 70 33.283 3.354 2.743
555 HB3 MET 70 2HB MET 70 34.435 4.257 1.767
556 HG2 MET 70 1HG MET 70 35.944 2.420 1.706
557 HG3 MET 70 2HG MET 70 35.003 1.535 2.904
558 HE1 MET 70 3HE MET 70 32.763 0.058 2.239
559 HE2 MET 70 1HE MET 70 32.204 1.731 2.295
560 HE3 MET 70 2HE MET 70 31.745 0.693 0.945
561 HA PRO 71 HA PRO 71 35.185 8.232 4.340
562 HB2 PRO 71 1HB PRO 71 36.039 9.302 1.996
563 HB3 PRO 71 2HB PRO 71 37.144 8.675 3.224
564 HG2 PRO 71 1HG PRO 71 36.163 7.370 0.715
565 HG3 PRO 71 2HG PRO 71 37.800 7.394 1.397
566 HD2 PRO 71 1HD PRO 71 36.139 5.273 1.669
567 HD3 PRO 71 2HD PRO 71 37.331 5.718 2.908
568 H ILE 72 H ILE 72 33.781 9.938 3.785
569 HA ILE 72 HA ILE 72 31.272 9.270 2.852
570 HB ILE 72 HB ILE 72 32.550 12.007 2.778
571 HG12 ILE 72 1HG1 ILE 72 30.719 10.907 4.904
572 HG13 ILE 72 2HG1 ILE 72 32.465 10.713 4.998
573 HG21 ILE 72 1HG2 ILE 72 29.642 11.209 2.757
574 HG22 ILE 72 2HG2 ILE 72 30.258 12.858 2.849
575 HG23 ILE 72 3HG2 ILE 72 30.542 11.890 1.402
576 HD11 ILE 72 3HD1 ILE 72 31.028 13.350 4.821
577 HD12 ILE 72 1HD1 ILE 72 31.643 12.619 6.303
578 HD13 ILE 72 2HD1 ILE 72 32.762 13.106 5.030
579 H ALA 73 H ALA 73 34.081 10.313 1.058
580 HA ALA 73 HA ALA 73 32.764 10.962 -1.365
581 HB1 ALA 73 1HB ALA 73 34.981 11.782 -0.971
582 HB2 ALA 73 2HB ALA 73 35.612 10.142 -0.817
583 HB3 ALA 73 3HB ALA 73 35.025 10.718 -2.377
584 H THR 74 H THR 74 34.393 8.010 -0.241
585 HA THR 74 HA THR 74 33.946 6.516 -2.599
586 HB THR 74 HB THR 74 34.420 5.550 0.227
587 HG1 THR 74 HG1 THR 74 36.569 5.153 -0.889
588 HG21 THR 74 3HG2 THR 74 34.530 4.077 -2.406
589 HG22 THR 74 1HG2 THR 74 33.425 3.771 -1.067
590 HG23 THR 74 2HG2 THR 74 35.148 3.446 -0.880
591 H VAL 75 H VAL 75 32.123 6.852 0.410
592 HA VAL 75 HA VAL 75 30.193 4.859 -0.169
593 HB VAL 75 HB VAL 75 30.002 7.260 1.654
594 HG11 VAL 75 1HG1 VAL 75 28.310 5.316 2.626
595 HG12 VAL 75 2HG1 VAL 75 27.826 6.768 1.749
596 HG13 VAL 75 3HG1 VAL 75 28.048 5.247 0.884
597 HG21 VAL 75 3HG2 VAL 75 30.179 4.709 2.961
598 HG22 VAL 75 1HG2 VAL 75 31.535 4.922 1.854
599 HG23 VAL 75 2HG2 VAL 75 31.229 6.117 3.114
600 H GLY 76 H GLY 76 30.254 8.374 -0.651
601 HA2 GLY 76 1HA GLY 76 27.641 8.733 -1.545
602 HA3 GLY 76 2HA GLY 76 29.007 9.733 -2.016
603 H ARG 77 H ARG 77 30.537 7.868 -3.402
604 HA ARG 77 HA ARG 77 29.417 7.981 -5.952
605 HB2 ARG 77 1HB ARG 77 31.682 6.401 -4.772
606 HB3 ARG 77 2HB ARG 77 31.201 6.160 -6.446
607 HG2 ARG 77 1HG ARG 77 31.887 8.263 -7.089
608 HG3 ARG 77 2HG ARG 77 31.760 8.917 -5.454
609 HD2 ARG 77 1HD ARG 77 33.652 7.118 -4.993
610 HD3 ARG 77 2HD ARG 77 33.945 7.349 -6.717
611 HE ARG 77 HE ARG 77 34.514 9.202 -4.601
612 HH11 ARG 77 2HH1 ARG 77 33.810 8.876 -7.994
613 HH12 ARG 77 1HH1 ARG 77 34.580 10.365 -8.431
614 HH21 ARG 77 2HH2 ARG 77 35.532 11.165 -5.163
615 HH22 ARG 77 1HH2 ARG 77 35.560 11.666 -6.820
616 H ASN 78 H ASN 78 29.301 5.462 -3.510
617 HA ASN 78 HA ASN 78 28.233 3.432 -5.182
618 HB2 ASN 78 1HB ASN 78 27.810 3.630 -2.202
619 HB3 ASN 78 2HB ASN 78 27.895 2.177 -3.194
620 HD21 ASN 78 2HD2 ASN 78 29.413 2.711 -0.856
621 HD22 ASN 78 1HD2 ASN 78 31.079 2.747 -1.314
622 H VAL 79 H VAL 79 26.895 6.250 -3.850
623 HA VAL 79 HA VAL 79 24.157 5.208 -4.138
624 HB VAL 79 HB VAL 79 24.352 7.889 -3.029
625 HG11 VAL 79 1HG1 VAL 79 22.450 6.131 -3.022
626 HG12 VAL 79 2HG1 VAL 79 23.297 5.466 -1.624
627 HG13 VAL 79 3HG1 VAL 79 22.703 7.127 -1.589
628 HG21 VAL 79 3HG2 VAL 79 25.817 5.650 -1.647
629 HG22 VAL 79 1HG2 VAL 79 26.442 7.234 -2.106
630 HG23 VAL 79 2HG2 VAL 79 25.247 7.097 -0.816
631 H GLY 80 H GLY 80 26.435 6.825 -5.862
632 HA2 GLY 80 1HA GLY 80 26.059 7.691 -8.027
633 HA3 GLY 80 2HA GLY 80 24.391 8.018 -7.581
634 H PHE 81 H PHE 81 27.038 8.957 -5.518
635 HA PHE 81 HA PHE 81 26.400 11.769 -6.091
636 HB2 PHE 81 1HB PHE 81 27.485 10.389 -3.642
637 HB3 PHE 81 2HB PHE 81 27.589 12.135 -3.844
638 HD1 PHE 81 HD1 PHE 81 25.015 9.453 -4.204
639 HD2 PHE 81 HD2 PHE 81 25.957 13.366 -2.821
640 HE1 PHE 81 HE1 PHE 81 22.732 9.686 -3.319
641 HE2 PHE 81 HE2 PHE 81 23.676 13.605 -1.933
642 HZ PHE 81 HZ PHE 81 22.059 11.764 -2.181
643 H ASP 82 H ASP 82 27.803 12.824 -7.311
644 HA ASP 82 HA ASP 82 30.453 11.803 -7.782
645 HB2 ASP 82 1HB ASP 82 28.847 14.106 -8.837
646 HB3 ASP 82 2HB ASP 82 30.584 14.042 -9.127
647 H ASP 83 H ASP 83 28.995 14.358 -5.900
648 HA ASP 83 HA ASP 83 31.672 15.217 -5.023
649 HB2 ASP 83 1HB ASP 83 29.117 16.773 -4.638
650 HB3 ASP 83 2HB ASP 83 30.774 17.355 -4.503
651 H GLN 84 H GLN 84 32.272 14.501 -3.098
652 HA GLN 84 HA GLN 84 30.570 13.123 -1.332
653 HB2 GLN 84 1HB GLN 84 32.436 12.938 0.111
654 HB3 GLN 84 2HB GLN 84 33.092 12.922 -1.520
655 HG2 GLN 84 1HG GLN 84 33.456 15.430 -1.203
656 HG3 GLN 84 2HG GLN 84 33.180 15.121 0.510
657 HE21 GLN 84 2HE2 GLN 84 34.762 14.218 1.711
658 HE22 GLN 84 1HE2 GLN 84 36.324 13.796 1.103
659 H LEU 85 H LEU 85 31.540 16.477 -1.529
660 HA LEU 85 HA LEU 85 30.698 17.272 1.049
661 HB2 LEU 85 1HB LEU 85 31.217 18.701 -1.525
662 HB3 LEU 85 2HB LEU 85 30.492 19.561 -0.169
663 HG LEU 85 HG LEU 85 32.876 19.963 -0.244
664 HD11 LEU 85 1HD1 LEU 85 31.451 18.994 1.970
665 HD12 LEU 85 2HD1 LEU 85 32.888 20.016 1.971
666 HD13 LEU 85 3HD1 LEU 85 33.053 18.263 2.054
667 HD21 LEU 85 3HD2 LEU 85 34.483 18.377 -0.464
668 HD22 LEU 85 1HD2 LEU 85 33.172 17.522 -1.276
669 HD23 LEU 85 2HD2 LEU 85 33.555 17.155 0.407
670 H TYR 86 H TYR 86 29.047 17.046 -2.055
671 HA TYR 86 HA TYR 86 26.694 18.399 -1.395
672 HB2 TYR 86 1HB TYR 86 27.002 17.897 -3.674
673 HB3 TYR 86 2HB TYR 86 27.305 16.194 -3.349
674 HD1 TYR 86 HD1 TYR 86 24.518 18.363 -2.162
675 HD2 TYR 86 HD2 TYR 86 25.682 15.054 -4.571
676 HE1 TYR 86 HE1 TYR 86 22.152 17.863 -2.606
677 HE2 TYR 86 HE2 TYR 86 23.318 14.546 -5.023
678 HH TYR 86 HH TYR 86 20.898 16.571 -4.660
679 H PHE 87 H PHE 87 27.469 14.938 -1.143
680 HA PHE 87 HA PHE 87 25.042 14.013 -0.191
681 HB2 PHE 87 1HB PHE 87 26.742 12.442 -0.803
682 HB3 PHE 87 2HB PHE 87 27.853 13.084 0.403
683 HD1 PHE 87 HD2 PHE 87 24.660 11.257 -0.018
684 HD2 PHE 87 HD1 PHE 87 27.886 12.235 2.582
685 HE1 PHE 87 HE2 PHE 87 23.856 9.589 1.602
686 HE2 PHE 87 HE1 PHE 87 27.087 10.567 4.205
687 HZ PHE 87 HZ PHE 87 25.069 9.243 3.717
688 H SER 88 H SER 88 27.638 15.639 1.519
689 HA SER 88 HA SER 88 26.719 15.137 4.145
690 HB2 SER 88 1HB SER 88 28.443 16.486 4.836
691 HB3 SER 88 2HB SER 88 28.994 16.159 3.193
692 HG SER 88 HG SER 88 28.280 18.506 4.319
693 H ARG 89 H ARG 89 26.032 17.673 1.801
694 HA ARG 89 HA ARG 89 24.637 19.417 3.509
695 HB2 ARG 89 1HB ARG 89 24.016 19.042 0.585
696 HB3 ARG 89 2HB ARG 89 23.866 20.505 1.549
697 HG2 ARG 89 1HG ARG 89 26.396 19.173 0.619
698 HG3 ARG 89 2HG ARG 89 25.764 20.750 0.141
699 HD2 ARG 89 1HD ARG 89 26.048 21.540 2.455
700 HD3 ARG 89 2HD ARG 89 26.727 19.973 2.892
701 HE ARG 89 HE ARG 89 28.261 20.863 0.801
702 HH11 ARG 89 2HH1 ARG 89 27.405 22.054 3.959
703 HH12 ARG 89 1HH1 ARG 89 28.888 22.921 4.178
704 HH21 ARG 89 2HH2 ARG 89 30.219 22.001 1.078
705 HH22 ARG 89 1HH2 ARG 89 30.488 22.891 2.538
706 H VAL 90 H VAL 90 23.432 16.884 1.314
707 HA VAL 90 HA VAL 90 20.715 17.176 2.106
708 HB VAL 90 HB VAL 90 22.104 14.878 0.723
709 HG11 VAL 90 1HG1 VAL 90 19.736 14.336 -0.014
710 HG12 VAL 90 2HG1 VAL 90 20.144 13.966 1.663
711 HG13 VAL 90 3HG1 VAL 90 19.198 15.405 1.280
712 HG21 VAL 90 3HG2 VAL 90 20.434 17.143 -0.366
713 HG22 VAL 90 1HG2 VAL 90 22.180 16.962 -0.537
714 HG23 VAL 90 2HG2 VAL 90 21.094 15.806 -1.308
715 H PHE 91 H PHE 91 23.269 14.863 2.961
716 HA PHE 91 HA PHE 91 21.722 13.235 4.642
717 HB2 PHE 91 1HB PHE 91 23.956 12.609 3.783
718 HB3 PHE 91 2HB PHE 91 24.684 13.822 4.831
719 HD1 PHE 91 HD2 PHE 91 24.491 13.554 7.316
720 HD2 PHE 91 HD1 PHE 91 23.420 10.471 4.584
721 HE1 PHE 91 HE2 PHE 91 24.635 11.900 9.132
722 HE2 PHE 91 HE1 PHE 91 23.562 8.812 6.396
723 HZ PHE 91 HZ PHE 91 24.171 9.525 8.673
724 H LYS 92 H LYS 92 23.466 16.226 5.239
725 HA LYS 92 HA LYS 92 23.420 16.245 8.028
726 HB2 LYS 92 1HB LYS 92 24.731 17.862 6.819
727 HB3 LYS 92 2HB LYS 92 23.295 18.523 6.048
728 HG2 LYS 92 1HG LYS 92 22.618 19.632 7.951
729 HG3 LYS 92 2HG LYS 92 23.530 18.567 9.023
730 HD2 LYS 92 1HD LYS 92 25.580 19.592 8.463
731 HD3 LYS 92 2HD LYS 92 24.876 20.413 7.067
732 HE2 LYS 92 1HE LYS 92 23.825 22.003 8.367
733 HE3 LYS 92 2HE LYS 92 23.799 20.969 9.795
734 HZ1 LYS 92 3HZ LYS 92 25.668 22.934 9.124
735 HZ2 LYS 92 1HZ LYS 92 26.468 21.444 9.087
736 HZ3 LYS 92 2HZ LYS 92 25.652 21.931 10.486
737 H LYS 93 H LYS 93 21.044 17.539 5.721
738 HA LYS 93 HA LYS 93 19.221 18.338 7.784
739 HB2 LYS 93 1HB LYS 93 17.972 19.274 6.112
740 HB3 LYS 93 2HB LYS 93 19.517 19.170 5.278
741 HG2 LYS 93 1HG LYS 93 18.606 16.828 4.534
742 HG3 LYS 93 2HG LYS 93 17.042 17.561 4.898
743 HD2 LYS 93 1HD LYS 93 17.549 19.406 3.375
744 HD3 LYS 93 2HD LYS 93 19.122 18.687 3.021
745 HE2 LYS 93 1HE LYS 93 17.725 18.058 1.234
746 HE3 LYS 93 2HE LYS 93 17.846 16.630 2.261
747 HZ1 LYS 93 3HZ LYS 93 15.567 18.489 1.968
748 HZ2 LYS 93 1HZ LYS 93 15.703 17.462 3.306
749 HZ3 LYS 93 2HZ LYS 93 15.594 16.812 1.748
750 H CYS 94 H CYS 94 19.804 15.452 5.976
751 HA CYS 94 HA CYS 94 17.325 14.204 6.053
752 HB2 CYS 94 1HB CYS 94 19.444 13.392 4.913
753 HB3 CYS 94 2HB CYS 94 19.952 12.781 6.482
754 HG CYS 94 HG CYS 94 18.256 10.748 6.658
755 H THR 95 H THR 95 19.935 14.084 8.469
756 HA THR 95 HA THR 95 17.982 13.032 10.408
757 HB THR 95 HB THR 95 19.923 12.216 11.706
758 HG1 THR 95 HG1 THR 95 21.482 12.905 9.425
759 HG21 THR 95 3HG2 THR 95 18.754 10.823 9.956
760 HG22 THR 95 1HG2 THR 95 20.400 10.323 10.343
761 HG23 THR 95 2HG2 THR 95 20.078 11.226 8.863
762 H GLY 96 H GLY 96 19.677 15.784 9.535
763 HA2 GLY 96 1HA GLY 96 19.378 17.862 10.631
764 HA3 GLY 96 2HA GLY 96 19.093 17.000 12.136
765 H ALA 97 H ALA 97 21.649 15.440 10.980
766 HA ALA 97 HA ALA 97 23.645 17.392 11.879
767 HB1 ALA 97 1HB ALA 97 24.003 14.614 12.838
768 HB2 ALA 97 2HB ALA 97 24.452 16.144 13.593
769 HB3 ALA 97 3HB ALA 97 22.776 15.594 13.642
770 H SER 98 H SER 98 25.812 16.915 11.208
771 HA SER 98 HA SER 98 25.981 15.935 8.570
772 HB2 SER 98 1HB SER 98 28.585 15.944 9.463
773 HB3 SER 98 2HB SER 98 27.735 17.336 8.793
774 HG SER 98 HG SER 98 28.641 17.843 10.809
775 HA PRO 99 HA PRO 99 26.830 11.649 8.954
776 HB2 PRO 99 1HB PRO 99 28.828 11.259 7.158
777 HB3 PRO 99 2HB PRO 99 27.160 11.595 6.680
778 HG2 PRO 99 1HG PRO 99 29.496 13.460 6.843
779 HG3 PRO 99 2HG PRO 99 28.253 13.331 5.585
780 HD2 PRO 99 1HD PRO 99 28.188 15.236 7.509
781 HD3 PRO 99 2HD PRO 99 26.714 14.538 6.806
782 H SER 100 H SER 100 29.588 13.808 9.246
783 HA SER 100 HA SER 100 31.425 11.902 10.252
784 HB2 SER 100 1HB SER 100 32.679 13.924 11.063
785 HB3 SER 100 2HB SER 100 32.259 13.975 9.351
786 HG SER 100 HG SER 100 31.757 15.823 11.050
787 H GLU 101 H GLU 101 28.987 13.929 11.746
788 HA GLU 101 HA GLU 101 29.843 13.497 14.431
789 HB2 GLU 101 1HB GLU 101 28.263 15.333 13.399
790 HB3 GLU 101 2HB GLU 101 27.006 14.155 13.753
791 HG2 GLU 101 1HG GLU 101 28.796 15.622 15.644
792 HG3 GLU 101 2HG GLU 101 27.036 15.522 15.626
793 H PHE 102 H PHE 102 27.264 12.100 12.426
794 HA PHE 102 HA PHE 102 26.245 10.346 14.367
795 HB2 PHE 102 1HB PHE 102 25.055 10.922 12.281
796 HB3 PHE 102 2HB PHE 102 26.248 10.012 11.360
797 HD1 PHE 102 HD2 PHE 102 23.490 9.753 13.780
798 HD2 PHE 102 HD1 PHE 102 26.157 7.643 11.220
799 HE1 PHE 102 HE2 PHE 102 22.147 7.712 14.069
800 HE2 PHE 102 HE1 PHE 102 24.817 5.598 11.504
801 HZ PHE 102 HZ PHE 102 22.810 5.631 12.931
802 H ARG 103 H ARG 103 28.737 9.898 11.890
803 HA ARG 103 HA ARG 103 29.199 7.170 12.282
804 HB2 ARG 103 1HB ARG 103 30.085 8.502 10.384
805 HB3 ARG 103 2HB ARG 103 31.217 9.275 11.485
806 HG2 ARG 103 1HG ARG 103 32.543 7.654 10.575
807 HG3 ARG 103 2HG ARG 103 31.930 6.810 11.999
808 HD2 ARG 103 1HD ARG 103 30.118 5.870 10.545
809 HD3 ARG 103 2HD ARG 103 30.955 6.567 9.159
810 HE ARG 103 HE ARG 103 32.411 4.818 9.239
811 HH11 ARG 103 2HH1 ARG 103 30.901 5.143 12.359
812 HH12 ARG 103 1HH1 ARG 103 31.644 3.720 13.012
813 HH21 ARG 103 2HH2 ARG 103 33.395 2.943 10.087
814 HH22 ARG 103 1HH2 ARG 103 33.063 2.470 11.719
815 H ALA 104 H ALA 104 30.320 9.975 14.048
816 HA ALA 104 HA ALA 104 32.386 8.728 15.511
817 HB1 ALA 104 1HB ALA 104 31.180 11.292 15.394
818 HB2 ALA 104 2HB ALA 104 31.211 10.781 17.082
819 HB3 ALA 104 3HB ALA 104 32.706 10.827 16.147
820 H GLY 105 H GLY 105 28.915 8.921 15.978
821 HA2 GLY 105 1HA GLY 105 27.637 7.404 17.229
822 HA3 GLY 105 2HA GLY 105 29.106 6.858 18.025
823 H CYS 106 H CYS 106 29.486 10.013 18.255
824 HA CYS 106 HA CYS 106 28.647 10.110 20.986
825 HB2 CYS 106 1HB CYS 106 30.682 11.265 19.897
826 HB3 CYS 106 2HB CYS 106 29.535 12.494 19.378
827 HG CYS 106 HG CYS 106 31.111 12.307 22.190
828 H GLU 107 H GLU 107 26.838 10.924 21.846
829 HA GLU 107 HA GLU 107 24.721 11.750 21.990
830 HB2 GLU 107 1HB GLU 107 26.054 13.698 20.135
831 HB3 GLU 107 2HB GLU 107 24.349 13.869 20.530
832 HG2 GLU 107 1HG GLU 107 25.099 13.782 22.974
833 HG3 GLU 107 2HG GLU 107 26.722 14.066 22.346
Start of MODEL 17
1 H1 MET 1 H MET 1 4.125 -0.968 0.249
2 HA MET 1 HA MET 1 1.835 0.746 -0.269
3 HB2 MET 1 1HB MET 1 3.085 1.649 -2.073
4 HB3 MET 1 2HB MET 1 4.224 1.427 -0.751
5 HG2 MET 1 1HG MET 1 4.344 -0.955 -2.160
6 HG3 MET 1 2HG MET 1 4.220 0.287 -3.405
7 HE1 MET 1 3HE MET 1 6.849 2.489 -3.284
8 HE2 MET 1 1HE MET 1 5.222 2.581 -2.608
9 HE3 MET 1 2HE MET 1 6.626 2.745 -1.553
10 H ASP 2 H ASP 2 1.485 0.664 -2.933
11 HA ASP 2 HA ASP 2 0.023 -1.790 -3.279
12 HB2 ASP 2 1HB ASP 2 -0.515 0.687 -4.083
13 HB3 ASP 2 2HB ASP 2 0.355 0.151 -5.518
14 H ASN 3 H ASN 3 0.317 -3.335 -4.905
15 HA ASN 3 HA ASN 3 2.921 -4.158 -5.404
16 HB2 ASN 3 1HB ASN 3 0.327 -4.820 -6.797
17 HB3 ASN 3 2HB ASN 3 1.849 -5.603 -7.211
18 HD21 ASN 3 2HD2 ASN 3 -0.868 -6.064 -5.572
19 HD22 ASN 3 1HD2 ASN 3 -0.310 -7.086 -4.296
20 H ARG 4 H ARG 4 0.712 -2.310 -7.467
21 HA ARG 4 HA ARG 4 2.344 -2.215 -9.750
22 HB2 ARG 4 1HB ARG 4 0.413 -0.066 -8.874
23 HB3 ARG 4 2HB ARG 4 0.926 -0.439 -10.514
24 HG2 ARG 4 1HG ARG 4 -0.151 -2.713 -10.174
25 HG3 ARG 4 2HG ARG 4 -0.888 -2.024 -8.727
26 HD2 ARG 4 1HD ARG 4 -2.123 -0.464 -9.961
27 HD3 ARG 4 2HD ARG 4 -1.120 -0.675 -11.396
28 HE ARG 4 HE ARG 4 -2.436 -2.440 -12.007
29 HH11 ARG 4 2HH1 ARG 4 -2.972 -1.742 -8.638
30 HH12 ARG 4 1HH1 ARG 4 -4.291 -2.855 -8.483
31 HH21 ARG 4 2HH2 ARG 4 -4.172 -3.908 -11.815
32 HH22 ARG 4 1HH2 ARG 4 -4.972 -4.087 -10.290
33 H VAL 5 H VAL 5 2.054 0.004 -6.997
34 HA VAL 5 HA VAL 5 3.921 1.905 -7.956
35 HB VAL 5 HB VAL 5 3.079 1.333 -5.111
36 HG11 VAL 5 1HG1 VAL 5 5.114 3.027 -6.130
37 HG12 VAL 5 2HG1 VAL 5 3.800 4.045 -5.538
38 HG13 VAL 5 3HG1 VAL 5 4.551 2.862 -4.467
39 HG21 VAL 5 3HG2 VAL 5 1.869 3.661 -5.858
40 HG22 VAL 5 1HG2 VAL 5 1.805 2.724 -7.351
41 HG23 VAL 5 2HG2 VAL 5 1.101 2.073 -5.871
42 H ARG 6 H ARG 6 4.218 -0.945 -5.895
43 HA ARG 6 HA ARG 6 6.811 -0.601 -4.971
44 HB2 ARG 6 1HB ARG 6 5.169 -2.407 -4.312
45 HB3 ARG 6 2HB ARG 6 5.620 -3.252 -5.786
46 HG2 ARG 6 1HG ARG 6 7.127 -4.267 -4.487
47 HG3 ARG 6 2HG ARG 6 8.054 -2.778 -4.677
48 HD2 ARG 6 1HD ARG 6 7.548 -2.031 -2.572
49 HD3 ARG 6 2HD ARG 6 6.020 -2.909 -2.512
50 HE ARG 6 HE ARG 6 8.185 -4.723 -2.549
51 HH11 ARG 6 2HH1 ARG 6 6.563 -2.450 -0.470
52 HH12 ARG 6 1HH1 ARG 6 7.000 -3.275 0.990
53 HH21 ARG 6 2HH2 ARG 6 8.767 -5.818 -0.635
54 HH22 ARG 6 1HH2 ARG 6 8.254 -5.190 0.895
55 H GLU 7 H GLU 7 5.660 -1.742 -8.085
56 HA GLU 7 HA GLU 7 8.105 -2.759 -9.052
57 HB2 GLU 7 1HB GLU 7 5.504 -1.966 -10.223
58 HB3 GLU 7 2HB GLU 7 6.875 -1.977 -11.325
59 HG2 GLU 7 1HG GLU 7 5.926 -4.288 -9.647
60 HG3 GLU 7 2HG GLU 7 5.697 -4.092 -11.384
61 H ALA 8 H ALA 8 6.701 0.465 -9.053
62 HA ALA 8 HA ALA 8 8.501 1.691 -10.831
63 HB1 ALA 8 1HB ALA 8 6.541 2.883 -10.343
64 HB2 ALA 8 2HB ALA 8 6.796 2.760 -8.602
65 HB3 ALA 8 3HB ALA 8 7.833 3.805 -9.574
66 H CYS 9 H CYS 9 8.631 1.162 -7.340
67 HA CYS 9 HA CYS 9 10.885 2.727 -6.780
68 HB2 CYS 9 1HB CYS 9 9.514 1.906 -4.981
69 HB3 CYS 9 2HB CYS 9 9.826 0.236 -5.436
70 HG CYS 9 HG CYS 9 12.703 1.682 -4.873
71 H GLN 10 H GLN 10 10.574 -0.546 -8.008
72 HA GLN 10 HA GLN 10 13.248 -1.355 -7.659
73 HB2 GLN 10 1HB GLN 10 11.096 -2.223 -9.581
74 HB3 GLN 10 2HB GLN 10 12.691 -2.965 -9.561
75 HG2 GLN 10 1HG GLN 10 10.966 -2.807 -7.111
76 HG3 GLN 10 2HG GLN 10 10.851 -4.132 -8.268
77 HE21 GLN 10 2HE2 GLN 10 11.965 -5.851 -7.726
78 HE22 GLN 10 1HE2 GLN 10 13.430 -5.877 -6.811
79 H TYR 11 H TYR 11 11.596 0.221 -10.368
80 HA TYR 11 HA TYR 11 13.856 0.237 -12.087
81 HB2 TYR 11 1HB TYR 11 11.634 0.445 -13.018
82 HB3 TYR 11 2HB TYR 11 11.337 1.911 -12.089
83 HD1 TYR 11 HD1 TYR 11 13.698 0.555 -14.648
84 HD2 TYR 11 HD2 TYR 11 11.659 3.961 -13.115
85 HE1 TYR 11 HE1 TYR 11 14.558 1.904 -16.516
86 HE2 TYR 11 HE2 TYR 11 12.512 5.318 -14.980
87 HH TYR 11 HH TYR 11 14.190 5.356 -16.612
88 H ILE 12 H ILE 12 12.420 2.680 -9.949
89 HA ILE 12 HA ILE 12 14.192 4.769 -10.550
90 HB ILE 12 HB ILE 12 12.711 4.221 -7.975
91 HG12 ILE 12 1HG1 ILE 12 12.018 6.081 -10.258
92 HG13 ILE 12 2HG1 ILE 12 11.319 4.480 -10.040
93 HG21 ILE 12 1HG2 ILE 12 13.017 6.909 -8.079
94 HG22 ILE 12 2HG2 ILE 12 14.074 5.822 -7.180
95 HG23 ILE 12 3HG2 ILE 12 14.538 6.372 -8.790
96 HD11 ILE 12 3HD1 ILE 12 9.765 5.353 -8.741
97 HD12 ILE 12 1HD1 ILE 12 11.008 5.884 -7.608
98 HD13 ILE 12 2HD1 ILE 12 10.496 6.948 -8.919
99 H SER 13 H SER 13 14.413 2.103 -8.264
100 HA SER 13 HA SER 13 16.596 2.978 -6.760
101 HB2 SER 13 1HB SER 13 16.785 0.766 -5.977
102 HB3 SER 13 2HB SER 13 15.080 0.922 -6.400
103 HG SER 13 HG SER 13 16.687 -0.908 -7.248
104 H ASP 14 H ASP 14 16.498 1.111 -9.772
105 HA ASP 14 HA ASP 14 19.301 0.761 -9.986
106 HB2 ASP 14 1HB ASP 14 17.299 -0.418 -11.232
107 HB3 ASP 14 2HB ASP 14 17.556 0.863 -12.413
108 H HIS 15 H HIS 15 17.112 3.308 -10.947
109 HA HIS 15 HA HIS 15 19.219 4.690 -12.422
110 HB2 HIS 15 1HB HIS 15 16.261 5.122 -12.106
111 HB3 HIS 15 2HB HIS 15 17.294 6.397 -12.746
112 HD1 HIS 15 HD1 HIS 15 17.187 6.429 -15.204
113 HD2 HIS 15 HD2 HIS 15 16.954 2.559 -13.713
114 HE1 HIS 15 HE1 HIS 15 17.017 4.940 -17.223
115 H LEU 16 H LEU 16 18.994 4.297 -9.388
116 HA LEU 16 HA LEU 16 18.534 6.825 -8.216
117 HB2 LEU 16 1HB LEU 16 18.526 4.720 -6.958
118 HB3 LEU 16 2HB LEU 16 20.257 4.551 -7.239
119 HG LEU 16 HG LEU 16 20.286 6.917 -6.019
120 HD11 LEU 16 1HD1 LEU 16 18.294 7.487 -5.212
121 HD12 LEU 16 2HD1 LEU 16 18.476 6.159 -4.066
122 HD13 LEU 16 3HD1 LEU 16 17.610 5.904 -5.581
123 HD21 LEU 16 3HD2 LEU 16 20.047 4.272 -4.589
124 HD22 LEU 16 1HD2 LEU 16 20.800 5.735 -3.954
125 HD23 LEU 16 2HD2 LEU 16 21.510 4.908 -5.341
126 H ALA 17 H ALA 17 21.267 5.434 -9.836
127 HA ALA 17 HA ALA 17 23.055 7.551 -8.919
128 HB1 ALA 17 1HB ALA 17 23.387 4.887 -10.044
129 HB2 ALA 17 2HB ALA 17 24.456 6.084 -10.776
130 HB3 ALA 17 3HB ALA 17 24.477 5.835 -9.031
131 H ASP 18 H ASP 18 21.042 6.762 -11.587
132 HA ASP 18 HA ASP 18 22.348 8.140 -13.657
133 HB2 ASP 18 1HB ASP 18 20.227 6.565 -13.647
134 HB3 ASP 18 2HB ASP 18 19.363 8.095 -13.525
135 H SER 19 H SER 19 22.438 10.237 -14.241
136 HA SER 19 HA SER 19 21.670 12.216 -12.310
137 HB2 SER 19 1HB SER 19 22.722 12.737 -15.093
138 HB3 SER 19 2HB SER 19 22.842 13.781 -13.677
139 HG SER 19 HG SER 19 24.199 12.183 -12.732
140 H ASN 20 H ASN 20 20.771 11.565 -15.694
141 HA ASN 20 HA ASN 20 18.580 13.463 -15.526
142 HB2 ASN 20 1HB ASN 20 19.281 11.634 -17.829
143 HB3 ASN 20 2HB ASN 20 18.280 13.082 -17.881
144 HD21 ASN 20 2HD2 ASN 20 21.091 12.000 -18.872
145 HD22 ASN 20 1HD2 ASN 20 22.067 13.420 -18.753
146 H PHE 21 H PHE 21 17.088 12.594 -14.128
147 HA PHE 21 HA PHE 21 16.186 9.872 -14.396
148 HB2 PHE 21 1HB PHE 21 16.220 10.817 -12.184
149 HB3 PHE 21 2HB PHE 21 15.223 12.176 -12.695
150 HD1 PHE 21 HD2 PHE 21 14.857 8.515 -13.271
151 HD2 PHE 21 HD1 PHE 21 13.240 12.047 -11.532
152 HE1 PHE 21 HE2 PHE 21 12.836 7.268 -12.627
153 HE2 PHE 21 HE1 PHE 21 11.216 10.806 -10.884
154 HZ PHE 21 HZ PHE 21 11.012 8.414 -11.432
155 H ASP 22 H ASP 22 14.370 9.134 -15.366
156 HA ASP 22 HA ASP 22 12.720 11.119 -16.790
157 HB2 ASP 22 1HB ASP 22 14.243 9.255 -17.991
158 HB3 ASP 22 2HB ASP 22 12.774 8.313 -17.752
159 H ILE 23 H ILE 23 11.044 11.366 -15.385
160 HA ILE 23 HA ILE 23 9.866 9.384 -13.816
161 HB ILE 23 HB ILE 23 9.501 11.840 -13.553
162 HG12 ILE 23 1HG1 ILE 23 6.989 11.589 -13.065
163 HG13 ILE 23 2HG1 ILE 23 7.160 9.946 -13.674
164 HG21 ILE 23 1HG2 ILE 23 9.084 12.294 -15.955
165 HG22 ILE 23 2HG2 ILE 23 7.518 11.499 -15.797
166 HG23 ILE 23 3HG2 ILE 23 7.853 12.974 -14.890
167 HD11 ILE 23 3HD1 ILE 23 8.343 11.178 -11.223
168 HD12 ILE 23 1HD1 ILE 23 7.373 9.714 -11.381
169 HD13 ILE 23 2HD1 ILE 23 9.045 9.730 -11.945
170 H ALA 24 H ALA 24 9.412 10.195 -17.174
171 HA ALA 24 HA ALA 24 6.937 8.944 -17.620
172 HB1 ALA 24 1HB ALA 24 7.825 10.433 -19.266
173 HB2 ALA 24 2HB ALA 24 9.258 9.426 -19.479
174 HB3 ALA 24 3HB ALA 24 7.679 8.836 -19.999
175 H SER 25 H SER 25 10.246 7.697 -17.726
176 HA SER 25 HA SER 25 9.633 5.141 -18.726
177 HB2 SER 25 1HB SER 25 11.922 6.039 -16.959
178 HB3 SER 25 2HB SER 25 11.840 4.479 -17.778
179 HG SER 25 HG SER 25 12.811 5.567 -19.308
180 H VAL 26 H VAL 26 9.661 6.458 -15.466
181 HA VAL 26 HA VAL 26 9.429 4.031 -14.057
182 HB VAL 26 HB VAL 26 8.325 6.717 -13.226
183 HG11 VAL 26 1HG1 VAL 26 7.934 5.850 -11.197
184 HG12 VAL 26 2HG1 VAL 26 7.991 4.289 -12.020
185 HG13 VAL 26 3HG1 VAL 26 9.427 4.911 -11.206
186 HG21 VAL 26 3HG2 VAL 26 11.050 5.818 -13.599
187 HG22 VAL 26 1HG2 VAL 26 10.435 7.431 -13.239
188 HG23 VAL 26 2HG2 VAL 26 10.745 6.293 -11.928
189 H ALA 27 H ALA 27 6.968 6.291 -15.259
190 HA ALA 27 HA ALA 27 4.745 4.847 -14.259
191 HB1 ALA 27 1HB ALA 27 5.146 7.287 -15.535
192 HB2 ALA 27 2HB ALA 27 4.124 6.362 -16.636
193 HB3 ALA 27 3HB ALA 27 3.613 6.623 -14.968
194 H GLN 28 H GLN 28 6.322 4.928 -17.440
195 HA GLN 28 HA GLN 28 4.558 3.188 -18.753
196 HB2 GLN 28 1HB GLN 28 6.115 4.538 -20.009
197 HB3 GLN 28 2HB GLN 28 7.485 3.752 -19.237
198 HG2 GLN 28 1HG GLN 28 6.966 1.671 -20.336
199 HG3 GLN 28 2HG GLN 28 5.504 2.370 -21.031
200 HE21 GLN 28 2HE2 GLN 28 5.675 3.024 -23.042
201 HE22 GLN 28 1HE2 GLN 28 7.127 3.515 -23.839
202 H HIS 29 H HIS 29 7.400 2.579 -16.771
203 HA HIS 29 HA HIS 29 7.774 -0.129 -17.335
204 HB2 HIS 29 1HB HIS 29 9.457 1.002 -16.091
205 HB3 HIS 29 2HB HIS 29 8.310 1.494 -14.848
206 HD1 HIS 29 HD1 HIS 29 8.693 -2.025 -16.175
207 HD2 HIS 29 HD2 HIS 29 9.418 0.167 -12.721
208 HE1 HIS 29 HE1 HIS 29 9.357 -3.714 -14.433
209 H VAL 30 H VAL 30 5.512 1.478 -15.185
210 HA VAL 30 HA VAL 30 4.497 -1.107 -14.250
211 HB VAL 30 HB VAL 30 3.074 0.295 -12.724
212 HG11 VAL 30 1HG1 VAL 30 6.064 0.312 -12.644
213 HG12 VAL 30 2HG1 VAL 30 5.135 1.103 -11.369
214 HG13 VAL 30 3HG1 VAL 30 4.923 -0.621 -11.675
215 HG21 VAL 30 3HG2 VAL 30 4.857 2.554 -13.621
216 HG22 VAL 30 1HG2 VAL 30 3.189 2.342 -14.154
217 HG23 VAL 30 2HG2 VAL 30 3.541 2.626 -12.449
218 H CYS 31 H CYS 31 4.088 0.194 -16.977
219 HA CYS 31 HA CYS 31 2.430 0.488 -18.511
220 HB2 CYS 31 1HB CYS 31 2.129 -1.941 -17.579
221 HB3 CYS 31 2HB CYS 31 0.665 -1.284 -16.858
222 HG CYS 31 HG CYS 31 1.037 -2.472 -19.827
223 H LEU 32 H LEU 32 2.503 2.434 -16.442
224 HA LEU 32 HA LEU 32 -0.309 3.272 -16.483
225 HB2 LEU 32 1HB LEU 32 1.217 2.579 -14.169
226 HB3 LEU 32 2HB LEU 32 0.854 4.303 -14.125
227 HG LEU 32 HG LEU 32 -0.772 2.823 -12.916
228 HD11 LEU 32 1HD1 LEU 32 -1.339 5.092 -13.639
229 HD12 LEU 32 2HD1 LEU 32 -2.733 4.014 -13.716
230 HD13 LEU 32 3HD1 LEU 32 -1.880 4.458 -15.194
231 HD21 LEU 32 3HD2 LEU 32 -0.658 1.075 -14.804
232 HD22 LEU 32 1HD2 LEU 32 -1.838 2.101 -15.621
233 HD23 LEU 32 2HD2 LEU 32 -2.220 1.398 -14.049
234 H SER 33 H SER 33 -0.554 5.629 -16.050
235 HA SER 33 HA SER 33 1.409 7.081 -17.596
236 HB2 SER 33 1HB SER 33 -1.369 7.505 -16.724
237 HB3 SER 33 2HB SER 33 -0.388 8.970 -16.754
238 HG SER 33 HG SER 33 0.097 8.540 -18.921
239 HA PRO 34 HA PRO 34 3.647 9.019 -14.360
240 HB2 PRO 34 1HB PRO 34 3.987 11.537 -15.314
241 HB3 PRO 34 2HB PRO 34 4.834 10.135 -15.980
242 HG2 PRO 34 1HG PRO 34 2.387 11.529 -16.997
243 HG3 PRO 34 2HG PRO 34 3.789 10.927 -17.900
244 HD2 PRO 34 1HD PRO 34 1.447 9.574 -17.773
245 HD3 PRO 34 2HD PRO 34 3.018 8.755 -17.896
246 H SER 35 H SER 35 0.895 10.924 -15.545
247 HA SER 35 HA SER 35 0.689 12.590 -13.265
248 HB2 SER 35 1HB SER 35 -0.310 13.130 -15.478
249 HB3 SER 35 2HB SER 35 -1.488 11.841 -15.232
250 HG SER 35 HG SER 35 -2.546 13.530 -14.444
251 H ARG 36 H ARG 36 -0.931 9.582 -14.204
252 HA ARG 36 HA ARG 36 -2.605 9.482 -11.899
253 HB2 ARG 36 1HB ARG 36 -2.713 8.238 -14.259
254 HB3 ARG 36 2HB ARG 36 -1.884 6.984 -13.346
255 HG2 ARG 36 1HG ARG 36 -4.447 8.237 -12.409
256 HG3 ARG 36 2HG ARG 36 -4.401 6.823 -13.465
257 HD2 ARG 36 1HD ARG 36 -2.849 5.808 -11.683
258 HD3 ARG 36 2HD ARG 36 -3.445 7.095 -10.636
259 HE ARG 36 HE ARG 36 -4.854 4.737 -11.443
260 HH11 ARG 36 2HH1 ARG 36 -5.217 8.055 -10.454
261 HH12 ARG 36 1HH1 ARG 36 -6.824 7.834 -9.846
262 HH21 ARG 36 2HH2 ARG 36 -6.969 4.433 -10.646
263 HH22 ARG 36 1HH2 ARG 36 -7.819 5.773 -9.955
264 H LEU 37 H LEU 37 0.453 7.928 -12.794
265 HA LEU 37 HA LEU 37 0.721 6.300 -10.530
266 HB2 LEU 37 1HB LEU 37 2.102 5.916 -12.433
267 HB3 LEU 37 2HB LEU 37 2.766 7.546 -12.352
268 HG LEU 37 HG LEU 37 3.771 6.842 -10.112
269 HD11 LEU 37 1HD1 LEU 37 4.158 4.426 -9.864
270 HD12 LEU 37 2HD1 LEU 37 3.074 4.127 -11.222
271 HD13 LEU 37 3HD1 LEU 37 2.450 4.848 -9.739
272 HD21 LEU 37 3HD2 LEU 37 4.666 6.611 -12.757
273 HD22 LEU 37 1HD2 LEU 37 5.186 5.138 -11.938
274 HD23 LEU 37 2HD2 LEU 37 5.646 6.714 -11.293
275 H SER 38 H SER 38 1.842 9.606 -11.151
276 HA SER 38 HA SER 38 3.251 9.983 -8.762
277 HB2 SER 38 1HB SER 38 3.320 11.495 -10.765
278 HB3 SER 38 2HB SER 38 1.736 12.109 -10.292
279 HG SER 38 HG SER 38 3.884 12.113 -8.469
280 H HIS 39 H HIS 39 -0.160 10.444 -9.542
281 HA HIS 39 HA HIS 39 -0.958 11.712 -7.178
282 HB2 HIS 39 1HB HIS 39 -2.379 11.540 -9.188
283 HB3 HIS 39 2HB HIS 39 -2.558 9.811 -8.906
284 HD1 HIS 39 HD1 HIS 39 -4.056 13.023 -8.100
285 HD2 HIS 39 HD2 HIS 39 -3.987 9.226 -6.414
286 HE1 HIS 39 HE1 HIS 39 -5.977 12.972 -6.478
287 H LEU 40 H LEU 40 -0.914 8.255 -8.010
288 HA LEU 40 HA LEU 40 -1.843 7.399 -5.459
289 HB2 LEU 40 1HB LEU 40 -0.335 5.854 -7.563
290 HB3 LEU 40 2HB LEU 40 -1.218 5.162 -6.204
291 HG LEU 40 HG LEU 40 -2.387 6.612 -8.576
292 HD11 LEU 40 1HD1 LEU 40 -3.373 3.961 -7.979
293 HD12 LEU 40 2HD1 LEU 40 -1.633 3.961 -8.264
294 HD13 LEU 40 3HD1 LEU 40 -2.726 4.613 -9.484
295 HD21 LEU 40 3HD2 LEU 40 -4.568 5.867 -7.499
296 HD22 LEU 40 1HD2 LEU 40 -3.744 7.242 -6.763
297 HD23 LEU 40 2HD2 LEU 40 -3.635 5.646 -6.018
298 H PHE 41 H PHE 41 1.308 8.004 -6.848
299 HA PHE 41 HA PHE 41 2.869 6.666 -4.922
300 HB2 PHE 41 1HB PHE 41 3.377 8.072 -7.244
301 HB3 PHE 41 2HB PHE 41 4.085 9.098 -6.001
302 HD1 PHE 41 HD1 PHE 41 4.219 5.822 -7.635
303 HD2 PHE 41 HD2 PHE 41 6.010 8.393 -4.754
304 HE1 PHE 41 HE1 PHE 41 6.201 4.365 -7.572
305 HE2 PHE 41 HE2 PHE 41 7.995 6.941 -4.687
306 HZ PHE 41 HZ PHE 41 8.093 4.924 -6.097
307 H ARG 42 H ARG 42 1.437 9.868 -5.009
308 HA ARG 42 HA ARG 42 2.834 11.001 -2.848
309 HB2 ARG 42 1HB ARG 42 0.757 11.774 -4.588
310 HB3 ARG 42 2HB ARG 42 0.118 11.953 -2.960
311 HG2 ARG 42 1HG ARG 42 2.616 13.068 -2.752
312 HG3 ARG 42 2HG ARG 42 2.106 13.536 -4.375
313 HD2 ARG 42 1HD ARG 42 0.730 15.070 -3.547
314 HD3 ARG 42 2HD ARG 42 -0.078 13.858 -2.554
315 HE ARG 42 HE ARG 42 2.202 14.413 -1.182
316 HH11 ARG 42 2HH1 ARG 42 -0.403 16.341 -2.452
317 HH12 ARG 42 1HH1 ARG 42 -0.277 17.556 -1.224
318 HH21 ARG 42 2HH2 ARG 42 2.379 16.006 0.441
319 HH22 ARG 42 1HH2 ARG 42 1.307 17.365 0.421
320 H GLN 43 H GLN 43 -0.262 9.263 -2.971
321 HA GLN 43 HA GLN 43 -0.601 9.385 -0.115
322 HB2 GLN 43 1HB GLN 43 -2.519 9.373 -1.697
323 HB3 GLN 43 2HB GLN 43 -2.101 7.725 -2.147
324 HG2 GLN 43 1HG GLN 43 -3.183 6.892 -0.405
325 HG3 GLN 43 2HG GLN 43 -2.352 7.976 0.710
326 HE21 GLN 43 2HE2 GLN 43 -4.068 8.514 1.960
327 HE22 GLN 43 1HE2 GLN 43 -5.438 9.397 1.389
328 H GLN 44 H GLN 44 0.606 7.083 -2.460
329 HA GLN 44 HA GLN 44 0.657 4.837 -0.719
330 HB2 GLN 44 1HB GLN 44 1.977 5.489 -3.336
331 HB3 GLN 44 2HB GLN 44 2.399 4.024 -2.459
332 HG2 GLN 44 1HG GLN 44 -0.389 4.755 -3.322
333 HG3 GLN 44 2HG GLN 44 0.692 3.682 -4.210
334 HE21 GLN 44 2HE2 GLN 44 -1.880 3.038 -3.149
335 HE22 GLN 44 1HE2 GLN 44 -1.656 1.776 -1.991
336 H LEU 45 H LEU 45 3.018 7.314 -1.592
337 HA LEU 45 HA LEU 45 4.924 6.169 0.319
338 HB2 LEU 45 1HB LEU 45 5.181 8.144 -1.923
339 HB3 LEU 45 2HB LEU 45 6.433 7.987 -0.692
340 HG LEU 45 HG LEU 45 7.058 6.740 -2.658
341 HD11 LEU 45 1HD1 LEU 45 7.696 4.775 -1.620
342 HD12 LEU 45 2HD1 LEU 45 6.184 4.635 -0.723
343 HD13 LEU 45 3HD1 LEU 45 7.381 5.841 -0.250
344 HD21 LEU 45 3HD2 LEU 45 4.614 5.027 -2.300
345 HD22 LEU 45 1HD2 LEU 45 5.752 5.050 -3.647
346 HD23 LEU 45 2HD2 LEU 45 4.651 6.406 -3.399
347 H GLY 46 H GLY 46 2.538 8.513 0.142
348 HA2 GLY 46 1HA GLY 46 1.855 10.058 1.711
349 HA3 GLY 46 2HA GLY 46 3.202 9.554 2.721
350 H ILE 47 H ILE 47 4.491 10.280 -0.211
351 HA ILE 47 HA ILE 47 4.636 13.158 0.158
352 HB ILE 47 HB ILE 47 7.053 13.252 0.266
353 HG12 ILE 47 1HG1 ILE 47 6.964 10.230 0.402
354 HG13 ILE 47 2HG1 ILE 47 7.518 11.171 -0.979
355 HG21 ILE 47 1HG2 ILE 47 7.375 12.523 2.526
356 HG22 ILE 47 2HG2 ILE 47 5.716 13.095 2.358
357 HG23 ILE 47 3HG2 ILE 47 6.053 11.365 2.390
358 HD11 ILE 47 3HD1 ILE 47 8.780 11.279 1.747
359 HD12 ILE 47 1HD1 ILE 47 9.336 10.245 0.431
360 HD13 ILE 47 2HD1 ILE 47 9.384 12.000 0.256
361 H SER 48 H SER 48 6.338 14.030 -1.545
362 HA SER 48 HA SER 48 5.364 13.160 -4.097
363 HB2 SER 48 1HB SER 48 7.272 14.909 -4.786
364 HB3 SER 48 2HB SER 48 5.696 15.425 -4.185
365 HG SER 48 HG SER 48 6.619 16.173 -2.451
366 H VAL 49 H VAL 49 6.485 12.185 -5.764
367 HA VAL 49 HA VAL 49 8.299 10.185 -5.160
368 HB VAL 49 HB VAL 49 7.004 10.197 -7.230
369 HG11 VAL 49 1HG1 VAL 49 8.831 12.024 -8.640
370 HG12 VAL 49 2HG1 VAL 49 7.089 11.799 -8.813
371 HG13 VAL 49 3HG1 VAL 49 7.726 12.786 -7.497
372 HG21 VAL 49 3HG2 VAL 49 8.519 8.960 -8.363
373 HG22 VAL 49 1HG2 VAL 49 9.748 10.225 -8.314
374 HG23 VAL 49 2HG2 VAL 49 9.481 9.198 -6.905
375 H LEU 50 H LEU 50 8.887 13.516 -6.114
376 HA LEU 50 HA LEU 50 11.640 13.307 -6.642
377 HB2 LEU 50 1HB LEU 50 10.092 15.666 -5.579
378 HB3 LEU 50 2HB LEU 50 11.703 15.729 -6.291
379 HG LEU 50 HG LEU 50 9.129 15.045 -7.706
380 HD11 LEU 50 1HD1 LEU 50 9.139 17.345 -7.516
381 HD12 LEU 50 2HD1 LEU 50 9.964 17.099 -9.055
382 HD13 LEU 50 3HD1 LEU 50 10.897 17.451 -7.601
383 HD21 LEU 50 3HD2 LEU 50 11.964 14.649 -8.436
384 HD22 LEU 50 1HD2 LEU 50 10.919 15.340 -9.677
385 HD23 LEU 50 2HD2 LEU 50 10.522 13.779 -8.960
386 H SER 51 H SER 51 9.877 14.066 -3.661
387 HA SER 51 HA SER 51 12.237 14.433 -2.096
388 HB2 SER 51 1HB SER 51 9.983 15.421 -1.562
389 HB3 SER 51 2HB SER 51 9.452 13.805 -1.095
390 HG SER 51 HG SER 51 11.173 15.559 0.196
391 H TRP 52 H TRP 52 10.019 11.751 -2.667
392 HA TRP 52 HA TRP 52 10.952 9.991 -0.711
393 HB2 TRP 52 1HB TRP 52 8.916 9.508 -1.903
394 HB3 TRP 52 2HB TRP 52 9.774 9.443 -3.440
395 HD1 TRP 52 HD1 TRP 52 9.125 7.388 -0.284
396 HE1 TRP 52 HE1 TRP 52 9.836 4.954 -0.724
397 HE3 TRP 52 HE3 TRP 52 11.365 8.008 -4.837
398 HZ2 TRP 52 HZ2 TRP 52 11.171 3.490 -2.734
399 HZ3 TRP 52 HZ3 TRP 52 12.335 6.040 -5.951
400 HH2 TRP 52 HH2 TRP 52 12.240 3.829 -4.920
401 H ARG 53 H ARG 53 12.114 10.611 -3.989
402 HA ARG 53 HA ARG 53 13.946 8.517 -4.200
403 HB2 ARG 53 1HB ARG 53 13.319 9.922 -6.099
404 HB3 ARG 53 2HB ARG 53 14.111 11.305 -5.356
405 HG2 ARG 53 1HG ARG 53 15.684 10.616 -6.882
406 HG3 ARG 53 2HG ARG 53 16.223 9.797 -5.414
407 HD2 ARG 53 1HD ARG 53 16.127 7.875 -6.523
408 HD3 ARG 53 2HD ARG 53 14.377 8.069 -6.613
409 HE ARG 53 HE ARG 53 14.602 8.506 -8.837
410 HH11 ARG 53 2HH1 ARG 53 17.659 9.097 -7.278
411 HH12 ARG 53 1HH1 ARG 53 18.500 9.415 -8.759
412 HH21 ARG 53 2HH2 ARG 53 15.699 8.923 -10.793
413 HH22 ARG 53 1HH2 ARG 53 17.384 9.317 -10.757
414 H GLU 54 H GLU 54 14.374 11.796 -2.908
415 HA GLU 54 HA GLU 54 17.124 11.528 -2.319
416 HB2 GLU 54 1HB GLU 54 15.663 13.661 -2.449
417 HB3 GLU 54 2HB GLU 54 15.265 13.312 -0.773
418 HG2 GLU 54 1HG GLU 54 17.796 13.236 -0.391
419 HG3 GLU 54 2HG GLU 54 17.918 14.028 -1.961
420 H ASP 55 H ASP 55 14.202 10.992 -0.399
421 HA ASP 55 HA ASP 55 15.401 10.520 2.075
422 HB2 ASP 55 1HB ASP 55 12.947 10.790 1.667
423 HB3 ASP 55 2HB ASP 55 12.922 9.159 1.004
424 H GLN 56 H GLN 56 14.713 8.290 -0.589
425 HA GLN 56 HA GLN 56 15.576 5.949 0.736
426 HB2 GLN 56 1HB GLN 56 15.091 6.704 -2.117
427 HB3 GLN 56 2HB GLN 56 15.916 5.192 -1.760
428 HG2 GLN 56 1HG GLN 56 13.182 5.998 -0.794
429 HG3 GLN 56 2HG GLN 56 13.543 4.831 -2.066
430 HE21 GLN 56 2HE2 GLN 56 12.784 5.180 1.123
431 HE22 GLN 56 1HE2 GLN 56 13.325 3.650 1.714
432 H ARG 57 H ARG 57 17.244 8.387 -1.157
433 HA ARG 57 HA ARG 57 19.659 7.014 -1.570
434 HB2 ARG 57 1HB ARG 57 18.958 9.937 -1.424
435 HB3 ARG 57 2HB ARG 57 20.614 9.404 -1.683
436 HG2 ARG 57 1HG ARG 57 20.130 8.498 -3.766
437 HG3 ARG 57 2HG ARG 57 18.398 8.423 -3.437
438 HD2 ARG 57 1HD ARG 57 18.062 10.593 -3.990
439 HD3 ARG 57 2HD ARG 57 19.630 11.105 -3.367
440 HE ARG 57 HE ARG 57 20.157 9.606 -5.620
441 HH11 ARG 57 2HH1 ARG 57 18.403 12.514 -4.855
442 HH12 ARG 57 1HH1 ARG 57 18.664 13.236 -6.408
443 HH21 ARG 57 2HH2 ARG 57 20.508 10.545 -7.669
444 HH22 ARG 57 1HH2 ARG 57 19.861 12.115 -8.009
445 H ILE 58 H ILE 58 18.651 9.213 1.031
446 HA ILE 58 HA ILE 58 21.091 9.121 2.454
447 HB ILE 58 HB ILE 58 18.338 9.667 3.569
448 HG12 ILE 58 1HG1 ILE 58 18.849 11.118 1.647
449 HG13 ILE 58 2HG1 ILE 58 18.826 12.032 3.152
450 HG21 ILE 58 1HG2 ILE 58 20.200 11.216 4.903
451 HG22 ILE 58 2HG2 ILE 58 19.431 9.749 5.508
452 HG23 ILE 58 3HG2 ILE 58 21.002 9.657 4.713
453 HD11 ILE 58 3HD1 ILE 58 21.303 11.879 3.205
454 HD12 ILE 58 1HD1 ILE 58 21.243 11.130 1.609
455 HD13 ILE 58 2HD1 ILE 58 20.662 12.781 1.832
456 H SER 59 H SER 59 18.061 7.305 2.797
457 HA SER 59 HA SER 59 18.822 5.817 5.062
458 HB2 SER 59 1HB SER 59 16.516 5.833 4.565
459 HB3 SER 59 2HB SER 59 16.786 5.361 2.888
460 HG SER 59 HG SER 59 16.038 3.696 4.477
461 H GLN 60 H GLN 60 19.257 5.266 1.612
462 HA GLN 60 HA GLN 60 20.250 2.609 1.870
463 HB2 GLN 60 1HB GLN 60 19.283 3.796 -0.217
464 HB3 GLN 60 2HB GLN 60 20.907 4.437 -0.422
465 HG2 GLN 60 1HG GLN 60 20.692 2.499 -1.785
466 HG3 GLN 60 2HG GLN 60 21.763 2.109 -0.440
467 HE21 GLN 60 2HE2 GLN 60 21.464 0.040 0.000
468 HE22 GLN 60 1HE2 GLN 60 19.937 -0.734 0.230
469 H ALA 61 H ALA 61 21.745 5.798 1.717
470 HA ALA 61 HA ALA 61 24.408 5.051 1.412
471 HB1 ALA 61 1HB ALA 61 23.244 7.401 1.501
472 HB2 ALA 61 2HB ALA 61 23.731 7.339 3.196
473 HB3 ALA 61 3HB ALA 61 24.947 7.219 1.923
474 H LYS 62 H LYS 62 22.402 5.198 4.305
475 HA LYS 62 HA LYS 62 24.441 4.834 6.209
476 HB2 LYS 62 1HB LYS 62 21.506 4.128 6.276
477 HB3 LYS 62 2HB LYS 62 22.569 3.983 7.670
478 HG2 LYS 62 1HG LYS 62 22.997 6.364 7.631
479 HG3 LYS 62 2HG LYS 62 22.018 6.538 6.173
480 HD2 LYS 62 1HD LYS 62 20.203 5.361 7.712
481 HD3 LYS 62 2HD LYS 62 21.183 6.086 8.989
482 HE2 LYS 62 1HE LYS 62 20.748 8.249 8.264
483 HE3 LYS 62 2HE LYS 62 20.297 7.721 6.644
484 HZ1 LYS 62 3HZ LYS 62 18.711 7.214 9.103
485 HZ2 LYS 62 1HZ LYS 62 18.271 6.790 7.526
486 HZ3 LYS 62 2HZ LYS 62 18.379 8.419 7.964
487 H LEU 63 H LEU 63 22.492 2.535 4.370
488 HA LEU 63 HA LEU 63 23.339 0.200 5.697
489 HB2 LEU 63 1HB LEU 63 21.436 0.622 3.954
490 HB3 LEU 63 2HB LEU 63 22.684 0.199 2.784
491 HG LEU 63 HG LEU 63 22.040 -1.633 5.068
492 HD11 LEU 63 1HD1 LEU 63 20.493 -1.212 2.544
493 HD12 LEU 63 2HD1 LEU 63 19.907 -1.465 4.187
494 HD13 LEU 63 3HD1 LEU 63 20.592 -2.812 3.278
495 HD21 LEU 63 3HD2 LEU 63 23.482 -1.774 2.472
496 HD22 LEU 63 1HD2 LEU 63 22.662 -3.223 3.053
497 HD23 LEU 63 2HD2 LEU 63 23.905 -2.458 4.043
498 H LEU 64 H LEU 64 24.571 1.842 2.804
499 HA LEU 64 HA LEU 64 26.627 -0.052 2.292
500 HB2 LEU 64 1HB LEU 64 26.537 2.837 1.445
501 HB3 LEU 64 2HB LEU 64 27.470 1.539 0.702
502 HG LEU 64 HG LEU 64 24.582 1.055 0.736
503 HD11 LEU 64 1HD1 LEU 64 25.725 3.469 -0.631
504 HD12 LEU 64 2HD1 LEU 64 24.285 3.349 0.379
505 HD13 LEU 64 3HD1 LEU 64 24.289 2.643 -1.237
506 HD21 LEU 64 3HD2 LEU 64 25.401 0.906 -1.832
507 HD22 LEU 64 1HD2 LEU 64 25.557 -0.411 -0.669
508 HD23 LEU 64 2HD2 LEU 64 26.931 0.647 -0.992
509 H LEU 65 H LEU 65 26.557 3.090 3.933
510 HA LEU 65 HA LEU 65 29.331 3.193 4.490
511 HB2 LEU 65 1HB LEU 65 26.908 4.642 5.370
512 HB3 LEU 65 2HB LEU 65 28.305 4.718 6.442
513 HG LEU 65 HG LEU 65 28.500 5.442 3.532
514 HD11 LEU 65 1HD1 LEU 65 28.328 7.824 4.388
515 HD12 LEU 65 2HD1 LEU 65 27.607 7.140 5.845
516 HD13 LEU 65 3HD1 LEU 65 26.823 6.910 4.282
517 HD21 LEU 65 3HD2 LEU 65 30.146 6.018 5.988
518 HD22 LEU 65 1HD2 LEU 65 30.384 6.827 4.440
519 HD23 LEU 65 2HD2 LEU 65 30.613 5.083 4.567
520 H SER 66 H SER 66 26.669 1.573 5.993
521 HA SER 66 HA SER 66 28.156 1.055 8.442
522 HB2 SER 66 1HB SER 66 25.371 0.298 7.544
523 HB3 SER 66 2HB SER 66 26.071 -0.227 9.075
524 HG SER 66 HG SER 66 24.777 1.733 9.169
525 H THR 67 H THR 67 27.347 -0.485 5.445
526 HA THR 67 HA THR 67 28.241 -3.097 6.399
527 HB THR 67 HB THR 67 26.207 -2.763 4.866
528 HG1 THR 67 HG1 THR 67 26.524 -4.796 4.224
529 HG21 THR 67 3HG2 THR 67 27.943 -1.380 3.301
530 HG22 THR 67 1HG2 THR 67 26.452 -2.119 2.717
531 HG23 THR 67 2HG2 THR 67 27.988 -2.967 2.533
532 H THR 68 H THR 68 29.520 -0.342 4.940
533 HA THR 68 HA THR 68 31.911 -1.849 4.127
534 HB THR 68 HB THR 68 32.189 -0.680 2.126
535 HG1 THR 68 HG1 THR 68 30.051 1.091 2.528
536 HG21 THR 68 3HG2 THR 68 29.921 -2.130 2.471
537 HG22 THR 68 1HG2 THR 68 30.455 -1.480 0.922
538 HG23 THR 68 2HG2 THR 68 29.258 -0.607 1.878
539 H ARG 69 H ARG 69 33.790 -0.224 3.747
540 HA ARG 69 HA ARG 69 33.731 1.771 5.916
541 HB2 ARG 69 1HB ARG 69 36.111 1.311 6.286
542 HB3 ARG 69 2HB ARG 69 35.139 -0.138 6.504
543 HG2 ARG 69 1HG ARG 69 36.309 0.334 3.823
544 HG3 ARG 69 2HG ARG 69 37.400 -0.139 5.128
545 HD2 ARG 69 1HD ARG 69 35.547 -1.960 5.560
546 HD3 ARG 69 2HD ARG 69 35.167 -1.654 3.866
547 HE ARG 69 HE ARG 69 37.853 -2.042 3.863
548 HH11 ARG 69 2HH1 ARG 69 35.146 -3.869 5.068
549 HH12 ARG 69 1HH1 ARG 69 35.914 -5.405 4.840
550 HH21 ARG 69 2HH2 ARG 69 38.875 -4.059 3.558
551 HH22 ARG 69 1HH2 ARG 69 38.036 -5.512 3.982
552 H MET 70 H MET 70 33.318 1.863 2.881
553 HA MET 70 HA MET 70 35.486 3.246 1.730
554 HB2 MET 70 1HB MET 70 32.547 3.176 1.056
555 HB3 MET 70 2HB MET 70 33.723 4.059 0.092
556 HG2 MET 70 1HG MET 70 34.920 2.006 -0.377
557 HG3 MET 70 2HG MET 70 33.806 1.103 0.647
558 HE1 MET 70 3HE MET 70 31.336 0.468 -0.025
559 HE2 MET 70 1HE MET 70 31.019 2.202 0.054
560 HE3 MET 70 2HE MET 70 30.471 1.268 -1.339
561 HA PRO 71 HA PRO 71 35.199 7.318 3.342
562 HB2 PRO 71 1HB PRO 71 35.897 8.807 1.182
563 HB3 PRO 71 2HB PRO 71 37.055 7.824 2.086
564 HG2 PRO 71 1HG PRO 71 35.647 7.208 -0.483
565 HG3 PRO 71 2HG PRO 71 37.342 6.934 -0.043
566 HD2 PRO 71 1HD PRO 71 35.488 4.961 0.002
567 HD3 PRO 71 2HD PRO 71 36.858 5.010 1.130
568 H ILE 72 H ILE 72 34.131 9.430 3.075
569 HA ILE 72 HA ILE 72 31.399 9.162 2.479
570 HB ILE 72 HB ILE 72 32.940 11.749 2.689
571 HG12 ILE 72 1HG1 ILE 72 31.646 10.088 4.862
572 HG13 ILE 72 2HG1 ILE 72 33.376 10.314 4.631
573 HG21 ILE 72 1HG2 ILE 72 30.983 12.776 2.490
574 HG22 ILE 72 2HG2 ILE 72 30.244 11.220 2.114
575 HG23 ILE 72 3HG2 ILE 72 30.293 11.793 3.781
576 HD11 ILE 72 3HD1 ILE 72 33.048 12.741 5.025
577 HD12 ILE 72 1HD1 ILE 72 31.360 12.404 5.410
578 HD13 ILE 72 2HD1 ILE 72 32.646 11.726 6.409
579 H ALA 73 H ALA 73 34.112 10.244 0.566
580 HA ALA 73 HA ALA 73 32.670 11.544 -1.486
581 HB1 ALA 73 1HB ALA 73 34.935 12.044 -1.456
582 HB2 ALA 73 2HB ALA 73 35.410 10.352 -1.305
583 HB3 ALA 73 3HB ALA 73 34.791 10.960 -2.840
584 H THR 74 H THR 74 33.887 8.217 -1.189
585 HA THR 74 HA THR 74 32.952 7.333 -3.703
586 HB THR 74 HB THR 74 33.454 5.683 -1.219
587 HG1 THR 74 HG1 THR 74 35.140 6.655 -3.276
588 HG21 THR 74 3HG2 THR 74 33.254 4.935 -4.136
589 HG22 THR 74 1HG2 THR 74 32.193 4.414 -2.828
590 HG23 THR 74 2HG2 THR 74 33.869 3.864 -2.877
591 H VAL 75 H VAL 75 31.591 6.968 -0.432
592 HA VAL 75 HA VAL 75 29.291 5.557 -1.128
593 HB VAL 75 HB VAL 75 29.539 7.584 1.098
594 HG11 VAL 75 1HG1 VAL 75 27.532 6.930 1.820
595 HG12 VAL 75 2HG1 VAL 75 27.312 6.204 0.226
596 HG13 VAL 75 3HG1 VAL 75 27.908 5.226 1.568
597 HG21 VAL 75 3HG2 VAL 75 30.870 5.071 0.688
598 HG22 VAL 75 1HG2 VAL 75 31.050 6.230 2.006
599 HG23 VAL 75 2HG2 VAL 75 29.812 4.977 2.096
600 H GLY 76 H GLY 76 29.904 9.039 -1.066
601 HA2 GLY 76 1HA GLY 76 27.315 9.978 -1.445
602 HA3 GLY 76 2HA GLY 76 28.765 10.790 -2.017
603 H ARG 77 H ARG 77 29.540 8.578 -3.765
604 HA ARG 77 HA ARG 77 28.113 9.393 -6.088
605 HB2 ARG 77 1HB ARG 77 30.330 7.504 -5.485
606 HB3 ARG 77 2HB ARG 77 29.452 7.262 -6.989
607 HG2 ARG 77 1HG ARG 77 30.575 9.938 -6.241
608 HG3 ARG 77 2HG ARG 77 31.550 8.709 -7.050
609 HD2 ARG 77 1HD ARG 77 28.959 9.871 -8.068
610 HD3 ARG 77 2HD ARG 77 30.573 10.274 -8.653
611 HE ARG 77 HE ARG 77 29.015 7.982 -9.347
612 HH11 ARG 77 2HH1 ARG 77 32.266 9.161 -8.943
613 HH12 ARG 77 1HH1 ARG 77 32.957 8.018 -10.046
614 HH21 ARG 77 2HH2 ARG 77 29.913 6.472 -10.803
615 HH22 ARG 77 1HH2 ARG 77 31.618 6.490 -11.105
616 H ASN 78 H ASN 78 27.944 6.622 -3.949
617 HA ASN 78 HA ASN 78 26.375 4.943 -5.573
618 HB2 ASN 78 1HB ASN 78 26.847 5.138 -2.614
619 HB3 ASN 78 2HB ASN 78 25.642 4.019 -3.247
620 HD21 ASN 78 2HD2 ASN 78 29.011 4.767 -2.997
621 HD22 ASN 78 1HD2 ASN 78 29.603 3.261 -3.602
622 H VAL 79 H VAL 79 25.568 7.630 -3.488
623 HA VAL 79 HA VAL 79 22.711 7.124 -3.723
624 HB VAL 79 HB VAL 79 22.493 9.217 -2.360
625 HG11 VAL 79 1HG1 VAL 79 22.966 8.148 -0.335
626 HG12 VAL 79 2HG1 VAL 79 22.707 6.822 -1.470
627 HG13 VAL 79 3HG1 VAL 79 24.346 7.282 -1.009
628 HG21 VAL 79 3HG2 VAL 79 24.630 10.233 -3.085
629 HG22 VAL 79 1HG2 VAL 79 24.455 10.177 -1.331
630 HG23 VAL 79 2HG2 VAL 79 25.496 9.014 -2.151
631 H GLY 80 H GLY 80 24.752 8.123 -5.895
632 HA2 GLY 80 1HA GLY 80 24.433 9.284 -7.865
633 HA3 GLY 80 2HA GLY 80 22.825 9.713 -7.299
634 H PHE 81 H PHE 81 25.671 10.399 -5.405
635 HA PHE 81 HA PHE 81 25.390 13.251 -6.088
636 HB2 PHE 81 1HB PHE 81 25.888 12.001 -3.381
637 HB3 PHE 81 2HB PHE 81 26.051 13.723 -3.711
638 HD1 PHE 81 HD2 PHE 81 23.685 13.965 -5.595
639 HD2 PHE 81 HD1 PHE 81 24.140 12.085 -1.804
640 HE1 PHE 81 HE2 PHE 81 21.284 14.275 -5.158
641 HE2 PHE 81 HE1 PHE 81 21.739 12.391 -1.360
642 HZ PHE 81 HZ PHE 81 20.308 13.488 -3.038
643 H ASP 82 H ASP 82 27.147 13.991 -7.057
644 HA ASP 82 HA ASP 82 29.656 12.583 -6.902
645 HB2 ASP 82 1HB ASP 82 29.280 15.272 -8.197
646 HB3 ASP 82 2HB ASP 82 30.391 13.979 -8.641
647 H ASP 83 H ASP 83 28.252 15.473 -5.535
648 HA ASP 83 HA ASP 83 30.795 16.360 -4.441
649 HB2 ASP 83 1HB ASP 83 27.999 17.474 -4.407
650 HB3 ASP 83 2HB ASP 83 29.258 18.135 -3.368
651 H GLN 84 H GLN 84 31.556 15.584 -2.598
652 HA GLN 84 HA GLN 84 30.120 13.859 -0.904
653 HB2 GLN 84 1HB GLN 84 32.051 14.124 0.642
654 HB3 GLN 84 2HB GLN 84 32.524 13.735 -1.007
655 HG2 GLN 84 1HG GLN 84 32.970 16.149 -1.384
656 HG3 GLN 84 2HG GLN 84 32.649 16.427 0.327
657 HE21 GLN 84 2HE2 GLN 84 33.911 14.727 1.732
658 HE22 GLN 84 1HE2 GLN 84 35.596 14.622 1.367
659 H LEU 85 H LEU 85 30.854 17.308 -0.680
660 HA LEU 85 HA LEU 85 29.859 17.719 1.921
661 HB2 LEU 85 1HB LEU 85 30.529 19.412 -0.408
662 HB3 LEU 85 2HB LEU 85 29.434 20.113 0.783
663 HG LEU 85 HG LEU 85 31.716 20.796 1.221
664 HD11 LEU 85 1HD1 LEU 85 31.696 20.453 3.499
665 HD12 LEU 85 2HD1 LEU 85 31.142 18.785 3.352
666 HD13 LEU 85 3HD1 LEU 85 30.019 20.115 3.072
667 HD21 LEU 85 3HD2 LEU 85 33.516 19.391 1.427
668 HD22 LEU 85 1HD2 LEU 85 32.580 18.540 0.199
669 HD23 LEU 85 2HD2 LEU 85 32.524 18.004 1.878
670 H TYR 86 H TYR 86 28.299 17.586 -1.210
671 HA TYR 86 HA TYR 86 25.845 18.757 -0.554
672 HB2 TYR 86 1HB TYR 86 26.568 18.208 -2.862
673 HB3 TYR 86 2HB TYR 86 26.343 16.499 -2.506
674 HD1 TYR 86 HD1 TYR 86 24.010 15.690 -1.921
675 HD2 TYR 86 HD2 TYR 86 24.764 19.541 -3.567
676 HE1 TYR 86 HE1 TYR 86 21.652 15.855 -2.598
677 HE2 TYR 86 HE2 TYR 86 22.407 19.717 -4.247
678 HH TYR 86 HH TYR 86 20.173 17.017 -3.853
679 H PHE 87 H PHE 87 26.863 15.354 -0.418
680 HA PHE 87 HA PHE 87 24.401 14.370 0.567
681 HB2 PHE 87 1HB PHE 87 25.906 12.828 -0.472
682 HB3 PHE 87 2HB PHE 87 27.203 13.249 0.641
683 HD1 PHE 87 HD2 PHE 87 23.719 11.917 0.711
684 HD2 PHE 87 HD1 PHE 87 27.632 11.820 2.383
685 HE1 PHE 87 HE2 PHE 87 23.037 10.075 2.192
686 HE2 PHE 87 HE1 PHE 87 26.957 9.978 3.867
687 HZ PHE 87 HZ PHE 87 24.656 9.103 3.774
688 H SER 88 H SER 88 27.358 15.477 2.142
689 HA SER 88 HA SER 88 26.657 14.708 4.767
690 HB2 SER 88 1HB SER 88 28.490 16.934 3.844
691 HB3 SER 88 2HB SER 88 28.421 16.281 5.481
692 HG SER 88 HG SER 88 29.330 14.436 4.804
693 H ARG 89 H ARG 89 26.030 17.604 2.873
694 HA ARG 89 HA ARG 89 25.060 19.225 4.962
695 HB2 ARG 89 1HB ARG 89 24.691 19.225 1.983
696 HB3 ARG 89 2HB ARG 89 23.791 20.349 2.991
697 HG2 ARG 89 1HG ARG 89 26.792 20.118 2.934
698 HG3 ARG 89 2HG ARG 89 25.849 21.320 2.050
699 HD2 ARG 89 1HD ARG 89 26.109 20.994 5.031
700 HD3 ARG 89 2HD ARG 89 26.626 22.360 4.043
701 HE ARG 89 HE ARG 89 23.988 21.856 5.056
702 HH11 ARG 89 2HH1 ARG 89 25.831 23.423 2.553
703 HH12 ARG 89 1HH1 ARG 89 24.614 24.609 2.218
704 HH21 ARG 89 2HH2 ARG 89 22.377 23.412 4.624
705 HH22 ARG 89 1HH2 ARG 89 22.650 24.603 3.397
706 H VAL 90 H VAL 90 23.327 17.199 2.601
707 HA VAL 90 HA VAL 90 20.765 17.664 3.749
708 HB VAL 90 HB VAL 90 20.976 16.988 1.419
709 HG11 VAL 90 1HG1 VAL 90 21.707 14.814 0.744
710 HG12 VAL 90 2HG1 VAL 90 22.958 15.511 1.774
711 HG13 VAL 90 3HG1 VAL 90 21.863 14.288 2.420
712 HG21 VAL 90 3HG2 VAL 90 19.606 14.696 2.774
713 HG22 VAL 90 1HG2 VAL 90 18.984 16.339 2.935
714 HG23 VAL 90 2HG2 VAL 90 19.116 15.598 1.340
715 H PHE 91 H PHE 91 23.165 15.088 4.059
716 HA PHE 91 HA PHE 91 21.581 13.360 5.640
717 HB2 PHE 91 1HB PHE 91 23.620 12.636 4.436
718 HB3 PHE 91 2HB PHE 91 24.597 13.592 5.545
719 HD1 PHE 91 HD1 PHE 91 24.759 12.941 7.922
720 HD2 PHE 91 HD2 PHE 91 22.781 10.505 5.046
721 HE1 PHE 91 HE1 PHE 91 24.885 11.026 9.462
722 HE2 PHE 91 HE2 PHE 91 22.903 8.587 6.582
723 HZ PHE 91 HZ PHE 91 23.956 8.846 8.794
724 H LYS 92 H LYS 92 23.726 16.033 6.410
725 HA LYS 92 HA LYS 92 23.991 15.649 9.159
726 HB2 LYS 92 1HB LYS 92 25.329 17.291 7.994
727 HB3 LYS 92 2HB LYS 92 23.895 18.207 7.552
728 HG2 LYS 92 1HG LYS 92 23.523 18.858 9.815
729 HG3 LYS 92 2HG LYS 92 24.782 17.764 10.392
730 HD2 LYS 92 1HD LYS 92 26.495 19.102 9.579
731 HD3 LYS 92 2HD LYS 92 25.443 19.914 8.417
732 HE2 LYS 92 1HE LYS 92 24.482 21.269 10.055
733 HE3 LYS 92 2HE LYS 92 25.003 20.212 11.367
734 HZ1 LYS 92 3HZ LYS 92 26.562 22.194 9.853
735 HZ2 LYS 92 1HZ LYS 92 27.354 20.875 10.558
736 HZ3 LYS 92 2HZ LYS 92 26.476 21.950 11.525
737 H LYS 93 H LYS 93 21.511 17.430 7.347
738 HA LYS 93 HA LYS 93 20.046 18.154 9.701
739 HB2 LYS 93 1HB LYS 93 18.687 19.359 8.307
740 HB3 LYS 93 2HB LYS 93 20.109 19.232 7.281
741 HG2 LYS 93 1HG LYS 93 18.897 17.053 6.440
742 HG3 LYS 93 2HG LYS 93 17.467 17.897 7.039
743 HD2 LYS 93 1HD LYS 93 18.092 19.852 5.654
744 HD3 LYS 93 2HD LYS 93 19.444 18.924 5.003
745 HE2 LYS 93 1HE LYS 93 17.829 18.605 3.386
746 HE3 LYS 93 2HE LYS 93 17.608 17.181 4.402
747 HZ1 LYS 93 3HZ LYS 93 15.601 17.876 5.086
748 HZ2 LYS 93 1HZ LYS 93 15.628 18.810 3.676
749 HZ3 LYS 93 2HZ LYS 93 16.050 19.505 5.159
750 H CYS 94 H CYS 94 20.110 15.438 7.567
751 HA CYS 94 HA CYS 94 17.547 14.410 7.854
752 HB2 CYS 94 1HB CYS 94 19.368 13.529 6.353
753 HB3 CYS 94 2HB CYS 94 20.079 12.763 7.768
754 HG CYS 94 HG CYS 94 16.926 11.905 7.629
755 H THR 95 H THR 95 20.408 13.813 9.882
756 HA THR 95 HA THR 95 18.615 12.729 11.953
757 HB THR 95 HB THR 95 20.455 11.479 12.842
758 HG1 THR 95 HG1 THR 95 22.379 12.313 12.596
759 HG21 THR 95 3HG2 THR 95 19.277 10.646 10.748
760 HG22 THR 95 1HG2 THR 95 20.851 9.932 11.097
761 HG23 THR 95 2HG2 THR 95 20.703 11.176 9.856
762 H GLY 96 H GLY 96 20.437 15.410 11.129
763 HA2 GLY 96 1HA GLY 96 20.471 17.376 12.452
764 HA3 GLY 96 2HA GLY 96 20.309 16.381 13.891
765 H ALA 97 H ALA 97 22.536 14.752 12.263
766 HA ALA 97 HA ALA 97 24.804 16.442 13.039
767 HB1 ALA 97 1HB ALA 97 25.027 13.565 13.701
768 HB2 ALA 97 2HB ALA 97 25.708 14.974 14.515
769 HB3 ALA 97 3HB ALA 97 24.010 14.557 14.747
770 H SER 98 H SER 98 26.800 15.890 12.019
771 HA SER 98 HA SER 98 26.527 15.137 9.316
772 HB2 SER 98 1HB SER 98 29.230 14.873 9.879
773 HB3 SER 98 2HB SER 98 28.422 16.351 9.359
774 HG SER 98 HG SER 98 29.710 16.407 11.387
775 HA PRO 99 HA PRO 99 27.072 10.786 9.233
776 HB2 PRO 99 1HB PRO 99 28.775 10.420 7.151
777 HB3 PRO 99 2HB PRO 99 27.091 10.914 6.939
778 HG2 PRO 99 1HG PRO 99 29.572 12.589 6.923
779 HG3 PRO 99 2HG PRO 99 28.166 12.661 5.845
780 HD2 PRO 99 1HD PRO 99 28.513 14.385 7.904
781 HD3 PRO 99 2HD PRO 99 26.907 13.857 7.360
782 H SER 100 H SER 100 30.016 12.707 9.296
783 HA SER 100 HA SER 100 31.803 10.592 9.891
784 HB2 SER 100 1HB SER 100 33.214 12.571 10.824
785 HB3 SER 100 2HB SER 100 32.858 12.521 9.098
786 HG SER 100 HG SER 100 32.446 14.584 9.959
787 H GLU 101 H GLU 101 29.769 12.661 11.857
788 HA GLU 101 HA GLU 101 30.940 11.951 14.357
789 HB2 GLU 101 1HB GLU 101 29.383 13.967 13.691
790 HB3 GLU 101 2HB GLU 101 28.098 12.852 14.131
791 HG2 GLU 101 1HG GLU 101 30.232 14.037 15.854
792 HG3 GLU 101 2HG GLU 101 28.483 14.052 16.076
793 H PHE 102 H PHE 102 28.012 10.900 12.640
794 HA PHE 102 HA PHE 102 27.078 9.094 14.553
795 HB2 PHE 102 1HB PHE 102 25.800 9.876 12.556
796 HB3 PHE 102 2HB PHE 102 26.807 8.837 11.552
797 HD1 PHE 102 HD1 PHE 102 24.876 8.483 14.730
798 HD2 PHE 102 HD2 PHE 102 25.797 6.898 10.889
799 HE1 PHE 102 HE1 PHE 102 23.338 6.607 15.140
800 HE2 PHE 102 HE2 PHE 102 24.260 5.020 11.292
801 HZ PHE 102 HZ PHE 102 23.028 4.872 13.419
802 H ARG 103 H ARG 103 29.456 8.703 11.987
803 HA ARG 103 HA ARG 103 29.729 5.891 12.226
804 HB2 ARG 103 1HB ARG 103 31.443 8.057 11.038
805 HB3 ARG 103 2HB ARG 103 32.004 6.392 11.105
806 HG2 ARG 103 1HG ARG 103 29.335 6.994 9.920
807 HG3 ARG 103 2HG ARG 103 30.800 7.292 8.982
808 HD2 ARG 103 1HD ARG 103 30.253 5.124 8.382
809 HD3 ARG 103 2HD ARG 103 31.436 4.878 9.666
810 HE ARG 103 HE ARG 103 28.720 4.928 10.598
811 HH11 ARG 103 2HH1 ARG 103 31.250 2.945 9.262
812 HH12 ARG 103 1HH1 ARG 103 30.607 1.467 9.898
813 HH21 ARG 103 2HH2 ARG 103 27.863 2.989 11.441
814 HH22 ARG 103 1HH2 ARG 103 28.679 1.493 11.137
815 H ALA 104 H ALA 104 31.238 8.620 13.830
816 HA ALA 104 HA ALA 104 33.367 7.226 15.051
817 HB1 ALA 104 1HB ALA 104 32.340 9.873 15.055
818 HB2 ALA 104 2HB ALA 104 32.554 9.362 16.730
819 HB3 ALA 104 3HB ALA 104 33.914 9.300 15.609
820 H GLY 105 H GLY 105 30.005 7.706 15.943
821 HA2 GLY 105 1HA GLY 105 28.755 6.343 17.372
822 HA3 GLY 105 2HA GLY 105 30.246 5.597 17.926
823 H CYS 106 H CYS 106 30.414 8.972 17.929
824 HA CYS 106 HA CYS 106 30.596 9.067 20.774
825 HB2 CYS 106 1HB CYS 106 31.705 10.558 18.860
826 HB3 CYS 106 2HB CYS 106 30.307 11.573 19.191
827 HG CYS 106 HG CYS 106 31.775 12.859 20.893
828 H GLU 107 H GLU 107 29.013 9.327 22.195
829 HA GLU 107 HA GLU 107 26.442 10.401 21.243
830 HB2 GLU 107 1HB GLU 107 25.515 9.171 23.281
831 HB3 GLU 107 2HB GLU 107 26.054 8.186 21.929
832 HG2 GLU 107 1HG GLU 107 27.949 8.775 24.150
833 HG3 GLU 107 2HG GLU 107 26.696 7.556 24.375
Start of MODEL 18
1 H1 MET 1 H MET 1 1.871 -1.493 0.435
2 HA MET 1 HA MET 1 2.667 0.225 -1.781
3 HB2 MET 1 1HB MET 1 4.072 -1.519 -0.178
4 HB3 MET 1 2HB MET 1 3.861 -2.445 -1.658
5 HG2 MET 1 1HG MET 1 5.838 -1.379 -2.079
6 HG3 MET 1 2HG MET 1 4.688 -0.262 -2.810
7 HE1 MET 1 3HE MET 1 5.311 2.898 -1.493
8 HE2 MET 1 1HE MET 1 6.677 2.170 -2.340
9 HE3 MET 1 2HE MET 1 5.027 1.776 -2.824
10 H ASP 2 H ASP 2 1.568 0.122 -3.617
11 HA ASP 2 HA ASP 2 -0.069 -2.172 -4.256
12 HB2 ASP 2 1HB ASP 2 -0.760 0.221 -4.672
13 HB3 ASP 2 2HB ASP 2 0.437 0.269 -5.963
14 H ASN 3 H ASN 3 0.136 -3.487 -6.087
15 HA ASN 3 HA ASN 3 2.705 -4.349 -6.724
16 HB2 ASN 3 1HB ASN 3 1.589 -5.572 -8.618
17 HB3 ASN 3 2HB ASN 3 0.846 -5.832 -7.042
18 HD21 ASN 3 2HD2 ASN 3 0.312 -5.015 -10.229
19 HD22 ASN 3 1HD2 ASN 3 -1.298 -4.405 -10.080
20 H ARG 4 H ARG 4 0.514 -2.235 -8.547
21 HA ARG 4 HA ARG 4 2.126 -1.898 -10.812
22 HB2 ARG 4 1HB ARG 4 -0.342 -0.948 -9.933
23 HB3 ARG 4 2HB ARG 4 0.637 0.500 -10.123
24 HG2 ARG 4 1HG ARG 4 1.240 -0.586 -12.431
25 HG3 ARG 4 2HG ARG 4 -0.272 -1.458 -12.169
26 HD2 ARG 4 1HD ARG 4 0.081 1.538 -12.172
27 HD3 ARG 4 2HD ARG 4 -0.644 0.577 -13.460
28 HE ARG 4 HE ARG 4 -1.875 1.376 -10.984
29 HH11 ARG 4 2HH1 ARG 4 -1.918 -0.910 -13.609
30 HH12 ARG 4 1HH1 ARG 4 -3.587 -1.322 -13.395
31 HH21 ARG 4 2HH2 ARG 4 -4.073 0.842 -10.692
32 HH22 ARG 4 1HH2 ARG 4 -4.813 -0.324 -11.737
33 H VAL 5 H VAL 5 1.930 -0.001 -7.818
34 HA VAL 5 HA VAL 5 3.845 1.940 -8.574
35 HB VAL 5 HB VAL 5 3.017 1.062 -5.803
36 HG11 VAL 5 1HG1 VAL 5 3.823 3.785 -5.929
37 HG12 VAL 5 2HG1 VAL 5 4.538 2.465 -5.001
38 HG13 VAL 5 3HG1 VAL 5 5.098 2.797 -6.640
39 HG21 VAL 5 3HG2 VAL 5 2.055 3.622 -6.841
40 HG22 VAL 5 1HG2 VAL 5 1.449 2.218 -7.719
41 HG23 VAL 5 2HG2 VAL 5 1.190 2.349 -5.980
42 H ARG 6 H ARG 6 4.079 -1.148 -6.885
43 HA ARG 6 HA ARG 6 6.685 -0.996 -5.949
44 HB2 ARG 6 1HB ARG 6 4.713 -3.033 -6.325
45 HB3 ARG 6 2HB ARG 6 6.262 -3.641 -6.894
46 HG2 ARG 6 1HG ARG 6 6.857 -4.052 -4.806
47 HG3 ARG 6 2HG ARG 6 6.723 -2.332 -4.432
48 HD2 ARG 6 1HD ARG 6 4.559 -2.545 -3.630
49 HD3 ARG 6 2HD ARG 6 4.276 -4.048 -4.509
50 HE ARG 6 HE ARG 6 6.300 -4.228 -2.465
51 HH11 ARG 6 2HH1 ARG 6 2.908 -4.502 -3.200
52 HH12 ARG 6 1HH1 ARG 6 2.568 -5.542 -1.856
53 HH21 ARG 6 2HH2 ARG 6 5.864 -5.596 -0.693
54 HH22 ARG 6 1HH2 ARG 6 4.250 -6.163 -0.430
55 H GLU 7 H GLU 7 5.490 -1.686 -9.176
56 HA GLU 7 HA GLU 7 7.997 -2.537 -10.238
57 HB2 GLU 7 1HB GLU 7 5.318 -1.866 -11.335
58 HB3 GLU 7 2HB GLU 7 6.679 -1.784 -12.444
59 HG2 GLU 7 1HG GLU 7 5.847 -4.179 -10.824
60 HG3 GLU 7 2HG GLU 7 5.609 -3.950 -12.555
61 H ALA 8 H ALA 8 6.363 0.542 -9.912
62 HA ALA 8 HA ALA 8 8.074 2.001 -11.659
63 HB1 ALA 8 1HB ALA 8 6.053 3.060 -11.330
64 HB2 ALA 8 2HB ALA 8 6.047 2.740 -9.595
65 HB3 ALA 8 3HB ALA 8 7.115 3.976 -10.260
66 H CYS 9 H CYS 9 7.945 1.625 -8.126
67 HA CYS 9 HA CYS 9 10.166 3.283 -7.580
68 HB2 CYS 9 1HB CYS 9 10.048 2.464 -5.351
69 HB3 CYS 9 2HB CYS 9 8.391 2.523 -5.938
70 HG CYS 9 HG CYS 9 9.853 0.056 -4.520
71 H GLN 10 H GLN 10 9.858 -0.092 -8.429
72 HA GLN 10 HA GLN 10 12.421 -0.957 -7.649
73 HB2 GLN 10 1HB GLN 10 10.509 -2.445 -8.264
74 HB3 GLN 10 2HB GLN 10 10.763 -2.005 -9.947
75 HG2 GLN 10 1HG GLN 10 11.753 -4.184 -9.302
76 HG3 GLN 10 2HG GLN 10 12.911 -3.034 -9.971
77 HE21 GLN 10 2HE2 GLN 10 11.595 -4.143 -6.875
78 HE22 GLN 10 1HE2 GLN 10 13.079 -4.014 -6.000
79 H TYR 11 H TYR 11 11.212 0.433 -10.668
80 HA TYR 11 HA TYR 11 13.648 0.143 -12.101
81 HB2 TYR 11 1HB TYR 11 11.716 0.396 -13.425
82 HB3 TYR 11 2HB TYR 11 11.173 1.804 -12.519
83 HD1 TYR 11 HD2 TYR 11 14.234 0.814 -14.436
84 HD2 TYR 11 HD1 TYR 11 11.290 3.789 -13.671
85 HE1 TYR 11 HE2 TYR 11 15.297 2.285 -16.096
86 HE2 TYR 11 HE1 TYR 11 12.345 5.268 -15.330
87 HH TYR 11 HH TYR 11 15.426 4.705 -16.598
88 H ILE 12 H ILE 12 12.182 2.824 -10.305
89 HA ILE 12 HA ILE 12 14.138 4.755 -10.887
90 HB ILE 12 HB ILE 12 12.407 4.528 -8.421
91 HG12 ILE 12 1HG1 ILE 12 11.919 6.295 -10.808
92 HG13 ILE 12 2HG1 ILE 12 11.320 4.641 -10.761
93 HG21 ILE 12 1HG2 ILE 12 13.840 6.134 -7.723
94 HG22 ILE 12 2HG2 ILE 12 14.336 6.557 -9.361
95 HG23 ILE 12 3HG2 ILE 12 12.808 7.159 -8.720
96 HD11 ILE 12 3HD1 ILE 12 10.526 5.741 -8.341
97 HD12 ILE 12 1HD1 ILE 12 10.264 7.019 -9.528
98 HD13 ILE 12 2HD1 ILE 12 9.518 5.437 -9.755
99 H SER 13 H SER 13 13.923 2.317 -8.349
100 HA SER 13 HA SER 13 16.074 3.205 -6.774
101 HB2 SER 13 1HB SER 13 14.714 1.621 -5.727
102 HB3 SER 13 2HB SER 13 14.706 0.555 -7.132
103 HG SER 13 HG SER 13 16.735 -0.121 -6.640
104 H ASP 14 H ASP 14 15.940 0.916 -9.476
105 HA ASP 14 HA ASP 14 18.618 0.099 -9.414
106 HB2 ASP 14 1HB ASP 14 16.600 -0.798 -10.800
107 HB3 ASP 14 2HB ASP 14 17.117 0.386 -11.997
108 H HIS 15 H HIS 15 17.068 2.874 -10.931
109 HA HIS 15 HA HIS 15 19.635 3.763 -12.015
110 HB2 HIS 15 1HB HIS 15 16.789 4.641 -12.455
111 HB3 HIS 15 2HB HIS 15 18.149 5.617 -13.002
112 HD1 HIS 15 HD1 HIS 15 18.837 5.163 -15.326
113 HD2 HIS 15 HD2 HIS 15 17.022 1.855 -13.586
114 HE1 HIS 15 HE1 HIS 15 18.737 3.421 -17.136
115 H LEU 16 H LEU 16 18.670 3.806 -9.104
116 HA LEU 16 HA LEU 16 18.239 6.418 -8.247
117 HB2 LEU 16 1HB LEU 16 18.030 4.386 -6.848
118 HB3 LEU 16 2HB LEU 16 19.788 4.268 -6.809
119 HG LEU 16 HG LEU 16 19.805 6.523 -5.685
120 HD11 LEU 16 1HD1 LEU 16 16.849 5.988 -5.665
121 HD12 LEU 16 2HD1 LEU 16 17.701 7.426 -6.228
122 HD13 LEU 16 3HD1 LEU 16 17.629 7.062 -4.504
123 HD21 LEU 16 3HD2 LEU 16 18.960 5.559 -3.488
124 HD22 LEU 16 1HD2 LEU 16 20.222 4.654 -4.323
125 HD23 LEU 16 2HD2 LEU 16 18.546 4.112 -4.407
126 H ALA 17 H ALA 17 21.134 4.869 -9.351
127 HA ALA 17 HA ALA 17 22.898 6.899 -8.282
128 HB1 ALA 17 1HB ALA 17 24.370 5.495 -10.126
129 HB2 ALA 17 2HB ALA 17 24.238 5.117 -8.408
130 HB3 ALA 17 3HB ALA 17 23.193 4.304 -9.573
131 H ASP 18 H ASP 18 21.050 6.385 -11.130
132 HA ASP 18 HA ASP 18 22.581 7.872 -12.977
133 HB2 ASP 18 1HB ASP 18 20.507 6.308 -13.331
134 HB3 ASP 18 2HB ASP 18 19.588 7.795 -13.111
135 H SER 19 H SER 19 22.223 10.001 -13.784
136 HA SER 19 HA SER 19 21.440 11.862 -11.674
137 HB2 SER 19 1HB SER 19 22.835 12.395 -14.308
138 HB3 SER 19 2HB SER 19 22.595 13.562 -13.008
139 HG SER 19 HG SER 19 24.697 12.416 -13.118
140 H ASN 20 H ASN 20 20.862 11.367 -15.153
141 HA ASN 20 HA ASN 20 18.692 13.266 -15.171
142 HB2 ASN 20 1HB ASN 20 19.422 11.306 -17.350
143 HB3 ASN 20 2HB ASN 20 18.526 12.813 -17.516
144 HD21 ASN 20 2HD2 ASN 20 19.815 14.757 -16.619
145 HD22 ASN 20 1HD2 ASN 20 21.456 14.854 -17.151
146 H PHE 21 H PHE 21 16.855 12.715 -14.187
147 HA PHE 21 HA PHE 21 15.837 9.977 -14.552
148 HB2 PHE 21 1HB PHE 21 16.210 10.526 -12.214
149 HB3 PHE 21 2HB PHE 21 15.251 11.993 -12.375
150 HD1 PHE 21 HD1 PHE 21 14.636 8.493 -13.495
151 HD2 PHE 21 HD2 PHE 21 13.363 11.761 -11.083
152 HE1 PHE 21 HE1 PHE 21 12.617 7.236 -12.864
153 HE2 PHE 21 HE2 PHE 21 11.342 10.509 -10.448
154 HZ PHE 21 HZ PHE 21 10.968 8.243 -11.338
155 H ASP 22 H ASP 22 13.953 9.657 -15.572
156 HA ASP 22 HA ASP 22 12.380 12.038 -16.308
157 HB2 ASP 22 1HB ASP 22 13.624 10.721 -18.145
158 HB3 ASP 22 2HB ASP 22 12.402 9.478 -17.891
159 H ILE 23 H ILE 23 10.710 12.079 -14.923
160 HA ILE 23 HA ILE 23 9.529 9.902 -13.651
161 HB ILE 23 HB ILE 23 9.223 12.290 -12.996
162 HG12 ILE 23 1HG1 ILE 23 6.717 12.016 -12.490
163 HG13 ILE 23 2HG1 ILE 23 6.836 10.485 -13.350
164 HG21 ILE 23 1HG2 ILE 23 6.968 12.518 -14.921
165 HG22 ILE 23 2HG2 ILE 23 7.943 13.779 -14.167
166 HG23 ILE 23 3HG2 ILE 23 8.604 12.831 -15.499
167 HD11 ILE 23 3HD1 ILE 23 8.688 9.881 -11.745
168 HD12 ILE 23 1HD1 ILE 23 8.205 11.295 -10.808
169 HD13 ILE 23 2HD1 ILE 23 7.062 9.978 -11.069
170 H ALA 24 H ALA 24 8.975 11.250 -16.820
171 HA ALA 24 HA ALA 24 6.468 10.119 -17.375
172 HB1 ALA 24 1HB ALA 24 7.316 11.825 -18.805
173 HB2 ALA 24 2HB ALA 24 8.743 10.867 -19.201
174 HB3 ALA 24 3HB ALA 24 7.154 10.358 -19.771
175 H SER 25 H SER 25 9.747 8.853 -17.806
176 HA SER 25 HA SER 25 9.041 6.492 -19.160
177 HB2 SER 25 1HB SER 25 11.417 7.131 -17.400
178 HB3 SER 25 2HB SER 25 11.271 5.653 -18.351
179 HG SER 25 HG SER 25 11.406 6.812 -20.197
180 H VAL 26 H VAL 26 9.176 7.303 -15.749
181 HA VAL 26 HA VAL 26 8.934 4.668 -14.742
182 HB VAL 26 HB VAL 26 8.126 7.283 -13.463
183 HG11 VAL 26 1HG1 VAL 26 7.017 5.400 -12.398
184 HG12 VAL 26 2HG1 VAL 26 8.562 4.563 -12.233
185 HG13 VAL 26 3HG1 VAL 26 8.268 6.057 -11.342
186 HG21 VAL 26 3HG2 VAL 26 10.372 6.535 -12.190
187 HG22 VAL 26 1HG2 VAL 26 10.697 5.873 -13.792
188 HG23 VAL 26 2HG2 VAL 26 10.362 7.593 -13.600
189 H ALA 27 H ALA 27 6.550 7.196 -15.453
190 HA ALA 27 HA ALA 27 4.297 5.744 -14.543
191 HB1 ALA 27 1HB ALA 27 4.763 8.312 -15.441
192 HB2 ALA 27 2HB ALA 27 3.713 7.622 -16.680
193 HB3 ALA 27 3HB ALA 27 3.199 7.631 -14.993
194 H GLN 28 H GLN 28 5.768 6.138 -17.746
195 HA GLN 28 HA GLN 28 3.838 4.707 -19.200
196 HB2 GLN 28 1HB GLN 28 5.399 6.088 -20.376
197 HB3 GLN 28 2HB GLN 28 6.769 5.205 -19.715
198 HG2 GLN 28 1HG GLN 28 6.311 3.308 -21.043
199 HG3 GLN 28 2HG GLN 28 4.723 3.924 -21.500
200 HE21 GLN 28 2HE2 GLN 28 4.598 5.660 -22.973
201 HE22 GLN 28 1HE2 GLN 28 5.900 6.012 -24.052
202 H HIS 29 H HIS 29 6.704 3.667 -17.443
203 HA HIS 29 HA HIS 29 6.874 1.040 -18.368
204 HB2 HIS 29 1HB HIS 29 8.673 1.893 -17.064
205 HB3 HIS 29 2HB HIS 29 7.607 2.281 -15.717
206 HD1 HIS 29 HD1 HIS 29 7.705 -1.045 -17.509
207 HD2 HIS 29 HD2 HIS 29 8.709 0.618 -13.837
208 HE1 HIS 29 HE1 HIS 29 8.322 -2.988 -16.037
209 H VAL 30 H VAL 30 4.803 2.486 -15.932
210 HA VAL 30 HA VAL 30 3.665 -0.128 -15.267
211 HB VAL 30 HB VAL 30 2.462 1.024 -13.482
212 HG11 VAL 30 1HG1 VAL 30 4.497 1.892 -12.220
213 HG12 VAL 30 2HG1 VAL 30 4.573 0.232 -12.816
214 HG13 VAL 30 3HG1 VAL 30 5.419 1.519 -13.676
215 HG21 VAL 30 3HG2 VAL 30 3.847 3.537 -14.413
216 HG22 VAL 30 1HG2 VAL 30 2.145 3.163 -14.691
217 HG23 VAL 30 2HG2 VAL 30 2.744 3.379 -13.046
218 H CYS 31 H CYS 31 3.257 1.581 -17.800
219 HA CYS 31 HA CYS 31 1.572 2.134 -19.231
220 HB2 CYS 31 1HB CYS 31 1.232 -0.391 -18.702
221 HB3 CYS 31 2HB CYS 31 -0.171 0.157 -17.793
222 HG CYS 31 HG CYS 31 -1.715 0.778 -19.821
223 H LEU 32 H LEU 32 1.744 3.790 -16.962
224 HA LEU 32 HA LEU 32 -1.028 4.713 -16.824
225 HB2 LEU 32 1HB LEU 32 0.116 3.383 -14.719
226 HB3 LEU 32 2HB LEU 32 0.433 5.070 -14.317
227 HG LEU 32 HG LEU 32 -2.338 4.475 -15.109
228 HD11 LEU 32 1HD1 LEU 32 -1.879 2.448 -13.874
229 HD12 LEU 32 2HD1 LEU 32 -2.900 3.517 -12.913
230 HD13 LEU 32 3HD1 LEU 32 -1.180 3.381 -12.550
231 HD21 LEU 32 3HD2 LEU 32 -2.512 5.768 -12.800
232 HD22 LEU 32 1HD2 LEU 32 -2.157 6.600 -14.314
233 HD23 LEU 32 2HD2 LEU 32 -0.848 6.194 -13.204
234 H SER 33 H SER 33 -1.178 6.967 -15.996
235 HA SER 33 HA SER 33 0.893 8.568 -17.225
236 HB2 SER 33 1HB SER 33 -1.240 9.980 -15.774
237 HB3 SER 33 2HB SER 33 -0.703 10.157 -17.444
238 HG SER 33 HG SER 33 -2.902 9.241 -16.989
239 HA PRO 34 HA PRO 34 3.092 9.826 -13.645
240 HB2 PRO 34 1HB PRO 34 3.557 12.455 -14.138
241 HB3 PRO 34 2HB PRO 34 4.372 11.155 -15.014
242 HG2 PRO 34 1HG PRO 34 2.013 12.805 -15.836
243 HG3 PRO 34 2HG PRO 34 3.421 12.310 -16.794
244 HD2 PRO 34 1HD PRO 34 1.028 11.055 -16.965
245 HD3 PRO 34 2HD PRO 34 2.570 10.204 -17.188
246 H SER 35 H SER 35 0.397 11.939 -14.546
247 HA SER 35 HA SER 35 0.191 13.263 -12.053
248 HB2 SER 35 1HB SER 35 -0.816 13.974 -14.299
249 HB3 SER 35 2HB SER 35 -2.106 12.820 -13.959
250 HG SER 35 HG SER 35 -1.375 14.793 -12.080
251 H ARG 36 H ARG 36 -1.531 10.481 -13.433
252 HA ARG 36 HA ARG 36 -3.142 10.051 -11.118
253 HB2 ARG 36 1HB ARG 36 -2.541 8.442 -13.584
254 HB3 ARG 36 2HB ARG 36 -3.467 7.749 -12.259
255 HG2 ARG 36 1HG ARG 36 -4.599 10.268 -12.809
256 HG3 ARG 36 2HG ARG 36 -4.339 9.467 -14.360
257 HD2 ARG 36 1HD ARG 36 -5.356 7.420 -12.944
258 HD3 ARG 36 2HD ARG 36 -6.152 8.769 -12.135
259 HE ARG 36 HE ARG 36 -6.734 7.752 -14.727
260 HH11 ARG 36 2HH1 ARG 36 -6.638 10.677 -12.841
261 HH12 ARG 36 1HH1 ARG 36 -7.845 11.482 -13.788
262 HH21 ARG 36 2HH2 ARG 36 -8.324 8.802 -15.982
263 HH22 ARG 36 1HH2 ARG 36 -8.804 10.414 -15.574
264 H LEU 37 H LEU 37 -0.195 8.542 -12.389
265 HA LEU 37 HA LEU 37 0.075 6.541 -10.452
266 HB2 LEU 37 1HB LEU 37 1.400 6.387 -12.394
267 HB3 LEU 37 2HB LEU 37 2.067 8.001 -12.160
268 HG LEU 37 HG LEU 37 3.223 7.081 -10.102
269 HD11 LEU 37 1HD1 LEU 37 3.531 4.683 -9.970
270 HD12 LEU 37 2HD1 LEU 37 2.478 4.446 -11.365
271 HD13 LEU 37 3HD1 LEU 37 1.816 5.080 -9.859
272 HD21 LEU 37 3HD2 LEU 37 4.444 5.490 -12.167
273 HD22 LEU 37 1HD2 LEU 37 5.009 6.984 -11.417
274 HD23 LEU 37 2HD2 LEU 37 3.925 7.050 -12.807
275 H SER 38 H SER 38 1.304 9.866 -10.522
276 HA SER 38 HA SER 38 2.808 9.770 -8.165
277 HB2 SER 38 1HB SER 38 2.865 11.616 -9.856
278 HB3 SER 38 2HB SER 38 1.310 12.171 -9.238
279 HG SER 38 HG SER 38 3.689 11.918 -7.708
280 H HIS 39 H HIS 39 -0.618 10.365 -8.705
281 HA HIS 39 HA HIS 39 -1.309 11.260 -6.145
282 HB2 HIS 39 1HB HIS 39 -2.823 11.393 -8.081
283 HB3 HIS 39 2HB HIS 39 -2.980 9.639 -8.078
284 HD1 HIS 39 HD1 HIS 39 -4.536 12.627 -6.786
285 HD2 HIS 39 HD2 HIS 39 -4.216 8.669 -5.566
286 HE1 HIS 39 HE1 HIS 39 -6.364 12.297 -5.091
287 H LEU 40 H LEU 40 -1.362 7.965 -7.490
288 HA LEU 40 HA LEU 40 -2.126 6.755 -5.022
289 HB2 LEU 40 1HB LEU 40 -0.751 5.339 -7.281
290 HB3 LEU 40 2HB LEU 40 -1.913 4.693 -6.124
291 HG LEU 40 HG LEU 40 -2.584 6.683 -8.290
292 HD11 LEU 40 1HD1 LEU 40 -3.751 4.064 -8.576
293 HD12 LEU 40 2HD1 LEU 40 -1.989 3.977 -8.586
294 HD13 LEU 40 3HD1 LEU 40 -2.827 5.018 -9.737
295 HD21 LEU 40 3HD2 LEU 40 -4.053 5.482 -6.043
296 HD22 LEU 40 1HD2 LEU 40 -4.889 5.454 -7.596
297 HD23 LEU 40 2HD2 LEU 40 -4.341 6.987 -6.918
298 H PHE 41 H PHE 41 0.918 7.480 -6.584
299 HA PHE 41 HA PHE 41 2.627 5.828 -5.130
300 HB2 PHE 41 1HB PHE 41 2.946 7.738 -7.075
301 HB3 PHE 41 2HB PHE 41 3.703 8.504 -5.682
302 HD1 PHE 41 HD1 PHE 41 3.855 5.701 -8.027
303 HD2 PHE 41 HD2 PHE 41 5.720 7.614 -4.713
304 HE1 PHE 41 HE1 PHE 41 5.888 4.368 -8.406
305 HE2 PHE 41 HE2 PHE 41 7.756 6.285 -5.087
306 HZ PHE 41 HZ PHE 41 7.842 4.660 -6.936
307 H ARG 42 H ARG 42 1.576 9.152 -4.429
308 HA ARG 42 HA ARG 42 3.000 9.357 -1.984
309 HB2 ARG 42 1HB ARG 42 2.313 11.350 -3.175
310 HB3 ARG 42 2HB ARG 42 0.620 10.897 -3.031
311 HG2 ARG 42 1HG ARG 42 1.971 11.058 -0.459
312 HG3 ARG 42 2HG ARG 42 1.992 12.579 -1.354
313 HD2 ARG 42 1HD ARG 42 -0.566 11.875 -1.734
314 HD3 ARG 42 2HD ARG 42 -0.277 11.087 -0.184
315 HE ARG 42 HE ARG 42 0.680 13.697 0.001
316 HH11 ARG 42 2HH1 ARG 42 -2.353 12.042 -0.425
317 HH12 ARG 42 1HH1 ARG 42 -3.288 13.283 0.342
318 HH21 ARG 42 2HH2 ARG 42 -0.539 15.337 1.014
319 HH22 ARG 42 1HH2 ARG 42 -2.255 15.157 1.160
320 H GLN 43 H GLN 43 -0.050 7.980 -2.862
321 HA GLN 43 HA GLN 43 -1.138 7.966 -0.202
322 HB2 GLN 43 1HB GLN 43 -2.317 7.814 -2.581
323 HB3 GLN 43 2HB GLN 43 -2.128 6.089 -2.294
324 HG2 GLN 43 1HG GLN 43 -3.403 7.912 -0.282
325 HG3 GLN 43 2HG GLN 43 -4.317 7.157 -1.586
326 HE21 GLN 43 2HE2 GLN 43 -3.701 6.883 1.547
327 HE22 GLN 43 1HE2 GLN 43 -3.802 5.170 1.753
328 H GLN 44 H GLN 44 0.505 5.647 -2.300
329 HA GLN 44 HA GLN 44 0.307 3.523 -0.357
330 HB2 GLN 44 1HB GLN 44 1.897 3.689 -2.923
331 HB3 GLN 44 2HB GLN 44 1.667 2.237 -1.957
332 HG2 GLN 44 1HG GLN 44 -0.582 3.786 -3.216
333 HG3 GLN 44 2HG GLN 44 0.210 2.404 -3.970
334 HE21 GLN 44 2HE2 GLN 44 -2.462 2.334 -3.533
335 HE22 GLN 44 1HE2 GLN 44 -2.834 1.212 -2.273
336 H LEU 45 H LEU 45 2.780 5.754 -1.522
337 HA LEU 45 HA LEU 45 4.774 4.628 0.266
338 HB2 LEU 45 1HB LEU 45 4.871 5.974 -2.160
339 HB3 LEU 45 2HB LEU 45 5.481 7.143 -0.991
340 HG LEU 45 HG LEU 45 6.600 4.366 -1.084
341 HD11 LEU 45 1HD1 LEU 45 7.282 6.667 -2.898
342 HD12 LEU 45 2HD1 LEU 45 6.814 5.028 -3.349
343 HD13 LEU 45 3HD1 LEU 45 8.377 5.320 -2.587
344 HD21 LEU 45 3HD2 LEU 45 7.014 6.334 0.664
345 HD22 LEU 45 1HD2 LEU 45 8.195 6.806 -0.558
346 HD23 LEU 45 2HD2 LEU 45 8.284 5.208 0.184
347 H GLY 46 H GLY 46 2.401 7.081 0.302
348 HA2 GLY 46 1HA GLY 46 1.773 8.531 1.975
349 HA3 GLY 46 2HA GLY 46 2.985 7.776 2.999
350 H ILE 47 H ILE 47 4.425 8.782 0.168
351 HA ILE 47 HA ILE 47 4.924 11.511 1.058
352 HB ILE 47 HB ILE 47 7.313 11.308 1.097
353 HG12 ILE 47 1HG1 ILE 47 6.883 8.392 0.416
354 HG13 ILE 47 2HG1 ILE 47 7.580 9.612 -0.644
355 HG21 ILE 47 1HG2 ILE 47 6.136 10.805 3.177
356 HG22 ILE 47 2HG2 ILE 47 6.076 9.099 2.735
357 HG23 ILE 47 3HG2 ILE 47 7.629 9.875 3.048
358 HD11 ILE 47 3HD1 ILE 47 9.455 9.868 0.911
359 HD12 ILE 47 1HD1 ILE 47 8.762 8.611 1.935
360 HD13 ILE 47 2HD1 ILE 47 9.308 8.219 0.304
361 H SER 48 H SER 48 6.569 12.559 -0.539
362 HA SER 48 HA SER 48 5.446 12.263 -3.159
363 HB2 SER 48 1HB SER 48 7.302 14.022 -3.681
364 HB3 SER 48 2HB SER 48 5.945 14.485 -2.655
365 HG SER 48 HG SER 48 8.310 14.878 -1.990
366 H VAL 49 H VAL 49 6.369 11.454 -4.995
367 HA VAL 49 HA VAL 49 8.105 9.310 -4.848
368 HB VAL 49 HB VAL 49 6.729 9.599 -6.793
369 HG11 VAL 49 1HG1 VAL 49 6.818 12.100 -6.766
370 HG12 VAL 49 2HG1 VAL 49 8.397 11.992 -7.547
371 HG13 VAL 49 3HG1 VAL 49 6.961 11.377 -8.367
372 HG21 VAL 49 3HG2 VAL 49 9.262 8.716 -6.880
373 HG22 VAL 49 1HG2 VAL 49 8.185 8.706 -8.276
374 HG23 VAL 49 2HG2 VAL 49 9.358 10.008 -8.077
375 H LEU 50 H LEU 50 8.836 12.696 -5.597
376 HA LEU 50 HA LEU 50 11.569 12.333 -6.170
377 HB2 LEU 50 1HB LEU 50 10.164 14.763 -5.070
378 HB3 LEU 50 2HB LEU 50 11.773 14.745 -5.790
379 HG LEU 50 HG LEU 50 9.173 14.181 -7.214
380 HD11 LEU 50 1HD1 LEU 50 9.344 16.508 -6.793
381 HD12 LEU 50 2HD1 LEU 50 9.835 16.256 -8.468
382 HD13 LEU 50 3HD1 LEU 50 11.054 16.529 -7.223
383 HD21 LEU 50 3HD2 LEU 50 10.893 14.458 -9.199
384 HD22 LEU 50 1HD2 LEU 50 10.613 12.895 -8.432
385 HD23 LEU 50 2HD2 LEU 50 12.025 13.854 -7.989
386 H SER 51 H SER 51 9.815 12.749 -3.171
387 HA SER 51 HA SER 51 12.111 13.259 -1.552
388 HB2 SER 51 1HB SER 51 9.987 14.005 -0.733
389 HB3 SER 51 2HB SER 51 9.295 12.390 -0.879
390 HG SER 51 HG SER 51 11.368 13.180 0.894
391 H TRP 52 H TRP 52 10.178 10.382 -2.280
392 HA TRP 52 HA TRP 52 11.412 8.591 -0.540
393 HB2 TRP 52 1HB TRP 52 9.394 7.954 -1.673
394 HB3 TRP 52 2HB TRP 52 10.153 8.145 -3.250
395 HD1 TRP 52 HD1 TRP 52 10.235 5.808 -0.183
396 HE1 TRP 52 HE1 TRP 52 11.100 3.508 -0.948
397 HE3 TRP 52 HE3 TRP 52 11.435 6.960 -5.017
398 HZ2 TRP 52 HZ2 TRP 52 12.154 2.337 -3.291
399 HZ3 TRP 52 HZ3 TRP 52 12.368 5.193 -6.454
400 HH2 TRP 52 HH2 TRP 52 12.719 2.930 -5.606
401 H ARG 53 H ARG 53 12.323 9.593 -3.804
402 HA ARG 53 HA ARG 53 14.376 7.757 -4.256
403 HB2 ARG 53 1HB ARG 53 13.483 9.212 -6.009
404 HB3 ARG 53 2HB ARG 53 14.157 10.621 -5.200
405 HG2 ARG 53 1HG ARG 53 16.352 9.015 -5.505
406 HG3 ARG 53 2HG ARG 53 15.427 8.688 -6.972
407 HD2 ARG 53 1HD ARG 53 16.992 10.539 -7.293
408 HD3 ARG 53 2HD ARG 53 15.319 11.072 -7.452
409 HE ARG 53 HE ARG 53 16.400 11.416 -4.810
410 HH11 ARG 53 2HH1 ARG 53 16.057 12.827 -7.974
411 HH12 ARG 53 1HH1 ARG 53 16.262 14.454 -7.414
412 HH21 ARG 53 2HH2 ARG 53 16.672 13.553 -4.060
413 HH22 ARG 53 1HH2 ARG 53 16.613 14.865 -5.188
414 H GLU 54 H GLU 54 14.499 10.984 -2.773
415 HA GLU 54 HA GLU 54 17.287 10.976 -2.305
416 HB2 GLU 54 1HB GLU 54 15.968 13.039 -2.319
417 HB3 GLU 54 2HB GLU 54 15.096 12.504 -0.890
418 HG2 GLU 54 1HG GLU 54 17.029 12.690 0.468
419 HG3 GLU 54 2HG GLU 54 18.070 12.919 -0.936
420 H ASP 55 H ASP 55 14.523 9.932 -0.388
421 HA ASP 55 HA ASP 55 15.938 9.465 2.018
422 HB2 ASP 55 1HB ASP 55 13.351 9.579 1.501
423 HB3 ASP 55 2HB ASP 55 13.534 7.839 1.302
424 H GLN 56 H GLN 56 15.266 7.478 -0.807
425 HA GLN 56 HA GLN 56 16.163 5.025 0.278
426 HB2 GLN 56 1HB GLN 56 15.497 6.069 -2.406
427 HB3 GLN 56 2HB GLN 56 16.601 4.700 -2.372
428 HG2 GLN 56 1HG GLN 56 13.856 4.801 -1.141
429 HG3 GLN 56 2HG GLN 56 14.308 3.962 -2.624
430 HE21 GLN 56 2HE2 GLN 56 13.495 3.389 0.402
431 HE22 GLN 56 1HE2 GLN 56 14.448 1.991 0.749
432 H ARG 57 H ARG 57 17.778 7.519 -1.658
433 HA ARG 57 HA ARG 57 20.270 6.149 -1.787
434 HB2 ARG 57 1HB ARG 57 21.157 8.327 -2.579
435 HB3 ARG 57 2HB ARG 57 19.725 7.807 -3.457
436 HG2 ARG 57 1HG ARG 57 18.362 9.319 -2.059
437 HG3 ARG 57 2HG ARG 57 19.843 9.887 -1.285
438 HD2 ARG 57 1HD ARG 57 20.582 10.307 -3.778
439 HD3 ARG 57 2HD ARG 57 18.840 10.348 -4.051
440 HE ARG 57 HE ARG 57 19.624 12.011 -1.870
441 HH11 ARG 57 2HH1 ARG 57 19.446 11.837 -5.343
442 HH12 ARG 57 1HH1 ARG 57 19.350 13.554 -5.554
443 HH21 ARG 57 2HH2 ARG 57 19.498 14.273 -2.135
444 HH22 ARG 57 1HH2 ARG 57 19.381 14.938 -3.729
445 H ILE 58 H ILE 58 18.973 8.705 0.290
446 HA ILE 58 HA ILE 58 21.360 9.169 1.737
447 HB ILE 58 HB ILE 58 18.472 9.709 2.405
448 HG12 ILE 58 1HG1 ILE 58 19.556 11.014 0.572
449 HG13 ILE 58 2HG1 ILE 58 19.035 12.008 1.928
450 HG21 ILE 58 1HG2 ILE 58 19.174 9.728 4.547
451 HG22 ILE 58 2HG2 ILE 58 20.872 9.890 4.100
452 HG23 ILE 58 3HG2 ILE 58 19.823 11.307 4.106
453 HD11 ILE 58 3HD1 ILE 58 21.516 12.025 0.739
454 HD12 ILE 58 1HD1 ILE 58 21.098 12.731 2.300
455 HD13 ILE 58 2HD1 ILE 58 21.770 11.102 2.220
456 H SER 59 H SER 59 18.594 7.035 2.274
457 HA SER 59 HA SER 59 19.435 6.130 4.835
458 HB2 SER 59 1HB SER 59 17.085 5.993 3.944
459 HB3 SER 59 2HB SER 59 17.622 4.683 2.893
460 HG SER 59 HG SER 59 16.948 4.604 5.499
461 H GLN 60 H GLN 60 20.033 5.081 1.547
462 HA GLN 60 HA GLN 60 21.183 2.566 2.227
463 HB2 GLN 60 1HB GLN 60 20.236 3.259 -0.032
464 HB3 GLN 60 2HB GLN 60 21.734 4.148 -0.280
465 HG2 GLN 60 1HG GLN 60 21.761 1.950 -1.353
466 HG3 GLN 60 2HG GLN 60 23.016 2.113 -0.127
467 HE21 GLN 60 2HE2 GLN 60 22.929 0.872 1.709
468 HE22 GLN 60 1HE2 GLN 60 21.828 -0.445 1.906
469 H ALA 61 H ALA 61 22.474 5.798 1.655
470 HA ALA 61 HA ALA 61 25.206 5.107 1.666
471 HB1 ALA 61 1HB ALA 61 23.988 7.329 1.012
472 HB2 ALA 61 2HB ALA 61 24.294 7.752 2.697
473 HB3 ALA 61 3HB ALA 61 25.640 7.363 1.627
474 H LYS 62 H LYS 62 23.054 6.228 4.263
475 HA LYS 62 HA LYS 62 25.065 6.129 6.280
476 HB2 LYS 62 1HB LYS 62 23.187 6.417 7.853
477 HB3 LYS 62 2HB LYS 62 23.129 7.577 6.533
478 HG2 LYS 62 1HG LYS 62 21.488 6.034 5.404
479 HG3 LYS 62 2HG LYS 62 21.423 5.134 6.921
480 HD2 LYS 62 1HD LYS 62 20.797 8.071 6.609
481 HD3 LYS 62 2HD LYS 62 19.597 6.780 6.716
482 HE2 LYS 62 1HE LYS 62 21.627 7.496 8.831
483 HE3 LYS 62 2HE LYS 62 19.910 7.894 8.870
484 HZ1 LYS 62 3HZ LYS 62 21.239 5.352 9.366
485 HZ2 LYS 62 1HZ LYS 62 19.766 5.276 8.536
486 HZ3 LYS 62 2HZ LYS 62 19.840 5.997 10.064
487 H LEU 63 H LEU 63 22.694 3.865 5.047
488 HA LEU 63 HA LEU 63 22.883 1.974 7.149
489 HB2 LEU 63 1HB LEU 63 21.019 2.038 5.563
490 HB3 LEU 63 2HB LEU 63 22.113 1.574 4.261
491 HG LEU 63 HG LEU 63 20.577 -0.217 5.295
492 HD11 LEU 63 1HD1 LEU 63 23.105 -0.293 4.099
493 HD12 LEU 63 2HD1 LEU 63 21.920 -1.595 4.193
494 HD13 LEU 63 3HD1 LEU 63 23.168 -1.448 5.430
495 HD21 LEU 63 3HD2 LEU 63 21.121 0.369 7.639
496 HD22 LEU 63 1HD2 LEU 63 22.767 -0.203 7.367
497 HD23 LEU 63 2HD2 LEU 63 21.414 -1.329 7.259
498 H LEU 64 H LEU 64 24.406 2.122 3.936
499 HA LEU 64 HA LEU 64 25.989 -0.206 4.328
500 HB2 LEU 64 1HB LEU 64 27.002 0.303 2.269
501 HB3 LEU 64 2HB LEU 64 25.324 0.823 2.124
502 HG LEU 64 HG LEU 64 26.391 3.151 2.845
503 HD11 LEU 64 1HD1 LEU 64 28.663 1.471 2.091
504 HD12 LEU 64 2HD1 LEU 64 28.618 2.986 2.992
505 HD13 LEU 64 3HD1 LEU 64 28.580 3.007 1.229
506 HD21 LEU 64 3HD2 LEU 64 26.279 3.797 0.583
507 HD22 LEU 64 1HD2 LEU 64 25.115 2.483 0.755
508 HD23 LEU 64 2HD2 LEU 64 26.687 2.178 0.016
509 H LEU 65 H LEU 65 26.540 3.241 4.799
510 HA LEU 65 HA LEU 65 29.286 3.248 5.193
511 HB2 LEU 65 1HB LEU 65 27.027 4.942 6.089
512 HB3 LEU 65 2HB LEU 65 28.560 5.137 6.935
513 HG LEU 65 HG LEU 65 28.437 5.300 3.946
514 HD11 LEU 65 1HD1 LEU 65 28.451 7.905 4.789
515 HD12 LEU 65 2HD1 LEU 65 27.266 7.161 5.863
516 HD13 LEU 65 3HD1 LEU 65 27.062 7.051 4.114
517 HD21 LEU 65 3HD2 LEU 65 30.299 6.183 6.117
518 HD22 LEU 65 1HD2 LEU 65 30.319 6.969 4.538
519 HD23 LEU 65 2HD2 LEU 65 30.641 5.240 4.666
520 H SER 66 H SER 66 26.729 2.150 7.283
521 HA SER 66 HA SER 66 28.294 2.069 9.674
522 HB2 SER 66 1HB SER 66 25.697 2.088 9.389
523 HB3 SER 66 2HB SER 66 25.878 0.341 9.233
524 HG SER 66 HG SER 66 25.541 1.321 11.430
525 H THR 67 H THR 67 27.592 -0.167 7.069
526 HA THR 67 HA THR 67 29.083 -2.294 8.425
527 HB THR 67 HB THR 67 26.954 -2.972 7.459
528 HG1 THR 67 HG1 THR 67 28.003 -4.507 5.795
529 HG21 THR 67 3HG2 THR 67 27.006 -3.035 4.821
530 HG22 THR 67 1HG2 THR 67 28.066 -1.643 5.033
531 HG23 THR 67 2HG2 THR 67 26.427 -1.611 5.685
532 H THR 68 H THR 68 29.939 0.269 6.740
533 HA THR 68 HA THR 68 32.145 -1.138 5.398
534 HB THR 68 HB THR 68 32.085 0.381 3.519
535 HG1 THR 68 HG1 THR 68 31.141 2.247 3.790
536 HG21 THR 68 3HG2 THR 68 30.077 -1.516 4.094
537 HG22 THR 68 1HG2 THR 68 30.629 -0.971 2.511
538 HG23 THR 68 2HG2 THR 68 29.280 -0.156 3.304
539 H ARG 69 H ARG 69 34.037 0.264 5.001
540 HA ARG 69 HA ARG 69 34.242 2.410 7.010
541 HB2 ARG 69 1HB ARG 69 36.700 1.726 7.132
542 HB3 ARG 69 2HB ARG 69 35.534 0.651 7.892
543 HG2 ARG 69 1HG ARG 69 36.297 0.112 5.074
544 HG3 ARG 69 2HG ARG 69 37.466 -0.256 6.344
545 HD2 ARG 69 1HD ARG 69 36.194 -1.929 7.221
546 HD3 ARG 69 2HD ARG 69 34.675 -1.164 6.756
547 HE ARG 69 HE ARG 69 35.978 -1.960 4.424
548 HH11 ARG 69 2HH1 ARG 69 34.519 -3.398 7.239
549 HH12 ARG 69 1HH1 ARG 69 34.066 -4.857 6.420
550 HH21 ARG 69 2HH2 ARG 69 35.387 -3.875 3.335
551 HH22 ARG 69 1HH2 ARG 69 34.561 -5.127 4.200
552 H MET 70 H MET 70 33.753 2.272 3.988
553 HA MET 70 HA MET 70 36.046 3.407 2.744
554 HB2 MET 70 1HB MET 70 33.136 3.328 1.947
555 HB3 MET 70 2HB MET 70 34.392 4.027 0.934
556 HG2 MET 70 1HG MET 70 35.552 1.819 0.983
557 HG3 MET 70 2HG MET 70 34.142 1.164 1.814
558 HE1 MET 70 3HE MET 70 31.661 0.611 0.263
559 HE2 MET 70 1HE MET 70 31.823 2.254 0.886
560 HE3 MET 70 2HE MET 70 31.346 1.990 -0.792
561 HA PRO 71 HA PRO 71 35.770 7.644 3.854
562 HB2 PRO 71 1HB PRO 71 36.605 8.854 1.572
563 HB3 PRO 71 2HB PRO 71 37.696 7.968 2.643
564 HG2 PRO 71 1HG PRO 71 36.401 7.073 0.097
565 HG3 PRO 71 2HG PRO 71 38.067 6.826 0.652
566 HD2 PRO 71 1HD PRO 71 36.170 4.902 0.834
567 HD3 PRO 71 2HD PRO 71 37.484 5.063 2.018
568 H ILE 72 H ILE 72 34.525 9.520 3.631
569 HA ILE 72 HA ILE 72 31.914 9.253 2.770
570 HB ILE 72 HB ILE 72 33.469 11.834 2.992
571 HG12 ILE 72 1HG1 ILE 72 31.769 10.413 5.053
572 HG13 ILE 72 2HG1 ILE 72 33.529 10.420 5.036
573 HG21 ILE 72 1HG2 ILE 72 30.775 12.175 3.719
574 HG22 ILE 72 2HG2 ILE 72 31.609 12.834 2.312
575 HG23 ILE 72 3HG2 ILE 72 30.775 11.284 2.197
576 HD11 ILE 72 3HD1 ILE 72 33.620 12.720 5.523
577 HD12 ILE 72 1HD1 ILE 72 31.903 12.937 5.183
578 HD13 ILE 72 2HD1 ILE 72 32.413 12.035 6.611
579 H ALA 73 H ALA 73 34.739 10.252 0.977
580 HA ALA 73 HA ALA 73 33.412 11.399 -1.242
581 HB1 ALA 73 1HB ALA 73 35.628 11.989 -1.176
582 HB2 ALA 73 2HB ALA 73 36.161 10.367 -0.732
583 HB3 ALA 73 3HB ALA 73 35.665 10.709 -2.390
584 H THR 74 H THR 74 34.688 8.133 -0.658
585 HA THR 74 HA THR 74 33.923 7.085 -3.176
586 HB THR 74 HB THR 74 34.453 5.645 -0.570
587 HG1 THR 74 HG1 THR 74 36.479 5.205 -1.798
588 HG21 THR 74 3HG2 THR 74 34.836 3.667 -2.018
589 HG22 THR 74 1HG2 THR 74 34.229 4.591 -3.391
590 HG23 THR 74 2HG2 THR 74 33.161 4.220 -2.037
591 H VAL 75 H VAL 75 32.393 7.000 0.027
592 HA VAL 75 HA VAL 75 30.225 5.366 -0.576
593 HB VAL 75 HB VAL 75 30.193 7.729 1.307
594 HG11 VAL 75 1HG1 VAL 75 28.603 5.174 1.440
595 HG12 VAL 75 2HG1 VAL 75 28.414 6.617 2.438
596 HG13 VAL 75 3HG1 VAL 75 27.996 6.666 0.725
597 HG21 VAL 75 3HG2 VAL 75 31.638 6.651 2.603
598 HG22 VAL 75 1HG2 VAL 75 30.575 5.244 2.640
599 HG23 VAL 75 2HG2 VAL 75 31.797 5.394 1.377
600 H GLY 76 H GLY 76 30.629 8.854 -1.017
601 HA2 GLY 76 1HA GLY 76 28.012 9.514 -1.723
602 HA3 GLY 76 2HA GLY 76 29.446 10.368 -2.272
603 H ARG 77 H ARG 77 30.666 8.351 -3.767
604 HA ARG 77 HA ARG 77 29.421 8.642 -6.243
605 HB2 ARG 77 1HB ARG 77 31.514 6.731 -5.233
606 HB3 ARG 77 2HB ARG 77 30.937 6.662 -6.893
607 HG2 ARG 77 1HG ARG 77 31.551 9.134 -7.028
608 HG3 ARG 77 2HG ARG 77 32.437 8.867 -5.526
609 HD2 ARG 77 1HD ARG 77 33.554 6.918 -6.758
610 HD3 ARG 77 2HD ARG 77 32.907 7.647 -8.227
611 HE ARG 77 HE ARG 77 34.360 9.510 -6.613
612 HH11 ARG 77 2HH1 ARG 77 34.663 6.997 -9.003
613 HH12 ARG 77 1HH1 ARG 77 36.174 7.582 -9.617
614 HH21 ARG 77 2HH2 ARG 77 36.349 10.290 -7.412
615 HH22 ARG 77 1HH2 ARG 77 37.132 9.455 -8.710
616 H ASN 78 H ASN 78 29.115 6.133 -3.812
617 HA ASN 78 HA ASN 78 27.812 4.189 -5.357
618 HB2 ASN 78 1HB ASN 78 28.368 4.655 -2.558
619 HB3 ASN 78 2HB ASN 78 26.743 4.010 -2.768
620 HD21 ASN 78 2HD2 ASN 78 29.896 3.206 -2.335
621 HD22 ASN 78 1HD2 ASN 78 29.868 1.589 -2.942
622 H VAL 79 H VAL 79 26.648 7.093 -3.801
623 HA VAL 79 HA VAL 79 23.881 6.419 -4.498
624 HB VAL 79 HB VAL 79 23.232 8.345 -3.135
625 HG11 VAL 79 1HG1 VAL 79 24.931 6.179 -2.010
626 HG12 VAL 79 2HG1 VAL 79 24.394 7.471 -0.934
627 HG13 VAL 79 3HG1 VAL 79 23.209 6.491 -1.798
628 HG21 VAL 79 3HG2 VAL 79 26.137 8.661 -2.413
629 HG22 VAL 79 1HG2 VAL 79 25.334 9.645 -3.636
630 HG23 VAL 79 2HG2 VAL 79 24.786 9.700 -1.961
631 H GLY 80 H GLY 80 26.175 7.396 -6.303
632 HA2 GLY 80 1HA GLY 80 26.167 8.562 -8.297
633 HA3 GLY 80 2HA GLY 80 24.525 9.077 -7.942
634 H PHE 81 H PHE 81 26.354 9.793 -5.291
635 HA PHE 81 HA PHE 81 26.364 12.605 -5.944
636 HB2 PHE 81 1HB PHE 81 26.841 10.984 -3.479
637 HB3 PHE 81 2HB PHE 81 27.455 12.634 -3.536
638 HD1 PHE 81 HD2 PHE 81 24.307 11.139 -4.851
639 HD2 PHE 81 HD1 PHE 81 26.110 13.916 -2.176
640 HE1 PHE 81 HE2 PHE 81 22.080 11.983 -4.232
641 HE2 PHE 81 HE1 PHE 81 23.886 14.764 -1.552
642 HZ PHE 81 HZ PHE 81 21.867 13.798 -2.581
643 H ASP 82 H ASP 82 27.992 13.556 -6.953
644 HA ASP 82 HA ASP 82 30.607 12.299 -7.041
645 HB2 ASP 82 1HB ASP 82 29.273 13.519 -8.975
646 HB3 ASP 82 2HB ASP 82 30.060 14.947 -8.309
647 H ASP 83 H ASP 83 29.052 15.074 -5.600
648 HA ASP 83 HA ASP 83 31.596 16.128 -4.637
649 HB2 ASP 83 1HB ASP 83 28.776 17.146 -4.679
650 HB3 ASP 83 2HB ASP 83 29.943 17.848 -3.561
651 H GLN 84 H GLN 84 32.418 15.460 -2.778
652 HA GLN 84 HA GLN 84 31.089 13.739 -0.998
653 HB2 GLN 84 1HB GLN 84 33.025 14.143 0.504
654 HB3 GLN 84 2HB GLN 84 33.497 13.731 -1.139
655 HG2 GLN 84 1HG GLN 84 33.770 16.186 -1.571
656 HG3 GLN 84 2HG GLN 84 33.540 16.440 0.158
657 HE21 GLN 84 2HE2 GLN 84 35.495 14.562 -2.122
658 HE22 GLN 84 1HE2 GLN 84 36.953 14.630 -1.197
659 H LEU 85 H LEU 85 31.670 17.224 -0.904
660 HA LEU 85 HA LEU 85 30.601 17.625 1.695
661 HB2 LEU 85 1HB LEU 85 30.741 19.641 -0.536
662 HB3 LEU 85 2HB LEU 85 30.676 19.962 1.195
663 HG LEU 85 HG LEU 85 32.989 18.633 -0.214
664 HD11 LEU 85 1HD1 LEU 85 33.108 20.790 -1.019
665 HD12 LEU 85 2HD1 LEU 85 34.064 20.901 0.458
666 HD13 LEU 85 3HD1 LEU 85 32.401 21.488 0.439
667 HD21 LEU 85 3HD2 LEU 85 34.143 18.768 1.822
668 HD22 LEU 85 1HD2 LEU 85 32.544 18.164 2.255
669 HD23 LEU 85 2HD2 LEU 85 32.949 19.858 2.528
670 H TYR 86 H TYR 86 29.220 17.568 -1.526
671 HA TYR 86 HA TYR 86 26.743 18.753 -0.966
672 HB2 TYR 86 1HB TYR 86 27.410 18.408 -3.249
673 HB3 TYR 86 2HB TYR 86 27.524 16.668 -3.009
674 HD1 TYR 86 HD2 TYR 86 24.828 19.043 -2.014
675 HD2 TYR 86 HD1 TYR 86 25.950 15.738 -4.448
676 HE1 TYR 86 HE2 TYR 86 22.493 18.795 -2.745
677 HE2 TYR 86 HE1 TYR 86 23.618 15.482 -5.186
678 HH TYR 86 HH TYR 86 21.486 16.112 -4.805
679 H PHE 87 H PHE 87 27.842 15.408 -0.689
680 HA PHE 87 HA PHE 87 25.324 14.293 -0.046
681 HB2 PHE 87 1HB PHE 87 27.030 12.810 -0.796
682 HB3 PHE 87 2HB PHE 87 28.150 13.360 0.447
683 HD1 PHE 87 HD1 PHE 87 24.701 11.934 0.286
684 HD2 PHE 87 HD2 PHE 87 28.523 11.893 2.159
685 HE1 PHE 87 HE1 PHE 87 23.957 10.108 1.757
686 HE2 PHE 87 HE2 PHE 87 27.785 10.065 3.632
687 HZ PHE 87 HZ PHE 87 25.500 9.170 3.432
688 H SER 88 H SER 88 28.042 15.351 1.984
689 HA SER 88 HA SER 88 26.826 14.719 4.453
690 HB2 SER 88 1HB SER 88 29.263 15.098 4.164
691 HB3 SER 88 2HB SER 88 28.944 16.812 3.898
692 HG SER 88 HG SER 88 29.507 16.361 6.074
693 H ARG 89 H ARG 89 26.810 17.610 2.446
694 HA ARG 89 HA ARG 89 25.631 19.369 4.294
695 HB2 ARG 89 1HB ARG 89 25.778 19.288 1.298
696 HB3 ARG 89 2HB ARG 89 24.800 20.508 2.104
697 HG2 ARG 89 1HG ARG 89 27.724 20.073 2.659
698 HG3 ARG 89 2HG ARG 89 27.101 21.242 1.493
699 HD2 ARG 89 1HD ARG 89 26.573 21.187 4.461
700 HD3 ARG 89 2HD ARG 89 27.569 22.351 3.588
701 HE ARG 89 HE ARG 89 24.706 22.345 3.812
702 HH11 ARG 89 2HH1 ARG 89 27.419 23.370 1.887
703 HH12 ARG 89 1HH1 ARG 89 26.566 24.685 1.149
704 HH21 ARG 89 2HH2 ARG 89 23.571 24.073 2.848
705 HH22 ARG 89 1HH2 ARG 89 24.377 25.085 1.697
706 H VAL 90 H VAL 90 24.147 17.408 1.717
707 HA VAL 90 HA VAL 90 21.480 18.114 2.417
708 HB VAL 90 HB VAL 90 22.500 15.780 0.791
709 HG11 VAL 90 1HG1 VAL 90 19.885 16.359 1.784
710 HG12 VAL 90 2HG1 VAL 90 19.890 16.527 0.027
711 HG13 VAL 90 3HG1 VAL 90 20.416 15.017 0.771
712 HG21 VAL 90 3HG2 VAL 90 21.332 17.498 -0.957
713 HG22 VAL 90 1HG2 VAL 90 22.028 18.620 0.212
714 HG23 VAL 90 2HG2 VAL 90 23.060 17.450 -0.610
715 H PHE 91 H PHE 91 23.498 15.262 3.044
716 HA PHE 91 HA PHE 91 21.565 13.748 4.397
717 HB2 PHE 91 1HB PHE 91 23.687 12.808 3.575
718 HB3 PHE 91 2HB PHE 91 24.566 13.742 4.780
719 HD1 PHE 91 HD1 PHE 91 21.380 11.902 5.223
720 HD2 PHE 91 HD2 PHE 91 25.544 12.076 6.088
721 HE1 PHE 91 HE1 PHE 91 21.119 10.059 6.833
722 HE2 PHE 91 HE2 PHE 91 25.290 10.233 7.699
723 HZ PHE 91 HZ PHE 91 23.076 9.222 8.072
724 H LYS 92 H LYS 92 23.751 16.265 5.495
725 HA LYS 92 HA LYS 92 23.537 15.925 8.251
726 HB2 LYS 92 1HB LYS 92 25.153 17.456 7.369
727 HB3 LYS 92 2HB LYS 92 23.905 18.418 6.589
728 HG2 LYS 92 1HG LYS 92 23.092 19.192 8.706
729 HG3 LYS 92 2HG LYS 92 24.179 18.101 9.569
730 HD2 LYS 92 1HD LYS 92 26.063 19.349 9.029
731 HD3 LYS 92 2HD LYS 92 25.273 20.131 7.658
732 HE2 LYS 92 1HE LYS 92 23.960 21.500 9.096
733 HE3 LYS 92 2HE LYS 92 24.447 20.580 10.519
734 HZ1 LYS 92 3HZ LYS 92 25.647 22.657 10.399
735 HZ2 LYS 92 1HZ LYS 92 26.219 22.284 8.851
736 HZ3 LYS 92 2HZ LYS 92 26.720 21.368 10.182
737 H LYS 93 H LYS 93 21.537 17.909 6.078
738 HA LYS 93 HA LYS 93 19.732 18.665 8.180
739 HB2 LYS 93 1HB LYS 93 19.566 18.962 5.177
740 HB3 LYS 93 2HB LYS 93 18.382 19.621 6.298
741 HG2 LYS 93 1HG LYS 93 19.885 21.181 7.158
742 HG3 LYS 93 2HG LYS 93 21.287 20.314 6.528
743 HD2 LYS 93 1HD LYS 93 20.092 20.816 4.216
744 HD3 LYS 93 2HD LYS 93 19.399 22.147 5.144
745 HE2 LYS 93 1HE LYS 93 22.347 21.558 4.902
746 HE3 LYS 93 2HE LYS 93 21.480 22.763 3.951
747 HZ1 LYS 93 3HZ LYS 93 22.438 22.914 6.650
748 HZ2 LYS 93 1HZ LYS 93 20.817 23.378 6.509
749 HZ3 LYS 93 2HZ LYS 93 22.004 24.156 5.588
750 H CYS 94 H CYS 94 19.956 16.084 5.884
751 HA CYS 94 HA CYS 94 17.283 15.291 5.719
752 HB2 CYS 94 1HB CYS 94 19.579 14.397 4.616
753 HB3 CYS 94 2HB CYS 94 19.322 13.144 5.825
754 HG CYS 94 HG CYS 94 17.584 11.813 4.491
755 H THR 95 H THR 95 19.819 14.231 7.978
756 HA THR 95 HA THR 95 17.737 13.004 9.652
757 HB THR 95 HB THR 95 19.424 11.407 9.167
758 HG1 THR 95 HG1 THR 95 19.377 10.895 11.212
759 HG21 THR 95 3HG2 THR 95 21.211 13.717 9.409
760 HG22 THR 95 1HG2 THR 95 21.377 12.254 8.440
761 HG23 THR 95 2HG2 THR 95 21.838 12.241 10.143
762 H GLY 96 H GLY 96 19.699 15.738 9.425
763 HA2 GLY 96 1HA GLY 96 19.490 17.579 10.900
764 HA3 GLY 96 2HA GLY 96 19.015 16.470 12.178
765 H ALA 97 H ALA 97 21.499 14.896 10.933
766 HA ALA 97 HA ALA 97 23.588 16.445 12.289
767 HB1 ALA 97 1HB ALA 97 23.633 13.529 12.767
768 HB2 ALA 97 2HB ALA 97 24.112 14.861 13.819
769 HB3 ALA 97 3HB ALA 97 22.406 14.456 13.632
770 H SER 98 H SER 98 25.741 15.896 11.666
771 HA SER 98 HA SER 98 25.987 15.261 8.909
772 HB2 SER 98 1HB SER 98 27.693 16.266 11.021
773 HB3 SER 98 2HB SER 98 28.542 15.063 10.051
774 HG SER 98 HG SER 98 28.743 16.557 8.602
775 HA PRO 99 HA PRO 99 26.768 10.946 8.830
776 HB2 PRO 99 1HB PRO 99 28.934 10.711 7.210
777 HB3 PRO 99 2HB PRO 99 27.331 11.154 6.612
778 HG2 PRO 99 1HG PRO 99 29.672 12.912 7.235
779 HG3 PRO 99 2HG PRO 99 28.563 12.974 5.852
780 HD2 PRO 99 1HD PRO 99 28.335 14.636 7.978
781 HD3 PRO 99 2HD PRO 99 26.930 14.073 7.051
782 H SER 100 H SER 100 29.666 12.885 9.463
783 HA SER 100 HA SER 100 31.202 10.764 10.554
784 HB2 SER 100 1HB SER 100 31.454 13.758 10.929
785 HB3 SER 100 2HB SER 100 32.665 12.575 11.422
786 HG SER 100 HG SER 100 33.296 13.227 9.435
787 H GLU 101 H GLU 101 28.897 13.030 11.892
788 HA GLU 101 HA GLU 101 29.509 12.615 14.624
789 HB2 GLU 101 1HB GLU 101 26.777 13.334 13.588
790 HB3 GLU 101 2HB GLU 101 27.526 13.801 15.109
791 HG2 GLU 101 1HG GLU 101 28.273 14.769 12.360
792 HG3 GLU 101 2HG GLU 101 27.458 15.688 13.624
793 H PHE 102 H PHE 102 27.048 11.189 12.493
794 HA PHE 102 HA PHE 102 25.827 9.530 14.373
795 HB2 PHE 102 1HB PHE 102 24.876 9.951 12.154
796 HB3 PHE 102 2HB PHE 102 26.199 9.060 11.407
797 HD1 PHE 102 HD1 PHE 102 26.307 6.642 11.545
798 HD2 PHE 102 HD2 PHE 102 23.085 8.809 13.288
799 HE1 PHE 102 HE1 PHE 102 25.014 4.558 11.737
800 HE2 PHE 102 HE2 PHE 102 21.787 6.728 13.485
801 HZ PHE 102 HZ PHE 102 22.752 4.598 12.710
802 H ARG 103 H ARG 103 28.556 8.875 12.199
803 HA ARG 103 HA ARG 103 28.931 6.199 13.106
804 HB2 ARG 103 1HB ARG 103 30.602 8.105 11.485
805 HB3 ARG 103 2HB ARG 103 31.219 6.530 11.966
806 HG2 ARG 103 1HG ARG 103 28.585 6.714 10.581
807 HG3 ARG 103 2HG ARG 103 30.078 6.847 9.649
808 HD2 ARG 103 1HD ARG 103 29.764 4.607 11.594
809 HD3 ARG 103 2HD ARG 103 28.941 4.516 10.038
810 HE ARG 103 HE ARG 103 31.469 5.136 9.338
811 HH11 ARG 103 2HH1 ARG 103 30.118 2.683 11.407
812 HH12 ARG 103 1HH1 ARG 103 31.382 1.539 11.095
813 HH21 ARG 103 2HH2 ARG 103 33.138 3.638 8.918
814 HH22 ARG 103 1HH2 ARG 103 33.099 2.084 9.680
815 H ALA 104 H ALA 104 30.119 9.324 14.103
816 HA ALA 104 HA ALA 104 32.331 8.504 15.627
817 HB1 ALA 104 1HB ALA 104 30.669 10.925 15.422
818 HB2 ALA 104 2HB ALA 104 31.523 10.710 16.950
819 HB3 ALA 104 3HB ALA 104 32.424 10.747 15.435
820 H GLY 105 H GLY 105 28.914 8.406 16.260
821 HA2 GLY 105 1HA GLY 105 27.827 7.176 17.907
822 HA3 GLY 105 2HA GLY 105 29.385 6.850 18.653
823 H CYS 106 H CYS 106 28.932 10.133 17.988
824 HA CYS 106 HA CYS 106 28.698 10.714 20.814
825 HB2 CYS 106 1HB CYS 106 30.241 11.923 19.171
826 HB3 CYS 106 2HB CYS 106 28.796 12.729 18.573
827 HG CYS 106 HG CYS 106 30.414 14.294 20.416
828 H GLU 107 H GLU 107 26.887 11.239 21.846
829 HA GLU 107 HA GLU 107 24.673 11.606 22.241
830 HB2 GLU 107 1HB GLU 107 25.302 13.541 20.033
831 HB3 GLU 107 2HB GLU 107 23.672 13.429 20.684
832 HG2 GLU 107 1HG GLU 107 26.018 13.834 22.493
833 HG3 GLU 107 2HG GLU 107 25.283 15.190 21.640
Start of MODEL 19
1 H1 MET 1 H MET 1 1.785 -3.472 -0.592
2 HA MET 1 HA MET 1 2.257 -0.807 -1.718
3 HB2 MET 1 1HB MET 1 4.445 -1.854 -1.100
4 HB3 MET 1 2HB MET 1 4.085 -3.160 -2.221
5 HG2 MET 1 1HG MET 1 4.177 -1.706 -4.086
6 HG3 MET 1 2HG MET 1 4.204 -0.279 -3.054
7 HE1 MET 1 3HE MET 1 7.497 0.601 -3.880
8 HE2 MET 1 1HE MET 1 5.825 0.964 -3.453
9 HE3 MET 1 2HE MET 1 7.026 0.722 -2.184
10 H ASP 2 H ASP 2 1.755 -0.590 -3.894
11 HA ASP 2 HA ASP 2 -0.026 -2.633 -4.933
12 HB2 ASP 2 1HB ASP 2 0.101 0.179 -5.103
13 HB3 ASP 2 2HB ASP 2 0.364 -0.423 -6.737
14 H ASN 3 H ASN 3 0.202 -3.657 -6.932
15 HA ASN 3 HA ASN 3 2.830 -4.403 -7.637
16 HB2 ASN 3 1HB ASN 3 0.286 -4.765 -9.237
17 HB3 ASN 3 2HB ASN 3 1.790 -5.654 -9.462
18 HD21 ASN 3 2HD2 ASN 3 2.576 -6.797 -7.456
19 HD22 ASN 3 1HD2 ASN 3 1.381 -7.617 -6.516
20 H ARG 4 H ARG 4 0.683 -1.923 -8.797
21 HA ARG 4 HA ARG 4 2.022 -1.419 -11.257
22 HB2 ARG 4 1HB ARG 4 0.220 0.360 -9.604
23 HB3 ARG 4 2HB ARG 4 0.745 0.706 -11.246
24 HG2 ARG 4 1HG ARG 4 -0.553 -0.988 -12.156
25 HG3 ARG 4 2HG ARG 4 -0.703 -1.832 -10.613
26 HD2 ARG 4 1HD ARG 4 -1.891 0.428 -9.914
27 HD3 ARG 4 2HD ARG 4 -2.186 0.527 -11.649
28 HE ARG 4 HE ARG 4 -3.397 -1.299 -9.781
29 HH11 ARG 4 2HH1 ARG 4 -2.604 -0.699 -13.118
30 HH12 ARG 4 1HH1 ARG 4 -3.842 -1.742 -13.735
31 HH21 ARG 4 2HH2 ARG 4 -5.030 -2.676 -10.582
32 HH22 ARG 4 1HH2 ARG 4 -5.222 -2.865 -12.292
33 H VAL 5 H VAL 5 2.101 0.185 -8.081
34 HA VAL 5 HA VAL 5 4.092 2.074 -8.810
35 HB VAL 5 HB VAL 5 4.322 2.469 -6.374
36 HG11 VAL 5 1HG1 VAL 5 1.962 3.195 -6.004
37 HG12 VAL 5 2HG1 VAL 5 2.642 3.702 -7.552
38 HG13 VAL 5 3HG1 VAL 5 1.523 2.340 -7.483
39 HG21 VAL 5 3HG2 VAL 5 2.371 0.178 -6.169
40 HG22 VAL 5 1HG2 VAL 5 4.017 0.233 -5.537
41 HG23 VAL 5 2HG2 VAL 5 2.772 1.275 -4.848
42 H ARG 6 H ARG 6 4.182 -1.119 -7.326
43 HA ARG 6 HA ARG 6 6.803 -1.184 -6.431
44 HB2 ARG 6 1HB ARG 6 4.910 -2.953 -6.251
45 HB3 ARG 6 2HB ARG 6 5.554 -3.565 -7.768
46 HG2 ARG 6 1HG ARG 6 7.417 -4.401 -6.802
47 HG3 ARG 6 2HG ARG 6 7.505 -3.113 -5.599
48 HD2 ARG 6 1HD ARG 6 6.064 -4.174 -4.158
49 HD3 ARG 6 2HD ARG 6 5.263 -5.068 -5.449
50 HE ARG 6 HE ARG 6 7.483 -5.937 -3.909
51 HH11 ARG 6 2HH1 ARG 6 6.117 -6.066 -7.108
52 HH12 ARG 6 1HH1 ARG 6 6.864 -7.578 -7.507
53 HH21 ARG 6 2HH2 ARG 6 8.471 -7.927 -4.422
54 HH22 ARG 6 1HH2 ARG 6 8.202 -8.636 -5.978
55 H GLU 7 H GLU 7 5.530 -1.655 -9.681
56 HA GLU 7 HA GLU 7 8.006 -2.492 -10.823
57 HB2 GLU 7 1HB GLU 7 5.419 -2.546 -11.662
58 HB3 GLU 7 2HB GLU 7 6.040 -1.191 -12.595
59 HG2 GLU 7 1HG GLU 7 6.482 -2.887 -14.036
60 HG3 GLU 7 2HG GLU 7 7.989 -2.877 -13.121
61 H ALA 8 H ALA 8 6.433 0.592 -10.313
62 HA ALA 8 HA ALA 8 8.179 2.093 -12.008
63 HB1 ALA 8 1HB ALA 8 6.174 3.176 -11.701
64 HB2 ALA 8 2HB ALA 8 6.094 2.772 -9.985
65 HB3 ALA 8 3HB ALA 8 7.202 4.025 -10.545
66 H CYS 9 H CYS 9 7.964 1.595 -8.494
67 HA CYS 9 HA CYS 9 10.135 3.233 -7.793
68 HB2 CYS 9 1HB CYS 9 9.993 2.274 -5.640
69 HB3 CYS 9 2HB CYS 9 8.349 2.230 -6.265
70 HG CYS 9 HG CYS 9 9.867 -0.172 -4.893
71 H GLN 10 H GLN 10 9.966 -0.062 -8.935
72 HA GLN 10 HA GLN 10 12.595 -0.834 -8.204
73 HB2 GLN 10 1HB GLN 10 10.549 -2.273 -8.966
74 HB3 GLN 10 2HB GLN 10 11.180 -1.984 -10.582
75 HG2 GLN 10 1HG GLN 10 12.118 -4.014 -9.979
76 HG3 GLN 10 2HG GLN 10 13.405 -2.852 -9.661
77 HE21 GLN 10 2HE2 GLN 10 14.460 -3.315 -7.882
78 HE22 GLN 10 1HE2 GLN 10 13.783 -3.947 -6.424
79 H TYR 11 H TYR 11 11.221 0.745 -11.024
80 HA TYR 11 HA TYR 11 13.528 0.537 -12.666
81 HB2 TYR 11 1HB TYR 11 11.510 0.958 -13.805
82 HB3 TYR 11 2HB TYR 11 11.078 2.283 -12.731
83 HD1 TYR 11 HD1 TYR 11 13.959 1.420 -14.963
84 HD2 TYR 11 HD2 TYR 11 11.160 4.366 -13.700
85 HE1 TYR 11 HE1 TYR 11 14.932 3.021 -16.557
86 HE2 TYR 11 HE2 TYR 11 12.125 5.973 -15.291
87 HH TYR 11 HH TYR 11 14.239 6.343 -16.480
88 H ILE 12 H ILE 12 12.293 3.066 -10.514
89 HA ILE 12 HA ILE 12 14.232 5.013 -11.072
90 HB ILE 12 HB ILE 12 12.746 4.548 -8.484
91 HG12 ILE 12 1HG1 ILE 12 11.938 6.747 -10.258
92 HG13 ILE 12 2HG1 ILE 12 11.684 5.145 -10.942
93 HG21 ILE 12 1HG2 ILE 12 14.587 6.676 -9.416
94 HG22 ILE 12 2HG2 ILE 12 13.170 7.170 -8.491
95 HG23 ILE 12 3HG2 ILE 12 14.324 6.033 -7.795
96 HD11 ILE 12 3HD1 ILE 12 10.753 5.069 -8.284
97 HD12 ILE 12 1HD1 ILE 12 10.123 6.541 -9.022
98 HD13 ILE 12 2HD1 ILE 12 9.819 4.975 -9.776
99 H SER 13 H SER 13 14.233 2.283 -8.855
100 HA SER 13 HA SER 13 16.458 2.930 -7.309
101 HB2 SER 13 1HB SER 13 14.874 1.012 -6.920
102 HB3 SER 13 2HB SER 13 15.706 0.141 -8.208
103 HG SER 13 HG SER 13 16.822 1.071 -5.771
104 H ASP 14 H ASP 14 16.247 1.419 -10.485
105 HA ASP 14 HA ASP 14 18.985 0.730 -10.704
106 HB2 ASP 14 1HB ASP 14 16.914 -0.025 -12.122
107 HB3 ASP 14 2HB ASP 14 17.311 1.383 -13.103
108 H HIS 15 H HIS 15 17.162 3.636 -11.418
109 HA HIS 15 HA HIS 15 19.553 4.915 -12.527
110 HB2 HIS 15 1HB HIS 15 16.640 5.697 -12.503
111 HB3 HIS 15 2HB HIS 15 17.910 6.806 -13.011
112 HD1 HIS 15 HD1 HIS 15 18.340 6.795 -15.440
113 HD2 HIS 15 HD2 HIS 15 16.786 3.169 -14.136
114 HE1 HIS 15 HE1 HIS 15 18.062 5.398 -17.513
115 H LEU 16 H LEU 16 18.874 4.278 -9.604
116 HA LEU 16 HA LEU 16 18.374 6.601 -8.166
117 HB2 LEU 16 1HB LEU 16 18.507 4.256 -7.283
118 HB3 LEU 16 2HB LEU 16 20.262 4.408 -7.331
119 HG LEU 16 HG LEU 16 20.035 6.343 -5.740
120 HD11 LEU 16 1HD1 LEU 16 17.390 6.247 -6.379
121 HD12 LEU 16 2HD1 LEU 16 18.060 7.049 -4.960
122 HD13 LEU 16 3HD1 LEU 16 17.416 5.414 -4.825
123 HD21 LEU 16 3HD2 LEU 16 20.790 4.341 -4.799
124 HD22 LEU 16 1HD2 LEU 16 19.228 3.548 -5.006
125 HD23 LEU 16 2HD2 LEU 16 19.423 4.805 -3.785
126 H ALA 17 H ALA 17 21.233 5.588 -9.840
127 HA ALA 17 HA ALA 17 22.892 7.606 -8.551
128 HB1 ALA 17 1HB ALA 17 23.873 6.044 -10.878
129 HB2 ALA 17 2HB ALA 17 24.708 6.521 -9.399
130 HB3 ALA 17 3HB ALA 17 23.563 5.180 -9.371
131 H ASP 18 H ASP 18 20.957 7.211 -11.360
132 HA ASP 18 HA ASP 18 22.229 8.987 -13.126
133 HB2 ASP 18 1HB ASP 18 20.177 7.342 -13.431
134 HB3 ASP 18 2HB ASP 18 19.249 8.798 -13.085
135 H SER 19 H SER 19 22.108 11.164 -13.430
136 HA SER 19 HA SER 19 21.246 12.738 -11.170
137 HB2 SER 19 1HB SER 19 22.118 14.652 -12.649
138 HB3 SER 19 2HB SER 19 23.293 13.457 -12.101
139 HG SER 19 HG SER 19 23.722 13.395 -14.174
140 H ASN 20 H ASN 20 20.469 12.647 -14.645
141 HA ASN 20 HA ASN 20 18.196 14.400 -14.251
142 HB2 ASN 20 1HB ASN 20 19.581 13.192 -16.604
143 HB3 ASN 20 2HB ASN 20 17.906 13.701 -16.797
144 HD21 ASN 20 2HD2 ASN 20 20.730 15.014 -15.092
145 HD22 ASN 20 1HD2 ASN 20 20.634 16.589 -15.797
146 H PHE 21 H PHE 21 16.461 13.527 -13.312
147 HA PHE 21 HA PHE 21 15.605 10.845 -14.177
148 HB2 PHE 21 1HB PHE 21 16.049 10.843 -11.822
149 HB3 PHE 21 2HB PHE 21 15.134 12.329 -11.589
150 HD1 PHE 21 HD2 PHE 21 14.427 9.068 -13.266
151 HD2 PHE 21 HD1 PHE 21 13.225 11.961 -10.384
152 HE1 PHE 21 HE2 PHE 21 12.411 7.744 -12.783
153 HE2 PHE 21 HE1 PHE 21 11.207 10.640 -9.896
154 HZ PHE 21 HZ PHE 21 10.797 8.529 -11.097
155 H ASP 22 H ASP 22 13.674 10.592 -15.130
156 HA ASP 22 HA ASP 22 11.917 12.953 -15.289
157 HB2 ASP 22 1HB ASP 22 13.136 12.035 -17.410
158 HB3 ASP 22 2HB ASP 22 11.903 10.779 -17.356
159 H ILE 23 H ILE 23 10.151 12.697 -14.103
160 HA ILE 23 HA ILE 23 9.242 10.225 -13.101
161 HB ILE 23 HB ILE 23 8.781 12.471 -12.080
162 HG12 ILE 23 1HG1 ILE 23 6.392 10.689 -12.604
163 HG13 ILE 23 2HG1 ILE 23 7.598 10.455 -11.343
164 HG21 ILE 23 1HG2 ILE 23 7.179 13.923 -12.921
165 HG22 ILE 23 2HG2 ILE 23 8.021 13.385 -14.374
166 HG23 ILE 23 3HG2 ILE 23 6.456 12.688 -13.952
167 HD11 ILE 23 3HD1 ILE 23 5.781 11.407 -10.250
168 HD12 ILE 23 1HD1 ILE 23 6.890 12.756 -10.497
169 HD13 ILE 23 2HD1 ILE 23 5.486 12.564 -11.548
170 H ALA 24 H ALA 24 8.513 11.996 -16.008
171 HA ALA 24 HA ALA 24 6.067 10.832 -16.702
172 HB1 ALA 24 1HB ALA 24 6.639 12.660 -17.997
173 HB2 ALA 24 2HB ALA 24 8.281 12.080 -18.276
174 HB3 ALA 24 3HB ALA 24 6.924 11.316 -19.103
175 H SER 25 H SER 25 9.387 9.794 -17.406
176 HA SER 25 HA SER 25 8.716 7.577 -19.001
177 HB2 SER 25 1HB SER 25 11.162 7.802 -17.240
178 HB3 SER 25 2HB SER 25 10.993 6.876 -18.732
179 HG SER 25 HG SER 25 12.003 8.719 -19.329
180 H VAL 26 H VAL 26 8.828 8.031 -15.551
181 HA VAL 26 HA VAL 26 8.874 5.293 -14.807
182 HB VAL 26 HB VAL 26 7.837 7.681 -13.274
183 HG11 VAL 26 1HG1 VAL 26 8.538 4.907 -12.319
184 HG12 VAL 26 2HG1 VAL 26 8.111 6.272 -11.285
185 HG13 VAL 26 3HG1 VAL 26 6.920 5.603 -12.401
186 HG21 VAL 26 3HG2 VAL 26 10.003 8.240 -13.234
187 HG22 VAL 26 1HG2 VAL 26 10.199 6.882 -12.126
188 HG23 VAL 26 2HG2 VAL 26 10.512 6.668 -13.849
189 H ALA 27 H ALA 27 6.279 7.601 -15.434
190 HA ALA 27 HA ALA 27 4.151 5.943 -14.574
191 HB1 ALA 27 1HB ALA 27 4.288 8.528 -15.182
192 HB2 ALA 27 2HB ALA 27 3.664 7.928 -16.720
193 HB3 ALA 27 3HB ALA 27 2.773 7.627 -15.228
194 H GLN 28 H GLN 28 5.655 6.487 -17.734
195 HA GLN 28 HA GLN 28 3.868 4.924 -19.243
196 HB2 GLN 28 1HB GLN 28 5.334 6.463 -20.359
197 HB3 GLN 28 2HB GLN 28 6.758 5.659 -19.711
198 HG2 GLN 28 1HG GLN 28 6.394 3.744 -21.075
199 HG3 GLN 28 2HG GLN 28 4.811 4.335 -21.579
200 HE21 GLN 28 2HE2 GLN 28 6.008 3.787 -23.671
201 HE22 GLN 28 1HE2 GLN 28 6.837 5.100 -24.429
202 H HIS 29 H HIS 29 6.786 4.113 -17.451
203 HA HIS 29 HA HIS 29 7.199 1.524 -18.404
204 HB2 HIS 29 1HB HIS 29 8.897 2.510 -17.061
205 HB3 HIS 29 2HB HIS 29 7.780 2.790 -15.729
206 HD1 HIS 29 HD1 HIS 29 8.200 -0.493 -17.555
207 HD2 HIS 29 HD2 HIS 29 8.982 1.204 -13.845
208 HE1 HIS 29 HE1 HIS 29 8.955 -2.394 -16.092
209 H VAL 30 H VAL 30 4.974 2.750 -15.983
210 HA VAL 30 HA VAL 30 4.060 0.039 -15.366
211 HB VAL 30 HB VAL 30 2.682 1.109 -13.620
212 HG11 VAL 30 1HG1 VAL 30 4.637 1.995 -12.251
213 HG12 VAL 30 2HG1 VAL 30 4.782 0.352 -12.880
214 HG13 VAL 30 3HG1 VAL 30 5.632 1.680 -13.672
215 HG21 VAL 30 3HG2 VAL 30 2.706 3.415 -13.184
216 HG22 VAL 30 1HG2 VAL 30 4.085 3.688 -14.250
217 HG23 VAL 30 2HG2 VAL 30 2.508 3.293 -14.932
218 H CYS 31 H CYS 31 3.536 1.809 -17.868
219 HA CYS 31 HA CYS 31 1.828 2.238 -19.314
220 HB2 CYS 31 1HB CYS 31 0.555 -0.117 -17.904
221 HB3 CYS 31 2HB CYS 31 0.133 0.489 -19.501
222 HG CYS 31 HG CYS 31 3.297 -0.084 -19.651
223 H LEU 32 H LEU 32 1.773 3.785 -16.953
224 HA LEU 32 HA LEU 32 -1.084 4.404 -16.856
225 HB2 LEU 32 1HB LEU 32 0.535 3.424 -14.647
226 HB3 LEU 32 2HB LEU 32 -0.236 4.968 -14.289
227 HG LEU 32 HG LEU 32 -1.835 2.662 -15.344
228 HD11 LEU 32 1HD1 LEU 32 -0.616 1.812 -13.410
229 HD12 LEU 32 2HD1 LEU 32 -2.330 2.010 -13.047
230 HD13 LEU 32 3HD1 LEU 32 -1.161 3.189 -12.453
231 HD21 LEU 32 3HD2 LEU 32 -3.394 4.249 -15.239
232 HD22 LEU 32 1HD2 LEU 32 -2.335 5.338 -14.343
233 HD23 LEU 32 2HD2 LEU 32 -3.275 4.118 -13.484
234 H SER 33 H SER 33 -1.506 6.584 -15.970
235 HA SER 33 HA SER 33 0.393 8.459 -17.055
236 HB2 SER 33 1HB SER 33 -2.395 8.592 -16.012
237 HB3 SER 33 2HB SER 33 -1.446 10.079 -15.996
238 HG SER 33 HG SER 33 -2.487 9.954 -17.958
239 HA PRO 34 HA PRO 34 2.473 9.726 -13.408
240 HB2 PRO 34 1HB PRO 34 2.666 12.413 -13.750
241 HB3 PRO 34 2HB PRO 34 3.604 11.254 -14.699
242 HG2 PRO 34 1HG PRO 34 1.086 12.700 -15.426
243 HG3 PRO 34 2HG PRO 34 2.532 12.406 -16.410
244 HD2 PRO 34 1HD PRO 34 0.278 10.926 -16.654
245 HD3 PRO 34 2HD PRO 34 1.897 10.250 -16.924
246 H SER 35 H SER 35 -0.437 11.584 -14.188
247 HA SER 35 HA SER 35 -0.763 12.752 -11.631
248 HB2 SER 35 1HB SER 35 -2.605 12.302 -13.966
249 HB3 SER 35 2HB SER 35 -3.211 12.974 -12.453
250 HG SER 35 HG SER 35 -2.161 14.332 -14.348
251 H ARG 36 H ARG 36 -2.194 9.873 -13.142
252 HA ARG 36 HA ARG 36 -3.714 9.155 -10.837
253 HB2 ARG 36 1HB ARG 36 -2.891 7.395 -13.151
254 HB3 ARG 36 2HB ARG 36 -4.209 7.104 -12.024
255 HG2 ARG 36 1HG ARG 36 -4.078 9.445 -13.912
256 HG3 ARG 36 2HG ARG 36 -4.935 7.938 -14.242
257 HD2 ARG 36 1HD ARG 36 -6.583 8.382 -12.724
258 HD3 ARG 36 2HD ARG 36 -5.522 9.339 -11.691
259 HE ARG 36 HE ARG 36 -5.831 10.764 -14.043
260 HH11 ARG 36 2HH1 ARG 36 -7.856 9.593 -11.464
261 HH12 ARG 36 1HH1 ARG 36 -9.010 10.878 -11.612
262 HH21 ARG 36 2HH2 ARG 36 -7.342 12.460 -14.246
263 HH22 ARG 36 1HH2 ARG 36 -8.717 12.507 -13.195
264 H LEU 37 H LEU 37 -0.571 8.227 -12.131
265 HA LEU 37 HA LEU 37 -0.095 6.116 -10.292
266 HB2 LEU 37 1HB LEU 37 1.117 6.200 -12.359
267 HB3 LEU 37 2HB LEU 37 1.770 7.788 -11.964
268 HG LEU 37 HG LEU 37 2.946 6.636 -10.015
269 HD11 LEU 37 1HD1 LEU 37 3.333 4.122 -11.005
270 HD12 LEU 37 2HD1 LEU 37 1.609 4.368 -11.281
271 HD13 LEU 37 3HD1 LEU 37 2.274 4.535 -9.656
272 HD21 LEU 37 3HD2 LEU 37 3.695 7.126 -12.608
273 HD22 LEU 37 1HD2 LEU 37 4.126 5.429 -12.393
274 HD23 LEU 37 2HD2 LEU 37 4.776 6.648 -11.297
275 H SER 38 H SER 38 0.670 9.560 -10.311
276 HA SER 38 HA SER 38 2.370 9.629 -8.093
277 HB2 SER 38 1HB SER 38 1.782 12.017 -7.940
278 HB3 SER 38 2HB SER 38 2.085 11.538 -9.610
279 HG SER 38 HG SER 38 -0.267 12.348 -8.388
280 H HIS 39 H HIS 39 -1.151 9.759 -8.309
281 HA HIS 39 HA HIS 39 -1.711 10.384 -5.641
282 HB2 HIS 39 1HB HIS 39 -3.392 10.417 -7.453
283 HB3 HIS 39 2HB HIS 39 -3.338 8.658 -7.520
284 HD1 HIS 39 HD1 HIS 39 -4.992 11.435 -5.829
285 HD2 HIS 39 HD2 HIS 39 -4.336 7.400 -5.086
286 HE1 HIS 39 HE1 HIS 39 -6.634 10.807 -4.031
287 H LEU 40 H LEU 40 -1.414 7.211 -7.221
288 HA LEU 40 HA LEU 40 -1.825 5.733 -4.822
289 HB2 LEU 40 1HB LEU 40 -0.444 4.797 -7.328
290 HB3 LEU 40 2HB LEU 40 -1.221 3.801 -6.099
291 HG LEU 40 HG LEU 40 -2.699 5.731 -7.883
292 HD11 LEU 40 1HD1 LEU 40 -3.311 3.038 -8.487
293 HD12 LEU 40 2HD1 LEU 40 -1.556 3.206 -8.528
294 HD13 LEU 40 3HD1 LEU 40 -2.565 4.253 -9.526
295 HD21 LEU 40 3HD2 LEU 40 -3.455 3.822 -5.737
296 HD22 LEU 40 1HD2 LEU 40 -4.534 3.982 -7.123
297 HD23 LEU 40 2HD2 LEU 40 -4.137 5.397 -6.147
298 H PHE 41 H PHE 41 0.970 7.067 -6.436
299 HA PHE 41 HA PHE 41 2.944 5.586 -5.043
300 HB2 PHE 41 1HB PHE 41 2.938 7.420 -7.119
301 HB3 PHE 41 2HB PHE 41 3.763 8.277 -5.822
302 HD1 PHE 41 HD2 PHE 41 3.874 5.381 -8.060
303 HD2 PHE 41 HD1 PHE 41 5.912 7.562 -5.026
304 HE1 PHE 41 HE2 PHE 41 5.943 4.152 -8.571
305 HE2 PHE 41 HE1 PHE 41 7.985 6.337 -5.533
306 HZ PHE 41 HZ PHE 41 8.002 4.628 -7.307
307 H ARG 42 H ARG 42 1.652 8.868 -4.553
308 HA ARG 42 HA ARG 42 3.136 9.326 -2.168
309 HB2 ARG 42 1HB ARG 42 0.873 10.710 -3.557
310 HB3 ARG 42 2HB ARG 42 1.288 11.172 -1.911
311 HG2 ARG 42 1HG ARG 42 3.728 11.237 -3.038
312 HG3 ARG 42 2HG ARG 42 2.728 11.644 -4.434
313 HD2 ARG 42 1HD ARG 42 2.775 13.739 -3.662
314 HD3 ARG 42 2HD ARG 42 1.644 13.181 -2.429
315 HE ARG 42 HE ARG 42 4.023 12.604 -1.324
316 HH11 ARG 42 2HH1 ARG 42 2.776 15.490 -2.820
317 HH12 ARG 42 1HH1 ARG 42 3.733 16.562 -1.853
318 HH21 ARG 42 2HH2 ARG 42 5.289 14.005 -0.044
319 HH22 ARG 42 1HH2 ARG 42 5.163 15.716 -0.275
320 H GLN 43 H GLN 43 0.073 7.855 -2.883
321 HA GLN 43 HA GLN 43 -0.908 7.979 -0.179
322 HB2 GLN 43 1HB GLN 43 -2.428 7.940 -2.134
323 HB3 GLN 43 2HB GLN 43 -1.879 6.311 -2.506
324 HG2 GLN 43 1HG GLN 43 -3.737 5.764 -1.357
325 HG3 GLN 43 2HG GLN 43 -2.640 5.917 0.014
326 HE21 GLN 43 2HE2 GLN 43 -4.073 6.549 1.535
327 HE22 GLN 43 1HE2 GLN 43 -4.968 8.025 1.473
328 H GLN 44 H GLN 44 0.632 5.568 -2.248
329 HA GLN 44 HA GLN 44 0.478 3.507 -0.239
330 HB2 GLN 44 1HB GLN 44 1.885 3.661 -2.905
331 HB3 GLN 44 2HB GLN 44 1.952 2.250 -1.858
332 HG2 GLN 44 1HG GLN 44 -0.656 3.401 -2.780
333 HG3 GLN 44 2HG GLN 44 0.254 2.251 -3.758
334 HE21 GLN 44 2HE2 GLN 44 -2.367 2.193 -2.217
335 HE22 GLN 44 1HE2 GLN 44 -2.277 0.728 -1.306
336 H LEU 45 H LEU 45 2.952 5.673 -1.531
337 HA LEU 45 HA LEU 45 4.952 4.608 0.291
338 HB2 LEU 45 1HB LEU 45 5.168 6.918 -1.632
339 HB3 LEU 45 2HB LEU 45 6.496 6.104 -0.807
340 HG LEU 45 HG LEU 45 4.936 5.263 -3.194
341 HD11 LEU 45 1HD1 LEU 45 7.187 6.252 -3.362
342 HD12 LEU 45 2HD1 LEU 45 7.120 4.603 -3.984
343 HD13 LEU 45 3HD1 LEU 45 7.823 4.919 -2.397
344 HD21 LEU 45 3HD2 LEU 45 5.976 2.927 -2.732
345 HD22 LEU 45 1HD2 LEU 45 4.435 3.358 -1.989
346 HD23 LEU 45 2HD2 LEU 45 5.921 3.436 -1.043
347 H GLY 46 H GLY 46 2.638 7.123 0.185
348 HA2 GLY 46 1HA GLY 46 2.026 8.579 1.880
349 HA3 GLY 46 2HA GLY 46 3.398 8.009 2.819
350 H ILE 47 H ILE 47 4.686 8.755 -0.070
351 HA ILE 47 HA ILE 47 4.869 11.631 0.316
352 HB ILE 47 HB ILE 47 7.168 11.778 0.664
353 HG12 ILE 47 1HG1 ILE 47 7.898 10.189 -1.030
354 HG13 ILE 47 2HG1 ILE 47 8.711 9.847 0.494
355 HG21 ILE 47 1HG2 ILE 47 7.636 10.417 2.641
356 HG22 ILE 47 2HG2 ILE 47 5.993 11.055 2.673
357 HG23 ILE 47 3HG2 ILE 47 6.275 9.368 2.242
358 HD11 ILE 47 3HD1 ILE 47 8.089 7.773 -0.444
359 HD12 ILE 47 1HD1 ILE 47 6.982 8.075 0.895
360 HD13 ILE 47 2HD1 ILE 47 6.448 8.332 -0.767
361 H SER 48 H SER 48 6.313 12.620 -1.411
362 HA SER 48 HA SER 48 5.479 11.590 -3.955
363 HB2 SER 48 1HB SER 48 6.847 14.040 -2.972
364 HB3 SER 48 2HB SER 48 7.131 13.588 -4.653
365 HG SER 48 HG SER 48 5.277 14.497 -5.010
366 H VAL 49 H VAL 49 6.892 11.096 -5.732
367 HA VAL 49 HA VAL 49 8.821 9.186 -5.191
368 HB VAL 49 HB VAL 49 8.725 10.896 -7.678
369 HG11 VAL 49 1HG1 VAL 49 9.728 8.086 -7.231
370 HG12 VAL 49 2HG1 VAL 49 9.695 8.943 -8.774
371 HG13 VAL 49 3HG1 VAL 49 10.733 9.515 -7.467
372 HG21 VAL 49 3HG2 VAL 49 7.443 8.400 -8.059
373 HG22 VAL 49 1HG2 VAL 49 6.756 9.138 -6.612
374 HG23 VAL 49 2HG2 VAL 49 6.739 10.015 -8.141
375 H LEU 50 H LEU 50 9.206 12.649 -5.759
376 HA LEU 50 HA LEU 50 11.964 12.796 -6.003
377 HB2 LEU 50 1HB LEU 50 9.833 14.641 -5.090
378 HB3 LEU 50 2HB LEU 50 11.495 15.076 -4.698
379 HG LEU 50 HG LEU 50 10.746 16.183 -6.734
380 HD11 LEU 50 1HD1 LEU 50 12.724 14.056 -7.502
381 HD12 LEU 50 2HD1 LEU 50 13.125 15.376 -6.404
382 HD13 LEU 50 3HD1 LEU 50 12.635 15.726 -8.061
383 HD21 LEU 50 3HD2 LEU 50 10.124 14.994 -8.703
384 HD22 LEU 50 1HD2 LEU 50 9.125 14.387 -7.382
385 HD23 LEU 50 2HD2 LEU 50 10.498 13.440 -7.956
386 H SER 51 H SER 51 9.977 12.786 -3.067
387 HA SER 51 HA SER 51 12.199 13.055 -1.294
388 HB2 SER 51 1HB SER 51 9.385 12.081 -0.737
389 HB3 SER 51 2HB SER 51 10.570 12.552 0.481
390 HG SER 51 HG SER 51 10.344 14.625 -0.068
391 H TRP 52 H TRP 52 10.221 10.332 -2.399
392 HA TRP 52 HA TRP 52 11.347 8.345 -0.786
393 HB2 TRP 52 1HB TRP 52 9.298 7.992 -2.079
394 HB3 TRP 52 2HB TRP 52 10.211 8.103 -3.581
395 HD1 TRP 52 HD1 TRP 52 9.704 5.769 -0.566
396 HE1 TRP 52 HE1 TRP 52 10.453 3.400 -1.241
397 HE3 TRP 52 HE3 TRP 52 11.662 6.817 -5.171
398 HZ2 TRP 52 HZ2 TRP 52 11.709 2.143 -3.434
399 HZ3 TRP 52 HZ3 TRP 52 12.618 4.975 -6.493
400 HH2 TRP 52 HH2 TRP 52 12.640 2.688 -5.641
401 H ARG 53 H ARG 53 12.346 9.604 -3.934
402 HA ARG 53 HA ARG 53 14.355 7.737 -4.494
403 HB2 ARG 53 1HB ARG 53 13.333 9.662 -5.943
404 HB3 ARG 53 2HB ARG 53 14.648 10.615 -5.269
405 HG2 ARG 53 1HG ARG 53 15.439 8.010 -6.368
406 HG3 ARG 53 2HG ARG 53 14.813 9.169 -7.543
407 HD2 ARG 53 1HD ARG 53 16.790 10.156 -5.565
408 HD3 ARG 53 2HD ARG 53 17.380 9.083 -6.833
409 HE ARG 53 HE ARG 53 15.764 11.263 -7.795
410 HH11 ARG 53 2HH1 ARG 53 18.973 10.218 -6.941
411 HH12 ARG 53 1HH1 ARG 53 19.762 11.399 -7.934
412 HH21 ARG 53 2HH2 ARG 53 16.791 12.822 -9.105
413 HH22 ARG 53 1HH2 ARG 53 18.520 12.880 -9.164
414 H GLU 54 H GLU 54 14.531 10.866 -2.817
415 HA GLU 54 HA GLU 54 17.312 10.769 -2.322
416 HB2 GLU 54 1HB GLU 54 16.193 12.880 -2.197
417 HB3 GLU 54 2HB GLU 54 15.073 12.283 -0.981
418 HG2 GLU 54 1HG GLU 54 17.961 12.213 -0.332
419 HG3 GLU 54 2HG GLU 54 17.166 13.786 -0.373
420 H ASP 55 H ASP 55 14.507 9.665 -0.499
421 HA ASP 55 HA ASP 55 15.894 9.017 1.883
422 HB2 ASP 55 1HB ASP 55 13.317 9.237 1.373
423 HB3 ASP 55 2HB ASP 55 13.448 7.510 1.048
424 H GLN 56 H GLN 56 15.190 7.231 -1.065
425 HA GLN 56 HA GLN 56 16.012 4.690 -0.132
426 HB2 GLN 56 1HB GLN 56 15.595 5.911 -2.833
427 HB3 GLN 56 2HB GLN 56 16.377 4.341 -2.705
428 HG2 GLN 56 1HG GLN 56 13.778 4.826 -1.323
429 HG3 GLN 56 2HG GLN 56 13.813 4.490 -3.053
430 HE21 GLN 56 2HE2 GLN 56 13.124 3.048 -0.346
431 HE22 GLN 56 1HE2 GLN 56 13.738 1.457 -0.620
432 H ARG 57 H ARG 57 17.708 7.255 -1.899
433 HA ARG 57 HA ARG 57 20.162 5.833 -2.109
434 HB2 ARG 57 1HB ARG 57 21.115 8.035 -2.737
435 HB3 ARG 57 2HB ARG 57 19.671 7.625 -3.654
436 HG2 ARG 57 1HG ARG 57 18.346 9.074 -2.165
437 HG3 ARG 57 2HG ARG 57 19.831 9.526 -1.325
438 HD2 ARG 57 1HD ARG 57 20.601 10.088 -3.804
439 HD3 ARG 57 2HD ARG 57 18.863 10.280 -4.028
440 HE ARG 57 HE ARG 57 19.928 11.679 -1.745
441 HH11 ARG 57 2HH1 ARG 57 19.233 11.828 -5.153
442 HH12 ARG 57 1HH1 ARG 57 19.157 13.559 -5.195
443 HH21 ARG 57 2HH2 ARG 57 19.831 13.958 -1.787
444 HH22 ARG 57 1HH2 ARG 57 19.498 14.769 -3.280
445 H ILE 58 H ILE 58 18.903 8.231 0.163
446 HA ILE 58 HA ILE 58 21.313 8.491 1.651
447 HB ILE 58 HB ILE 58 18.453 9.161 2.332
448 HG12 ILE 58 1HG1 ILE 58 19.594 10.495 0.558
449 HG13 ILE 58 2HG1 ILE 58 19.141 11.449 1.966
450 HG21 ILE 58 1HG2 ILE 58 19.820 10.597 4.119
451 HG22 ILE 58 2HG2 ILE 58 19.201 8.983 4.465
452 HG23 ILE 58 3HG2 ILE 58 20.891 9.199 4.008
453 HD11 ILE 58 3HD1 ILE 58 21.797 10.421 2.286
454 HD12 ILE 58 1HD1 ILE 58 21.648 11.276 0.751
455 HD13 ILE 58 2HD1 ILE 58 21.235 12.092 2.259
456 H SER 59 H SER 59 18.549 6.351 1.823
457 HA SER 59 HA SER 59 19.033 5.322 4.414
458 HB2 SER 59 1HB SER 59 16.869 4.958 3.507
459 HB3 SER 59 2HB SER 59 17.524 4.250 2.030
460 HG SER 59 HG SER 59 17.907 2.401 3.061
461 H GLN 60 H GLN 60 20.115 4.361 1.197
462 HA GLN 60 HA GLN 60 21.357 1.942 1.985
463 HB2 GLN 60 1HB GLN 60 20.730 2.539 -0.359
464 HB3 GLN 60 2HB GLN 60 22.058 3.692 -0.377
465 HG2 GLN 60 1HG GLN 60 22.752 1.689 -1.480
466 HG3 GLN 60 2HG GLN 60 23.628 1.834 0.043
467 HE21 GLN 60 2HE2 GLN 60 23.427 0.273 1.550
468 HE22 GLN 60 1HE2 GLN 60 22.456 -1.143 1.364
469 H ALA 61 H ALA 61 22.523 5.260 1.660
470 HA ALA 61 HA ALA 61 25.250 4.813 2.011
471 HB1 ALA 61 1HB ALA 61 23.887 6.989 1.479
472 HB2 ALA 61 2HB ALA 61 23.991 7.226 3.224
473 HB3 ALA 61 3HB ALA 61 25.464 7.082 2.264
474 H LYS 62 H LYS 62 22.725 5.397 4.440
475 HA LYS 62 HA LYS 62 24.500 5.244 6.662
476 HB2 LYS 62 1HB LYS 62 21.500 4.875 6.595
477 HB3 LYS 62 2HB LYS 62 22.472 5.193 8.026
478 HG2 LYS 62 1HG LYS 62 22.695 7.395 7.557
479 HG3 LYS 62 2HG LYS 62 22.688 7.138 5.810
480 HD2 LYS 62 1HD LYS 62 20.670 8.250 6.266
481 HD3 LYS 62 2HD LYS 62 20.218 6.555 6.077
482 HE2 LYS 62 1HE LYS 62 19.057 7.320 7.981
483 HE3 LYS 62 2HE LYS 62 20.407 6.367 8.595
484 HZ1 LYS 62 3HZ LYS 62 19.772 8.953 9.275
485 HZ2 LYS 62 1HZ LYS 62 21.138 9.095 8.286
486 HZ3 LYS 62 2HZ LYS 62 21.192 8.123 9.670
487 H LEU 63 H LEU 63 22.561 2.926 4.894
488 HA LEU 63 HA LEU 63 22.715 0.813 6.772
489 HB2 LEU 63 1HB LEU 63 21.159 1.068 4.758
490 HB3 LEU 63 2HB LEU 63 22.504 0.455 3.798
491 HG LEU 63 HG LEU 63 21.435 -1.099 6.131
492 HD11 LEU 63 1HD1 LEU 63 19.839 -0.372 4.010
493 HD12 LEU 63 2HD1 LEU 63 19.603 -1.772 5.056
494 HD13 LEU 63 3HD1 LEU 63 20.463 -1.950 3.527
495 HD21 LEU 63 3HD2 LEU 63 23.114 -2.422 5.522
496 HD22 LEU 63 1HD2 LEU 63 23.427 -1.464 4.075
497 HD23 LEU 63 2HD2 LEU 63 22.224 -2.753 4.035
498 H LEU 64 H LEU 64 24.603 1.520 3.838
499 HA LEU 64 HA LEU 64 26.388 -0.665 4.185
500 HB2 LEU 64 1HB LEU 64 27.567 0.182 2.349
501 HB3 LEU 64 2HB LEU 64 25.880 0.589 2.044
502 HG LEU 64 HG LEU 64 26.636 2.877 3.175
503 HD11 LEU 64 1HD1 LEU 64 28.830 2.923 3.562
504 HD12 LEU 64 2HD1 LEU 64 29.018 3.054 1.813
505 HD13 LEU 64 3HD1 LEU 64 29.118 1.476 2.595
506 HD21 LEU 64 3HD2 LEU 64 26.892 3.782 0.956
507 HD22 LEU 64 1HD2 LEU 64 25.640 2.539 0.935
508 HD23 LEU 64 2HD2 LEU 64 27.248 2.181 0.305
509 H LEU 65 H LEU 65 26.460 2.731 5.116
510 HA LEU 65 HA LEU 65 29.149 2.821 5.962
511 HB2 LEU 65 1HB LEU 65 26.711 4.451 6.525
512 HB3 LEU 65 2HB LEU 65 28.178 4.724 7.462
513 HG LEU 65 HG LEU 65 28.213 4.816 4.463
514 HD11 LEU 65 1HD1 LEU 65 28.163 7.434 5.265
515 HD12 LEU 65 2HD1 LEU 65 26.938 6.694 6.295
516 HD13 LEU 65 3HD1 LEU 65 26.816 6.555 4.541
517 HD21 LEU 65 3HD2 LEU 65 29.996 5.621 6.704
518 HD22 LEU 65 1HD2 LEU 65 30.019 6.582 5.225
519 HD23 LEU 65 2HD2 LEU 65 30.388 4.858 5.162
520 H SER 66 H SER 66 26.236 1.658 7.468
521 HA SER 66 HA SER 66 27.219 1.614 10.140
522 HB2 SER 66 1HB SER 66 24.833 1.585 9.763
523 HB3 SER 66 2HB SER 66 24.957 0.105 8.811
524 HG SER 66 HG SER 66 24.288 -0.329 10.946
525 H THR 67 H THR 67 27.790 -0.326 7.403
526 HA THR 67 HA THR 67 28.990 -2.419 9.099
527 HB THR 67 HB THR 67 27.109 -3.323 7.822
528 HG1 THR 67 HG1 THR 67 28.597 -4.881 8.007
529 HG21 THR 67 3HG2 THR 67 27.085 -3.356 5.414
530 HG22 THR 67 1HG2 THR 67 28.648 -2.543 5.345
531 HG23 THR 67 2HG2 THR 67 27.233 -1.683 5.951
532 H THR 68 H THR 68 29.745 0.163 7.290
533 HA THR 68 HA THR 68 32.338 -0.983 6.512
534 HB THR 68 HB THR 68 32.393 0.282 4.463
535 HG1 THR 68 HG1 THR 68 31.194 2.099 5.019
536 HG21 THR 68 3HG2 THR 68 31.313 -1.365 3.421
537 HG22 THR 68 1HG2 THR 68 29.756 -0.687 3.893
538 HG23 THR 68 2HG2 THR 68 30.584 -1.821 4.960
539 H ARG 69 H ARG 69 34.046 0.657 6.258
540 HA ARG 69 HA ARG 69 33.567 3.009 7.968
541 HB2 ARG 69 1HB ARG 69 35.875 2.789 8.785
542 HB3 ARG 69 2HB ARG 69 34.914 1.365 9.161
543 HG2 ARG 69 1HG ARG 69 36.519 1.352 6.663
544 HG3 ARG 69 2HG ARG 69 37.359 1.175 8.205
545 HD2 ARG 69 1HD ARG 69 35.478 -0.602 8.656
546 HD3 ARG 69 2HD ARG 69 35.379 -0.629 6.896
547 HE ARG 69 HE ARG 69 38.050 -0.920 7.930
548 HH11 ARG 69 2HH1 ARG 69 35.121 -2.566 7.018
549 HH12 ARG 69 1HH1 ARG 69 35.908 -4.084 6.737
550 HH21 ARG 69 2HH2 ARG 69 39.097 -2.913 7.563
551 HH22 ARG 69 1HH2 ARG 69 38.169 -4.281 7.048
552 H MET 70 H MET 70 33.671 2.473 4.953
553 HA MET 70 HA MET 70 35.952 3.715 3.882
554 HB2 MET 70 1HB MET 70 33.150 3.363 2.832
555 HB3 MET 70 2HB MET 70 34.409 4.151 1.891
556 HG2 MET 70 1HG MET 70 35.735 2.157 1.883
557 HG3 MET 70 2HG MET 70 34.623 1.362 2.994
558 HE1 MET 70 3HE MET 70 32.220 0.476 2.323
559 HE2 MET 70 1HE MET 70 31.805 2.152 1.961
560 HE3 MET 70 2HE MET 70 31.438 0.881 0.794
561 HA PRO 71 HA PRO 71 35.384 8.007 4.603
562 HB2 PRO 71 1HB PRO 71 36.358 9.081 2.307
563 HB3 PRO 71 2HB PRO 71 37.391 8.338 3.534
564 HG2 PRO 71 1HG PRO 71 36.367 7.183 0.970
565 HG3 PRO 71 2HG PRO 71 37.988 7.068 1.680
566 HD2 PRO 71 1HD PRO 71 36.173 5.066 1.859
567 HD3 PRO 71 2HD PRO 71 37.369 5.387 3.131
568 H ILE 72 H ILE 72 34.336 9.982 3.785
569 HA ILE 72 HA ILE 72 31.717 9.500 2.900
570 HB ILE 72 HB ILE 72 33.179 12.137 2.754
571 HG12 ILE 72 1HG1 ILE 72 33.432 11.214 4.989
572 HG13 ILE 72 2HG1 ILE 72 32.272 12.538 5.027
573 HG21 ILE 72 1HG2 ILE 72 31.232 13.040 2.177
574 HG22 ILE 72 2HG2 ILE 72 30.606 11.406 1.963
575 HG23 ILE 72 3HG2 ILE 72 30.400 12.234 3.506
576 HD11 ILE 72 3HD1 ILE 72 30.647 10.396 4.627
577 HD12 ILE 72 1HD1 ILE 72 31.918 9.705 5.635
578 HD13 ILE 72 2HD1 ILE 72 31.016 11.113 6.195
579 H ALA 73 H ALA 73 34.651 10.277 1.173
580 HA ALA 73 HA ALA 73 33.481 11.073 -1.272
581 HB1 ALA 73 1HB ALA 73 35.764 11.616 -0.861
582 HB2 ALA 73 2HB ALA 73 36.190 9.919 -0.642
583 HB3 ALA 73 3HB ALA 73 35.722 10.512 -2.236
584 H THR 74 H THR 74 34.696 7.931 -0.139
585 HA THR 74 HA THR 74 34.069 6.535 -2.530
586 HB THR 74 HB THR 74 34.486 5.471 0.270
587 HG1 THR 74 HG1 THR 74 36.555 4.860 -0.972
588 HG21 THR 74 3HG2 THR 74 33.293 3.834 -1.039
589 HG22 THR 74 1HG2 THR 74 34.975 3.327 -0.894
590 HG23 THR 74 2HG2 THR 74 34.400 4.053 -2.395
591 H VAL 75 H VAL 75 32.418 6.805 0.607
592 HA VAL 75 HA VAL 75 30.279 5.103 0.100
593 HB VAL 75 HB VAL 75 30.291 7.625 1.764
594 HG11 VAL 75 1HG1 VAL 75 28.020 6.940 1.239
595 HG12 VAL 75 2HG1 VAL 75 28.374 5.295 1.773
596 HG13 VAL 75 3HG1 VAL 75 28.381 6.622 2.936
597 HG21 VAL 75 3HG2 VAL 75 31.738 5.294 2.115
598 HG22 VAL 75 1HG2 VAL 75 31.373 6.495 3.354
599 HG23 VAL 75 2HG2 VAL 75 30.336 5.082 3.163
600 H GLY 76 H GLY 76 30.682 8.532 -0.677
601 HA2 GLY 76 1HA GLY 76 28.094 9.106 -1.534
602 HA3 GLY 76 2HA GLY 76 29.545 9.896 -2.130
603 H ARG 77 H ARG 77 30.794 7.697 -3.345
604 HA ARG 77 HA ARG 77 29.642 7.732 -5.882
605 HB2 ARG 77 1HB ARG 77 31.686 5.963 -4.577
606 HB3 ARG 77 2HB ARG 77 31.135 5.631 -6.214
607 HG2 ARG 77 1HG ARG 77 32.120 7.513 -7.077
608 HG3 ARG 77 2HG ARG 77 32.078 8.372 -5.536
609 HD2 ARG 77 1HD ARG 77 33.810 6.822 -4.679
610 HD3 ARG 77 2HD ARG 77 33.894 6.081 -6.277
611 HE ARG 77 HE ARG 77 34.328 8.734 -6.736
612 HH11 ARG 77 2HH1 ARG 77 35.795 6.320 -4.701
613 HH12 ARG 77 1HH1 ARG 77 37.368 7.044 -4.754
614 HH21 ARG 77 2HH2 ARG 77 36.395 9.697 -6.814
615 HH22 ARG 77 1HH2 ARG 77 37.708 8.965 -5.955
616 H ASN 78 H ASN 78 29.200 5.517 -3.201
617 HA ASN 78 HA ASN 78 27.893 3.450 -4.596
618 HB2 ASN 78 1HB ASN 78 27.646 4.307 -1.704
619 HB3 ASN 78 2HB ASN 78 27.011 2.800 -2.359
620 HD21 ASN 78 2HD2 ASN 78 29.159 3.535 -0.355
621 HD22 ASN 78 1HD2 ASN 78 30.527 2.603 -0.850
622 H VAL 79 H VAL 79 26.775 6.496 -3.296
623 HA VAL 79 HA VAL 79 23.996 5.819 -3.925
624 HB VAL 79 HB VAL 79 23.399 7.902 -2.788
625 HG11 VAL 79 1HG1 VAL 79 25.278 6.122 -1.241
626 HG12 VAL 79 2HG1 VAL 79 24.168 7.282 -0.510
627 HG13 VAL 79 3HG1 VAL 79 23.537 5.919 -1.434
628 HG21 VAL 79 3HG2 VAL 79 26.317 8.238 -2.127
629 HG22 VAL 79 1HG2 VAL 79 25.522 9.090 -3.451
630 HG23 VAL 79 2HG2 VAL 79 24.991 9.350 -1.789
631 H GLY 80 H GLY 80 26.300 6.534 -5.840
632 HA2 GLY 80 1HA GLY 80 26.327 7.479 -7.945
633 HA3 GLY 80 2HA GLY 80 24.678 8.022 -7.671
634 H PHE 81 H PHE 81 26.535 9.030 -5.114
635 HA PHE 81 HA PHE 81 26.498 11.759 -6.058
636 HB2 PHE 81 1HB PHE 81 27.039 10.412 -3.445
637 HB3 PHE 81 2HB PHE 81 27.627 12.054 -3.687
638 HD1 PHE 81 HD1 PHE 81 24.485 10.471 -4.885
639 HD2 PHE 81 HD2 PHE 81 26.280 13.375 -2.342
640 HE1 PHE 81 HE1 PHE 81 22.257 11.347 -4.318
641 HE2 PHE 81 HE2 PHE 81 24.055 14.255 -1.771
642 HZ PHE 81 HZ PHE 81 22.040 13.241 -2.759
643 H ASP 82 H ASP 82 28.097 12.610 -7.196
644 HA ASP 82 HA ASP 82 30.698 11.362 -7.286
645 HB2 ASP 82 1HB ASP 82 31.199 12.914 -9.051
646 HB3 ASP 82 2HB ASP 82 29.560 12.322 -9.304
647 H ASP 83 H ASP 83 29.237 14.191 -5.850
648 HA ASP 83 HA ASP 83 31.851 15.130 -4.915
649 HB2 ASP 83 1HB ASP 83 29.120 16.414 -4.955
650 HB3 ASP 83 2HB ASP 83 30.492 17.118 -4.103
651 H GLN 84 H GLN 84 32.534 14.514 -2.983
652 HA GLN 84 HA GLN 84 30.985 13.040 -1.162
653 HB2 GLN 84 1HB GLN 84 32.876 13.051 0.256
654 HB3 GLN 84 2HB GLN 84 33.516 13.072 -1.381
655 HG2 GLN 84 1HG GLN 84 33.228 15.477 0.404
656 HG3 GLN 84 2HG GLN 84 34.721 14.584 0.120
657 HE21 GLN 84 2HE2 GLN 84 34.697 14.149 -2.535
658 HE22 GLN 84 1HE2 GLN 84 34.734 15.645 -3.398
659 H LEU 85 H LEU 85 31.718 16.465 -1.389
660 HA LEU 85 HA LEU 85 30.719 17.178 1.173
661 HB2 LEU 85 1HB LEU 85 31.353 18.679 -1.335
662 HB3 LEU 85 2HB LEU 85 30.522 19.485 -0.006
663 HG LEU 85 HG LEU 85 33.080 18.056 0.551
664 HD11 LEU 85 1HD1 LEU 85 34.077 19.244 -1.081
665 HD12 LEU 85 2HD1 LEU 85 33.973 20.553 0.095
666 HD13 LEU 85 3HD1 LEU 85 32.764 20.418 -1.181
667 HD21 LEU 85 3HD2 LEU 85 31.671 19.051 2.342
668 HD22 LEU 85 1HD2 LEU 85 31.926 20.633 1.606
669 HD23 LEU 85 2HD2 LEU 85 33.296 19.731 2.254
670 H TYR 86 H TYR 86 29.279 16.876 -2.016
671 HA TYR 86 HA TYR 86 26.849 18.174 -1.525
672 HB2 TYR 86 1HB TYR 86 27.466 17.601 -3.777
673 HB3 TYR 86 2HB TYR 86 27.526 15.887 -3.381
674 HD1 TYR 86 HD1 TYR 86 24.900 18.336 -2.428
675 HD2 TYR 86 HD2 TYR 86 25.925 14.985 -4.840
676 HE1 TYR 86 HE1 TYR 86 22.544 18.105 -3.098
677 HE2 TYR 86 HE2 TYR 86 23.573 14.745 -5.518
678 HH TYR 86 HH TYR 86 21.317 15.372 -4.587
679 H PHE 87 H PHE 87 27.853 14.835 -0.960
680 HA PHE 87 HA PHE 87 25.313 13.865 -0.176
681 HB2 PHE 87 1HB PHE 87 26.998 12.290 -0.835
682 HB3 PHE 87 2HB PHE 87 28.111 12.880 0.396
683 HD1 PHE 87 HD2 PHE 87 24.606 11.592 0.268
684 HD2 PHE 87 HD1 PHE 87 28.405 11.491 2.185
685 HE1 PHE 87 HE2 PHE 87 23.766 9.891 1.835
686 HE2 PHE 87 HE1 PHE 87 27.571 9.790 3.756
687 HZ PHE 87 HZ PHE 87 25.249 8.989 3.582
688 H SER 88 H SER 88 28.086 15.078 1.677
689 HA SER 88 HA SER 88 26.943 14.677 4.228
690 HB2 SER 88 1HB SER 88 28.814 15.756 5.077
691 HB3 SER 88 2HB SER 88 29.414 15.219 3.508
692 HG SER 88 HG SER 88 29.261 17.251 2.738
693 H ARG 89 H ARG 89 26.861 17.371 1.964
694 HA ARG 89 HA ARG 89 25.724 19.289 3.675
695 HB2 ARG 89 1HB ARG 89 25.847 18.935 0.705
696 HB3 ARG 89 2HB ARG 89 24.811 20.185 1.382
697 HG2 ARG 89 1HG ARG 89 26.651 21.302 2.369
698 HG3 ARG 89 2HG ARG 89 27.733 19.947 2.040
699 HD2 ARG 89 1HD ARG 89 27.724 20.375 -0.280
700 HD3 ARG 89 2HD ARG 89 26.343 21.462 -0.151
701 HE ARG 89 HE ARG 89 29.081 22.145 0.174
702 HH11 ARG 89 2HH1 ARG 89 25.883 22.878 1.337
703 HH12 ARG 89 1HH1 ARG 89 26.281 24.500 1.799
704 HH21 ARG 89 2HH2 ARG 89 29.617 24.278 0.778
705 HH22 ARG 89 1HH2 ARG 89 28.405 25.296 1.480
706 H VAL 90 H VAL 90 24.185 17.089 1.335
707 HA VAL 90 HA VAL 90 21.532 17.856 2.023
708 HB VAL 90 HB VAL 90 22.513 15.364 0.624
709 HG11 VAL 90 1HG1 VAL 90 20.423 14.626 0.726
710 HG12 VAL 90 2HG1 VAL 90 19.917 16.081 1.586
711 HG13 VAL 90 3HG1 VAL 90 19.902 16.047 -0.178
712 HG21 VAL 90 3HG2 VAL 90 23.119 17.437 -0.532
713 HG22 VAL 90 1HG2 VAL 90 21.905 16.527 -1.430
714 HG23 VAL 90 2HG2 VAL 90 21.432 17.948 -0.499
715 H PHE 91 H PHE 91 23.574 15.083 2.885
716 HA PHE 91 HA PHE 91 21.676 13.712 4.430
717 HB2 PHE 91 1HB PHE 91 23.660 12.562 3.742
718 HB3 PHE 91 2HB PHE 91 24.693 13.744 4.538
719 HD1 PHE 91 HD2 PHE 91 24.971 13.730 6.953
720 HD2 PHE 91 HD1 PHE 91 22.571 10.818 4.984
721 HE1 PHE 91 HE2 PHE 91 25.001 12.338 8.982
722 HE2 PHE 91 HE1 PHE 91 22.597 9.422 7.010
723 HZ PHE 91 HZ PHE 91 23.814 10.180 9.012
724 H LYS 92 H LYS 92 23.894 16.318 5.219
725 HA LYS 92 HA LYS 92 23.741 16.256 7.999
726 HB2 LYS 92 1HB LYS 92 25.343 17.678 6.917
727 HB3 LYS 92 2HB LYS 92 24.073 18.577 6.098
728 HG2 LYS 92 1HG LYS 92 23.451 19.705 8.028
729 HG3 LYS 92 2HG LYS 92 24.213 18.515 9.085
730 HD2 LYS 92 1HD LYS 92 26.379 19.299 8.569
731 HD3 LYS 92 2HD LYS 92 25.795 20.234 7.190
732 HE2 LYS 92 1HE LYS 92 24.784 21.843 8.579
733 HE3 LYS 92 2HE LYS 92 24.899 20.807 10.001
734 HZ1 LYS 92 3HZ LYS 92 26.954 21.515 10.423
735 HZ2 LYS 92 1HZ LYS 92 26.646 22.770 9.331
736 HZ3 LYS 92 2HZ LYS 92 27.448 21.374 8.811
737 H LYS 93 H LYS 93 21.693 18.005 5.678
738 HA LYS 93 HA LYS 93 19.950 19.013 7.720
739 HB2 LYS 93 1HB LYS 93 19.940 19.037 4.722
740 HB3 LYS 93 2HB LYS 93 18.495 19.507 5.607
741 HG2 LYS 93 1HG LYS 93 19.513 21.534 5.296
742 HG3 LYS 93 2HG LYS 93 20.133 21.082 6.886
743 HD2 LYS 93 1HD LYS 93 22.098 21.664 5.889
744 HD3 LYS 93 2HD LYS 93 22.035 19.969 5.400
745 HE2 LYS 93 1HE LYS 93 22.589 21.262 3.473
746 HE3 LYS 93 2HE LYS 93 20.927 20.704 3.285
747 HZ1 LYS 93 3HZ LYS 93 21.521 23.364 4.421
748 HZ2 LYS 93 1HZ LYS 93 20.090 22.813 3.705
749 HZ3 LYS 93 2HZ LYS 93 21.447 23.129 2.747
750 H CYS 94 H CYS 94 20.107 16.157 5.772
751 HA CYS 94 HA CYS 94 17.437 15.351 5.777
752 HB2 CYS 94 1HB CYS 94 19.551 14.312 4.635
753 HB3 CYS 94 2HB CYS 94 19.649 13.354 6.107
754 HG CYS 94 HG CYS 94 17.485 13.132 3.549
755 H THR 95 H THR 95 20.012 14.614 8.119
756 HA THR 95 HA THR 95 17.954 13.655 9.989
757 HB THR 95 HB THR 95 19.852 12.646 11.252
758 HG1 THR 95 HG1 THR 95 21.810 13.198 10.700
759 HG21 THR 95 3HG2 THR 95 19.248 11.886 8.423
760 HG22 THR 95 1HG2 THR 95 18.788 11.078 9.921
761 HG23 THR 95 2HG2 THR 95 20.449 10.975 9.337
762 H GLY 96 H GLY 96 19.925 16.303 9.335
763 HA2 GLY 96 1HA GLY 96 19.783 18.328 10.554
764 HA3 GLY 96 2HA GLY 96 19.349 17.406 11.986
765 H ALA 97 H ALA 97 21.787 15.668 10.842
766 HA ALA 97 HA ALA 97 23.924 17.355 11.931
767 HB1 ALA 97 1HB ALA 97 23.922 14.499 12.739
768 HB2 ALA 97 2HB ALA 97 24.550 15.916 13.582
769 HB3 ALA 97 3HB ALA 97 22.816 15.593 13.570
770 H SER 98 H SER 98 26.005 16.871 11.184
771 HA SER 98 HA SER 98 26.150 15.860 8.554
772 HB2 SER 98 1HB SER 98 28.756 15.854 9.399
773 HB3 SER 98 2HB SER 98 27.905 17.269 8.779
774 HG SER 98 HG SER 98 29.003 17.109 11.081
775 HA PRO 99 HA PRO 99 26.939 11.568 8.993
776 HB2 PRO 99 1HB PRO 99 28.911 11.126 7.180
777 HB3 PRO 99 2HB PRO 99 27.242 11.477 6.717
778 HG2 PRO 99 1HG PRO 99 29.604 13.313 6.826
779 HG3 PRO 99 2HG PRO 99 28.345 13.183 5.585
780 HD2 PRO 99 1HD PRO 99 28.327 15.116 7.481
781 HD3 PRO 99 2HD PRO 99 26.837 14.427 6.806
782 H SER 100 H SER 100 29.783 13.652 9.137
783 HA SER 100 HA SER 100 31.555 11.723 10.213
784 HB2 SER 100 1HB SER 100 33.079 13.489 10.498
785 HB3 SER 100 2HB SER 100 32.097 14.009 9.129
786 HG SER 100 HG SER 100 31.509 15.664 10.264
787 H GLU 101 H GLU 101 29.254 13.951 11.640
788 HA GLU 101 HA GLU 101 30.154 13.582 14.330
789 HB2 GLU 101 1HB GLU 101 28.894 15.589 13.511
790 HB3 GLU 101 2HB GLU 101 27.462 14.578 13.388
791 HG2 GLU 101 1HG GLU 101 27.006 14.897 15.524
792 HG3 GLU 101 2HG GLU 101 28.588 14.276 15.989
793 H PHE 102 H PHE 102 27.420 12.334 12.434
794 HA PHE 102 HA PHE 102 26.262 10.779 14.453
795 HB2 PHE 102 1HB PHE 102 25.397 11.394 12.069
796 HB3 PHE 102 2HB PHE 102 26.214 9.913 11.581
797 HD1 PHE 102 HD2 PHE 102 23.484 11.319 13.588
798 HD2 PHE 102 HD1 PHE 102 25.353 7.764 12.178
799 HE1 PHE 102 HE2 PHE 102 21.523 10.012 14.294
800 HE2 PHE 102 HE1 PHE 102 23.394 6.452 12.881
801 HZ PHE 102 HZ PHE 102 21.476 7.575 13.942
802 H ARG 103 H ARG 103 28.678 9.932 11.995
803 HA ARG 103 HA ARG 103 28.919 7.217 12.619
804 HB2 ARG 103 1HB ARG 103 29.872 8.379 10.605
805 HB3 ARG 103 2HB ARG 103 31.139 9.018 11.643
806 HG2 ARG 103 1HG ARG 103 32.182 7.188 10.756
807 HG3 ARG 103 2HG ARG 103 31.512 6.501 12.237
808 HD2 ARG 103 1HD ARG 103 29.542 5.745 10.913
809 HD3 ARG 103 2HD ARG 103 30.365 6.302 9.457
810 HE ARG 103 HE ARG 103 31.713 4.449 9.545
811 HH11 ARG 103 2HH1 ARG 103 30.037 4.805 12.576
812 HH12 ARG 103 1HH1 ARG 103 30.542 3.264 13.185
813 HH21 ARG 103 2HH2 ARG 103 32.384 2.418 10.336
814 HH22 ARG 103 1HH2 ARG 103 31.878 1.907 11.910
815 H ALA 104 H ALA 104 30.541 10.050 13.968
816 HA ALA 104 HA ALA 104 32.366 8.629 15.601
817 HB1 ALA 104 1HB ALA 104 31.369 11.441 15.516
818 HB2 ALA 104 2HB ALA 104 32.321 10.894 16.897
819 HB3 ALA 104 3HB ALA 104 33.001 10.817 15.272
820 H GLY 105 H GLY 105 29.018 9.482 15.958
821 HA2 GLY 105 1HA GLY 105 27.538 8.485 17.481
822 HA3 GLY 105 2HA GLY 105 28.914 7.952 18.436
823 H CYS 106 H CYS 106 29.727 10.991 17.932
824 HA CYS 106 HA CYS 106 29.002 11.853 20.534
825 HB2 CYS 106 1HB CYS 106 31.060 12.570 19.302
826 HB3 CYS 106 2HB CYS 106 30.038 13.546 18.254
827 HG CYS 106 HG CYS 106 30.440 13.995 21.623
828 H GLU 107 H GLU 107 27.143 12.686 21.195
829 HA GLU 107 HA GLU 107 25.041 13.321 19.384
830 HB2 GLU 107 1HB GLU 107 23.788 13.970 21.402
831 HB3 GLU 107 2HB GLU 107 24.554 12.398 21.579
832 HG2 GLU 107 1HG GLU 107 26.411 13.539 22.806
833 HG3 GLU 107 2HG GLU 107 25.439 15.009 22.775
Start of MODEL 20
1 H1 MET 1 H MET 1 4.060 -2.303 -0.757
2 HA MET 1 HA MET 1 2.254 -0.040 -1.040
3 HB2 MET 1 1HB MET 1 3.413 0.614 -3.202
4 HB3 MET 1 2HB MET 1 4.248 1.043 -1.715
5 HG2 MET 1 1HG MET 1 4.932 -1.552 -2.964
6 HG3 MET 1 2HG MET 1 5.478 -0.085 -3.772
7 HE1 MET 1 3HE MET 1 7.760 1.588 -2.224
8 HE2 MET 1 1HE MET 1 6.022 1.881 -2.166
9 HE3 MET 1 2HE MET 1 6.942 1.738 -0.668
10 H ASP 2 H ASP 2 1.635 -0.060 -3.609
11 HA ASP 2 HA ASP 2 0.324 -2.597 -3.951
12 HB2 ASP 2 1HB ASP 2 -0.572 -0.221 -4.517
13 HB3 ASP 2 2HB ASP 2 0.333 -0.415 -6.015
14 H ASN 3 H ASN 3 0.555 -4.029 -5.690
15 HA ASN 3 HA ASN 3 3.142 -4.647 -6.474
16 HB2 ASN 3 1HB ASN 3 2.193 -6.284 -7.920
17 HB3 ASN 3 2HB ASN 3 1.105 -6.155 -6.541
18 HD21 ASN 3 2HD2 ASN 3 -0.920 -5.254 -6.810
19 HD22 ASN 3 1HD2 ASN 3 -1.617 -4.988 -8.368
20 H ARG 4 H ARG 4 0.770 -2.567 -7.992
21 HA ARG 4 HA ARG 4 2.115 -2.311 -10.487
22 HB2 ARG 4 1HB ARG 4 -0.132 -1.740 -10.611
23 HB3 ARG 4 2HB ARG 4 -0.090 -0.833 -9.105
24 HG2 ARG 4 1HG ARG 4 -0.365 0.651 -11.001
25 HG3 ARG 4 2HG ARG 4 1.184 0.938 -10.205
26 HD2 ARG 4 1HD ARG 4 1.594 0.960 -12.543
27 HD3 ARG 4 2HD ARG 4 2.230 -0.563 -11.925
28 HE ARG 4 HE ARG 4 -0.469 -0.701 -12.940
29 HH11 ARG 4 2HH1 ARG 4 2.922 -0.995 -13.671
30 HH12 ARG 4 1HH1 ARG 4 2.669 -1.999 -15.060
31 HH21 ARG 4 2HH2 ARG 4 -0.815 -2.022 -14.767
32 HH22 ARG 4 1HH2 ARG 4 0.543 -2.582 -15.683
33 H VAL 5 H VAL 5 2.033 -0.351 -7.533
34 HA VAL 5 HA VAL 5 3.736 1.698 -8.517
35 HB VAL 5 HB VAL 5 3.151 0.905 -5.661
36 HG11 VAL 5 1HG1 VAL 5 5.054 2.723 -6.708
37 HG12 VAL 5 2HG1 VAL 5 3.759 3.667 -5.968
38 HG13 VAL 5 3HG1 VAL 5 4.614 2.446 -5.023
39 HG21 VAL 5 3HG2 VAL 5 1.944 3.190 -7.194
40 HG22 VAL 5 1HG2 VAL 5 1.214 1.585 -7.171
41 HG23 VAL 5 2HG2 VAL 5 1.411 2.487 -5.668
42 H ARG 6 H ARG 6 4.293 -1.262 -6.672
43 HA ARG 6 HA ARG 6 6.957 -0.870 -5.975
44 HB2 ARG 6 1HB ARG 6 5.233 -2.817 -5.461
45 HB3 ARG 6 2HB ARG 6 6.062 -3.592 -6.805
46 HG2 ARG 6 1HG ARG 6 7.956 -3.923 -5.626
47 HG3 ARG 6 2HG ARG 6 7.786 -2.418 -4.722
48 HD2 ARG 6 1HD ARG 6 6.515 -3.378 -3.094
49 HD3 ARG 6 2HD ARG 6 5.803 -4.556 -4.195
50 HE ARG 6 HE ARG 6 7.520 -6.005 -3.717
51 HH11 ARG 6 2HH1 ARG 6 8.293 -2.835 -2.504
52 HH12 ARG 6 1HH1 ARG 6 9.678 -3.372 -1.612
53 HH21 ARG 6 2HH2 ARG 6 9.341 -6.724 -2.546
54 HH22 ARG 6 1HH2 ARG 6 10.274 -5.584 -1.638
55 H GLU 7 H GLU 7 5.533 -1.943 -9.001
56 HA GLU 7 HA GLU 7 7.877 -2.867 -10.248
57 HB2 GLU 7 1HB GLU 7 5.155 -2.146 -11.071
58 HB3 GLU 7 2HB GLU 7 6.365 -1.887 -12.320
59 HG2 GLU 7 1HG GLU 7 5.614 -4.051 -12.696
60 HG3 GLU 7 2HG GLU 7 7.130 -4.272 -11.823
61 H ALA 8 H ALA 8 6.394 0.339 -10.108
62 HA ALA 8 HA ALA 8 8.239 1.576 -11.885
63 HB1 ALA 8 1HB ALA 8 6.868 3.197 -9.812
64 HB2 ALA 8 2HB ALA 8 7.062 3.493 -11.541
65 HB3 ALA 8 3HB ALA 8 5.863 2.330 -10.974
66 H CYS 9 H CYS 9 8.121 1.114 -8.399
67 HA CYS 9 HA CYS 9 10.164 2.881 -7.663
68 HB2 CYS 9 1HB CYS 9 9.405 0.255 -6.365
69 HB3 CYS 9 2HB CYS 9 10.344 1.539 -5.613
70 HG CYS 9 HG CYS 9 8.296 2.632 -4.540
71 H GLN 10 H GLN 10 10.269 -0.429 -8.848
72 HA GLN 10 HA GLN 10 12.963 -0.979 -8.295
73 HB2 GLN 10 1HB GLN 10 11.394 -2.729 -8.930
74 HB3 GLN 10 2HB GLN 10 11.200 -2.010 -10.523
75 HG2 GLN 10 1HG GLN 10 12.658 -3.959 -10.583
76 HG3 GLN 10 2HG GLN 10 13.514 -2.492 -11.053
77 HE21 GLN 10 2HE2 GLN 10 15.545 -3.093 -10.518
78 HE22 GLN 10 1HE2 GLN 10 16.059 -3.449 -8.908
79 H TYR 11 H TYR 11 11.418 0.672 -10.987
80 HA TYR 11 HA TYR 11 13.705 0.800 -12.655
81 HB2 TYR 11 1HB TYR 11 11.564 1.133 -13.659
82 HB3 TYR 11 2HB TYR 11 11.173 2.441 -12.547
83 HD1 TYR 11 HD2 TYR 11 13.859 1.600 -15.016
84 HD2 TYR 11 HD1 TYR 11 11.271 4.571 -13.410
85 HE1 TYR 11 HE2 TYR 11 14.735 3.231 -16.636
86 HE2 TYR 11 HE1 TYR 11 12.138 6.210 -15.026
87 HH TYR 11 HH TYR 11 13.921 5.366 -17.720
88 H ILE 12 H ILE 12 12.311 3.044 -10.293
89 HA ILE 12 HA ILE 12 14.139 5.148 -10.715
90 HB ILE 12 HB ILE 12 12.605 4.462 -8.205
91 HG12 ILE 12 1HG1 ILE 12 11.926 6.429 -10.399
92 HG13 ILE 12 2HG1 ILE 12 11.226 4.819 -10.264
93 HG21 ILE 12 1HG2 ILE 12 13.942 7.030 -9.046
94 HG22 ILE 12 2HG2 ILE 12 12.916 6.829 -7.627
95 HG23 ILE 12 3HG2 ILE 12 14.450 5.966 -7.735
96 HD11 ILE 12 3HD1 ILE 12 10.974 7.018 -8.225
97 HD12 ILE 12 1HD1 ILE 12 9.738 6.535 -9.386
98 HD13 ILE 12 2HD1 ILE 12 10.247 5.415 -8.121
99 H SER 13 H SER 13 14.215 2.317 -8.625
100 HA SER 13 HA SER 13 16.470 3.073 -7.096
101 HB2 SER 13 1HB SER 13 14.740 1.177 -6.679
102 HB3 SER 13 2HB SER 13 15.798 0.206 -7.703
103 HG SER 13 HG SER 13 16.163 1.091 -5.126
104 H ASP 14 H ASP 14 16.121 1.125 -10.036
105 HA ASP 14 HA ASP 14 18.869 0.480 -10.282
106 HB2 ASP 14 1HB ASP 14 16.452 0.259 -11.981
107 HB3 ASP 14 2HB ASP 14 17.995 0.287 -12.830
108 H HIS 15 H HIS 15 17.001 3.271 -11.107
109 HA HIS 15 HA HIS 15 19.188 4.359 -12.728
110 HB2 HIS 15 1HB HIS 15 16.276 4.897 -12.518
111 HB3 HIS 15 2HB HIS 15 17.311 6.276 -12.877
112 HD1 HIS 15 HD1 HIS 15 17.565 6.662 -15.294
113 HD2 HIS 15 HD2 HIS 15 16.992 2.637 -14.439
114 HE1 HIS 15 HE1 HIS 15 17.551 5.496 -17.523
115 H LEU 16 H LEU 16 18.971 4.071 -9.683
116 HA LEU 16 HA LEU 16 18.769 6.641 -8.551
117 HB2 LEU 16 1HB LEU 16 18.757 4.368 -7.392
118 HB3 LEU 16 2HB LEU 16 20.515 4.439 -7.488
119 HG LEU 16 HG LEU 16 19.163 6.762 -6.249
120 HD11 LEU 16 1HD1 LEU 16 18.376 5.759 -4.391
121 HD12 LEU 16 2HD1 LEU 16 19.599 4.489 -4.424
122 HD13 LEU 16 3HD1 LEU 16 18.187 4.380 -5.475
123 HD21 LEU 16 3HD2 LEU 16 21.756 5.760 -6.475
124 HD22 LEU 16 1HD2 LEU 16 21.305 5.501 -4.790
125 HD23 LEU 16 2HD2 LEU 16 21.220 7.119 -5.486
126 H ALA 17 H ALA 17 21.326 5.035 -10.252
127 HA ALA 17 HA ALA 17 23.324 6.978 -9.407
128 HB1 ALA 17 1HB ALA 17 24.362 5.383 -11.474
129 HB2 ALA 17 2HB ALA 17 24.682 5.256 -9.744
130 HB3 ALA 17 3HB ALA 17 23.377 4.318 -10.470
131 H ASP 18 H ASP 18 21.102 6.464 -11.974
132 HA ASP 18 HA ASP 18 22.404 7.802 -14.073
133 HB2 ASP 18 1HB ASP 18 19.576 7.112 -13.430
134 HB3 ASP 18 2HB ASP 18 19.864 8.309 -14.690
135 H SER 19 H SER 19 22.428 9.920 -14.737
136 HA SER 19 HA SER 19 22.089 11.891 -12.662
137 HB2 SER 19 1HB SER 19 23.950 11.773 -14.477
138 HB3 SER 19 2HB SER 19 22.757 12.548 -15.519
139 HG SER 19 HG SER 19 23.877 13.523 -13.110
140 H ASN 20 H ASN 20 20.687 11.313 -15.878
141 HA ASN 20 HA ASN 20 18.735 13.416 -15.503
142 HB2 ASN 20 1HB ASN 20 19.136 11.408 -17.730
143 HB3 ASN 20 2HB ASN 20 17.908 12.671 -17.745
144 HD21 ASN 20 2HD2 ASN 20 19.910 12.391 -19.679
145 HD22 ASN 20 1HD2 ASN 20 20.945 13.772 -19.594
146 H PHE 21 H PHE 21 17.336 12.870 -13.893
147 HA PHE 21 HA PHE 21 15.919 10.304 -14.134
148 HB2 PHE 21 1HB PHE 21 16.976 10.547 -11.982
149 HB3 PHE 21 2HB PHE 21 16.282 12.150 -11.769
150 HD1 PHE 21 HD2 PHE 21 14.773 8.915 -12.839
151 HD2 PHE 21 HD1 PHE 21 14.832 12.073 -9.987
152 HE1 PHE 21 HE2 PHE 21 12.833 7.918 -11.700
153 HE2 PHE 21 HE1 PHE 21 12.893 11.081 -8.843
154 HZ PHE 21 HZ PHE 21 11.890 9.002 -9.700
155 H ASP 22 H ASP 22 14.112 10.531 -15.281
156 HA ASP 22 HA ASP 22 12.420 12.888 -14.760
157 HB2 ASP 22 1HB ASP 22 11.768 12.961 -16.991
158 HB3 ASP 22 2HB ASP 22 13.464 12.502 -17.116
159 H ILE 23 H ILE 23 10.385 12.564 -14.083
160 HA ILE 23 HA ILE 23 9.578 9.979 -13.226
161 HB ILE 23 HB ILE 23 8.910 12.120 -12.116
162 HG12 ILE 23 1HG1 ILE 23 6.640 10.307 -12.966
163 HG13 ILE 23 2HG1 ILE 23 7.762 9.991 -11.647
164 HG21 ILE 23 1HG2 ILE 23 7.387 13.591 -13.016
165 HG22 ILE 23 2HG2 ILE 23 8.285 13.106 -14.453
166 HG23 ILE 23 3HG2 ILE 23 6.711 12.388 -14.113
167 HD11 ILE 23 3HD1 ILE 23 5.394 11.692 -11.738
168 HD12 ILE 23 1HD1 ILE 23 6.183 10.907 -10.370
169 HD13 ILE 23 2HD1 ILE 23 6.797 12.445 -10.979
170 H ALA 24 H ALA 24 9.131 11.766 -16.141
171 HA ALA 24 HA ALA 24 6.756 10.657 -17.110
172 HB1 ALA 24 1HB ALA 24 7.313 12.277 -18.551
173 HB2 ALA 24 2HB ALA 24 9.039 12.099 -18.234
174 HB3 ALA 24 3HB ALA 24 8.236 11.020 -19.375
175 H SER 25 H SER 25 10.087 9.484 -17.289
176 HA SER 25 HA SER 25 9.508 7.261 -18.964
177 HB2 SER 25 1HB SER 25 11.782 8.260 -18.682
178 HB3 SER 25 2HB SER 25 11.832 7.590 -17.052
179 HG SER 25 HG SER 25 12.328 6.378 -19.413
180 H VAL 26 H VAL 26 9.391 7.814 -15.528
181 HA VAL 26 HA VAL 26 9.354 5.103 -14.699
182 HB VAL 26 HB VAL 26 8.222 7.544 -13.324
183 HG11 VAL 26 1HG1 VAL 26 7.283 6.062 -11.943
184 HG12 VAL 26 2HG1 VAL 26 8.187 4.715 -12.636
185 HG13 VAL 26 3HG1 VAL 26 8.920 5.720 -11.385
186 HG21 VAL 26 3HG2 VAL 26 10.730 6.234 -12.442
187 HG22 VAL 26 1HG2 VAL 26 10.794 7.190 -13.922
188 HG23 VAL 26 2HG2 VAL 26 10.269 7.936 -12.413
189 H ALA 27 H ALA 27 6.765 7.456 -15.323
190 HA ALA 27 HA ALA 27 4.616 5.759 -14.682
191 HB1 ALA 27 1HB ALA 27 4.894 8.397 -15.429
192 HB2 ALA 27 2HB ALA 27 4.006 7.681 -16.775
193 HB3 ALA 27 3HB ALA 27 3.373 7.554 -15.134
194 H GLN 28 H GLN 28 6.328 6.353 -17.715
195 HA GLN 28 HA GLN 28 4.610 4.875 -19.388
196 HB2 GLN 28 1HB GLN 28 6.237 6.451 -20.285
197 HB3 GLN 28 2HB GLN 28 7.561 5.467 -19.675
198 HG2 GLN 28 1HG GLN 28 7.119 3.740 -21.222
199 HG3 GLN 28 2HG GLN 28 5.565 4.442 -21.668
200 HE21 GLN 28 2HE2 GLN 28 9.045 4.990 -21.764
201 HE22 GLN 28 1HE2 GLN 28 9.038 5.946 -23.203
202 H HIS 29 H HIS 29 7.380 3.956 -17.422
203 HA HIS 29 HA HIS 29 7.814 1.386 -18.417
204 HB2 HIS 29 1HB HIS 29 9.429 2.289 -16.928
205 HB3 HIS 29 2HB HIS 29 8.224 2.574 -15.676
206 HD1 HIS 29 HD1 HIS 29 8.733 -0.678 -17.544
207 HD2 HIS 29 HD2 HIS 29 9.201 0.913 -13.734
208 HE1 HIS 29 HE1 HIS 29 9.318 -2.628 -16.068
209 H VAL 30 H VAL 30 5.435 2.589 -16.137
210 HA VAL 30 HA VAL 30 4.421 -0.123 -15.693
211 HB VAL 30 HB VAL 30 2.960 0.913 -13.987
212 HG11 VAL 30 1HG1 VAL 30 5.315 1.987 -12.872
213 HG12 VAL 30 2HG1 VAL 30 4.634 0.377 -12.630
214 HG13 VAL 30 3HG1 VAL 30 5.806 0.656 -13.918
215 HG21 VAL 30 3HG2 VAL 30 3.080 3.196 -13.412
216 HG22 VAL 30 1HG2 VAL 30 4.505 3.456 -14.420
217 HG23 VAL 30 2HG2 VAL 30 2.936 3.162 -15.169
218 H CYS 31 H CYS 31 4.108 1.737 -18.145
219 HA CYS 31 HA CYS 31 2.509 2.283 -19.673
220 HB2 CYS 31 1HB CYS 31 1.251 -0.147 -18.393
221 HB3 CYS 31 2HB CYS 31 0.620 0.620 -19.846
222 HG CYS 31 HG CYS 31 3.871 -0.315 -19.877
223 H LEU 32 H LEU 32 2.376 3.728 -17.230
224 HA LEU 32 HA LEU 32 -0.472 4.435 -17.257
225 HB2 LEU 32 1HB LEU 32 0.536 3.061 -15.188
226 HB3 LEU 32 2HB LEU 32 0.950 4.696 -14.676
227 HG LEU 32 HG LEU 32 -1.431 5.319 -14.826
228 HD11 LEU 32 1HD1 LEU 32 -2.537 2.673 -14.829
229 HD12 LEU 32 2HD1 LEU 32 -1.629 2.952 -16.315
230 HD13 LEU 32 3HD1 LEU 32 -2.929 4.052 -15.857
231 HD21 LEU 32 3HD2 LEU 32 -0.516 4.612 -12.695
232 HD22 LEU 32 1HD2 LEU 32 -0.831 2.923 -13.094
233 HD23 LEU 32 2HD2 LEU 32 -2.176 4.040 -12.862
234 H SER 33 H SER 33 -0.863 6.624 -16.322
235 HA SER 33 HA SER 33 1.078 8.469 -17.401
236 HB2 SER 33 1HB SER 33 -1.722 8.651 -16.395
237 HB3 SER 33 2HB SER 33 -0.748 10.121 -16.380
238 HG SER 33 HG SER 33 -1.913 9.821 -18.350
239 HA PRO 34 HA PRO 34 3.123 9.695 -13.720
240 HB2 PRO 34 1HB PRO 34 3.383 12.375 -14.068
241 HB3 PRO 34 2HB PRO 34 4.312 11.191 -14.995
242 HG2 PRO 34 1HG PRO 34 1.842 12.691 -15.775
243 HG3 PRO 34 2HG PRO 34 3.298 12.360 -16.731
244 HD2 PRO 34 1HD PRO 34 1.015 10.931 -17.010
245 HD3 PRO 34 2HD PRO 34 2.623 10.217 -17.248
246 H SER 35 H SER 35 0.331 11.722 -14.561
247 HA SER 35 HA SER 35 -0.028 12.857 -12.005
248 HB2 SER 35 1HB SER 35 -1.069 13.498 -14.323
249 HB3 SER 35 2HB SER 35 -2.342 12.373 -13.852
250 HG SER 35 HG SER 35 -2.478 14.740 -13.234
251 H ARG 36 H ARG 36 -1.525 10.040 -13.566
252 HA ARG 36 HA ARG 36 -3.147 9.371 -11.322
253 HB2 ARG 36 1HB ARG 36 -3.727 8.670 -13.600
254 HB3 ARG 36 2HB ARG 36 -2.277 7.676 -13.670
255 HG2 ARG 36 1HG ARG 36 -4.165 6.271 -13.238
256 HG3 ARG 36 2HG ARG 36 -3.162 6.334 -11.787
257 HD2 ARG 36 1HD ARG 36 -4.682 7.653 -10.639
258 HD3 ARG 36 2HD ARG 36 -5.446 8.234 -12.118
259 HE ARG 36 HE ARG 36 -5.921 5.520 -12.033
260 HH11 ARG 36 2HH1 ARG 36 -6.629 8.287 -10.043
261 HH12 ARG 36 1HH1 ARG 36 -8.101 7.623 -9.416
262 HH21 ARG 36 2HH2 ARG 36 -7.857 4.635 -11.214
263 HH22 ARG 36 1HH2 ARG 36 -8.798 5.545 -10.082
264 H LEU 37 H LEU 37 0.054 8.437 -12.422
265 HA LEU 37 HA LEU 37 0.406 6.270 -10.626
266 HB2 LEU 37 1HB LEU 37 1.799 6.371 -12.538
267 HB3 LEU 37 2HB LEU 37 2.330 8.006 -12.150
268 HG LEU 37 HG LEU 37 3.402 6.938 -10.067
269 HD11 LEU 37 1HD1 LEU 37 4.120 4.544 -10.619
270 HD12 LEU 37 2HD1 LEU 37 2.745 4.526 -11.723
271 HD13 LEU 37 3HD1 LEU 37 2.488 4.791 -9.999
272 HD21 LEU 37 3HD2 LEU 37 4.561 7.826 -12.115
273 HD22 LEU 37 1HD2 LEU 37 4.568 6.175 -12.735
274 HD23 LEU 37 2HD2 LEU 37 5.428 6.561 -11.244
275 H SER 38 H SER 38 1.311 9.695 -10.494
276 HA SER 38 HA SER 38 2.726 9.629 -8.083
277 HB2 SER 38 1HB SER 38 1.107 11.858 -9.334
278 HB3 SER 38 2HB SER 38 2.176 12.073 -7.948
279 HG SER 38 HG SER 38 2.931 12.373 -10.320
280 H HIS 39 H HIS 39 -0.723 10.007 -8.732
281 HA HIS 39 HA HIS 39 -1.566 10.656 -6.145
282 HB2 HIS 39 1HB HIS 39 -2.995 10.808 -8.165
283 HB3 HIS 39 2HB HIS 39 -3.070 9.050 -8.222
284 HD1 HIS 39 HD1 HIS 39 -4.810 11.920 -6.898
285 HD2 HIS 39 HD2 HIS 39 -4.345 7.944 -5.786
286 HE1 HIS 39 HE1 HIS 39 -6.678 11.451 -5.281
287 H LEU 40 H LEU 40 -1.302 7.478 -7.721
288 HA LEU 40 HA LEU 40 -2.098 6.026 -5.402
289 HB2 LEU 40 1HB LEU 40 -1.016 5.369 -8.083
290 HB3 LEU 40 2HB LEU 40 -0.835 4.155 -6.817
291 HG LEU 40 HG LEU 40 -3.454 5.339 -7.737
292 HD11 LEU 40 1HD1 LEU 40 -3.840 3.083 -8.675
293 HD12 LEU 40 2HD1 LEU 40 -2.164 2.676 -8.307
294 HD13 LEU 40 3HD1 LEU 40 -2.526 3.952 -9.469
295 HD21 LEU 40 3HD2 LEU 40 -4.202 3.184 -6.434
296 HD22 LEU 40 1HD2 LEU 40 -3.910 4.702 -5.584
297 HD23 LEU 40 2HD2 LEU 40 -2.680 3.438 -5.578
298 H PHE 41 H PHE 41 0.958 7.124 -6.696
299 HA PHE 41 HA PHE 41 2.688 5.500 -5.202
300 HB2 PHE 41 1HB PHE 41 3.000 7.478 -7.083
301 HB3 PHE 41 2HB PHE 41 3.633 8.245 -5.630
302 HD1 PHE 41 HD1 PHE 41 4.042 5.450 -7.974
303 HD2 PHE 41 HD2 PHE 41 5.674 7.517 -4.630
304 HE1 PHE 41 HE1 PHE 41 6.167 4.244 -8.270
305 HE2 PHE 41 HE2 PHE 41 7.801 6.315 -4.921
306 HZ PHE 41 HZ PHE 41 8.050 4.677 -6.743
307 H ARG 42 H ARG 42 1.449 8.764 -4.509
308 HA ARG 42 HA ARG 42 2.679 8.934 -1.952
309 HB2 ARG 42 1HB ARG 42 2.076 10.948 -3.156
310 HB3 ARG 42 2HB ARG 42 0.381 10.479 -3.161
311 HG2 ARG 42 1HG ARG 42 0.086 11.003 -0.943
312 HG3 ARG 42 2HG ARG 42 1.798 10.807 -0.560
313 HD2 ARG 42 1HD ARG 42 2.340 12.861 -1.680
314 HD3 ARG 42 2HD ARG 42 0.689 13.022 -2.277
315 HE ARG 42 HE ARG 42 0.459 12.932 0.453
316 HH11 ARG 42 2HH1 ARG 42 2.140 14.932 -1.848
317 HH12 ARG 42 1HH1 ARG 42 2.076 16.352 -0.857
318 HH21 ARG 42 2HH2 ARG 42 0.368 14.795 1.767
319 HH22 ARG 42 1HH2 ARG 42 1.069 16.273 1.199
320 H GLN 43 H GLN 43 -0.242 7.513 -3.115
321 HA GLN 43 HA GLN 43 -1.576 7.452 -0.568
322 HB2 GLN 43 1HB GLN 43 -2.716 7.435 -2.833
323 HB3 GLN 43 2HB GLN 43 -2.200 5.760 -2.987
324 HG2 GLN 43 1HG GLN 43 -4.330 5.514 -2.183
325 HG3 GLN 43 2HG GLN 43 -3.386 5.465 -0.694
326 HE21 GLN 43 2HE2 GLN 43 -6.106 6.088 -0.791
327 HE22 GLN 43 1HE2 GLN 43 -6.311 7.732 -0.300
328 H GLN 44 H GLN 44 0.224 5.140 -2.559
329 HA GLN 44 HA GLN 44 -0.065 3.033 -0.609
330 HB2 GLN 44 1HB GLN 44 1.504 3.252 -3.177
331 HB3 GLN 44 2HB GLN 44 1.542 1.825 -2.149
332 HG2 GLN 44 1HG GLN 44 -1.020 2.944 -3.235
333 HG3 GLN 44 2HG GLN 44 -0.036 1.787 -4.131
334 HE21 GLN 44 2HE2 GLN 44 -2.637 1.236 -3.411
335 HE22 GLN 44 1HE2 GLN 44 -2.648 -0.024 -2.230
336 H LEU 45 H LEU 45 2.471 5.244 -1.683
337 HA LEU 45 HA LEU 45 4.365 4.149 0.227
338 HB2 LEU 45 1HB LEU 45 4.602 5.431 -2.213
339 HB3 LEU 45 2HB LEU 45 5.119 6.649 -1.049
340 HG LEU 45 HG LEU 45 6.288 3.895 -0.964
341 HD11 LEU 45 1HD1 LEU 45 6.363 5.074 -3.308
342 HD12 LEU 45 2HD1 LEU 45 7.792 4.282 -2.645
343 HD13 LEU 45 3HD1 LEU 45 7.628 6.034 -2.542
344 HD21 LEU 45 3HD2 LEU 45 6.632 5.642 0.837
345 HD22 LEU 45 1HD2 LEU 45 7.543 6.561 -0.362
346 HD23 LEU 45 2HD2 LEU 45 8.093 4.957 0.124
347 H GLY 46 H GLY 46 1.947 6.522 0.166
348 HA2 GLY 46 1HA GLY 46 1.235 7.977 1.802
349 HA3 GLY 46 2HA GLY 46 2.473 7.306 2.854
350 H ILE 47 H ILE 47 3.929 8.285 0.038
351 HA ILE 47 HA ILE 47 4.239 11.076 0.783
352 HB ILE 47 HB ILE 47 6.672 10.982 0.904
353 HG12 ILE 47 1HG1 ILE 47 6.304 7.983 0.721
354 HG13 ILE 47 2HG1 ILE 47 7.043 9.012 -0.502
355 HG21 ILE 47 1HG2 ILE 47 6.882 9.979 3.093
356 HG22 ILE 47 2HG2 ILE 47 5.322 10.790 2.960
357 HG23 ILE 47 3HG2 ILE 47 5.416 9.034 2.832
358 HD11 ILE 47 3HD1 ILE 47 8.095 8.433 2.255
359 HD12 ILE 47 1HD1 ILE 47 8.760 7.882 0.718
360 HD13 ILE 47 2HD1 ILE 47 8.806 9.595 1.135
361 H SER 48 H SER 48 5.583 12.271 -0.803
362 HA SER 48 HA SER 48 4.849 11.516 -3.463
363 HB2 SER 48 1HB SER 48 4.816 13.801 -3.324
364 HB3 SER 48 2HB SER 48 6.152 13.857 -2.174
365 HG SER 48 HG SER 48 6.250 14.298 -4.764
366 H VAL 49 H VAL 49 6.176 10.958 -5.185
367 HA VAL 49 HA VAL 49 8.259 9.194 -4.710
368 HB VAL 49 HB VAL 49 7.151 9.118 -6.820
369 HG11 VAL 49 1HG1 VAL 49 7.436 11.950 -6.728
370 HG12 VAL 49 2HG1 VAL 49 8.150 11.359 -8.230
371 HG13 VAL 49 3HG1 VAL 49 6.475 10.971 -7.836
372 HG21 VAL 49 3HG2 VAL 49 8.979 8.901 -8.304
373 HG22 VAL 49 1HG2 VAL 49 9.912 10.131 -7.452
374 HG23 VAL 49 2HG2 VAL 49 9.620 8.565 -6.696
375 H LEU 50 H LEU 50 8.329 12.665 -5.174
376 HA LEU 50 HA LEU 50 11.085 12.973 -5.639
377 HB2 LEU 50 1HB LEU 50 8.910 14.636 -5.506
378 HB3 LEU 50 2HB LEU 50 9.836 15.108 -4.082
379 HG LEU 50 HG LEU 50 11.770 15.593 -5.494
380 HD11 LEU 50 1HD1 LEU 50 11.396 15.660 -7.982
381 HD12 LEU 50 2HD1 LEU 50 9.953 14.683 -7.711
382 HD13 LEU 50 3HD1 LEU 50 11.540 14.051 -7.275
383 HD21 LEU 50 3HD2 LEU 50 10.762 17.591 -5.334
384 HD22 LEU 50 1HD2 LEU 50 9.177 16.936 -5.747
385 HD23 LEU 50 2HD2 LEU 50 10.331 17.324 -7.024
386 H SER 51 H SER 51 9.199 13.037 -2.632
387 HA SER 51 HA SER 51 11.470 13.498 -0.965
388 HB2 SER 51 1HB SER 51 8.799 12.353 -0.128
389 HB3 SER 51 2HB SER 51 9.966 13.203 0.885
390 HG SER 51 HG SER 51 8.044 14.396 -0.024
391 H TRP 52 H TRP 52 9.666 10.647 -1.984
392 HA TRP 52 HA TRP 52 10.799 8.768 -0.259
393 HB2 TRP 52 1HB TRP 52 8.872 8.211 -1.612
394 HB3 TRP 52 2HB TRP 52 9.796 8.444 -3.093
395 HD1 TRP 52 HD1 TRP 52 10.030 6.150 0.041
396 HE1 TRP 52 HE1 TRP 52 10.780 3.818 -0.749
397 HE3 TRP 52 HE3 TRP 52 10.584 7.122 -4.947
398 HZ2 TRP 52 HZ2 TRP 52 11.510 2.557 -3.167
399 HZ3 TRP 52 HZ3 TRP 52 11.312 5.299 -6.430
400 HH2 TRP 52 HH2 TRP 52 11.765 3.065 -5.557
401 H ARG 53 H ARG 53 11.927 10.000 -3.372
402 HA ARG 53 HA ARG 53 14.088 8.223 -3.696
403 HB2 ARG 53 1HB ARG 53 13.116 10.661 -4.955
404 HB3 ARG 53 2HB ARG 53 14.872 10.596 -4.910
405 HG2 ARG 53 1HG ARG 53 14.195 8.071 -5.743
406 HG3 ARG 53 2HG ARG 53 12.985 9.088 -6.528
407 HD2 ARG 53 1HD ARG 53 14.870 8.883 -7.994
408 HD3 ARG 53 2HD ARG 53 14.830 10.530 -7.365
409 HE ARG 53 HE ARG 53 16.493 9.292 -5.650
410 HH11 ARG 53 2HH1 ARG 53 16.368 9.424 -9.127
411 HH12 ARG 53 1HH1 ARG 53 18.081 9.258 -9.325
412 HH21 ARG 53 2HH2 ARG 53 18.750 9.072 -5.898
413 HH22 ARG 53 1HH2 ARG 53 19.435 9.056 -7.488
414 H GLU 54 H GLU 54 13.922 11.483 -2.289
415 HA GLU 54 HA GLU 54 16.654 11.710 -1.666
416 HB2 GLU 54 1HB GLU 54 14.964 13.576 -1.696
417 HB3 GLU 54 2HB GLU 54 14.368 12.978 -0.155
418 HG2 GLU 54 1HG GLU 54 16.354 13.530 0.957
419 HG3 GLU 54 2HG GLU 54 17.242 13.729 -0.553
420 H ASP 55 H ASP 55 13.902 10.593 0.277
421 HA ASP 55 HA ASP 55 15.300 10.135 2.661
422 HB2 ASP 55 1HB ASP 55 12.698 9.985 1.950
423 HB3 ASP 55 2HB ASP 55 13.094 8.270 2.007
424 H GLN 56 H GLN 56 14.725 8.048 -0.134
425 HA GLN 56 HA GLN 56 15.919 5.732 1.005
426 HB2 GLN 56 1HB GLN 56 15.006 6.554 -1.707
427 HB3 GLN 56 2HB GLN 56 16.122 5.200 -1.596
428 HG2 GLN 56 1HG GLN 56 13.426 5.422 -0.280
429 HG3 GLN 56 2HG GLN 56 13.857 4.394 -1.645
430 HE21 GLN 56 2HE2 GLN 56 15.944 3.046 -1.076
431 HE22 GLN 56 1HE2 GLN 56 15.833 2.179 0.414
432 H ARG 57 H ARG 57 17.117 8.423 -0.903
433 HA ARG 57 HA ARG 57 19.596 7.396 -1.662
434 HB2 ARG 57 1HB ARG 57 18.559 10.162 -1.164
435 HB3 ARG 57 2HB ARG 57 20.273 9.921 -1.478
436 HG2 ARG 57 1HG ARG 57 19.940 9.349 -3.654
437 HG3 ARG 57 2HG ARG 57 18.340 8.671 -3.346
438 HD2 ARG 57 1HD ARG 57 18.444 10.842 -4.671
439 HD3 ARG 57 2HD ARG 57 17.330 10.787 -3.306
440 HE ARG 57 HE ARG 57 19.915 11.837 -2.630
441 HH11 ARG 57 2HH1 ARG 57 16.770 12.600 -3.914
442 HH12 ARG 57 1HH1 ARG 57 16.855 14.275 -3.480
443 HH21 ARG 57 2HH2 ARG 57 20.039 14.041 -2.054
444 HH22 ARG 57 1HH2 ARG 57 18.716 15.094 -2.423
445 H ILE 58 H ILE 58 18.685 9.180 1.273
446 HA ILE 58 HA ILE 58 21.304 9.061 2.408
447 HB ILE 58 HB ILE 58 18.658 9.616 3.756
448 HG12 ILE 58 1HG1 ILE 58 19.179 11.202 1.945
449 HG13 ILE 58 2HG1 ILE 58 19.263 11.976 3.524
450 HG21 ILE 58 1HG2 ILE 58 20.742 10.920 5.088
451 HG22 ILE 58 2HG2 ILE 58 19.800 9.544 5.659
452 HG23 ILE 58 3HG2 ILE 58 21.315 9.278 4.797
453 HD11 ILE 58 3HD1 ILE 58 21.592 11.048 1.862
454 HD12 ILE 58 1HD1 ILE 58 21.083 12.715 2.130
455 HD13 ILE 58 2HD1 ILE 58 21.708 11.757 3.473
456 H SER 59 H SER 59 18.290 7.264 2.937
457 HA SER 59 HA SER 59 19.153 5.660 5.052
458 HB2 SER 59 1HB SER 59 17.127 5.126 2.872
459 HB3 SER 59 2HB SER 59 17.365 4.061 4.257
460 HG SER 59 HG SER 59 15.681 5.786 4.387
461 H GLN 60 H GLN 60 19.638 5.361 1.595
462 HA GLN 60 HA GLN 60 20.612 2.691 1.630
463 HB2 GLN 60 1HB GLN 60 19.755 3.693 -0.418
464 HB3 GLN 60 2HB GLN 60 21.024 4.910 -0.381
465 HG2 GLN 60 1HG GLN 60 21.627 3.272 -1.991
466 HG3 GLN 60 2HG GLN 60 22.694 3.080 -0.601
467 HE21 GLN 60 2HE2 GLN 60 22.702 1.197 0.503
468 HE22 GLN 60 1HE2 GLN 60 21.741 -0.177 0.086
469 H ALA 61 H ALA 61 22.194 5.864 1.664
470 HA ALA 61 HA ALA 61 24.843 4.823 1.664
471 HB1 ALA 61 1HB ALA 61 23.740 7.300 1.290
472 HB2 ALA 61 2HB ALA 61 24.520 7.465 2.864
473 HB3 ALA 61 3HB ALA 61 25.462 6.962 1.460
474 H LYS 62 H LYS 62 22.572 5.777 4.179
475 HA LYS 62 HA LYS 62 24.438 5.587 6.327
476 HB2 LYS 62 1HB LYS 62 21.829 6.515 6.013
477 HB3 LYS 62 2HB LYS 62 21.671 5.139 7.096
478 HG2 LYS 62 1HG LYS 62 23.107 6.106 8.696
479 HG3 LYS 62 2HG LYS 62 23.660 7.340 7.563
480 HD2 LYS 62 1HD LYS 62 22.140 8.634 8.605
481 HD3 LYS 62 2HD LYS 62 20.988 7.802 7.559
482 HE2 LYS 62 1HE LYS 62 20.092 7.677 9.738
483 HE3 LYS 62 2HE LYS 62 20.762 6.082 9.401
484 HZ1 LYS 62 3HZ LYS 62 21.251 7.209 11.652
485 HZ2 LYS 62 1HZ LYS 62 22.398 8.100 10.785
486 HZ3 LYS 62 2HZ LYS 62 22.507 6.413 10.845
487 H LEU 63 H LEU 63 21.983 3.412 4.987
488 HA LEU 63 HA LEU 63 22.178 1.361 6.867
489 HB2 LEU 63 1HB LEU 63 20.390 1.247 5.364
490 HB3 LEU 63 2HB LEU 63 21.444 1.415 3.961
491 HG LEU 63 HG LEU 63 22.223 -0.849 4.212
492 HD11 LEU 63 1HD1 LEU 63 22.362 -1.580 6.325
493 HD12 LEU 63 2HD1 LEU 63 20.700 -2.113 6.074
494 HD13 LEU 63 3HD1 LEU 63 21.020 -0.572 6.870
495 HD21 LEU 63 3HD2 LEU 63 19.220 -0.714 4.469
496 HD22 LEU 63 1HD2 LEU 63 20.146 -2.062 3.809
497 HD23 LEU 63 2HD2 LEU 63 20.141 -0.505 2.979
498 H LEU 64 H LEU 64 23.911 1.744 3.780
499 HA LEU 64 HA LEU 64 25.516 -0.572 4.121
500 HB2 LEU 64 1HB LEU 64 26.608 0.057 2.167
501 HB3 LEU 64 2HB LEU 64 24.975 0.690 1.969
502 HG LEU 64 HG LEU 64 26.114 2.880 2.952
503 HD11 LEU 64 1HD1 LEU 64 28.342 1.133 2.240
504 HD12 LEU 64 2HD1 LEU 64 28.313 2.593 3.227
505 HD13 LEU 64 3HD1 LEU 64 28.407 2.718 1.471
506 HD21 LEU 64 3HD2 LEU 64 26.224 3.710 0.744
507 HD22 LEU 64 1HD2 LEU 64 24.958 2.482 0.738
508 HD23 LEU 64 2HD2 LEU 64 26.550 2.110 0.077
509 H LEU 65 H LEU 65 25.939 2.828 4.921
510 HA LEU 65 HA LEU 65 28.668 2.791 5.539
511 HB2 LEU 65 1HB LEU 65 26.353 4.502 6.225
512 HB3 LEU 65 2HB LEU 65 27.772 4.636 7.262
513 HG LEU 65 HG LEU 65 28.004 4.910 4.284
514 HD11 LEU 65 1HD1 LEU 65 27.836 7.384 5.857
515 HD12 LEU 65 2HD1 LEU 65 26.315 6.513 5.661
516 HD13 LEU 65 3HD1 LEU 65 27.231 7.017 4.241
517 HD21 LEU 65 3HD2 LEU 65 29.645 5.623 6.683
518 HD22 LEU 65 1HD2 LEU 65 29.861 6.486 5.160
519 HD23 LEU 65 2HD2 LEU 65 30.114 4.741 5.228
520 H SER 66 H SER 66 25.892 1.675 7.317
521 HA SER 66 HA SER 66 27.159 1.519 9.864
522 HB2 SER 66 1HB SER 66 24.684 0.201 8.737
523 HB3 SER 66 2HB SER 66 25.215 -0.012 10.405
524 HG SER 66 HG SER 66 24.375 1.851 10.848
525 H THR 67 H THR 67 27.078 -0.509 7.061
526 HA THR 67 HA THR 67 28.429 -2.660 8.551
527 HB THR 67 HB THR 67 26.410 -3.442 7.451
528 HG1 THR 67 HG1 THR 67 28.660 -4.316 5.939
529 HG21 THR 67 3HG2 THR 67 27.604 -2.064 5.082
530 HG22 THR 67 1HG2 THR 67 25.945 -2.032 5.679
531 HG23 THR 67 2HG2 THR 67 26.553 -3.459 4.840
532 H THR 68 H THR 68 29.238 -0.048 6.883
533 HA THR 68 HA THR 68 31.620 -1.331 5.731
534 HB THR 68 HB THR 68 31.594 0.152 3.818
535 HG1 THR 68 HG1 THR 68 30.579 1.970 4.638
536 HG21 THR 68 3HG2 THR 68 28.865 -0.598 3.402
537 HG22 THR 68 1HG2 THR 68 29.687 -1.878 4.294
538 HG23 THR 68 2HG2 THR 68 30.327 -1.332 2.744
539 H ARG 69 H ARG 69 33.454 0.148 5.471
540 HA ARG 69 HA ARG 69 33.367 2.371 7.404
541 HB2 ARG 69 1HB ARG 69 35.842 1.829 7.754
542 HB3 ARG 69 2HB ARG 69 34.671 0.727 8.464
543 HG2 ARG 69 1HG ARG 69 35.391 -0.080 5.785
544 HG3 ARG 69 2HG ARG 69 36.806 0.064 6.829
545 HD2 ARG 69 1HD ARG 69 35.758 -1.395 8.474
546 HD3 ARG 69 2HD ARG 69 34.314 -1.509 7.469
547 HE ARG 69 HE ARG 69 36.806 -2.907 7.099
548 HH11 ARG 69 2HH1 ARG 69 33.873 -1.793 5.590
549 HH12 ARG 69 1HH1 ARG 69 33.926 -2.969 4.319
550 HH21 ARG 69 2HH2 ARG 69 36.887 -4.460 5.430
551 HH22 ARG 69 1HH2 ARG 69 35.640 -4.487 4.230
552 H MET 70 H MET 70 33.154 2.103 4.358
553 HA MET 70 HA MET 70 35.476 3.301 3.253
554 HB2 MET 70 1HB MET 70 32.666 3.404 2.152
555 HB3 MET 70 2HB MET 70 34.163 3.608 1.253
556 HG2 MET 70 1HG MET 70 34.756 1.296 1.659
557 HG3 MET 70 2HG MET 70 33.308 1.079 2.640
558 HE1 MET 70 3HE MET 70 30.911 0.730 1.704
559 HE2 MET 70 1HE MET 70 31.000 2.426 1.228
560 HE3 MET 70 2HE MET 70 30.429 1.218 0.078
561 HA PRO 71 HA PRO 71 34.989 7.546 4.264
562 HB2 PRO 71 1HB PRO 71 36.027 8.729 2.052
563 HB3 PRO 71 2HB PRO 71 37.022 7.894 3.251
564 HG2 PRO 71 1HG PRO 71 36.020 6.912 0.607
565 HG3 PRO 71 2HG PRO 71 37.624 6.720 1.336
566 HD2 PRO 71 1HD PRO 71 35.765 4.752 1.367
567 HD3 PRO 71 2HD PRO 71 36.945 4.972 2.676
568 H ILE 72 H ILE 72 33.832 9.472 3.754
569 HA ILE 72 HA ILE 72 31.281 9.144 2.758
570 HB ILE 72 HB ILE 72 32.870 11.713 2.820
571 HG12 ILE 72 1HG1 ILE 72 30.851 11.171 4.893
572 HG13 ILE 72 2HG1 ILE 72 32.250 10.104 4.943
573 HG21 ILE 72 1HG2 ILE 72 30.965 12.060 1.453
574 HG22 ILE 72 2HG2 ILE 72 29.922 11.172 2.563
575 HG23 ILE 72 3HG2 ILE 72 30.580 12.739 3.034
576 HD11 ILE 72 3HD1 ILE 72 33.019 11.758 6.275
577 HD12 ILE 72 1HD1 ILE 72 33.528 12.419 4.721
578 HD13 ILE 72 2HD1 ILE 72 32.049 13.001 5.485
579 H ALA 73 H ALA 73 34.211 10.082 1.060
580 HA ALA 73 HA ALA 73 33.078 10.973 -1.337
581 HB1 ALA 73 1HB ALA 73 35.320 11.452 -1.179
582 HB2 ALA 73 2HB ALA 73 35.734 9.844 -0.584
583 HB3 ALA 73 3HB ALA 73 35.344 10.080 -2.288
584 H THR 74 H THR 74 34.137 7.718 -0.381
585 HA THR 74 HA THR 74 33.465 6.469 -2.828
586 HB THR 74 HB THR 74 33.703 5.248 -0.071
587 HG1 THR 74 HG1 THR 74 35.798 4.589 -1.191
588 HG21 THR 74 3HG2 THR 74 33.784 3.934 -2.790
589 HG22 THR 74 1HG2 THR 74 32.458 3.816 -1.634
590 HG23 THR 74 2HG2 THR 74 34.034 3.131 -1.240
591 H VAL 75 H VAL 75 31.748 6.657 0.284
592 HA VAL 75 HA VAL 75 29.504 5.160 -0.426
593 HB VAL 75 HB VAL 75 29.538 7.524 1.454
594 HG11 VAL 75 1HG1 VAL 75 27.443 5.868 0.602
595 HG12 VAL 75 2HG1 VAL 75 27.860 5.325 2.228
596 HG13 VAL 75 3HG1 VAL 75 27.432 7.013 1.943
597 HG21 VAL 75 3HG2 VAL 75 31.068 6.329 2.576
598 HG22 VAL 75 1HG2 VAL 75 29.714 5.285 3.010
599 HG23 VAL 75 2HG2 VAL 75 30.748 4.867 1.644
600 H GLY 76 H GLY 76 30.194 8.602 -0.855
601 HA2 GLY 76 1HA GLY 76 27.683 9.482 -1.667
602 HA3 GLY 76 2HA GLY 76 29.206 10.185 -2.191
603 H ARG 77 H ARG 77 30.125 7.726 -3.472
604 HA ARG 77 HA ARG 77 29.067 8.175 -6.051
605 HB2 ARG 77 1HB ARG 77 31.281 6.877 -4.998
606 HB3 ARG 77 2HB ARG 77 30.343 5.577 -5.720
607 HG2 ARG 77 1HG ARG 77 30.226 7.268 -7.747
608 HG3 ARG 77 2HG ARG 77 31.708 7.874 -7.004
609 HD2 ARG 77 1HD ARG 77 32.866 5.937 -7.409
610 HD3 ARG 77 2HD ARG 77 31.412 4.940 -7.399
611 HE ARG 77 HE ARG 77 31.176 6.553 -9.608
612 HH11 ARG 77 2HH1 ARG 77 33.473 4.211 -8.443
613 HH12 ARG 77 1HH1 ARG 77 33.967 3.714 -10.027
614 HH21 ARG 77 2HH2 ARG 77 31.818 5.907 -11.700
615 HH22 ARG 77 1HH2 ARG 77 33.025 4.679 -11.879
616 H ASN 78 H ASN 78 28.329 5.849 -3.537
617 HA ASN 78 HA ASN 78 26.799 4.067 -5.108
618 HB2 ASN 78 1HB ASN 78 27.023 4.632 -2.173
619 HB3 ASN 78 2HB ASN 78 25.731 3.587 -2.758
620 HD21 ASN 78 2HD2 ASN 78 28.861 3.690 -1.684
621 HD22 ASN 78 1HD2 ASN 78 29.400 2.151 -2.256
622 H VAL 79 H VAL 79 26.062 7.088 -3.518
623 HA VAL 79 HA VAL 79 23.207 6.798 -4.038
624 HB VAL 79 HB VAL 79 23.048 9.056 -2.951
625 HG11 VAL 79 1HG1 VAL 79 24.376 6.847 -1.385
626 HG12 VAL 79 2HG1 VAL 79 23.510 8.213 -0.680
627 HG13 VAL 79 3HG1 VAL 79 22.648 7.039 -1.675
628 HG21 VAL 79 3HG2 VAL 79 25.329 9.808 -3.470
629 HG22 VAL 79 1HG2 VAL 79 24.979 9.909 -1.745
630 HG23 VAL 79 2HG2 VAL 79 25.973 8.592 -2.367
631 H GLY 80 H GLY 80 25.594 7.361 -6.014
632 HA2 GLY 80 1HA GLY 80 25.612 8.289 -8.131
633 HA3 GLY 80 2HA GLY 80 24.013 8.946 -7.812
634 H PHE 81 H PHE 81 25.970 9.822 -5.293
635 HA PHE 81 HA PHE 81 26.282 12.508 -6.396
636 HB2 PHE 81 1HB PHE 81 26.510 11.455 -3.571
637 HB3 PHE 81 2HB PHE 81 26.776 13.136 -4.022
638 HD1 PHE 81 HD1 PHE 81 24.547 13.238 -6.122
639 HD2 PHE 81 HD2 PHE 81 24.677 11.822 -2.110
640 HE1 PHE 81 HE1 PHE 81 22.138 13.682 -5.891
641 HE2 PHE 81 HE2 PHE 81 22.268 12.263 -1.873
642 HZ PHE 81 HZ PHE 81 20.995 13.193 -3.765
643 H ASP 82 H ASP 82 28.151 13.055 -7.279
644 HA ASP 82 HA ASP 82 30.556 11.540 -6.715
645 HB2 ASP 82 1HB ASP 82 31.482 12.532 -8.615
646 HB3 ASP 82 2HB ASP 82 29.773 12.421 -9.024
647 H ASP 83 H ASP 83 29.146 14.593 -5.876
648 HA ASP 83 HA ASP 83 31.638 15.678 -4.857
649 HB2 ASP 83 1HB ASP 83 30.057 17.207 -5.907
650 HB3 ASP 83 2HB ASP 83 28.809 16.744 -4.754
651 H GLN 84 H GLN 84 32.390 15.182 -2.917
652 HA GLN 84 HA GLN 84 30.986 13.643 -1.030
653 HB2 GLN 84 1HB GLN 84 33.364 13.547 -1.019
654 HB3 GLN 84 2HB GLN 84 33.503 15.289 -0.825
655 HG2 GLN 84 1HG GLN 84 32.959 15.220 1.414
656 HG3 GLN 84 2HG GLN 84 32.140 13.666 1.273
657 HE21 GLN 84 2HE2 GLN 84 34.153 14.432 3.174
658 HE22 GLN 84 1HE2 GLN 84 35.491 13.363 2.948
659 H LEU 85 H LEU 85 31.522 17.114 -1.309
660 HA LEU 85 HA LEU 85 30.458 17.811 1.223
661 HB2 LEU 85 1HB LEU 85 31.116 19.251 -1.290
662 HB3 LEU 85 2HB LEU 85 30.053 20.054 -0.136
663 HG LEU 85 HG LEU 85 32.385 20.750 0.122
664 HD11 LEU 85 1HD1 LEU 85 32.534 20.486 2.503
665 HD12 LEU 85 2HD1 LEU 85 31.469 19.081 2.457
666 HD13 LEU 85 3HD1 LEU 85 30.838 20.678 2.058
667 HD21 LEU 85 3HD2 LEU 85 34.143 19.339 0.466
668 HD22 LEU 85 1HD2 LEU 85 33.133 18.301 -0.541
669 HD23 LEU 85 2HD2 LEU 85 33.142 18.091 1.210
670 H TYR 86 H TYR 86 29.034 17.263 -1.928
671 HA TYR 86 HA TYR 86 26.522 18.432 -1.476
672 HB2 TYR 86 1HB TYR 86 27.402 17.686 -3.696
673 HB3 TYR 86 2HB TYR 86 27.112 16.021 -3.203
674 HD1 TYR 86 HD1 TYR 86 24.702 15.382 -2.581
675 HD2 TYR 86 HD2 TYR 86 25.703 18.929 -4.707
676 HE1 TYR 86 HE1 TYR 86 22.387 15.539 -3.397
677 HE2 TYR 86 HE2 TYR 86 23.391 19.097 -5.527
678 HH TYR 86 HH TYR 86 21.132 18.314 -4.840
679 H PHE 87 H PHE 87 27.629 15.083 -1.033
680 HA PHE 87 HA PHE 87 25.161 14.103 -0.059
681 HB2 PHE 87 1HB PHE 87 26.750 12.533 -0.918
682 HB3 PHE 87 2HB PHE 87 27.989 13.079 0.207
683 HD1 PHE 87 HD1 PHE 87 24.798 11.253 -0.074
684 HD2 PHE 87 HD2 PHE 87 28.133 12.202 2.395
685 HE1 PHE 87 HE1 PHE 87 24.109 9.511 1.521
686 HE2 PHE 87 HE2 PHE 87 27.450 10.461 3.993
687 HZ PHE 87 HZ PHE 87 25.435 9.112 3.557
688 H SER 88 H SER 88 28.075 15.299 1.561
689 HA SER 88 HA SER 88 27.222 14.771 4.197
690 HB2 SER 88 1HB SER 88 29.089 16.016 4.904
691 HB3 SER 88 2HB SER 88 29.584 15.368 3.340
692 HG SER 88 HG SER 88 29.423 17.916 4.101
693 H ARG 89 H ARG 89 26.793 17.535 2.060
694 HA ARG 89 HA ARG 89 25.766 19.341 3.955
695 HB2 ARG 89 1HB ARG 89 25.620 19.100 0.978
696 HB3 ARG 89 2HB ARG 89 24.577 20.260 1.790
697 HG2 ARG 89 1HG ARG 89 26.392 21.502 2.595
698 HG3 ARG 89 2HG ARG 89 27.537 20.201 2.260
699 HD2 ARG 89 1HD ARG 89 26.868 20.518 -0.198
700 HD3 ARG 89 2HD ARG 89 26.173 22.050 0.331
701 HE ARG 89 HE ARG 89 28.742 22.030 1.309
702 HH11 ARG 89 2HH1 ARG 89 27.240 21.806 -1.824
703 HH12 ARG 89 1HH1 ARG 89 28.566 22.546 -2.657
704 HH21 ARG 89 2HH2 ARG 89 30.494 23.006 0.223
705 HH22 ARG 89 1HH2 ARG 89 30.417 23.228 -1.492
706 H VAL 90 H VAL 90 24.089 17.148 1.706
707 HA VAL 90 HA VAL 90 21.488 17.779 2.670
708 HB VAL 90 HB VAL 90 22.422 15.351 1.132
709 HG11 VAL 90 1HG1 VAL 90 20.380 14.552 1.515
710 HG12 VAL 90 2HG1 VAL 90 19.863 16.056 2.280
711 HG13 VAL 90 3HG1 VAL 90 19.760 15.875 0.529
712 HG21 VAL 90 3HG2 VAL 90 21.146 17.902 0.147
713 HG22 VAL 90 1HG2 VAL 90 22.852 17.484 -0.015
714 HG23 VAL 90 2HG2 VAL 90 21.626 16.523 -0.841
715 H PHE 91 H PHE 91 23.710 15.071 3.255
716 HA PHE 91 HA PHE 91 22.030 13.598 4.950
717 HB2 PHE 91 1HB PHE 91 24.086 12.689 3.929
718 HB3 PHE 91 2HB PHE 91 25.053 13.730 4.969
719 HD1 PHE 91 HD1 PHE 91 25.240 13.281 7.352
720 HD2 PHE 91 HD2 PHE 91 23.024 10.713 4.781
721 HE1 PHE 91 HE1 PHE 91 25.248 11.540 9.091
722 HE2 PHE 91 HE2 PHE 91 23.027 8.968 6.516
723 HZ PHE 91 HZ PHE 91 24.140 9.380 8.674
724 H LYS 92 H LYS 92 24.238 16.257 5.579
725 HA LYS 92 HA LYS 92 24.351 16.126 8.362
726 HB2 LYS 92 1HB LYS 92 25.820 17.604 7.169
727 HB3 LYS 92 2HB LYS 92 24.463 18.496 6.494
728 HG2 LYS 92 1HG LYS 92 24.504 18.437 9.415
729 HG3 LYS 92 2HG LYS 92 25.902 19.231 8.687
730 HD2 LYS 92 1HD LYS 92 23.885 20.273 7.203
731 HD3 LYS 92 2HD LYS 92 23.078 20.054 8.758
732 HE2 LYS 92 1HE LYS 92 24.060 22.268 8.624
733 HE3 LYS 92 2HE LYS 92 24.883 21.309 9.853
734 HZ1 LYS 92 3HZ LYS 92 26.781 21.189 8.625
735 HZ2 LYS 92 1HZ LYS 92 26.218 22.697 8.101
736 HZ3 LYS 92 2HZ LYS 92 25.984 21.325 7.139
737 H LYS 93 H LYS 93 22.050 17.845 6.271
738 HA LYS 93 HA LYS 93 20.495 18.815 8.473
739 HB2 LYS 93 1HB LYS 93 19.664 18.624 5.576
740 HB3 LYS 93 2HB LYS 93 18.990 19.683 6.808
741 HG2 LYS 93 1HG LYS 93 21.160 20.848 6.948
742 HG3 LYS 93 2HG LYS 93 21.762 19.828 5.639
743 HD2 LYS 93 1HD LYS 93 19.400 21.700 5.467
744 HD3 LYS 93 2HD LYS 93 21.012 22.019 4.823
745 HE2 LYS 93 1HE LYS 93 20.028 21.217 2.934
746 HE3 LYS 93 2HE LYS 93 20.575 19.690 3.626
747 HZ1 LYS 93 3HZ LYS 93 18.047 20.217 2.871
748 HZ2 LYS 93 1HZ LYS 93 17.971 20.534 4.531
749 HZ3 LYS 93 2HZ LYS 93 18.488 19.020 3.983
750 H CYS 94 H CYS 94 20.539 15.941 6.551
751 HA CYS 94 HA CYS 94 17.921 15.047 6.784
752 HB2 CYS 94 1HB CYS 94 19.815 13.992 5.463
753 HB3 CYS 94 2HB CYS 94 20.345 13.258 6.972
754 HG CYS 94 HG CYS 94 17.154 12.627 6.577
755 H THR 95 H THR 95 20.653 14.490 8.992
756 HA THR 95 HA THR 95 18.722 13.621 11.040
757 HB THR 95 HB THR 95 20.696 12.590 12.185
758 HG1 THR 95 HG1 THR 95 22.642 12.662 11.263
759 HG21 THR 95 3HG2 THR 95 20.617 10.622 10.937
760 HG22 THR 95 1HG2 THR 95 20.490 11.483 9.404
761 HG23 THR 95 2HG2 THR 95 19.112 11.430 10.503
762 H GLY 96 H GLY 96 20.670 16.183 10.122
763 HA2 GLY 96 1HA GLY 96 20.698 18.243 11.291
764 HA3 GLY 96 2HA GLY 96 20.413 17.369 12.788
765 H ALA 97 H ALA 97 22.683 15.565 11.400
766 HA ALA 97 HA ALA 97 24.952 17.234 12.218
767 HB1 ALA 97 1HB ALA 97 25.018 14.391 13.057
768 HB2 ALA 97 2HB ALA 97 25.732 15.815 13.815
769 HB3 ALA 97 3HB ALA 97 24.007 15.496 13.988
770 H SER 98 H SER 98 26.927 16.711 11.247
771 HA SER 98 HA SER 98 26.761 15.667 8.631
772 HB2 SER 98 1HB SER 98 28.903 16.723 10.383
773 HB3 SER 98 2HB SER 98 29.427 15.650 9.085
774 HG SER 98 HG SER 98 29.259 17.981 8.594
775 HA PRO 99 HA PRO 99 27.536 11.369 9.040
776 HB2 PRO 99 1HB PRO 99 29.274 10.874 7.014
777 HB3 PRO 99 2HB PRO 99 27.567 11.244 6.746
778 HG2 PRO 99 1HG PRO 99 29.949 13.046 6.549
779 HG3 PRO 99 2HG PRO 99 28.550 12.918 5.466
780 HD2 PRO 99 1HD PRO 99 28.782 14.876 7.323
781 HD3 PRO 99 2HD PRO 99 27.214 14.201 6.838
782 H SER 100 H SER 100 30.399 13.417 8.826
783 HA SER 100 HA SER 100 32.265 11.478 9.707
784 HB2 SER 100 1HB SER 100 33.816 13.282 9.911
785 HB3 SER 100 2HB SER 100 32.792 13.662 8.527
786 HG SER 100 HG SER 100 32.609 14.723 11.150
787 H GLU 101 H GLU 101 30.168 13.742 11.371
788 HA GLU 101 HA GLU 101 31.372 13.386 13.941
789 HB2 GLU 101 1HB GLU 101 30.047 15.400 13.257
790 HB3 GLU 101 2HB GLU 101 28.599 14.404 13.309
791 HG2 GLU 101 1HG GLU 101 28.455 15.244 15.388
792 HG3 GLU 101 2HG GLU 101 29.544 13.908 15.757
793 H PHE 102 H PHE 102 28.421 12.155 12.392
794 HA PHE 102 HA PHE 102 27.578 10.583 14.582
795 HB2 PHE 102 1HB PHE 102 26.139 11.294 12.652
796 HB3 PHE 102 2HB PHE 102 26.970 10.100 11.661
797 HD1 PHE 102 HD1 PHE 102 24.958 10.448 14.764
798 HD2 PHE 102 HD2 PHE 102 26.204 7.913 11.580
799 HE1 PHE 102 HE1 PHE 102 23.368 8.727 15.516
800 HE2 PHE 102 HE2 PHE 102 24.616 6.189 12.326
801 HZ PHE 102 HZ PHE 102 23.194 6.595 14.296
802 H ARG 103 H ARG 103 29.393 9.767 11.639
803 HA ARG 103 HA ARG 103 29.689 7.021 12.225
804 HB2 ARG 103 1HB ARG 103 30.068 8.291 10.000
805 HB3 ARG 103 2HB ARG 103 31.685 8.593 10.621
806 HG2 ARG 103 1HG ARG 103 30.702 5.797 10.658
807 HG3 ARG 103 2HG ARG 103 31.120 6.505 9.096
808 HD2 ARG 103 1HD ARG 103 33.340 6.701 9.624
809 HD3 ARG 103 2HD ARG 103 33.026 6.840 11.354
810 HE ARG 103 HE ARG 103 32.387 4.252 10.302
811 HH11 ARG 103 2HH1 ARG 103 34.951 6.272 11.514
812 HH12 ARG 103 1HH1 ARG 103 35.939 4.940 12.016
813 HH21 ARG 103 2HH2 ARG 103 33.680 2.491 10.958
814 HH22 ARG 103 1HH2 ARG 103 35.216 2.790 11.698
815 H ALA 104 H ALA 104 31.458 9.863 13.201
816 HA ALA 104 HA ALA 104 33.850 8.673 14.042
817 HB1 ALA 104 1HB ALA 104 32.407 11.179 14.802
818 HB2 ALA 104 2HB ALA 104 33.858 10.686 15.676
819 HB3 ALA 104 3HB ALA 104 33.933 10.983 13.939
820 H GLY 105 H GLY 105 30.689 8.779 15.503
821 HA2 GLY 105 1HA GLY 105 29.885 7.425 17.212
822 HA3 GLY 105 2HA GLY 105 31.521 6.843 17.483
823 H CYS 106 H CYS 106 31.352 10.216 17.369
824 HA CYS 106 HA CYS 106 31.827 10.363 20.231
825 HB2 CYS 106 1HB CYS 106 33.214 11.579 18.464
826 HB3 CYS 106 2HB CYS 106 31.842 12.665 18.283
827 HG CYS 106 HG CYS 106 34.288 13.050 20.260
828 H GLU 107 H GLU 107 30.330 10.898 21.671
829 HA GLU 107 HA GLU 107 27.811 12.060 20.700
830 HB2 GLU 107 1HB GLU 107 28.481 10.379 23.106
831 HB3 GLU 107 2HB GLU 107 26.971 11.272 22.994
832 HG2 GLU 107 1HG GLU 107 26.712 10.051 20.723
833 HG3 GLU 107 2HG GLU 107 27.913 8.943 21.383
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