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 |
|
|
23002 |
2jso   |
15371 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA MET 1 HA MET 1 3.590 -1.532 -2.688
2 H1 MET 1 H1 MET 1 3.459 -1.570 -0.303
3 H2 MET 1 H2 MET 1 2.309 -0.406 -0.307
4 H3 MET 1 H3 MET 1 1.986 -1.872 -0.989
5 HB2 MET 1 HB2 MET 1 1.308 -0.632 -3.120
6 HB3 MET 1 HB3 MET 1 1.803 0.931 -2.453
7 HG2 MET 1 HG2 MET 1 1.889 0.961 -4.891
8 HG3 MET 1 HG3 MET 1 3.504 1.165 -4.223
9 HE1 MET 1 HE1 MET 1 3.065 0.616 -7.237
10 HE2 MET 1 HE2 MET 1 4.691 0.686 -6.518
11 HE3 MET 1 HE3 MET 1 4.245 -0.665 -7.584
12 H GLU 2 H GLU 2 5.589 -0.757 -3.164
13 HA GLU 2 HA GLU 2 6.606 1.645 -1.760
14 HB2 GLU 2 HB2 GLU 2 8.123 -0.992 -2.020
15 HB3 GLU 2 HB3 GLU 2 8.721 0.520 -1.354
16 HG2 GLU 2 HG2 GLU 2 8.257 -0.671 0.561
17 HG3 GLU 2 HG3 GLU 2 6.818 0.325 0.401
18 H TRP 3 H TRP 3 8.519 2.492 -2.958
19 HA TRP 3 HA TRP 3 8.230 1.986 -5.879
20 HD1 TRP 3 HD1 TRP 3 6.127 4.157 -2.915
21 HE1 TRP 3 HE1 TRP 3 3.612 3.979 -3.332
22 HE3 TRP 3 HE3 TRP 3 6.194 3.683 -8.008
23 HZ2 TRP 3 HZ2 TRP 3 1.835 3.679 -5.608
24 HZ3 TRP 3 HZ3 TRP 3 4.079 3.446 -9.277
25 HH2 TRP 3 HH2 TRP 3 1.896 3.447 -8.089
26 HB2 TRP 3 HB2 TRP 3 8.198 4.699 -4.510
27 HB3 TRP 3 HB3 TRP 3 8.009 4.386 -6.223
28 H LEU 4 H LEU 4 9.932 3.078 -7.125
29 HA LEU 4 HA LEU 4 12.572 3.157 -5.719
30 HG LEU 4 HG LEU 4 14.015 3.001 -8.579
31 HB2 LEU 4 HB2 LEU 4 12.230 1.085 -7.008
32 HB3 LEU 4 HB3 LEU 4 11.713 2.020 -8.412
33 HD11 LEU 4 HD11 LEU 4 14.803 2.752 -6.270
34 HD12 LEU 4 HD12 LEU 4 14.658 0.985 -6.380
35 HD13 LEU 4 HD13 LEU 4 15.859 1.849 -7.360
36 HD21 LEU 4 HD21 LEU 4 13.873 -0.045 -8.622
37 HD22 LEU 4 HD22 LEU 4 13.309 1.039 -9.912
38 HD23 LEU 4 HD23 LEU 4 15.032 0.969 -9.511
39 H VAL 5 H VAL 5 13.688 5.025 -6.080
40 HA VAL 5 HA VAL 5 12.640 7.079 -7.877
41 HB VAL 5 HB VAL 5 15.160 6.956 -6.151
42 HG11 VAL 5 HG11 VAL 5 15.400 8.652 -7.920
43 HG12 VAL 5 HG12 VAL 5 13.799 9.305 -7.538
44 HG13 VAL 5 HG13 VAL 5 15.129 9.440 -6.364
45 HG21 VAL 5 HG21 VAL 5 12.413 8.170 -5.620
46 HG22 VAL 5 HG22 VAL 5 13.170 6.828 -4.743
47 HG23 VAL 5 HG23 VAL 5 13.856 8.442 -4.613
48 H LYS 6 H LYS 6 12.876 6.462 -10.054
49 HA LYS 6 HA LYS 6 15.474 5.271 -10.877
50 HB2 LYS 6 HB2 LYS 6 12.829 5.695 -12.255
51 HB3 LYS 6 HB3 LYS 6 14.251 5.347 -13.214
52 HG2 LYS 6 HG2 LYS 6 13.736 3.527 -10.866
53 HG3 LYS 6 HG3 LYS 6 12.665 3.391 -12.248
54 HD2 LYS 6 HD2 LYS 6 14.503 1.786 -12.378
55 HD3 LYS 6 HD3 LYS 6 14.455 2.886 -13.758
56 HE2 LYS 6 HE2 LYS 6 16.306 4.220 -12.771
57 HE3 LYS 6 HE3 LYS 6 16.354 3.124 -11.379
58 HZ1 LYS 6 HZ1 LYS 6 16.978 1.336 -12.895
59 HZ2 LYS 6 HZ2 LYS 6 16.901 2.334 -14.187
60 HZ3 LYS 6 HZ3 LYS 6 18.030 2.569 -13.040
61 H LYS 7 H LYS 7 13.983 8.437 -10.899
62 HA LYS 7 HA LYS 7 16.509 9.513 -11.890
63 HB2 LYS 7 HB2 LYS 7 13.887 10.444 -13.155
64 HB3 LYS 7 HB3 LYS 7 15.486 11.154 -13.374
65 HG2 LYS 7 HG2 LYS 7 16.219 8.833 -14.261
66 HG3 LYS 7 HG3 LYS 7 14.484 8.472 -14.371
67 HD2 LYS 7 HD2 LYS 7 14.281 10.563 -15.836
68 HD3 LYS 7 HD3 LYS 7 16.052 10.676 -15.773
69 HE2 LYS 7 HE2 LYS 7 15.984 8.166 -16.564
70 HE3 LYS 7 HE3 LYS 7 14.309 8.515 -17.010
71 HZ1 LYS 7 HZ1 LYS 7 15.177 10.316 -18.435
72 HZ2 LYS 7 HZ2 LYS 7 16.715 9.903 -18.046
73 HZ3 LYS 7 HZ3 LYS 7 15.778 8.864 -18.873
74 H SER 8 H SER 8 16.753 11.742 -11.089
75 HA SER 8 HA SER 8 14.717 12.807 -9.274
76 HG SER 8 HG SER 8 18.271 12.025 -8.757
77 HB2 SER 8 HB2 SER 8 16.575 12.896 -7.458
78 HB3 SER 8 HB3 SER 8 15.709 11.377 -7.704
79 H CYS 9 H CYS 9 15.051 14.997 -8.870
80 HA CYS 9 HA CYS 9 17.171 16.343 -10.489
81 HG CYS 9 HG CYS 9 13.837 16.609 -12.692
82 HB2 CYS 9 HB2 CYS 9 14.229 17.062 -10.148
83 HB3 CYS 9 HB3 CYS 9 15.429 17.979 -11.078
84 H CYS 10 H CYS 10 18.537 16.850 -8.852
85 HA CYS 10 HA CYS 10 18.010 17.640 -6.229
86 HG CYS 10 HG CYS 10 21.791 16.583 -7.202
87 HB2 CYS 10 HB2 CYS 10 20.285 18.534 -8.052
88 HB3 CYS 10 HB3 CYS 10 20.294 18.541 -6.283
89 H ASN 11 H ASN 11 17.808 19.698 -5.184
90 HA ASN 11 HA ASN 11 17.934 22.127 -6.769
91 HB2 ASN 11 HB2 ASN 11 15.758 22.823 -6.733
92 HB3 ASN 11 HB3 ASN 11 15.455 21.106 -6.904
93 HD21 ASN 11 HD22 ASN 11 15.307 19.933 -4.557
94 HD22 ASN 11 HD21 ASN 11 14.253 20.771 -3.461
95 H LYS 12 H LYS 12 17.843 24.041 -5.449
96 HA LYS 12 HA LYS 12 17.548 23.662 -2.485
97 HB2 LYS 12 HB2 LYS 12 18.987 25.936 -3.921
98 HB3 LYS 12 HB3 LYS 12 18.766 25.775 -2.184
99 HG2 LYS 12 HG2 LYS 12 20.307 23.878 -2.101
100 HG3 LYS 12 HG3 LYS 12 20.467 23.897 -3.875
101 HD2 LYS 12 HD2 LYS 12 21.327 26.205 -3.802
102 HD3 LYS 12 HD3 LYS 12 21.190 26.245 -2.047
103 HE2 LYS 12 HE2 LYS 12 22.813 24.025 -3.283
104 HE3 LYS 12 HE3 LYS 12 23.462 25.660 -3.405
105 HZ1 LYS 12 HZ1 LYS 12 23.364 25.856 -1.011
106 HZ2 LYS 12 HZ2 LYS 12 22.743 24.349 -0.852
107 HZ3 LYS 12 HZ3 LYS 12 24.255 24.562 -1.424
108 H GLN 13 H GLN 13 16.628 25.289 -5.464
109 HA GLN 13 HA GLN 13 16.312 27.796 -4.375
110 HB2 GLN 13 HB2 GLN 13 15.334 26.580 -6.994
111 HB3 GLN 13 HB3 GLN 13 15.248 28.300 -6.632
112 HG2 GLN 13 HG2 GLN 13 17.701 28.391 -6.286
113 HG3 GLN 13 HG3 GLN 13 17.827 26.678 -6.694
114 HE21 GLN 13 HE22 GLN 13 17.454 26.002 -8.919
115 HE22 GLN 13 HE21 GLN 13 17.423 27.167 -10.214
116 H ASP 14 H ASP 14 13.833 25.307 -4.491
117 HA ASP 14 HA ASP 14 12.110 27.188 -2.997
118 HB2 ASP 14 HB2 ASP 14 11.408 27.212 -5.441
119 HB3 ASP 14 HB3 ASP 14 11.014 25.500 -5.280
120 H ASN 15 H ASN 15 13.886 24.829 -2.560
121 HA ASN 15 HA ASN 15 14.142 22.874 -1.611
122 HB2 ASN 15 HB2 ASN 15 12.796 24.229 0.157
123 HB3 ASN 15 HB3 ASN 15 11.495 23.104 -0.192
124 HD21 ASN 15 HD22 ASN 15 13.146 20.649 -0.471
125 HD22 ASN 15 HD21 ASN 15 13.718 20.311 1.162
126 H ARG 16 H ARG 16 11.188 23.162 -3.469
127 HA ARG 16 HA ARG 16 10.319 20.489 -3.379
128 HE ARG 16 HE ARG 16 8.030 24.656 -4.989
129 HB2 ARG 16 HB2 ARG 16 9.979 22.627 -5.525
130 HB3 ARG 16 HB3 ARG 16 9.193 21.041 -5.568
131 HG2 ARG 16 HG2 ARG 16 8.217 21.514 -3.302
132 HG3 ARG 16 HG3 ARG 16 8.817 23.167 -3.407
133 HD2 ARG 16 HD2 ARG 16 7.042 21.935 -5.543
134 HD3 ARG 16 HD3 ARG 16 6.376 22.734 -4.110
135 HH11 ARG 16 HH11 ARG 16 5.544 22.804 -6.814
136 HH12 ARG 16 HH12 ARG 16 5.038 24.214 -7.686
137 HH21 ARG 16 HH21 ARG 16 7.448 26.331 -6.111
138 HH22 ARG 16 HH22 ARG 16 6.199 26.310 -7.344
139 H HIS 17 H HIS 17 11.339 18.720 -3.967
140 HA HIS 17 HA HIS 17 13.282 18.669 -6.221
141 HD1 HIS 17 HD1 HIS 17 13.840 18.004 -2.140
142 HD2 HIS 17 HD2 HIS 17 15.957 17.158 -5.660
143 HE1 HIS 17 HE1 HIS 17 16.274 18.666 -1.694
144 HB2 HIS 17 HB2 HIS 17 12.505 16.649 -4.066
145 HB3 HIS 17 HB3 HIS 17 13.471 16.229 -5.477
146 H VAL 18 H VAL 18 12.894 16.844 -7.776
147 HA VAL 18 HA VAL 18 10.130 15.863 -7.948
148 HB VAL 18 HB VAL 18 11.625 17.193 -10.254
149 HG11 VAL 18 HG11 VAL 18 10.440 15.131 -11.041
150 HG12 VAL 18 HG12 VAL 18 8.930 15.757 -10.344
151 HG13 VAL 18 HG13 VAL 18 9.735 16.604 -11.684
152 HG21 VAL 18 HG21 VAL 18 8.940 17.842 -8.955
153 HG22 VAL 18 HG22 VAL 18 10.419 18.802 -8.788
154 HG23 VAL 18 HG23 VAL 18 9.634 18.661 -10.350
155 H LEU 19 H LEU 19 10.116 13.731 -8.645
156 HA LEU 19 HA LEU 19 12.586 12.513 -9.622
157 HG LEU 19 HG LEU 19 10.693 12.575 -6.355
158 HB2 LEU 19 HB2 LEU 19 11.824 10.626 -7.771
159 HB3 LEU 19 HB3 LEU 19 13.247 11.617 -7.694
160 HD11 LEU 19 HD11 LEU 19 11.075 10.263 -5.618
161 HD12 LEU 19 HD12 LEU 19 12.750 10.664 -5.177
162 HD13 LEU 19 HD13 LEU 19 11.386 11.412 -4.313
163 HD21 LEU 19 HD21 LEU 19 13.687 12.941 -5.778
164 HD22 LEU 19 HD22 LEU 19 12.572 14.189 -6.354
165 HD23 LEU 19 HD23 LEU 19 12.387 13.537 -4.735
166 H MET 20 H MET 20 12.219 10.459 -10.540
167 HA MET 20 HA MET 20 9.426 9.964 -11.412
168 HB2 MET 20 HB2 MET 20 12.131 9.006 -12.349
169 HB3 MET 20 HB3 MET 20 10.692 8.024 -12.656
170 HG2 MET 20 HG2 MET 20 9.617 9.729 -13.899
171 HG3 MET 20 HG3 MET 20 10.753 10.964 -13.364
172 HE1 MET 20 HE1 MET 20 11.928 7.347 -14.625
173 HE2 MET 20 HE2 MET 20 10.409 7.644 -15.512
174 HE3 MET 20 HE3 MET 20 11.963 7.632 -16.376
175 H LEU 21 H LEU 21 8.309 8.987 -9.878
176 HA LEU 21 HA LEU 21 9.398 6.907 -8.078
177 HG LEU 21 HG LEU 21 8.085 7.149 -6.018
178 HB2 LEU 21 HB2 LEU 21 6.720 8.274 -8.504
179 HB3 LEU 21 HB3 LEU 21 6.705 6.610 -7.939
180 HD11 LEU 21 HD11 LEU 21 9.435 8.993 -6.756
181 HD12 LEU 21 HD12 LEU 21 8.016 9.975 -7.144
182 HD13 LEU 21 HD13 LEU 21 8.422 9.624 -5.448
183 HD21 LEU 21 HD21 LEU 21 5.655 8.968 -6.285
184 HD22 LEU 21 HD22 LEU 21 5.635 7.248 -5.839
185 HD23 LEU 21 HD23 LEU 21 6.399 8.425 -4.763
186 H CYS 22 H CYS 22 9.466 4.793 -8.704
187 HA CYS 22 HA CYS 22 7.735 3.906 -10.960
188 HG CYS 22 HG CYS 22 11.246 4.449 -12.817
189 HB2 CYS 22 HB2 CYS 22 10.687 3.276 -10.503
190 HB3 CYS 22 HB3 CYS 22 9.668 2.632 -11.805
191 H ASP 23 H ASP 23 7.576 1.539 -11.012
192 HA ASP 23 HA ASP 23 6.932 0.161 -8.606
193 HB2 ASP 23 HB2 ASP 23 6.153 -0.822 -10.583
194 HB3 ASP 23 HB3 ASP 23 7.670 -0.555 -11.435
195 H ALA 24 H ALA 24 8.161 -1.280 -7.320
196 HA ALA 24 HA ALA 24 10.950 -0.708 -6.924
197 HB1 ALA 24 HB1 ALA 24 9.453 -1.238 -5.062
198 HB2 ALA 24 HB2 ALA 24 9.151 -2.858 -5.735
199 HB3 ALA 24 HB3 ALA 24 10.774 -2.416 -5.160
200 H GLY 25 H GLY 25 11.409 -1.160 -9.254
201 HA2 GLY 25 HA2 GLY 25 13.002 -3.284 -9.931
202 HA3 GLY 25 HA3 GLY 25 11.358 -3.870 -10.265
203 H GLY 26 H GLY 26 10.593 -0.896 -10.825
204 HA2 GLY 26 HA2 GLY 26 10.967 0.774 -12.378
205 HA3 GLY 26 HA3 GLY 26 12.121 -0.237 -13.251
206 H ALA 27 H ALA 27 9.259 -2.051 -12.615
207 HA ALA 27 HA ALA 27 8.835 -2.327 -15.414
208 HB1 ALA 27 HB1 ALA 27 8.445 -4.109 -13.732
209 HB2 ALA 27 HB2 ALA 27 7.049 -3.200 -13.102
210 HB3 ALA 27 HB3 ALA 27 7.023 -3.841 -14.756
211 H ILE 28 H ILE 28 7.490 0.011 -13.241
212 HA ILE 28 HA ILE 28 5.617 1.035 -15.269
213 HB ILE 28 HB ILE 28 4.880 0.531 -12.338
214 HG12 ILE 28 HG12 ILE 28 3.779 -0.761 -14.875
215 HG13 ILE 28 HG13 ILE 28 4.745 -1.553 -13.628
216 HG21 ILE 28 HG21 ILE 28 3.934 2.663 -13.189
217 HG22 ILE 28 HG22 ILE 28 3.207 1.792 -14.561
218 HG23 ILE 28 HG23 ILE 28 2.677 1.492 -12.892
219 HD11 ILE 28 HD11 ILE 28 2.909 -1.120 -11.972
220 HD12 ILE 28 HD12 ILE 28 1.894 -0.574 -13.335
221 HD13 ILE 28 HD13 ILE 28 2.502 -2.232 -13.295
222 H LYS 29 H LYS 29 5.559 3.391 -15.065
223 HA LYS 29 HA LYS 29 7.433 4.542 -13.068
224 HB2 LYS 29 HB2 LYS 29 7.588 5.110 -16.058
225 HB3 LYS 29 HB3 LYS 29 8.566 5.822 -14.772
226 HG2 LYS 29 HG2 LYS 29 9.299 3.361 -14.247
227 HG3 LYS 29 HG3 LYS 29 8.624 2.968 -15.827
228 HD2 LYS 29 HD2 LYS 29 10.179 4.516 -16.926
229 HD3 LYS 29 HD3 LYS 29 10.725 5.124 -15.362
230 HE2 LYS 29 HE2 LYS 29 12.403 3.646 -16.246
231 HE3 LYS 29 HE3 LYS 29 11.708 2.951 -14.782
232 HZ1 LYS 29 HZ1 LYS 29 10.506 1.382 -16.083
233 HZ2 LYS 29 HZ2 LYS 29 10.877 2.136 -17.508
234 HZ3 LYS 29 HZ3 LYS 29 12.028 1.371 -16.647
235 H MET 30 H MET 30 7.046 6.620 -12.506
236 HA MET 30 HA MET 30 4.734 8.149 -13.520
237 HB2 MET 30 HB2 MET 30 5.184 7.159 -10.660
238 HB3 MET 30 HB3 MET 30 4.090 8.463 -11.085
239 HG2 MET 30 HG2 MET 30 2.722 6.975 -12.434
240 HG3 MET 30 HG3 MET 30 3.839 5.640 -12.161
241 HE1 MET 30 HE1 MET 30 2.838 8.149 -9.165
242 HE2 MET 30 HE2 MET 30 1.488 8.234 -10.324
243 HE3 MET 30 HE3 MET 30 1.261 7.463 -8.737
244 H ILE 31 H ILE 31 4.811 10.269 -11.983
245 HA ILE 31 HA ILE 31 7.614 11.127 -11.464
246 HB ILE 31 HB ILE 31 5.440 12.818 -12.759
247 HG12 ILE 31 HG12 ILE 31 7.926 12.147 -14.330
248 HG13 ILE 31 HG13 ILE 31 6.636 10.960 -14.307
249 HG21 ILE 31 HG21 ILE 31 6.980 14.178 -11.471
250 HG22 ILE 31 HG22 ILE 31 8.388 13.350 -12.166
251 HG23 ILE 31 HG23 ILE 31 7.384 14.415 -13.165
252 HD11 ILE 31 HD11 ILE 31 5.000 12.560 -15.128
253 HD12 ILE 31 HD12 ILE 31 6.203 13.856 -15.108
254 HD13 ILE 31 HD13 ILE 31 6.394 12.487 -16.220
255 H ALA 32 H ALA 32 7.694 12.413 -9.539
256 HA ALA 32 HA ALA 32 5.143 13.401 -8.466
257 HB1 ALA 32 HB1 ALA 32 5.631 11.276 -7.217
258 HB2 ALA 32 HB2 ALA 32 7.179 12.001 -6.697
259 HB3 ALA 32 HB3 ALA 32 5.646 12.731 -6.199
260 H GLU 33 H GLU 33 5.335 15.294 -7.432
261 HA GLU 33 HA GLU 33 7.967 16.689 -7.355
262 HB2 GLU 33 HB2 GLU 33 6.166 17.803 -8.685
263 HB3 GLU 33 HB3 GLU 33 5.101 17.762 -7.273
264 HG2 GLU 33 HG2 GLU 33 6.684 19.208 -6.034
265 HG3 GLU 33 HG3 GLU 33 7.771 19.234 -7.420
266 H VAL 34 H VAL 34 8.732 17.081 -5.284
267 HA VAL 34 HA VAL 34 7.011 16.390 -2.987
268 HB VAL 34 HB VAL 34 8.532 14.767 -2.139
269 HG11 VAL 34 HG11 VAL 34 6.959 13.907 -3.939
270 HG12 VAL 34 HG12 VAL 34 8.306 14.002 -5.079
271 HG13 VAL 34 HG13 VAL 34 8.405 12.927 -3.673
272 HG21 VAL 34 HG21 VAL 34 10.373 15.290 -4.509
273 HG22 VAL 34 HG22 VAL 34 10.701 15.679 -2.802
274 HG23 VAL 34 HG23 VAL 34 10.568 13.997 -3.302
275 H LYS 35 H LYS 35 8.118 17.016 -0.915
276 HA LYS 35 HA LYS 35 10.367 18.945 -1.298
277 HB2 LYS 35 HB2 LYS 35 8.171 19.973 -0.474
278 HB3 LYS 35 HB3 LYS 35 8.367 19.027 1.004
279 HG2 LYS 35 HG2 LYS 35 10.481 20.166 1.490
280 HG3 LYS 35 HG3 LYS 35 10.452 20.978 -0.081
281 HD2 LYS 35 HD2 LYS 35 8.377 21.395 2.112
282 HD3 LYS 35 HD3 LYS 35 9.803 22.413 1.876
283 HE2 LYS 35 HE2 LYS 35 9.029 22.982 -0.426
284 HE3 LYS 35 HE3 LYS 35 7.581 21.997 -0.179
285 HZ1 LYS 35 HZ1 LYS 35 6.947 23.493 1.624
286 HZ2 LYS 35 HZ2 LYS 35 8.286 24.404 1.403
287 HZ3 LYS 35 HZ3 LYS 35 7.146 24.333 0.244
288 H SER 36 H SER 36 11.985 18.753 0.500
289 HA SER 36 HA SER 36 12.059 16.028 1.679
290 HG SER 36 HG SER 36 13.504 15.678 -1.643
291 HB2 SER 36 HB2 SER 36 14.370 17.110 0.054
292 HB3 SER 36 HB3 SER 36 14.002 15.441 0.506
293 H ASP 37 H ASP 37 13.229 15.967 3.583
294 HA ASP 37 HA ASP 37 14.568 18.493 4.456
295 HB2 ASP 37 HB2 ASP 37 12.693 17.607 5.834
296 HB3 ASP 37 HB3 ASP 37 13.616 16.131 6.107
297 H PHE 38 H PHE 38 15.386 15.780 2.871
298 HA PHE 38 HA PHE 38 18.155 15.659 3.828
299 HD1 PHE 38 HD2 PHE 38 14.648 13.889 5.062
300 HD2 PHE 38 HD1 PHE 38 18.790 13.542 6.222
301 HE1 PHE 38 HE2 PHE 38 13.976 13.838 7.454
302 HE2 PHE 38 HE1 PHE 38 18.113 13.507 8.610
303 HZ PHE 38 HZ PHE 38 15.707 13.646 9.228
304 HB2 PHE 38 HB2 PHE 38 16.426 13.177 3.445
305 HB3 PHE 38 HB3 PHE 38 18.116 13.209 3.899
306 H ALA 39 H ALA 39 19.453 14.480 2.108
307 HA ALA 39 HA ALA 39 18.642 15.154 -0.582
308 HB1 ALA 39 HB1 ALA 39 21.021 15.039 0.100
309 HB2 ALA 39 HB2 ALA 39 20.848 13.296 0.427
310 HB3 ALA 39 HB3 ALA 39 20.679 13.914 -1.228
311 H VAL 40 H VAL 40 18.124 13.677 -2.281
312 HA VAL 40 HA VAL 40 17.517 10.883 -1.697
313 HB VAL 40 HB VAL 40 15.407 11.885 -1.133
314 HG11 VAL 40 HG11 VAL 40 15.559 14.100 -2.171
315 HG12 VAL 40 HG12 VAL 40 15.410 13.374 -3.787
316 HG13 VAL 40 HG13 VAL 40 14.064 13.288 -2.637
317 HG21 VAL 40 HG21 VAL 40 15.140 10.804 -3.961
318 HG22 VAL 40 HG22 VAL 40 15.316 9.819 -2.494
319 HG23 VAL 40 HG23 VAL 40 13.890 10.844 -2.701
320 H LYS 41 H LYS 41 17.925 9.652 -3.583
321 HA LYS 41 HA LYS 41 18.310 11.045 -6.112
322 HB2 LYS 41 HB2 LYS 41 20.629 10.460 -6.461
323 HB3 LYS 41 HB3 LYS 41 20.414 11.593 -5.170
324 HG2 LYS 41 HG2 LYS 41 22.070 9.417 -5.153
325 HG3 LYS 41 HG3 LYS 41 21.602 10.377 -3.761
326 HD2 LYS 41 HD2 LYS 41 19.856 8.763 -3.191
327 HD3 LYS 41 HD3 LYS 41 20.275 7.778 -4.612
328 HE2 LYS 41 HE2 LYS 41 22.598 7.550 -3.653
329 HE3 LYS 41 HE3 LYS 41 22.033 8.419 -2.216
330 HZ1 LYS 41 HZ1 LYS 41 20.277 6.627 -2.063
331 HZ2 LYS 41 HZ2 LYS 41 21.115 5.789 -3.186
332 HZ3 LYS 41 HZ3 LYS 41 21.824 6.129 -1.752
333 H VAL 42 H VAL 42 19.262 9.458 -7.794
334 HA VAL 42 HA VAL 42 17.442 7.466 -8.261
335 HB VAL 42 HB VAL 42 20.319 7.585 -9.274
336 HG11 VAL 42 HG11 VAL 42 19.329 5.437 -9.855
337 HG12 VAL 42 HG12 VAL 42 17.833 6.223 -10.397
338 HG13 VAL 42 HG13 VAL 42 19.349 6.450 -11.297
339 HG21 VAL 42 HG21 VAL 42 17.767 8.946 -10.202
340 HG22 VAL 42 HG22 VAL 42 19.299 9.712 -9.746
341 HG23 VAL 42 HG23 VAL 42 19.206 8.783 -11.238
342 H GLY 43 H GLY 43 17.163 5.367 -7.759
343 HA2 GLY 43 HA2 GLY 43 17.824 3.188 -7.237
344 HA3 GLY 43 HA3 GLY 43 19.337 3.776 -6.540
345 H ASP 44 H ASP 44 17.217 5.891 -5.180
346 HA ASP 44 HA ASP 44 17.148 4.496 -2.650
347 HB2 ASP 44 HB2 ASP 44 15.886 7.079 -3.659
348 HB3 ASP 44 HB3 ASP 44 15.566 6.449 -2.050
349 H LEU 45 H LEU 45 15.512 3.310 -1.717
350 HA LEU 45 HA LEU 45 13.026 2.757 -3.158
351 HG LEU 45 HG LEU 45 11.305 1.751 -1.095
352 HB2 LEU 45 HB2 LEU 45 14.283 1.200 -1.467
353 HB3 LEU 45 HB3 LEU 45 13.668 2.290 -0.226
354 HD11 LEU 45 HD11 LEU 45 11.994 0.755 -3.296
355 HD12 LEU 45 HD12 LEU 45 12.794 -0.562 -2.427
356 HD13 LEU 45 HD13 LEU 45 11.032 -0.357 -2.319
357 HD21 LEU 45 HD21 LEU 45 12.999 -0.487 0.091
358 HD22 LEU 45 HD22 LEU 45 12.225 0.837 0.989
359 HD23 LEU 45 HD23 LEU 45 11.224 -0.360 0.161
360 H LEU 46 H LEU 46 10.968 3.553 -2.380
361 HA LEU 46 HA LEU 46 10.958 5.567 -0.197
362 HG LEU 46 HG LEU 46 11.474 6.658 -3.209
363 HB2 LEU 46 HB2 LEU 46 9.249 5.677 -2.714
364 HB3 LEU 46 HB3 LEU 46 9.090 6.730 -1.320
365 HD11 LEU 46 HD11 LEU 46 9.446 7.499 -4.262
366 HD12 LEU 46 HD12 LEU 46 9.161 8.625 -2.916
367 HD13 LEU 46 HD13 LEU 46 10.571 8.830 -3.974
368 HD21 LEU 46 HD21 LEU 46 10.827 8.602 -0.950
369 HD22 LEU 46 HD22 LEU 46 12.180 7.454 -0.999
370 HD23 LEU 46 HD23 LEU 46 12.135 8.799 -2.140
371 H SER 47 H SER 47 9.313 5.090 1.261
372 HA SER 47 HA SER 47 7.289 3.041 0.560
373 HG SER 47 HG SER 47 9.826 1.088 2.218
374 HB2 SER 47 HB2 SER 47 8.954 3.022 3.111
375 HB3 SER 47 HB3 SER 47 7.714 1.850 2.633
376 HA PRO 48 HA PRO 48 4.976 6.328 2.363
377 HB2 PRO 48 HB2 PRO 48 2.582 5.127 3.023
378 HB3 PRO 48 HB3 PRO 48 3.095 5.487 1.350
379 HG2 PRO 48 HG2 PRO 48 3.327 2.864 2.848
380 HG3 PRO 48 HG3 PRO 48 2.733 3.140 1.179
381 HD2 PRO 48 HD2 PRO 48 5.283 2.320 1.684
382 HD3 PRO 48 HD3 PRO 48 4.924 3.468 0.359
383 H LEU 49 H LEU 49 4.438 7.270 4.288
384 HA LEU 49 HA LEU 49 4.631 5.680 6.826
385 HG LEU 49 HG LEU 49 7.222 6.646 5.718
386 HB2 LEU 49 HB2 LEU 49 5.555 8.513 6.192
387 HB3 LEU 49 HB3 LEU 49 5.405 7.891 7.827
388 HD11 LEU 49 HD11 LEU 49 7.926 8.943 6.222
389 HD12 LEU 49 HD12 LEU 49 7.903 8.590 7.964
390 HD13 LEU 49 HD13 LEU 49 9.065 7.770 6.897
391 HD21 LEU 49 HD21 LEU 49 6.984 6.257 8.744
392 HD22 LEU 49 HD22 LEU 49 6.652 5.048 7.481
393 HD23 LEU 49 HD23 LEU 49 8.300 5.610 7.748
394 H GLN 50 H GLN 50 3.090 8.283 4.982
395 HA GLN 50 HA GLN 50 0.546 7.619 6.053
396 HB2 GLN 50 HB2 GLN 50 -0.100 9.953 6.738
397 HB3 GLN 50 HB3 GLN 50 0.965 9.117 7.849
398 HG2 GLN 50 HG2 GLN 50 2.880 10.409 7.139
399 HG3 GLN 50 HG3 GLN 50 1.956 11.156 5.827
400 HE21 GLN 50 HE22 GLN 50 1.925 13.351 6.458
401 HE22 GLN 50 HE21 GLN 50 1.329 13.896 7.999
402 H ASN 51 H ASN 51 -0.881 9.757 4.884
403 HA ASN 51 HA ASN 51 -0.975 8.982 2.239
404 HB2 ASN 51 HB2 ASN 51 -2.786 10.209 3.306
405 HB3 ASN 51 HB3 ASN 51 -1.781 11.654 3.459
406 HD21 ASN 51 HD22 ASN 51 -1.904 13.160 1.771
407 HD22 ASN 51 HD21 ASN 51 -2.560 12.810 0.196
408 H ALA 52 H ALA 52 0.954 11.714 3.532
409 HA ALA 52 HA ALA 52 2.035 12.167 0.784
410 HB1 ALA 52 HB1 ALA 52 0.776 14.047 1.748
411 HB2 ALA 52 HB2 ALA 52 1.883 14.080 3.143
412 HB3 ALA 52 HB3 ALA 52 2.487 14.444 1.514
413 H LEU 53 H LEU 53 3.100 11.364 4.114
414 HA LEU 53 HA LEU 53 5.875 12.085 3.414
415 HG LEU 53 HG LEU 53 4.485 13.408 5.660
416 HB2 LEU 53 HB2 LEU 53 4.659 10.878 5.916
417 HB3 LEU 53 HB3 LEU 53 6.387 11.033 5.682
418 HD11 LEU 53 HD11 LEU 53 4.557 12.325 7.881
419 HD12 LEU 53 HD12 LEU 53 6.332 12.382 7.864
420 HD13 LEU 53 HD13 LEU 53 5.385 13.886 7.909
421 HD21 LEU 53 HD21 LEU 53 7.537 13.242 5.764
422 HD22 LEU 53 HD22 LEU 53 6.567 13.860 4.416
423 HD23 LEU 53 HD23 LEU 53 6.581 14.729 5.948
424 H TYR 54 H TYR 54 7.451 10.684 2.887
425 HA TYR 54 HA TYR 54 6.946 7.767 2.993
426 HD1 TYR 54 HD1 TYR 54 5.234 9.953 0.731
427 HD2 TYR 54 HD2 TYR 54 6.897 6.101 -0.241
428 HE1 TYR 54 HE1 TYR 54 3.086 9.295 -0.296
429 HE2 TYR 54 HE2 TYR 54 4.763 5.433 -1.282
430 HH TYR 54 HH TYR 54 2.568 6.066 -1.788
431 HB2 TYR 54 HB2 TYR 54 7.867 9.390 0.584
432 HB3 TYR 54 HB3 TYR 54 8.265 7.699 0.773
433 H CYS 55 H CYS 55 8.830 6.599 3.396
434 HA CYS 55 HA CYS 55 11.119 7.787 4.635
435 HG CYS 55 HG CYS 55 10.296 3.842 5.442
436 HB2 CYS 55 HB2 CYS 55 10.942 5.079 3.233
437 HB3 CYS 55 HB3 CYS 55 12.041 5.542 4.534
438 H ILE 56 H ILE 56 13.394 7.507 3.744
439 HA ILE 56 HA ILE 56 13.558 7.540 0.760
440 HB ILE 56 HB ILE 56 15.286 9.080 2.733
441 HG12 ILE 56 HG12 ILE 56 13.531 10.206 0.521
442 HG13 ILE 56 HG13 ILE 56 13.009 10.109 2.202
443 HG21 ILE 56 HG21 ILE 56 16.690 8.281 0.897
444 HG22 ILE 56 HG22 ILE 56 15.505 8.848 -0.302
445 HG23 ILE 56 HG23 ILE 56 16.442 9.981 0.682
446 HD11 ILE 56 HD11 ILE 56 14.922 11.523 2.906
447 HD12 ILE 56 HD12 ILE 56 15.385 11.746 1.208
448 HD13 ILE 56 HD13 ILE 56 13.850 12.353 1.777
449 H ASN 57 H ASN 57 15.067 6.250 -0.067
450 HA ASN 57 HA ASN 57 16.741 4.875 -0.439
451 HB2 ASN 57 HB2 ASN 57 18.187 6.356 0.858
452 HB3 ASN 57 HB3 ASN 57 17.788 5.479 2.343
453 HD21 ASN 57 HD22 ASN 57 19.051 4.980 -0.984
454 HD22 ASN 57 HD21 ASN 57 20.092 3.613 -0.573
455 H ARG 58 H ARG 58 15.800 4.259 2.917
456 HA ARG 58 HA ARG 58 14.094 2.184 2.540
457 HE ARG 58 HE ARG 58 19.530 -0.704 4.296
458 HB2 ARG 58 HB2 ARG 58 15.287 0.130 3.248
459 HB3 ARG 58 HB3 ARG 58 15.785 0.683 1.678
460 HG2 ARG 58 HG2 ARG 58 17.860 1.639 2.628
461 HG3 ARG 58 HG3 ARG 58 17.352 1.163 4.259
462 HD2 ARG 58 HD2 ARG 58 17.364 -1.199 3.607
463 HD3 ARG 58 HD3 ARG 58 17.747 -0.782 1.939
464 HH11 ARG 58 HH11 ARG 58 19.208 -0.009 0.825
465 HH12 ARG 58 HH12 ARG 58 20.904 -0.041 0.518
466 HH21 ARG 58 HH21 ARG 58 21.786 -0.725 3.889
467 HH22 ARG 58 HH22 ARG 58 22.399 -0.438 2.306
468 H GLU 59 H GLU 59 15.112 4.561 4.405
469 HA GLU 59 HA GLU 59 14.638 3.128 6.962
470 HB2 GLU 59 HB2 GLU 59 16.419 4.287 8.044
471 HB3 GLU 59 HB3 GLU 59 17.048 3.366 6.682
472 HG2 GLU 59 HG2 GLU 59 17.106 5.511 5.338
473 HG3 GLU 59 HG3 GLU 59 16.636 6.386 6.801
474 H LYS 60 H LYS 60 13.433 4.189 8.431
475 HA LYS 60 HA LYS 60 11.601 6.040 7.263
476 HB2 LYS 60 HB2 LYS 60 11.743 5.325 10.215
477 HB3 LYS 60 HB3 LYS 60 10.332 5.816 9.273
478 HG2 LYS 60 HG2 LYS 60 10.575 3.649 7.949
479 HG3 LYS 60 HG3 LYS 60 11.846 3.178 9.092
480 HD2 LYS 60 HD2 LYS 60 10.131 3.535 10.962
481 HD3 LYS 60 HD3 LYS 60 8.904 3.661 9.680
482 HE2 LYS 60 HE2 LYS 60 9.656 1.405 8.828
483 HE3 LYS 60 HE3 LYS 60 10.789 1.307 10.181
484 HZ1 LYS 60 HZ1 LYS 60 8.868 1.406 11.687
485 HZ2 LYS 60 HZ2 LYS 60 7.840 1.421 10.414
486 HZ3 LYS 60 HZ3 LYS 60 8.779 0.121 10.692
487 H LEU 61 H LEU 61 14.491 6.590 9.080
488 HA LEU 61 HA LEU 61 13.729 8.991 10.435
489 HG LEU 61 HG LEU 61 15.833 6.377 10.817
490 HB2 LEU 61 HB2 LEU 61 16.517 8.257 9.448
491 HB3 LEU 61 HB3 LEU 61 16.102 9.405 10.714
492 HD11 LEU 61 HD11 LEU 61 18.110 7.310 11.103
493 HD12 LEU 61 HD12 LEU 61 17.528 8.323 12.441
494 HD13 LEU 61 HD13 LEU 61 17.516 6.550 12.588
495 HD21 LEU 61 HD21 LEU 61 14.987 8.413 12.926
496 HD22 LEU 61 HD22 LEU 61 13.923 7.290 12.047
497 HD23 LEU 61 HD23 LEU 61 15.117 6.657 13.180
498 H HIS 62 H HIS 62 14.844 8.341 7.128
499 HA HIS 62 HA HIS 62 15.198 11.236 6.576
500 HD1 HIS 62 HD1 HIS 62 18.522 8.276 4.697
501 HD2 HIS 62 HD2 HIS 62 17.282 10.849 7.789
502 HE1 HIS 62 HE1 HIS 62 20.487 8.470 6.300
503 HB2 HIS 62 HB2 HIS 62 15.835 8.767 4.917
504 HB3 HIS 62 HB3 HIS 62 16.231 10.438 4.495
505 H THR 63 H THR 63 13.567 12.299 5.375
506 HA THR 63 HA THR 63 11.464 10.605 4.164
507 HB THR 63 HB THR 63 9.862 12.261 5.301
508 HG1 THR 63 HG1 THR 63 10.667 13.327 7.087
509 HG21 THR 63 HG21 THR 63 10.242 9.875 6.039
510 HG22 THR 63 HG22 THR 63 11.435 10.478 7.206
511 HG23 THR 63 HG23 THR 63 9.734 10.975 7.332
512 H VAL 64 H VAL 64 10.146 11.482 2.644
513 HA VAL 64 HA VAL 64 10.606 14.272 1.762
514 HB VAL 64 HB VAL 64 9.873 13.631 -0.509
515 HG11 VAL 64 HG11 VAL 64 12.311 13.849 0.097
516 HG12 VAL 64 HG12 VAL 64 12.367 12.076 0.154
517 HG13 VAL 64 HG13 VAL 64 11.951 12.897 -1.354
518 HG21 VAL 64 HG21 VAL 64 10.275 10.735 0.367
519 HG22 VAL 64 HG22 VAL 64 8.731 11.500 -0.075
520 HG23 VAL 64 HG23 VAL 64 9.994 11.298 -1.293
521 H LYS 65 H LYS 65 8.599 15.180 0.850
522 HA LYS 65 HA LYS 65 6.096 13.952 1.903
523 HB2 LYS 65 HB2 LYS 65 6.955 15.912 3.281
524 HB3 LYS 65 HB3 LYS 65 6.801 16.922 1.840
525 HG2 LYS 65 HG2 LYS 65 4.343 16.316 1.757
526 HG3 LYS 65 HG3 LYS 65 4.560 15.421 3.275
527 HD2 LYS 65 HD2 LYS 65 5.350 17.545 4.362
528 HD3 LYS 65 HD3 LYS 65 5.044 18.404 2.835
529 HE2 LYS 65 HE2 LYS 65 2.640 17.676 2.961
530 HE3 LYS 65 HE3 LYS 65 2.975 16.926 4.527
531 HZ1 LYS 65 HZ1 LYS 65 3.572 19.138 5.367
532 HZ2 LYS 65 HZ2 LYS 65 3.218 19.818 3.923
533 HZ3 LYS 65 HZ3 LYS 65 2.043 19.123 4.808
534 H VAL 66 H VAL 66 4.948 13.386 0.107
535 HA VAL 66 HA VAL 66 5.477 14.394 -2.524
536 HB VAL 66 HB VAL 66 3.105 12.849 -1.384
537 HG11 VAL 66 HG11 VAL 66 2.441 13.837 -3.528
538 HG12 VAL 66 HG12 VAL 66 3.941 13.264 -4.296
539 HG13 VAL 66 HG13 VAL 66 2.710 12.111 -3.736
540 HG21 VAL 66 HG21 VAL 66 5.592 11.866 -2.865
541 HG22 VAL 66 HG22 VAL 66 5.244 11.613 -1.143
542 HG23 VAL 66 HG23 VAL 66 4.217 10.862 -2.361
543 H LEU 67 H LEU 67 4.378 15.894 -3.748
544 HA LEU 67 HA LEU 67 2.440 17.687 -2.335
545 HG LEU 67 HG LEU 67 5.588 18.014 -2.193
546 HB2 LEU 67 HB2 LEU 67 4.524 18.383 -4.442
547 HB3 LEU 67 HB3 LEU 67 3.386 19.500 -3.705
548 HD11 LEU 67 HD11 LEU 67 6.529 19.599 -3.768
549 HD12 LEU 67 HD12 LEU 67 5.426 20.874 -3.193
550 HD13 LEU 67 HD13 LEU 67 6.687 20.223 -2.123
551 HD21 LEU 67 HD21 LEU 67 3.758 20.282 -1.291
552 HD22 LEU 67 HD22 LEU 67 3.717 18.606 -0.698
553 HD23 LEU 67 HD23 LEU 67 5.126 19.614 -0.371
554 H SER 68 H SER 68 3.513 16.326 -5.501
555 HA SER 68 HA SER 68 0.724 15.976 -6.338
556 HG SER 68 HG SER 68 1.251 19.220 -7.874
557 HB2 SER 68 HB2 SER 68 2.757 17.490 -8.051
558 HB3 SER 68 HB3 SER 68 1.113 17.040 -8.524
559 H ALA 69 H ALA 69 0.661 14.366 -8.148
560 HA ALA 69 HA ALA 69 3.159 13.314 -9.139
561 HB1 ALA 69 HB1 ALA 69 2.964 12.000 -7.037
562 HB2 ALA 69 HB2 ALA 69 1.318 11.502 -7.498
563 HB3 ALA 69 HB3 ALA 69 2.716 10.965 -8.454
564 H SER 70 H SER 70 2.847 11.903 -10.952
565 HA SER 70 HA SER 70 0.157 11.631 -12.129
566 HG SER 70 HG SER 70 0.938 14.960 -13.341
567 HB2 SER 70 HB2 SER 70 2.398 13.175 -13.520
568 HB3 SER 70 HB3 SER 70 0.782 12.846 -14.160
569 H SER 71 H SER 71 0.253 10.242 -14.097
570 HA SER 71 HA SER 71 2.216 8.173 -14.150
571 HG SER 71 HG SER 71 -1.040 7.571 -15.546
572 HB2 SER 71 HB2 SER 71 0.409 9.150 -16.397
573 HB3 SER 71 HB3 SER 71 1.150 7.546 -16.238
574 H TYR 72 H TYR 72 3.968 7.844 -15.700
575 HA TYR 72 HA TYR 72 5.469 10.258 -16.116
576 HD1 TYR 72 HD1 TYR 72 8.233 10.224 -16.090
577 HD2 TYR 72 HD2 TYR 72 6.933 7.450 -19.132
578 HE1 TYR 72 HE1 TYR 72 10.063 10.988 -17.558
579 HE2 TYR 72 HE2 TYR 72 8.771 8.204 -20.608
580 HH TYR 72 HH TYR 72 11.141 10.716 -19.616
581 HB2 TYR 72 HB2 TYR 72 6.650 8.233 -15.603
582 HB3 TYR 72 HB3 TYR 72 5.926 7.385 -16.970
583 H SER 73 H SER 73 5.682 11.524 -17.824
584 HA SER 73 HA SER 73 5.439 10.530 -20.523
585 HG SER 73 HG SER 73 2.106 11.939 -20.428
586 HB2 SER 73 HB2 SER 73 3.941 13.045 -19.632
587 HB3 SER 73 HB3 SER 73 4.151 12.508 -21.304
588 HA PRO 74 HA PRO 74 9.219 12.639 -20.174
589 HB2 PRO 74 HB2 PRO 74 9.842 13.448 -22.764
590 HB3 PRO 74 HB3 PRO 74 9.940 11.770 -22.157
591 HG2 PRO 74 HG2 PRO 74 7.693 13.060 -23.718
592 HG3 PRO 74 HG3 PRO 74 8.436 11.448 -23.961
593 HD2 PRO 74 HD2 PRO 74 6.095 11.744 -22.615
594 HD3 PRO 74 HD3 PRO 74 7.316 10.548 -22.080
595 H ASP 75 H ASP 75 6.965 14.608 -22.207
596 HA ASP 75 HA ASP 75 8.207 17.122 -21.657
597 HB2 ASP 75 HB2 ASP 75 6.668 16.828 -23.518
598 HB3 ASP 75 HB3 ASP 75 5.355 16.391 -22.422
599 H GLU 76 H GLU 76 5.665 15.275 -19.978
600 HA GLU 76 HA GLU 76 4.947 17.372 -18.157
601 HB2 GLU 76 HB2 GLU 76 3.626 15.245 -18.910
602 HB3 GLU 76 HB3 GLU 76 4.576 14.390 -17.694
603 HG2 GLU 76 HG2 GLU 76 2.531 14.962 -16.655
604 HG3 GLU 76 HG3 GLU 76 3.698 16.097 -15.992
605 H TRP 77 H TRP 77 7.325 14.723 -18.091
606 HA TRP 77 HA TRP 77 8.117 15.032 -15.343
607 HD1 TRP 77 HD1 TRP 77 9.979 13.833 -13.955
608 HE1 TRP 77 HE1 TRP 77 12.463 13.587 -13.453
609 HE3 TRP 77 HE3 TRP 77 11.730 13.497 -18.756
610 HZ2 TRP 77 HZ2 TRP 77 14.941 13.349 -14.951
611 HZ3 TRP 77 HZ3 TRP 77 14.160 13.279 -19.189
612 HH2 TRP 77 HH2 TRP 77 15.775 13.224 -17.298
613 HB2 TRP 77 HB2 TRP 77 8.659 13.008 -16.564
614 HB3 TRP 77 HB3 TRP 77 9.486 13.913 -17.811
615 H GLU 78 H GLU 78 9.591 16.247 -18.433
616 HA GLU 78 HA GLU 78 11.556 17.778 -17.116
617 HB2 GLU 78 HB2 GLU 78 10.328 18.072 -19.884
618 HB3 GLU 78 HB3 GLU 78 11.691 19.043 -19.304
619 HG2 GLU 78 HG2 GLU 78 12.969 16.947 -18.830
620 HG3 GLU 78 HG3 GLU 78 11.664 16.003 -19.541
621 H ARG 79 H ARG 79 8.213 18.717 -18.019
622 HA ARG 79 HA ARG 79 8.286 21.453 -17.312
623 HE ARG 79 HE ARG 79 4.017 22.681 -19.204
624 HB2 ARG 79 HB2 ARG 79 6.250 19.261 -17.393
625 HB3 ARG 79 HB3 ARG 79 5.860 20.573 -16.298
626 HG2 ARG 79 HG2 ARG 79 5.887 22.214 -18.005
627 HG3 ARG 79 HG3 ARG 79 6.576 21.092 -19.206
628 HD2 ARG 79 HD2 ARG 79 4.606 19.894 -19.450
629 HD3 ARG 79 HD3 ARG 79 4.054 20.253 -17.807
630 HH11 ARG 79 HH11 ARG 79 2.366 19.547 -19.143
631 HH12 ARG 79 HH12 ARG 79 0.885 20.140 -19.819
632 HH21 ARG 79 HH21 ARG 79 1.964 23.533 -19.859
633 HH22 ARG 79 HH22 ARG 79 0.627 22.485 -20.137
634 H GLN 80 H GLN 80 7.806 18.593 -15.149
635 HA GLN 80 HA GLN 80 7.519 20.293 -12.822
636 HB2 GLN 80 HB2 GLN 80 7.933 17.305 -13.190
637 HB3 GLN 80 HB3 GLN 80 7.761 18.074 -11.601
638 HG2 GLN 80 HG2 GLN 80 5.564 18.887 -12.092
639 HG3 GLN 80 HG3 GLN 80 5.699 18.488 -13.800
640 HE21 GLN 80 HE22 GLN 80 5.441 16.350 -14.514
641 HE22 GLN 80 HE21 GLN 80 4.712 15.125 -13.477
642 H CYS 81 H CYS 81 10.303 18.507 -14.306
643 HA CYS 81 HA CYS 81 12.228 19.180 -12.363
644 HG CYS 81 HG CYS 81 13.418 16.632 -15.277
645 HB2 CYS 81 HB2 CYS 81 12.684 19.149 -15.379
646 HB3 CYS 81 HB3 CYS 81 13.891 18.915 -14.111
647 H LYS 82 H LYS 82 10.975 21.188 -15.095
648 HA LYS 82 HA LYS 82 12.723 23.404 -14.596
649 HB2 LYS 82 HB2 LYS 82 9.958 23.273 -15.901
650 HB3 LYS 82 HB3 LYS 82 10.909 24.722 -15.776
651 HG2 LYS 82 HG2 LYS 82 12.788 23.063 -16.877
652 HG3 LYS 82 HG3 LYS 82 11.301 22.372 -17.550
653 HD2 LYS 82 HD2 LYS 82 10.648 24.646 -18.373
654 HD3 LYS 82 HD3 LYS 82 12.156 25.292 -17.688
655 HE2 LYS 82 HE2 LYS 82 13.390 23.564 -19.130
656 HE3 LYS 82 HE3 LYS 82 11.851 23.295 -19.965
657 HZ1 LYS 82 HZ1 LYS 82 11.867 25.680 -20.526
658 HZ2 LYS 82 HZ2 LYS 82 13.315 25.872 -19.758
659 HZ3 LYS 82 HZ3 LYS 82 13.201 24.939 -21.103
660 H VAL 83 H VAL 83 9.420 22.678 -13.290
661 HA VAL 83 HA VAL 83 9.243 25.091 -11.802
662 HB VAL 83 HB VAL 83 7.938 22.377 -11.357
663 HG11 VAL 83 HG11 VAL 83 7.783 23.629 -9.249
664 HG12 VAL 83 HG12 VAL 83 7.230 25.078 -10.118
665 HG13 VAL 83 HG13 VAL 83 6.215 23.618 -10.055
666 HG21 VAL 83 HG21 VAL 83 6.911 24.954 -12.644
667 HG22 VAL 83 HG22 VAL 83 7.375 23.494 -13.525
668 HG23 VAL 83 HG23 VAL 83 5.988 23.449 -12.439
669 H ALA 84 H ALA 84 10.868 21.996 -10.982
670 HA ALA 84 HA ALA 84 11.444 22.550 -8.283
671 HB1 ALA 84 HB1 ALA 84 11.863 20.379 -9.517
672 HB2 ALA 84 HB2 ALA 84 13.307 21.132 -10.228
673 HB3 ALA 84 HB3 ALA 84 13.200 20.914 -8.482
674 H GLY 85 H GLY 85 12.705 24.181 -11.106
675 HA2 GLY 85 HA2 GLY 85 14.839 25.508 -9.496
676 HA3 GLY 85 HA3 GLY 85 15.131 24.857 -11.116
677 H LYS 86 H LYS 86 12.244 26.578 -9.910
678 HA LYS 86 HA LYS 86 11.189 28.465 -10.503
679 HB2 LYS 86 HB2 LYS 86 13.976 29.645 -10.799
680 HB3 LYS 86 HB3 LYS 86 12.466 30.527 -10.564
681 HG2 LYS 86 HG2 LYS 86 12.202 29.234 -8.362
682 HG3 LYS 86 HG3 LYS 86 13.899 28.749 -8.575
683 HD2 LYS 86 HD2 LYS 86 14.516 31.183 -8.772
684 HD3 LYS 86 HD3 LYS 86 12.836 31.619 -8.448
685 HE2 LYS 86 HE2 LYS 86 14.746 30.176 -6.566
686 HE3 LYS 86 HE3 LYS 86 14.231 31.849 -6.435
687 HZ1 LYS 86 HZ1 LYS 86 12.059 31.170 -5.852
688 HZ2 LYS 86 HZ2 LYS 86 12.306 29.609 -6.290
689 HZ3 LYS 86 HZ3 LYS 86 13.058 30.194 -4.980
690 H THR 87 H THR 87 11.679 26.633 -12.719
691 HA THR 87 HA THR 87 11.330 26.474 -14.875
692 HB THR 87 HB THR 87 9.929 29.147 -14.695
693 HG1 THR 87 HG1 THR 87 9.170 27.813 -13.096
694 HG21 THR 87 HG21 THR 87 10.114 28.270 -17.016
695 HG22 THR 87 HG22 THR 87 9.460 26.707 -16.481
696 HG23 THR 87 HG23 THR 87 8.453 28.171 -16.421
697 H GLN 88 H GLN 88 13.522 26.411 -15.323
698 HA GLN 88 HA GLN 88 14.499 28.673 -16.999
699 HB2 GLN 88 HB2 GLN 88 16.094 26.887 -15.109
700 HB3 GLN 88 HB3 GLN 88 16.798 27.978 -16.306
701 HG2 GLN 88 HG2 GLN 88 15.819 29.925 -15.168
702 HG3 GLN 88 HG3 GLN 88 15.015 28.874 -13.996
703 HE21 GLN 88 HE22 GLN 88 16.286 27.703 -12.446
704 HE22 GLN 88 HE21 GLN 88 17.975 28.133 -12.121
Start of MODEL 2
1 HA MET 1 HA MET 1 4.087 -2.203 -2.397
2 H1 MET 1 H1 MET 1 3.985 -2.254 -0.035
3 H2 MET 1 H2 MET 1 2.791 -1.132 -0.001
4 H3 MET 1 H3 MET 1 2.504 -2.607 -0.677
5 HB2 MET 1 HB2 MET 1 1.755 -1.477 -2.841
6 HB3 MET 1 HB3 MET 1 2.126 0.123 -2.179
7 HG2 MET 1 HG2 MET 1 2.221 0.157 -4.617
8 HG3 MET 1 HG3 MET 1 3.816 0.475 -3.948
9 HE1 MET 1 HE1 MET 1 3.401 -0.113 -6.982
10 HE2 MET 1 HE2 MET 1 4.972 0.179 -6.203
11 HE3 MET 1 HE3 MET 1 4.759 -1.223 -7.277
12 H GLU 2 HN GLU 2 5.939 -1.209 -3.035
13 HA GLU 2 HA GLU 2 6.890 1.191 -1.594
14 HB2 GLU 2 HB2 GLU 2 8.572 -1.305 -2.104
15 HB3 GLU 2 HB3 GLU 2 9.074 0.203 -1.348
16 HG2 GLU 2 HG2 GLU 2 8.788 -1.157 0.494
17 HG3 GLU 2 HG3 GLU 2 7.261 -0.280 0.445
18 H TRP 3 HN TRP 3 8.631 2.245 -2.901
19 HA TRP 3 HA TRP 3 8.266 1.764 -5.808
20 HD1 TRP 3 HD1 TRP 3 6.134 3.620 -2.651
21 HE1 TRP 3 HE1 TRP 3 3.628 3.199 -2.929
22 HE3 TRP 3 HE3 TRP 3 5.934 3.350 -7.755
23 HZ2 TRP 3 HZ2 TRP 3 1.758 2.785 -5.110
24 HZ3 TRP 3 HZ3 TRP 3 3.782 2.928 -8.911
25 HH2 TRP 3 HH2 TRP 3 1.689 2.646 -7.598
26 HB2 TRP 3 HB2 TRP 3 8.036 4.404 -4.321
27 HB3 TRP 3 HB3 TRP 3 7.795 4.164 -6.030
28 H LEU 4 HN LEU 4 9.836 3.262 -7.002
29 HA LEU 4 HA LEU 4 12.500 3.294 -5.660
30 HG LEU 4 HG LEU 4 14.021 3.184 -8.427
31 HB2 LEU 4 HB2 LEU 4 12.164 1.254 -6.977
32 HB3 LEU 4 HB3 LEU 4 11.691 2.236 -8.374
33 HD11 LEU 4 HD11 LEU 4 14.766 2.768 -6.136
34 HD12 LEU 4 HD12 LEU 4 14.550 1.019 -6.339
35 HD13 LEU 4 HD13 LEU 4 15.803 1.884 -7.253
36 HD21 LEU 4 HD21 LEU 4 13.814 0.147 -8.636
37 HD22 LEU 4 HD22 LEU 4 13.277 1.299 -9.875
38 HD23 LEU 4 HD23 LEU 4 14.995 1.185 -9.461
39 H VAL 5 HN VAL 5 13.507 5.080 -5.956
40 HA VAL 5 HA VAL 5 12.672 7.265 -7.785
41 HB VAL 5 HB VAL 5 15.131 7.014 -6.007
42 HG11 VAL 5 HG11 VAL 5 15.159 9.498 -6.144
43 HG12 VAL 5 HG12 VAL 5 15.412 8.723 -7.706
44 HG13 VAL 5 HG13 VAL 5 13.822 9.408 -7.313
45 HG21 VAL 5 HG21 VAL 5 13.255 6.882 -4.501
46 HG22 VAL 5 HG22 VAL 5 13.836 8.538 -4.424
47 HG23 VAL 5 HG23 VAL 5 12.381 8.148 -5.376
48 H LYS 6 HN LYS 6 13.063 6.733 -9.814
49 HA LYS 6 HA LYS 6 15.564 5.388 -10.690
50 HB2 LYS 6 HB2 LYS 6 12.877 5.926 -11.932
51 HB3 LYS 6 HB3 LYS 6 14.246 5.566 -12.963
52 HG2 LYS 6 HG2 LYS 6 13.749 3.701 -10.656
53 HG3 LYS 6 HG3 LYS 6 12.634 3.644 -12.009
54 HD2 LYS 6 HD2 LYS 6 14.452 1.984 -12.203
55 HD3 LYS 6 HD3 LYS 6 14.348 3.087 -13.577
56 HE2 LYS 6 HE2 LYS 6 16.257 4.390 -12.743
57 HE3 LYS 6 HE3 LYS 6 16.352 3.363 -11.297
58 HZ1 LYS 6 HZ1 LYS 6 16.798 2.440 -14.081
59 HZ2 LYS 6 HZ2 LYS 6 17.957 2.693 -12.970
60 HZ3 LYS 6 HZ3 LYS 6 16.885 1.490 -12.753
61 H LYS 7 HN LYS 7 14.141 8.575 -10.515
62 HA LYS 7 HA LYS 7 16.542 9.744 -11.688
63 HB2 LYS 7 HB2 LYS 7 13.825 10.712 -12.664
64 HB3 LYS 7 HB3 LYS 7 15.407 11.392 -13.029
65 HG2 LYS 7 HG2 LYS 7 16.023 9.144 -14.087
66 HG3 LYS 7 HG3 LYS 7 14.308 8.709 -13.927
67 HD2 LYS 7 HD2 LYS 7 13.804 10.847 -15.262
68 HD3 LYS 7 HD3 LYS 7 15.549 10.942 -15.576
69 HE2 LYS 7 HE2 LYS 7 15.477 8.616 -16.510
70 HE3 LYS 7 HE3 LYS 7 13.735 8.572 -16.226
71 HZ1 LYS 7 HZ1 LYS 7 14.198 9.148 -18.508
72 HZ2 LYS 7 HZ2 LYS 7 13.513 10.445 -17.783
73 HZ3 LYS 7 HZ3 LYS 7 15.123 10.418 -18.081
74 H SER 8 HN SER 8 16.777 11.957 -10.748
75 HA SER 8 HA SER 8 14.775 12.877 -8.808
76 HG SER 8 HG SER 8 16.826 13.009 -5.957
77 HB2 SER 8 HB2 SER 8 16.357 11.328 -7.559
78 HB3 SER 8 HB3 SER 8 17.666 12.456 -7.971
79 H CYS 9 HN CYS 9 15.134 15.119 -8.398
80 HA CYS 9 HA CYS 9 16.849 16.555 -10.379
81 HG CYS 9 HG CYS 9 13.750 14.923 -10.599
82 HB2 CYS 9 HB2 CYS 9 13.963 17.254 -9.721
83 HB3 CYS 9 HB3 CYS 9 14.990 17.937 -10.988
84 H CYS 10 HN CYS 10 18.329 17.220 -8.834
85 HA CYS 10 HA CYS 10 17.780 18.225 -6.261
86 HG CYS 10 HG CYS 10 19.747 16.639 -5.786
87 HB2 CYS 10 HB2 CYS 10 20.063 18.962 -8.143
88 HB3 CYS 10 HB3 CYS 10 20.043 19.167 -6.384
89 H ASN 11 HN ASN 11 17.311 20.251 -5.467
90 HA ASN 11 HA ASN 11 17.453 22.686 -7.074
91 HB2 ASN 11 HB2 ASN 11 15.270 23.287 -7.193
92 HB3 ASN 11 HB3 ASN 11 15.089 21.567 -7.505
93 HD21 ASN 11 HD22 ASN 11 14.720 20.210 -5.404
94 HD22 ASN 11 HD21 ASN 11 13.631 20.889 -4.245
95 H LYS 12 HN LYS 12 17.479 24.483 -5.747
96 HA LYS 12 HA LYS 12 17.015 24.109 -2.847
97 HB2 LYS 12 HB2 LYS 12 19.047 25.436 -2.295
98 HB3 LYS 12 HB3 LYS 12 19.322 23.811 -2.880
99 HG2 LYS 12 HG2 LYS 12 20.984 25.322 -3.752
100 HG3 LYS 12 HG3 LYS 12 20.037 24.636 -5.069
101 HD2 LYS 12 HD2 LYS 12 18.762 26.691 -5.302
102 HD3 LYS 12 HD3 LYS 12 19.533 27.403 -3.882
103 HE2 LYS 12 HE2 LYS 12 20.961 26.579 -6.462
104 HE3 LYS 12 HE3 LYS 12 20.406 28.217 -6.110
105 HZ1 LYS 12 HZ1 LYS 12 21.914 28.265 -4.211
106 HZ2 LYS 12 HZ2 LYS 12 22.454 26.755 -4.547
107 HZ3 LYS 12 HZ3 LYS 12 22.731 27.973 -5.588
108 H GLN 13 HN GLN 13 16.156 25.709 -5.609
109 HA GLN 13 HA GLN 13 15.999 28.395 -4.594
110 HB2 GLN 13 HB2 GLN 13 14.358 27.144 -6.829
111 HB3 GLN 13 HB3 GLN 13 14.684 28.847 -6.548
112 HG2 GLN 13 HG2 GLN 13 16.189 28.465 -8.222
113 HG3 GLN 13 HG3 GLN 13 17.228 28.130 -6.848
114 HE21 GLN 13 HE22 GLN 13 15.614 26.808 -9.651
115 HE22 GLN 13 HE21 GLN 13 16.336 25.201 -9.572
116 H ASP 14 HN ASP 14 13.862 25.509 -4.531
117 HA ASP 14 HA ASP 14 12.179 26.980 -2.546
118 HB2 ASP 14 HB2 ASP 14 11.264 27.220 -4.928
119 HB3 ASP 14 HB3 ASP 14 10.932 25.489 -4.875
120 H ASN 15 HN ASN 15 13.915 24.323 -3.134
121 HA ASN 15 HA ASN 15 14.285 22.366 -2.415
122 HB2 ASN 15 HB2 ASN 15 14.192 23.573 -0.240
123 HB3 ASN 15 HB3 ASN 15 12.536 22.987 -0.041
124 HD21 ASN 15 HD22 ASN 15 12.538 21.279 1.291
125 HD22 ASN 15 HD21 ASN 15 13.750 19.995 1.357
126 H ARG 16 HN ARG 16 11.435 23.016 -3.701
127 HA ARG 16 HA ARG 16 10.050 20.464 -3.312
128 HE ARG 16 HE ARG 16 6.348 22.338 -5.899
129 HB2 ARG 16 HB2 ARG 16 9.626 22.486 -5.527
130 HB3 ARG 16 HB3 ARG 16 8.577 21.139 -5.052
131 HG2 ARG 16 HG2 ARG 16 8.369 22.345 -2.764
132 HG3 ARG 16 HG3 ARG 16 9.157 23.707 -3.538
133 HD2 ARG 16 HD2 ARG 16 6.361 22.836 -3.676
134 HD3 ARG 16 HD3 ARG 16 7.037 24.414 -3.969
135 HH11 ARG 16 HH11 ARG 16 8.242 25.352 -5.495
136 HH12 ARG 16 HH12 ARG 16 8.573 25.485 -7.198
137 HH21 ARG 16 HH21 ARG 16 6.890 22.486 -8.085
138 HH22 ARG 16 HH22 ARG 16 7.787 23.865 -8.675
139 H HIS 17 HN HIS 17 11.559 18.932 -3.763
140 HA HIS 17 HA HIS 17 13.142 18.754 -6.212
141 HD1 HIS 17 HD1 HIS 17 13.782 18.899 -2.409
142 HD2 HIS 17 HD2 HIS 17 15.838 17.016 -5.559
143 HE1 HIS 17 HE1 HIS 17 16.231 19.581 -2.178
144 HB2 HIS 17 HB2 HIS 17 12.447 16.867 -3.920
145 HB3 HIS 17 HB3 HIS 17 13.374 16.342 -5.322
146 H VAL 18 HN VAL 18 12.843 16.873 -7.676
147 HA VAL 18 HA VAL 18 10.140 15.752 -7.768
148 HB VAL 18 HB VAL 18 11.478 16.703 -10.318
149 HG11 VAL 18 HG11 VAL 18 9.329 16.331 -11.379
150 HG12 VAL 18 HG12 VAL 18 9.808 14.863 -10.553
151 HG13 VAL 18 HG13 VAL 18 8.576 15.914 -9.823
152 HG21 VAL 18 HG21 VAL 18 9.219 18.126 -8.863
153 HG22 VAL 18 HG22 VAL 18 10.876 18.737 -9.039
154 HG23 VAL 18 HG23 VAL 18 9.848 18.543 -10.460
155 H LEU 19 HN LEU 19 10.151 13.709 -8.574
156 HA LEU 19 HA LEU 19 12.702 12.536 -9.427
157 HG LEU 19 HG LEU 19 10.580 12.317 -6.181
158 HB2 LEU 19 HB2 LEU 19 11.759 10.594 -7.687
159 HB3 LEU 19 HB3 LEU 19 13.206 11.556 -7.529
160 HD11 LEU 19 HD11 LEU 19 11.550 11.320 -4.185
161 HD12 LEU 19 HD12 LEU 19 11.351 10.139 -5.487
162 HD13 LEU 19 HD13 LEU 19 12.967 10.786 -5.126
163 HD21 LEU 19 HD21 LEU 19 13.443 13.368 -6.132
164 HD22 LEU 19 HD22 LEU 19 11.917 14.274 -6.048
165 HD23 LEU 19 HD23 LEU 19 12.487 13.417 -4.634
166 H MET 20 HN MET 20 12.331 10.244 -10.132
167 HA MET 20 HA MET 20 9.602 9.998 -11.314
168 HB2 MET 20 HB2 MET 20 12.256 9.085 -12.404
169 HB3 MET 20 HB3 MET 20 10.779 8.155 -12.711
170 HG2 MET 20 HG2 MET 20 9.616 10.185 -13.473
171 HG3 MET 20 HG3 MET 20 11.088 11.129 -13.247
172 HE1 MET 20 HE1 MET 20 9.347 8.243 -15.206
173 HE2 MET 20 HE2 MET 20 10.488 7.889 -16.525
174 HE3 MET 20 HE3 MET 20 10.892 7.434 -14.856
175 H LEU 21 HN LEU 21 8.453 8.925 -10.079
176 HA LEU 21 HA LEU 21 9.554 7.128 -7.999
177 HG LEU 21 HG LEU 21 8.040 6.878 -6.097
178 HB2 LEU 21 HB2 LEU 21 8.212 9.128 -7.403
179 HB3 LEU 21 HB3 LEU 21 6.851 8.530 -8.352
180 HD11 LEU 21 HD11 LEU 21 5.871 9.024 -5.863
181 HD12 LEU 21 HD12 LEU 21 6.412 7.935 -4.562
182 HD13 LEU 21 HD13 LEU 21 7.515 9.158 -5.217
183 HD21 LEU 21 HD21 LEU 21 6.409 5.706 -7.500
184 HD22 LEU 21 HD22 LEU 21 5.637 6.082 -5.958
185 HD23 LEU 21 HD23 LEU 21 5.275 7.060 -7.398
186 H CYS 22 HN CYS 22 9.555 5.062 -8.654
187 HA CYS 22 HA CYS 22 7.619 4.146 -10.735
188 HG CYS 22 HG CYS 22 10.607 5.926 -10.760
189 HB2 CYS 22 HB2 CYS 22 10.559 3.426 -10.330
190 HB3 CYS 22 HB3 CYS 22 9.528 2.938 -11.678
191 H ASP 23 HN ASP 23 7.553 1.716 -10.840
192 HA ASP 23 HA ASP 23 6.865 0.377 -8.408
193 HB2 ASP 23 HB2 ASP 23 6.101 -0.651 -10.367
194 HB3 ASP 23 HB3 ASP 23 7.602 -0.354 -11.236
195 H ALA 24 HN ALA 24 8.122 -1.045 -7.076
196 HA ALA 24 HA ALA 24 10.930 -0.507 -6.760
197 HB1 ALA 24 HB1 ALA 24 10.807 -2.285 -5.044
198 HB2 ALA 24 HB2 ALA 24 9.560 -1.046 -4.838
199 HB3 ALA 24 HB3 ALA 24 9.132 -2.629 -5.532
200 H GLY 25 HN GLY 25 11.476 -0.906 -9.018
201 HA2 GLY 25 HA2 GLY 25 12.962 -3.061 -9.791
202 HA3 GLY 25 HA3 GLY 25 11.290 -3.581 -10.119
203 H GLY 26 HN GLY 26 10.709 -0.562 -10.559
204 HA2 GLY 26 HA2 GLY 26 10.814 1.040 -12.184
205 HA3 GLY 26 HA3 GLY 26 12.114 0.157 -12.998
206 H ALA 27 HN ALA 27 9.299 -1.841 -12.393
207 HA ALA 27 HA ALA 27 9.011 -2.266 -15.210
208 HB1 ALA 27 HB1 ALA 27 7.171 -3.106 -12.928
209 HB2 ALA 27 HB2 ALA 27 7.213 -3.800 -14.559
210 HB3 ALA 27 HB3 ALA 27 8.607 -4.002 -13.481
211 H ILE 28 HN ILE 28 7.529 0.042 -13.103
212 HA ILE 28 HA ILE 28 5.785 1.089 -15.227
213 HB ILE 28 HB ILE 28 4.897 0.568 -12.342
214 HG12 ILE 28 HG12 ILE 28 3.887 -0.664 -14.946
215 HG13 ILE 28 HG13 ILE 28 4.784 -1.493 -13.669
216 HG21 ILE 28 HG21 ILE 28 3.352 1.892 -14.624
217 HG22 ILE 28 HG22 ILE 28 2.738 1.584 -12.985
218 HG23 ILE 28 HG23 ILE 28 4.029 2.734 -13.210
219 HD11 ILE 28 HD11 ILE 28 1.946 -0.457 -13.487
220 HD12 ILE 28 HD12 ILE 28 2.516 -2.128 -13.436
221 HD13 ILE 28 HD13 ILE 28 2.889 -1.034 -12.088
222 H LYS 29 HN LYS 29 5.746 3.449 -14.988
223 HA LYS 29 HA LYS 29 7.537 4.538 -12.881
224 HB2 LYS 29 HB2 LYS 29 7.850 5.114 -15.858
225 HB3 LYS 29 HB3 LYS 29 8.725 5.876 -14.529
226 HG2 LYS 29 HG2 LYS 29 9.486 3.444 -13.912
227 HG3 LYS 29 HG3 LYS 29 8.945 3.016 -15.534
228 HD2 LYS 29 HD2 LYS 29 10.535 4.615 -16.521
229 HD3 LYS 29 HD3 LYS 29 10.935 5.240 -14.919
230 HE2 LYS 29 HE2 LYS 29 12.733 3.842 -15.625
231 HE3 LYS 29 HE3 LYS 29 11.930 3.104 -14.247
232 HZ1 LYS 29 HZ1 LYS 29 10.878 1.524 -15.728
233 HZ2 LYS 29 HZ2 LYS 29 11.423 2.309 -17.071
234 HZ3 LYS 29 HZ3 LYS 29 12.465 1.539 -16.088
235 H MET 30 HN MET 30 7.062 6.585 -12.220
236 HA MET 30 HA MET 30 4.977 8.180 -13.553
237 HB2 MET 30 HB2 MET 30 4.914 7.538 -10.575
238 HB3 MET 30 HB3 MET 30 3.811 8.561 -11.473
239 HG2 MET 30 HG2 MET 30 3.332 6.395 -12.882
240 HG3 MET 30 HG3 MET 30 4.026 5.561 -11.494
241 HE1 MET 30 HE1 MET 30 3.062 6.100 -8.939
242 HE2 MET 30 HE2 MET 30 2.820 7.847 -9.210
243 HE3 MET 30 HE3 MET 30 1.470 6.841 -8.652
244 H ILE 31 HN ILE 31 4.943 10.355 -12.180
245 HA ILE 31 HA ILE 31 7.738 11.224 -11.634
246 HB ILE 31 HB ILE 31 5.497 12.794 -12.888
247 HG12 ILE 31 HG12 ILE 31 8.046 12.181 -14.404
248 HG13 ILE 31 HG13 ILE 31 6.846 10.898 -14.324
249 HG21 ILE 31 HG21 ILE 31 8.433 13.471 -12.372
250 HG22 ILE 31 HG22 ILE 31 7.344 14.453 -13.365
251 HG23 ILE 31 HG23 ILE 31 7.009 14.254 -11.645
252 HD11 ILE 31 HD11 ILE 31 5.100 12.348 -15.145
253 HD12 ILE 31 HD12 ILE 31 6.219 13.720 -15.207
254 HD13 ILE 31 HD13 ILE 31 6.473 12.322 -16.278
255 H ALA 32 HN ALA 32 7.854 12.442 -9.631
256 HA ALA 32 HA ALA 32 5.309 13.223 -8.344
257 HB1 ALA 32 HB1 ALA 32 6.053 12.271 -6.192
258 HB2 ALA 32 HB2 ALA 32 5.832 10.997 -7.409
259 HB3 ALA 32 HB3 ALA 32 7.472 11.554 -6.984
260 H GLU 33 HN GLU 33 5.503 15.189 -7.463
261 HA GLU 33 HA GLU 33 8.176 16.460 -7.211
262 HB2 GLU 33 HB2 GLU 33 6.469 17.730 -8.546
263 HB3 GLU 33 HB3 GLU 33 5.373 17.691 -7.151
264 HG2 GLU 33 HG2 GLU 33 7.059 18.943 -5.821
265 HG3 GLU 33 HG3 GLU 33 8.111 19.034 -7.216
266 H VAL 34 HN VAL 34 8.864 16.897 -5.115
267 HA VAL 34 HA VAL 34 7.088 16.360 -2.833
268 HB VAL 34 HB VAL 34 8.612 14.734 -1.874
269 HG11 VAL 34 HG11 VAL 34 8.108 13.763 -4.717
270 HG12 VAL 34 HG12 VAL 34 8.268 12.791 -3.244
271 HG13 VAL 34 HG13 VAL 34 6.859 13.835 -3.466
272 HG21 VAL 34 HG21 VAL 34 10.768 15.448 -2.737
273 HG22 VAL 34 HG22 VAL 34 10.510 13.756 -3.162
274 HG23 VAL 34 HG23 VAL 34 10.297 15.017 -4.395
275 H LYS 35 HN LYS 35 8.149 17.141 -0.804
276 HA LYS 35 HA LYS 35 10.407 19.034 -1.305
277 HB2 LYS 35 HB2 LYS 35 8.218 20.015 -0.350
278 HB3 LYS 35 HB3 LYS 35 8.536 19.068 1.107
279 HG2 LYS 35 HG2 LYS 35 10.683 20.204 1.405
280 HG3 LYS 35 HG3 LYS 35 10.487 21.083 -0.125
281 HD2 LYS 35 HD2 LYS 35 8.622 21.371 2.273
282 HD3 LYS 35 HD3 LYS 35 10.014 22.417 1.960
283 HE2 LYS 35 HE2 LYS 35 9.045 23.067 -0.240
284 HE3 LYS 35 HE3 LYS 35 7.626 22.062 0.093
285 HZ1 LYS 35 HZ1 LYS 35 7.216 24.374 0.647
286 HZ2 LYS 35 HZ2 LYS 35 7.157 23.484 2.010
287 HZ3 LYS 35 HZ3 LYS 35 8.463 24.413 1.692
288 H SER 36 HN SER 36 12.247 18.648 0.062
289 HA SER 36 HA SER 36 12.182 15.946 1.356
290 HG SER 36 HG SER 36 13.647 15.973 -2.047
291 HB2 SER 36 HB2 SER 36 14.531 16.957 -0.228
292 HB3 SER 36 HB3 SER 36 14.003 15.292 0.146
293 H ASP 37 HN ASP 37 12.802 15.985 3.442
294 HA ASP 37 HA ASP 37 14.268 18.329 4.479
295 HB2 ASP 37 HB2 ASP 37 12.296 17.367 5.673
296 HB3 ASP 37 HB3 ASP 37 13.205 15.878 5.928
297 H PHE 38 HN PHE 38 15.067 15.514 2.933
298 HA PHE 38 HA PHE 38 17.814 15.420 3.959
299 HD1 PHE 38 HD2 PHE 38 14.316 13.771 5.138
300 HD2 PHE 38 HD1 PHE 38 18.424 13.117 6.282
301 HE1 PHE 38 HE2 PHE 38 13.635 13.666 7.520
302 HE2 PHE 38 HE1 PHE 38 17.739 13.022 8.665
303 HZ PHE 38 HZ PHE 38 15.344 13.289 9.288
304 HB2 PHE 38 HB2 PHE 38 16.069 12.961 3.504
305 HB3 PHE 38 HB3 PHE 38 17.761 12.953 3.957
306 H ALA 39 HN ALA 39 19.205 14.361 2.255
307 HA ALA 39 HA ALA 39 18.501 15.081 -0.416
308 HB1 ALA 39 HB1 ALA 39 20.844 14.937 0.361
309 HB2 ALA 39 HB2 ALA 39 20.660 13.183 0.612
310 HB3 ALA 39 HB3 ALA 39 20.569 13.865 -1.024
311 H VAL 40 HN VAL 40 18.000 13.695 -2.208
312 HA VAL 40 HA VAL 40 17.369 10.879 -1.741
313 HB VAL 40 HB VAL 40 15.292 11.924 -1.101
314 HG11 VAL 40 HG11 VAL 40 13.932 13.333 -2.572
315 HG12 VAL 40 HG12 VAL 40 15.456 14.130 -2.184
316 HG13 VAL 40 HG13 VAL 40 15.227 13.377 -3.779
317 HG21 VAL 40 HG21 VAL 40 14.981 10.823 -3.913
318 HG22 VAL 40 HG22 VAL 40 15.214 9.843 -2.454
319 HG23 VAL 40 HG23 VAL 40 13.760 10.841 -2.621
320 H LYS 41 HN LYS 41 17.803 9.703 -3.598
321 HA LYS 41 HA LYS 41 18.427 11.115 -6.099
322 HB2 LYS 41 HB2 LYS 41 20.795 10.170 -6.061
323 HB3 LYS 41 HB3 LYS 41 20.443 11.593 -5.108
324 HG2 LYS 41 HG2 LYS 41 21.917 10.161 -3.876
325 HG3 LYS 41 HG3 LYS 41 20.372 10.274 -3.041
326 HD2 LYS 41 HD2 LYS 41 19.749 8.031 -4.070
327 HD3 LYS 41 HD3 LYS 41 21.368 7.965 -4.768
328 HE2 LYS 41 HE2 LYS 41 21.369 6.652 -2.753
329 HE3 LYS 41 HE3 LYS 41 22.322 8.109 -2.438
330 HZ1 LYS 41 HZ1 LYS 41 20.774 7.584 -0.633
331 HZ2 LYS 41 HZ2 LYS 41 20.370 9.027 -1.298
332 HZ3 LYS 41 HZ3 LYS 41 19.485 7.691 -1.653
333 H VAL 42 HN VAL 42 19.344 9.508 -7.721
334 HA VAL 42 HA VAL 42 17.407 7.546 -8.144
335 HB VAL 42 HB VAL 42 20.198 7.783 -9.373
336 HG11 VAL 42 HG11 VAL 42 19.309 5.619 -9.974
337 HG12 VAL 42 HG12 VAL 42 17.686 6.288 -10.230
338 HG13 VAL 42 HG13 VAL 42 19.016 6.680 -11.352
339 HG21 VAL 42 HG21 VAL 42 18.771 8.977 -11.172
340 HG22 VAL 42 HG22 VAL 42 17.490 9.022 -9.922
341 HG23 VAL 42 HG23 VAL 42 19.030 9.867 -9.671
342 H GLY 43 HN GLY 43 17.326 5.358 -8.067
343 HA2 GLY 43 HA2 GLY 43 17.727 3.237 -7.346
344 HA3 GLY 43 HA3 GLY 43 19.376 3.683 -6.859
345 H ASP 44 HN ASP 44 16.380 5.443 -5.823
346 HA ASP 44 HA ASP 44 17.097 4.545 -3.002
347 HB2 ASP 44 HB2 ASP 44 15.875 7.168 -3.887
348 HB3 ASP 44 HB3 ASP 44 15.474 6.445 -2.337
349 H LEU 45 HN LEU 45 15.473 3.618 -1.711
350 HA LEU 45 HA LEU 45 13.036 2.788 -3.157
351 HG LEU 45 HG LEU 45 11.366 1.752 -1.249
352 HB2 LEU 45 HB2 LEU 45 14.388 1.371 -1.406
353 HB3 LEU 45 HB3 LEU 45 13.690 2.464 -0.215
354 HD11 LEU 45 HD11 LEU 45 11.332 -0.502 -2.199
355 HD12 LEU 45 HD12 LEU 45 12.306 0.564 -3.220
356 HD13 LEU 45 HD13 LEU 45 13.107 -0.589 -2.133
357 HD21 LEU 45 HD21 LEU 45 11.281 -0.174 0.274
358 HD22 LEU 45 HD22 LEU 45 13.056 -0.126 0.436
359 HD23 LEU 45 HD23 LEU 45 12.052 1.239 1.001
360 H LEU 46 HN LEU 46 10.940 3.490 -2.449
361 HA LEU 46 HA LEU 46 10.785 5.564 -0.342
362 HG LEU 46 HG LEU 46 11.314 6.585 -3.325
363 HB2 LEU 46 HB2 LEU 46 9.154 5.567 -2.909
364 HB3 LEU 46 HB3 LEU 46 8.888 6.618 -1.530
365 HD11 LEU 46 HD11 LEU 46 9.409 7.516 -4.479
366 HD12 LEU 46 HD12 LEU 46 8.963 8.521 -3.081
367 HD13 LEU 46 HD13 LEU 46 10.421 8.883 -4.009
368 HD21 LEU 46 HD21 LEU 46 11.902 8.766 -2.164
369 HD22 LEU 46 HD22 LEU 46 10.596 8.421 -0.996
370 HD23 LEU 46 HD23 LEU 46 11.995 7.355 -1.107
371 H SER 47 HN SER 47 9.440 4.883 1.186
372 HA SER 47 HA SER 47 7.287 2.921 0.517
373 HG SER 47 HG SER 47 9.747 0.911 2.113
374 HB2 SER 47 HB2 SER 47 9.022 2.894 3.016
375 HB3 SER 47 HB3 SER 47 7.699 1.777 2.631
376 HA PRO 48 HA PRO 48 5.006 6.231 2.285
377 HB2 PRO 48 HB2 PRO 48 2.569 5.070 2.863
378 HB3 PRO 48 HB3 PRO 48 3.133 5.431 1.208
379 HG2 PRO 48 HG2 PRO 48 3.281 2.796 2.696
380 HG3 PRO 48 HG3 PRO 48 2.735 3.090 1.013
381 HD2 PRO 48 HD2 PRO 48 5.256 2.226 1.580
382 HD3 PRO 48 HD3 PRO 48 4.951 3.386 0.251
383 H LEU 49 HN LEU 49 4.373 7.159 4.138
384 HA LEU 49 HA LEU 49 4.458 5.625 6.718
385 HG LEU 49 HG LEU 49 7.038 6.612 5.641
386 HB2 LEU 49 HB2 LEU 49 5.341 8.470 6.061
387 HB3 LEU 49 HB3 LEU 49 5.168 7.859 7.702
388 HD11 LEU 49 HD11 LEU 49 7.705 8.925 6.048
389 HD12 LEU 49 HD12 LEU 49 7.663 8.659 7.806
390 HD13 LEU 49 HD13 LEU 49 8.855 7.805 6.799
391 HD21 LEU 49 HD21 LEU 49 6.817 6.333 8.681
392 HD22 LEU 49 HD22 LEU 49 6.476 5.075 7.470
393 HD23 LEU 49 HD23 LEU 49 8.127 5.656 7.696
394 H GLN 50 HN GLN 50 3.090 8.237 4.767
395 HA GLN 50 HA GLN 50 0.415 7.644 5.612
396 HB2 GLN 50 HB2 GLN 50 -0.156 10.042 6.147
397 HB3 GLN 50 HB3 GLN 50 0.775 9.220 7.391
398 HG2 GLN 50 HG2 GLN 50 2.771 10.400 6.865
399 HG3 GLN 50 HG3 GLN 50 2.134 10.956 5.315
400 HE21 GLN 50 HE22 GLN 50 2.216 13.183 5.550
401 HE22 GLN 50 HE21 GLN 50 1.381 14.053 6.812
402 H ASN 51 HN ASN 51 -0.983 9.426 4.211
403 HA ASN 51 HA ASN 51 -0.591 8.800 1.556
404 HB2 ASN 51 HB2 ASN 51 -2.687 9.707 2.405
405 HB3 ASN 51 HB3 ASN 51 -1.932 11.268 2.741
406 HD21 ASN 51 HD22 ASN 51 -1.650 12.772 0.997
407 HD22 ASN 51 HD21 ASN 51 -2.216 12.441 -0.615
408 H ALA 52 HN ALA 52 0.875 11.593 3.247
409 HA ALA 52 HA ALA 52 2.161 12.390 0.751
410 HB1 ALA 52 HB1 ALA 52 1.152 14.189 2.982
411 HB2 ALA 52 HB2 ALA 52 1.906 14.706 1.456
412 HB3 ALA 52 HB3 ALA 52 0.331 13.905 1.427
413 H LEU 53 HN LEU 53 3.244 10.614 3.091
414 HA LEU 53 HA LEU 53 5.810 11.991 3.061
415 HG LEU 53 HG LEU 53 4.651 13.465 5.220
416 HB2 LEU 53 HB2 LEU 53 4.583 10.891 5.607
417 HB3 LEU 53 HB3 LEU 53 6.316 10.926 5.370
418 HD11 LEU 53 HD11 LEU 53 4.367 12.431 7.453
419 HD12 LEU 53 HD12 LEU 53 6.128 12.283 7.618
420 HD13 LEU 53 HD13 LEU 53 5.364 13.887 7.547
421 HD21 LEU 53 HD21 LEU 53 7.636 12.973 5.726
422 HD22 LEU 53 HD22 LEU 53 6.935 13.579 4.221
423 HD23 LEU 53 HD23 LEU 53 6.830 14.554 5.684
424 H TYR 54 HN TYR 54 7.402 10.589 2.570
425 HA TYR 54 HA TYR 54 6.893 7.679 2.822
426 HD1 TYR 54 HD1 TYR 54 5.186 9.793 0.535
427 HD2 TYR 54 HD2 TYR 54 6.781 5.901 -0.410
428 HE1 TYR 54 HE1 TYR 54 3.025 9.162 -0.480
429 HE2 TYR 54 HE2 TYR 54 4.642 5.279 -1.469
430 HH TYR 54 HH TYR 54 2.466 5.954 -1.994
431 HB2 TYR 54 HB2 TYR 54 7.829 9.153 0.328
432 HB3 TYR 54 HB3 TYR 54 8.171 7.463 0.617
433 H CYS 55 HN CYS 55 8.671 6.567 3.320
434 HA CYS 55 HA CYS 55 11.016 7.685 4.521
435 HG CYS 55 HG CYS 55 8.484 5.042 4.304
436 HB2 CYS 55 HB2 CYS 55 10.789 4.941 3.198
437 HB3 CYS 55 HB3 CYS 55 11.774 5.397 4.581
438 H ILE 56 HN ILE 56 13.252 7.515 3.621
439 HA ILE 56 HA ILE 56 13.414 7.215 0.649
440 HB ILE 56 HB ILE 56 15.236 8.795 2.495
441 HG12 ILE 56 HG12 ILE 56 13.461 10.066 0.377
442 HG13 ILE 56 HG13 ILE 56 12.863 9.814 2.017
443 HG21 ILE 56 HG21 ILE 56 15.242 8.480 -0.543
444 HG22 ILE 56 HG22 ILE 56 16.182 9.715 0.302
445 HG23 ILE 56 HG23 ILE 56 16.547 8.034 0.569
446 HD11 ILE 56 HD11 ILE 56 14.741 11.064 2.960
447 HD12 ILE 56 HD12 ILE 56 15.337 11.438 1.330
448 HD13 ILE 56 HD13 ILE 56 13.776 12.048 1.866
449 H ASN 57 HN ASN 57 15.093 6.040 -0.118
450 HA ASN 57 HA ASN 57 16.861 4.741 -0.358
451 HB2 ASN 57 HB2 ASN 57 18.028 6.400 1.119
452 HB3 ASN 57 HB3 ASN 57 17.651 5.401 2.525
453 HD21 ASN 57 HD21 ASN 57 19.047 5.249 -0.743
454 HD22 ASN 57 HD22 ASN 57 20.305 4.058 -0.381
455 H ARG 58 HN ARG 58 16.205 4.027 3.052
456 HA ARG 58 HA ARG 58 15.062 1.454 2.572
457 HE ARG 58 HE ARG 58 20.242 -0.475 0.649
458 HB2 ARG 58 HB2 ARG 58 17.873 1.605 3.794
459 HB3 ARG 58 HB3 ARG 58 16.838 0.183 3.841
460 HG2 ARG 58 HG2 ARG 58 16.896 0.094 1.332
461 HG3 ARG 58 HG3 ARG 58 18.125 1.380 1.375
462 HD2 ARG 58 HD2 ARG 58 19.570 -0.025 2.793
463 HD3 ARG 58 HD3 ARG 58 18.383 -1.330 2.743
464 HH11 ARG 58 HH11 ARG 58 17.331 -2.403 1.312
465 HH12 ARG 58 HH12 ARG 58 17.479 -3.372 -0.106
466 HH21 ARG 58 HH21 ARG 58 20.437 -1.764 -1.239
467 HH22 ARG 58 HH22 ARG 58 19.287 -2.998 -1.585
468 H GLU 59 HN GLU 59 15.180 4.282 4.385
469 HA GLU 59 HA GLU 59 14.509 2.875 6.898
470 HB2 GLU 59 HB2 GLU 59 16.046 4.167 8.201
471 HB3 GLU 59 HB3 GLU 59 16.922 3.269 6.965
472 HG2 GLU 59 HG2 GLU 59 17.004 5.406 5.582
473 HG3 GLU 59 HG3 GLU 59 16.308 6.258 6.968
474 H LYS 60 HN LYS 60 13.197 3.916 8.251
475 HA LYS 60 HA LYS 60 11.322 5.658 7.031
476 HB2 LYS 60 HB2 LYS 60 11.606 4.879 9.964
477 HB3 LYS 60 HB3 LYS 60 10.186 5.631 9.232
478 HG2 LYS 60 HG2 LYS 60 9.971 3.648 7.698
479 HG3 LYS 60 HG3 LYS 60 11.277 2.856 8.580
480 HD2 LYS 60 HD2 LYS 60 8.620 3.766 9.772
481 HD3 LYS 60 HD3 LYS 60 9.025 2.112 9.290
482 HE2 LYS 60 HE2 LYS 60 10.892 2.090 10.944
483 HE3 LYS 60 HE3 LYS 60 10.448 3.723 11.459
484 HZ1 LYS 60 HZ1 LYS 60 9.507 2.052 12.917
485 HZ2 LYS 60 HZ2 LYS 60 8.298 2.842 12.166
486 HZ3 LYS 60 HZ3 LYS 60 8.713 1.333 11.692
487 H LEU 61 HN LEU 61 14.095 6.382 9.056
488 HA LEU 61 HA LEU 61 13.129 8.770 10.211
489 HG LEU 61 HG LEU 61 15.189 6.233 10.846
490 HB2 LEU 61 HB2 LEU 61 16.028 8.102 9.520
491 HB3 LEU 61 HB3 LEU 61 15.474 9.265 10.719
492 HD11 LEU 61 HD11 LEU 61 16.815 8.190 12.516
493 HD12 LEU 61 HD12 LEU 61 16.742 6.424 12.731
494 HD13 LEU 61 HD13 LEU 61 17.445 7.109 11.254
495 HD21 LEU 61 HD21 LEU 61 14.208 8.348 12.807
496 HD22 LEU 61 HD22 LEU 61 13.215 7.198 11.880
497 HD23 LEU 61 HD23 LEU 61 14.296 6.601 13.143
498 H HIS 62 HN HIS 62 14.821 8.157 7.178
499 HA HIS 62 HA HIS 62 15.090 11.022 6.546
500 HD1 HIS 62 HD1 HIS 62 18.550 8.366 4.582
501 HD2 HIS 62 HD2 HIS 62 17.006 10.329 7.972
502 HE1 HIS 62 HE1 HIS 62 20.453 8.503 6.263
503 HB2 HIS 62 HB2 HIS 62 15.729 8.524 4.920
504 HB3 HIS 62 HB3 HIS 62 16.141 10.181 4.482
505 H THR 63 HN THR 63 13.278 12.091 5.662
506 HA THR 63 HA THR 63 11.325 10.460 4.157
507 HB THR 63 HB THR 63 9.695 12.038 5.264
508 HG1 THR 63 HG1 THR 63 10.441 13.188 7.039
509 HG21 THR 63 HG21 THR 63 11.369 10.408 7.220
510 HG22 THR 63 HG22 THR 63 9.639 10.796 7.340
511 HG23 THR 63 HG23 THR 63 10.216 9.698 6.071
512 H VAL 64 HN VAL 64 10.126 11.364 2.576
513 HA VAL 64 HA VAL 64 10.729 14.119 1.600
514 HB VAL 64 HB VAL 64 9.696 13.102 -0.574
515 HG11 VAL 64 HG11 VAL 64 12.591 12.609 0.148
516 HG12 VAL 64 HG12 VAL 64 11.915 12.675 -1.492
517 HG13 VAL 64 HG13 VAL 64 11.860 14.112 -0.458
518 HG21 VAL 64 HG21 VAL 64 9.248 10.843 0.304
519 HG22 VAL 64 HG22 VAL 64 10.268 10.842 -1.141
520 HG23 VAL 64 HG23 VAL 64 10.993 10.556 0.454
521 H LYS 65 HN LYS 65 8.827 15.236 0.992
522 HA LYS 65 HA LYS 65 6.306 14.172 2.180
523 HB2 LYS 65 HB2 LYS 65 7.519 15.997 3.427
524 HB3 LYS 65 HB3 LYS 65 7.291 17.069 2.052
525 HG2 LYS 65 HG2 LYS 65 4.970 15.709 3.477
526 HG3 LYS 65 HG3 LYS 65 5.667 17.204 4.078
527 HD2 LYS 65 HD2 LYS 65 4.958 18.487 2.244
528 HD3 LYS 65 HD3 LYS 65 4.726 17.083 1.210
529 HE2 LYS 65 HE2 LYS 65 2.898 16.313 2.810
530 HE3 LYS 65 HE3 LYS 65 3.003 17.906 3.572
531 HZ1 LYS 65 HZ1 LYS 65 1.281 17.799 1.848
532 HZ2 LYS 65 HZ2 LYS 65 2.419 18.889 1.433
533 HZ3 LYS 65 HZ3 LYS 65 2.393 17.412 0.704
534 H VAL 66 HN VAL 66 4.614 13.985 0.675
535 HA VAL 66 HA VAL 66 5.402 14.546 -2.077
536 HB VAL 66 HB VAL 66 2.762 13.425 -1.060
537 HG11 VAL 66 HG11 VAL 66 4.118 13.300 -3.806
538 HG12 VAL 66 HG12 VAL 66 2.651 12.410 -3.346
539 HG13 VAL 66 HG13 VAL 66 2.622 14.170 -3.415
540 HG21 VAL 66 HG21 VAL 66 3.749 11.201 -1.611
541 HG22 VAL 66 HG22 VAL 66 5.316 11.976 -1.911
542 HG23 VAL 66 HG23 VAL 66 4.607 11.982 -0.283
543 H LEU 67 HN LEU 67 4.562 16.027 -3.495
544 HA LEU 67 HA LEU 67 2.732 18.117 -2.382
545 HG LEU 67 HG LEU 67 5.819 18.149 -2.082
546 HB2 LEU 67 HB2 LEU 67 4.942 18.356 -4.460
547 HB3 LEU 67 HB3 LEU 67 3.898 19.659 -3.917
548 HD11 LEU 67 HD11 LEU 67 6.154 20.698 -3.671
549 HD12 LEU 67 HD12 LEU 67 7.183 20.287 -2.276
550 HD13 LEU 67 HD13 LEU 67 7.164 19.248 -3.695
551 HD21 LEU 67 HD21 LEU 67 5.499 20.062 -0.561
552 HD22 LEU 67 HD22 LEU 67 4.323 20.779 -1.688
553 HD23 LEU 67 HD23 LEU 67 3.968 19.242 -0.867
554 H SER 68 HN SER 68 3.742 16.320 -5.347
555 HA SER 68 HA SER 68 0.997 16.225 -6.352
556 HG SER 68 HG SER 68 1.872 19.431 -7.866
557 HB2 SER 68 HB2 SER 68 3.208 17.573 -7.983
558 HB3 SER 68 HB3 SER 68 1.551 17.265 -8.508
559 H ALA 69 HN ALA 69 0.936 14.670 -8.253
560 HA ALA 69 HA ALA 69 3.408 13.556 -9.193
561 HB1 ALA 69 HB1 ALA 69 3.178 12.180 -7.150
562 HB2 ALA 69 HB2 ALA 69 1.508 11.753 -7.610
563 HB3 ALA 69 HB3 ALA 69 2.883 11.191 -8.587
564 H SER 70 HN SER 70 3.055 12.089 -10.998
565 HA SER 70 HA SER 70 0.360 11.700 -12.052
566 HG SER 70 HG SER 70 2.359 14.720 -13.873
567 HB2 SER 70 HB2 SER 70 1.062 12.838 -14.261
568 HB3 SER 70 HB3 SER 70 0.534 13.864 -12.926
569 H SER 71 HN SER 71 0.332 10.086 -13.714
570 HA SER 71 HA SER 71 2.367 8.175 -13.908
571 HG SER 71 HG SER 71 -1.014 7.440 -14.938
572 HB2 SER 71 HB2 SER 71 0.344 8.921 -16.056
573 HB3 SER 71 HB3 SER 71 1.116 7.344 -15.807
574 H TYR 72 HN TYR 72 4.034 7.796 -15.527
575 HA TYR 72 HA TYR 72 5.429 10.200 -16.056
576 HD1 TYR 72 HD2 TYR 72 8.153 10.308 -16.318
577 HD2 TYR 72 HD1 TYR 72 6.791 7.360 -19.162
578 HE1 TYR 72 HE2 TYR 72 9.865 11.072 -17.917
579 HE2 TYR 72 HE1 TYR 72 8.503 8.128 -20.777
580 HH TYR 72 HH TYR 72 10.839 10.750 -20.019
581 HB2 TYR 72 HB2 TYR 72 6.699 8.237 -15.657
582 HB3 TYR 72 HB3 TYR 72 5.896 7.357 -16.963
583 H SER 73 HN SER 73 5.646 11.483 -17.745
584 HA SER 73 HA SER 73 5.112 10.593 -20.445
585 HG SER 73 HG SER 73 2.086 12.414 -19.219
586 HB2 SER 73 HB2 SER 73 3.967 13.202 -19.384
587 HB3 SER 73 HB3 SER 73 3.795 12.585 -21.027
588 HA PRO 74 HA PRO 74 9.022 12.667 -20.430
589 HB2 PRO 74 HB2 PRO 74 9.181 13.609 -23.080
590 HB3 PRO 74 HB3 PRO 74 9.625 11.967 -22.509
591 HG2 PRO 74 HG2 PRO 74 7.084 12.914 -23.823
592 HG3 PRO 74 HG3 PRO 74 7.946 11.362 -24.050
593 HD2 PRO 74 HD2 PRO 74 5.714 11.574 -22.501
594 HD3 PRO 74 HD3 PRO 74 7.056 10.474 -22.055
595 H ASP 75 HN ASP 75 6.518 14.518 -22.208
596 HA ASP 75 HA ASP 75 7.612 17.090 -21.804
597 HB2 ASP 75 HB2 ASP 75 5.870 16.684 -23.446
598 HB3 ASP 75 HB3 ASP 75 4.744 16.140 -22.200
599 H GLU 76 HN GLU 76 5.174 15.311 -19.848
600 HA GLU 76 HA GLU 76 4.813 17.425 -17.962
601 HB2 GLU 76 HB2 GLU 76 4.271 14.444 -17.638
602 HB3 GLU 76 HB3 GLU 76 3.707 15.716 -16.555
603 HG2 GLU 76 HG2 GLU 76 2.433 16.763 -18.404
604 HG3 GLU 76 HG3 GLU 76 2.955 15.484 -19.501
605 H TRP 77 HN TRP 77 7.105 14.712 -18.135
606 HA TRP 77 HA TRP 77 8.192 14.947 -15.497
607 HD1 TRP 77 HD1 TRP 77 10.468 13.950 -14.501
608 HE1 TRP 77 HE1 TRP 77 12.996 13.638 -14.512
609 HE3 TRP 77 HE3 TRP 77 11.163 13.330 -19.530
610 HZ2 TRP 77 HZ2 TRP 77 15.101 13.295 -16.483
611 HZ3 TRP 77 HZ3 TRP 77 13.444 13.045 -20.453
612 HH2 TRP 77 HH2 TRP 77 15.422 13.057 -18.946
613 HB2 TRP 77 HB2 TRP 77 8.639 12.971 -16.757
614 HB3 TRP 77 HB3 TRP 77 9.183 13.872 -18.149
615 H GLU 78 HN GLU 78 9.293 16.338 -18.684
616 HA GLU 78 HA GLU 78 11.391 17.724 -17.339
617 HB2 GLU 78 HB2 GLU 78 10.241 18.032 -20.137
618 HB3 GLU 78 HB3 GLU 78 11.671 18.908 -19.555
619 HG2 GLU 78 HG2 GLU 78 12.743 16.708 -18.969
620 HG3 GLU 78 HG3 GLU 78 11.388 15.875 -19.710
621 H ARG 79 HN ARG 79 8.146 18.767 -18.251
622 HA ARG 79 HA ARG 79 8.335 21.501 -17.519
623 HE ARG 79 HE ARG 79 3.824 21.556 -17.927
624 HB2 ARG 79 HB2 ARG 79 6.216 19.361 -17.422
625 HB3 ARG 79 HB3 ARG 79 5.861 20.963 -16.750
626 HG2 ARG 79 HG2 ARG 79 6.162 22.063 -18.854
627 HG3 ARG 79 HG3 ARG 79 6.957 20.656 -19.568
628 HD2 ARG 79 HD2 ARG 79 4.717 20.839 -20.453
629 HD3 ARG 79 HD3 ARG 79 4.887 19.371 -19.478
630 HH11 ARG 79 HH11 ARG 79 2.934 19.156 -20.407
631 HH12 ARG 79 HH12 ARG 79 1.267 19.091 -19.932
632 HH21 ARG 79 HH21 ARG 79 1.603 21.448 -17.293
633 HH22 ARG 79 HH22 ARG 79 0.500 20.426 -18.130
634 H GLN 80 HN GLN 80 7.601 18.620 -15.406
635 HA GLN 80 HA GLN 80 7.518 20.214 -13.045
636 HB2 GLN 80 HB2 GLN 80 7.943 17.235 -13.479
637 HB3 GLN 80 HB3 GLN 80 7.839 17.988 -11.875
638 HG2 GLN 80 HG2 GLN 80 5.617 18.803 -12.271
639 HG3 GLN 80 HG3 GLN 80 5.663 18.344 -13.965
640 HE21 GLN 80 HE22 GLN 80 5.346 16.167 -14.570
641 HE22 GLN 80 HE21 GLN 80 4.620 15.011 -13.446
642 H CYS 81 HN CYS 81 10.254 18.646 -14.764
643 HA CYS 81 HA CYS 81 12.164 18.915 -12.691
644 HG CYS 81 HG CYS 81 11.279 16.838 -14.917
645 HB2 CYS 81 HB2 CYS 81 12.584 19.008 -15.714
646 HB3 CYS 81 HB3 CYS 81 13.865 18.867 -14.507
647 H LYS 82 HN LYS 82 11.183 21.332 -15.237
648 HA LYS 82 HA LYS 82 13.109 23.213 -14.204
649 HB2 LYS 82 HB2 LYS 82 11.877 24.926 -15.538
650 HB3 LYS 82 HB3 LYS 82 12.625 23.594 -16.433
651 HG2 LYS 82 HG2 LYS 82 10.462 22.557 -16.821
652 HG3 LYS 82 HG3 LYS 82 9.680 23.745 -15.779
653 HD2 LYS 82 HD2 LYS 82 9.223 24.278 -18.067
654 HD3 LYS 82 HD3 LYS 82 10.205 25.540 -17.328
655 HE2 LYS 82 HE2 LYS 82 12.248 24.461 -18.404
656 HE3 LYS 82 HE3 LYS 82 11.156 23.335 -19.221
657 HZ1 LYS 82 HZ1 LYS 82 11.687 25.207 -20.644
658 HZ2 LYS 82 HZ2 LYS 82 10.102 25.278 -20.279
659 HZ3 LYS 82 HZ3 LYS 82 11.161 26.289 -19.529
660 H VAL 83 HN VAL 83 9.548 22.770 -13.869
661 HA VAL 83 HA VAL 83 9.249 25.060 -12.315
662 HB VAL 83 HB VAL 83 7.499 22.625 -12.737
663 HG11 VAL 83 HG11 VAL 83 5.575 23.990 -11.903
664 HG12 VAL 83 HG12 VAL 83 6.682 23.494 -10.628
665 HG13 VAL 83 HG13 VAL 83 6.735 25.167 -11.241
666 HG21 VAL 83 HG21 VAL 83 7.400 25.529 -13.711
667 HG22 VAL 83 HG22 VAL 83 7.922 24.147 -14.672
668 HG23 VAL 83 HG23 VAL 83 6.244 24.249 -14.155
669 H ALA 84 HN ALA 84 10.589 22.065 -11.262
670 HA ALA 84 HA ALA 84 10.298 21.963 -8.542
671 HB1 ALA 84 HB1 ALA 84 12.616 21.163 -8.504
672 HB2 ALA 84 HB2 ALA 84 11.818 20.564 -9.974
673 HB3 ALA 84 HB3 ALA 84 12.945 21.929 -10.067
674 H GLY 85 HN GLY 85 12.157 24.452 -10.361
675 HA2 GLY 85 HA2 GLY 85 11.730 26.432 -8.350
676 HA3 GLY 85 HA3 GLY 85 13.353 25.752 -8.159
677 H LYS 86 HN LYS 86 12.037 25.920 -11.413
678 HA LYS 86 HA LYS 86 13.296 28.454 -12.090
679 HB2 LYS 86 HB2 LYS 86 15.010 26.318 -11.973
680 HB3 LYS 86 HB3 LYS 86 14.333 26.009 -13.554
681 HG2 LYS 86 HG2 LYS 86 16.355 27.226 -13.848
682 HG3 LYS 86 HG3 LYS 86 15.068 28.373 -14.217
683 HD2 LYS 86 HD2 LYS 86 15.293 29.337 -11.917
684 HD3 LYS 86 HD3 LYS 86 16.597 28.202 -11.570
685 HE2 LYS 86 HE2 LYS 86 16.623 30.286 -13.806
686 HE3 LYS 86 HE3 LYS 86 17.334 30.522 -12.210
687 HZ1 LYS 86 HZ1 LYS 86 18.208 28.467 -14.156
688 HZ2 LYS 86 HZ2 LYS 86 18.998 29.841 -13.793
689 HZ3 LYS 86 HZ3 LYS 86 18.845 28.682 -12.662
690 H THR 87 HN THR 87 13.388 28.276 -14.773
691 HA THR 87 HA THR 87 10.720 27.392 -15.723
692 HB THR 87 HB THR 87 10.780 29.661 -16.950
693 HG1 THR 87 HG1 THR 87 12.110 31.209 -16.073
694 HG21 THR 87 HG21 THR 87 9.830 30.885 -15.074
695 HG22 THR 87 HG22 THR 87 9.300 29.198 -14.989
696 HG23 THR 87 HG23 THR 87 10.581 29.781 -13.903
697 H GLN 88 HN GLN 88 13.937 26.805 -16.114
698 HA GLN 88 HA GLN 88 13.752 26.218 -18.981
699 HB2 GLN 88 HB2 GLN 88 15.984 27.878 -17.710
700 HB3 GLN 88 HB3 GLN 88 16.041 27.149 -19.315
701 HG2 GLN 88 HG2 GLN 88 14.064 28.533 -19.991
702 HG3 GLN 88 HG3 GLN 88 14.106 29.328 -18.413
703 HE21 GLN 88 HE22 GLN 88 15.783 28.988 -21.532
704 HE22 GLN 88 HE21 GLN 88 16.862 30.341 -21.312
Start of MODEL 3
1 HA MET 1 HA MET 1 3.703 -1.946 -2.466
2 H1 MET 1 H1 MET 1 2.438 -0.847 -0.060
3 H2 MET 1 H2 MET 1 1.934 -2.189 -0.865
4 H3 MET 1 H3 MET 1 3.398 -2.166 -0.126
5 HB2 MET 1 HB2 MET 1 1.478 -0.933 -2.932
6 HB3 MET 1 HB3 MET 1 2.013 0.581 -2.193
7 HG2 MET 1 HG2 MET 1 2.127 0.665 -4.635
8 HG3 MET 1 HG3 MET 1 3.723 0.857 -3.921
9 HE1 MET 1 HE1 MET 1 4.851 0.537 -6.228
10 HE2 MET 1 HE2 MET 1 4.556 -0.838 -7.316
11 HE3 MET 1 HE3 MET 1 3.262 0.340 -7.000
12 H GLU 2 HN GLU 2 5.614 -0.902 -3.149
13 HA GLU 2 HA GLU 2 6.702 1.325 -1.568
14 HB2 GLU 2 HB2 GLU 2 8.258 -1.250 -2.096
15 HB3 GLU 2 HB3 GLU 2 8.869 0.226 -1.339
16 HG2 GLU 2 HG2 GLU 2 7.140 -0.101 0.497
17 HG3 GLU 2 HG3 GLU 2 6.763 -1.672 -0.209
18 H TRP 3 HN TRP 3 8.488 2.365 -2.885
19 HA TRP 3 HA TRP 3 8.105 1.882 -5.787
20 HD1 TRP 3 HD1 TRP 3 6.057 3.875 -2.626
21 HE1 TRP 3 HE1 TRP 3 3.521 3.639 -2.880
22 HE3 TRP 3 HE3 TRP 3 5.797 3.507 -7.719
23 HZ2 TRP 3 HZ2 TRP 3 1.611 3.307 -5.039
24 HZ3 TRP 3 HZ3 TRP 3 3.611 3.227 -8.854
25 HH2 TRP 3 HH2 TRP 3 1.513 3.127 -7.523
26 HB2 TRP 3 HB2 TRP 3 7.968 4.537 -4.318
27 HB3 TRP 3 HB3 TRP 3 7.701 4.286 -6.022
28 H LEU 4 HN LEU 4 9.676 3.357 -6.989
29 HA LEU 4 HA LEU 4 12.370 3.346 -5.711
30 HG LEU 4 HG LEU 4 13.610 3.175 -8.796
31 HB2 LEU 4 HB2 LEU 4 12.061 1.315 -6.943
32 HB3 LEU 4 HB3 LEU 4 11.394 2.201 -8.327
33 HD11 LEU 4 HD11 LEU 4 15.612 2.135 -7.683
34 HD12 LEU 4 HD12 LEU 4 14.684 3.195 -6.627
35 HD13 LEU 4 HD13 LEU 4 14.528 1.431 -6.465
36 HD21 LEU 4 HD21 LEU 4 12.870 1.077 -9.870
37 HD22 LEU 4 HD22 LEU 4 14.624 1.084 -9.625
38 HD23 LEU 4 HD23 LEU 4 13.586 0.134 -8.543
39 H VAL 5 HN VAL 5 13.400 5.106 -6.041
40 HA VAL 5 HA VAL 5 12.562 7.289 -7.873
41 HB VAL 5 HB VAL 5 15.070 7.036 -6.169
42 HG11 VAL 5 HG11 VAL 5 13.693 9.429 -7.423
43 HG12 VAL 5 HG12 VAL 5 15.092 9.512 -6.327
44 HG13 VAL 5 HG13 VAL 5 15.258 8.741 -7.903
45 HG21 VAL 5 HG21 VAL 5 12.346 8.187 -5.453
46 HG22 VAL 5 HG22 VAL 5 13.232 6.911 -4.604
47 HG23 VAL 5 HG23 VAL 5 13.835 8.560 -4.549
48 H LYS 6 HN LYS 6 12.931 6.831 -9.913
49 HA LYS 6 HA LYS 6 15.335 5.377 -10.897
50 HB2 LYS 6 HB2 LYS 6 12.699 6.236 -12.108
51 HB3 LYS 6 HB3 LYS 6 14.026 5.707 -13.114
52 HG2 LYS 6 HG2 LYS 6 12.735 4.032 -10.930
53 HG3 LYS 6 HG3 LYS 6 12.386 3.929 -12.649
54 HD2 LYS 6 HD2 LYS 6 14.878 3.057 -11.195
55 HD3 LYS 6 HD3 LYS 6 13.767 2.121 -12.216
56 HE2 LYS 6 HE2 LYS 6 14.574 3.350 -14.221
57 HE3 LYS 6 HE3 LYS 6 15.696 4.267 -13.210
58 HZ1 LYS 6 HZ1 LYS 6 16.810 2.181 -12.656
59 HZ2 LYS 6 HZ2 LYS 6 15.773 1.326 -13.589
60 HZ3 LYS 6 HZ3 LYS 6 16.790 2.400 -14.268
61 H LYS 7 HN LYS 7 14.022 8.634 -10.649
62 HA LYS 7 HA LYS 7 16.414 9.774 -11.865
63 HB2 LYS 7 HB2 LYS 7 13.683 10.771 -12.770
64 HB3 LYS 7 HB3 LYS 7 15.253 11.460 -13.145
65 HG2 LYS 7 HG2 LYS 7 15.844 9.293 -14.347
66 HG3 LYS 7 HG3 LYS 7 14.147 8.806 -14.127
67 HD2 LYS 7 HD2 LYS 7 13.508 11.016 -15.249
68 HD3 LYS 7 HD3 LYS 7 15.219 11.219 -15.652
69 HE2 LYS 7 HE2 LYS 7 15.223 9.171 -16.964
70 HE3 LYS 7 HE3 LYS 7 13.590 8.762 -16.418
71 HZ1 LYS 7 HZ1 LYS 7 12.742 10.657 -17.621
72 HZ2 LYS 7 HZ2 LYS 7 14.241 11.114 -18.096
73 HZ3 LYS 7 HZ3 LYS 7 13.595 9.716 -18.645
74 H SER 8 HN SER 8 16.725 11.936 -10.898
75 HA SER 8 HA SER 8 14.778 12.909 -8.905
76 HG SER 8 HG SER 8 18.389 12.292 -8.790
77 HB2 SER 8 HB2 SER 8 16.788 12.986 -7.282
78 HB3 SER 8 HB3 SER 8 15.986 11.429 -7.527
79 H CYS 9 HN CYS 9 14.986 15.118 -8.662
80 HA CYS 9 HA CYS 9 17.116 16.526 -10.214
81 HG CYS 9 HG CYS 9 13.940 16.600 -12.621
82 HB2 CYS 9 HB2 CYS 9 14.113 17.025 -10.104
83 HB3 CYS 9 HB3 CYS 9 15.290 18.128 -10.838
84 H CYS 10 HN CYS 10 18.361 17.024 -8.480
85 HA CYS 10 HA CYS 10 17.563 17.905 -5.936
86 HG CYS 10 HG CYS 10 21.356 16.623 -6.311
87 HB2 CYS 10 HB2 CYS 10 20.089 18.599 -7.490
88 HB3 CYS 10 HB3 CYS 10 19.870 18.704 -5.736
89 H ASN 11 HN ASN 11 17.316 19.970 -5.017
90 HA ASN 11 HA ASN 11 17.766 22.412 -6.547
91 HB2 ASN 11 HB2 ASN 11 15.675 23.236 -6.738
92 HB3 ASN 11 HB3 ASN 11 15.276 21.546 -7.006
93 HD21 ASN 11 HD22 ASN 11 14.567 20.310 -4.980
94 HD22 ASN 11 HD21 ASN 11 13.648 21.171 -3.793
95 H LYS 12 HN LYS 12 17.809 24.231 -5.152
96 HA LYS 12 HA LYS 12 17.117 23.820 -2.327
97 HB2 LYS 12 HB2 LYS 12 19.221 24.817 -1.502
98 HB3 LYS 12 HB3 LYS 12 19.372 23.222 -2.201
99 HG2 LYS 12 HG2 LYS 12 21.266 24.538 -2.821
100 HG3 LYS 12 HG3 LYS 12 20.334 24.162 -4.271
101 HD2 LYS 12 HD2 LYS 12 19.425 26.412 -4.343
102 HD3 LYS 12 HD3 LYS 12 20.110 26.789 -2.746
103 HE2 LYS 12 HE2 LYS 12 22.407 26.425 -3.688
104 HE3 LYS 12 HE3 LYS 12 21.698 26.134 -5.279
105 HZ1 LYS 12 HZ1 LYS 12 22.484 28.406 -5.036
106 HZ2 LYS 12 HZ2 LYS 12 20.872 28.418 -5.254
107 HZ3 LYS 12 HZ3 LYS 12 21.505 28.678 -3.766
108 H GLN 13 HN GLN 13 16.514 25.586 -5.012
109 HA GLN 13 HA GLN 13 16.575 28.226 -3.720
110 HB2 GLN 13 HB2 GLN 13 15.353 27.370 -6.370
111 HB3 GLN 13 HB3 GLN 13 15.538 29.021 -5.773
112 HG2 GLN 13 HG2 GLN 13 18.072 28.518 -5.638
113 HG3 GLN 13 HG3 GLN 13 17.728 27.104 -6.642
114 HE21 GLN 13 HE22 GLN 13 16.155 27.788 -8.661
115 HE22 GLN 13 HE21 GLN 13 16.740 29.197 -9.523
116 H ASP 14 HN ASP 14 14.317 25.491 -4.170
117 HA ASP 14 HA ASP 14 12.216 27.153 -2.801
118 HB2 ASP 14 HB2 ASP 14 12.030 27.178 -5.311
119 HB3 ASP 14 HB3 ASP 14 11.770 25.430 -5.253
120 H ASN 15 HN ASN 15 13.817 24.193 -2.906
121 HA ASN 15 HA ASN 15 13.881 22.454 -1.572
122 HB2 ASN 15 HB2 ASN 15 12.792 24.106 0.166
123 HB3 ASN 15 HB3 ASN 15 11.365 23.102 -0.061
124 HD21 ASN 15 HD22 ASN 15 12.689 20.520 -0.337
125 HD22 ASN 15 HD21 ASN 15 13.437 20.145 1.216
126 H ARG 16 HN ARG 16 11.173 23.248 -3.463
127 HA ARG 16 HA ARG 16 9.789 20.698 -3.472
128 HE ARG 16 HE ARG 16 6.134 22.342 -6.219
129 HB2 ARG 16 HB2 ARG 16 9.798 23.060 -5.391
130 HB3 ARG 16 HB3 ARG 16 8.861 21.576 -5.643
131 HG2 ARG 16 HG2 ARG 16 7.681 21.927 -3.522
132 HG3 ARG 16 HG3 ARG 16 8.568 23.408 -3.224
133 HD2 ARG 16 HD2 ARG 16 6.132 23.490 -4.179
134 HD3 ARG 16 HD3 ARG 16 7.320 24.627 -4.761
135 HH11 ARG 16 HH11 ARG 16 8.557 25.009 -6.311
136 HH12 ARG 16 HH12 ARG 16 8.754 24.864 -8.045
137 HH21 ARG 16 HH21 ARG 16 6.545 22.190 -8.500
138 HH22 ARG 16 HH22 ARG 16 7.678 23.307 -9.229
139 H HIS 17 HN HIS 17 11.109 19.012 -3.879
140 HA HIS 17 HA HIS 17 12.978 18.895 -6.157
141 HD1 HIS 17 HD1 HIS 17 13.447 18.920 -2.287
142 HD2 HIS 17 HD2 HIS 17 15.562 17.096 -5.410
143 HE1 HIS 17 HE1 HIS 17 15.917 19.461 -1.883
144 HB2 HIS 17 HB2 HIS 17 12.121 17.039 -3.893
145 HB3 HIS 17 HB3 HIS 17 13.081 16.459 -5.251
146 H VAL 18 HN VAL 18 12.701 16.997 -7.645
147 HA VAL 18 HA VAL 18 10.024 15.859 -7.802
148 HB VAL 18 HB VAL 18 11.350 16.822 -10.356
149 HG11 VAL 18 HG11 VAL 18 8.430 16.148 -9.778
150 HG12 VAL 18 HG12 VAL 18 9.139 16.551 -11.359
151 HG13 VAL 18 HG13 VAL 18 9.603 15.060 -10.552
152 HG21 VAL 18 HG21 VAL 18 10.875 18.901 -9.120
153 HG22 VAL 18 HG22 VAL 18 9.794 18.734 -10.507
154 HG23 VAL 18 HG23 VAL 18 9.198 18.379 -8.879
155 H LEU 19 HN LEU 19 10.074 13.831 -8.617
156 HA LEU 19 HA LEU 19 12.634 12.701 -9.517
157 HG LEU 19 HG LEU 19 10.581 12.420 -6.222
158 HB2 LEU 19 HB2 LEU 19 11.673 10.733 -7.781
159 HB3 LEU 19 HB3 LEU 19 13.154 11.646 -7.660
160 HD11 LEU 19 HD11 LEU 19 11.640 11.432 -4.262
161 HD12 LEU 19 HD12 LEU 19 11.423 10.244 -5.553
162 HD13 LEU 19 HD13 LEU 19 13.036 10.926 -5.248
163 HD21 LEU 19 HD21 LEU 19 13.423 13.519 -6.288
164 HD22 LEU 19 HD22 LEU 19 11.881 14.392 -6.124
165 HD23 LEU 19 HD23 LEU 19 12.545 13.538 -4.746
166 H MET 20 HN MET 20 12.234 10.336 -10.153
167 HA MET 20 HA MET 20 9.504 10.101 -11.336
168 HB2 MET 20 HB2 MET 20 12.149 9.169 -12.435
169 HB3 MET 20 HB3 MET 20 10.680 8.218 -12.695
170 HG2 MET 20 HG2 MET 20 9.491 10.207 -13.516
171 HG3 MET 20 HG3 MET 20 10.959 11.169 -13.346
172 HE1 MET 20 HE1 MET 20 10.372 7.769 -16.466
173 HE2 MET 20 HE2 MET 20 10.817 7.387 -14.789
174 HE3 MET 20 HE3 MET 20 9.249 8.151 -15.141
175 H LEU 21 HN LEU 21 8.367 9.019 -10.086
176 HA LEU 21 HA LEU 21 9.505 7.222 -8.018
177 HG LEU 21 HG LEU 21 7.987 6.979 -6.087
178 HB2 LEU 21 HB2 LEU 21 8.204 9.229 -7.383
179 HB3 LEU 21 HB3 LEU 21 6.822 8.670 -8.323
180 HD11 LEU 21 HD11 LEU 21 7.536 9.265 -5.186
181 HD12 LEU 21 HD12 LEU 21 5.880 9.181 -5.810
182 HD13 LEU 21 HD13 LEU 21 6.409 8.067 -4.526
183 HD21 LEU 21 HD21 LEU 21 5.553 6.262 -5.937
184 HD22 LEU 21 HD22 LEU 21 5.211 7.262 -7.364
185 HD23 LEU 21 HD23 LEU 21 6.299 5.872 -7.491
186 H CYS 22 HN CYS 22 9.388 5.112 -8.598
187 HA CYS 22 HA CYS 22 7.428 4.258 -10.685
188 HG CYS 22 HG CYS 22 10.441 5.999 -10.757
189 HB2 CYS 22 HB2 CYS 22 10.364 3.501 -10.337
190 HB3 CYS 22 HB3 CYS 22 9.306 3.030 -11.668
191 H ASP 23 HN ASP 23 7.350 1.827 -10.832
192 HA ASP 23 HA ASP 23 6.680 0.466 -8.410
193 HB2 ASP 23 HB2 ASP 23 5.886 -0.518 -10.386
194 HB3 ASP 23 HB3 ASP 23 7.406 -0.268 -11.243
195 H ALA 24 HN ALA 24 7.935 -0.942 -7.093
196 HA ALA 24 HA ALA 24 10.756 -0.427 -6.828
197 HB1 ALA 24 HB1 ALA 24 9.400 -0.911 -4.875
198 HB2 ALA 24 HB2 ALA 24 8.957 -2.507 -5.528
199 HB3 ALA 24 HB3 ALA 24 10.640 -2.159 -5.070
200 H GLY 25 HN GLY 25 11.269 -0.875 -9.071
201 HA2 GLY 25 HA2 GLY 25 12.704 -3.059 -9.846
202 HA3 GLY 25 HA3 GLY 25 11.022 -3.568 -10.128
203 H GLY 26 HN GLY 26 10.461 -0.552 -10.613
204 HA2 GLY 26 HA2 GLY 26 10.548 1.020 -12.264
205 HA3 GLY 26 HA3 GLY 26 11.823 0.110 -13.089
206 H ALA 27 HN ALA 27 8.985 -1.835 -12.399
207 HA ALA 27 HA ALA 27 8.622 -2.295 -15.203
208 HB1 ALA 27 HB1 ALA 27 8.202 -3.992 -13.439
209 HB2 ALA 27 HB2 ALA 27 6.806 -3.043 -12.869
210 HB3 ALA 27 HB3 ALA 27 6.792 -3.762 -14.490
211 H ILE 28 HN ILE 28 7.253 0.081 -13.092
212 HA ILE 28 HA ILE 28 5.515 1.172 -15.194
213 HB ILE 28 HB ILE 28 4.649 0.695 -12.295
214 HG12 ILE 28 HG12 ILE 28 3.560 -0.513 -14.878
215 HG13 ILE 28 HG13 ILE 28 4.446 -1.367 -13.612
216 HG21 ILE 28 HG21 ILE 28 3.118 2.062 -14.561
217 HG22 ILE 28 HG22 ILE 28 2.517 1.781 -12.912
218 HG23 ILE 28 HG23 ILE 28 3.844 2.884 -13.159
219 HD11 ILE 28 HD11 ILE 28 1.647 -0.233 -13.393
220 HD12 ILE 28 HD12 ILE 28 2.162 -1.924 -13.343
221 HD13 ILE 28 HD13 ILE 28 2.590 -0.838 -12.004
222 H LYS 29 HN LYS 29 5.556 3.535 -14.962
223 HA LYS 29 HA LYS 29 7.372 4.578 -12.857
224 HB2 LYS 29 HB2 LYS 29 7.735 5.137 -15.832
225 HB3 LYS 29 HB3 LYS 29 8.624 5.868 -14.494
226 HG2 LYS 29 HG2 LYS 29 9.316 3.423 -13.872
227 HG3 LYS 29 HG3 LYS 29 8.747 2.997 -15.486
228 HD2 LYS 29 HD2 LYS 29 10.373 4.587 -16.479
229 HD3 LYS 29 HD3 LYS 29 10.853 5.116 -14.867
230 HE2 LYS 29 HE2 LYS 29 12.539 3.642 -15.719
231 HE3 LYS 29 HE3 LYS 29 11.768 2.883 -14.332
232 HZ1 LYS 29 HZ1 LYS 29 10.559 1.436 -15.826
233 HZ2 LYS 29 HZ2 LYS 29 11.073 2.255 -17.161
234 HZ3 LYS 29 HZ3 LYS 29 12.122 1.388 -16.272
235 H MET 30 HN MET 30 6.971 6.674 -12.241
236 HA MET 30 HA MET 30 4.836 8.240 -13.551
237 HB2 MET 30 HB2 MET 30 4.955 7.599 -10.564
238 HB3 MET 30 HB3 MET 30 3.879 8.734 -11.327
239 HG2 MET 30 HG2 MET 30 2.801 6.916 -12.596
240 HG3 MET 30 HG3 MET 30 3.917 5.751 -11.886
241 HE1 MET 30 HE1 MET 30 2.144 8.772 -9.862
242 HE2 MET 30 HE2 MET 30 1.021 8.306 -11.166
243 HE3 MET 30 HE3 MET 30 0.617 7.962 -9.469
244 H ILE 31 HN ILE 31 4.880 10.472 -12.384
245 HA ILE 31 HA ILE 31 7.677 11.337 -11.800
246 HB ILE 31 HB ILE 31 5.435 12.876 -13.107
247 HG12 ILE 31 HG12 ILE 31 8.082 12.329 -14.476
248 HG13 ILE 31 HG13 ILE 31 6.891 11.036 -14.473
249 HG21 ILE 31 HG21 ILE 31 7.230 14.617 -13.486
250 HG22 ILE 31 HG22 ILE 31 6.829 14.389 -11.786
251 HG23 ILE 31 HG23 ILE 31 8.315 13.672 -12.455
252 HD11 ILE 31 HD11 ILE 31 6.289 13.853 -15.399
253 HD12 ILE 31 HD12 ILE 31 6.640 12.466 -16.451
254 HD13 ILE 31 HD13 ILE 31 5.190 12.465 -15.422
255 H ALA 32 HN ALA 32 7.777 12.471 -9.767
256 HA ALA 32 HA ALA 32 5.207 13.175 -8.472
257 HB1 ALA 32 HB1 ALA 32 5.812 10.949 -7.589
258 HB2 ALA 32 HB2 ALA 32 7.432 11.558 -7.152
259 HB3 ALA 32 HB3 ALA 32 5.989 12.204 -6.344
260 H GLU 33 HN GLU 33 5.326 15.137 -7.620
261 HA GLU 33 HA GLU 33 7.939 16.527 -7.366
262 HB2 GLU 33 HB2 GLU 33 6.066 17.664 -8.642
263 HB3 GLU 33 HB3 GLU 33 5.067 17.574 -7.178
264 HG2 GLU 33 HG2 GLU 33 6.778 18.939 -5.976
265 HG3 GLU 33 HG3 GLU 33 7.689 19.093 -7.463
266 H VAL 34 HN VAL 34 8.614 17.064 -5.266
267 HA VAL 34 HA VAL 34 6.948 16.261 -2.976
268 HB VAL 34 HB VAL 34 8.619 14.752 -2.130
269 HG11 VAL 34 HG11 VAL 34 8.391 12.832 -3.525
270 HG12 VAL 34 HG12 VAL 34 6.903 13.763 -3.693
271 HG13 VAL 34 HG13 VAL 34 8.121 13.817 -4.977
272 HG21 VAL 34 HG21 VAL 34 10.530 13.959 -3.550
273 HG22 VAL 34 HG22 VAL 34 10.210 15.308 -4.660
274 HG23 VAL 34 HG23 VAL 34 10.686 15.611 -2.967
275 H LYS 35 HN LYS 35 8.199 16.785 -0.894
276 HA LYS 35 HA LYS 35 10.260 18.895 -1.273
277 HB2 LYS 35 HB2 LYS 35 7.997 19.833 -0.450
278 HB3 LYS 35 HB3 LYS 35 8.247 18.892 1.022
279 HG2 LYS 35 HG2 LYS 35 10.412 20.076 1.372
280 HG3 LYS 35 HG3 LYS 35 10.146 21.014 -0.109
281 HD2 LYS 35 HD2 LYS 35 8.353 21.070 2.362
282 HD3 LYS 35 HD3 LYS 35 9.619 22.249 1.994
283 HE2 LYS 35 HE2 LYS 35 8.446 22.845 -0.129
284 HE3 LYS 35 HE3 LYS 35 7.153 21.707 0.276
285 HZ1 LYS 35 HZ1 LYS 35 6.571 23.958 0.911
286 HZ2 LYS 35 HZ2 LYS 35 6.688 23.043 2.252
287 HZ3 LYS 35 HZ3 LYS 35 7.876 24.098 1.872
288 H SER 36 HN SER 36 12.037 18.484 0.051
289 HA SER 36 HA SER 36 11.961 15.889 1.540
290 HG SER 36 HG SER 36 13.410 15.590 -1.844
291 HB2 SER 36 HB2 SER 36 14.280 16.812 -0.161
292 HB3 SER 36 HB3 SER 36 13.871 15.176 0.402
293 H ASP 37 HN ASP 37 13.056 15.796 3.459
294 HA ASP 37 HA ASP 37 14.386 18.295 4.388
295 HB2 ASP 37 HB2 ASP 37 12.502 17.321 5.703
296 HB3 ASP 37 HB3 ASP 37 13.469 15.870 5.967
297 H PHE 38 HN PHE 38 15.230 15.489 2.873
298 HA PHE 38 HA PHE 38 18.026 15.524 3.793
299 HD1 PHE 38 HD2 PHE 38 14.679 13.790 5.176
300 HD2 PHE 38 HD1 PHE 38 18.860 13.211 6.073
301 HE1 PHE 38 HE2 PHE 38 14.149 13.724 7.597
302 HE2 PHE 38 HE1 PHE 38 18.323 13.132 8.496
303 HZ PHE 38 HZ PHE 38 15.969 13.393 9.261
304 HB2 PHE 38 HB2 PHE 38 16.361 12.992 3.446
305 HB3 PHE 38 HB3 PHE 38 18.073 13.053 3.800
306 H ALA 39 HN ALA 39 19.384 14.466 2.075
307 HA ALA 39 HA ALA 39 18.581 15.082 -0.595
308 HB1 ALA 39 HB1 ALA 39 20.950 15.021 0.110
309 HB2 ALA 39 HB2 ALA 39 20.817 13.274 0.431
310 HB3 ALA 39 HB3 ALA 39 20.656 13.892 -1.225
311 H VAL 40 HN VAL 40 18.045 13.640 -2.303
312 HA VAL 40 HA VAL 40 17.550 10.811 -1.784
313 HB VAL 40 HB VAL 40 15.427 11.689 -1.114
314 HG11 VAL 40 HG11 VAL 40 13.975 13.108 -2.494
315 HG12 VAL 40 HG12 VAL 40 15.450 13.959 -2.032
316 HG13 VAL 40 HG13 VAL 40 15.277 13.316 -3.682
317 HG21 VAL 40 HG21 VAL 40 13.910 10.650 -2.675
318 HG22 VAL 40 HG22 VAL 40 15.095 10.773 -3.991
319 HG23 VAL 40 HG23 VAL 40 15.402 9.698 -2.617
320 H LYS 41 HN LYS 41 17.893 9.643 -3.707
321 HA LYS 41 HA LYS 41 18.368 11.125 -6.194
322 HB2 LYS 41 HB2 LYS 41 20.714 10.272 -6.378
323 HB3 LYS 41 HB3 LYS 41 20.436 11.574 -5.249
324 HG2 LYS 41 HG2 LYS 41 22.029 10.013 -4.330
325 HG3 LYS 41 HG3 LYS 41 20.572 10.032 -3.333
326 HD2 LYS 41 HD2 LYS 41 19.804 7.955 -4.400
327 HD3 LYS 41 HD3 LYS 41 21.234 7.950 -5.456
328 HE2 LYS 41 HE2 LYS 41 22.695 7.567 -3.576
329 HE3 LYS 41 HE3 LYS 41 21.387 7.893 -2.421
330 HZ1 LYS 41 HZ1 LYS 41 21.779 5.514 -2.723
331 HZ2 LYS 41 HZ2 LYS 41 20.247 5.953 -3.148
332 HZ3 LYS 41 HZ3 LYS 41 21.372 5.618 -4.308
333 H VAL 42 HN VAL 42 19.182 9.545 -7.930
334 HA VAL 42 HA VAL 42 17.275 7.586 -8.316
335 HB VAL 42 HB VAL 42 20.060 7.787 -9.546
336 HG11 VAL 42 HG11 VAL 42 18.869 6.677 -11.532
337 HG12 VAL 42 HG12 VAL 42 19.167 5.623 -10.154
338 HG13 VAL 42 HG13 VAL 42 17.544 6.293 -10.403
339 HG21 VAL 42 HG21 VAL 42 17.390 9.085 -10.079
340 HG22 VAL 42 HG22 VAL 42 18.982 9.854 -9.921
341 HG23 VAL 42 HG23 VAL 42 18.610 8.943 -11.381
342 H GLY 43 HN GLY 43 17.178 5.371 -8.286
343 HA2 GLY 43 HA2 GLY 43 17.592 3.236 -7.613
344 HA3 GLY 43 HA3 GLY 43 19.259 3.673 -7.182
345 H ASP 44 HN ASP 44 16.253 5.323 -6.016
346 HA ASP 44 HA ASP 44 17.070 4.401 -3.229
347 HB2 ASP 44 HB2 ASP 44 15.877 7.069 -4.033
348 HB3 ASP 44 HB3 ASP 44 15.656 6.376 -2.438
349 H LEU 45 HN LEU 45 15.464 3.559 -1.865
350 HA LEU 45 HA LEU 45 12.950 2.821 -3.200
351 HG LEU 45 HG LEU 45 11.341 1.830 -1.141
352 HB2 LEU 45 HB2 LEU 45 14.342 1.397 -1.485
353 HB3 LEU 45 HB3 LEU 45 13.718 2.516 -0.277
354 HD11 LEU 45 HD11 LEU 45 12.120 0.660 -3.202
355 HD12 LEU 45 HD12 LEU 45 12.972 -0.524 -2.193
356 HD13 LEU 45 HD13 LEU 45 11.200 -0.403 -2.132
357 HD21 LEU 45 HD21 LEU 45 11.378 -0.168 0.327
358 HD22 LEU 45 HD22 LEU 45 13.155 -0.080 0.378
359 HD23 LEU 45 HD23 LEU 45 12.157 1.245 1.040
360 H LEU 46 HN LEU 46 10.896 3.559 -2.448
361 HA LEU 46 HA LEU 46 10.782 5.644 -0.341
362 HG LEU 46 HG LEU 46 11.348 6.643 -3.313
363 HB2 LEU 46 HB2 LEU 46 9.168 5.679 -2.931
364 HB3 LEU 46 HB3 LEU 46 8.906 6.734 -1.552
365 HD11 LEU 46 HD11 LEU 46 9.038 8.638 -3.126
366 HD12 LEU 46 HD12 LEU 46 10.522 8.970 -4.024
367 HD13 LEU 46 HD13 LEU 46 9.489 7.625 -4.516
368 HD21 LEU 46 HD21 LEU 46 10.609 8.488 -0.996
369 HD22 LEU 46 HD22 LEU 46 11.985 7.394 -1.069
370 HD23 LEU 46 HD23 LEU 46 11.959 8.813 -2.124
371 H SER 47 HN SER 47 9.491 4.856 1.197
372 HA SER 47 HA SER 47 7.185 3.135 0.401
373 HG SER 47 HG SER 47 9.287 0.647 1.497
374 HB2 SER 47 HB2 SER 47 8.845 2.624 2.889
375 HB3 SER 47 HB3 SER 47 7.535 1.643 2.224
376 HA PRO 48 HA PRO 48 5.087 6.304 2.475
377 HB2 PRO 48 HB2 PRO 48 2.658 5.173 3.117
378 HB3 PRO 48 HB3 PRO 48 3.160 5.583 1.452
379 HG2 PRO 48 HG2 PRO 48 3.314 2.892 2.837
380 HG3 PRO 48 HG3 PRO 48 2.699 3.260 1.193
381 HD2 PRO 48 HD2 PRO 48 5.225 2.328 1.611
382 HD3 PRO 48 HD3 PRO 48 4.883 3.544 0.342
383 H LEU 49 HN LEU 49 4.578 7.150 4.442
384 HA LEU 49 HA LEU 49 4.931 5.471 6.908
385 HG LEU 49 HG LEU 49 7.369 6.774 5.372
386 HB2 LEU 49 HB2 LEU 49 5.743 8.368 6.415
387 HB3 LEU 49 HB3 LEU 49 5.896 7.510 7.943
388 HD11 LEU 49 HD11 LEU 49 8.094 8.932 6.257
389 HD12 LEU 49 HD12 LEU 49 8.327 8.226 7.870
390 HD13 LEU 49 HD13 LEU 49 9.350 7.709 6.511
391 HD21 LEU 49 HD21 LEU 49 8.738 5.326 6.824
392 HD22 LEU 49 HD22 LEU 49 7.708 5.727 8.220
393 HD23 LEU 49 HD23 LEU 49 7.055 4.816 6.840
394 H GLN 50 HN GLN 50 3.340 8.188 5.298
395 HA GLN 50 HA GLN 50 0.844 7.597 6.533
396 HB2 GLN 50 HB2 GLN 50 0.368 9.894 7.393
397 HB3 GLN 50 HB3 GLN 50 1.505 8.970 8.352
398 HG2 GLN 50 HG2 GLN 50 3.390 10.241 7.500
399 HG3 GLN 50 HG3 GLN 50 2.344 11.103 6.358
400 HE21 GLN 50 HE22 GLN 50 2.690 13.224 7.186
401 HE22 GLN 50 HE21 GLN 50 2.203 13.695 8.791
402 H ASN 51 HN ASN 51 -0.501 9.930 5.596
403 HA ASN 51 HA ASN 51 -1.074 9.105 3.080
404 HB2 ASN 51 HB2 ASN 51 -2.526 10.604 4.331
405 HB3 ASN 51 HB3 ASN 51 -1.361 11.925 4.193
406 HD21 ASN 51 HD22 ASN 51 -1.379 13.209 2.281
407 HD22 ASN 51 HD21 ASN 51 -2.438 12.887 0.937
408 H ALA 52 HN ALA 52 1.327 11.719 3.739
409 HA ALA 52 HA ALA 52 2.103 11.603 0.914
410 HB1 ALA 52 HB1 ALA 52 0.895 13.673 1.418
411 HB2 ALA 52 HB2 ALA 52 1.990 14.004 2.784
412 HB3 ALA 52 HB3 ALA 52 2.604 14.019 1.121
413 H LEU 53 HN LEU 53 3.289 11.271 4.244
414 HA LEU 53 HA LEU 53 6.018 11.911 3.423
415 HG LEU 53 HG LEU 53 4.917 13.234 5.822
416 HB2 LEU 53 HB2 LEU 53 4.937 10.695 5.972
417 HB3 LEU 53 HB3 LEU 53 6.650 10.745 5.607
418 HD11 LEU 53 HD11 LEU 53 6.925 12.041 7.791
419 HD12 LEU 53 HD12 LEU 53 6.052 13.576 7.986
420 HD13 LEU 53 HD13 LEU 53 5.163 12.046 7.996
421 HD21 LEU 53 HD21 LEU 53 6.913 13.583 4.392
422 HD22 LEU 53 HD22 LEU 53 7.111 14.415 5.933
423 HD23 LEU 53 HD23 LEU 53 7.951 12.880 5.639
424 H TYR 54 HN TYR 54 7.497 10.526 2.730
425 HA TYR 54 HA TYR 54 7.035 7.610 2.961
426 HD1 TYR 54 HD1 TYR 54 5.461 9.876 0.668
427 HD2 TYR 54 HD2 TYR 54 6.892 5.934 -0.281
428 HE1 TYR 54 HE1 TYR 54 3.262 9.332 -0.304
429 HE2 TYR 54 HE2 TYR 54 4.707 5.385 -1.298
430 HH TYR 54 HH TYR 54 1.971 7.711 -1.369
431 HB2 TYR 54 HB2 TYR 54 8.056 9.164 0.542
432 HB3 TYR 54 HB3 TYR 54 8.348 7.454 0.776
433 H CYS 55 HN CYS 55 8.980 6.474 3.321
434 HA CYS 55 HA CYS 55 11.185 7.936 4.545
435 HG CYS 55 HG CYS 55 11.239 3.444 4.036
436 HB2 CYS 55 HB2 CYS 55 12.237 5.751 4.722
437 HB3 CYS 55 HB3 CYS 55 10.554 5.631 5.266
438 H ILE 56 HN ILE 56 13.451 7.734 3.641
439 HA ILE 56 HA ILE 56 13.525 7.470 0.658
440 HB ILE 56 HB ILE 56 15.386 9.006 2.505
441 HG12 ILE 56 HG12 ILE 56 13.624 10.263 0.370
442 HG13 ILE 56 HG13 ILE 56 13.025 10.021 2.012
443 HG21 ILE 56 HG21 ILE 56 15.417 8.696 -0.531
444 HG22 ILE 56 HG22 ILE 56 16.390 9.886 0.348
445 HG23 ILE 56 HG23 ILE 56 16.687 8.184 0.588
446 HD11 ILE 56 HD11 ILE 56 14.797 11.327 2.973
447 HD12 ILE 56 HD12 ILE 56 15.521 11.622 1.376
448 HD13 ILE 56 HD13 ILE 56 13.930 12.277 1.756
449 H ASN 57 HN ASN 57 15.029 6.171 -0.180
450 HA ASN 57 HA ASN 57 16.781 4.863 -0.541
451 HB2 ASN 57 HB2 ASN 57 18.081 6.426 0.952
452 HB3 ASN 57 HB3 ASN 57 17.737 5.355 2.319
453 HD21 ASN 57 HD21 ASN 57 19.055 5.410 -1.015
454 HD22 ASN 57 HD22 ASN 57 20.192 4.086 -0.770
455 H ARG 58 HN ARG 58 15.897 4.227 2.830
456 HA ARG 58 HA ARG 58 14.741 1.686 2.406
457 HE ARG 58 HE ARG 58 19.692 1.935 2.199
458 HB2 ARG 58 HB2 ARG 58 16.399 0.184 3.297
459 HB3 ARG 58 HB3 ARG 58 17.167 1.063 1.989
460 HG2 ARG 58 HG2 ARG 58 18.166 2.626 3.794
461 HG3 ARG 58 HG3 ARG 58 17.530 1.490 4.989
462 HD2 ARG 58 HD2 ARG 58 19.783 0.870 4.672
463 HD3 ARG 58 HD3 ARG 58 18.818 -0.349 3.820
464 HH11 ARG 58 HH11 ARG 58 20.625 -1.313 3.306
465 HH12 ARG 58 HH12 ARG 58 21.749 -1.580 2.027
466 HH21 ARG 58 HH21 ARG 58 21.171 1.588 0.514
467 HH22 ARG 58 HH22 ARG 58 22.067 0.119 0.391
468 H GLU 59 HN GLU 59 15.326 4.455 4.358
469 HA GLU 59 HA GLU 59 14.409 3.029 6.782
470 HB2 GLU 59 HB2 GLU 59 16.102 4.023 8.143
471 HB3 GLU 59 HB3 GLU 59 16.834 3.021 6.889
472 HG2 GLU 59 HG2 GLU 59 17.236 5.193 5.563
473 HG3 GLU 59 HG3 GLU 59 16.772 6.066 7.026
474 H LYS 60 HN LYS 60 13.165 4.098 8.059
475 HA LYS 60 HA LYS 60 11.744 6.314 6.963
476 HB2 LYS 60 HB2 LYS 60 10.222 6.074 8.812
477 HB3 LYS 60 HB3 LYS 60 10.641 4.487 8.170
478 HG2 LYS 60 HG2 LYS 60 12.236 4.159 10.073
479 HG3 LYS 60 HG3 LYS 60 11.771 5.748 10.713
480 HD2 LYS 60 HD2 LYS 60 9.404 4.964 10.906
481 HD3 LYS 60 HD3 LYS 60 9.881 3.401 10.244
482 HE2 LYS 60 HE2 LYS 60 9.725 3.116 12.598
483 HE3 LYS 60 HE3 LYS 60 11.437 3.066 12.179
484 HZ1 LYS 60 HZ1 LYS 60 11.011 4.411 14.144
485 HZ2 LYS 60 HZ2 LYS 60 11.619 5.363 12.973
486 HZ3 LYS 60 HZ3 LYS 60 10.020 5.409 13.328
487 H LEU 61 HN LEU 61 14.499 6.368 9.024
488 HA LEU 61 HA LEU 61 13.915 8.790 10.377
489 HG LEU 61 HG LEU 61 14.726 7.027 11.829
490 HB2 LEU 61 HB2 LEU 61 16.636 7.627 9.586
491 HB3 LEU 61 HB3 LEU 61 16.340 8.917 10.742
492 HD11 LEU 61 HD11 LEU 61 17.002 5.425 10.588
493 HD12 LEU 61 HD12 LEU 61 15.892 4.842 11.843
494 HD13 LEU 61 HD13 LEU 61 15.269 5.229 10.245
495 HD21 LEU 61 HD21 LEU 61 17.741 7.227 12.281
496 HD22 LEU 61 HD22 LEU 61 16.502 8.270 13.015
497 HD23 LEU 61 HD23 LEU 61 16.559 6.551 13.427
498 H HIS 62 HN HIS 62 14.798 8.119 7.045
499 HA HIS 62 HA HIS 62 15.440 10.997 6.578
500 HD1 HIS 62 HD1 HIS 62 18.503 7.984 4.371
501 HD2 HIS 62 HD2 HIS 62 17.491 10.240 7.777
502 HE1 HIS 62 HE1 HIS 62 20.517 7.884 5.923
503 HB2 HIS 62 HB2 HIS 62 15.829 8.566 4.789
504 HB3 HIS 62 HB3 HIS 62 16.327 10.222 4.438
505 H THR 63 HN THR 63 13.633 12.149 5.821
506 HA THR 63 HA THR 63 11.441 10.582 4.599
507 HB THR 63 HB THR 63 10.017 12.238 5.852
508 HG1 THR 63 HG1 THR 63 11.006 13.444 7.456
509 HG21 THR 63 HG21 THR 63 10.180 11.084 7.965
510 HG22 THR 63 HG22 THR 63 10.578 9.919 6.690
511 HG23 THR 63 HG23 THR 63 11.876 10.642 7.668
512 H VAL 64 HN VAL 64 10.091 11.512 3.165
513 HA VAL 64 HA VAL 64 10.668 14.163 2.008
514 HB VAL 64 HB VAL 64 11.994 12.625 0.698
515 HG11 VAL 64 HG11 VAL 64 9.516 10.935 0.218
516 HG12 VAL 64 HG12 VAL 64 11.105 10.729 -0.544
517 HG13 VAL 64 HG13 VAL 64 10.922 10.455 1.187
518 HG21 VAL 64 HG21 VAL 64 10.707 14.385 -0.519
519 HG22 VAL 64 HG22 VAL 64 11.161 12.984 -1.496
520 HG23 VAL 64 HG23 VAL 64 9.492 13.141 -0.909
521 H LYS 65 HN LYS 65 8.709 15.059 1.069
522 HA LYS 65 HA LYS 65 6.225 13.633 1.905
523 HB2 LYS 65 HB2 LYS 65 6.972 15.611 3.329
524 HB3 LYS 65 HB3 LYS 65 6.720 16.631 1.909
525 HG2 LYS 65 HG2 LYS 65 4.333 15.921 1.832
526 HG3 LYS 65 HG3 LYS 65 4.600 14.882 3.247
527 HD2 LYS 65 HD2 LYS 65 5.188 16.873 4.599
528 HD3 LYS 65 HD3 LYS 65 4.954 17.914 3.175
529 HE2 LYS 65 HE2 LYS 65 2.579 17.178 3.036
530 HE3 LYS 65 HE3 LYS 65 2.810 16.158 4.463
531 HZ1 LYS 65 HZ1 LYS 65 1.808 18.274 5.042
532 HZ2 LYS 65 HZ2 LYS 65 3.274 18.173 5.742
533 HZ3 LYS 65 HZ3 LYS 65 3.057 19.113 4.422
534 H VAL 66 HN VAL 66 4.761 13.357 0.326
535 HA VAL 66 HA VAL 66 5.309 14.158 -2.392
536 HB VAL 66 HB VAL 66 2.952 12.800 -1.005
537 HG11 VAL 66 HG11 VAL 66 2.026 13.896 -3.010
538 HG12 VAL 66 HG12 VAL 66 3.369 13.291 -4.006
539 HG13 VAL 66 HG13 VAL 66 2.180 12.166 -3.310
540 HG21 VAL 66 HG21 VAL 66 5.136 11.778 -2.896
541 HG22 VAL 66 HG22 VAL 66 5.059 11.487 -1.148
542 HG23 VAL 66 HG23 VAL 66 3.820 10.807 -2.211
543 H LEU 67 HN LEU 67 4.423 15.761 -3.618
544 HA LEU 67 HA LEU 67 2.546 17.679 -2.293
545 HG LEU 67 HG LEU 67 5.682 17.877 -2.203
546 HB2 LEU 67 HB2 LEU 67 4.612 18.199 -4.461
547 HB3 LEU 67 HB3 LEU 67 3.530 19.391 -3.754
548 HD11 LEU 67 HD11 LEU 67 5.678 20.686 -3.361
549 HD12 LEU 67 HD12 LEU 67 6.929 20.016 -2.285
550 HD13 LEU 67 HD13 LEU 67 6.688 19.317 -3.872
551 HD21 LEU 67 HD21 LEU 67 4.007 20.291 -1.393
552 HD22 LEU 67 HD22 LEU 67 3.878 18.650 -0.719
553 HD23 LEU 67 HD23 LEU 67 5.350 19.586 -0.463
554 H SER 68 HN SER 68 3.468 16.016 -5.364
555 HA SER 68 HA SER 68 0.736 15.485 -6.012
556 HG SER 68 HG SER 68 2.077 18.667 -8.175
557 HB2 SER 68 HB2 SER 68 0.881 16.707 -8.280
558 HB3 SER 68 HB3 SER 68 0.513 17.679 -6.857
559 H ALA 69 HN ALA 69 0.679 14.151 -8.109
560 HA ALA 69 HA ALA 69 3.213 13.426 -9.274
561 HB1 ALA 69 HB1 ALA 69 3.032 10.994 -8.773
562 HB2 ALA 69 HB2 ALA 69 3.258 11.939 -7.295
563 HB3 ALA 69 HB3 ALA 69 1.642 11.314 -7.713
564 H SER 70 HN SER 70 2.942 12.030 -11.127
565 HA SER 70 HA SER 70 0.224 11.663 -12.247
566 HG SER 70 HG SER 70 -0.056 14.227 -12.472
567 HB2 SER 70 HB2 SER 70 2.368 13.316 -13.660
568 HB3 SER 70 HB3 SER 70 0.731 12.983 -14.239
569 H SER 71 HN SER 71 0.282 10.236 -14.164
570 HA SER 71 HA SER 71 2.245 8.221 -14.258
571 HG SER 71 HG SER 71 -1.038 7.690 -15.642
572 HB2 SER 71 HB2 SER 71 0.465 9.190 -16.528
573 HB3 SER 71 HB3 SER 71 1.157 7.570 -16.321
574 H TYR 72 HN TYR 72 4.057 7.864 -15.694
575 HA TYR 72 HA TYR 72 5.540 10.261 -16.156
576 HD1 TYR 72 HD1 TYR 72 8.092 10.521 -16.428
577 HD2 TYR 72 HD2 TYR 72 7.280 7.060 -18.872
578 HE1 TYR 72 HE1 TYR 72 9.884 11.204 -17.979
579 HE2 TYR 72 HE2 TYR 72 9.101 7.719 -20.410
580 HH TYR 72 HH TYR 72 10.787 9.280 -20.865
581 HB2 TYR 72 HB2 TYR 72 6.770 8.312 -15.592
582 HB3 TYR 72 HB3 TYR 72 6.037 7.375 -16.898
583 H SER 73 HN SER 73 5.865 11.466 -17.875
584 HA SER 73 HA SER 73 5.583 10.472 -20.562
585 HG SER 73 HG SER 73 2.271 11.871 -20.495
586 HB2 SER 73 HB2 SER 73 4.091 12.961 -19.614
587 HB3 SER 73 HB3 SER 73 4.315 12.504 -21.310
588 HA PRO 74 HA PRO 74 9.413 12.561 -20.283
589 HB2 PRO 74 HB2 PRO 74 9.831 13.441 -22.928
590 HB3 PRO 74 HB3 PRO 74 10.197 11.810 -22.277
591 HG2 PRO 74 HG2 PRO 74 7.796 12.749 -23.838
592 HG3 PRO 74 HG3 PRO 74 8.657 11.183 -23.949
593 HD2 PRO 74 HD2 PRO 74 6.301 11.445 -22.614
594 HD3 PRO 74 HD3 PRO 74 7.591 10.359 -22.012
595 H ASP 75 HN ASP 75 7.130 14.440 -22.333
596 HA ASP 75 HA ASP 75 8.275 16.972 -21.829
597 HB2 ASP 75 HB2 ASP 75 6.670 16.570 -23.638
598 HB3 ASP 75 HB3 ASP 75 5.389 16.250 -22.465
599 H GLU 76 HN GLU 76 5.689 15.220 -20.051
600 HA GLU 76 HA GLU 76 5.118 17.341 -18.225
601 HB2 GLU 76 HB2 GLU 76 4.720 14.333 -17.995
602 HB3 GLU 76 HB3 GLU 76 4.084 15.491 -16.839
603 HG2 GLU 76 HG2 GLU 76 3.356 15.584 -19.799
604 HG3 GLU 76 HG3 GLU 76 2.475 14.636 -18.611
605 H TRP 77 HN TRP 77 7.493 14.686 -18.194
606 HA TRP 77 HA TRP 77 8.379 14.980 -15.495
607 HD1 TRP 77 HD1 TRP 77 10.770 14.073 -14.422
608 HE1 TRP 77 HE1 TRP 77 13.317 13.943 -14.430
609 HE3 TRP 77 HE3 TRP 77 11.502 13.402 -19.437
610 HZ2 TRP 77 HZ2 TRP 77 15.438 13.702 -16.402
611 HZ3 TRP 77 HZ3 TRP 77 13.796 13.246 -20.361
612 HH2 TRP 77 HH2 TRP 77 15.772 13.415 -18.858
613 HB2 TRP 77 HB2 TRP 77 8.990 12.998 -16.598
614 HB3 TRP 77 HB3 TRP 77 9.483 13.820 -18.052
615 H GLU 78 HN GLU 78 9.724 16.324 -18.589
616 HA GLU 78 HA GLU 78 11.636 17.891 -17.169
617 HB2 GLU 78 HB2 GLU 78 10.572 18.146 -20.012
618 HB3 GLU 78 HB3 GLU 78 11.933 19.077 -19.359
619 HG2 GLU 78 HG2 GLU 78 13.073 16.901 -18.772
620 HG3 GLU 78 HG3 GLU 78 11.787 16.043 -19.609
621 H ARG 79 HN ARG 79 8.348 18.672 -18.287
622 HA ARG 79 HA ARG 79 8.280 21.423 -17.720
623 HE ARG 79 HE ARG 79 3.268 22.513 -17.066
624 HB2 ARG 79 HB2 ARG 79 6.518 20.148 -18.849
625 HB3 ARG 79 HB3 ARG 79 6.223 19.215 -17.380
626 HG2 ARG 79 HG2 ARG 79 5.467 21.370 -16.256
627 HG3 ARG 79 HG3 ARG 79 5.612 22.159 -17.847
628 HD2 ARG 79 HD2 ARG 79 4.048 20.420 -18.778
629 HD3 ARG 79 HD3 ARG 79 3.896 19.732 -17.150
630 HH11 ARG 79 HH11 ARG 79 1.913 19.428 -18.231
631 HH12 ARG 79 HH12 ARG 79 0.270 19.979 -18.154
632 HH21 ARG 79 HH21 ARG 79 1.082 23.222 -16.951
633 HH22 ARG 79 HH22 ARG 79 -0.207 22.174 -17.404
634 H GLN 80 HN GLN 80 7.628 18.642 -15.467
635 HA GLN 80 HA GLN 80 7.184 20.390 -13.238
636 HB2 GLN 80 HB2 GLN 80 7.764 17.412 -13.479
637 HB3 GLN 80 HB3 GLN 80 7.493 18.214 -11.920
638 HG2 GLN 80 HG2 GLN 80 5.278 18.897 -12.514
639 HG3 GLN 80 HG3 GLN 80 5.508 18.471 -14.207
640 HE21 GLN 80 HE22 GLN 80 5.363 16.338 -14.890
641 HE22 GLN 80 HE21 GLN 80 4.605 15.101 -13.885
642 H CYS 81 HN CYS 81 10.069 18.552 -14.383
643 HA CYS 81 HA CYS 81 11.635 19.162 -12.089
644 HG CYS 81 HG CYS 81 10.804 16.646 -14.088
645 HB2 CYS 81 HB2 CYS 81 12.476 18.367 -14.907
646 HB3 CYS 81 HB3 CYS 81 13.540 18.398 -13.487
647 H LYS 82 HN LYS 82 11.277 20.985 -15.187
648 HA LYS 82 HA LYS 82 13.395 22.790 -14.469
649 HB2 LYS 82 HB2 LYS 82 13.074 23.837 -16.480
650 HB3 LYS 82 HB3 LYS 82 12.612 22.183 -16.842
651 HG2 LYS 82 HG2 LYS 82 10.186 22.927 -16.540
652 HG3 LYS 82 HG3 LYS 82 10.806 24.597 -16.413
653 HD2 LYS 82 HD2 LYS 82 11.854 24.356 -18.654
654 HD3 LYS 82 HD3 LYS 82 11.165 22.721 -18.788
655 HE2 LYS 82 HE2 LYS 82 8.876 23.679 -18.553
656 HE3 LYS 82 HE3 LYS 82 9.568 25.300 -18.424
657 HZ1 LYS 82 HZ1 LYS 82 9.790 23.542 -20.802
658 HZ2 LYS 82 HZ2 LYS 82 8.814 24.838 -20.669
659 HZ3 LYS 82 HZ3 LYS 82 10.429 25.042 -20.681
660 H VAL 83 HN VAL 83 10.469 22.365 -13.041
661 HA VAL 83 HA VAL 83 10.337 25.176 -12.299
662 HB VAL 83 HB VAL 83 8.160 23.187 -12.797
663 HG11 VAL 83 HG11 VAL 83 7.983 25.973 -11.601
664 HG12 VAL 83 HG12 VAL 83 6.611 25.291 -12.516
665 HG13 VAL 83 HG13 VAL 83 7.188 24.487 -11.063
666 HG21 VAL 83 HG21 VAL 83 9.026 24.115 -14.873
667 HG22 VAL 83 HG22 VAL 83 7.543 25.009 -14.573
668 HG23 VAL 83 HG23 VAL 83 9.134 25.734 -14.198
669 H ALA 84 HN ALA 84 11.490 22.502 -11.274
670 HA ALA 84 HA ALA 84 10.740 22.182 -8.544
671 HB1 ALA 84 HB1 ALA 84 13.441 21.778 -9.899
672 HB2 ALA 84 HB2 ALA 84 12.887 20.990 -8.410
673 HB3 ALA 84 HB3 ALA 84 12.107 20.606 -9.956
674 H GLY 85 HN GLY 85 11.065 25.096 -9.270
675 HA2 GLY 85 HA2 GLY 85 11.858 26.991 -8.138
676 HA3 GLY 85 HA3 GLY 85 12.962 25.978 -7.176
677 H LYS 86 HN LYS 86 12.373 26.589 -10.666
678 HA LYS 86 HA LYS 86 15.236 27.001 -11.214
679 HB2 LYS 86 HB2 LYS 86 13.733 24.659 -12.343
680 HB3 LYS 86 HB3 LYS 86 15.275 25.290 -12.967
681 HG2 LYS 86 HG2 LYS 86 16.214 24.974 -10.621
682 HG3 LYS 86 HG3 LYS 86 14.718 24.113 -10.217
683 HD2 LYS 86 HD2 LYS 86 15.221 22.449 -12.006
684 HD3 LYS 86 HD3 LYS 86 16.746 23.311 -12.340
685 HE2 LYS 86 HE2 LYS 86 17.357 23.031 -9.899
686 HE3 LYS 86 HE3 LYS 86 15.902 22.055 -9.681
687 HZ1 LYS 86 HZ1 LYS 86 18.224 21.377 -11.389
688 HZ2 LYS 86 HZ2 LYS 86 17.769 20.659 -9.986
689 HZ3 LYS 86 HZ3 LYS 86 16.845 20.493 -11.334
690 H THR 87 HN THR 87 13.536 26.232 -13.820
691 HA THR 87 HA THR 87 13.614 28.785 -15.049
692 HB THR 87 HB THR 87 11.642 26.626 -15.815
693 HG1 THR 87 HG1 THR 87 13.540 25.588 -15.756
694 HG21 THR 87 HG21 THR 87 11.397 28.735 -17.052
695 HG22 THR 87 HG22 THR 87 13.131 28.727 -17.446
696 HG23 THR 87 HG23 THR 87 12.055 27.469 -18.098
697 H GLN 88 HN GLN 88 11.154 27.156 -13.066
698 HA GLN 88 HA GLN 88 10.086 29.774 -12.380
699 HB2 GLN 88 HB2 GLN 88 8.207 27.517 -13.208
700 HB3 GLN 88 HB3 GLN 88 7.730 29.011 -12.419
701 HG2 GLN 88 HG2 GLN 88 8.555 30.296 -14.396
702 HG3 GLN 88 HG3 GLN 88 8.946 28.770 -15.202
703 HE21 GLN 88 HE22 GLN 88 6.265 30.804 -13.994
704 HE22 GLN 88 HE21 GLN 88 5.010 30.001 -14.905
Start of MODEL 4
1 HA MET 1 HA MET 1 3.509 -1.209 -2.446
2 H1 MET 1 H1 MET 1 1.826 -1.323 -0.778
3 H2 MET 1 H2 MET 1 3.287 -0.935 -0.115
4 H3 MET 1 H3 MET 1 2.138 0.222 -0.294
5 HB2 MET 1 HB2 MET 1 1.173 -0.451 -3.014
6 HB3 MET 1 HB3 MET 1 1.681 1.220 -2.718
7 HG2 MET 1 HG2 MET 1 3.385 1.017 -4.502
8 HG3 MET 1 HG3 MET 1 2.962 -0.685 -4.724
9 HE1 MET 1 HE1 MET 1 2.578 -0.562 -7.300
10 HE2 MET 1 HE2 MET 1 1.753 0.801 -8.086
11 HE3 MET 1 HE3 MET 1 3.243 1.079 -7.156
12 H GLU 2 HN GLU 2 5.459 -0.339 -3.105
13 HA GLU 2 HA GLU 2 6.418 2.146 -1.779
14 HB2 GLU 2 HB2 GLU 2 7.975 -0.462 -2.122
15 HB3 GLU 2 HB3 GLU 2 8.555 1.039 -1.415
16 HG2 GLU 2 HG2 GLU 2 8.127 -0.273 0.450
17 HG3 GLU 2 HG3 GLU 2 6.713 0.771 0.360
18 H TRP 3 HN TRP 3 8.332 3.027 -3.026
19 HA TRP 3 HA TRP 3 8.050 2.403 -5.919
20 HD1 TRP 3 HD1 TRP 3 6.553 5.579 -3.111
21 HE1 TRP 3 HE1 TRP 3 4.005 5.695 -3.250
22 HE3 TRP 3 HE3 TRP 3 5.946 3.564 -7.771
23 HZ2 TRP 3 HZ2 TRP 3 1.938 4.978 -5.170
24 HZ3 TRP 3 HZ3 TRP 3 3.679 3.319 -8.746
25 HH2 TRP 3 HH2 TRP 3 1.672 4.012 -7.453
26 HB2 TRP 3 HB2 TRP 3 8.465 5.177 -4.785
27 HB3 TRP 3 HB3 TRP 3 8.057 4.736 -6.425
28 H LEU 4 HN LEU 4 9.865 3.205 -7.197
29 HA LEU 4 HA LEU 4 12.476 3.359 -5.760
30 HG LEU 4 HG LEU 4 14.045 3.233 -8.510
31 HB2 LEU 4 HB2 LEU 4 12.227 1.283 -7.039
32 HB3 LEU 4 HB3 LEU 4 11.745 2.213 -8.465
33 HD11 LEU 4 HD11 LEU 4 14.625 1.118 -6.385
34 HD12 LEU 4 HD12 LEU 4 15.852 2.035 -7.285
35 HD13 LEU 4 HD13 LEU 4 14.757 2.876 -6.191
36 HD21 LEU 4 HD21 LEU 4 13.384 1.308 -9.936
37 HD22 LEU 4 HD22 LEU 4 15.094 1.241 -9.487
38 HD23 LEU 4 HD23 LEU 4 13.922 0.189 -8.665
39 H VAL 5 HN VAL 5 13.515 5.154 -6.146
40 HA VAL 5 HA VAL 5 12.568 7.256 -8.032
41 HB VAL 5 HB VAL 5 15.060 7.224 -6.259
42 HG11 VAL 5 HG11 VAL 5 14.887 9.698 -6.523
43 HG12 VAL 5 HG12 VAL 5 15.188 8.861 -8.044
44 HG13 VAL 5 HG13 VAL 5 13.552 9.446 -7.676
45 HG21 VAL 5 HG21 VAL 5 12.256 8.269 -5.645
46 HG22 VAL 5 HG22 VAL 5 13.146 7.025 -4.753
47 HG23 VAL 5 HG23 VAL 5 13.709 8.690 -4.703
48 H LYS 6 HN LYS 6 13.093 6.886 -10.059
49 HA LYS 6 HA LYS 6 15.600 5.447 -10.814
50 HB2 LYS 6 HB2 LYS 6 12.948 5.842 -12.120
51 HB3 LYS 6 HB3 LYS 6 14.346 5.522 -13.128
52 HG2 LYS 6 HG2 LYS 6 13.930 3.697 -10.773
53 HG3 LYS 6 HG3 LYS 6 12.818 3.548 -12.121
54 HD2 LYS 6 HD2 LYS 6 14.697 1.974 -12.292
55 HD3 LYS 6 HD3 LYS 6 14.560 3.051 -13.683
56 HE2 LYS 6 HE2 LYS 6 16.416 4.439 -12.850
57 HE3 LYS 6 HE3 LYS 6 16.533 3.436 -11.390
58 HZ1 LYS 6 HZ1 LYS 6 18.178 2.801 -13.040
59 HZ2 LYS 6 HZ2 LYS 6 17.147 1.563 -12.812
60 HZ3 LYS 6 HZ3 LYS 6 17.036 2.488 -14.155
61 H LYS 7 HN LYS 7 14.075 8.606 -10.884
62 HA LYS 7 HA LYS 7 16.481 9.835 -11.938
63 HB2 LYS 7 HB2 LYS 7 13.820 10.241 -13.360
64 HB3 LYS 7 HB3 LYS 7 15.188 11.350 -13.449
65 HG2 LYS 7 HG2 LYS 7 16.628 9.587 -14.375
66 HG3 LYS 7 HG3 LYS 7 15.275 8.447 -14.337
67 HD2 LYS 7 HD2 LYS 7 13.985 9.940 -15.856
68 HD3 LYS 7 HD3 LYS 7 15.399 10.994 -16.000
69 HE2 LYS 7 HE2 LYS 7 15.391 8.007 -16.668
70 HE3 LYS 7 HE3 LYS 7 15.077 9.274 -17.861
71 HZ1 LYS 7 HZ1 LYS 7 17.377 8.595 -17.916
72 HZ2 LYS 7 HZ2 LYS 7 17.302 10.147 -17.437
73 HZ3 LYS 7 HZ3 LYS 7 17.608 8.961 -16.348
74 H SER 8 HN SER 8 16.556 12.045 -11.136
75 HA SER 8 HA SER 8 14.439 13.027 -9.320
76 HG SER 8 HG SER 8 18.067 12.488 -8.915
77 HB2 SER 8 HB2 SER 8 16.346 13.223 -7.588
78 HB3 SER 8 HB3 SER 8 15.577 11.649 -7.820
79 H CYS 9 HN CYS 9 14.742 15.253 -8.878
80 HA CYS 9 HA CYS 9 16.950 16.697 -10.286
81 HG CYS 9 HG CYS 9 15.949 16.949 -12.572
82 HB2 CYS 9 HB2 CYS 9 14.031 17.523 -9.924
83 HB3 CYS 9 HB3 CYS 9 15.318 18.543 -10.588
84 H CYS 10 HN CYS 10 18.273 16.925 -8.517
85 HA CYS 10 HA CYS 10 17.494 17.418 -5.841
86 HG CYS 10 HG CYS 10 19.142 15.499 -5.552
87 HB2 CYS 10 HB2 CYS 10 20.074 18.201 -7.262
88 HB3 CYS 10 HB3 CYS 10 19.840 18.043 -5.515
89 H ASN 11 HN ASN 11 17.638 19.429 -4.591
90 HA ASN 11 HA ASN 11 17.437 21.980 -6.082
91 HB2 ASN 11 HB2 ASN 11 15.242 22.255 -5.875
92 HB3 ASN 11 HB3 ASN 11 15.109 20.533 -5.619
93 HD21 ASN 11 HD21 ASN 11 15.147 19.803 -3.235
94 HD22 ASN 11 HD22 ASN 11 14.436 20.884 -2.078
95 H LYS 12 HN LYS 12 17.455 23.782 -4.762
96 HA LYS 12 HA LYS 12 17.729 23.522 -1.838
97 HB2 LYS 12 HB2 LYS 12 19.775 24.613 -3.772
98 HB3 LYS 12 HB3 LYS 12 19.477 25.587 -2.340
99 HG2 LYS 12 HG2 LYS 12 20.081 22.626 -2.162
100 HG3 LYS 12 HG3 LYS 12 21.350 23.865 -2.185
101 HD2 LYS 12 HD2 LYS 12 20.327 24.975 -0.211
102 HD3 LYS 12 HD3 LYS 12 19.084 23.720 -0.135
103 HE2 LYS 12 HE2 LYS 12 20.845 21.985 0.173
104 HE3 LYS 12 HE3 LYS 12 22.091 23.237 0.102
105 HZ1 LYS 12 HZ1 LYS 12 21.136 24.209 2.111
106 HZ2 LYS 12 HZ2 LYS 12 19.985 23.048 2.180
107 HZ3 LYS 12 HZ3 LYS 12 21.553 22.657 2.378
108 H GLN 13 HN GLN 13 16.961 25.446 -4.726
109 HA GLN 13 HA GLN 13 16.698 27.889 -3.400
110 HB2 GLN 13 HB2 GLN 13 15.409 26.862 -5.977
111 HB3 GLN 13 HB3 GLN 13 15.373 28.551 -5.473
112 HG2 GLN 13 HG2 GLN 13 17.794 28.737 -5.626
113 HG3 GLN 13 HG3 GLN 13 17.960 27.011 -5.952
114 HE21 GLN 13 HE22 GLN 13 17.995 26.375 -8.097
115 HE22 GLN 13 HE21 GLN 13 17.345 27.300 -9.430
116 H ASP 14 HN ASP 14 14.353 25.226 -3.632
117 HA ASP 14 HA ASP 14 12.312 26.998 -2.320
118 HB2 ASP 14 HB2 ASP 14 12.159 26.758 -4.865
119 HB3 ASP 14 HB3 ASP 14 11.751 25.066 -4.589
120 H ASN 15 HN ASN 15 14.063 24.276 -1.907
121 HA ASN 15 HA ASN 15 14.003 22.446 -0.711
122 HB2 ASN 15 HB2 ASN 15 12.838 24.144 0.947
123 HB3 ASN 15 HB3 ASN 15 11.443 23.104 0.698
124 HD21 ASN 15 HD21 ASN 15 12.434 20.552 0.696
125 HD22 ASN 15 HD22 ASN 15 13.260 20.189 2.200
126 H ARG 16 HN ARG 16 11.871 22.968 -3.131
127 HA ARG 16 HA ARG 16 10.370 20.425 -2.855
128 HE ARG 16 HE ARG 16 8.390 24.592 -4.651
129 HB2 ARG 16 HB2 ARG 16 10.196 22.692 -4.889
130 HB3 ARG 16 HB3 ARG 16 9.340 21.151 -5.036
131 HG2 ARG 16 HG2 ARG 16 8.360 21.563 -2.727
132 HG3 ARG 16 HG3 ARG 16 8.984 23.212 -2.814
133 HD2 ARG 16 HD2 ARG 16 7.172 21.963 -4.922
134 HD3 ARG 16 HD3 ARG 16 6.557 22.869 -3.530
135 HH11 ARG 16 HH11 ARG 16 5.574 22.905 -6.085
136 HH12 ARG 16 HH12 ARG 16 5.019 24.335 -6.894
137 HH21 ARG 16 HH21 ARG 16 7.734 26.326 -5.686
138 HH22 ARG 16 HH22 ARG 16 6.323 26.368 -6.727
139 H HIS 17 HN HIS 17 10.995 18.639 -3.809
140 HA HIS 17 HA HIS 17 13.113 18.668 -5.920
141 HD1 HIS 17 HD1 HIS 17 13.810 16.648 -1.820
142 HD2 HIS 17 HD2 HIS 17 15.415 18.183 -5.374
143 HE1 HIS 17 HE1 HIS 17 16.141 17.524 -1.229
144 HB2 HIS 17 HB2 HIS 17 12.237 16.517 -3.926
145 HB3 HIS 17 HB3 HIS 17 13.273 16.203 -5.319
146 H VAL 18 HN VAL 18 12.719 16.934 -7.559
147 HA VAL 18 HA VAL 18 9.948 15.987 -7.723
148 HB VAL 18 HB VAL 18 11.215 16.997 -10.263
149 HG11 VAL 18 HG11 VAL 18 9.031 16.961 -11.172
150 HG12 VAL 18 HG12 VAL 18 9.150 15.474 -10.238
151 HG13 VAL 18 HG13 VAL 18 8.254 16.845 -9.578
152 HG21 VAL 18 HG21 VAL 18 9.827 19.085 -10.140
153 HG22 VAL 18 HG22 VAL 18 9.497 18.735 -8.441
154 HG23 VAL 18 HG23 VAL 18 11.158 19.068 -8.986
155 H LEU 19 HN LEU 19 9.862 13.983 -8.555
156 HA LEU 19 HA LEU 19 12.369 12.759 -9.551
157 HG LEU 19 HG LEU 19 10.517 12.573 -6.159
158 HB2 LEU 19 HB2 LEU 19 11.290 10.834 -7.778
159 HB3 LEU 19 HB3 LEU 19 12.875 11.562 -7.806
160 HD11 LEU 19 HD11 LEU 19 12.995 11.000 -5.374
161 HD12 LEU 19 HD12 LEU 19 11.705 11.569 -4.284
162 HD13 LEU 19 HD13 LEU 19 11.346 10.358 -5.522
163 HD21 LEU 19 HD21 LEU 19 11.882 14.469 -6.201
164 HD22 LEU 19 HD22 LEU 19 12.678 13.606 -4.910
165 HD23 LEU 19 HD23 LEU 19 13.366 13.546 -6.556
166 H MET 20 HN MET 20 12.000 10.398 -10.130
167 HA MET 20 HA MET 20 9.396 10.198 -11.564
168 HB2 MET 20 HB2 MET 20 11.412 10.499 -13.012
169 HB3 MET 20 HB3 MET 20 12.086 9.012 -12.324
170 HG2 MET 20 HG2 MET 20 10.114 7.754 -13.190
171 HG3 MET 20 HG3 MET 20 9.452 9.261 -13.824
172 HE1 MET 20 HE1 MET 20 13.190 7.835 -13.905
173 HE2 MET 20 HE2 MET 20 12.123 6.457 -14.211
174 HE3 MET 20 HE3 MET 20 13.173 7.070 -15.509
175 H LEU 21 HN LEU 21 8.245 9.066 -10.149
176 HA LEU 21 HA LEU 21 9.426 7.088 -8.291
177 HG LEU 21 HG LEU 21 8.259 7.397 -6.180
178 HB2 LEU 21 HB2 LEU 21 6.761 8.489 -8.603
179 HB3 LEU 21 HB3 LEU 21 6.734 6.845 -7.974
180 HD11 LEU 21 HD11 LEU 21 9.654 9.133 -7.034
181 HD12 LEU 21 HD12 LEU 21 8.276 10.167 -7.435
182 HD13 LEU 21 HD13 LEU 21 8.725 9.893 -5.735
183 HD21 LEU 21 HD21 LEU 21 5.828 7.624 -5.854
184 HD22 LEU 21 HD22 LEU 21 6.700 8.821 -4.882
185 HD23 LEU 21 HD23 LEU 21 5.888 9.309 -6.389
186 H CYS 22 HN CYS 22 9.325 4.943 -8.669
187 HA CYS 22 HA CYS 22 7.746 3.977 -11.000
188 HG CYS 22 HG CYS 22 10.623 5.843 -10.922
189 HB2 CYS 22 HB2 CYS 22 10.660 3.321 -10.371
190 HB3 CYS 22 HB3 CYS 22 9.718 2.769 -11.766
191 H ASP 23 HN ASP 23 7.653 1.588 -11.023
192 HA ASP 23 HA ASP 23 6.953 0.302 -8.550
193 HB2 ASP 23 HB2 ASP 23 6.164 -0.813 -10.436
194 HB3 ASP 23 HB3 ASP 23 7.627 -0.502 -11.360
195 H ALA 24 HN ALA 24 8.229 -1.131 -7.230
196 HA ALA 24 HA ALA 24 11.022 -0.524 -6.904
197 HB1 ALA 24 HB1 ALA 24 9.298 -2.728 -5.706
198 HB2 ALA 24 HB2 ALA 24 10.932 -2.274 -5.175
199 HB3 ALA 24 HB3 ALA 24 9.597 -1.118 -5.008
200 H GLY 25 HN GLY 25 11.557 -0.899 -9.185
201 HA2 GLY 25 HA2 GLY 25 13.094 -2.989 -9.998
202 HA3 GLY 25 HA3 GLY 25 11.443 -3.600 -10.263
203 H GLY 26 HN GLY 26 10.800 -0.550 -10.726
204 HA2 GLY 26 HA2 GLY 26 10.981 1.048 -12.370
205 HA3 GLY 26 HA3 GLY 26 12.086 0.021 -13.283
206 H ALA 27 HN ALA 27 9.286 -1.830 -12.538
207 HA ALA 27 HA ALA 27 8.742 -2.045 -15.331
208 HB1 ALA 27 HB1 ALA 27 8.547 -3.902 -13.692
209 HB2 ALA 27 HB2 ALA 27 7.128 -3.100 -12.971
210 HB3 ALA 27 HB3 ALA 27 7.067 -3.689 -14.644
211 H ILE 28 HN ILE 28 7.498 0.243 -13.132
212 HA ILE 28 HA ILE 28 5.348 1.139 -14.939
213 HB ILE 28 HB ILE 28 5.097 0.755 -11.913
214 HG12 ILE 28 HG12 ILE 28 4.689 -1.371 -13.100
215 HG13 ILE 28 HG13 ILE 28 3.289 -0.769 -12.243
216 HG21 ILE 28 HG21 ILE 28 4.002 2.825 -12.437
217 HG22 ILE 28 HG22 ILE 28 3.162 2.108 -13.829
218 HG23 ILE 28 HG23 ILE 28 2.756 1.614 -12.173
219 HD11 ILE 28 HD11 ILE 28 3.683 -0.479 -15.255
220 HD12 ILE 28 HD12 ILE 28 2.719 -1.732 -14.451
221 HD13 ILE 28 HD13 ILE 28 2.234 -0.035 -14.323
222 H LYS 29 HN LYS 29 5.284 3.530 -14.790
223 HA LYS 29 HA LYS 29 7.255 4.766 -12.961
224 HB2 LYS 29 HB2 LYS 29 7.293 5.203 -15.977
225 HB3 LYS 29 HB3 LYS 29 8.206 6.109 -14.765
226 HG2 LYS 29 HG2 LYS 29 9.143 3.764 -14.050
227 HG3 LYS 29 HG3 LYS 29 8.564 3.213 -15.617
228 HD2 LYS 29 HD2 LYS 29 10.056 4.717 -16.781
229 HD3 LYS 29 HD3 LYS 29 10.359 5.642 -15.317
230 HE2 LYS 29 HE2 LYS 29 12.320 4.325 -15.742
231 HE3 LYS 29 HE3 LYS 29 11.557 3.722 -14.284
232 HZ1 LYS 29 HZ1 LYS 29 12.263 1.950 -15.845
233 HZ2 LYS 29 HZ2 LYS 29 10.654 1.863 -15.584
234 HZ3 LYS 29 HZ3 LYS 29 11.238 2.494 -16.982
235 H MET 30 HN MET 30 6.876 6.851 -12.462
236 HA MET 30 HA MET 30 4.474 8.319 -13.337
237 HB2 MET 30 HB2 MET 30 5.164 7.394 -10.504
238 HB3 MET 30 HB3 MET 30 4.035 8.691 -10.866
239 HG2 MET 30 HG2 MET 30 2.614 7.139 -12.143
240 HG3 MET 30 HG3 MET 30 3.743 5.823 -11.813
241 HE1 MET 30 HE1 MET 30 1.256 8.408 -10.252
242 HE2 MET 30 HE2 MET 30 1.087 7.829 -8.578
243 HE3 MET 30 HE3 MET 30 2.601 8.593 -9.096
244 H ILE 31 HN ILE 31 4.616 10.532 -12.208
245 HA ILE 31 HA ILE 31 7.424 11.431 -11.739
246 HB ILE 31 HB ILE 31 5.203 12.862 -13.198
247 HG12 ILE 31 HG12 ILE 31 7.975 12.408 -14.367
248 HG13 ILE 31 HG13 ILE 31 6.841 11.063 -14.379
249 HG21 ILE 31 HG21 ILE 31 7.916 13.832 -12.223
250 HG22 ILE 31 HG22 ILE 31 7.028 14.648 -13.527
251 HG23 ILE 31 HG23 ILE 31 6.319 14.544 -11.914
252 HD11 ILE 31 HD11 ILE 31 6.615 12.322 -16.431
253 HD12 ILE 31 HD12 ILE 31 5.130 12.438 -15.467
254 HD13 ILE 31 HD13 ILE 31 6.256 13.806 -15.516
255 H ALA 32 HN ALA 32 7.538 12.662 -9.771
256 HA ALA 32 HA ALA 32 4.984 13.538 -8.571
257 HB1 ALA 32 HB1 ALA 32 7.062 11.970 -7.001
258 HB2 ALA 32 HB2 ALA 32 5.537 12.630 -6.395
259 HB3 ALA 32 HB3 ALA 32 5.507 11.298 -7.572
260 H GLU 33 HN GLU 33 5.150 15.421 -7.595
261 HA GLU 33 HA GLU 33 7.787 16.780 -7.367
262 HB2 GLU 33 HB2 GLU 33 5.812 17.945 -8.545
263 HB3 GLU 33 HB3 GLU 33 4.926 17.852 -7.013
264 HG2 GLU 33 HG2 GLU 33 6.798 19.196 -5.955
265 HG3 GLU 33 HG3 GLU 33 7.463 19.430 -7.570
266 H VAL 34 HN VAL 34 8.538 17.115 -5.253
267 HA VAL 34 HA VAL 34 6.816 16.311 -3.001
268 HB VAL 34 HB VAL 34 8.327 14.681 -2.203
269 HG11 VAL 34 HG11 VAL 34 7.995 13.929 -5.121
270 HG12 VAL 34 HG12 VAL 34 8.126 12.854 -3.714
271 HG13 VAL 34 HG13 VAL 34 6.692 13.860 -3.922
272 HG21 VAL 34 HG21 VAL 34 10.129 15.246 -4.589
273 HG22 VAL 34 HG22 VAL 34 10.496 15.519 -2.864
274 HG23 VAL 34 HG23 VAL 34 10.324 13.877 -3.472
275 H LYS 35 HN LYS 35 8.110 16.600 -0.934
276 HA LYS 35 HA LYS 35 10.135 18.772 -1.064
277 HB2 LYS 35 HB2 LYS 35 7.563 19.062 0.021
278 HB3 LYS 35 HB3 LYS 35 8.499 18.569 1.426
279 HG2 LYS 35 HG2 LYS 35 10.056 20.410 1.090
280 HG3 LYS 35 HG3 LYS 35 9.300 20.838 -0.458
281 HD2 LYS 35 HD2 LYS 35 7.144 21.290 0.768
282 HD3 LYS 35 HD3 LYS 35 7.995 21.000 2.302
283 HE2 LYS 35 HE2 LYS 35 9.558 22.856 1.771
284 HE3 LYS 35 HE3 LYS 35 8.725 23.121 0.229
285 HZ1 LYS 35 HZ1 LYS 35 6.732 23.710 1.489
286 HZ2 LYS 35 HZ2 LYS 35 7.502 23.460 2.911
287 HZ3 LYS 35 HZ3 LYS 35 7.973 24.667 1.926
288 H SER 36 HN SER 36 11.647 18.486 0.945
289 HA SER 36 HA SER 36 11.647 15.741 2.009
290 HG SER 36 HG SER 36 11.794 15.332 -0.584
291 HB2 SER 36 HB2 SER 36 14.093 16.610 0.471
292 HB3 SER 36 HB3 SER 36 13.591 14.981 0.958
293 H ASP 37 HN ASP 37 12.990 15.422 3.786
294 HA ASP 37 HA ASP 37 13.992 17.925 5.025
295 HB2 ASP 37 HB2 ASP 37 12.471 16.342 6.251
296 HB3 ASP 37 HB3 ASP 37 13.772 15.150 6.230
297 H PHE 38 HN PHE 38 15.173 15.238 3.263
298 HA PHE 38 HA PHE 38 17.962 16.116 3.618
299 HD1 PHE 38 HD2 PHE 38 15.678 13.562 5.686
300 HD2 PHE 38 HD1 PHE 38 19.909 14.386 5.618
301 HE1 PHE 38 HE2 PHE 38 15.714 13.556 8.157
302 HE2 PHE 38 HE1 PHE 38 19.948 14.359 8.100
303 HZ PHE 38 HZ PHE 38 17.854 13.945 9.380
304 HB2 PHE 38 HB2 PHE 38 17.085 13.192 3.629
305 HB3 PHE 38 HB3 PHE 38 18.740 13.765 3.588
306 H ALA 39 HN ALA 39 19.261 15.226 1.693
307 HA ALA 39 HA ALA 39 17.909 15.648 -0.781
308 HB1 ALA 39 HB1 ALA 39 20.034 14.887 -1.790
309 HB2 ALA 39 HB2 ALA 39 20.330 16.049 -0.483
310 HB3 ALA 39 HB3 ALA 39 20.591 14.307 -0.207
311 H VAL 40 HN VAL 40 17.483 14.113 -2.467
312 HA VAL 40 HA VAL 40 17.378 11.246 -1.832
313 HB VAL 40 HB VAL 40 15.232 12.003 -1.067
314 HG11 VAL 40 HG11 VAL 40 14.990 14.190 -2.111
315 HG12 VAL 40 HG12 VAL 40 14.833 13.445 -3.717
316 HG13 VAL 40 HG13 VAL 40 13.587 13.195 -2.478
317 HG21 VAL 40 HG21 VAL 40 14.852 10.827 -3.844
318 HG22 VAL 40 HG22 VAL 40 15.251 9.910 -2.380
319 HG23 VAL 40 HG23 VAL 40 13.704 10.761 -2.493
320 H LYS 41 HN LYS 41 17.635 10.004 -3.758
321 HA LYS 41 HA LYS 41 17.971 11.426 -6.306
322 HB2 LYS 41 HB2 LYS 41 20.399 10.751 -6.457
323 HB3 LYS 41 HB3 LYS 41 20.007 12.091 -5.411
324 HG2 LYS 41 HG2 LYS 41 21.724 10.709 -4.410
325 HG3 LYS 41 HG3 LYS 41 20.275 10.713 -3.406
326 HD2 LYS 41 HD2 LYS 41 19.640 8.503 -4.327
327 HD3 LYS 41 HD3 LYS 41 21.100 8.504 -5.338
328 HE2 LYS 41 HE2 LYS 41 22.519 8.427 -3.373
329 HE3 LYS 41 HE3 LYS 41 21.139 8.731 -2.303
330 HZ1 LYS 41 HZ1 LYS 41 20.209 6.627 -2.911
331 HZ2 LYS 41 HZ2 LYS 41 21.437 6.302 -3.961
332 HZ3 LYS 41 HZ3 LYS 41 21.738 6.388 -2.353
333 H VAL 42 HN VAL 42 19.062 9.822 -7.919
334 HA VAL 42 HA VAL 42 17.279 7.752 -8.337
335 HB VAL 42 HB VAL 42 20.113 8.117 -9.412
336 HG11 VAL 42 HG11 VAL 42 19.163 6.840 -11.417
337 HG12 VAL 42 HG12 VAL 42 19.452 5.864 -9.978
338 HG13 VAL 42 HG13 VAL 42 17.799 6.379 -10.365
339 HG21 VAL 42 HG21 VAL 42 17.377 9.160 -10.146
340 HG22 VAL 42 HG22 VAL 42 18.883 10.070 -9.924
341 HG23 VAL 42 HG23 VAL 42 18.682 9.082 -11.368
342 H GLY 43 HN GLY 43 17.284 5.564 -8.215
343 HA2 GLY 43 HA2 GLY 43 17.777 3.459 -7.528
344 HA3 GLY 43 HA3 GLY 43 19.409 3.976 -7.042
345 H ASP 44 HN ASP 44 16.311 5.510 -5.991
346 HA ASP 44 HA ASP 44 17.080 4.643 -3.170
347 HB2 ASP 44 HB2 ASP 44 15.773 7.240 -4.028
348 HB3 ASP 44 HB3 ASP 44 15.585 6.547 -2.425
349 H LEU 45 HN LEU 45 15.474 3.706 -1.876
350 HA LEU 45 HA LEU 45 12.963 2.999 -3.275
351 HG LEU 45 HG LEU 45 11.348 1.895 -1.199
352 HB2 LEU 45 HB2 LEU 45 14.323 1.435 -1.681
353 HB3 LEU 45 HB3 LEU 45 13.713 2.468 -0.386
354 HD11 LEU 45 HD11 LEU 45 11.994 0.984 -3.452
355 HD12 LEU 45 HD12 LEU 45 12.845 -0.345 -2.647
356 HD13 LEU 45 HD13 LEU 45 11.082 -0.175 -2.482
357 HD21 LEU 45 HD21 LEU 45 11.386 -0.263 -0.005
358 HD22 LEU 45 HD22 LEU 45 13.161 -0.315 -0.133
359 HD23 LEU 45 HD23 LEU 45 12.361 0.958 0.819
360 H LEU 46 HN LEU 46 10.934 3.788 -2.501
361 HA LEU 46 HA LEU 46 10.940 5.788 -0.304
362 HG LEU 46 HG LEU 46 11.497 6.987 -3.121
363 HB2 LEU 46 HB2 LEU 46 9.323 5.901 -2.885
364 HB3 LEU 46 HB3 LEU 46 8.979 6.867 -1.462
365 HD11 LEU 46 HD11 LEU 46 9.124 8.903 -2.878
366 HD12 LEU 46 HD12 LEU 46 10.611 9.276 -3.760
367 HD13 LEU 46 HD13 LEU 46 9.584 7.942 -4.300
368 HD21 LEU 46 HD21 LEU 46 11.983 9.082 -1.794
369 HD22 LEU 46 HD22 LEU 46 10.645 8.632 -0.701
370 HD23 LEU 46 HD23 LEU 46 12.067 7.586 -0.860
371 H SER 47 HN SER 47 9.939 4.757 1.287
372 HA SER 47 HA SER 47 7.590 3.020 0.619
373 HG SER 47 HG SER 47 10.140 0.894 1.974
374 HB2 SER 47 HB2 SER 47 9.282 2.702 3.105
375 HB3 SER 47 HB3 SER 47 8.038 1.623 2.472
376 HA PRO 48 HA PRO 48 5.434 6.235 2.571
377 HB2 PRO 48 HB2 PRO 48 2.999 5.106 3.177
378 HB3 PRO 48 HB3 PRO 48 3.544 5.480 1.516
379 HG2 PRO 48 HG2 PRO 48 3.665 2.824 2.967
380 HG3 PRO 48 HG3 PRO 48 3.106 3.154 1.295
381 HD2 PRO 48 HD2 PRO 48 5.620 2.241 1.839
382 HD3 PRO 48 HD3 PRO 48 5.315 3.401 0.511
383 H LEU 49 HN LEU 49 4.696 7.083 4.485
384 HA LEU 49 HA LEU 49 5.095 5.521 7.019
385 HG LEU 49 HG LEU 49 7.500 6.870 5.548
386 HB2 LEU 49 HB2 LEU 49 5.729 8.440 6.419
387 HB3 LEU 49 HB3 LEU 49 5.864 7.682 8.001
388 HD11 LEU 49 HD11 LEU 49 8.062 9.130 6.238
389 HD12 LEU 49 HD12 LEU 49 8.232 8.614 7.930
390 HD13 LEU 49 HD13 LEU 49 9.362 8.020 6.694
391 HD21 LEU 49 HD21 LEU 49 7.745 6.093 8.489
392 HD22 LEU 49 HD22 LEU 49 7.293 5.021 7.144
393 HD23 LEU 49 HD23 LEU 49 8.921 5.702 7.216
394 H GLN 50 HN GLN 50 3.391 8.068 5.251
395 HA GLN 50 HA GLN 50 0.881 7.343 6.375
396 HB2 GLN 50 HB2 GLN 50 0.208 9.624 7.142
397 HB3 GLN 50 HB3 GLN 50 1.348 8.802 8.188
398 HG2 GLN 50 HG2 GLN 50 3.189 10.173 7.401
399 HG3 GLN 50 HG3 GLN 50 2.155 10.933 6.179
400 HE21 GLN 50 HE22 GLN 50 2.321 13.093 6.961
401 HE22 GLN 50 HE21 GLN 50 1.717 13.575 8.523
402 H ASN 51 HN ASN 51 -0.586 9.526 5.297
403 HA ASN 51 HA ASN 51 -0.927 8.618 2.761
404 HB2 ASN 51 HB2 ASN 51 -2.577 10.004 3.885
405 HB3 ASN 51 HB3 ASN 51 -1.521 11.417 3.801
406 HD21 ASN 51 HD22 ASN 51 -1.523 12.675 1.872
407 HD22 ASN 51 HD21 ASN 51 -2.450 12.244 0.463
408 H ALA 52 HN ALA 52 1.152 11.473 3.519
409 HA ALA 52 HA ALA 52 2.083 11.443 0.738
410 HB1 ALA 52 HB1 ALA 52 2.477 13.860 1.055
411 HB2 ALA 52 HB2 ALA 52 0.778 13.437 1.307
412 HB3 ALA 52 HB3 ALA 52 1.839 13.754 2.704
413 H LEU 53 HN LEU 53 3.176 11.064 4.100
414 HA LEU 53 HA LEU 53 5.887 11.858 3.395
415 HG LEU 53 HG LEU 53 4.693 13.132 5.742
416 HB2 LEU 53 HB2 LEU 53 4.762 10.590 5.889
417 HB3 LEU 53 HB3 LEU 53 6.490 10.687 5.595
418 HD11 LEU 53 HD11 LEU 53 6.628 11.963 7.797
419 HD12 LEU 53 HD12 LEU 53 5.724 13.484 7.957
420 HD13 LEU 53 HD13 LEU 53 4.858 11.944 7.920
421 HD21 LEU 53 HD21 LEU 53 7.741 12.829 5.672
422 HD22 LEU 53 HD22 LEU 53 6.729 13.565 4.419
423 HD23 LEU 53 HD23 LEU 53 6.877 14.344 5.993
424 H TYR 54 HN TYR 54 7.470 10.553 2.716
425 HA TYR 54 HA TYR 54 7.193 7.606 2.948
426 HD1 TYR 54 HD1 TYR 54 5.515 9.779 0.442
427 HD2 TYR 54 HD2 TYR 54 7.152 5.833 -0.044
428 HE1 TYR 54 HE1 TYR 54 3.427 9.054 -0.672
429 HE2 TYR 54 HE2 TYR 54 5.077 5.086 -1.142
430 HH TYR 54 HH TYR 54 2.305 7.281 -1.726
431 HB2 TYR 54 HB2 TYR 54 8.104 9.226 0.528
432 HB3 TYR 54 HB3 TYR 54 8.533 7.547 0.774
433 H CYS 55 HN CYS 55 9.176 6.620 3.436
434 HA CYS 55 HA CYS 55 11.302 8.320 4.526
435 HG CYS 55 HG CYS 55 9.660 4.819 3.827
436 HB2 CYS 55 HB2 CYS 55 12.457 6.187 4.938
437 HB3 CYS 55 HB3 CYS 55 10.837 6.230 5.659
438 H ILE 56 HN ILE 56 13.535 8.244 3.692
439 HA ILE 56 HA ILE 56 13.684 7.965 0.729
440 HB ILE 56 HB ILE 56 15.585 9.216 2.774
441 HG12 ILE 56 HG12 ILE 56 14.087 10.617 0.546
442 HG13 ILE 56 HG13 ILE 56 13.383 10.438 2.154
443 HG21 ILE 56 HG21 ILE 56 16.865 10.070 0.757
444 HG22 ILE 56 HG22 ILE 56 16.953 8.334 0.909
445 HG23 ILE 56 HG23 ILE 56 15.852 9.047 -0.272
446 HD11 ILE 56 HD11 ILE 56 14.466 12.654 1.824
447 HD12 ILE 56 HD12 ILE 56 15.112 11.740 3.185
448 HD13 ILE 56 HD13 ILE 56 16.028 11.858 1.671
449 H ASN 57 HN ASN 57 14.955 6.458 -0.160
450 HA ASN 57 HA ASN 57 16.582 5.016 -0.595
451 HB2 ASN 57 HB2 ASN 57 18.065 6.433 0.859
452 HB3 ASN 57 HB3 ASN 57 17.690 5.366 2.218
453 HD21 ASN 57 HD22 ASN 57 18.959 5.479 -1.102
454 HD22 ASN 57 HD21 ASN 57 20.006 4.066 -0.948
455 H ARG 58 HN ARG 58 15.188 4.579 2.551
456 HA ARG 58 HA ARG 58 13.637 2.527 2.588
457 HE ARG 58 HE ARG 58 17.476 -1.563 2.013
458 HB2 ARG 58 HB2 ARG 58 14.738 0.451 3.163
459 HB3 ARG 58 HB3 ARG 58 15.190 0.953 1.565
460 HG2 ARG 58 HG2 ARG 58 17.172 2.044 3.370
461 HG3 ARG 58 HG3 ARG 58 16.838 0.409 3.919
462 HD2 ARG 58 HD2 ARG 58 17.836 1.274 1.180
463 HD3 ARG 58 HD3 ARG 58 18.724 0.412 2.416
464 HH11 ARG 58 HH11 ARG 58 16.595 1.002 -0.298
465 HH12 ARG 58 HH12 ARG 58 16.252 -0.105 -1.588
466 HH21 ARG 58 HH21 ARG 58 16.847 -3.014 0.355
467 HH22 ARG 58 HH22 ARG 58 16.288 -2.431 -1.164
468 H GLU 59 HN GLU 59 15.742 4.665 4.204
469 HA GLU 59 HA GLU 59 15.371 3.310 6.815
470 HB2 GLU 59 HB2 GLU 59 17.087 4.645 7.702
471 HB3 GLU 59 HB3 GLU 59 17.673 3.739 6.299
472 HG2 GLU 59 HG2 GLU 59 17.386 5.874 4.927
473 HG3 GLU 59 HG3 GLU 59 17.085 6.728 6.447
474 H LYS 60 HN LYS 60 14.210 4.197 8.368
475 HA LYS 60 HA LYS 60 12.114 5.855 7.378
476 HB2 LYS 60 HB2 LYS 60 12.477 4.978 10.255
477 HB3 LYS 60 HB3 LYS 60 10.978 5.419 9.444
478 HG2 LYS 60 HG2 LYS 60 12.672 2.934 8.982
479 HG3 LYS 60 HG3 LYS 60 11.062 3.018 9.684
480 HD2 LYS 60 HD2 LYS 60 10.112 3.720 7.526
481 HD3 LYS 60 HD3 LYS 60 11.705 3.696 6.766
482 HE2 LYS 60 HE2 LYS 60 10.327 1.273 7.993
483 HE3 LYS 60 HE3 LYS 60 10.296 1.696 6.280
484 HZ1 LYS 60 HZ1 LYS 60 12.738 1.467 6.249
485 HZ2 LYS 60 HZ2 LYS 60 12.720 0.978 7.819
486 HZ3 LYS 60 HZ3 LYS 60 11.991 0.078 6.679
487 H LEU 61 HN LEU 61 14.938 6.727 9.233
488 HA LEU 61 HA LEU 61 13.809 9.033 10.438
489 HG LEU 61 HG LEU 61 14.882 7.448 12.010
490 HB2 LEU 61 HB2 LEU 61 16.759 8.440 9.876
491 HB3 LEU 61 HB3 LEU 61 16.114 9.635 10.987
492 HD11 LEU 61 HD11 LEU 61 15.909 5.811 10.466
493 HD12 LEU 61 HD12 LEU 61 17.528 6.377 10.926
494 HD13 LEU 61 HD13 LEU 61 16.487 5.562 12.110
495 HD21 LEU 61 HD21 LEU 61 17.751 8.294 12.620
496 HD22 LEU 61 HD22 LEU 61 16.277 9.043 13.273
497 HD23 LEU 61 HD23 LEU 61 16.682 7.378 13.709
498 H HIS 62 HN HIS 62 14.878 8.535 7.168
499 HA HIS 62 HA HIS 62 15.264 11.473 6.770
500 HD1 HIS 62 HD1 HIS 62 18.887 8.949 4.828
501 HD2 HIS 62 HD2 HIS 62 17.293 11.017 8.129
502 HE1 HIS 62 HE1 HIS 62 20.769 9.157 6.523
503 HB2 HIS 62 HB2 HIS 62 16.114 9.103 5.055
504 HB3 HIS 62 HB3 HIS 62 16.425 10.802 4.700
505 H THR 63 HN THR 63 13.468 12.477 5.750
506 HA THR 63 HA THR 63 11.521 10.674 4.433
507 HB THR 63 HB THR 63 9.864 12.110 5.637
508 HG1 THR 63 HG1 THR 63 10.631 13.451 7.267
509 HG21 THR 63 HG21 THR 63 10.079 11.006 7.761
510 HG22 THR 63 HG22 THR 63 10.750 9.896 6.555
511 HG23 THR 63 HG23 THR 63 11.838 10.831 7.595
512 H VAL 64 HN VAL 64 9.976 11.574 3.121
513 HA VAL 64 HA VAL 64 10.544 14.051 1.614
514 HB VAL 64 HB VAL 64 10.130 11.167 0.706
515 HG11 VAL 64 HG11 VAL 64 9.797 13.617 -1.034
516 HG12 VAL 64 HG12 VAL 64 9.903 11.945 -1.630
517 HG13 VAL 64 HG13 VAL 64 8.520 12.436 -0.646
518 HG21 VAL 64 HG21 VAL 64 12.110 11.471 -0.577
519 HG22 VAL 64 HG22 VAL 64 12.089 13.231 -0.363
520 HG23 VAL 64 HG23 VAL 64 12.437 12.195 1.011
521 H LYS 65 HN LYS 65 8.509 15.084 1.010
522 HA LYS 65 HA LYS 65 6.037 13.667 1.920
523 HB2 LYS 65 HB2 LYS 65 6.738 15.656 3.356
524 HB3 LYS 65 HB3 LYS 65 6.445 16.676 1.940
525 HG2 LYS 65 HG2 LYS 65 4.093 15.809 1.845
526 HG3 LYS 65 HG3 LYS 65 4.398 14.852 3.298
527 HD2 LYS 65 HD2 LYS 65 4.536 17.894 3.102
528 HD3 LYS 65 HD3 LYS 65 3.169 16.964 3.732
529 HE2 LYS 65 HE2 LYS 65 4.639 16.020 5.517
530 HE3 LYS 65 HE3 LYS 65 5.985 17.000 4.917
531 HZ1 LYS 65 HZ1 LYS 65 4.685 18.984 5.443
532 HZ2 LYS 65 HZ2 LYS 65 3.446 18.077 6.004
533 HZ3 LYS 65 HZ3 LYS 65 4.880 18.067 6.774
534 H VAL 66 HN VAL 66 4.634 13.326 0.280
535 HA VAL 66 HA VAL 66 5.224 14.214 -2.405
536 HB VAL 66 HB VAL 66 2.854 12.766 -1.133
537 HG11 VAL 66 HG11 VAL 66 2.187 12.167 -3.478
538 HG12 VAL 66 HG12 VAL 66 1.995 13.888 -3.156
539 HG13 VAL 66 HG13 VAL 66 3.387 13.317 -4.106
540 HG21 VAL 66 HG21 VAL 66 5.130 11.818 -2.951
541 HG22 VAL 66 HG22 VAL 66 4.993 11.494 -1.214
542 HG23 VAL 66 HG23 VAL 66 3.808 10.813 -2.331
543 H LEU 67 HN LEU 67 4.318 15.860 -3.601
544 HA LEU 67 HA LEU 67 2.429 17.713 -2.198
545 HG LEU 67 HG LEU 67 5.576 17.875 -2.058
546 HB2 LEU 67 HB2 LEU 67 4.532 18.351 -4.298
547 HB3 LEU 67 HB3 LEU 67 3.453 19.502 -3.525
548 HD11 LEU 67 HD11 LEU 67 5.613 20.783 -2.929
549 HD12 LEU 67 HD12 LEU 67 6.875 19.945 -1.991
550 HD13 LEU 67 HD13 LEU 67 6.550 19.467 -3.665
551 HD21 LEU 67 HD21 LEU 67 3.876 20.222 -1.113
552 HD22 LEU 67 HD22 LEU 67 3.767 18.542 -0.539
553 HD23 LEU 67 HD23 LEU 67 5.220 19.488 -0.211
554 H SER 68 HN SER 68 3.316 16.147 -5.319
555 HA SER 68 HA SER 68 0.555 15.810 -6.037
556 HG SER 68 HG SER 68 0.640 18.281 -5.827
557 HB2 SER 68 HB2 SER 68 2.296 17.752 -7.645
558 HB3 SER 68 HB3 SER 68 0.831 16.989 -8.285
559 H ALA 69 HN ALA 69 0.473 14.284 -7.936
560 HA ALA 69 HA ALA 69 2.960 13.546 -9.195
561 HB1 ALA 69 HB1 ALA 69 3.123 12.203 -7.112
562 HB2 ALA 69 HB2 ALA 69 1.533 11.476 -7.455
563 HB3 ALA 69 HB3 ALA 69 2.915 11.166 -8.532
564 H SER 70 HN SER 70 2.660 12.029 -10.930
565 HA SER 70 HA SER 70 -0.073 11.566 -11.966
566 HG SER 70 HG SER 70 0.504 14.923 -13.220
567 HB2 SER 70 HB2 SER 70 2.030 13.216 -13.447
568 HB3 SER 70 HB3 SER 70 0.415 12.792 -14.036
569 H SER 71 HN SER 71 0.058 10.252 -14.041
570 HA SER 71 HA SER 71 1.990 8.171 -14.058
571 HG SER 71 HG SER 71 -1.229 7.704 -15.616
572 HB2 SER 71 HB2 SER 71 0.322 9.222 -16.380
573 HB3 SER 71 HB3 SER 71 0.995 7.592 -16.193
574 H TYR 72 HN TYR 72 3.791 7.810 -15.550
575 HA TYR 72 HA TYR 72 5.371 10.181 -15.941
576 HD1 TYR 72 HD1 TYR 72 8.210 9.964 -15.865
577 HD2 TYR 72 HD2 TYR 72 6.723 7.363 -18.974
578 HE1 TYR 72 HE1 TYR 72 10.090 10.632 -17.310
579 HE2 TYR 72 HE2 TYR 72 8.618 8.018 -20.427
580 HH TYR 72 HH TYR 72 11.165 10.317 -19.362
581 HB2 TYR 72 HB2 TYR 72 6.493 8.135 -15.419
582 HB3 TYR 72 HB3 TYR 72 5.744 7.292 -16.777
583 H SER 73 HN SER 73 5.908 11.287 -17.796
584 HA SER 73 HA SER 73 5.468 10.217 -20.408
585 HG SER 73 HG SER 73 3.168 10.292 -19.610
586 HB2 SER 73 HB2 SER 73 3.936 12.667 -19.443
587 HB3 SER 73 HB3 SER 73 4.243 12.351 -21.165
588 HA PRO 74 HA PRO 74 9.345 12.166 -20.268
589 HB2 PRO 74 HB2 PRO 74 9.876 12.779 -22.952
590 HB3 PRO 74 HB3 PRO 74 10.057 11.170 -22.188
591 HG2 PRO 74 HG2 PRO 74 7.762 12.240 -23.832
592 HG3 PRO 74 HG3 PRO 74 8.497 10.606 -23.870
593 HD2 PRO 74 HD2 PRO 74 6.169 11.102 -22.555
594 HD3 PRO 74 HD3 PRO 74 7.379 9.960 -21.894
595 H ASP 75 HN ASP 75 7.263 14.009 -22.555
596 HA ASP 75 HA ASP 75 8.446 16.543 -22.208
597 HB2 ASP 75 HB2 ASP 75 6.875 16.166 -23.991
598 HB3 ASP 75 HB3 ASP 75 5.612 15.659 -22.869
599 H GLU 76 HN GLU 76 5.827 14.968 -20.349
600 HA GLU 76 HA GLU 76 5.292 17.272 -18.747
601 HB2 GLU 76 HB2 GLU 76 3.746 15.346 -19.355
602 HB3 GLU 76 HB3 GLU 76 4.577 14.377 -18.137
603 HG2 GLU 76 HG2 GLU 76 3.508 15.405 -16.419
604 HG3 GLU 76 HG3 GLU 76 3.676 17.015 -17.120
605 H TRP 77 HN TRP 77 7.486 14.501 -18.378
606 HA TRP 77 HA TRP 77 8.270 15.066 -15.659
607 HD1 TRP 77 HD1 TRP 77 11.840 12.828 -17.932
608 HE1 TRP 77 HE1 TRP 77 13.827 12.808 -16.323
609 HE3 TRP 77 HE3 TRP 77 9.457 14.479 -13.737
610 HZ2 TRP 77 HZ2 TRP 77 14.305 13.405 -13.519
611 HZ3 TRP 77 HZ3 TRP 77 10.677 14.649 -11.590
612 HH2 TRP 77 HH2 TRP 77 13.099 14.139 -11.470
613 HB2 TRP 77 HB2 TRP 77 8.753 12.898 -16.595
614 HB3 TRP 77 HB3 TRP 77 9.533 13.596 -17.986
615 H GLU 78 HN GLU 78 9.723 15.927 -18.887
616 HA GLU 78 HA GLU 78 11.792 17.450 -17.702
617 HB2 GLU 78 HB2 GLU 78 10.596 17.480 -20.500
618 HB3 GLU 78 HB3 GLU 78 12.003 18.453 -20.044
619 HG2 GLU 78 HG2 GLU 78 13.214 16.403 -19.340
620 HG3 GLU 78 HG3 GLU 78 11.864 15.413 -19.879
621 H ARG 79 HN ARG 79 8.556 18.461 -18.654
622 HA ARG 79 HA ARG 79 8.879 21.253 -18.121
623 HE ARG 79 HE ARG 79 4.204 21.229 -18.774
624 HB2 ARG 79 HB2 ARG 79 6.669 19.216 -18.110
625 HB3 ARG 79 HB3 ARG 79 6.329 20.810 -17.419
626 HG2 ARG 79 HG2 ARG 79 6.662 21.945 -19.461
627 HG3 ARG 79 HG3 ARG 79 7.580 20.612 -20.173
628 HD2 ARG 79 HD2 ARG 79 5.298 20.837 -21.145
629 HD3 ARG 79 HD3 ARG 79 5.668 19.262 -20.432
630 HH11 ARG 79 HH22 ARG 79 3.920 18.324 -20.875
631 HH12 ARG 79 HH21 ARG 79 2.599 17.677 -19.896
632 HH21 ARG 79 HH11 ARG 79 2.360 20.288 -17.641
633 HH22 ARG 79 HH12 ARG 79 1.766 18.734 -18.188
634 H GLN 80 HN GLN 80 7.819 18.544 -15.936
635 HA GLN 80 HA GLN 80 7.605 20.270 -13.689
636 HB2 GLN 80 HB2 GLN 80 7.754 17.250 -13.943
637 HB3 GLN 80 HB3 GLN 80 7.557 18.084 -12.390
638 HG2 GLN 80 HG2 GLN 80 5.505 19.126 -13.064
639 HG3 GLN 80 HG3 GLN 80 5.679 18.565 -14.726
640 HE21 GLN 80 HE22 GLN 80 5.429 16.322 -15.203
641 HE22 GLN 80 HE21 GLN 80 4.467 15.287 -14.146
642 H CYS 81 HN CYS 81 10.455 18.540 -14.975
643 HA CYS 81 HA CYS 81 12.174 18.637 -12.788
644 HG CYS 81 HG CYS 81 13.225 16.590 -13.900
645 HB2 CYS 81 HB2 CYS 81 12.778 19.347 -15.695
646 HB3 CYS 81 HB3 CYS 81 13.997 19.002 -14.463
647 H LYS 82 HN LYS 82 10.939 21.359 -14.679
648 HA LYS 82 HA LYS 82 12.948 23.258 -14.045
649 HB2 LYS 82 HB2 LYS 82 9.992 23.684 -14.662
650 HB3 LYS 82 HB3 LYS 82 11.219 24.954 -14.604
651 HG2 LYS 82 HG2 LYS 82 12.404 24.037 -16.485
652 HG3 LYS 82 HG3 LYS 82 11.409 22.580 -16.508
653 HD2 LYS 82 HD2 LYS 82 10.714 24.021 -18.300
654 HD3 LYS 82 HD3 LYS 82 9.421 23.936 -17.095
655 HE2 LYS 82 HE2 LYS 82 10.141 26.132 -16.168
656 HE3 LYS 82 HE3 LYS 82 11.458 26.202 -17.345
657 HZ1 LYS 82 HZ1 LYS 82 8.569 26.194 -18.017
658 HZ2 LYS 82 HZ2 LYS 82 9.551 27.490 -18.066
659 HZ3 LYS 82 HZ3 LYS 82 9.788 26.263 -19.108
660 H VAL 83 HN VAL 83 10.226 21.994 -12.154
661 HA VAL 83 HA VAL 83 9.862 24.290 -10.594
662 HB VAL 83 HB VAL 83 9.229 21.377 -9.968
663 HG11 VAL 83 HG11 VAL 83 9.119 22.654 -7.871
664 HG12 VAL 83 HG12 VAL 83 8.125 23.903 -8.658
665 HG13 VAL 83 HG13 VAL 83 7.493 22.262 -8.423
666 HG21 VAL 83 HG21 VAL 83 8.121 22.212 -12.036
667 HG22 VAL 83 HG22 VAL 83 6.950 21.958 -10.745
668 HG23 VAL 83 HG23 VAL 83 7.491 23.604 -11.136
669 H ALA 84 HN ALA 84 12.188 21.609 -10.242
670 HA ALA 84 HA ALA 84 12.929 22.276 -7.522
671 HB1 ALA 84 HB1 ALA 84 14.830 20.705 -7.998
672 HB2 ALA 84 HB2 ALA 84 13.248 20.011 -8.381
673 HB3 ALA 84 HB3 ALA 84 14.304 20.607 -9.685
674 H GLY 85 HN GLY 85 14.388 22.936 -10.752
675 HA2 GLY 85 HA2 GLY 85 16.608 24.406 -9.473
676 HA3 GLY 85 HA3 GLY 85 16.494 23.859 -11.147
677 H LYS 86 HN LYS 86 13.608 25.263 -10.874
678 HA LYS 86 HA LYS 86 12.660 27.049 -11.734
679 HB2 LYS 86 HB2 LYS 86 14.880 28.789 -10.598
680 HB3 LYS 86 HB3 LYS 86 13.253 29.282 -11.057
681 HG2 LYS 86 HG2 LYS 86 14.065 27.559 -8.687
682 HG3 LYS 86 HG3 LYS 86 13.370 29.179 -8.658
683 HD2 LYS 86 HD2 LYS 86 11.235 28.276 -9.587
684 HD3 LYS 86 HD3 LYS 86 11.942 26.648 -9.594
685 HE2 LYS 86 HE2 LYS 86 12.379 26.942 -7.100
686 HE3 LYS 86 HE3 LYS 86 11.359 28.390 -7.172
687 HZ1 LYS 86 HZ1 LYS 86 9.569 26.931 -8.029
688 HZ2 LYS 86 HZ2 LYS 86 10.558 25.619 -7.853
689 HZ3 LYS 86 HZ3 LYS 86 10.060 26.452 -6.537
690 H THR 87 HN THR 87 14.571 25.455 -13.105
691 HA THR 87 HA THR 87 15.090 26.911 -15.511
692 HB THR 87 HB THR 87 17.491 25.621 -14.138
693 HG1 THR 87 HG1 THR 87 17.005 27.216 -12.714
694 HG21 THR 87 HG21 THR 87 17.668 26.097 -16.551
695 HG22 THR 87 HG22 THR 87 17.273 27.806 -16.260
696 HG23 THR 87 HG23 THR 87 18.785 27.111 -15.630
697 H GLN 88 HN GLN 88 15.254 25.254 -17.200
698 HA GLN 88 HA GLN 88 14.388 22.597 -16.371
699 HB2 GLN 88 HB2 GLN 88 13.604 23.789 -18.471
700 HB3 GLN 88 HB3 GLN 88 15.208 23.520 -19.163
701 HG2 GLN 88 HG2 GLN 88 14.908 21.122 -19.107
702 HG3 GLN 88 HG3 GLN 88 13.508 21.257 -18.042
703 HE21 GLN 88 HE22 GLN 88 11.576 20.979 -19.027
704 HE22 GLN 88 HE21 GLN 88 11.211 21.380 -20.702
Start of MODEL 5
1 HA MET 1 HA MET 1 3.587 -1.205 -2.818
2 H1 MET 1 H1 MET 1 2.104 0.027 -0.614
3 H2 MET 1 H2 MET 1 1.791 -1.442 -1.293
4 H3 MET 1 H3 MET 1 3.202 -1.180 -0.474
5 HB2 MET 1 HB2 MET 1 1.392 -0.265 -3.534
6 HB3 MET 1 HB3 MET 1 1.854 1.304 -2.861
7 HG2 MET 1 HG2 MET 1 2.226 1.301 -5.253
8 HG3 MET 1 HG3 MET 1 3.782 1.401 -4.435
9 HE1 MET 1 HE1 MET 1 3.407 0.802 -7.526
10 HE2 MET 1 HE2 MET 1 4.995 0.901 -6.730
11 HE3 MET 1 HE3 MET 1 4.600 -0.487 -7.770
12 H GLU 2 HN GLU 2 5.597 -0.432 -3.189
13 HA GLU 2 HA GLU 2 6.560 1.969 -1.772
14 HB2 GLU 2 HB2 GLU 2 8.070 -0.686 -1.908
15 HB3 GLU 2 HB3 GLU 2 8.622 0.826 -1.197
16 HG2 GLU 2 HG2 GLU 2 7.987 -0.348 0.686
17 HG3 GLU 2 HG3 GLU 2 6.557 0.628 0.377
18 H TRP 3 HN TRP 3 8.350 2.912 -3.012
19 HA TRP 3 HA TRP 3 8.149 2.129 -5.882
20 HD1 TRP 3 HD1 TRP 3 6.127 4.586 -3.133
21 HE1 TRP 3 HE1 TRP 3 3.616 4.489 -3.585
22 HE3 TRP 3 HE3 TRP 3 6.247 3.801 -8.190
23 HZ2 TRP 3 HZ2 TRP 3 1.861 4.082 -5.862
24 HZ3 TRP 3 HZ3 TRP 3 4.145 3.558 -9.477
25 HH2 TRP 3 HH2 TRP 3 1.947 3.691 -8.322
26 HB2 TRP 3 HB2 TRP 3 8.247 4.936 -4.735
27 HB3 TRP 3 HB3 TRP 3 8.070 4.498 -6.421
28 H LEU 4 HN LEU 4 9.907 2.757 -7.220
29 HA LEU 4 HA LEU 4 12.534 3.060 -5.840
30 HG LEU 4 HG LEU 4 14.049 3.070 -8.614
31 HB2 LEU 4 HB2 LEU 4 12.269 1.036 -7.211
32 HB3 LEU 4 HB3 LEU 4 11.763 2.032 -8.583
33 HD11 LEU 4 HD11 LEU 4 14.673 0.898 -6.561
34 HD12 LEU 4 HD12 LEU 4 15.885 1.844 -7.451
35 HD13 LEU 4 HD13 LEU 4 14.800 2.652 -6.321
36 HD21 LEU 4 HD21 LEU 4 13.970 0.031 -8.875
37 HD22 LEU 4 HD22 LEU 4 13.400 1.185 -10.099
38 HD23 LEU 4 HD23 LEU 4 15.117 1.130 -9.672
39 H VAL 5 HN VAL 5 13.523 4.889 -6.170
40 HA VAL 5 HA VAL 5 12.524 7.035 -7.981
41 HB VAL 5 HB VAL 5 15.030 6.985 -6.232
42 HG11 VAL 5 HG11 VAL 5 15.133 8.673 -7.955
43 HG12 VAL 5 HG12 VAL 5 13.498 9.229 -7.559
44 HG13 VAL 5 HG13 VAL 5 14.834 9.458 -6.403
45 HG21 VAL 5 HG21 VAL 5 13.653 8.393 -4.625
46 HG22 VAL 5 HG22 VAL 5 12.208 7.979 -5.581
47 HG23 VAL 5 HG23 VAL 5 13.109 6.722 -4.720
48 H LYS 6 HN LYS 6 12.991 6.657 -10.017
49 HA LYS 6 HA LYS 6 15.536 5.396 -10.906
50 HB2 LYS 6 HB2 LYS 6 12.814 5.721 -12.052
51 HB3 LYS 6 HB3 LYS 6 14.168 5.506 -13.146
52 HG2 LYS 6 HG2 LYS 6 14.071 3.586 -10.857
53 HG3 LYS 6 HG3 LYS 6 12.785 3.429 -12.040
54 HD2 LYS 6 HD2 LYS 6 14.755 1.974 -12.490
55 HD3 LYS 6 HD3 LYS 6 14.288 3.019 -13.834
56 HE2 LYS 6 HE2 LYS 6 16.127 4.575 -13.347
57 HE3 LYS 6 HE3 LYS 6 16.574 3.633 -11.911
58 HZ1 LYS 6 HZ1 LYS 6 16.709 2.645 -14.704
59 HZ2 LYS 6 HZ2 LYS 6 17.981 3.098 -13.795
60 HZ3 LYS 6 HZ3 LYS 6 17.123 1.780 -13.380
61 H LYS 7 HN LYS 7 14.038 8.542 -10.688
62 HA LYS 7 HA LYS 7 16.360 9.793 -11.941
63 HB2 LYS 7 HB2 LYS 7 13.529 10.455 -12.842
64 HB3 LYS 7 HB3 LYS 7 14.909 11.510 -13.073
65 HG2 LYS 7 HG2 LYS 7 16.018 9.891 -14.514
66 HG3 LYS 7 HG3 LYS 7 14.721 8.718 -14.260
67 HD2 LYS 7 HD2 LYS 7 13.083 10.356 -15.242
68 HD3 LYS 7 HD3 LYS 7 14.443 11.448 -15.567
69 HE2 LYS 7 HE2 LYS 7 15.503 9.729 -16.984
70 HE3 LYS 7 HE3 LYS 7 14.181 8.608 -16.649
71 HZ1 LYS 7 HZ1 LYS 7 13.922 9.752 -18.784
72 HZ2 LYS 7 HZ2 LYS 7 12.672 10.130 -17.815
73 HZ3 LYS 7 HZ3 LYS 7 13.878 11.212 -18.058
74 H SER 8 HN SER 8 16.659 11.879 -10.927
75 HA SER 8 HA SER 8 14.678 12.879 -8.970
76 HG SER 8 HG SER 8 18.274 12.372 -8.851
77 HB2 SER 8 HB2 SER 8 16.661 13.046 -7.345
78 HB3 SER 8 HB3 SER 8 15.909 11.457 -7.565
79 H CYS 9 HN CYS 9 14.450 14.924 -9.710
80 HA CYS 9 HA CYS 9 16.387 16.244 -11.412
81 HG CYS 9 HG CYS 9 14.418 16.346 -13.125
82 HB2 CYS 9 HB2 CYS 9 13.888 17.294 -9.996
83 HB3 CYS 9 HB3 CYS 9 14.759 18.119 -11.296
84 H CYS 10 HN CYS 10 17.746 17.996 -10.908
85 HA CYS 10 HA CYS 10 18.563 18.446 -8.163
86 HG CYS 10 HG CYS 10 21.350 20.913 -9.551
87 HB2 CYS 10 HB2 CYS 10 20.016 18.784 -10.233
88 HB3 CYS 10 HB3 CYS 10 19.045 20.227 -10.595
89 H ASN 11 HN ASN 11 18.055 20.384 -6.897
90 HA ASN 11 HA ASN 11 15.641 21.878 -7.758
91 HB2 ASN 11 HB2 ASN 11 14.329 20.995 -6.026
92 HB3 ASN 11 HB3 ASN 11 15.083 19.576 -6.752
93 HD21 ASN 11 HD22 ASN 11 13.989 19.958 -3.989
94 HD22 ASN 11 HD21 ASN 11 15.314 19.594 -2.918
95 H LYS 12 HN LYS 12 18.580 22.405 -6.367
96 HA LYS 12 HA LYS 12 17.985 23.249 -3.783
97 HB2 LYS 12 HB2 LYS 12 20.262 23.160 -5.446
98 HB3 LYS 12 HB3 LYS 12 20.164 24.835 -4.938
99 HG2 LYS 12 HG2 LYS 12 20.125 22.397 -3.103
100 HG3 LYS 12 HG3 LYS 12 21.555 23.356 -3.454
101 HD2 LYS 12 HD2 LYS 12 19.071 24.299 -1.962
102 HD3 LYS 12 HD3 LYS 12 20.616 23.895 -1.243
103 HE2 LYS 12 HE2 LYS 12 20.141 26.195 -3.197
104 HE3 LYS 12 HE3 LYS 12 20.205 26.344 -1.444
105 HZ1 LYS 12 HZ1 LYS 12 22.469 25.461 -3.140
106 HZ2 LYS 12 HZ2 LYS 12 22.318 26.913 -2.420
107 HZ3 LYS 12 HZ3 LYS 12 22.504 25.579 -1.509
108 H GLN 13 HN GLN 13 17.332 25.053 -6.710
109 HA GLN 13 HA GLN 13 17.254 27.649 -5.479
110 HB2 GLN 13 HB2 GLN 13 15.765 26.662 -7.934
111 HB3 GLN 13 HB3 GLN 13 16.041 28.340 -7.497
112 HG2 GLN 13 HG2 GLN 13 18.176 26.321 -8.323
113 HG3 GLN 13 HG3 GLN 13 17.570 27.668 -9.274
114 HE21 GLN 13 HE22 GLN 13 18.018 29.920 -8.462
115 HE22 GLN 13 HE21 GLN 13 19.444 30.187 -7.492
116 H ASP 14 HN ASP 14 14.946 24.952 -5.448
117 HA ASP 14 HA ASP 14 12.911 26.785 -4.241
118 HB2 ASP 14 HB2 ASP 14 12.670 26.058 -6.776
119 HB3 ASP 14 HB3 ASP 14 12.097 24.540 -6.075
120 H ASN 15 HN ASN 15 14.609 23.820 -3.945
121 HA ASN 15 HA ASN 15 14.741 22.230 -2.511
122 HB2 ASN 15 HB2 ASN 15 14.570 24.047 -0.828
123 HB3 ASN 15 HB3 ASN 15 12.844 23.695 -0.676
124 HD21 ASN 15 HD22 ASN 15 12.254 21.985 0.641
125 HD22 ASN 15 HD21 ASN 15 13.357 20.805 1.334
126 H ARG 16 HN ARG 16 11.885 22.828 -4.046
127 HA ARG 16 HA ARG 16 10.513 20.338 -3.245
128 HE ARG 16 HE ARG 16 8.619 24.294 -5.302
129 HB2 ARG 16 HB2 ARG 16 10.053 22.277 -5.550
130 HB3 ARG 16 HB3 ARG 16 9.156 20.766 -5.323
131 HG2 ARG 16 HG2 ARG 16 8.467 21.546 -3.043
132 HG3 ARG 16 HG3 ARG 16 9.215 23.114 -3.375
133 HD2 ARG 16 HD2 ARG 16 7.075 21.837 -5.135
134 HD3 ARG 16 HD3 ARG 16 6.717 22.995 -3.837
135 HH11 ARG 16 HH11 ARG 16 5.608 22.762 -6.489
136 HH12 ARG 16 HH12 ARG 16 5.192 24.140 -7.454
137 HH21 ARG 16 HH21 ARG 16 8.241 25.840 -6.640
138 HH22 ARG 16 HH22 ARG 16 6.799 25.966 -7.634
139 H HIS 17 HN HIS 17 11.743 18.527 -3.662
140 HA HIS 17 HA HIS 17 13.350 18.260 -6.117
141 HD1 HIS 17 HD1 HIS 17 14.035 16.685 -2.013
142 HD2 HIS 17 HD2 HIS 17 15.865 16.657 -5.787
143 HE1 HIS 17 HE1 HIS 17 16.548 16.767 -1.580
144 HB2 HIS 17 HB2 HIS 17 12.446 16.263 -3.998
145 HB3 HIS 17 HB3 HIS 17 13.290 15.800 -5.464
146 H VAL 18 HN VAL 18 12.774 16.593 -7.723
147 HA VAL 18 HA VAL 18 9.990 15.684 -7.735
148 HB VAL 18 HB VAL 18 11.336 16.720 -10.240
149 HG11 VAL 18 HG11 VAL 18 9.260 16.396 -11.367
150 HG12 VAL 18 HG12 VAL 18 9.614 14.906 -10.530
151 HG13 VAL 18 HG13 VAL 18 8.402 16.015 -9.853
152 HG21 VAL 18 HG21 VAL 18 10.781 18.660 -8.792
153 HG22 VAL 18 HG22 VAL 18 9.734 18.621 -10.216
154 HG23 VAL 18 HG23 VAL 18 9.125 18.069 -8.645
155 H LEU 19 HN LEU 19 9.896 13.672 -8.544
156 HA LEU 19 HA LEU 19 12.394 12.406 -9.486
157 HG LEU 19 HG LEU 19 10.457 12.268 -6.153
158 HB2 LEU 19 HB2 LEU 19 11.465 10.494 -7.692
159 HB3 LEU 19 HB3 LEU 19 12.961 11.388 -7.646
160 HD11 LEU 19 HD11 LEU 19 11.267 10.054 -5.453
161 HD12 LEU 19 HD12 LEU 19 12.894 10.715 -5.199
162 HD13 LEU 19 HD13 LEU 19 11.530 11.271 -4.196
163 HD21 LEU 19 HD21 LEU 19 11.818 14.167 -6.122
164 HD22 LEU 19 HD22 LEU 19 12.493 13.327 -4.745
165 HD23 LEU 19 HD23 LEU 19 13.330 13.248 -6.314
166 H MET 20 HN MET 20 12.049 10.133 -10.135
167 HA MET 20 HA MET 20 9.391 9.914 -11.464
168 HB2 MET 20 HB2 MET 20 11.332 10.160 -12.977
169 HB3 MET 20 HB3 MET 20 12.024 8.667 -12.308
170 HG2 MET 20 HG2 MET 20 9.997 7.440 -13.109
171 HG3 MET 20 HG3 MET 20 9.348 8.958 -13.720
172 HE1 MET 20 HE1 MET 20 12.971 6.718 -15.538
173 HE2 MET 20 HE2 MET 20 13.039 7.468 -13.927
174 HE3 MET 20 HE3 MET 20 11.948 6.108 -14.214
175 H LEU 21 HN LEU 21 8.228 8.820 -10.026
176 HA LEU 21 HA LEU 21 9.377 6.786 -8.220
177 HG LEU 21 HG LEU 21 8.367 7.165 -6.129
178 HB2 LEU 21 HB2 LEU 21 6.738 8.255 -8.465
179 HB3 LEU 21 HB3 LEU 21 6.703 6.617 -7.817
180 HD11 LEU 21 HD11 LEU 21 8.789 9.686 -5.705
181 HD12 LEU 21 HD12 LEU 21 9.660 8.942 -7.056
182 HD13 LEU 21 HD13 LEU 21 8.232 9.939 -7.373
183 HD21 LEU 21 HD21 LEU 21 6.875 8.552 -4.712
184 HD22 LEU 21 HD22 LEU 21 5.947 9.026 -6.154
185 HD23 LEU 21 HD23 LEU 21 5.965 7.334 -5.620
186 H CYS 22 HN CYS 22 9.365 4.714 -8.688
187 HA CYS 22 HA CYS 22 7.721 3.734 -10.971
188 HG CYS 22 HG CYS 22 10.552 5.650 -10.927
189 HB2 CYS 22 HB2 CYS 22 10.663 3.152 -10.383
190 HB3 CYS 22 HB3 CYS 22 9.723 2.559 -11.761
191 H ASP 23 HN ASP 23 7.673 1.334 -11.036
192 HA ASP 23 HA ASP 23 7.001 0.021 -8.561
193 HB2 ASP 23 HB2 ASP 23 6.194 -1.093 -10.438
194 HB3 ASP 23 HB3 ASP 23 7.635 -0.757 -11.389
195 H ALA 24 HN ALA 24 8.301 -1.441 -7.293
196 HA ALA 24 HA ALA 24 11.088 -0.800 -6.963
197 HB1 ALA 24 HB1 ALA 24 9.674 -1.437 -5.073
198 HB2 ALA 24 HB2 ALA 24 9.390 -3.039 -5.794
199 HB3 ALA 24 HB3 ALA 24 11.021 -2.574 -5.261
200 H GLY 25 HN GLY 25 11.602 -1.142 -9.257
201 HA2 GLY 25 HA2 GLY 25 13.163 -3.193 -10.110
202 HA3 GLY 25 HA3 GLY 25 11.521 -3.834 -10.363
203 H GLY 26 HN GLY 26 10.877 -0.753 -10.775
204 HA2 GLY 26 HA2 GLY 26 10.990 0.843 -12.419
205 HA3 GLY 26 HA3 GLY 26 12.108 -0.159 -13.344
206 H ALA 27 HN ALA 27 9.318 -2.042 -12.579
207 HA ALA 27 HA ALA 27 8.734 -2.238 -15.371
208 HB1 ALA 27 HB1 ALA 27 7.067 -3.883 -14.671
209 HB2 ALA 27 HB2 ALA 27 8.558 -4.108 -13.741
210 HB3 ALA 27 HB3 ALA 27 7.151 -3.308 -12.996
211 H ILE 28 HN ILE 28 7.576 0.065 -13.167
212 HA ILE 28 HA ILE 28 5.344 0.952 -14.880
213 HB ILE 28 HB ILE 28 5.241 0.669 -11.832
214 HG12 ILE 28 HG12 ILE 28 4.869 -1.545 -12.874
215 HG13 ILE 28 HG13 ILE 28 3.499 -0.940 -11.972
216 HG21 ILE 28 HG21 ILE 28 2.863 1.425 -12.047
217 HG22 ILE 28 HG22 ILE 28 4.050 2.660 -12.453
218 HG23 ILE 28 HG23 ILE 28 3.179 1.816 -13.751
219 HD11 ILE 28 HD11 ILE 28 3.696 -0.800 -15.010
220 HD12 ILE 28 HD12 ILE 28 2.855 -2.062 -14.087
221 HD13 ILE 28 HD13 ILE 28 2.286 -0.389 -14.007
222 H LYS 29 HN LYS 29 5.343 3.356 -14.782
223 HA LYS 29 HA LYS 29 7.357 4.597 -12.999
224 HB2 LYS 29 HB2 LYS 29 7.360 4.977 -16.028
225 HB3 LYS 29 HB3 LYS 29 8.320 5.871 -14.845
226 HG2 LYS 29 HG2 LYS 29 9.256 3.550 -14.128
227 HG3 LYS 29 HG3 LYS 29 8.574 2.937 -15.627
228 HD2 LYS 29 HD2 LYS 29 10.033 4.284 -16.961
229 HD3 LYS 29 HD3 LYS 29 10.384 5.361 -15.623
230 HE2 LYS 29 HE2 LYS 29 12.350 4.056 -15.931
231 HE3 LYS 29 HE3 LYS 29 11.619 3.517 -14.433
232 HZ1 LYS 29 HZ1 LYS 29 10.721 1.580 -15.648
233 HZ2 LYS 29 HZ2 LYS 29 11.321 2.144 -17.066
234 HZ3 LYS 29 HZ3 LYS 29 12.335 1.668 -15.891
235 H MET 30 HN MET 30 6.837 6.598 -12.346
236 HA MET 30 HA MET 30 4.641 8.170 -13.530
237 HB2 MET 30 HB2 MET 30 4.893 7.475 -10.569
238 HB3 MET 30 HB3 MET 30 3.706 8.542 -11.305
239 HG2 MET 30 HG2 MET 30 3.128 6.343 -12.719
240 HG3 MET 30 HG3 MET 30 3.843 5.558 -11.311
241 HE1 MET 30 HE1 MET 30 2.657 8.140 -9.191
242 HE2 MET 30 HE2 MET 30 1.390 7.122 -8.483
243 HE3 MET 30 HE3 MET 30 3.012 6.448 -8.762
244 H ILE 31 HN ILE 31 4.704 10.396 -12.292
245 HA ILE 31 HA ILE 31 7.496 11.180 -11.593
246 HB ILE 31 HB ILE 31 5.399 12.827 -13.008
247 HG12 ILE 31 HG12 ILE 31 8.120 12.109 -14.162
248 HG13 ILE 31 HG13 ILE 31 6.789 10.965 -14.314
249 HG21 ILE 31 HG21 ILE 31 6.752 14.276 -11.572
250 HG22 ILE 31 HG22 ILE 31 8.252 13.491 -12.115
251 HG23 ILE 31 HG23 ILE 31 7.315 14.505 -13.219
252 HD11 ILE 31 HD11 ILE 31 6.905 12.402 -16.260
253 HD12 ILE 31 HD12 ILE 31 5.371 12.592 -15.375
254 HD13 ILE 31 HD13 ILE 31 6.635 13.831 -15.237
255 H ALA 32 HN ALA 32 7.561 12.346 -9.603
256 HA ALA 32 HA ALA 32 4.989 13.271 -8.477
257 HB1 ALA 32 HB1 ALA 32 5.556 12.459 -6.258
258 HB2 ALA 32 HB2 ALA 32 5.530 11.077 -7.376
259 HB3 ALA 32 HB3 ALA 32 7.083 11.781 -6.843
260 H GLU 33 HN GLU 33 5.179 15.256 -7.698
261 HA GLU 33 HA GLU 33 7.841 16.552 -7.500
262 HB2 GLU 33 HB2 GLU 33 5.992 17.716 -8.808
263 HB3 GLU 33 HB3 GLU 33 4.977 17.673 -7.359
264 HG2 GLU 33 HG2 GLU 33 6.781 19.056 -6.200
265 HG3 GLU 33 HG3 GLU 33 7.542 19.262 -7.766
266 H VAL 34 HN VAL 34 8.566 17.025 -5.401
267 HA VAL 34 HA VAL 34 6.836 16.323 -3.114
268 HB VAL 34 HB VAL 34 8.439 14.781 -2.245
269 HG11 VAL 34 HG11 VAL 34 8.083 13.859 -5.112
270 HG12 VAL 34 HG12 VAL 34 8.217 12.879 -3.635
271 HG13 VAL 34 HG13 VAL 34 6.773 13.852 -3.925
272 HG21 VAL 34 HG21 VAL 34 10.135 15.280 -4.714
273 HG22 VAL 34 HG22 VAL 34 10.548 15.645 -3.015
274 HG23 VAL 34 HG23 VAL 34 10.400 13.971 -3.553
275 H LYS 35 HN LYS 35 8.183 16.834 -1.012
276 HA LYS 35 HA LYS 35 10.288 18.862 -1.492
277 HB2 LYS 35 HB2 LYS 35 8.080 20.014 -0.863
278 HB3 LYS 35 HB3 LYS 35 8.206 19.215 0.706
279 HG2 LYS 35 HG2 LYS 35 10.434 20.294 1.016
280 HG3 LYS 35 HG3 LYS 35 10.267 21.108 -0.556
281 HD2 LYS 35 HD2 LYS 35 8.420 21.472 1.855
282 HD3 LYS 35 HD3 LYS 35 9.745 22.557 1.416
283 HE2 LYS 35 HE2 LYS 35 8.641 23.031 -0.766
284 HE3 LYS 35 HE3 LYS 35 7.293 21.979 -0.308
285 HZ1 LYS 35 HZ1 LYS 35 8.080 24.456 1.118
286 HZ2 LYS 35 HZ2 LYS 35 6.791 24.297 0.137
287 HZ3 LYS 35 HZ3 LYS 35 6.840 23.483 1.547
288 H SER 36 HN SER 36 11.916 18.727 0.050
289 HA SER 36 HA SER 36 11.835 16.295 1.790
290 HG SER 36 HG SER 36 12.427 15.028 -0.740
291 HB2 SER 36 HB2 SER 36 14.190 17.057 0.058
292 HB3 SER 36 HB3 SER 36 13.850 15.502 0.831
293 H ASP 37 HN ASP 37 13.277 16.284 3.522
294 HA ASP 37 HA ASP 37 14.632 18.879 4.162
295 HB2 ASP 37 HB2 ASP 37 12.781 18.199 5.674
296 HB3 ASP 37 HB3 ASP 37 13.653 16.713 6.048
297 H PHE 38 HN PHE 38 15.366 16.139 2.696
298 HA PHE 38 HA PHE 38 18.132 15.952 3.642
299 HD1 PHE 38 HD1 PHE 38 14.559 14.245 4.856
300 HD2 PHE 38 HD2 PHE 38 18.660 13.829 6.123
301 HE1 PHE 38 HE1 PHE 38 13.822 14.228 7.228
302 HE2 PHE 38 HE2 PHE 38 17.918 13.795 8.492
303 HZ PHE 38 HZ PHE 38 15.501 13.994 9.047
304 HB2 PHE 38 HB2 PHE 38 16.371 13.496 3.292
305 HB3 PHE 38 HB3 PHE 38 18.048 13.518 3.784
306 H ALA 39 HN ALA 39 19.397 14.735 1.926
307 HA ALA 39 HA ALA 39 18.549 15.313 -0.757
308 HB1 ALA 39 HB1 ALA 39 20.935 15.240 -0.114
309 HB2 ALA 39 HB2 ALA 39 20.782 13.510 0.284
310 HB3 ALA 39 HB3 ALA 39 20.585 14.060 -1.391
311 H VAL 40 HN VAL 40 17.946 13.795 -2.385
312 HA VAL 40 HA VAL 40 17.475 10.986 -1.751
313 HB VAL 40 HB VAL 40 15.347 11.797 -1.097
314 HG11 VAL 40 HG11 VAL 40 15.217 13.555 -3.572
315 HG12 VAL 40 HG12 VAL 40 13.878 13.263 -2.444
316 HG13 VAL 40 HG13 VAL 40 15.326 14.086 -1.877
317 HG21 VAL 40 HG21 VAL 40 13.789 10.865 -2.697
318 HG22 VAL 40 HG22 VAL 40 14.989 10.982 -4.002
319 HG23 VAL 40 HG23 VAL 40 15.244 9.868 -2.644
320 H LYS 41 HN LYS 41 17.827 9.759 -3.679
321 HA LYS 41 HA LYS 41 18.221 11.234 -6.173
322 HB2 LYS 41 HB2 LYS 41 20.467 10.943 -6.471
323 HB3 LYS 41 HB3 LYS 41 20.368 11.462 -4.803
324 HG2 LYS 41 HG2 LYS 41 20.822 8.634 -5.823
325 HG3 LYS 41 HG3 LYS 41 22.026 9.694 -5.112
326 HD2 LYS 41 HD2 LYS 41 20.950 9.598 -2.944
327 HD3 LYS 41 HD3 LYS 41 19.592 8.676 -3.606
328 HE2 LYS 41 HE2 LYS 41 22.417 7.612 -3.839
329 HE3 LYS 41 HE3 LYS 41 21.488 7.404 -2.348
330 HZ1 LYS 41 HZ1 LYS 41 20.515 6.495 -4.995
331 HZ2 LYS 41 HZ2 LYS 41 21.211 5.526 -3.861
332 HZ3 LYS 41 HZ3 LYS 41 19.788 6.282 -3.532
333 H VAL 42 HN VAL 42 18.902 9.738 -7.967
334 HA VAL 42 HA VAL 42 17.233 7.619 -8.337
335 HB VAL 42 HB VAL 42 20.044 7.921 -9.484
336 HG11 VAL 42 HG11 VAL 42 18.950 6.765 -11.496
337 HG12 VAL 42 HG12 VAL 42 19.212 5.729 -10.097
338 HG13 VAL 42 HG13 VAL 42 17.589 6.371 -10.415
339 HG21 VAL 42 HG21 VAL 42 18.625 9.018 -11.382
340 HG22 VAL 42 HG22 VAL 42 17.372 9.165 -10.116
341 HG23 VAL 42 HG23 VAL 42 18.952 9.956 -9.931
342 H GLY 43 HN GLY 43 17.263 5.410 -8.254
343 HA2 GLY 43 HA2 GLY 43 17.738 3.317 -7.516
344 HA3 GLY 43 HA3 GLY 43 19.373 3.830 -7.043
345 H ASP 44 HN ASP 44 16.292 5.419 -6.014
346 HA ASP 44 HA ASP 44 17.042 4.592 -3.180
347 HB2 ASP 44 HB2 ASP 44 15.745 7.151 -4.141
348 HB3 ASP 44 HB3 ASP 44 15.393 6.503 -2.554
349 H LEU 45 HN LEU 45 15.440 3.736 -1.814
350 HA LEU 45 HA LEU 45 12.958 2.872 -3.171
351 HG LEU 45 HG LEU 45 11.437 1.917 -0.819
352 HB2 LEU 45 HB2 LEU 45 14.355 1.380 -1.573
353 HB3 LEU 45 HB3 LEU 45 13.866 2.488 -0.293
354 HD11 LEU 45 HD11 LEU 45 10.993 -0.178 -2.035
355 HD12 LEU 45 HD12 LEU 45 11.741 1.004 -3.112
356 HD13 LEU 45 HD13 LEU 45 12.716 -0.323 -2.452
357 HD21 LEU 45 HD21 LEU 45 11.533 -0.243 0.357
358 HD22 LEU 45 HD22 LEU 45 13.291 -0.322 0.075
359 HD23 LEU 45 HD23 LEU 45 12.590 0.967 1.085
360 H LEU 46 HN LEU 46 10.920 3.648 -2.435
361 HA LEU 46 HA LEU 46 10.855 5.664 -0.259
362 HG LEU 46 HG LEU 46 11.414 6.890 -3.079
363 HB2 LEU 46 HB2 LEU 46 9.280 5.711 -2.857
364 HB3 LEU 46 HB3 LEU 46 8.877 6.668 -1.440
365 HD11 LEU 46 HD11 LEU 46 9.457 7.793 -4.208
366 HD12 LEU 46 HD12 LEU 46 8.975 8.705 -2.762
367 HD13 LEU 46 HD13 LEU 46 10.443 9.147 -3.642
368 HD21 LEU 46 HD21 LEU 46 11.982 7.463 -0.806
369 HD22 LEU 46 HD22 LEU 46 11.865 8.954 -1.735
370 HD23 LEU 46 HD23 LEU 46 10.541 8.482 -0.634
371 H SER 47 HN SER 47 9.878 4.702 1.352
372 HA SER 47 HA SER 47 7.617 2.816 0.832
373 HG SER 47 HG SER 47 10.240 0.993 2.416
374 HB2 SER 47 HB2 SER 47 9.422 2.975 3.275
375 HB3 SER 47 HB3 SER 47 8.164 1.767 2.948
376 HA PRO 48 HA PRO 48 5.343 6.193 2.526
377 HB2 PRO 48 HB2 PRO 48 2.922 5.047 3.172
378 HB3 PRO 48 HB3 PRO 48 3.469 5.334 1.496
379 HG2 PRO 48 HG2 PRO 48 3.647 2.770 3.103
380 HG3 PRO 48 HG3 PRO 48 3.075 2.984 1.417
381 HD2 PRO 48 HD2 PRO 48 5.611 2.161 1.990
382 HD3 PRO 48 HD3 PRO 48 5.280 3.254 0.610
383 H LEU 49 HN LEU 49 4.595 7.155 4.370
384 HA LEU 49 HA LEU 49 4.926 5.731 6.996
385 HG LEU 49 HG LEU 49 7.402 6.705 5.916
386 HB2 LEU 49 HB2 LEU 49 5.638 8.555 6.109
387 HB3 LEU 49 HB3 LEU 49 5.483 8.123 7.805
388 HD11 LEU 49 HD11 LEU 49 7.919 9.066 7.772
389 HD12 LEU 49 HD12 LEU 49 9.165 8.123 6.918
390 HD13 LEU 49 HD13 LEU 49 7.989 9.072 5.996
391 HD21 LEU 49 HD21 LEU 49 8.521 6.089 8.097
392 HD22 LEU 49 HD22 LEU 49 7.176 6.849 8.969
393 HD23 LEU 49 HD23 LEU 49 6.895 5.418 7.951
394 H GLN 50 HN GLN 50 3.270 8.222 5.091
395 HA GLN 50 HA GLN 50 0.720 7.565 6.206
396 HB2 GLN 50 HB2 GLN 50 0.119 9.902 6.888
397 HB3 GLN 50 HB3 GLN 50 1.243 9.089 7.960
398 HG2 GLN 50 HG2 GLN 50 3.131 10.363 7.040
399 HG3 GLN 50 HG3 GLN 50 2.057 11.143 5.869
400 HE21 GLN 50 HE22 GLN 50 1.954 13.299 6.542
401 HE22 GLN 50 HE21 GLN 50 1.601 13.800 8.173
402 H ASN 51 HN ASN 51 -0.690 9.724 5.038
403 HA ASN 51 HA ASN 51 -1.002 8.748 2.517
404 HB2 ASN 51 HB2 ASN 51 -2.658 10.178 3.586
405 HB3 ASN 51 HB3 ASN 51 -1.588 11.579 3.480
406 HD21 ASN 51 HD22 ASN 51 -1.475 12.744 1.480
407 HD22 ASN 51 HD21 ASN 51 -2.423 12.304 0.088
408 H ALA 52 HN ALA 52 1.141 11.550 3.280
409 HA ALA 52 HA ALA 52 2.061 11.508 0.498
410 HB1 ALA 52 HB1 ALA 52 0.754 13.499 1.030
411 HB2 ALA 52 HB2 ALA 52 1.791 13.833 2.439
412 HB3 ALA 52 HB3 ALA 52 2.452 13.929 0.796
413 H LEU 53 HN LEU 53 3.184 11.137 3.866
414 HA LEU 53 HA LEU 53 5.881 11.915 3.041
415 HG LEU 53 HG LEU 53 6.813 13.167 4.567
416 HB2 LEU 53 HB2 LEU 53 4.749 11.230 5.727
417 HB3 LEU 53 HB3 LEU 53 6.405 10.753 5.385
418 HD11 LEU 53 HD11 LEU 53 4.412 13.858 4.585
419 HD12 LEU 53 HD12 LEU 53 4.389 13.649 6.350
420 HD13 LEU 53 HD13 LEU 53 5.431 14.884 5.613
421 HD21 LEU 53 HD21 LEU 53 7.808 12.151 6.566
422 HD22 LEU 53 HD22 LEU 53 7.429 13.858 6.818
423 HD23 LEU 53 HD23 LEU 53 6.379 12.601 7.521
424 H TYR 54 HN TYR 54 7.556 10.584 2.736
425 HA TYR 54 HA TYR 54 7.171 7.655 2.997
426 HD1 TYR 54 HD1 TYR 54 5.817 9.985 0.352
427 HD2 TYR 54 HD2 TYR 54 6.945 5.840 0.046
428 HE1 TYR 54 HE1 TYR 54 3.627 9.469 -0.677
429 HE2 TYR 54 HE2 TYR 54 4.779 5.312 -1.004
430 HH TYR 54 HH TYR 54 2.692 6.148 -1.673
431 HB2 TYR 54 HB2 TYR 54 8.279 9.133 0.568
432 HB3 TYR 54 HB3 TYR 54 8.515 7.423 0.864
433 H CYS 55 HN CYS 55 9.033 6.580 3.524
434 HA CYS 55 HA CYS 55 11.300 7.919 4.740
435 HG CYS 55 HG CYS 55 10.352 4.008 5.854
436 HB2 CYS 55 HB2 CYS 55 11.077 5.070 3.614
437 HB3 CYS 55 HB3 CYS 55 12.170 5.623 4.875
438 H ILE 56 HN ILE 56 13.294 8.392 3.680
439 HA ILE 56 HA ILE 56 13.446 7.961 0.744
440 HB ILE 56 HB ILE 56 15.300 9.401 2.677
441 HG12 ILE 56 HG12 ILE 56 13.567 10.603 0.474
442 HG13 ILE 56 HG13 ILE 56 13.024 10.473 2.149
443 HG21 ILE 56 HG21 ILE 56 16.475 10.235 0.616
444 HG22 ILE 56 HG22 ILE 56 16.649 8.512 0.786
445 HG23 ILE 56 HG23 ILE 56 15.476 9.154 -0.367
446 HD11 ILE 56 HD11 ILE 56 14.816 11.875 2.944
447 HD12 ILE 56 HD12 ILE 56 15.473 12.052 1.300
448 HD13 ILE 56 HD13 ILE 56 13.888 12.707 1.690
449 H ASN 57 HN ASN 57 14.875 6.567 -0.130
450 HA ASN 57 HA ASN 57 16.559 5.196 -0.518
451 HB2 ASN 57 HB2 ASN 57 17.934 6.705 0.947
452 HB3 ASN 57 HB3 ASN 57 17.572 5.652 2.321
453 HD21 ASN 57 HD22 ASN 57 18.921 5.716 -0.979
454 HD22 ASN 57 HD21 ASN 57 20.066 4.400 -0.728
455 H ARG 58 HN ARG 58 15.199 4.606 2.639
456 HA ARG 58 HA ARG 58 13.778 2.477 2.625
457 HE ARG 58 HE ARG 58 17.253 1.403 0.331
458 HB2 ARG 58 HB2 ARG 58 14.967 0.389 2.964
459 HB3 ARG 58 HB3 ARG 58 15.309 1.048 1.400
460 HG2 ARG 58 HG2 ARG 58 17.471 2.073 2.670
461 HG3 ARG 58 HG3 ARG 58 17.096 0.813 3.842
462 HD2 ARG 58 HD2 ARG 58 18.724 -0.044 2.284
463 HD3 ARG 58 HD3 ARG 58 17.185 -0.878 1.974
464 HH11 ARG 58 HH21 ARG 58 19.071 -1.638 0.595
465 HH12 ARG 58 HH22 ARG 58 19.514 -1.684 -1.071
466 HH21 ARG 58 HH11 ARG 58 17.840 1.356 -1.867
467 HH22 ARG 58 HH12 ARG 58 18.790 0.069 -2.510
468 H GLU 59 HN GLU 59 15.124 4.810 4.322
469 HA GLU 59 HA GLU 59 14.887 3.345 6.896
470 HB2 GLU 59 HB2 GLU 59 16.664 4.589 7.856
471 HB3 GLU 59 HB3 GLU 59 17.257 3.679 6.463
472 HG2 GLU 59 HG2 GLU 59 17.143 5.810 5.099
473 HG3 GLU 59 HG3 GLU 59 16.715 6.683 6.576
474 H LYS 60 HN LYS 60 13.826 4.382 8.496
475 HA LYS 60 HA LYS 60 11.787 6.118 7.540
476 HB2 LYS 60 HB2 LYS 60 12.451 5.290 10.396
477 HB3 LYS 60 HB3 LYS 60 10.958 6.086 9.882
478 HG2 LYS 60 HG2 LYS 60 10.500 4.160 8.333
479 HG3 LYS 60 HG3 LYS 60 11.892 3.314 9.015
480 HD2 LYS 60 HD2 LYS 60 9.428 4.240 10.558
481 HD3 LYS 60 HD3 LYS 60 9.736 2.592 9.992
482 HE2 LYS 60 HE2 LYS 60 11.795 2.494 11.396
483 HE3 LYS 60 HE3 LYS 60 11.454 4.121 12.000
484 HZ1 LYS 60 HZ1 LYS 60 10.670 2.431 13.527
485 HZ2 LYS 60 HZ2 LYS 60 9.393 3.263 12.954
486 HZ3 LYS 60 HZ3 LYS 60 9.711 1.758 12.397
487 H LEU 61 HN LEU 61 14.816 6.892 9.109
488 HA LEU 61 HA LEU 61 13.947 9.248 10.421
489 HG LEU 61 HG LEU 61 16.113 6.728 10.761
490 HB2 LEU 61 HB2 LEU 61 16.757 8.636 9.384
491 HB3 LEU 61 HB3 LEU 61 16.331 9.766 10.664
492 HD11 LEU 61 HD11 LEU 61 17.902 8.682 12.259
493 HD12 LEU 61 HD12 LEU 61 17.883 6.910 12.445
494 HD13 LEU 61 HD13 LEU 61 18.387 7.634 10.906
495 HD21 LEU 61 HD21 LEU 61 15.500 7.034 13.156
496 HD22 LEU 61 HD22 LEU 61 15.345 8.786 12.871
497 HD23 LEU 61 HD23 LEU 61 14.266 7.637 12.044
498 H HIS 62 HN HIS 62 15.334 8.684 7.223
499 HA HIS 62 HA HIS 62 15.386 11.566 6.572
500 HD1 HIS 62 HD1 HIS 62 18.796 9.147 4.254
501 HD2 HIS 62 HD2 HIS 62 17.474 10.962 7.816
502 HE1 HIS 62 HE1 HIS 62 20.842 9.379 5.745
503 HB2 HIS 62 HB2 HIS 62 16.016 9.102 4.897
504 HB3 HIS 62 HB3 HIS 62 16.266 10.779 4.411
505 H THR 63 HN THR 63 13.441 12.512 5.847
506 HA THR 63 HA THR 63 11.474 10.737 4.522
507 HB THR 63 HB THR 63 9.820 12.178 5.733
508 HG1 THR 63 HG1 THR 63 10.590 13.458 7.415
509 HG21 THR 63 HG21 THR 63 11.779 10.795 7.621
510 HG22 THR 63 HG22 THR 63 10.026 11.005 7.834
511 HG23 THR 63 HG23 THR 63 10.643 9.931 6.565
512 H VAL 64 HN VAL 64 9.965 11.721 3.143
513 HA VAL 64 HA VAL 64 10.534 14.388 2.022
514 HB VAL 64 HB VAL 64 11.878 12.908 0.680
515 HG11 VAL 64 HG11 VAL 64 11.047 10.943 -0.529
516 HG12 VAL 64 HG12 VAL 64 10.944 10.687 1.210
517 HG13 VAL 64 HG13 VAL 64 9.479 11.080 0.290
518 HG21 VAL 64 HG21 VAL 64 11.002 13.168 -1.505
519 HG22 VAL 64 HG22 VAL 64 9.329 13.222 -0.913
520 HG23 VAL 64 HG23 VAL 64 10.440 14.562 -0.565
521 H LYS 65 HN LYS 65 8.544 15.283 1.112
522 HA LYS 65 HA LYS 65 6.088 13.690 1.737
523 HB2 LYS 65 HB2 LYS 65 6.399 15.538 3.334
524 HB3 LYS 65 HB3 LYS 65 6.557 16.689 1.991
525 HG2 LYS 65 HG2 LYS 65 4.283 16.113 1.235
526 HG3 LYS 65 HG3 LYS 65 4.097 14.977 2.570
527 HD2 LYS 65 HD2 LYS 65 4.230 16.866 4.159
528 HD3 LYS 65 HD3 LYS 65 4.492 17.997 2.821
529 HE2 LYS 65 HE2 LYS 65 2.024 16.230 3.208
530 HE3 LYS 65 HE3 LYS 65 2.116 17.940 3.619
531 HZ1 LYS 65 HZ1 LYS 65 1.070 17.581 1.470
532 HZ2 LYS 65 HZ2 LYS 65 2.425 18.459 1.294
533 HZ3 LYS 65 HZ3 LYS 65 2.408 16.875 0.849
534 H VAL 66 HN VAL 66 4.691 13.419 0.098
535 HA VAL 66 HA VAL 66 5.285 14.372 -2.566
536 HB VAL 66 HB VAL 66 2.974 12.811 -1.324
537 HG11 VAL 66 HG11 VAL 66 2.317 12.212 -3.660
538 HG12 VAL 66 HG12 VAL 66 2.067 13.924 -3.331
539 HG13 VAL 66 HG13 VAL 66 3.474 13.402 -4.291
540 HG21 VAL 66 HG21 VAL 66 5.280 11.981 -3.161
541 HG22 VAL 66 HG22 VAL 66 5.159 11.621 -1.430
542 HG23 VAL 66 HG23 VAL 66 3.999 10.917 -2.558
543 H LEU 67 HN LEU 67 4.255 15.897 -3.783
544 HA LEU 67 HA LEU 67 2.379 17.761 -2.376
545 HG LEU 67 HG LEU 67 5.622 17.972 -2.502
546 HB2 LEU 67 HB2 LEU 67 4.350 18.399 -4.599
547 HB3 LEU 67 HB3 LEU 67 3.319 19.538 -3.744
548 HD11 LEU 67 HD11 LEU 67 6.345 19.637 -4.150
549 HD12 LEU 67 HD12 LEU 67 5.435 20.897 -3.285
550 HD13 LEU 67 HD13 LEU 67 6.820 20.077 -2.523
551 HD21 LEU 67 HD21 LEU 67 5.415 19.483 -0.583
552 HD22 LEU 67 HD22 LEU 67 3.953 20.210 -1.300
553 HD23 LEU 67 HD23 LEU 67 3.961 18.505 -0.790
554 H SER 68 HN SER 68 3.281 16.188 -5.496
555 HA SER 68 HA SER 68 0.521 15.679 -6.138
556 HG SER 68 HG SER 68 0.498 18.142 -5.985
557 HB2 SER 68 HB2 SER 68 2.142 17.639 -7.843
558 HB3 SER 68 HB3 SER 68 0.686 16.807 -8.414
559 H ALA 69 HN ALA 69 0.467 14.111 -7.995
560 HA ALA 69 HA ALA 69 2.978 13.378 -9.232
561 HB1 ALA 69 HB1 ALA 69 2.920 11.010 -8.500
562 HB2 ALA 69 HB2 ALA 69 3.125 12.090 -7.110
563 HB3 ALA 69 HB3 ALA 69 1.536 11.359 -7.441
564 H SER 70 HN SER 70 2.694 11.950 -11.005
565 HA SER 70 HA SER 70 -0.020 11.267 -11.951
566 HG SER 70 HG SER 70 0.120 14.688 -13.176
567 HB2 SER 70 HB2 SER 70 1.812 13.170 -13.489
568 HB3 SER 70 HB3 SER 70 0.237 12.567 -14.021
569 H SER 71 HN SER 71 0.109 9.826 -13.865
570 HA SER 71 HA SER 71 2.230 8.043 -14.095
571 HG SER 71 HG SER 71 -1.032 7.315 -15.450
572 HB2 SER 71 HB2 SER 71 0.363 8.921 -16.331
573 HB3 SER 71 HB3 SER 71 1.160 7.347 -16.147
574 H TYR 72 HN TYR 72 3.978 7.804 -15.655
575 HA TYR 72 HA TYR 72 5.394 10.264 -15.944
576 HD1 TYR 72 HD1 TYR 72 8.307 9.952 -15.521
577 HD2 TYR 72 HD2 TYR 72 7.026 8.074 -19.183
578 HE1 TYR 72 HE1 TYR 72 10.265 10.901 -16.677
579 HE2 TYR 72 HE2 TYR 72 9.015 8.982 -20.342
580 HH TYR 72 HH TYR 72 10.985 10.223 -20.125
581 HB2 TYR 72 HB2 TYR 72 6.564 8.174 -15.525
582 HB3 TYR 72 HB3 TYR 72 5.976 7.491 -17.041
583 H SER 73 HN SER 73 5.809 11.550 -17.635
584 HA SER 73 HA SER 73 5.389 10.725 -20.361
585 HG SER 73 HG SER 73 2.144 12.235 -20.096
586 HB2 SER 73 HB2 SER 73 4.029 13.199 -19.204
587 HB3 SER 73 HB3 SER 73 4.182 12.854 -20.935
588 HA PRO 74 HA PRO 74 9.311 12.663 -20.073
589 HB2 PRO 74 HB2 PRO 74 9.738 13.523 -22.717
590 HB3 PRO 74 HB3 PRO 74 10.035 11.872 -22.078
591 HG2 PRO 74 HG2 PRO 74 7.667 12.934 -23.612
592 HG3 PRO 74 HG3 PRO 74 8.455 11.332 -23.746
593 HD2 PRO 74 HD2 PRO 74 6.125 11.693 -22.382
594 HD3 PRO 74 HD3 PRO 74 7.366 10.535 -21.814
595 H ASP 75 HN ASP 75 7.061 14.604 -22.096
596 HA ASP 75 HA ASP 75 8.272 17.111 -21.663
597 HB2 ASP 75 HB2 ASP 75 6.577 16.740 -23.385
598 HB3 ASP 75 HB3 ASP 75 5.346 16.443 -22.152
599 H GLU 76 HN GLU 76 5.746 15.433 -19.741
600 HA GLU 76 HA GLU 76 5.348 17.572 -17.890
601 HB2 GLU 76 HB2 GLU 76 4.834 14.590 -17.565
602 HB3 GLU 76 HB3 GLU 76 4.233 15.841 -16.492
603 HG2 GLU 76 HG2 GLU 76 3.508 15.508 -19.433
604 HG3 GLU 76 HG3 GLU 76 2.508 15.067 -18.055
605 H TRP 77 HN TRP 77 7.662 14.841 -17.984
606 HA TRP 77 HA TRP 77 8.668 15.177 -15.316
607 HD1 TRP 77 HD1 TRP 77 11.176 14.428 -14.385
608 HE1 TRP 77 HE1 TRP 77 13.715 14.215 -14.576
609 HE3 TRP 77 HE3 TRP 77 11.501 13.342 -19.370
610 HZ2 TRP 77 HZ2 TRP 77 15.668 13.759 -16.678
611 HZ3 TRP 77 HZ3 TRP 77 13.712 13.058 -20.454
612 HH2 TRP 77 HH2 TRP 77 15.802 13.270 -19.119
613 HB2 TRP 77 HB2 TRP 77 9.225 13.149 -16.313
614 HB3 TRP 77 HB3 TRP 77 9.593 13.864 -17.863
615 H GLU 78 HN GLU 78 9.793 16.454 -18.521
616 HA GLU 78 HA GLU 78 11.865 18.002 -17.315
617 HB2 GLU 78 HB2 GLU 78 10.521 18.217 -20.036
618 HB3 GLU 78 HB3 GLU 78 11.928 19.175 -19.541
619 HG2 GLU 78 HG2 GLU 78 13.166 17.047 -19.045
620 HG3 GLU 78 HG3 GLU 78 11.812 16.130 -19.690
621 H ARG 79 HN ARG 79 8.497 18.825 -18.120
622 HA ARG 79 HA ARG 79 8.506 21.561 -17.443
623 HE ARG 79 HE ARG 79 3.574 22.719 -16.475
624 HB2 ARG 79 HB2 ARG 79 6.641 20.324 -18.467
625 HB3 ARG 79 HB3 ARG 79 6.460 19.361 -17.003
626 HG2 ARG 79 HG2 ARG 79 5.854 21.515 -15.769
627 HG3 ARG 79 HG3 ARG 79 5.838 22.315 -17.360
628 HD2 ARG 79 HD2 ARG 79 4.160 20.597 -18.134
629 HD3 ARG 79 HD3 ARG 79 4.195 19.887 -16.513
630 HH11 ARG 79 HH11 ARG 79 2.131 19.489 -16.960
631 HH12 ARG 79 HH12 ARG 79 0.536 20.008 -16.518
632 HH21 ARG 79 HH21 ARG 79 1.456 23.377 -15.883
633 HH22 ARG 79 HH22 ARG 79 0.150 22.255 -15.895
634 H GLN 80 HN GLN 80 7.915 18.704 -15.260
635 HA GLN 80 HA GLN 80 7.785 20.370 -12.946
636 HB2 GLN 80 HB2 GLN 80 8.166 17.377 -13.293
637 HB3 GLN 80 HB3 GLN 80 7.973 18.181 -11.716
638 HG2 GLN 80 HG2 GLN 80 5.794 18.978 -12.233
639 HG3 GLN 80 HG3 GLN 80 5.942 18.546 -13.934
640 HE21 GLN 80 HE22 GLN 80 5.665 16.428 -14.617
641 HE22 GLN 80 HE21 GLN 80 4.867 15.234 -13.595
642 H CYS 81 HN CYS 81 10.541 18.790 -14.583
643 HA CYS 81 HA CYS 81 12.490 19.268 -12.587
644 HG CYS 81 HG CYS 81 15.236 18.299 -15.297
645 HB2 CYS 81 HB2 CYS 81 12.722 17.892 -14.716
646 HB3 CYS 81 HB3 CYS 81 12.903 19.424 -15.598
647 H LYS 82 HN LYS 82 11.039 21.536 -15.002
648 HA LYS 82 HA LYS 82 12.893 23.654 -14.463
649 HB2 LYS 82 HB2 LYS 82 10.018 23.751 -15.488
650 HB3 LYS 82 HB3 LYS 82 11.065 25.146 -15.347
651 HG2 LYS 82 HG2 LYS 82 12.577 24.343 -17.031
652 HG3 LYS 82 HG3 LYS 82 11.866 22.734 -16.992
653 HD2 LYS 82 HD2 LYS 82 11.064 23.649 -18.955
654 HD3 LYS 82 HD3 LYS 82 9.696 23.722 -17.868
655 HE2 LYS 82 HE2 LYS 82 11.534 26.067 -18.584
656 HE3 LYS 82 HE3 LYS 82 10.012 25.696 -19.378
657 HZ1 LYS 82 HZ1 LYS 82 9.564 27.357 -17.829
658 HZ2 LYS 82 HZ2 LYS 82 8.919 26.019 -17.171
659 HZ3 LYS 82 HZ3 LYS 82 10.340 26.653 -16.600
660 H VAL 83 HN VAL 83 9.665 22.723 -13.182
661 HA VAL 83 HA VAL 83 9.400 24.885 -11.454
662 HB VAL 83 HB VAL 83 8.258 22.071 -11.195
663 HG11 VAL 83 HG11 VAL 83 8.028 23.208 -9.034
664 HG12 VAL 83 HG12 VAL 83 7.356 24.645 -9.838
665 HG13 VAL 83 HG13 VAL 83 6.462 23.107 -9.839
666 HG21 VAL 83 HG21 VAL 83 7.065 24.625 -12.376
667 HG22 VAL 83 HG22 VAL 83 7.622 23.229 -13.313
668 HG23 VAL 83 HG23 VAL 83 6.242 23.057 -12.231
669 H ALA 84 HN ALA 84 11.013 21.743 -10.874
670 HA ALA 84 HA ALA 84 11.652 21.937 -8.170
671 HB1 ALA 84 HB1 ALA 84 13.558 20.938 -10.322
672 HB2 ALA 84 HB2 ALA 84 13.417 20.390 -8.645
673 HB3 ALA 84 HB3 ALA 84 12.128 20.031 -9.814
674 H GLY 85 HN GLY 85 13.085 23.791 -10.849
675 HA2 GLY 85 HA2 GLY 85 15.159 24.868 -8.984
676 HA3 GLY 85 HA3 GLY 85 15.474 24.407 -10.648
677 H LYS 86 HN LYS 86 12.421 26.034 -10.040
678 HA LYS 86 HA LYS 86 11.594 27.967 -10.894
679 HB2 LYS 86 HB2 LYS 86 14.201 29.231 -9.966
680 HB3 LYS 86 HB3 LYS 86 12.697 30.063 -10.347
681 HG2 LYS 86 HG2 LYS 86 11.588 28.863 -8.435
682 HG3 LYS 86 HG3 LYS 86 13.175 28.179 -8.002
683 HD2 LYS 86 HD2 LYS 86 14.102 30.501 -7.867
684 HD3 LYS 86 HD3 LYS 86 12.504 31.158 -8.200
685 HE2 LYS 86 HE2 LYS 86 13.314 29.524 -5.756
686 HE3 LYS 86 HE3 LYS 86 13.099 31.274 -5.822
687 HZ1 LYS 86 HZ1 LYS 86 11.030 29.189 -5.991
688 HZ2 LYS 86 HZ2 LYS 86 11.145 30.412 -4.934
689 HZ3 LYS 86 HZ3 LYS 86 10.720 30.748 -6.473
690 H THR 87 HN THR 87 12.459 26.374 -12.844
691 HA THR 87 HA THR 87 13.256 26.126 -14.911
692 HB THR 87 HB THR 87 12.833 29.116 -15.195
693 HG1 THR 87 HG1 THR 87 10.986 28.094 -14.524
694 HG21 THR 87 HG21 THR 87 13.026 26.856 -17.242
695 HG22 THR 87 HG22 THR 87 12.344 28.468 -17.584
696 HG23 THR 87 HG23 THR 87 14.044 28.304 -17.147
697 H GLN 88 HN GLN 88 15.063 25.581 -13.434
698 HA GLN 88 HA GLN 88 17.541 26.977 -13.513
699 HB2 GLN 88 HB2 GLN 88 18.524 24.757 -13.037
700 HB3 GLN 88 HB3 GLN 88 17.217 25.195 -11.951
701 HG2 GLN 88 HG2 GLN 88 15.676 23.715 -13.376
702 HG3 GLN 88 HG3 GLN 88 17.123 23.150 -14.212
703 HE21 GLN 88 HE22 GLN 88 15.071 21.803 -12.290
704 HE22 GLN 88 HE21 GLN 88 16.069 21.121 -11.018
Start of MODEL 6
1 HA MET 1 HA MET 1 3.531 -1.489 -2.624
2 H1 MET 1 H1 MET 1 2.076 -0.040 -0.540
3 H2 MET 1 H2 MET 1 1.726 -1.555 -1.085
4 H3 MET 1 H3 MET 1 3.152 -1.255 -0.311
5 HB2 MET 1 HB2 MET 1 1.317 -0.641 -3.393
6 HB3 MET 1 HB3 MET 1 1.798 1.005 -2.947
7 HG2 MET 1 HG2 MET 1 3.632 0.948 -4.580
8 HG3 MET 1 HG3 MET 1 3.326 -0.763 -4.905
9 HE1 MET 1 HE1 MET 1 2.426 0.844 -8.302
10 HE2 MET 1 HE2 MET 1 3.761 1.203 -7.184
11 HE3 MET 1 HE3 MET 1 3.279 -0.482 -7.481
12 H GLU 2 HN GLU 2 5.535 -0.687 -3.173
13 HA GLU 2 HA GLU 2 6.519 1.746 -1.788
14 HB2 GLU 2 HB2 GLU 2 8.009 -0.913 -2.013
15 HB3 GLU 2 HB3 GLU 2 8.578 0.580 -1.278
16 HG2 GLU 2 HG2 GLU 2 7.991 -0.697 0.570
17 HG3 GLU 2 HG3 GLU 2 6.595 0.358 0.366
18 H TRP 3 HN TRP 3 8.356 2.677 -3.027
19 HA TRP 3 HA TRP 3 8.171 1.941 -5.909
20 HD1 TRP 3 HD1 TRP 3 6.077 4.330 -3.159
21 HE1 TRP 3 HE1 TRP 3 3.575 4.353 -3.688
22 HE3 TRP 3 HE3 TRP 3 6.323 3.672 -8.220
23 HZ2 TRP 3 HZ2 TRP 3 1.884 4.210 -6.043
24 HZ3 TRP 3 HZ3 TRP 3 4.260 3.647 -9.593
25 HH2 TRP 3 HH2 TRP 3 2.035 3.921 -8.514
26 HB2 TRP 3 HB2 TRP 3 8.237 4.731 -4.703
27 HB3 TRP 3 HB3 TRP 3 8.098 4.327 -6.400
28 H LEU 4 HN LEU 4 9.955 2.785 -7.163
29 HA LEU 4 HA LEU 4 12.530 3.010 -5.672
30 HG LEU 4 HG LEU 4 14.196 2.828 -8.339
31 HB2 LEU 4 HB2 LEU 4 12.262 0.925 -6.955
32 HB3 LEU 4 HB3 LEU 4 11.871 1.870 -8.399
33 HD11 LEU 4 HD11 LEU 4 15.911 1.582 -7.020
34 HD12 LEU 4 HD12 LEU 4 14.796 2.474 -5.988
35 HD13 LEU 4 HD13 LEU 4 14.615 0.720 -6.169
36 HD21 LEU 4 HD21 LEU 4 13.546 0.894 -9.773
37 HD22 LEU 4 HD22 LEU 4 15.240 0.809 -9.259
38 HD23 LEU 4 HD23 LEU 4 14.024 -0.217 -8.471
39 H VAL 5 HN VAL 5 13.579 4.794 -6.029
40 HA VAL 5 HA VAL 5 12.712 6.901 -7.929
41 HB VAL 5 HB VAL 5 15.172 6.816 -6.119
42 HG11 VAL 5 HG11 VAL 5 15.113 9.280 -6.397
43 HG12 VAL 5 HG12 VAL 5 15.400 8.431 -7.912
44 HG13 VAL 5 HG13 VAL 5 13.786 9.088 -7.570
45 HG21 VAL 5 HG21 VAL 5 12.383 7.953 -5.588
46 HG22 VAL 5 HG22 VAL 5 13.210 6.698 -4.655
47 HG23 VAL 5 HG23 VAL 5 13.819 8.348 -4.611
48 H LYS 6 HN LYS 6 13.213 6.423 -9.945
49 HA LYS 6 HA LYS 6 15.751 5.025 -10.659
50 HB2 LYS 6 HB2 LYS 6 13.128 5.446 -12.077
51 HB3 LYS 6 HB3 LYS 6 14.554 5.018 -12.988
52 HG2 LYS 6 HG2 LYS 6 13.926 3.307 -10.596
53 HG3 LYS 6 HG3 LYS 6 12.883 3.163 -12.000
54 HD2 LYS 6 HD2 LYS 6 14.685 1.492 -12.020
55 HD3 LYS 6 HD3 LYS 6 14.684 2.533 -13.445
56 HE2 LYS 6 HE2 LYS 6 16.553 3.855 -12.535
57 HE3 LYS 6 HE3 LYS 6 16.540 2.883 -11.050
58 HZ1 LYS 6 HZ1 LYS 6 17.152 1.850 -13.764
59 HZ2 LYS 6 HZ2 LYS 6 18.242 2.132 -12.590
60 HZ3 LYS 6 HZ3 LYS 6 17.140 0.949 -12.399
61 H LYS 7 HN LYS 7 14.231 8.177 -10.746
62 HA LYS 7 HA LYS 7 16.646 9.335 -11.878
63 HB2 LYS 7 HB2 LYS 7 13.950 10.025 -13.127
64 HB3 LYS 7 HB3 LYS 7 15.487 10.852 -13.385
65 HG2 LYS 7 HG2 LYS 7 16.443 8.658 -14.234
66 HG3 LYS 7 HG3 LYS 7 14.789 8.011 -14.199
67 HD2 LYS 7 HD2 LYS 7 14.102 9.830 -15.782
68 HD3 LYS 7 HD3 LYS 7 15.792 10.375 -15.841
69 HE2 LYS 7 HE2 LYS 7 16.480 8.109 -16.626
70 HE3 LYS 7 HE3 LYS 7 14.799 7.578 -16.576
71 HZ1 LYS 7 HZ1 LYS 7 15.458 8.212 -18.809
72 HZ2 LYS 7 HZ2 LYS 7 14.296 9.231 -18.292
73 HZ3 LYS 7 HZ3 LYS 7 15.859 9.717 -18.338
74 H SER 8 HN SER 8 16.865 11.503 -11.043
75 HA SER 8 HA SER 8 14.836 12.612 -9.203
76 HG SER 8 HG SER 8 18.424 11.872 -8.912
77 HB2 SER 8 HB2 SER 8 16.802 12.730 -7.518
78 HB3 SER 8 HB3 SER 8 15.940 11.198 -7.697
79 H CYS 9 HN CYS 9 15.145 14.848 -9.014
80 HA CYS 9 HA CYS 9 17.382 16.095 -10.566
81 HG CYS 9 HG CYS 9 14.328 16.514 -13.066
82 HB2 CYS 9 HB2 CYS 9 14.417 16.784 -10.510
83 HB3 CYS 9 HB3 CYS 9 15.673 17.847 -11.168
84 H CYS 10 HN CYS 10 18.665 16.669 -8.905
85 HA CYS 10 HA CYS 10 17.989 17.631 -6.359
86 HG CYS 10 HG CYS 10 21.794 16.466 -6.904
87 HB2 CYS 10 HB2 CYS 10 20.393 18.348 -8.084
88 HB3 CYS 10 HB3 CYS 10 20.271 18.519 -6.327
89 H ASN 11 HN ASN 11 17.644 19.728 -5.514
90 HA ASN 11 HA ASN 11 17.751 22.080 -7.261
91 HB2 ASN 11 HB2 ASN 11 15.564 22.588 -7.418
92 HB3 ASN 11 HB3 ASN 11 15.336 20.850 -7.354
93 HD21 ASN 11 HD21 ASN 11 14.973 19.941 -5.040
94 HD22 ASN 11 HD22 ASN 11 13.998 20.898 -3.981
95 H LYS 12 HN LYS 12 17.739 24.001 -6.082
96 HA LYS 12 HA LYS 12 17.173 23.944 -3.211
97 HB2 LYS 12 HB2 LYS 12 19.230 25.148 -2.585
98 HB3 LYS 12 HB3 LYS 12 19.463 23.487 -3.074
99 HG2 LYS 12 HG2 LYS 12 21.264 24.783 -3.923
100 HG3 LYS 12 HG3 LYS 12 20.302 24.219 -5.292
101 HD2 LYS 12 HD2 LYS 12 19.299 26.414 -5.564
102 HD3 LYS 12 HD3 LYS 12 20.011 26.980 -4.038
103 HE2 LYS 12 HE2 LYS 12 22.298 26.600 -5.018
104 HE3 LYS 12 HE3 LYS 12 21.547 26.147 -6.551
105 HZ1 LYS 12 HZ1 LYS 12 20.637 28.399 -6.687
106 HZ2 LYS 12 HZ2 LYS 12 21.319 28.806 -5.255
107 HZ3 LYS 12 HZ3 LYS 12 22.256 28.456 -6.537
108 H GLN 13 HN GLN 13 16.415 25.209 -6.078
109 HA GLN 13 HA GLN 13 16.346 28.044 -5.291
110 HB2 GLN 13 HB2 GLN 13 15.295 26.624 -7.783
111 HB3 GLN 13 HB3 GLN 13 15.249 28.365 -7.473
112 HG2 GLN 13 HG2 GLN 13 17.785 28.300 -7.221
113 HG3 GLN 13 HG3 GLN 13 17.732 26.640 -7.811
114 HE21 GLN 13 HE22 GLN 13 18.265 26.548 -9.997
115 HE22 GLN 13 HE21 GLN 13 17.953 27.828 -11.151
116 H ASP 14 HN ASP 14 14.178 25.190 -5.316
117 HA ASP 14 HA ASP 14 12.052 26.981 -4.185
118 HB2 ASP 14 HB2 ASP 14 11.822 26.395 -6.675
119 HB3 ASP 14 HB3 ASP 14 11.514 24.738 -6.149
120 H ASN 15 HN ASN 15 13.881 24.261 -3.686
121 HA ASN 15 HA ASN 15 14.123 22.773 -2.094
122 HB2 ASN 15 HB2 ASN 15 12.891 24.484 -0.578
123 HB3 ASN 15 HB3 ASN 15 11.506 23.411 -0.740
124 HD21 ASN 15 HD22 ASN 15 13.149 20.856 -0.689
125 HD22 ASN 15 HD21 ASN 15 13.680 20.716 0.979
126 H ARG 16 HN ARG 16 11.295 23.033 -4.012
127 HA ARG 16 HA ARG 16 10.279 20.351 -3.573
128 HE ARG 16 HE ARG 16 8.011 24.125 -5.653
129 HB2 ARG 16 HB2 ARG 16 9.728 22.371 -5.783
130 HB3 ARG 16 HB3 ARG 16 8.939 20.792 -5.633
131 HG2 ARG 16 HG2 ARG 16 8.234 21.472 -3.278
132 HG3 ARG 16 HG3 ARG 16 8.773 23.110 -3.655
133 HD2 ARG 16 HD2 ARG 16 6.732 21.543 -5.287
134 HD3 ARG 16 HD3 ARG 16 6.313 22.716 -4.027
135 HH11 ARG 16 HH21 ARG 16 5.139 22.273 -6.651
136 HH12 ARG 16 HH22 ARG 16 4.432 23.624 -7.477
137 HH21 ARG 16 HH11 ARG 16 7.329 25.657 -6.887
138 HH22 ARG 16 HH12 ARG 16 5.787 25.642 -7.729
139 H HIS 17 HN HIS 17 11.550 18.682 -4.045
140 HA HIS 17 HA HIS 17 13.309 18.571 -6.415
141 HD1 HIS 17 HD1 HIS 17 13.952 18.280 -2.377
142 HD2 HIS 17 HD2 HIS 17 15.964 17.068 -5.844
143 HE1 HIS 17 HE1 HIS 17 16.376 19.062 -2.103
144 HB2 HIS 17 HB2 HIS 17 12.592 16.668 -4.131
145 HB3 HIS 17 HB3 HIS 17 13.531 16.156 -5.533
146 H VAL 18 HN VAL 18 12.974 16.660 -7.864
147 HA VAL 18 HA VAL 18 10.254 15.617 -7.929
148 HB VAL 18 HB VAL 18 11.453 16.409 -10.575
149 HG11 VAL 18 HG11 VAL 18 8.522 16.254 -9.718
150 HG12 VAL 18 HG12 VAL 18 9.182 16.300 -11.373
151 HG13 VAL 18 HG13 VAL 18 9.422 14.880 -10.364
152 HG21 VAL 18 HG21 VAL 18 11.423 18.577 -9.503
153 HG22 VAL 18 HG22 VAL 18 10.117 18.478 -10.676
154 HG23 VAL 18 HG23 VAL 18 9.746 18.331 -8.950
155 H LEU 19 HN LEU 19 10.219 13.566 -8.657
156 HA LEU 19 HA LEU 19 12.730 12.345 -9.621
157 HG LEU 19 HG LEU 19 10.790 12.262 -6.275
158 HB2 LEU 19 HB2 LEU 19 11.741 10.462 -7.794
159 HB3 LEU 19 HB3 LEU 19 13.269 11.299 -7.772
160 HD11 LEU 19 HD11 LEU 19 13.204 10.685 -5.339
161 HD12 LEU 19 HD12 LEU 19 11.871 11.294 -4.319
162 HD13 LEU 19 HD13 LEU 19 11.552 10.071 -5.553
163 HD21 LEU 19 HD21 LEU 19 13.653 13.247 -6.521
164 HD22 LEU 19 HD22 LEU 19 12.150 14.173 -6.276
165 HD23 LEU 19 HD23 LEU 19 12.873 13.333 -4.921
166 H MET 20 HN MET 20 12.278 9.945 -10.144
167 HA MET 20 HA MET 20 9.542 9.760 -11.300
168 HB2 MET 20 HB2 MET 20 12.180 8.797 -12.409
169 HB3 MET 20 HB3 MET 20 10.655 7.974 -12.792
170 HG2 MET 20 HG2 MET 20 9.632 10.053 -13.519
171 HG3 MET 20 HG3 MET 20 11.084 10.963 -13.116
172 HE1 MET 20 HE1 MET 20 11.169 7.392 -14.974
173 HE2 MET 20 HE2 MET 20 9.601 8.130 -15.376
174 HE3 MET 20 HE3 MET 20 10.842 7.935 -16.633
175 H LEU 21 HN LEU 21 8.355 8.502 -10.274
176 HA LEU 21 HA LEU 21 9.454 6.630 -8.223
177 HG LEU 21 HG LEU 21 8.451 7.042 -6.170
178 HB2 LEU 21 HB2 LEU 21 6.858 8.156 -8.520
179 HB3 LEU 21 HB3 LEU 21 6.769 6.527 -7.850
180 HD11 LEU 21 HD11 LEU 21 8.464 9.754 -7.527
181 HD12 LEU 21 HD12 LEU 21 8.912 9.605 -5.814
182 HD13 LEU 21 HD13 LEU 21 9.831 8.741 -7.056
183 HD21 LEU 21 HD21 LEU 21 6.076 8.954 -6.215
184 HD22 LEU 21 HD22 LEU 21 6.078 7.279 -5.638
185 HD23 LEU 21 HD23 LEU 21 7.011 8.506 -4.770
186 H CYS 22 HN CYS 22 9.488 4.584 -8.694
187 HA CYS 22 HA CYS 22 7.882 3.586 -11.000
188 HG CYS 22 HG CYS 22 10.778 5.508 -10.731
189 HB2 CYS 22 HB2 CYS 22 10.801 2.987 -10.352
190 HB3 CYS 22 HB3 CYS 22 9.900 2.498 -11.796
191 H ASP 23 HN ASP 23 7.824 1.217 -11.077
192 HA ASP 23 HA ASP 23 7.093 -0.139 -8.667
193 HB2 ASP 23 HB2 ASP 23 6.384 -1.219 -10.613
194 HB3 ASP 23 HB3 ASP 23 7.861 -0.846 -11.489
195 H ALA 24 HN ALA 24 8.323 -1.541 -7.302
196 HA ALA 24 HA ALA 24 11.092 -0.933 -6.869
197 HB1 ALA 24 HB1 ALA 24 9.594 -1.578 -5.049
198 HB2 ALA 24 HB2 ALA 24 9.346 -3.180 -5.784
199 HB3 ALA 24 HB3 ALA 24 10.950 -2.713 -5.174
200 H GLY 25 HN GLY 25 11.751 -1.267 -9.121
201 HA2 GLY 25 HA2 GLY 25 13.349 -3.359 -9.864
202 HA3 GLY 25 HA3 GLY 25 11.712 -3.925 -10.275
203 H GLY 26 HN GLY 26 10.987 -0.965 -10.724
204 HA2 GLY 26 HA2 GLY 26 11.269 0.731 -12.261
205 HA3 GLY 26 HA3 GLY 26 12.513 -0.195 -13.106
206 H ALA 27 HN ALA 27 9.664 -2.129 -12.609
207 HA ALA 27 HA ALA 27 9.423 -2.415 -15.433
208 HB1 ALA 27 HB1 ALA 27 7.522 -3.343 -13.237
209 HB2 ALA 27 HB2 ALA 27 7.613 -3.976 -14.892
210 HB3 ALA 27 HB3 ALA 27 8.977 -4.215 -13.784
211 H ILE 28 HN ILE 28 7.887 -0.139 -13.333
212 HA ILE 28 HA ILE 28 6.096 0.869 -15.439
213 HB ILE 28 HB ILE 28 5.237 0.242 -12.566
214 HG12 ILE 28 HG12 ILE 28 4.278 -0.973 -15.197
215 HG13 ILE 28 HG13 ILE 28 5.213 -1.790 -13.940
216 HG21 ILE 28 HG21 ILE 28 4.262 2.383 -13.373
217 HG22 ILE 28 HG22 ILE 28 3.624 1.549 -14.811
218 HG23 ILE 28 HG23 ILE 28 3.028 1.168 -13.181
219 HD11 ILE 28 HD11 ILE 28 2.330 -0.892 -13.734
220 HD12 ILE 28 HD12 ILE 28 2.979 -2.535 -13.721
221 HD13 ILE 28 HD13 ILE 28 3.301 -1.455 -12.347
222 H LYS 29 HN LYS 29 5.928 3.230 -15.140
223 HA LYS 29 HA LYS 29 7.622 4.379 -12.992
224 HB2 LYS 29 HB2 LYS 29 8.029 5.017 -15.943
225 HB3 LYS 29 HB3 LYS 29 8.855 5.740 -14.561
226 HG2 LYS 29 HG2 LYS 29 9.645 3.305 -14.019
227 HG3 LYS 29 HG3 LYS 29 9.140 2.921 -15.664
228 HD2 LYS 29 HD2 LYS 29 10.717 4.568 -16.574
229 HD3 LYS 29 HD3 LYS 29 11.078 5.161 -14.951
230 HE2 LYS 29 HE2 LYS 29 12.912 3.807 -15.680
231 HE3 LYS 29 HE3 LYS 29 12.113 3.036 -14.316
232 HZ1 LYS 29 HZ1 LYS 29 11.116 1.449 -15.806
233 HZ2 LYS 29 HZ2 LYS 29 11.619 2.268 -17.146
234 HZ3 LYS 29 HZ3 LYS 29 12.696 1.518 -16.185
235 H MET 30 HN MET 30 7.153 6.453 -12.439
236 HA MET 30 HA MET 30 5.002 8.011 -13.733
237 HB2 MET 30 HB2 MET 30 5.164 7.425 -10.743
238 HB3 MET 30 HB3 MET 30 3.978 8.416 -11.574
239 HG2 MET 30 HG2 MET 30 3.459 6.165 -12.877
240 HG3 MET 30 HG3 MET 30 4.211 5.439 -11.454
241 HE1 MET 30 HE1 MET 30 2.912 8.138 -9.457
242 HE2 MET 30 HE2 MET 30 1.744 7.074 -8.653
243 HE3 MET 30 HE3 MET 30 3.408 6.511 -8.932
244 H ILE 31 HN ILE 31 5.029 10.226 -12.431
245 HA ILE 31 HA ILE 31 7.815 11.061 -11.774
246 HB ILE 31 HB ILE 31 5.555 12.663 -12.957
247 HG12 ILE 31 HG12 ILE 31 8.201 12.366 -14.403
248 HG13 ILE 31 HG13 ILE 31 7.122 10.976 -14.444
249 HG21 ILE 31 HG21 ILE 31 7.387 14.434 -13.210
250 HG22 ILE 31 HG22 ILE 31 6.831 14.143 -11.565
251 HG23 ILE 31 HG23 ILE 31 8.368 13.439 -12.108
252 HD11 ILE 31 HD11 ILE 31 5.267 12.351 -15.221
253 HD12 ILE 31 HD12 ILE 31 6.294 13.794 -15.177
254 HD13 ILE 31 HD13 ILE 31 6.662 12.476 -16.316
255 H ALA 32 HN ALA 32 7.905 12.284 -9.749
256 HA ALA 32 HA ALA 32 5.352 13.079 -8.532
257 HB1 ALA 32 HB1 ALA 32 7.455 11.611 -6.909
258 HB2 ALA 32 HB2 ALA 32 5.888 12.212 -6.349
259 HB3 ALA 32 HB3 ALA 32 5.939 10.855 -7.494
260 H GLU 33 HN GLU 33 5.526 14.958 -7.473
261 HA GLU 33 HA GLU 33 8.172 16.311 -7.337
262 HB2 GLU 33 HB2 GLU 33 6.350 17.436 -8.675
263 HB3 GLU 33 HB3 GLU 33 5.320 17.435 -7.236
264 HG2 GLU 33 HG2 GLU 33 7.021 18.864 -6.074
265 HG3 GLU 33 HG3 GLU 33 7.969 18.905 -7.555
266 H VAL 34 HN VAL 34 8.895 16.858 -5.279
267 HA VAL 34 HA VAL 34 7.216 16.226 -2.935
268 HB VAL 34 HB VAL 34 8.890 14.708 -2.044
269 HG11 VAL 34 HG11 VAL 34 8.258 13.709 -4.848
270 HG12 VAL 34 HG12 VAL 34 8.550 12.751 -3.386
271 HG13 VAL 34 HG13 VAL 34 7.087 13.735 -3.520
272 HG21 VAL 34 HG21 VAL 34 10.951 15.515 -3.008
273 HG22 VAL 34 HG22 VAL 34 10.754 13.815 -3.431
274 HG23 VAL 34 HG23 VAL 34 10.423 15.064 -4.648
275 H LYS 35 HN LYS 35 8.291 17.037 -0.919
276 HA LYS 35 HA LYS 35 10.448 19.037 -1.459
277 HB2 LYS 35 HB2 LYS 35 8.211 20.034 -0.579
278 HB3 LYS 35 HB3 LYS 35 8.570 19.202 0.934
279 HG2 LYS 35 HG2 LYS 35 10.723 20.433 1.079
280 HG3 LYS 35 HG3 LYS 35 10.405 21.214 -0.475
281 HD2 LYS 35 HD2 LYS 35 8.689 21.531 2.030
282 HD3 LYS 35 HD3 LYS 35 9.966 22.645 1.525
283 HE2 LYS 35 HE2 LYS 35 8.747 23.057 -0.622
284 HE3 LYS 35 HE3 LYS 35 7.439 22.005 -0.064
285 HZ1 LYS 35 HZ1 LYS 35 7.080 23.549 1.782
286 HZ2 LYS 35 HZ2 LYS 35 8.282 24.523 1.254
287 HZ3 LYS 35 HZ3 LYS 35 6.939 24.325 0.357
288 H SER 36 HN SER 36 12.177 18.875 0.080
289 HA SER 36 HA SER 36 12.216 16.290 1.568
290 HG SER 36 HG SER 36 13.702 15.904 -1.820
291 HB2 SER 36 HB2 SER 36 14.620 17.082 -0.015
292 HB3 SER 36 HB3 SER 36 13.962 15.480 0.368
293 H ASP 37 HN ASP 37 13.517 16.193 3.319
294 HA ASP 37 HA ASP 37 15.037 18.655 4.099
295 HB2 ASP 37 HB2 ASP 37 13.027 18.152 5.485
296 HB3 ASP 37 HB3 ASP 37 13.730 16.588 5.899
297 H PHE 38 HN PHE 38 15.560 15.837 2.683
298 HA PHE 38 HA PHE 38 18.243 15.386 3.778
299 HD1 PHE 38 HD1 PHE 38 14.502 14.053 4.847
300 HD2 PHE 38 HD2 PHE 38 18.517 13.194 6.165
301 HE1 PHE 38 HE1 PHE 38 13.737 14.111 7.206
302 HE2 PHE 38 HE2 PHE 38 17.747 13.247 8.525
303 HZ PHE 38 HZ PHE 38 15.357 13.700 9.050
304 HB2 PHE 38 HB2 PHE 38 16.233 13.146 3.295
305 HB3 PHE 38 HB3 PHE 38 17.897 12.953 3.811
306 H ALA 39 HN ALA 39 19.517 14.171 2.106
307 HA ALA 39 HA ALA 39 18.938 14.969 -0.576
308 HB1 ALA 39 HB1 ALA 39 20.900 12.886 0.489
309 HB2 ALA 39 HB2 ALA 39 20.904 13.580 -1.145
310 HB3 ALA 39 HB3 ALA 39 21.241 14.619 0.252
311 H VAL 40 HN VAL 40 18.414 13.620 -2.387
312 HA VAL 40 HA VAL 40 17.476 10.870 -1.932
313 HB VAL 40 HB VAL 40 15.778 12.837 -3.527
314 HG11 VAL 40 HG11 VAL 40 14.039 11.081 -3.167
315 HG12 VAL 40 HG12 VAL 40 15.457 10.457 -4.025
316 HG13 VAL 40 HG13 VAL 40 15.229 10.097 -2.303
317 HG21 VAL 40 HG21 VAL 40 15.647 13.716 -1.243
318 HG22 VAL 40 HG22 VAL 40 14.142 12.936 -1.709
319 HG23 VAL 40 HG23 VAL 40 15.268 12.088 -0.632
320 H LYS 41 HN LYS 41 18.000 9.608 -3.797
321 HA LYS 41 HA LYS 41 18.586 10.954 -6.305
322 HB2 LYS 41 HB2 LYS 41 20.847 10.425 -6.554
323 HB3 LYS 41 HB3 LYS 41 20.727 11.194 -4.989
324 HG2 LYS 41 HG2 LYS 41 21.133 8.245 -5.580
325 HG3 LYS 41 HG3 LYS 41 22.288 9.371 -4.869
326 HD2 LYS 41 HD2 LYS 41 20.780 9.582 -2.868
327 HD3 LYS 41 HD3 LYS 41 19.726 8.358 -3.616
328 HE2 LYS 41 HE2 LYS 41 21.606 6.750 -3.653
329 HE3 LYS 41 HE3 LYS 41 22.604 7.920 -2.770
330 HZ1 LYS 41 HZ1 LYS 41 21.504 6.305 -1.306
331 HZ2 LYS 41 HZ2 LYS 41 21.003 7.822 -0.962
332 HZ3 LYS 41 HZ3 LYS 41 20.018 6.817 -1.812
333 H VAL 42 HN VAL 42 19.286 9.271 -7.968
334 HA VAL 42 HA VAL 42 17.460 7.240 -8.224
335 HB VAL 42 HB VAL 42 20.273 7.407 -9.408
336 HG11 VAL 42 HG11 VAL 42 19.179 6.111 -11.317
337 HG12 VAL 42 HG12 VAL 42 19.456 5.181 -9.845
338 HG13 VAL 42 HG13 VAL 42 17.827 5.782 -10.203
339 HG21 VAL 42 HG21 VAL 42 18.846 8.392 -11.350
340 HG22 VAL 42 HG22 VAL 42 17.573 8.575 -10.107
341 HG23 VAL 42 HG23 VAL 42 19.124 9.420 -9.946
342 H GLY 43 HN GLY 43 17.371 5.059 -7.984
343 HA2 GLY 43 HA2 GLY 43 17.816 2.973 -7.180
344 HA3 GLY 43 HA3 GLY 43 19.445 3.480 -6.683
345 H ASP 44 HN ASP 44 16.360 5.162 -5.802
346 HA ASP 44 HA ASP 44 17.028 4.430 -2.914
347 HB2 ASP 44 HB2 ASP 44 15.833 6.997 -3.981
348 HB3 ASP 44 HB3 ASP 44 15.438 6.390 -2.381
349 H LEU 45 HN LEU 45 15.317 3.614 -1.589
350 HA LEU 45 HA LEU 45 12.874 2.838 -3.077
351 HG LEU 45 HG LEU 45 11.130 1.860 -1.187
352 HB2 LEU 45 HB2 LEU 45 14.139 1.359 -1.315
353 HB3 LEU 45 HB3 LEU 45 13.443 2.467 -0.133
354 HD11 LEU 45 HD11 LEU 45 12.765 -0.508 -2.195
355 HD12 LEU 45 HD12 LEU 45 10.997 -0.333 -2.256
356 HD13 LEU 45 HD13 LEU 45 12.023 0.730 -3.224
357 HD21 LEU 45 HD21 LEU 45 11.804 1.186 1.031
358 HD22 LEU 45 HD22 LEU 45 10.967 -0.145 0.224
359 HD23 LEU 45 HD23 LEU 45 12.742 -0.185 0.378
360 H LEU 46 HN LEU 46 10.806 3.628 -2.388
361 HA LEU 46 HA LEU 46 10.703 5.674 -0.251
362 HG LEU 46 HG LEU 46 11.412 6.768 -3.121
363 HB2 LEU 46 HB2 LEU 46 9.181 5.796 -2.890
364 HB3 LEU 46 HB3 LEU 46 8.870 6.818 -1.492
365 HD11 LEU 46 HD11 LEU 46 10.635 9.059 -3.845
366 HD12 LEU 46 HD12 LEU 46 9.564 7.745 -4.347
367 HD13 LEU 46 HD13 LEU 46 9.116 8.781 -2.976
368 HD21 LEU 46 HD21 LEU 46 11.975 8.890 -1.871
369 HD22 LEU 46 HD22 LEU 46 10.574 8.579 -0.810
370 HD23 LEU 46 HD23 LEU 46 11.935 7.455 -0.846
371 H SER 47 HN SER 47 9.361 4.942 1.256
372 HA SER 47 HA SER 47 7.027 3.274 0.438
373 HG SER 47 HG SER 47 9.390 0.979 1.958
374 HB2 SER 47 HB2 SER 47 8.555 2.814 3.015
375 HB3 SER 47 HB3 SER 47 7.282 1.822 2.305
376 HA PRO 48 HA PRO 48 4.925 6.513 2.417
377 HB2 PRO 48 HB2 PRO 48 2.506 5.394 3.136
378 HB3 PRO 48 HB3 PRO 48 2.977 5.749 1.453
379 HG2 PRO 48 HG2 PRO 48 3.162 3.108 2.922
380 HG3 PRO 48 HG3 PRO 48 2.529 3.419 1.273
381 HD2 PRO 48 HD2 PRO 48 5.060 2.506 1.694
382 HD3 PRO 48 HD3 PRO 48 4.705 3.678 0.392
383 H LEU 49 HN LEU 49 4.474 7.460 4.309
384 HA LEU 49 HA LEU 49 4.580 5.893 6.864
385 HG LEU 49 HG LEU 49 7.138 7.133 5.523
386 HB2 LEU 49 HB2 LEU 49 5.409 8.777 6.323
387 HB3 LEU 49 HB3 LEU 49 5.412 7.991 7.898
388 HD11 LEU 49 HD11 LEU 49 8.998 8.145 6.799
389 HD12 LEU 49 HD12 LEU 49 7.780 9.343 6.319
390 HD13 LEU 49 HD13 LEU 49 7.840 8.759 7.997
391 HD21 LEU 49 HD21 LEU 49 6.734 5.259 7.060
392 HD22 LEU 49 HD22 LEU 49 8.395 5.828 7.225
393 HD23 LEU 49 HD23 LEU 49 7.186 6.270 8.451
394 H GLN 50 HN GLN 50 3.186 8.510 4.934
395 HA GLN 50 HA GLN 50 0.524 7.899 5.789
396 HB2 GLN 50 HB2 GLN 50 -0.067 10.283 6.367
397 HB3 GLN 50 HB3 GLN 50 0.870 9.442 7.594
398 HG2 GLN 50 HG2 GLN 50 2.866 10.639 7.073
399 HG3 GLN 50 HG3 GLN 50 2.197 11.246 5.553
400 HE21 GLN 50 HE22 GLN 50 2.312 13.462 5.892
401 HE22 GLN 50 HE21 GLN 50 1.480 14.282 7.188
402 H ASN 51 HN ASN 51 -0.910 9.669 4.415
403 HA ASN 51 HA ASN 51 -0.491 9.090 1.748
404 HB2 ASN 51 HB2 ASN 51 -2.620 9.902 2.611
405 HB3 ASN 51 HB3 ASN 51 -1.925 11.485 2.971
406 HD21 ASN 51 HD22 ASN 51 -1.750 13.036 1.267
407 HD22 ASN 51 HD21 ASN 51 -2.285 12.707 -0.357
408 H ALA 52 HN ALA 52 0.914 11.857 3.498
409 HA ALA 52 HA ALA 52 2.067 12.879 1.011
410 HB1 ALA 52 HB1 ALA 52 1.152 14.414 3.471
411 HB2 ALA 52 HB2 ALA 52 1.841 15.110 1.990
412 HB3 ALA 52 HB3 ALA 52 0.271 14.295 1.928
413 H LEU 53 HN LEU 53 3.219 10.956 3.326
414 HA LEU 53 HA LEU 53 5.811 12.277 3.202
415 HG LEU 53 HG LEU 53 4.752 13.802 5.361
416 HB2 LEU 53 HB2 LEU 53 4.623 11.237 5.789
417 HB3 LEU 53 HB3 LEU 53 6.349 11.220 5.515
418 HD11 LEU 53 HD11 LEU 53 6.249 12.619 7.746
419 HD12 LEU 53 HD12 LEU 53 5.525 14.240 7.666
420 HD13 LEU 53 HD13 LEU 53 4.489 12.808 7.615
421 HD21 LEU 53 HD21 LEU 53 7.730 13.255 5.840
422 HD22 LEU 53 HD22 LEU 53 7.033 13.812 4.313
423 HD23 LEU 53 HD23 LEU 53 6.955 14.849 5.735
424 H TYR 54 HN TYR 54 7.306 10.856 2.569
425 HA TYR 54 HA TYR 54 6.801 7.945 2.926
426 HD1 TYR 54 HD1 TYR 54 4.901 9.800 0.866
427 HD2 TYR 54 HD2 TYR 54 6.826 6.170 -0.441
428 HE1 TYR 54 HE1 TYR 54 2.774 9.030 -0.092
429 HE2 TYR 54 HE2 TYR 54 4.701 5.394 -1.417
430 HH TYR 54 HH TYR 54 2.431 5.874 -1.772
431 HB2 TYR 54 HB2 TYR 54 7.660 9.409 0.401
432 HB3 TYR 54 HB3 TYR 54 8.100 7.742 0.706
433 H CYS 55 HN CYS 55 8.637 6.842 3.472
434 HA CYS 55 HA CYS 55 10.919 8.342 4.511
435 HG CYS 55 HG CYS 55 9.015 4.994 3.732
436 HB2 CYS 55 HB2 CYS 55 11.840 6.135 5.031
437 HB3 CYS 55 HB3 CYS 55 10.182 6.310 5.648
438 H ILE 56 HN ILE 56 13.169 7.806 3.758
439 HA ILE 56 HA ILE 56 13.300 7.390 0.804
440 HB ILE 56 HB ILE 56 15.203 8.937 2.597
441 HG12 ILE 56 HG12 ILE 56 13.460 10.249 0.488
442 HG13 ILE 56 HG13 ILE 56 12.849 10.029 2.128
443 HG21 ILE 56 HG21 ILE 56 15.132 8.577 -0.439
444 HG22 ILE 56 HG22 ILE 56 16.132 9.790 0.365
445 HG23 ILE 56 HG23 ILE 56 16.444 8.100 0.651
446 HD11 ILE 56 HD11 ILE 56 13.880 12.252 1.829
447 HD12 ILE 56 HD12 ILE 56 14.659 11.297 3.090
448 HD13 ILE 56 HD13 ILE 56 15.446 11.497 1.527
449 H ASN 57 HN ASN 57 14.853 6.113 0.023
450 HA ASN 57 HA ASN 57 16.583 4.773 -0.262
451 HB2 ASN 57 HB2 ASN 57 17.873 6.432 1.119
452 HB3 ASN 57 HB3 ASN 57 17.527 5.479 2.565
453 HD21 ASN 57 HD22 ASN 57 18.812 5.236 -0.752
454 HD22 ASN 57 HD21 ASN 57 19.992 3.961 -0.412
455 H ARG 58 HN ARG 58 16.004 4.212 3.188
456 HA ARG 58 HA ARG 58 15.051 1.520 2.902
457 HE ARG 58 HE ARG 58 19.770 2.039 2.424
458 HB2 ARG 58 HB2 ARG 58 17.900 2.108 3.854
459 HB3 ARG 58 HB3 ARG 58 17.071 0.617 4.261
460 HG2 ARG 58 HG2 ARG 58 16.937 -0.064 1.931
461 HG3 ARG 58 HG3 ARG 58 17.758 1.419 1.413
462 HD2 ARG 58 HD2 ARG 58 18.988 -0.584 3.326
463 HD3 ARG 58 HD3 ARG 58 19.266 -0.557 1.573
464 HH11 ARG 58 HH11 ARG 58 21.193 -1.151 3.084
465 HH12 ARG 58 HH12 ARG 58 22.767 -0.532 3.422
466 HH21 ARG 58 HH21 ARG 58 21.823 2.860 2.874
467 HH22 ARG 58 HH22 ARG 58 23.137 1.822 3.293
468 H GLU 59 HN GLU 59 15.127 4.485 4.626
469 HA GLU 59 HA GLU 59 14.539 3.121 7.170
470 HB2 GLU 59 HB2 GLU 59 16.151 4.364 8.429
471 HB3 GLU 59 HB3 GLU 59 16.967 3.419 7.186
472 HG2 GLU 59 HG2 GLU 59 17.111 5.536 5.781
473 HG3 GLU 59 HG3 GLU 59 16.475 6.431 7.167
474 H LYS 60 HN LYS 60 13.282 4.199 8.519
475 HA LYS 60 HA LYS 60 11.450 5.967 7.282
476 HB2 LYS 60 HB2 LYS 60 11.651 5.128 10.196
477 HB3 LYS 60 HB3 LYS 60 10.284 5.981 9.470
478 HG2 LYS 60 HG2 LYS 60 10.053 4.076 7.813
479 HG3 LYS 60 HG3 LYS 60 11.240 3.175 8.755
480 HD2 LYS 60 HD2 LYS 60 8.560 4.233 9.755
481 HD3 LYS 60 HD3 LYS 60 8.885 2.566 9.307
482 HE2 LYS 60 HE2 LYS 60 10.263 4.052 11.597
483 HE3 LYS 60 HE3 LYS 60 8.853 3.013 11.777
484 HZ1 LYS 60 HZ1 LYS 60 10.853 1.806 12.284
485 HZ2 LYS 60 HZ2 LYS 60 10.172 1.152 10.960
486 HZ3 LYS 60 HZ3 LYS 60 11.502 2.096 10.820
487 H LEU 61 HN LEU 61 14.231 6.702 9.264
488 HA LEU 61 HA LEU 61 13.317 9.134 10.374
489 HG LEU 61 HG LEU 61 15.375 6.597 11.025
490 HB2 LEU 61 HB2 LEU 61 16.187 8.412 9.611
491 HB3 LEU 61 HB3 LEU 61 15.685 9.619 10.790
492 HD11 LEU 61 HD11 LEU 61 17.650 7.462 11.334
493 HD12 LEU 61 HD12 LEU 61 17.070 8.592 12.579
494 HD13 LEU 61 HD13 LEU 61 16.989 6.834 12.854
495 HD21 LEU 61 HD21 LEU 61 14.475 8.785 12.946
496 HD22 LEU 61 HD22 LEU 61 13.444 7.614 12.086
497 HD23 LEU 61 HD23 LEU 61 14.557 7.049 13.336
498 H HIS 62 HN HIS 62 14.832 8.404 7.278
499 HA HIS 62 HA HIS 62 15.166 11.257 6.580
500 HD1 HIS 62 HD1 HIS 62 18.479 8.373 4.633
501 HD2 HIS 62 HD2 HIS 62 17.132 10.585 7.952
502 HE1 HIS 62 HE1 HIS 62 20.426 8.480 6.265
503 HB2 HIS 62 HB2 HIS 62 15.705 8.715 4.988
504 HB3 HIS 62 HB3 HIS 62 16.159 10.353 4.521
505 H THR 63 HN THR 63 13.370 12.335 5.694
506 HA THR 63 HA THR 63 11.330 10.700 4.291
507 HB THR 63 HB THR 63 9.735 12.272 5.438
508 HG1 THR 63 HG1 THR 63 11.034 13.960 6.078
509 HG21 THR 63 HG21 THR 63 10.340 9.973 6.290
510 HG22 THR 63 HG22 THR 63 11.502 10.744 7.391
511 HG23 THR 63 HG23 THR 63 9.766 11.099 7.537
512 H VAL 64 HN VAL 64 10.024 11.658 2.786
513 HA VAL 64 HA VAL 64 10.692 14.394 1.809
514 HB VAL 64 HB VAL 64 9.611 13.338 -0.387
515 HG11 VAL 64 HG11 VAL 64 12.542 13.113 0.309
516 HG12 VAL 64 HG12 VAL 64 11.847 13.104 -1.331
517 HG13 VAL 64 HG13 VAL 64 11.665 14.533 -0.305
518 HG21 VAL 64 HG21 VAL 64 9.355 11.035 0.454
519 HG22 VAL 64 HG22 VAL 64 10.386 11.135 -0.980
520 HG23 VAL 64 HG23 VAL 64 11.117 10.901 0.618
521 H LYS 65 HN LYS 65 8.881 15.612 1.476
522 HA LYS 65 HA LYS 65 6.267 14.550 2.388
523 HB2 LYS 65 HB2 LYS 65 7.073 16.764 3.261
524 HB3 LYS 65 HB3 LYS 65 7.070 17.380 1.596
525 HG2 LYS 65 HG2 LYS 65 4.611 16.914 1.464
526 HG3 LYS 65 HG3 LYS 65 4.654 16.350 3.146
527 HD2 LYS 65 HD2 LYS 65 5.402 18.584 3.888
528 HD3 LYS 65 HD3 LYS 65 5.373 19.157 2.203
529 HE2 LYS 65 HE2 LYS 65 2.947 18.645 2.068
530 HE3 LYS 65 HE3 LYS 65 2.972 18.048 3.732
531 HZ1 LYS 65 HZ1 LYS 65 3.539 20.843 2.921
532 HZ2 LYS 65 HZ2 LYS 65 2.168 20.317 3.625
533 HZ3 LYS 65 HZ3 LYS 65 3.565 20.287 4.459
534 H VAL 66 HN VAL 66 4.714 14.042 0.806
535 HA VAL 66 HA VAL 66 5.619 14.355 -2.022
536 HB VAL 66 HB VAL 66 3.334 12.716 -0.854
537 HG11 VAL 66 HG11 VAL 66 3.213 11.729 -3.158
538 HG12 VAL 66 HG12 VAL 66 2.767 13.435 -3.157
539 HG13 VAL 66 HG13 VAL 66 4.372 12.949 -3.733
540 HG21 VAL 66 HG21 VAL 66 6.047 11.926 -2.030
541 HG22 VAL 66 HG22 VAL 66 5.559 11.771 -0.331
542 HG23 VAL 66 HG23 VAL 66 4.760 10.797 -1.576
543 H LEU 67 HN LEU 67 4.520 15.631 -3.486
544 HA LEU 67 HA LEU 67 2.528 17.527 -2.289
545 HG LEU 67 HG LEU 67 5.755 17.695 -2.198
546 HB2 LEU 67 HB2 LEU 67 4.630 18.066 -4.412
547 HB3 LEU 67 HB3 LEU 67 3.564 19.244 -3.659
548 HD11 LEU 67 HD11 LEU 67 5.692 20.563 -3.174
549 HD12 LEU 67 HD12 LEU 67 7.012 19.768 -2.286
550 HD13 LEU 67 HD13 LEU 67 6.619 19.233 -3.912
551 HD21 LEU 67 HD21 LEU 67 3.972 18.398 -0.646
552 HD22 LEU 67 HD22 LEU 67 5.450 19.337 -0.396
553 HD23 LEU 67 HD23 LEU 67 4.076 20.061 -1.266
554 H SER 68 HN SER 68 3.544 15.741 -5.243
555 HA SER 68 HA SER 68 0.859 15.517 -6.234
556 HG SER 68 HG SER 68 0.985 17.977 -6.008
557 HB2 SER 68 HB2 SER 68 2.817 17.412 -7.634
558 HB3 SER 68 HB3 SER 68 1.415 16.692 -8.440
559 H ALA 69 HN ALA 69 0.894 14.075 -8.167
560 HA ALA 69 HA ALA 69 3.417 13.210 -9.243
561 HB1 ALA 69 HB1 ALA 69 3.391 11.787 -7.231
562 HB2 ALA 69 HB2 ALA 69 1.737 11.236 -7.613
563 HB3 ALA 69 HB3 ALA 69 3.097 10.793 -8.666
564 H SER 70 HN SER 70 3.100 11.765 -11.077
565 HA SER 70 HA SER 70 0.396 11.414 -12.156
566 HG SER 70 HG SER 70 2.410 14.623 -13.577
567 HB2 SER 70 HB2 SER 70 1.139 12.761 -14.245
568 HB3 SER 70 HB3 SER 70 0.576 13.646 -12.826
569 H SER 71 HN SER 71 0.397 9.983 -14.000
570 HA SER 71 HA SER 71 2.416 8.060 -14.271
571 HG SER 71 HG SER 71 -0.924 7.456 -15.493
572 HB2 SER 71 HB2 SER 71 0.488 9.015 -16.427
573 HB3 SER 71 HB3 SER 71 1.234 7.412 -16.285
574 H TYR 72 HN TYR 72 4.182 7.828 -15.767
575 HA TYR 72 HA TYR 72 5.593 10.260 -16.094
576 HD1 TYR 72 HD1 TYR 72 8.353 10.366 -16.261
577 HD2 TYR 72 HD2 TYR 72 7.035 7.632 -19.331
578 HE1 TYR 72 HE1 TYR 72 10.032 11.299 -17.805
579 HE2 TYR 72 HE2 TYR 72 8.725 8.554 -20.880
580 HH TYR 72 HH TYR 72 10.449 10.102 -21.167
581 HB2 TYR 72 HB2 TYR 72 6.866 8.283 -15.766
582 HB3 TYR 72 HB3 TYR 72 6.107 7.470 -17.140
583 H SER 73 HN SER 73 5.924 11.630 -17.761
584 HA SER 73 HA SER 73 5.617 10.792 -20.486
585 HG SER 73 HG SER 73 3.335 10.519 -19.721
586 HB2 SER 73 HB2 SER 73 3.818 12.935 -19.287
587 HB3 SER 73 HB3 SER 73 4.156 12.847 -21.029
588 HA PRO 74 HA PRO 74 9.226 13.195 -20.297
589 HB2 PRO 74 HB2 PRO 74 9.457 14.244 -22.891
590 HB3 PRO 74 HB3 PRO 74 9.923 12.593 -22.377
591 HG2 PRO 74 HG2 PRO 74 7.389 13.522 -23.727
592 HG3 PRO 74 HG3 PRO 74 8.327 12.027 -24.025
593 HD2 PRO 74 HD2 PRO 74 6.054 12.025 -22.535
594 HD3 PRO 74 HD3 PRO 74 7.443 10.983 -22.101
595 H ASP 75 HN ASP 75 6.738 15.027 -22.151
596 HA ASP 75 HA ASP 75 7.618 17.626 -21.504
597 HB2 ASP 75 HB2 ASP 75 5.963 17.232 -23.228
598 HB3 ASP 75 HB3 ASP 75 4.840 16.518 -22.066
599 H GLU 76 HN GLU 76 5.467 15.428 -19.706
600 HA GLU 76 HA GLU 76 4.671 17.336 -17.732
601 HB2 GLU 76 HB2 GLU 76 3.568 15.095 -18.527
602 HB3 GLU 76 HB3 GLU 76 4.711 14.297 -17.461
603 HG2 GLU 76 HG2 GLU 76 2.633 14.487 -16.305
604 HG3 GLU 76 HG3 GLU 76 3.768 15.595 -15.542
605 H TRP 77 HN TRP 77 7.275 14.932 -17.939
606 HA TRP 77 HA TRP 77 8.279 15.196 -15.263
607 HD1 TRP 77 HD1 TRP 77 11.661 13.434 -18.230
608 HE1 TRP 77 HE1 TRP 77 13.750 12.987 -16.836
609 HE3 TRP 77 HE3 TRP 77 9.740 14.409 -13.599
610 HZ2 TRP 77 HZ2 TRP 77 14.454 12.891 -14.027
611 HZ3 TRP 77 HZ3 TRP 77 11.108 14.009 -11.574
612 HH2 TRP 77 HH2 TRP 77 13.465 13.267 -11.769
613 HB2 TRP 77 HB2 TRP 77 8.751 13.267 -16.654
614 HB3 TRP 77 HB3 TRP 77 9.396 14.262 -17.925
615 H GLU 78 HN GLU 78 9.248 16.674 -18.428
616 HA GLU 78 HA GLU 78 11.289 18.237 -17.241
617 HB2 GLU 78 HB2 GLU 78 9.821 18.468 -19.896
618 HB3 GLU 78 HB3 GLU 78 11.121 19.572 -19.426
619 HG2 GLU 78 HG2 GLU 78 12.665 17.654 -19.122
620 HG3 GLU 78 HG3 GLU 78 11.409 16.544 -19.656
621 H ARG 79 HN ARG 79 7.876 19.087 -17.875
622 HA ARG 79 HA ARG 79 8.140 21.810 -17.098
623 HE ARG 79 HE ARG 79 3.402 21.946 -17.569
624 HB2 ARG 79 HB2 ARG 79 6.000 19.736 -17.269
625 HB3 ARG 79 HB3 ARG 79 5.624 21.189 -16.328
626 HG2 ARG 79 HG2 ARG 79 5.953 22.656 -18.174
627 HG3 ARG 79 HG3 ARG 79 6.782 21.423 -19.131
628 HD2 ARG 79 HD2 ARG 79 4.431 21.929 -19.886
629 HD3 ARG 79 HD3 ARG 79 4.827 20.238 -19.567
630 HH11 ARG 79 HH21 ARG 79 3.323 19.016 -19.621
631 HH12 ARG 79 HH22 ARG 79 2.297 18.139 -18.504
632 HH21 ARG 79 HH11 ARG 79 2.077 20.714 -16.116
633 HH22 ARG 79 HH12 ARG 79 1.799 19.029 -16.429
634 H GLN 80 HN GLN 80 7.443 18.884 -15.062
635 HA GLN 80 HA GLN 80 7.256 20.380 -12.647
636 HB2 GLN 80 HB2 GLN 80 7.956 17.464 -13.177
637 HB3 GLN 80 HB3 GLN 80 7.752 18.151 -11.553
638 HG2 GLN 80 HG2 GLN 80 5.461 18.770 -11.999
639 HG3 GLN 80 HG3 GLN 80 5.600 18.319 -13.693
640 HE21 GLN 80 HE22 GLN 80 5.402 16.168 -14.323
641 HE22 GLN 80 HE21 GLN 80 4.813 14.929 -13.217
642 H CYS 81 HN CYS 81 10.098 18.899 -14.310
643 HA CYS 81 HA CYS 81 11.993 19.588 -12.293
644 HG CYS 81 HG CYS 81 11.195 17.165 -14.388
645 HB2 CYS 81 HB2 CYS 81 12.379 19.282 -15.304
646 HB3 CYS 81 HB3 CYS 81 13.673 19.346 -14.097
647 H LYS 82 HN LYS 82 10.652 21.566 -14.997
648 HA LYS 82 HA LYS 82 12.549 23.684 -14.695
649 HB2 LYS 82 HB2 LYS 82 9.783 23.507 -15.955
650 HB3 LYS 82 HB3 LYS 82 10.686 25.020 -15.874
651 HG2 LYS 82 HG2 LYS 82 12.530 24.102 -17.154
652 HG3 LYS 82 HG3 LYS 82 11.809 22.489 -17.147
653 HD2 LYS 82 HD2 LYS 82 9.865 23.341 -18.439
654 HD3 LYS 82 HD3 LYS 82 10.600 24.962 -18.461
655 HE2 LYS 82 HE2 LYS 82 12.592 24.024 -19.633
656 HE3 LYS 82 HE3 LYS 82 11.841 22.423 -19.623
657 HZ1 LYS 82 HZ1 LYS 82 10.063 23.327 -21.016
658 HZ2 LYS 82 HZ2 LYS 82 10.763 24.806 -21.021
659 HZ3 LYS 82 HZ3 LYS 82 11.509 23.547 -21.732
660 H VAL 83 HN VAL 83 9.297 23.005 -13.316
661 HA VAL 83 HA VAL 83 9.094 25.430 -11.945
662 HB VAL 83 HB VAL 83 7.845 22.702 -11.470
663 HG11 VAL 83 HG11 VAL 83 7.141 25.316 -10.072
664 HG12 VAL 83 HG12 VAL 83 6.157 23.833 -10.045
665 HG13 VAL 83 HG13 VAL 83 7.757 23.834 -9.304
666 HG21 VAL 83 HG21 VAL 83 7.221 23.950 -13.565
667 HG22 VAL 83 HG22 VAL 83 5.860 23.750 -12.459
668 HG23 VAL 83 HG23 VAL 83 6.699 25.313 -12.567
669 H ALA 84 HN ALA 84 10.588 22.322 -10.900
670 HA ALA 84 HA ALA 84 11.377 23.076 -8.298
671 HB1 ALA 84 HB1 ALA 84 12.841 21.314 -10.310
672 HB2 ALA 84 HB2 ALA 84 13.129 21.368 -8.569
673 HB3 ALA 84 HB3 ALA 84 11.560 20.807 -9.180
674 H GLY 85 HN GLY 85 12.653 24.177 -11.384
675 HA2 GLY 85 HA2 GLY 85 14.928 25.579 -10.067
676 HA3 GLY 85 HA3 GLY 85 14.814 25.141 -11.776
677 H LYS 86 HN LYS 86 11.885 26.389 -10.284
678 HA LYS 86 HA LYS 86 10.716 28.290 -10.511
679 HB2 LYS 86 HB2 LYS 86 13.452 29.645 -10.414
680 HB3 LYS 86 HB3 LYS 86 11.928 30.483 -10.221
681 HG2 LYS 86 HG2 LYS 86 12.932 28.340 -8.306
682 HG3 LYS 86 HG3 LYS 86 13.144 30.081 -8.125
683 HD2 LYS 86 HD2 LYS 86 10.513 30.179 -8.347
684 HD3 LYS 86 HD3 LYS 86 10.601 28.457 -7.911
685 HE2 LYS 86 HE2 LYS 86 11.986 29.119 -5.901
686 HE3 LYS 86 HE3 LYS 86 11.785 30.814 -6.359
687 HZ1 LYS 86 HZ1 LYS 86 10.188 30.304 -4.717
688 HZ2 LYS 86 HZ2 LYS 86 9.333 30.408 -6.104
689 HZ3 LYS 86 HZ3 LYS 86 9.705 28.931 -5.449
690 H THR 87 HN THR 87 11.575 26.926 -12.921
691 HA THR 87 HA THR 87 11.798 27.091 -15.141
692 HB THR 87 HB THR 87 9.840 29.406 -14.966
693 HG1 THR 87 HG1 THR 87 9.102 27.851 -13.570
694 HG21 THR 87 HG21 THR 87 10.459 28.752 -17.279
695 HG22 THR 87 HG22 THR 87 10.084 27.057 -16.913
696 HG23 THR 87 HG23 THR 87 8.796 28.281 -16.919
697 H GLN 88 HN GLN 88 13.893 28.328 -13.770
698 HA GLN 88 HA GLN 88 14.739 30.819 -14.808
699 HB2 GLN 88 HB2 GLN 88 15.780 29.624 -12.907
700 HB3 GLN 88 HB3 GLN 88 16.330 28.345 -13.999
701 HG2 GLN 88 HG2 GLN 88 17.791 29.973 -15.167
702 HG3 GLN 88 HG3 GLN 88 17.170 31.268 -14.137
703 HE21 GLN 88 HE22 GLN 88 19.225 31.772 -13.198
704 HE22 GLN 88 HE21 GLN 88 20.044 30.681 -12.108
Start of MODEL 7
1 HA MET 1 HA MET 1 3.812 -1.633 -2.224
2 H1 MET 1 H1 MET 1 2.472 -0.309 0.017
3 H2 MET 1 H2 MET 1 2.213 -1.858 -0.488
4 H3 MET 1 H3 MET 1 3.679 -1.413 0.126
5 HB2 MET 1 HB2 MET 1 1.423 -0.950 -2.672
6 HB3 MET 1 HB3 MET 1 1.885 0.732 -2.356
7 HG2 MET 1 HG2 MET 1 3.525 0.626 -4.211
8 HG3 MET 1 HG3 MET 1 3.134 -1.078 -4.467
9 HE1 MET 1 HE1 MET 1 3.268 0.785 -6.843
10 HE2 MET 1 HE2 MET 1 2.649 -0.870 -7.022
11 HE3 MET 1 HE3 MET 1 1.751 0.493 -7.724
12 H GLU 2 HN GLU 2 5.708 -0.675 -2.926
13 HA GLU 2 HA GLU 2 6.585 1.851 -1.625
14 HB2 GLU 2 HB2 GLU 2 8.268 -0.674 -1.999
15 HB3 GLU 2 HB3 GLU 2 8.789 0.859 -1.319
16 HG2 GLU 2 HG2 GLU 2 8.480 -0.444 0.570
17 HG3 GLU 2 HG3 GLU 2 7.000 0.509 0.504
18 H TRP 3 HN TRP 3 8.424 2.800 -2.927
19 HA TRP 3 HA TRP 3 8.083 2.163 -5.811
20 HD1 TRP 3 HD1 TRP 3 6.563 5.293 -2.977
21 HE1 TRP 3 HE1 TRP 3 4.009 5.360 -3.058
22 HE3 TRP 3 HE3 TRP 3 5.891 3.291 -7.632
23 HZ2 TRP 3 HZ2 TRP 3 1.916 4.621 -4.940
24 HZ3 TRP 3 HZ3 TRP 3 3.609 3.015 -8.563
25 HH2 TRP 3 HH2 TRP 3 1.619 3.669 -7.225
26 HB2 TRP 3 HB2 TRP 3 8.441 4.953 -4.699
27 HB3 TRP 3 HB3 TRP 3 8.009 4.493 -6.325
28 H LEU 4 HN LEU 4 9.821 2.967 -7.139
29 HA LEU 4 HA LEU 4 12.484 3.186 -5.805
30 HG LEU 4 HG LEU 4 13.925 3.175 -8.637
31 HB2 LEU 4 HB2 LEU 4 12.203 1.147 -7.153
32 HB3 LEU 4 HB3 LEU 4 11.646 2.123 -8.519
33 HD11 LEU 4 HD11 LEU 4 15.800 1.960 -7.518
34 HD12 LEU 4 HD12 LEU 4 14.754 2.789 -6.366
35 HD13 LEU 4 HD13 LEU 4 14.618 1.033 -6.573
36 HD21 LEU 4 HD21 LEU 4 13.854 0.132 -8.856
37 HD22 LEU 4 HD22 LEU 4 13.235 1.267 -10.076
38 HD23 LEU 4 HD23 LEU 4 14.966 1.228 -9.706
39 H VAL 5 HN VAL 5 13.495 5.001 -6.213
40 HA VAL 5 HA VAL 5 12.420 7.138 -7.989
41 HB VAL 5 HB VAL 5 14.982 7.091 -6.339
42 HG11 VAL 5 HG11 VAL 5 14.852 9.555 -6.537
43 HG12 VAL 5 HG12 VAL 5 15.074 8.760 -8.089
44 HG13 VAL 5 HG13 VAL 5 13.465 9.368 -7.635
45 HG21 VAL 5 HG21 VAL 5 12.195 8.121 -5.621
46 HG22 VAL 5 HG22 VAL 5 13.125 6.877 -4.768
47 HG23 VAL 5 HG23 VAL 5 13.669 8.551 -4.719
48 H LYS 6 HN LYS 6 12.807 6.727 -10.054
49 HA LYS 6 HA LYS 6 15.346 5.460 -10.967
50 HB2 LYS 6 HB2 LYS 6 12.640 5.836 -12.203
51 HB3 LYS 6 HB3 LYS 6 14.020 5.543 -13.229
52 HG2 LYS 6 HG2 LYS 6 13.679 3.670 -10.904
53 HG3 LYS 6 HG3 LYS 6 12.529 3.534 -12.222
54 HD2 LYS 6 HD2 LYS 6 14.445 1.990 -12.460
55 HD3 LYS 6 HD3 LYS 6 14.218 3.069 -13.839
56 HE2 LYS 6 HE2 LYS 6 16.064 4.508 -13.081
57 HE3 LYS 6 HE3 LYS 6 16.278 3.503 -11.633
58 HZ1 LYS 6 HZ1 LYS 6 17.865 2.926 -13.358
59 HZ2 LYS 6 HZ2 LYS 6 16.884 1.655 -13.093
60 HZ3 LYS 6 HZ3 LYS 6 16.685 2.583 -14.424
61 H LYS 7 HN LYS 7 13.764 8.577 -10.804
62 HA LYS 7 HA LYS 7 16.051 9.857 -12.065
63 HB2 LYS 7 HB2 LYS 7 13.266 10.623 -13.025
64 HB3 LYS 7 HB3 LYS 7 14.805 11.361 -13.459
65 HG2 LYS 7 HG2 LYS 7 15.484 9.087 -14.452
66 HG3 LYS 7 HG3 LYS 7 13.782 8.611 -14.239
67 HD2 LYS 7 HD2 LYS 7 13.235 10.761 -15.587
68 HD3 LYS 7 HD3 LYS 7 14.961 10.791 -15.992
69 HE2 LYS 7 HE2 LYS 7 14.795 8.535 -16.962
70 HE3 LYS 7 HE3 LYS 7 13.100 8.427 -16.473
71 HZ1 LYS 7 HZ1 LYS 7 12.586 10.236 -17.993
72 HZ2 LYS 7 HZ2 LYS 7 14.156 10.390 -18.427
73 HZ3 LYS 7 HZ3 LYS 7 13.329 9.037 -18.811
74 H SER 8 HN SER 8 16.194 12.071 -11.216
75 HA SER 8 HA SER 8 14.304 13.005 -9.150
76 HG SER 8 HG SER 8 17.940 12.375 -9.157
77 HB2 SER 8 HB2 SER 8 16.397 13.108 -7.620
78 HB3 SER 8 HB3 SER 8 15.568 11.558 -7.808
79 H CYS 9 HN CYS 9 14.777 15.262 -8.646
80 HA CYS 9 HA CYS 9 16.913 16.541 -10.280
81 HG CYS 9 HG CYS 9 13.331 19.159 -9.851
82 HB2 CYS 9 HB2 CYS 9 15.550 18.384 -10.721
83 HB3 CYS 9 HB3 CYS 9 14.464 17.005 -10.956
84 H CYS 10 HN CYS 10 17.432 18.775 -9.277
85 HA CYS 10 HA CYS 10 17.415 18.754 -6.308
86 HG CYS 10 HG CYS 10 19.536 17.006 -8.063
87 HB2 CYS 10 HB2 CYS 10 19.718 19.619 -8.118
88 HB3 CYS 10 HB3 CYS 10 19.633 19.850 -6.364
89 H ASN 11 HN ASN 11 16.864 20.849 -5.519
90 HA ASN 11 HA ASN 11 16.507 23.011 -7.546
91 HB2 ASN 11 HB2 ASN 11 14.319 23.394 -7.225
92 HB3 ASN 11 HB3 ASN 11 14.328 21.642 -7.107
93 HD21 ASN 11 HD22 ASN 11 14.122 20.693 -4.875
94 HD22 ASN 11 HD21 ASN 11 13.346 21.621 -3.651
95 H LYS 12 HN LYS 12 16.277 22.323 -4.032
96 HA LYS 12 HA LYS 12 16.603 23.492 -2.205
97 HB2 LYS 12 HB2 LYS 12 18.999 23.645 -3.648
98 HB3 LYS 12 HB3 LYS 12 18.738 25.296 -3.122
99 HG2 LYS 12 HG2 LYS 12 18.794 22.823 -1.336
100 HG3 LYS 12 HG3 LYS 12 20.128 23.954 -1.581
101 HD2 LYS 12 HD2 LYS 12 18.663 25.793 -0.649
102 HD3 LYS 12 HD3 LYS 12 17.474 24.563 -0.203
103 HE2 LYS 12 HE2 LYS 12 20.374 24.653 0.744
104 HE3 LYS 12 HE3 LYS 12 18.991 25.249 1.662
105 HZ1 LYS 12 HZ1 LYS 12 19.593 23.044 2.370
106 HZ2 LYS 12 HZ2 LYS 12 18.113 22.986 1.699
107 HZ3 LYS 12 HZ3 LYS 12 19.415 22.424 0.877
108 H GLN 13 HN GLN 13 16.151 25.613 -4.994
109 HA GLN 13 HA GLN 13 16.020 28.055 -3.548
110 HB2 GLN 13 HB2 GLN 13 15.216 27.176 -6.346
111 HB3 GLN 13 HB3 GLN 13 15.127 28.860 -5.818
112 HG2 GLN 13 HG2 GLN 13 17.441 29.103 -5.629
113 HG3 GLN 13 HG3 GLN 13 17.742 27.388 -5.411
114 HE21 GLN 13 HE22 GLN 13 17.701 25.942 -7.237
115 HE22 GLN 13 HE21 GLN 13 17.951 26.575 -8.857
116 H ASP 14 HN ASP 14 13.497 25.664 -4.386
117 HA ASP 14 HA ASP 14 11.623 27.348 -2.781
118 HB2 ASP 14 HB2 ASP 14 11.289 27.631 -5.292
119 HB3 ASP 14 HB3 ASP 14 10.774 25.945 -5.327
120 H ASN 15 HN ASN 15 13.156 24.512 -2.976
121 HA ASN 15 HA ASN 15 13.280 22.819 -1.570
122 HB2 ASN 15 HB2 ASN 15 11.998 24.457 0.033
123 HB3 ASN 15 HB3 ASN 15 10.650 23.352 -0.216
124 HD21 ASN 15 HD22 ASN 15 12.328 20.869 -0.349
125 HD22 ASN 15 HD21 ASN 15 12.930 20.620 1.286
126 H ARG 16 HN ARG 16 10.611 23.308 -3.602
127 HA ARG 16 HA ARG 16 9.411 20.674 -3.481
128 HE ARG 16 HE ARG 16 7.486 25.383 -5.274
129 HB2 ARG 16 HB2 ARG 16 9.351 22.803 -5.646
130 HB3 ARG 16 HB3 ARG 16 8.393 21.320 -5.676
131 HG2 ARG 16 HG2 ARG 16 7.248 21.998 -3.593
132 HG3 ARG 16 HG3 ARG 16 8.178 23.497 -3.547
133 HD2 ARG 16 HD2 ARG 16 6.299 22.684 -5.812
134 HD3 ARG 16 HD3 ARG 16 5.891 23.784 -4.498
135 HH11 ARG 16 HH11 ARG 16 7.067 22.735 -7.733
136 HH12 ARG 16 HH12 ARG 16 7.985 23.670 -8.887
137 HH21 ARG 16 HH21 ARG 16 8.536 26.422 -6.800
138 HH22 ARG 16 HH22 ARG 16 8.809 25.735 -8.411
139 H HIS 17 HN HIS 17 10.680 18.896 -3.963
140 HA HIS 17 HA HIS 17 12.537 19.006 -6.303
141 HD1 HIS 17 HD1 HIS 17 13.662 18.152 -2.177
142 HD2 HIS 17 HD2 HIS 17 15.110 18.609 -6.093
143 HE1 HIS 17 HE1 HIS 17 15.825 19.522 -1.993
144 HB2 HIS 17 HB2 HIS 17 12.210 17.003 -4.035
145 HB3 HIS 17 HB3 HIS 17 13.132 16.653 -5.498
146 H VAL 18 HN VAL 18 12.353 17.004 -7.767
147 HA VAL 18 HA VAL 18 9.699 15.777 -7.766
148 HB VAL 18 HB VAL 18 10.969 16.837 -10.316
149 HG11 VAL 18 HG11 VAL 18 9.334 14.934 -10.538
150 HG12 VAL 18 HG12 VAL 18 8.079 15.999 -9.868
151 HG13 VAL 18 HG13 VAL 18 8.886 16.383 -11.405
152 HG21 VAL 18 HG21 VAL 18 10.325 18.841 -9.034
153 HG22 VAL 18 HG22 VAL 18 9.219 18.618 -10.383
154 HG23 VAL 18 HG23 VAL 18 8.709 18.157 -8.758
155 H LEU 19 HN LEU 19 9.731 13.785 -8.582
156 HA LEU 19 HA LEU 19 12.232 12.639 -9.602
157 HG LEU 19 HG LEU 19 10.362 12.366 -6.220
158 HB2 LEU 19 HB2 LEU 19 11.467 10.675 -7.798
159 HB3 LEU 19 HB3 LEU 19 12.904 11.660 -7.751
160 HD11 LEU 19 HD11 LEU 19 11.222 10.195 -5.584
161 HD12 LEU 19 HD12 LEU 19 12.851 10.864 -5.362
162 HD13 LEU 19 HD13 LEU 19 11.507 11.376 -4.300
163 HD21 LEU 19 HD21 LEU 19 12.397 13.482 -4.811
164 HD22 LEU 19 HD22 LEU 19 13.176 13.506 -6.410
165 HD23 LEU 19 HD23 LEU 19 11.633 14.348 -6.132
166 H MET 20 HN MET 20 11.831 10.232 -10.122
167 HA MET 20 HA MET 20 9.062 9.978 -11.188
168 HB2 MET 20 HB2 MET 20 11.685 9.080 -12.378
169 HB3 MET 20 HB3 MET 20 10.193 8.162 -12.657
170 HG2 MET 20 HG2 MET 20 9.021 10.141 -13.420
171 HG3 MET 20 HG3 MET 20 10.432 11.155 -13.110
172 HE1 MET 20 HE1 MET 20 10.266 7.949 -16.473
173 HE2 MET 20 HE2 MET 20 10.644 7.515 -14.793
174 HE3 MET 20 HE3 MET 20 9.032 8.148 -15.210
175 H LEU 21 HN LEU 21 7.959 8.794 -10.012
176 HA LEU 21 HA LEU 21 9.104 6.854 -8.069
177 HG LEU 21 HG LEU 21 7.974 7.187 -5.987
178 HB2 LEU 21 HB2 LEU 21 6.446 8.274 -8.398
179 HB3 LEU 21 HB3 LEU 21 6.420 6.632 -7.762
180 HD11 LEU 21 HD11 LEU 21 9.384 8.898 -6.831
181 HD12 LEU 21 HD12 LEU 21 8.025 9.927 -7.288
182 HD13 LEU 21 HD13 LEU 21 8.442 9.708 -5.572
183 HD21 LEU 21 HD21 LEU 21 5.632 9.139 -6.149
184 HD22 LEU 21 HD22 LEU 21 5.550 7.450 -5.615
185 HD23 LEU 21 HD23 LEU 21 6.462 8.628 -4.661
186 H CYS 22 HN CYS 22 9.049 4.757 -8.508
187 HA CYS 22 HA CYS 22 7.536 3.798 -10.875
188 HG CYS 22 HG CYS 22 10.360 5.783 -10.727
189 HB2 CYS 22 HB2 CYS 22 10.485 3.273 -10.268
190 HB3 CYS 22 HB3 CYS 22 9.575 2.716 -11.680
191 H ASP 23 HN ASP 23 7.501 1.425 -10.943
192 HA ASP 23 HA ASP 23 6.912 0.057 -8.482
193 HB2 ASP 23 HB2 ASP 23 6.084 -1.010 -10.386
194 HB3 ASP 23 HB3 ASP 23 7.527 -0.666 -11.330
195 H ALA 24 HN ALA 24 8.270 -1.346 -7.223
196 HA ALA 24 HA ALA 24 11.064 -0.708 -7.009
197 HB1 ALA 24 HB1 ALA 24 11.075 -2.500 -5.321
198 HB2 ALA 24 HB2 ALA 24 9.731 -1.371 -5.070
199 HB3 ALA 24 HB3 ALA 24 9.427 -2.968 -5.793
200 H GLY 25 HN GLY 25 11.522 -1.025 -9.316
201 HA2 GLY 25 HA2 GLY 25 13.057 -3.056 -10.242
202 HA3 GLY 25 HA3 GLY 25 11.415 -3.715 -10.435
203 H GLY 26 HN GLY 26 10.688 -0.663 -10.822
204 HA2 GLY 26 HA2 GLY 26 10.702 0.942 -12.460
205 HA3 GLY 26 HA3 GLY 26 11.835 -0.014 -13.416
206 H ALA 27 HN ALA 27 9.093 -1.959 -12.576
207 HA ALA 27 HA ALA 27 8.404 -2.182 -15.340
208 HB1 ALA 27 HB1 ALA 27 6.742 -3.797 -14.562
209 HB2 ALA 27 HB2 ALA 27 8.264 -4.031 -13.683
210 HB3 ALA 27 HB3 ALA 27 6.894 -3.203 -12.897
211 H ILE 28 HN ILE 28 7.337 0.135 -13.093
212 HA ILE 28 HA ILE 28 5.142 1.106 -14.799
213 HB ILE 28 HB ILE 28 5.031 0.713 -11.763
214 HG12 ILE 28 HG12 ILE 28 4.418 -1.354 -12.955
215 HG13 ILE 28 HG13 ILE 28 3.103 -0.676 -12.021
216 HG21 ILE 28 HG21 ILE 28 4.054 2.867 -12.184
217 HG22 ILE 28 HG22 ILE 28 3.085 2.238 -13.534
218 HG23 ILE 28 HG23 ILE 28 2.746 1.737 -11.864
219 HD11 ILE 28 HD11 ILE 28 2.353 -1.556 -14.202
220 HD12 ILE 28 HD12 ILE 28 2.010 0.172 -14.044
221 HD13 ILE 28 HD13 ILE 28 3.375 -0.379 -15.045
222 H LYS 29 HN LYS 29 5.257 3.470 -14.744
223 HA LYS 29 HA LYS 29 7.169 4.694 -12.864
224 HB2 LYS 29 HB2 LYS 29 7.394 5.130 -15.875
225 HB3 LYS 29 HB3 LYS 29 8.303 5.943 -14.597
226 HG2 LYS 29 HG2 LYS 29 9.126 3.555 -13.936
227 HG3 LYS 29 HG3 LYS 29 8.525 3.056 -15.516
228 HD2 LYS 29 HD2 LYS 29 10.056 4.641 -16.622
229 HD3 LYS 29 HD3 LYS 29 10.513 5.320 -15.057
230 HE2 LYS 29 HE2 LYS 29 12.295 3.904 -15.768
231 HE3 LYS 29 HE3 LYS 29 11.532 3.195 -14.354
232 HZ1 LYS 29 HZ1 LYS 29 10.424 1.592 -15.794
233 HZ2 LYS 29 HZ2 LYS 29 10.969 2.343 -17.152
234 HZ3 LYS 29 HZ3 LYS 29 12.011 1.583 -16.165
235 H MET 30 HN MET 30 6.659 6.780 -12.358
236 HA MET 30 HA MET 30 4.564 8.335 -13.711
237 HB2 MET 30 HB2 MET 30 3.516 8.661 -11.390
238 HB3 MET 30 HB3 MET 30 3.109 7.203 -12.295
239 HG2 MET 30 HG2 MET 30 4.730 5.930 -10.901
240 HG3 MET 30 HG3 MET 30 5.036 7.398 -9.965
241 HE1 MET 30 HE1 MET 30 2.043 8.647 -9.639
242 HE2 MET 30 HE2 MET 30 1.648 7.906 -8.075
243 HE3 MET 30 HE3 MET 30 3.291 8.518 -8.373
244 H ILE 31 HN ILE 31 4.523 10.544 -12.502
245 HA ILE 31 HA ILE 31 7.306 11.314 -11.731
246 HB ILE 31 HB ILE 31 5.204 12.929 -13.173
247 HG12 ILE 31 HG12 ILE 31 7.919 12.219 -14.339
248 HG13 ILE 31 HG13 ILE 31 6.620 11.038 -14.454
249 HG21 ILE 31 HG21 ILE 31 7.143 14.585 -13.443
250 HG22 ILE 31 HG22 ILE 31 6.549 14.422 -11.796
251 HG23 ILE 31 HG23 ILE 31 8.053 13.606 -12.289
252 HD11 ILE 31 HD11 ILE 31 6.393 13.897 -15.424
253 HD12 ILE 31 HD12 ILE 31 6.659 12.465 -16.434
254 HD13 ILE 31 HD13 ILE 31 5.143 12.645 -15.523
255 H ALA 32 HN ALA 32 7.386 12.452 -9.718
256 HA ALA 32 HA ALA 32 4.810 13.320 -8.537
257 HB1 ALA 32 HB1 ALA 32 6.917 11.781 -6.988
258 HB2 ALA 32 HB2 ALA 32 5.358 12.363 -6.390
259 HB3 ALA 32 HB3 ALA 32 5.399 11.051 -7.592
260 H GLU 33 HN GLU 33 4.978 15.220 -7.564
261 HA GLU 33 HA GLU 33 7.638 16.525 -7.328
262 HB2 GLU 33 HB2 GLU 33 5.857 17.825 -8.533
263 HB3 GLU 33 HB3 GLU 33 4.798 17.660 -7.118
264 HG2 GLU 33 HG2 GLU 33 6.464 18.914 -5.758
265 HG3 GLU 33 HG3 GLU 33 7.488 19.094 -7.165
266 H VAL 34 HN VAL 34 8.318 17.046 -5.253
267 HA VAL 34 HA VAL 34 6.730 16.159 -2.944
268 HB VAL 34 HB VAL 34 8.504 14.768 -2.134
269 HG11 VAL 34 HG11 VAL 34 8.099 13.851 -5.002
270 HG12 VAL 34 HG12 VAL 34 8.427 12.862 -3.563
271 HG13 VAL 34 HG13 VAL 34 6.876 13.684 -3.736
272 HG21 VAL 34 HG21 VAL 34 10.062 15.444 -4.657
273 HG22 VAL 34 HG22 VAL 34 10.500 15.844 -2.975
274 HG23 VAL 34 HG23 VAL 34 10.496 14.166 -3.506
275 H LYS 35 HN LYS 35 8.121 16.729 -0.905
276 HA LYS 35 HA LYS 35 9.947 19.015 -1.327
277 HB2 LYS 35 HB2 LYS 35 7.624 19.765 -0.495
278 HB3 LYS 35 HB3 LYS 35 7.948 18.852 0.981
279 HG2 LYS 35 HG2 LYS 35 9.991 20.220 1.342
280 HG3 LYS 35 HG3 LYS 35 9.657 21.121 -0.153
281 HD2 LYS 35 HD2 LYS 35 7.847 21.047 2.303
282 HD3 LYS 35 HD3 LYS 35 9.012 22.326 1.935
283 HE2 LYS 35 HE2 LYS 35 7.813 22.797 -0.206
284 HE3 LYS 35 HE3 LYS 35 6.614 21.562 0.205
285 HZ1 LYS 35 HZ1 LYS 35 7.127 24.024 1.776
286 HZ2 LYS 35 HZ2 LYS 35 5.846 23.768 0.806
287 HZ3 LYS 35 HZ3 LYS 35 6.024 22.881 2.159
288 H SER 36 HN SER 36 11.716 18.830 0.122
289 HA SER 36 HA SER 36 11.889 16.219 1.568
290 HG SER 36 HG SER 36 13.260 15.818 -1.763
291 HB2 SER 36 HB2 SER 36 14.211 17.232 -0.033
292 HB3 SER 36 HB3 SER 36 13.727 15.574 0.357
293 H ASP 37 HN ASP 37 13.405 16.077 3.251
294 HA ASP 37 HA ASP 37 14.680 18.639 4.127
295 HB2 ASP 37 HB2 ASP 37 12.808 17.842 5.568
296 HB3 ASP 37 HB3 ASP 37 13.688 16.339 5.844
297 H PHE 38 HN PHE 38 15.357 15.870 2.590
298 HA PHE 38 HA PHE 38 18.170 15.761 3.392
299 HD1 PHE 38 HD1 PHE 38 14.777 14.046 4.844
300 HD2 PHE 38 HD2 PHE 38 18.962 13.470 5.713
301 HE1 PHE 38 HE1 PHE 38 14.260 13.970 7.266
302 HE2 PHE 38 HE2 PHE 38 18.438 13.372 8.137
303 HZ PHE 38 HZ PHE 38 16.088 13.621 8.919
304 HB2 PHE 38 HB2 PHE 38 16.435 13.274 3.099
305 HB3 PHE 38 HB3 PHE 38 18.151 13.306 3.433
306 H ALA 39 HN ALA 39 19.383 14.690 1.555
307 HA ALA 39 HA ALA 39 18.396 15.432 -1.022
308 HB1 ALA 39 HB1 ALA 39 20.808 15.340 -0.486
309 HB2 ALA 39 HB2 ALA 39 20.693 13.578 -0.242
310 HB3 ALA 39 HB3 ALA 39 20.421 14.276 -1.851
311 H VAL 40 HN VAL 40 17.804 14.036 -2.786
312 HA VAL 40 HA VAL 40 17.209 11.204 -2.228
313 HB VAL 40 HB VAL 40 15.193 12.988 -3.661
314 HG11 VAL 40 HG11 VAL 40 15.068 10.602 -4.185
315 HG12 VAL 40 HG12 VAL 40 15.063 10.184 -2.462
316 HG13 VAL 40 HG13 VAL 40 13.685 11.043 -3.168
317 HG21 VAL 40 HG21 VAL 40 15.084 12.166 -0.743
318 HG22 VAL 40 HG22 VAL 40 15.168 13.827 -1.366
319 HG23 VAL 40 HG23 VAL 40 13.728 12.854 -1.660
320 H LYS 41 HN LYS 41 17.630 9.952 -4.109
321 HA LYS 41 HA LYS 41 18.225 11.302 -6.630
322 HB2 LYS 41 HB2 LYS 41 20.582 10.275 -6.667
323 HB3 LYS 41 HB3 LYS 41 20.298 11.775 -5.816
324 HG2 LYS 41 HG2 LYS 41 21.804 10.403 -4.541
325 HG3 LYS 41 HG3 LYS 41 20.306 10.637 -3.652
326 HD2 LYS 41 HD2 LYS 41 19.577 8.329 -4.505
327 HD3 LYS 41 HD3 LYS 41 21.194 8.157 -5.185
328 HE2 LYS 41 HE2 LYS 41 21.168 7.033 -3.063
329 HE3 LYS 41 HE3 LYS 41 22.139 8.499 -2.865
330 HZ1 LYS 41 HZ1 LYS 41 19.291 8.181 -2.078
331 HZ2 LYS 41 HZ2 LYS 41 20.568 8.162 -1.038
332 HZ3 LYS 41 HZ3 LYS 41 20.183 9.540 -1.836
333 H VAL 42 HN VAL 42 18.957 9.697 -8.300
334 HA VAL 42 HA VAL 42 17.139 7.639 -8.565
335 HB VAL 42 HB VAL 42 19.886 7.920 -9.878
336 HG11 VAL 42 HG11 VAL 42 19.086 5.695 -10.358
337 HG12 VAL 42 HG12 VAL 42 17.431 6.280 -10.612
338 HG13 VAL 42 HG13 VAL 42 18.720 6.675 -11.777
339 HG21 VAL 42 HG21 VAL 42 18.668 9.928 -10.275
340 HG22 VAL 42 HG22 VAL 42 18.344 8.949 -11.706
341 HG23 VAL 42 HG23 VAL 42 17.129 9.055 -10.396
342 H GLY 43 HN GLY 43 17.130 5.456 -8.397
343 HA2 GLY 43 HA2 GLY 43 17.639 3.368 -7.653
344 HA3 GLY 43 HA3 GLY 43 19.280 3.888 -7.218
345 H ASP 44 HN ASP 44 16.259 5.567 -6.142
346 HA ASP 44 HA ASP 44 17.114 4.800 -3.318
347 HB2 ASP 44 HB2 ASP 44 15.747 7.322 -4.268
348 HB3 ASP 44 HB3 ASP 44 15.386 6.644 -2.688
349 H LEU 45 HN LEU 45 15.577 3.861 -1.911
350 HA LEU 45 HA LEU 45 13.082 2.937 -3.218
351 HG LEU 45 HG LEU 45 11.600 1.919 -0.957
352 HB2 LEU 45 HB2 LEU 45 14.554 1.491 -1.619
353 HB3 LEU 45 HB3 LEU 45 14.007 2.582 -0.345
354 HD11 LEU 45 HD11 LEU 45 12.083 0.922 -3.198
355 HD12 LEU 45 HD12 LEU 45 13.041 -0.345 -2.412
356 HD13 LEU 45 HD13 LEU 45 11.293 -0.222 -2.110
357 HD21 LEU 45 HD21 LEU 45 11.755 -0.186 0.320
358 HD22 LEU 45 HD22 LEU 45 13.524 -0.181 0.115
359 HD23 LEU 45 HD23 LEU 45 12.714 1.113 1.037
360 H LEU 46 HN LEU 46 11.047 3.654 -2.433
361 HA LEU 46 HA LEU 46 10.985 5.695 -0.272
362 HG LEU 46 HG LEU 46 11.462 6.813 -3.192
363 HB2 LEU 46 HB2 LEU 46 9.313 5.702 -2.819
364 HB3 LEU 46 HB3 LEU 46 9.014 6.716 -1.419
365 HD11 LEU 46 HD11 LEU 46 9.065 8.689 -2.900
366 HD12 LEU 46 HD12 LEU 46 10.507 9.064 -3.853
367 HD13 LEU 46 HD13 LEU 46 9.486 7.696 -4.312
368 HD21 LEU 46 HD21 LEU 46 10.675 8.523 -0.806
369 HD22 LEU 46 HD22 LEU 46 12.099 7.491 -0.960
370 HD23 LEU 46 HD23 LEU 46 11.979 8.943 -1.957
371 H SER 47 HN SER 47 9.963 4.737 1.341
372 HA SER 47 HA SER 47 7.687 2.893 0.717
373 HG SER 47 HG SER 47 10.321 0.915 2.194
374 HB2 SER 47 HB2 SER 47 9.364 2.718 3.227
375 HB3 SER 47 HB3 SER 47 8.165 1.576 2.622
376 HA PRO 48 HA PRO 48 5.425 6.092 2.550
377 HB2 PRO 48 HB2 PRO 48 3.064 4.889 3.313
378 HB3 PRO 48 HB3 PRO 48 3.533 5.204 1.618
379 HG2 PRO 48 HG2 PRO 48 3.820 2.630 3.185
380 HG3 PRO 48 HG3 PRO 48 3.202 2.857 1.516
381 HD2 PRO 48 HD2 PRO 48 5.768 2.075 2.018
382 HD3 PRO 48 HD3 PRO 48 5.375 3.168 0.657
383 H LEU 49 HN LEU 49 4.844 7.076 4.404
384 HA LEU 49 HA LEU 49 5.126 5.688 7.046
385 HG LEU 49 HG LEU 49 7.715 6.739 5.594
386 HB2 LEU 49 HB2 LEU 49 6.037 8.488 6.259
387 HB3 LEU 49 HB3 LEU 49 6.047 7.853 7.896
388 HD11 LEU 49 HD11 LEU 49 9.602 7.869 6.738
389 HD12 LEU 49 HD12 LEU 49 8.383 9.022 6.167
390 HD13 LEU 49 HD13 LEU 49 8.462 8.601 7.889
391 HD21 LEU 49 HD21 LEU 49 7.297 5.043 7.330
392 HD22 LEU 49 HD22 LEU 49 8.973 5.595 7.399
393 HD23 LEU 49 HD23 LEU 49 7.800 6.186 8.597
394 H GLN 50 HN GLN 50 3.761 8.265 5.045
395 HA GLN 50 HA GLN 50 1.161 8.116 6.406
396 HB2 GLN 50 HB2 GLN 50 2.900 10.580 6.053
397 HB3 GLN 50 HB3 GLN 50 1.172 10.761 5.839
398 HG2 GLN 50 HG2 GLN 50 0.636 10.260 7.989
399 HG3 GLN 50 HG3 GLN 50 2.139 9.359 8.294
400 HE21 GLN 50 HE22 GLN 50 1.680 12.749 7.037
401 HE22 GLN 50 HE21 GLN 50 2.665 13.465 8.287
402 H ASN 51 HN ASN 51 -0.331 9.521 4.789
403 HA ASN 51 HA ASN 51 -0.287 8.422 2.178
404 HB2 ASN 51 HB2 ASN 51 -2.289 9.440 3.140
405 HB3 ASN 51 HB3 ASN 51 -1.482 10.997 3.299
406 HD21 ASN 51 HD22 ASN 51 -1.581 12.434 1.514
407 HD22 ASN 51 HD21 ASN 51 -2.188 11.981 -0.053
408 H ALA 52 HN ALA 52 1.079 11.506 3.420
409 HA ALA 52 HA ALA 52 2.215 12.126 0.839
410 HB1 ALA 52 HB1 ALA 52 0.992 13.835 2.159
411 HB2 ALA 52 HB2 ALA 52 2.191 13.673 3.464
412 HB3 ALA 52 HB3 ALA 52 2.674 14.288 1.864
413 H LEU 53 HN LEU 53 3.353 11.335 4.195
414 HA LEU 53 HA LEU 53 6.092 11.894 3.388
415 HG LEU 53 HG LEU 53 4.977 13.231 5.726
416 HB2 LEU 53 HB2 LEU 53 5.034 10.668 5.949
417 HB3 LEU 53 HB3 LEU 53 6.737 10.763 5.577
418 HD11 LEU 53 HD11 LEU 53 6.877 12.048 7.806
419 HD12 LEU 53 HD12 LEU 53 5.980 13.577 7.948
420 HD13 LEU 53 HD13 LEU 53 5.107 12.037 7.908
421 HD21 LEU 53 HD21 LEU 53 7.062 13.538 4.397
422 HD22 LEU 53 HD22 LEU 53 7.173 14.402 5.933
423 HD23 LEU 53 HD23 LEU 53 8.019 12.860 5.719
424 H TYR 54 HN TYR 54 7.599 10.546 2.718
425 HA TYR 54 HA TYR 54 7.235 7.615 2.983
426 HD1 TYR 54 HD2 TYR 54 5.505 9.659 0.490
427 HD2 TYR 54 HD1 TYR 54 7.303 5.781 0.044
428 HE1 TYR 54 HE2 TYR 54 3.429 8.826 -0.562
429 HE2 TYR 54 HE1 TYR 54 5.230 4.916 -0.969
430 HH TYR 54 HH TYR 54 2.349 6.968 -1.528
431 HB2 TYR 54 HB2 TYR 54 8.126 9.222 0.550
432 HB3 TYR 54 HB3 TYR 54 8.624 7.563 0.802
433 H CYS 55 HN CYS 55 9.222 6.567 3.406
434 HA CYS 55 HA CYS 55 11.366 8.204 4.547
435 HG CYS 55 HG CYS 55 11.621 3.700 4.485
436 HB2 CYS 55 HB2 CYS 55 12.457 6.111 4.985
437 HB3 CYS 55 HB3 CYS 55 10.759 5.960 5.479
438 H ILE 56 HN ILE 56 13.653 7.871 3.650
439 HA ILE 56 HA ILE 56 13.650 7.561 0.671
440 HB ILE 56 HB ILE 56 15.555 9.153 2.418
441 HG12 ILE 56 HG12 ILE 56 13.671 10.398 0.394
442 HG13 ILE 56 HG13 ILE 56 13.128 10.118 2.046
443 HG21 ILE 56 HG21 ILE 56 16.371 10.072 0.175
444 HG22 ILE 56 HG22 ILE 56 16.765 8.388 0.431
445 HG23 ILE 56 HG23 ILE 56 15.404 8.820 -0.613
446 HD11 ILE 56 HD11 ILE 56 14.039 12.409 1.712
447 HD12 ILE 56 HD12 ILE 56 14.834 11.485 2.992
448 HD13 ILE 56 HD13 ILE 56 15.636 11.712 1.434
449 H ASN 57 HN ASN 57 15.175 6.340 -0.220
450 HA ASN 57 HA ASN 57 16.931 5.076 -0.654
451 HB2 ASN 57 HB2 ASN 57 18.247 6.681 0.772
452 HB3 ASN 57 HB3 ASN 57 17.994 5.617 2.162
453 HD21 ASN 57 HD22 ASN 57 19.122 5.640 -1.215
454 HD22 ASN 57 HD21 ASN 57 20.382 4.414 -1.013
455 H ARG 58 HN ARG 58 16.258 4.405 2.751
456 HA ARG 58 HA ARG 58 15.217 1.802 2.414
457 HE ARG 58 HE ARG 58 20.961 0.692 4.982
458 HB2 ARG 58 HB2 ARG 58 17.043 0.400 3.134
459 HB3 ARG 58 HB3 ARG 58 17.626 1.330 1.768
460 HG2 ARG 58 HG2 ARG 58 18.653 2.961 3.519
461 HG3 ARG 58 HG3 ARG 58 18.274 1.714 4.717
462 HD2 ARG 58 HD2 ARG 58 19.568 0.066 3.295
463 HD3 ARG 58 HD3 ARG 58 20.093 1.418 2.289
464 HH11 ARG 58 HH21 ARG 58 20.903 3.373 2.625
465 HH12 ARG 58 HH22 ARG 58 22.295 4.147 3.298
466 HH21 ARG 58 HH11 ARG 58 22.778 1.756 5.871
467 HH22 ARG 58 HH12 ARG 58 23.363 3.223 5.187
468 H GLU 59 HN GLU 59 15.725 4.598 4.304
469 HA GLU 59 HA GLU 59 15.187 3.126 6.809
470 HB2 GLU 59 HB2 GLU 59 16.891 4.299 8.007
471 HB3 GLU 59 HB3 GLU 59 17.608 3.371 6.689
472 HG2 GLU 59 HG2 GLU 59 17.723 5.519 5.336
473 HG3 GLU 59 HG3 GLU 59 17.191 6.393 6.778
474 H LYS 60 HN LYS 60 14.007 4.145 8.247
475 HA LYS 60 HA LYS 60 12.129 5.988 7.188
476 HB2 LYS 60 HB2 LYS 60 12.460 4.992 10.044
477 HB3 LYS 60 HB3 LYS 60 11.052 5.852 9.408
478 HG2 LYS 60 HG2 LYS 60 10.733 4.017 7.715
479 HG3 LYS 60 HG3 LYS 60 12.048 3.118 8.491
480 HD2 LYS 60 HD2 LYS 60 10.789 3.105 10.628
481 HD3 LYS 60 HD3 LYS 60 9.466 4.006 9.853
482 HE2 LYS 60 HE2 LYS 60 9.156 2.156 8.225
483 HE3 LYS 60 HE3 LYS 60 10.477 1.259 8.984
484 HZ1 LYS 60 HZ1 LYS 60 8.330 0.506 9.777
485 HZ2 LYS 60 HZ2 LYS 60 9.156 1.160 11.018
486 HZ3 LYS 60 HZ3 LYS 60 7.932 1.989 10.318
487 H LEU 61 HN LEU 61 15.032 6.627 9.006
488 HA LEU 61 HA LEU 61 14.202 8.997 10.311
489 HG LEU 61 HG LEU 61 16.326 6.447 10.664
490 HB2 LEU 61 HB2 LEU 61 16.994 8.326 9.265
491 HB3 LEU 61 HB3 LEU 61 16.598 9.480 10.536
492 HD11 LEU 61 HD11 LEU 61 18.129 8.393 12.160
493 HD12 LEU 61 HD12 LEU 61 18.085 6.623 12.361
494 HD13 LEU 61 HD13 LEU 61 18.612 7.327 10.821
495 HD21 LEU 61 HD21 LEU 61 14.482 7.391 11.926
496 HD22 LEU 61 HD22 LEU 61 15.702 6.787 13.053
497 HD23 LEU 61 HD23 LEU 61 15.569 8.537 12.747
498 H HIS 62 HN HIS 62 15.407 8.386 7.063
499 HA HIS 62 HA HIS 62 15.644 11.266 6.428
500 HD1 HIS 62 HD1 HIS 62 18.752 8.370 4.147
501 HD2 HIS 62 HD2 HIS 62 17.754 10.612 7.568
502 HE1 HIS 62 HE1 HIS 62 20.834 8.419 5.606
503 HB2 HIS 62 HB2 HIS 62 16.052 8.794 4.697
504 HB3 HIS 62 HB3 HIS 62 16.460 10.456 4.267
505 H THR 63 HN THR 63 13.734 12.327 5.764
506 HA THR 63 HA THR 63 11.608 10.671 4.544
507 HB THR 63 HB THR 63 10.111 12.231 5.826
508 HG1 THR 63 HG1 THR 63 11.045 13.460 7.452
509 HG21 THR 63 HG21 THR 63 10.817 9.932 6.615
510 HG22 THR 63 HG22 THR 63 12.058 10.714 7.615
511 HG23 THR 63 HG23 THR 63 10.334 11.044 7.910
512 H VAL 64 HN VAL 64 10.199 11.580 3.133
513 HA VAL 64 HA VAL 64 10.683 14.266 1.996
514 HB VAL 64 HB VAL 64 12.071 12.728 0.706
515 HG11 VAL 64 HG11 VAL 64 10.991 10.561 1.117
516 HG12 VAL 64 HG12 VAL 64 9.593 11.065 0.145
517 HG13 VAL 64 HG13 VAL 64 11.190 10.873 -0.605
518 HG21 VAL 64 HG21 VAL 64 10.895 14.531 -0.512
519 HG22 VAL 64 HG22 VAL 64 11.261 13.120 -1.512
520 HG23 VAL 64 HG23 VAL 64 9.609 13.359 -0.914
521 H LYS 65 HN LYS 65 8.688 15.072 1.010
522 HA LYS 65 HA LYS 65 6.252 13.594 1.919
523 HB2 LYS 65 HB2 LYS 65 7.014 15.573 3.319
524 HB3 LYS 65 HB3 LYS 65 6.753 16.597 1.902
525 HG2 LYS 65 HG2 LYS 65 4.369 15.893 1.847
526 HG3 LYS 65 HG3 LYS 65 4.630 14.899 3.289
527 HD2 LYS 65 HD2 LYS 65 4.960 17.927 3.122
528 HD3 LYS 65 HD3 LYS 65 3.540 17.081 3.753
529 HE2 LYS 65 HE2 LYS 65 4.957 16.022 5.515
530 HE3 LYS 65 HE3 LYS 65 6.361 16.916 4.913
531 HZ1 LYS 65 HZ1 LYS 65 5.202 18.977 5.473
532 HZ2 LYS 65 HZ2 LYS 65 3.908 18.150 6.034
533 HZ3 LYS 65 HZ3 LYS 65 5.345 18.034 6.792
534 H VAL 66 HN VAL 66 4.797 13.238 0.320
535 HA VAL 66 HA VAL 66 5.344 14.178 -2.381
536 HB VAL 66 HB VAL 66 3.077 12.528 -1.169
537 HG11 VAL 66 HG11 VAL 66 2.565 11.889 -3.550
538 HG12 VAL 66 HG12 VAL 66 2.218 13.586 -3.220
539 HG13 VAL 66 HG13 VAL 66 3.690 13.147 -4.112
540 HG21 VAL 66 HG21 VAL 66 4.205 10.640 -2.300
541 HG22 VAL 66 HG22 VAL 66 5.470 11.728 -2.907
542 HG23 VAL 66 HG23 VAL 66 5.315 11.414 -1.169
543 H LEU 67 HN LEU 67 4.237 15.707 -3.553
544 HA LEU 67 HA LEU 67 2.278 17.408 -2.056
545 HG LEU 67 HG LEU 67 5.524 17.883 -2.345
546 HB2 LEU 67 HB2 LEU 67 4.118 18.229 -4.327
547 HB3 LEU 67 HB3 LEU 67 3.031 19.268 -3.413
548 HD11 LEU 67 HD11 LEU 67 6.528 20.066 -2.306
549 HD12 LEU 67 HD12 LEU 67 5.876 19.802 -3.912
550 HD13 LEU 67 HD13 LEU 67 4.996 20.844 -2.783
551 HD21 LEU 67 HD21 LEU 67 3.904 18.097 -0.511
552 HD22 LEU 67 HD22 LEU 67 5.243 19.221 -0.301
553 HD23 LEU 67 HD23 LEU 67 3.672 19.816 -0.894
554 H SER 68 HN SER 68 3.188 16.025 -5.265
555 HA SER 68 HA SER 68 0.393 15.661 -6.038
556 HG SER 68 HG SER 68 0.703 19.055 -7.313
557 HB2 SER 68 HB2 SER 68 2.282 17.440 -7.664
558 HB3 SER 68 HB3 SER 68 0.663 16.925 -8.151
559 H ALA 69 HN ALA 69 0.329 14.211 -8.004
560 HA ALA 69 HA ALA 69 2.827 13.498 -9.248
561 HB1 ALA 69 HB1 ALA 69 1.318 11.345 -7.687
562 HB2 ALA 69 HB2 ALA 69 2.712 11.077 -8.759
563 HB3 ALA 69 HB3 ALA 69 2.919 12.003 -7.266
564 H SER 70 HN SER 70 2.532 12.115 -11.103
565 HA SER 70 HA SER 70 -0.179 11.651 -12.163
566 HG SER 70 HG SER 70 -0.621 14.181 -12.339
567 HB2 SER 70 HB2 SER 70 1.828 13.452 -13.599
568 HB3 SER 70 HB3 SER 70 0.206 13.020 -14.154
569 H SER 71 HN SER 71 -0.035 10.344 -14.210
570 HA SER 71 HA SER 71 1.955 8.382 -14.343
571 HG SER 71 HG SER 71 -1.288 7.905 -15.854
572 HB2 SER 71 HB2 SER 71 0.245 9.437 -16.630
573 HB3 SER 71 HB3 SER 71 0.927 7.809 -16.458
574 H TYR 72 HN TYR 72 3.662 8.035 -15.939
575 HA TYR 72 HA TYR 72 5.336 10.335 -16.190
576 HD1 TYR 72 HD1 TYR 72 7.858 10.367 -16.399
577 HD2 TYR 72 HD2 TYR 72 6.822 7.313 -19.266
578 HE1 TYR 72 HE1 TYR 72 9.781 11.028 -17.793
579 HE2 TYR 72 HE2 TYR 72 8.773 7.946 -20.645
580 HH TYR 72 HH TYR 72 10.648 9.344 -20.831
581 HB2 TYR 72 HB2 TYR 72 6.331 8.166 -15.880
582 HB3 TYR 72 HB3 TYR 72 5.526 7.523 -17.310
583 H SER 73 HN SER 73 5.931 11.568 -17.934
584 HA SER 73 HA SER 73 5.377 10.821 -20.634
585 HG SER 73 HG SER 73 3.101 10.992 -19.767
586 HB2 SER 73 HB2 SER 73 4.064 13.267 -19.376
587 HB3 SER 73 HB3 SER 73 4.320 13.112 -21.129
588 HA PRO 74 HA PRO 74 9.396 12.418 -20.315
589 HB2 PRO 74 HB2 PRO 74 9.983 13.245 -22.933
590 HB3 PRO 74 HB3 PRO 74 10.047 11.564 -22.318
591 HG2 PRO 74 HG2 PRO 74 7.844 12.943 -23.853
592 HG3 PRO 74 HG3 PRO 74 8.452 11.269 -24.035
593 HD2 PRO 74 HD2 PRO 74 6.163 11.823 -22.676
594 HD3 PRO 74 HD3 PRO 74 7.280 10.538 -22.119
595 H ASP 75 HN ASP 75 7.481 14.654 -22.406
596 HA ASP 75 HA ASP 75 8.993 16.970 -21.806
597 HB2 ASP 75 HB2 ASP 75 7.442 16.885 -23.686
598 HB3 ASP 75 HB3 ASP 75 6.068 16.689 -22.592
599 H GLU 76 HN GLU 76 6.075 15.623 -20.237
600 HA GLU 76 HA GLU 76 5.685 17.712 -18.378
601 HB2 GLU 76 HB2 GLU 76 4.186 15.643 -19.164
602 HB3 GLU 76 HB3 GLU 76 4.939 14.840 -17.789
603 HG2 GLU 76 HG2 GLU 76 2.974 15.706 -16.885
604 HG3 GLU 76 HG3 GLU 76 4.156 16.926 -16.419
605 H TRP 77 HN TRP 77 7.735 14.782 -18.243
606 HA TRP 77 HA TRP 77 8.486 14.957 -15.489
607 HD1 TRP 77 HD1 TRP 77 10.919 13.865 -14.420
608 HE1 TRP 77 HE1 TRP 77 13.458 13.609 -14.533
609 HE3 TRP 77 HE3 TRP 77 11.409 13.001 -19.436
610 HZ2 TRP 77 HZ2 TRP 77 15.483 13.285 -16.592
611 HZ3 TRP 77 HZ3 TRP 77 13.650 12.729 -20.452
612 HH2 TRP 77 HH2 TRP 77 15.697 12.895 -19.045
613 HB2 TRP 77 HB2 TRP 77 8.981 12.908 -16.453
614 HB3 TRP 77 HB3 TRP 77 9.467 13.597 -17.981
615 H GLU 78 HN GLU 78 10.146 16.119 -18.501
616 HA GLU 78 HA GLU 78 12.225 17.379 -17.039
617 HB2 GLU 78 HB2 GLU 78 11.182 17.922 -19.853
618 HB3 GLU 78 HB3 GLU 78 12.649 18.644 -19.172
619 HG2 GLU 78 HG2 GLU 78 13.536 16.322 -18.744
620 HG3 GLU 78 HG3 GLU 78 12.142 15.677 -19.609
621 H ARG 79 HN ARG 79 9.146 18.672 -18.249
622 HA ARG 79 HA ARG 79 9.418 21.379 -17.569
623 HE ARG 79 HE ARG 79 4.726 23.349 -17.669
624 HB2 ARG 79 HB2 ARG 79 7.597 20.335 -18.873
625 HB3 ARG 79 HB3 ARG 79 7.022 19.510 -17.423
626 HG2 ARG 79 HG2 ARG 79 6.592 21.834 -16.415
627 HG3 ARG 79 HG3 ARG 79 6.972 22.496 -18.024
628 HD2 ARG 79 HD2 ARG 79 5.182 20.954 -18.971
629 HD3 ARG 79 HD3 ARG 79 4.802 20.480 -17.308
630 HH11 ARG 79 HH11 ARG 79 2.814 20.371 -18.132
631 HH12 ARG 79 HH12 ARG 79 1.294 21.209 -18.156
632 HH21 ARG 79 HH21 ARG 79 2.699 24.432 -17.665
633 HH22 ARG 79 HH22 ARG 79 1.232 23.554 -17.866
634 H GLN 80 HN GLN 80 8.101 18.690 -15.495
635 HA GLN 80 HA GLN 80 7.765 20.393 -13.237
636 HB2 GLN 80 HB2 GLN 80 8.017 17.372 -13.503
637 HB3 GLN 80 HB3 GLN 80 7.675 18.197 -11.970
638 HG2 GLN 80 HG2 GLN 80 5.628 19.130 -12.781
639 HG3 GLN 80 HG3 GLN 80 5.945 18.582 -14.425
640 HE21 GLN 80 HE22 GLN 80 5.656 16.422 -14.987
641 HE22 GLN 80 HE21 GLN 80 4.713 15.322 -13.980
642 H CYS 81 HN CYS 81 10.551 18.368 -14.312
643 HA CYS 81 HA CYS 81 12.059 18.688 -11.921
644 HG CYS 81 HG CYS 81 11.305 16.340 -14.049
645 HB2 CYS 81 HB2 CYS 81 12.920 18.162 -14.791
646 HB3 CYS 81 HB3 CYS 81 14.013 18.096 -13.394
647 H LYS 82 HN LYS 82 11.788 20.898 -14.763
648 HA LYS 82 HA LYS 82 13.823 22.596 -13.605
649 HB2 LYS 82 HB2 LYS 82 13.177 24.297 -15.211
650 HB3 LYS 82 HB3 LYS 82 13.730 22.762 -15.901
651 HG2 LYS 82 HG2 LYS 82 11.430 22.190 -16.532
652 HG3 LYS 82 HG3 LYS 82 10.850 23.673 -15.767
653 HD2 LYS 82 HD2 LYS 82 10.926 24.008 -18.142
654 HD3 LYS 82 HD3 LYS 82 12.125 25.031 -17.357
655 HE2 LYS 82 HE2 LYS 82 13.846 23.174 -17.916
656 HE3 LYS 82 HE3 LYS 82 12.585 22.447 -18.917
657 HZ1 LYS 82 HZ1 LYS 82 14.004 23.873 -20.232
658 HZ2 LYS 82 HZ2 LYS 82 12.529 24.566 -20.172
659 HZ3 LYS 82 HZ3 LYS 82 13.757 25.154 -19.243
660 H VAL 83 HN VAL 83 10.222 22.732 -13.843
661 HA VAL 83 HA VAL 83 10.142 25.146 -12.426
662 HB VAL 83 HB VAL 83 7.940 23.130 -12.984
663 HG11 VAL 83 HG11 VAL 83 7.104 24.534 -11.168
664 HG12 VAL 83 HG12 VAL 83 7.716 26.001 -11.967
665 HG13 VAL 83 HG13 VAL 83 6.369 25.072 -12.672
666 HG21 VAL 83 HG21 VAL 83 7.383 24.894 -14.741
667 HG22 VAL 83 HG22 VAL 83 8.905 25.718 -14.311
668 HG23 VAL 83 HG23 VAL 83 8.920 24.093 -15.007
669 H ALA 84 HN ALA 84 10.767 22.081 -11.133
670 HA ALA 84 HA ALA 84 10.173 22.020 -8.477
671 HB1 ALA 84 HB1 ALA 84 12.437 21.062 -8.243
672 HB2 ALA 84 HB2 ALA 84 11.716 20.536 -9.767
673 HB3 ALA 84 HB3 ALA 84 12.943 21.817 -9.760
674 H GLY 85 HN GLY 85 12.466 24.320 -10.024
675 HA2 GLY 85 HA2 GLY 85 11.713 26.485 -8.439
676 HA3 GLY 85 HA3 GLY 85 13.138 25.805 -7.634
677 H LYS 86 HN LYS 86 12.740 25.633 -11.160
678 HA LYS 86 HA LYS 86 14.838 27.640 -11.665
679 HB2 LYS 86 HB2 LYS 86 14.985 24.723 -12.527
680 HB3 LYS 86 HB3 LYS 86 16.222 25.934 -12.790
681 HG2 LYS 86 HG2 LYS 86 16.947 25.911 -10.541
682 HG3 LYS 86 HG3 LYS 86 15.547 24.992 -9.970
683 HD2 LYS 86 HD2 LYS 86 17.555 23.898 -11.962
684 HD3 LYS 86 HD3 LYS 86 17.636 23.616 -10.218
685 HE2 LYS 86 HE2 LYS 86 15.941 22.101 -10.212
686 HE3 LYS 86 HE3 LYS 86 14.948 23.058 -11.304
687 HZ1 LYS 86 HZ1 LYS 86 16.300 22.255 -13.153
688 HZ2 LYS 86 HZ2 LYS 86 17.126 21.252 -12.134
689 HZ3 LYS 86 HZ3 LYS 86 15.500 21.053 -12.357
690 H THR 87 HN THR 87 15.373 27.189 -14.200
691 HA THR 87 HA THR 87 12.882 26.772 -15.752
692 HB THR 87 HB THR 87 13.834 28.642 -17.248
693 HG1 THR 87 HG1 THR 87 15.840 29.009 -16.446
694 HG21 THR 87 HG21 THR 87 12.907 29.432 -14.449
695 HG22 THR 87 HG22 THR 87 12.813 30.416 -15.925
696 HG23 THR 87 HG23 THR 87 11.847 28.938 -15.788
697 H GLN 88 HN GLN 88 15.622 25.259 -15.027
698 HA GLN 88 HA GLN 88 15.998 24.059 -17.653
699 HB2 GLN 88 HB2 GLN 88 18.287 25.221 -15.985
700 HB3 GLN 88 HB3 GLN 88 18.481 24.098 -17.331
701 HG2 GLN 88 HG2 GLN 88 17.438 25.775 -18.866
702 HG3 GLN 88 HG3 GLN 88 17.357 26.924 -17.525
703 HE21 GLN 88 HE22 GLN 88 19.569 25.176 -19.714
704 HE22 GLN 88 HE21 GLN 88 20.971 26.161 -19.380
Start of MODEL 8
1 HA MET 1 HA MET 1 4.245 -2.408 -2.575
2 H1 MET 1 H1 MET 1 3.916 -2.179 -0.261
3 H2 MET 1 H2 MET 1 2.685 -1.114 -0.465
4 H3 MET 1 H3 MET 1 2.511 -2.673 -0.971
5 HB2 MET 1 HB2 MET 1 1.911 -1.901 -3.286
6 HB3 MET 1 HB3 MET 1 2.170 -0.191 -2.895
7 HG2 MET 1 HG2 MET 1 3.953 -0.046 -4.572
8 HG3 MET 1 HG3 MET 1 3.864 -1.786 -4.863
9 HE1 MET 1 HE1 MET 1 3.767 -1.424 -7.467
10 HE2 MET 1 HE2 MET 1 2.677 -0.259 -8.248
11 HE3 MET 1 HE3 MET 1 3.948 0.315 -7.146
12 H GLU 2 HN GLU 2 6.097 -1.375 -3.189
13 HA GLU 2 HA GLU 2 6.828 1.138 -1.767
14 HB2 GLU 2 HB2 GLU 2 8.606 -1.289 -2.267
15 HB3 GLU 2 HB3 GLU 2 9.064 0.237 -1.516
16 HG2 GLU 2 HG2 GLU 2 8.780 -1.166 0.315
17 HG3 GLU 2 HG3 GLU 2 7.278 -0.249 0.275
18 H TRP 3 HN TRP 3 8.623 2.309 -2.967
19 HA TRP 3 HA TRP 3 8.255 1.990 -5.890
20 HD1 TRP 3 HD1 TRP 3 6.172 3.624 -2.570
21 HE1 TRP 3 HE1 TRP 3 3.682 3.122 -2.814
22 HE3 TRP 3 HE3 TRP 3 5.871 3.561 -7.678
23 HZ2 TRP 3 HZ2 TRP 3 1.766 2.801 -4.973
24 HZ3 TRP 3 HZ3 TRP 3 3.700 3.168 -8.805
25 HH2 TRP 3 HH2 TRP 3 1.640 2.793 -7.462
26 HB2 TRP 3 HB2 TRP 3 8.024 4.502 -4.208
27 HB3 TRP 3 HB3 TRP 3 7.759 4.402 -5.925
28 H LEU 4 HN LEU 4 9.851 3.494 -7.027
29 HA LEU 4 HA LEU 4 12.512 3.466 -5.696
30 HG LEU 4 HG LEU 4 14.021 3.281 -8.464
31 HB2 LEU 4 HB2 LEU 4 12.163 1.398 -6.959
32 HB3 LEU 4 HB3 LEU 4 11.684 2.341 -8.378
33 HD11 LEU 4 HD11 LEU 4 14.556 1.143 -6.351
34 HD12 LEU 4 HD12 LEU 4 15.803 2.000 -7.281
35 HD13 LEU 4 HD13 LEU 4 14.771 2.893 -6.166
36 HD21 LEU 4 HD21 LEU 4 13.262 1.389 -9.884
37 HD22 LEU 4 HD22 LEU 4 14.975 1.250 -9.464
38 HD23 LEU 4 HD23 LEU 4 13.774 0.244 -8.627
39 H VAL 5 HN VAL 5 13.524 5.239 -6.040
40 HA VAL 5 HA VAL 5 12.699 7.374 -7.950
41 HB VAL 5 HB VAL 5 15.169 7.201 -6.161
42 HG11 VAL 5 HG11 VAL 5 13.765 9.528 -7.499
43 HG12 VAL 5 HG12 VAL 5 15.129 9.672 -6.366
44 HG13 VAL 5 HG13 VAL 5 15.356 8.865 -7.918
45 HG21 VAL 5 HG21 VAL 5 12.386 8.254 -5.523
46 HG22 VAL 5 HG22 VAL 5 13.310 7.042 -4.627
47 HG23 VAL 5 HG23 VAL 5 13.836 8.717 -4.598
48 H LYS 6 HN LYS 6 13.147 6.869 -9.961
49 HA LYS 6 HA LYS 6 15.625 5.432 -10.759
50 HB2 LYS 6 HB2 LYS 6 12.949 5.918 -12.003
51 HB3 LYS 6 HB3 LYS 6 14.321 5.586 -13.048
52 HG2 LYS 6 HG2 LYS 6 13.931 3.732 -10.714
53 HG3 LYS 6 HG3 LYS 6 12.770 3.626 -12.022
54 HD2 LYS 6 HD2 LYS 6 14.636 2.023 -12.265
55 HD3 LYS 6 HD3 LYS 6 14.432 3.098 -13.650
56 HE2 LYS 6 HE2 LYS 6 16.335 4.479 -12.922
57 HE3 LYS 6 HE3 LYS 6 16.522 3.485 -11.463
58 HZ1 LYS 6 HZ1 LYS 6 17.057 1.600 -12.901
59 HZ2 LYS 6 HZ2 LYS 6 16.881 2.516 -14.244
60 HZ3 LYS 6 HZ3 LYS 6 18.078 2.833 -13.189
61 H LYS 7 HN LYS 7 14.203 8.634 -10.735
62 HA LYS 7 HA LYS 7 16.631 9.810 -11.825
63 HB2 LYS 7 HB2 LYS 7 13.938 10.358 -13.120
64 HB3 LYS 7 HB3 LYS 7 15.314 11.451 -13.213
65 HG2 LYS 7 HG2 LYS 7 16.687 9.719 -14.288
66 HG3 LYS 7 HG3 LYS 7 15.341 8.575 -14.209
67 HD2 LYS 7 HD2 LYS 7 13.959 10.163 -15.580
68 HD3 LYS 7 HD3 LYS 7 15.400 11.167 -15.790
69 HE2 LYS 7 HE2 LYS 7 15.217 8.217 -16.562
70 HE3 LYS 7 HE3 LYS 7 14.873 9.549 -17.676
71 HZ1 LYS 7 HZ1 LYS 7 17.163 10.305 -17.385
72 HZ2 LYS 7 HZ2 LYS 7 17.492 9.059 -16.373
73 HZ3 LYS 7 HZ3 LYS 7 17.131 8.775 -17.934
74 H SER 8 HN SER 8 16.771 12.024 -11.023
75 HA SER 8 HA SER 8 14.812 13.070 -9.083
76 HG SER 8 HG SER 8 18.457 12.431 -8.844
77 HB2 SER 8 HB2 SER 8 16.814 13.204 -7.460
78 HB3 SER 8 HB3 SER 8 15.998 11.647 -7.644
79 H CYS 9 HN CYS 9 15.539 15.349 -8.509
80 HA CYS 9 HA CYS 9 17.326 16.546 -10.596
81 HG CYS 9 HG CYS 9 13.986 15.654 -10.585
82 HB2 CYS 9 HB2 CYS 9 14.788 17.762 -9.429
83 HB3 CYS 9 HB3 CYS 9 15.785 18.409 -10.739
84 H CYS 10 HN CYS 10 18.739 18.131 -9.907
85 HA CYS 10 HA CYS 10 19.282 18.614 -7.126
86 HG CYS 10 HG CYS 10 21.666 17.992 -7.909
87 HB2 CYS 10 HB2 CYS 10 19.964 20.308 -9.583
88 HB3 CYS 10 HB3 CYS 10 20.716 20.433 -7.986
89 H ASN 11 HN ASN 11 18.305 20.094 -5.758
90 HA ASN 11 HA ASN 11 16.059 21.696 -6.901
91 HB2 ASN 11 HB2 ASN 11 14.667 20.827 -5.232
92 HB3 ASN 11 HB3 ASN 11 15.543 19.417 -5.828
93 HD21 ASN 11 HD21 ASN 11 14.237 19.988 -3.106
94 HD22 ASN 11 HD22 ASN 11 15.529 19.736 -1.966
95 H LYS 12 HN LYS 12 18.891 22.338 -5.313
96 HA LYS 12 HA LYS 12 18.078 23.463 -2.895
97 HB2 LYS 12 HB2 LYS 12 20.483 23.555 -4.612
98 HB3 LYS 12 HB3 LYS 12 20.282 25.026 -3.678
99 HG2 LYS 12 HG2 LYS 12 20.208 22.252 -2.426
100 HG3 LYS 12 HG3 LYS 12 21.674 23.231 -2.586
101 HD2 LYS 12 HD2 LYS 12 20.633 25.049 -1.238
102 HD3 LYS 12 HD3 LYS 12 19.160 24.100 -1.083
103 HE2 LYS 12 HE2 LYS 12 20.375 23.833 0.950
104 HE3 LYS 12 HE3 LYS 12 20.437 22.297 0.083
105 HZ1 LYS 12 HZ1 LYS 12 22.585 22.911 1.008
106 HZ2 LYS 12 HZ2 LYS 12 22.698 22.867 -0.614
107 HZ3 LYS 12 HZ3 LYS 12 22.622 24.304 0.169
108 H GLN 13 HN GLN 13 17.665 24.884 -6.059
109 HA GLN 13 HA GLN 13 17.475 27.607 -5.174
110 HB2 GLN 13 HB2 GLN 13 16.340 26.215 -7.642
111 HB3 GLN 13 HB3 GLN 13 16.349 27.963 -7.383
112 HG2 GLN 13 HG2 GLN 13 18.844 27.920 -7.230
113 HG3 GLN 13 HG3 GLN 13 18.826 26.196 -7.606
114 HE21 GLN 13 HE22 GLN 13 18.399 25.522 -9.795
115 HE22 GLN 13 HE21 GLN 13 18.301 26.669 -11.104
116 H ASP 14 HN ASP 14 15.240 24.909 -4.859
117 HA ASP 14 HA ASP 14 13.096 26.831 -4.053
118 HB2 ASP 14 HB2 ASP 14 12.967 26.000 -6.497
119 HB3 ASP 14 HB3 ASP 14 12.592 24.417 -5.812
120 H ASN 15 HN ASN 15 14.680 23.827 -3.463
121 HA ASN 15 HA ASN 15 14.627 22.330 -1.843
122 HB2 ASN 15 HB2 ASN 15 13.828 24.338 -0.379
123 HB3 ASN 15 HB3 ASN 15 12.267 23.522 -0.408
124 HD21 ASN 15 HD22 ASN 15 12.928 20.812 -0.105
125 HD22 ASN 15 HD21 ASN 15 13.716 20.581 1.440
126 H ARG 16 HN ARG 16 11.934 22.990 -3.813
127 HA ARG 16 HA ARG 16 10.494 20.491 -3.258
128 HE ARG 16 HE ARG 16 5.937 23.410 -3.731
129 HB2 ARG 16 HB2 ARG 16 10.292 22.397 -5.624
130 HB3 ARG 16 HB3 ARG 16 9.274 20.978 -5.355
131 HG2 ARG 16 HG2 ARG 16 8.515 21.968 -3.174
132 HG3 ARG 16 HG3 ARG 16 9.437 23.427 -3.542
133 HD2 ARG 16 HD2 ARG 16 8.098 23.720 -5.644
134 HD3 ARG 16 HD3 ARG 16 7.194 22.264 -5.253
135 HH11 ARG 16 HH11 ARG 16 8.721 25.459 -4.608
136 HH12 ARG 16 HH12 ARG 16 8.074 26.875 -3.850
137 HH21 ARG 16 HH21 ARG 16 5.097 25.297 -2.722
138 HH22 ARG 16 HH22 ARG 16 5.980 26.774 -2.751
139 H HIS 17 HN HIS 17 11.651 18.637 -3.621
140 HA HIS 17 HA HIS 17 13.555 18.352 -5.860
141 HD1 HIS 17 HD1 HIS 17 13.784 16.772 -1.704
142 HD2 HIS 17 HD2 HIS 17 15.920 16.625 -5.312
143 HE1 HIS 17 HE1 HIS 17 16.251 16.725 -1.065
144 HB2 HIS 17 HB2 HIS 17 12.350 16.433 -3.828
145 HB3 HIS 17 HB3 HIS 17 13.284 15.876 -5.204
146 H VAL 18 HN VAL 18 13.077 16.787 -7.601
147 HA VAL 18 HA VAL 18 10.301 15.918 -7.854
148 HB VAL 18 HB VAL 18 11.644 17.090 -10.291
149 HG11 VAL 18 HG11 VAL 18 8.702 16.543 -9.679
150 HG12 VAL 18 HG12 VAL 18 9.373 17.147 -11.208
151 HG13 VAL 18 HG13 VAL 18 9.769 15.521 -10.658
152 HG21 VAL 18 HG21 VAL 18 9.702 18.593 -8.490
153 HG22 VAL 18 HG22 VAL 18 11.396 19.018 -8.757
154 HG23 VAL 18 HG23 VAL 18 10.252 19.138 -10.084
155 H LEU 19 HN LEU 19 10.207 13.982 -8.828
156 HA LEU 19 HA LEU 19 12.704 12.699 -9.738
157 HG LEU 19 HG LEU 19 10.494 12.359 -6.525
158 HB2 LEU 19 HB2 LEU 19 11.715 10.733 -8.073
159 HB3 LEU 19 HB3 LEU 19 13.156 11.682 -7.850
160 HD11 LEU 19 HD11 LEU 19 11.314 10.182 -5.872
161 HD12 LEU 19 HD12 LEU 19 12.906 10.873 -5.463
162 HD13 LEU 19 HD13 LEU 19 11.454 11.342 -4.545
163 HD21 LEU 19 HD21 LEU 19 13.303 13.518 -6.492
164 HD22 LEU 19 HD22 LEU 19 11.732 14.331 -6.271
165 HD23 LEU 19 HD23 LEU 19 12.432 13.432 -4.940
166 H MET 20 HN MET 20 12.264 10.362 -10.327
167 HA MET 20 HA MET 20 9.639 10.184 -11.744
168 HB2 MET 20 HB2 MET 20 11.621 10.356 -13.261
169 HB3 MET 20 HB3 MET 20 12.254 8.864 -12.534
170 HG2 MET 20 HG2 MET 20 10.226 7.660 -13.299
171 HG3 MET 20 HG3 MET 20 9.566 9.168 -13.930
172 HE1 MET 20 HE1 MET 20 13.329 7.818 -14.218
173 HE2 MET 20 HE2 MET 20 12.283 6.396 -14.315
174 HE3 MET 20 HE3 MET 20 13.198 6.924 -15.747
175 H LEU 21 HN LEU 21 8.501 9.180 -10.252
176 HA LEU 21 HA LEU 21 9.702 7.334 -8.293
177 HG LEU 21 HG LEU 21 8.127 6.929 -6.376
178 HB2 LEU 21 HB2 LEU 21 8.308 9.232 -7.583
179 HB3 LEU 21 HB3 LEU 21 6.962 8.677 -8.576
180 HD11 LEU 21 HD11 LEU 21 5.915 9.019 -6.087
181 HD12 LEU 21 HD12 LEU 21 6.449 7.874 -4.836
182 HD13 LEU 21 HD13 LEU 21 7.545 9.146 -5.396
183 HD21 LEU 21 HD21 LEU 21 5.719 6.118 -6.314
184 HD22 LEU 21 HD22 LEU 21 5.389 7.123 -7.740
185 HD23 LEU 21 HD23 LEU 21 6.534 5.777 -7.837
186 H CYS 22 HN CYS 22 9.652 5.222 -8.830
187 HA CYS 22 HA CYS 22 7.681 4.232 -10.845
188 HG CYS 22 HG CYS 22 10.676 5.866 -10.999
189 HB2 CYS 22 HB2 CYS 22 10.564 3.364 -10.351
190 HB3 CYS 22 HB3 CYS 22 9.493 2.837 -11.662
191 H ASP 23 HN ASP 23 7.473 1.682 -10.559
192 HA ASP 23 HA ASP 23 6.942 1.113 -7.736
193 HB2 ASP 23 HB2 ASP 23 6.213 -0.969 -8.363
194 HB3 ASP 23 HB3 ASP 23 5.794 -0.010 -9.774
195 H ALA 24 HN ALA 24 8.140 -0.592 -6.522
196 HA ALA 24 HA ALA 24 10.978 -0.356 -6.594
197 HB1 ALA 24 HB1 ALA 24 10.919 -2.132 -4.874
198 HB2 ALA 24 HB2 ALA 24 9.806 -0.801 -4.530
199 HB3 ALA 24 HB3 ALA 24 9.177 -2.342 -5.165
200 H GLY 25 HN GLY 25 11.246 -0.779 -8.896
201 HA2 GLY 25 HA2 GLY 25 12.410 -3.185 -9.712
202 HA3 GLY 25 HA3 GLY 25 10.669 -3.316 -10.058
203 H GLY 26 HN GLY 26 10.525 -0.301 -10.486
204 HA2 GLY 26 HA2 GLY 26 10.796 1.243 -12.144
205 HA3 GLY 26 HA3 GLY 26 12.179 0.339 -12.762
206 H ALA 27 HN ALA 27 9.163 -1.449 -12.488
207 HA ALA 27 HA ALA 27 9.131 -1.834 -15.413
208 HB1 ALA 27 HB1 ALA 27 8.853 -3.783 -13.915
209 HB2 ALA 27 HB2 ALA 27 7.422 -3.022 -13.177
210 HB3 ALA 27 HB3 ALA 27 7.393 -3.507 -14.885
211 H ILE 28 HN ILE 28 7.327 -0.189 -12.838
212 HA ILE 28 HA ILE 28 5.477 1.030 -14.861
213 HB ILE 28 HB ILE 28 5.049 0.586 -11.876
214 HG12 ILE 28 HG12 ILE 28 4.904 -1.589 -12.973
215 HG13 ILE 28 HG13 ILE 28 3.348 -1.060 -12.374
216 HG21 ILE 28 HG21 ILE 28 2.692 1.276 -12.348
217 HG22 ILE 28 HG22 ILE 28 3.868 2.566 -12.590
218 HG23 ILE 28 HG23 ILE 28 3.183 1.724 -13.995
219 HD11 ILE 28 HD11 ILE 28 2.619 -0.465 -14.656
220 HD12 ILE 28 HD12 ILE 28 4.217 -0.919 -15.297
221 HD13 ILE 28 HD13 ILE 28 3.165 -2.146 -14.573
222 H LYS 29 HN LYS 29 5.499 3.333 -14.842
223 HA LYS 29 HA LYS 29 7.402 4.615 -12.941
224 HB2 LYS 29 HB2 LYS 29 7.393 4.985 -15.965
225 HB3 LYS 29 HB3 LYS 29 8.311 5.926 -14.788
226 HG2 LYS 29 HG2 LYS 29 9.252 3.545 -14.048
227 HG3 LYS 29 HG3 LYS 29 8.718 3.043 -15.648
228 HD2 LYS 29 HD2 LYS 29 10.177 4.661 -16.725
229 HD3 LYS 29 HD3 LYS 29 10.446 5.500 -15.206
230 HE2 LYS 29 HE2 LYS 29 12.451 4.328 -15.676
231 HE3 LYS 29 HE3 LYS 29 11.700 3.547 -14.296
232 HZ1 LYS 29 HZ1 LYS 29 11.458 2.557 -17.099
233 HZ2 LYS 29 HZ2 LYS 29 12.556 2.001 -16.035
234 HZ3 LYS 29 HZ3 LYS 29 10.977 1.757 -15.741
235 H MET 30 HN MET 30 6.957 6.656 -12.352
236 HA MET 30 HA MET 30 4.687 8.174 -13.445
237 HB2 MET 30 HB2 MET 30 5.040 7.430 -10.497
238 HB3 MET 30 HB3 MET 30 3.909 8.597 -11.124
239 HG2 MET 30 HG2 MET 30 2.795 6.792 -12.447
240 HG3 MET 30 HG3 MET 30 3.918 5.627 -11.749
241 HE1 MET 30 HE1 MET 30 2.043 8.679 -9.865
242 HE2 MET 30 HE2 MET 30 0.943 8.063 -11.123
243 HE3 MET 30 HE3 MET 30 0.566 7.814 -9.403
244 H ILE 31 HN ILE 31 4.785 10.378 -12.195
245 HA ILE 31 HA ILE 31 7.609 11.276 -11.850
246 HB ILE 31 HB ILE 31 5.279 12.787 -13.015
247 HG12 ILE 31 HG12 ILE 31 7.814 12.229 -14.574
248 HG13 ILE 31 HG13 ILE 31 6.650 10.920 -14.451
249 HG21 ILE 31 HG21 ILE 31 6.756 14.324 -11.834
250 HG22 ILE 31 HG22 ILE 31 8.199 13.577 -12.564
251 HG23 ILE 31 HG23 ILE 31 7.062 14.499 -13.561
252 HD11 ILE 31 HD11 ILE 31 4.854 12.298 -15.277
253 HD12 ILE 31 HD12 ILE 31 5.925 13.704 -15.379
254 HD13 ILE 31 HD13 ILE 31 6.213 12.295 -16.426
255 H ALA 32 HN ALA 32 7.843 12.568 -9.900
256 HA ALA 32 HA ALA 32 5.364 13.280 -8.460
257 HB1 ALA 32 HB1 ALA 32 6.255 12.395 -6.340
258 HB2 ALA 32 HB2 ALA 32 6.019 11.092 -7.521
259 HB3 ALA 32 HB3 ALA 32 7.658 11.714 -7.192
260 H GLU 33 HN GLU 33 5.524 15.262 -7.714
261 HA GLU 33 HA GLU 33 8.120 16.692 -7.519
262 HB2 GLU 33 HB2 GLU 33 6.207 17.659 -8.930
263 HB3 GLU 33 HB3 GLU 33 5.214 17.681 -7.467
264 HG2 GLU 33 HG2 GLU 33 6.995 19.211 -6.445
265 HG3 GLU 33 HG3 GLU 33 7.685 19.341 -8.060
266 H VAL 34 HN VAL 34 8.800 17.090 -5.384
267 HA VAL 34 HA VAL 34 6.968 16.456 -3.152
268 HB VAL 34 HB VAL 34 8.420 14.784 -2.280
269 HG11 VAL 34 HG11 VAL 34 8.161 12.940 -3.752
270 HG12 VAL 34 HG12 VAL 34 6.787 14.001 -4.074
271 HG13 VAL 34 HG13 VAL 34 8.156 13.974 -5.192
272 HG21 VAL 34 HG21 VAL 34 10.259 15.338 -4.637
273 HG22 VAL 34 HG22 VAL 34 10.612 15.494 -2.894
274 HG23 VAL 34 HG23 VAL 34 10.384 13.900 -3.613
275 H LYS 35 HN LYS 35 8.217 16.907 -0.993
276 HA LYS 35 HA LYS 35 10.472 18.812 -1.362
277 HB2 LYS 35 HB2 LYS 35 8.299 20.080 -0.863
278 HB3 LYS 35 HB3 LYS 35 8.261 19.250 0.696
279 HG2 LYS 35 HG2 LYS 35 10.533 20.210 1.177
280 HG3 LYS 35 HG3 LYS 35 10.468 21.087 -0.367
281 HD2 LYS 35 HD2 LYS 35 8.528 21.431 1.965
282 HD3 LYS 35 HD3 LYS 35 9.911 22.478 1.619
283 HE2 LYS 35 HE2 LYS 35 8.921 23.063 -0.592
284 HE3 LYS 35 HE3 LYS 35 7.516 22.050 -0.227
285 HZ1 LYS 35 HZ1 LYS 35 7.082 24.372 0.280
286 HZ2 LYS 35 HZ2 LYS 35 7.041 23.507 1.660
287 HZ3 LYS 35 HZ3 LYS 35 8.334 24.446 1.320
288 H SER 36 HN SER 36 12.034 18.555 0.273
289 HA SER 36 HA SER 36 11.635 16.222 2.090
290 HG SER 36 HG SER 36 12.947 14.784 -0.842
291 HB2 SER 36 HB2 SER 36 14.150 16.530 0.471
292 HB3 SER 36 HB3 SER 36 13.467 15.079 1.221
293 H ASP 37 HN ASP 37 13.035 16.103 3.851
294 HA ASP 37 HA ASP 37 14.523 18.601 4.530
295 HB2 ASP 37 HB2 ASP 37 12.722 17.828 6.069
296 HB3 ASP 37 HB3 ASP 37 13.605 16.322 6.317
297 H PHE 38 HN PHE 38 15.150 15.852 2.952
298 HA PHE 38 HA PHE 38 17.951 15.577 3.817
299 HD1 PHE 38 HD2 PHE 38 14.407 14.003 5.121
300 HD2 PHE 38 HD1 PHE 38 18.553 13.239 6.036
301 HE1 PHE 38 HE2 PHE 38 13.848 13.871 7.534
302 HE2 PHE 38 HE1 PHE 38 17.988 13.104 8.449
303 HZ PHE 38 HZ PHE 38 15.637 13.416 9.202
304 HB2 PHE 38 HB2 PHE 38 16.041 13.241 3.374
305 HB3 PHE 38 HB3 PHE 38 17.751 13.121 3.739
306 H ALA 39 HN ALA 39 19.206 14.578 2.016
307 HA ALA 39 HA ALA 39 18.317 15.295 -0.613
308 HB1 ALA 39 HB1 ALA 39 20.709 15.224 0.008
309 HB2 ALA 39 HB2 ALA 39 20.590 13.468 0.286
310 HB3 ALA 39 HB3 ALA 39 20.370 14.129 -1.346
311 H VAL 40 HN VAL 40 17.789 13.851 -2.357
312 HA VAL 40 HA VAL 40 17.391 11.008 -1.833
313 HB VAL 40 HB VAL 40 15.226 11.797 -1.217
314 HG11 VAL 40 HG11 VAL 40 13.745 13.149 -2.651
315 HG12 VAL 40 HG12 VAL 40 15.163 14.052 -2.123
316 HG13 VAL 40 HG13 VAL 40 15.083 13.424 -3.784
317 HG21 VAL 40 HG21 VAL 40 15.274 9.807 -2.687
318 HG22 VAL 40 HG22 VAL 40 13.769 10.725 -2.822
319 HG23 VAL 40 HG23 VAL 40 15.002 10.854 -4.094
320 H LYS 41 HN LYS 41 17.883 9.843 -3.722
321 HA LYS 41 HA LYS 41 18.238 11.290 -6.238
322 HB2 LYS 41 HB2 LYS 41 20.519 11.067 -6.498
323 HB3 LYS 41 HB3 LYS 41 20.348 11.685 -4.870
324 HG2 LYS 41 HG2 LYS 41 21.046 8.851 -5.722
325 HG3 LYS 41 HG3 LYS 41 22.093 10.028 -4.926
326 HD2 LYS 41 HD2 LYS 41 20.622 9.907 -2.898
327 HD3 LYS 41 HD3 LYS 41 19.664 8.666 -3.741
328 HE2 LYS 41 HE2 LYS 41 21.670 7.241 -3.953
329 HE3 LYS 41 HE3 LYS 41 22.596 8.415 -3.001
330 HZ1 LYS 41 HZ1 LYS 41 20.143 7.029 -2.062
331 HZ2 LYS 41 HZ2 LYS 41 21.681 6.579 -1.663
332 HZ3 LYS 41 HZ3 LYS 41 21.093 8.018 -1.160
333 H VAL 42 HN VAL 42 19.249 9.675 -7.890
334 HA VAL 42 HA VAL 42 17.413 7.649 -8.274
335 HB VAL 42 HB VAL 42 20.236 7.922 -9.396
336 HG11 VAL 42 HG11 VAL 42 19.461 5.690 -9.946
337 HG12 VAL 42 HG12 VAL 42 17.829 6.285 -10.312
338 HG13 VAL 42 HG13 VAL 42 19.199 6.678 -11.383
339 HG21 VAL 42 HG21 VAL 42 18.796 8.938 -11.327
340 HG22 VAL 42 HG22 VAL 42 17.531 9.071 -10.065
341 HG23 VAL 42 HG23 VAL 42 19.079 9.919 -9.891
342 H GLY 43 HN GLY 43 17.337 5.483 -8.116
343 HA2 GLY 43 HA2 GLY 43 17.764 3.363 -7.410
344 HA3 GLY 43 HA3 GLY 43 19.408 3.830 -6.915
345 H ASP 44 HN ASP 44 16.385 5.533 -5.899
346 HA ASP 44 HA ASP 44 17.098 4.655 -3.065
347 HB2 ASP 44 HB2 ASP 44 15.837 7.256 -3.970
348 HB3 ASP 44 HB3 ASP 44 15.535 6.561 -2.384
349 H LEU 45 HN LEU 45 15.460 3.728 -1.790
350 HA LEU 45 HA LEU 45 13.012 2.951 -3.238
351 HG LEU 45 HG LEU 45 11.315 1.894 -1.406
352 HB2 LEU 45 HB2 LEU 45 14.334 1.509 -1.475
353 HB3 LEU 45 HB3 LEU 45 13.615 2.594 -0.288
354 HD11 LEU 45 HD11 LEU 45 13.090 -0.451 -2.210
355 HD12 LEU 45 HD12 LEU 45 11.320 -0.365 -2.346
356 HD13 LEU 45 HD13 LEU 45 12.332 0.696 -3.333
357 HD21 LEU 45 HD21 LEU 45 12.947 0.034 0.355
358 HD22 LEU 45 HD22 LEU 45 11.901 1.386 0.872
359 HD23 LEU 45 HD23 LEU 45 11.183 -0.039 0.116
360 H LEU 46 HN LEU 46 10.915 3.647 -2.502
361 HA LEU 46 HA LEU 46 10.756 5.716 -0.395
362 HG LEU 46 HG LEU 46 11.360 6.708 -3.359
363 HB2 LEU 46 HB2 LEU 46 9.155 5.779 -2.986
364 HB3 LEU 46 HB3 LEU 46 8.912 6.834 -1.607
365 HD11 LEU 46 HD11 LEU 46 10.546 9.013 -4.142
366 HD12 LEU 46 HD12 LEU 46 9.503 7.662 -4.602
367 HD13 LEU 46 HD13 LEU 46 9.054 8.718 -3.245
368 HD21 LEU 46 HD21 LEU 46 10.575 8.627 -1.103
369 HD22 LEU 46 HD22 LEU 46 11.929 7.503 -1.088
370 HD23 LEU 46 HD23 LEU 46 11.969 8.886 -2.191
371 H SER 47 HN SER 47 9.342 5.024 1.090
372 HA SER 47 HA SER 47 7.075 3.297 0.227
373 HG SER 47 HG SER 47 9.404 0.946 1.683
374 HB2 SER 47 HB2 SER 47 8.620 2.771 2.784
375 HB3 SER 47 HB3 SER 47 7.312 1.813 2.086
376 HA PRO 48 HA PRO 48 5.045 6.535 2.428
377 HB2 PRO 48 HB2 PRO 48 2.522 5.508 2.795
378 HB3 PRO 48 HB3 PRO 48 3.149 6.051 1.212
379 HG2 PRO 48 HG2 PRO 48 3.028 3.229 2.305
380 HG3 PRO 48 HG3 PRO 48 2.571 3.809 0.671
381 HD2 PRO 48 HD2 PRO 48 4.994 2.649 1.199
382 HD3 PRO 48 HD3 PRO 48 4.818 3.961 -0.003
383 H LEU 49 HN LEU 49 4.940 7.180 4.455
384 HA LEU 49 HA LEU 49 5.163 5.217 6.704
385 HG LEU 49 HG LEU 49 7.409 6.887 5.546
386 HB2 LEU 49 HB2 LEU 49 5.497 8.247 6.502
387 HB3 LEU 49 HB3 LEU 49 5.650 7.334 8.003
388 HD11 LEU 49 HD11 LEU 49 9.145 8.077 6.843
389 HD12 LEU 49 HD12 LEU 49 7.762 9.122 6.453
390 HD13 LEU 49 HD13 LEU 49 7.944 8.466 8.094
391 HD21 LEU 49 HD21 LEU 49 7.598 5.872 8.421
392 HD22 LEU 49 HD22 LEU 49 7.329 4.894 6.959
393 HD23 LEU 49 HD23 LEU 49 8.877 5.705 7.203
394 H GLN 50 HN GLN 50 3.205 7.717 5.281
395 HA GLN 50 HA GLN 50 0.709 6.933 6.449
396 HB2 GLN 50 HB2 GLN 50 0.258 9.259 7.373
397 HB3 GLN 50 HB3 GLN 50 1.359 8.298 8.344
398 HG2 GLN 50 HG2 GLN 50 3.247 9.567 7.755
399 HG3 GLN 50 HG3 GLN 50 2.516 10.162 6.272
400 HE21 GLN 50 HE22 GLN 50 1.369 12.070 6.270
401 HE22 GLN 50 HE21 GLN 50 1.133 13.061 7.702
402 H ASN 51 HN ASN 51 -0.718 9.256 5.550
403 HA ASN 51 HA ASN 51 -0.236 9.231 2.678
404 HB2 ASN 51 HB2 ASN 51 -2.487 9.777 3.711
405 HB3 ASN 51 HB3 ASN 51 -1.782 11.324 4.232
406 HD21 ASN 51 HD22 ASN 51 -1.776 13.035 2.711
407 HD22 ASN 51 HD21 ASN 51 -2.087 12.812 1.012
408 H ALA 52 HN ALA 52 0.494 11.007 1.501
409 HA ALA 52 HA ALA 52 1.951 12.416 0.736
410 HB1 ALA 52 HB1 ALA 52 2.229 14.549 1.797
411 HB2 ALA 52 HB2 ALA 52 0.558 13.999 1.992
412 HB3 ALA 52 HB3 ALA 52 1.690 13.898 3.364
413 H LEU 53 HN LEU 53 3.026 11.486 4.059
414 HA LEU 53 HA LEU 53 5.789 12.060 3.308
415 HG LEU 53 HG LEU 53 4.679 13.485 5.483
416 HB2 LEU 53 HB2 LEU 53 4.586 10.926 5.837
417 HB3 LEU 53 HB3 LEU 53 6.319 10.921 5.554
418 HD11 LEU 53 HD11 LEU 53 5.539 13.896 7.766
419 HD12 LEU 53 HD12 LEU 53 4.513 12.458 7.721
420 HD13 LEU 53 HD13 LEU 53 6.280 12.280 7.789
421 HD21 LEU 53 HD21 LEU 53 7.682 12.975 5.798
422 HD22 LEU 53 HD22 LEU 53 6.898 13.602 4.341
423 HD23 LEU 53 HD23 LEU 53 6.890 14.562 5.820
424 H TYR 54 HN TYR 54 7.211 10.708 2.523
425 HA TYR 54 HA TYR 54 6.829 7.772 2.797
426 HD1 TYR 54 HD2 TYR 54 5.238 10.018 0.523
427 HD2 TYR 54 HD1 TYR 54 6.838 6.162 -0.549
428 HE1 TYR 54 HE2 TYR 54 3.136 9.485 -0.641
429 HE2 TYR 54 HE1 TYR 54 4.751 5.637 -1.763
430 HH TYR 54 HH TYR 54 1.970 7.904 -1.906
431 HB2 TYR 54 HB2 TYR 54 7.889 9.354 0.417
432 HB3 TYR 54 HB3 TYR 54 8.190 7.647 0.654
433 H CYS 55 HN CYS 55 8.723 6.700 3.301
434 HA CYS 55 HA CYS 55 10.931 8.266 4.439
435 HG CYS 55 HG CYS 55 9.102 4.872 3.660
436 HB2 CYS 55 HB2 CYS 55 11.939 6.073 4.890
437 HB3 CYS 55 HB3 CYS 55 10.298 6.199 5.543
438 H ILE 56 HN ILE 56 13.201 7.856 3.646
439 HA ILE 56 HA ILE 56 13.321 7.465 0.685
440 HB ILE 56 HB ILE 56 15.178 9.047 2.500
441 HG12 ILE 56 HG12 ILE 56 13.328 10.264 0.415
442 HG13 ILE 56 HG13 ILE 56 12.820 10.057 2.093
443 HG21 ILE 56 HG21 ILE 56 15.140 8.756 -0.542
444 HG22 ILE 56 HG22 ILE 56 16.128 9.941 0.323
445 HG23 ILE 56 HG23 ILE 56 16.445 8.243 0.542
446 HD11 ILE 56 HD11 ILE 56 15.233 11.694 1.261
447 HD12 ILE 56 HD12 ILE 56 13.660 12.305 1.766
448 HD13 ILE 56 HD13 ILE 56 14.652 11.398 2.917
449 H ASN 57 HN ASN 57 14.892 6.223 -0.122
450 HA ASN 57 HA ASN 57 16.686 4.970 -0.445
451 HB2 ASN 57 HB2 ASN 57 17.922 6.569 1.038
452 HB3 ASN 57 HB3 ASN 57 17.571 5.526 2.425
453 HD21 ASN 57 HD22 ASN 57 18.934 5.499 -0.879
454 HD22 ASN 57 HD21 ASN 57 20.114 4.216 -0.578
455 H ARG 58 HN ARG 58 15.839 4.284 2.930
456 HA ARG 58 HA ARG 58 14.779 1.699 2.516
457 HE ARG 58 HE ARG 58 20.402 0.434 5.294
458 HB2 ARG 58 HB2 ARG 58 16.548 0.255 3.277
459 HB3 ARG 58 HB3 ARG 58 17.215 1.205 1.966
460 HG2 ARG 58 HG2 ARG 58 18.170 2.777 3.819
461 HG3 ARG 58 HG3 ARG 58 17.728 1.492 4.950
462 HD2 ARG 58 HD2 ARG 58 19.071 -0.115 3.532
463 HD3 ARG 58 HD3 ARG 58 19.652 1.264 2.596
464 HH11 ARG 58 HH11 ARG 58 20.441 3.210 3.051
465 HH12 ARG 58 HH12 ARG 58 21.798 3.958 3.816
466 HH21 ARG 58 HH21 ARG 58 22.174 1.462 6.307
467 HH22 ARG 58 HH22 ARG 58 22.786 2.956 5.709
468 H GLU 59 HN GLU 59 15.207 4.458 4.452
469 HA GLU 59 HA GLU 59 14.605 2.964 6.928
470 HB2 GLU 59 HB2 GLU 59 16.278 4.128 8.184
471 HB3 GLU 59 HB3 GLU 59 17.031 3.220 6.874
472 HG2 GLU 59 HG2 GLU 59 17.176 5.381 5.549
473 HG3 GLU 59 HG3 GLU 59 16.594 6.238 6.981
474 H LYS 60 HN LYS 60 13.403 4.003 8.366
475 HA LYS 60 HA LYS 60 11.534 5.806 7.248
476 HB2 LYS 60 HB2 LYS 60 11.864 4.949 10.152
477 HB3 LYS 60 HB3 LYS 60 10.451 5.762 9.468
478 HG2 LYS 60 HG2 LYS 60 10.165 3.827 7.870
479 HG3 LYS 60 HG3 LYS 60 11.474 2.989 8.720
480 HD2 LYS 60 HD2 LYS 60 10.167 3.081 10.836
481 HD3 LYS 60 HD3 LYS 60 8.893 3.979 10.007
482 HE2 LYS 60 HE2 LYS 60 8.162 1.715 10.164
483 HE3 LYS 60 HE3 LYS 60 8.529 2.046 8.470
484 HZ1 LYS 60 HZ1 LYS 60 9.385 -0.099 9.203
485 HZ2 LYS 60 HZ2 LYS 60 10.630 0.856 8.769
486 HZ3 LYS 60 HZ3 LYS 60 10.305 0.591 10.353
487 H LEU 61 HN LEU 61 14.399 6.488 9.132
488 HA LEU 61 HA LEU 61 13.551 8.881 10.362
489 HG LEU 61 HG LEU 61 15.622 6.321 10.839
490 HB2 LEU 61 HB2 LEU 61 16.376 8.172 9.442
491 HB3 LEU 61 HB3 LEU 61 15.938 9.347 10.679
492 HD11 LEU 61 HD11 LEU 61 17.309 6.501 12.609
493 HD12 LEU 61 HD12 LEU 61 17.913 7.173 11.083
494 HD13 LEU 61 HD13 LEU 61 17.385 8.266 12.382
495 HD21 LEU 61 HD21 LEU 61 14.905 6.706 13.196
496 HD22 LEU 61 HD22 LEU 61 14.809 8.452 12.859
497 HD23 LEU 61 HD23 LEU 61 13.740 7.308 12.013
498 H HIS 62 HN HIS 62 14.858 8.255 7.150
499 HA HIS 62 HA HIS 62 15.209 11.138 6.565
500 HD1 HIS 62 HD1 HIS 62 18.384 8.244 4.397
501 HD2 HIS 62 HD2 HIS 62 17.231 10.427 7.806
502 HE1 HIS 62 HE1 HIS 62 20.392 8.253 5.958
503 HB2 HIS 62 HB2 HIS 62 15.655 8.669 4.837
504 HB3 HIS 62 HB3 HIS 62 16.106 10.325 4.431
505 H THR 63 HN THR 63 13.363 12.259 5.844
506 HA THR 63 HA THR 63 11.236 10.682 4.524
507 HB THR 63 HB THR 63 9.746 12.276 5.768
508 HG1 THR 63 HG1 THR 63 10.663 13.470 7.430
509 HG21 THR 63 HG21 THR 63 11.578 10.695 7.621
510 HG22 THR 63 HG22 THR 63 9.854 11.070 7.846
511 HG23 THR 63 HG23 THR 63 10.364 9.953 6.565
512 H VAL 64 HN VAL 64 9.874 11.649 3.103
513 HA VAL 64 HA VAL 64 10.477 14.315 1.996
514 HB VAL 64 HB VAL 64 11.794 12.845 0.634
515 HG11 VAL 64 HG11 VAL 64 10.824 10.624 1.161
516 HG12 VAL 64 HG12 VAL 64 9.378 11.043 0.228
517 HG13 VAL 64 HG13 VAL 64 10.954 10.893 -0.576
518 HG21 VAL 64 HG21 VAL 64 9.228 13.176 -0.933
519 HG22 VAL 64 HG22 VAL 64 10.335 14.516 -0.566
520 HG23 VAL 64 HG23 VAL 64 10.899 13.141 -1.532
521 H LYS 65 HN LYS 65 8.544 15.257 1.088
522 HA LYS 65 HA LYS 65 6.035 13.788 1.752
523 HB2 LYS 65 HB2 LYS 65 6.710 15.712 3.278
524 HB3 LYS 65 HB3 LYS 65 6.508 16.785 1.884
525 HG2 LYS 65 HG2 LYS 65 4.135 16.071 1.692
526 HG3 LYS 65 HG3 LYS 65 4.356 14.976 3.075
527 HD2 LYS 65 HD2 LYS 65 4.891 16.915 4.524
528 HD3 LYS 65 HD3 LYS 65 4.680 18.009 3.137
529 HE2 LYS 65 HE2 LYS 65 2.317 17.253 2.911
530 HE3 LYS 65 HE3 LYS 65 2.527 16.179 4.300
531 HZ1 LYS 65 HZ1 LYS 65 2.741 19.136 4.386
532 HZ2 LYS 65 HZ2 LYS 65 1.486 18.259 4.939
533 HZ3 LYS 65 HZ3 LYS 65 2.936 18.145 5.671
534 H VAL 66 HN VAL 66 4.651 13.559 0.064
535 HA VAL 66 HA VAL 66 5.422 14.486 -2.564
536 HB VAL 66 HB VAL 66 2.883 13.136 -1.555
537 HG11 VAL 66 HG11 VAL 66 3.837 13.588 -4.426
538 HG12 VAL 66 HG12 VAL 66 2.509 12.506 -3.947
539 HG13 VAL 66 HG13 VAL 66 2.358 14.237 -3.678
540 HG21 VAL 66 HG21 VAL 66 4.906 11.728 -1.297
541 HG22 VAL 66 HG22 VAL 66 3.868 11.101 -2.576
542 HG23 VAL 66 HG23 VAL 66 5.333 12.011 -2.996
543 H LEU 67 HN LEU 67 4.519 16.086 -3.828
544 HA LEU 67 HA LEU 67 2.684 18.038 -2.488
545 HG LEU 67 HG LEU 67 5.851 18.148 -2.469
546 HB2 LEU 67 HB2 LEU 67 4.712 18.530 -4.701
547 HB3 LEU 67 HB3 LEU 67 3.693 19.735 -3.932
548 HD11 LEU 67 HD11 LEU 67 5.962 20.950 -3.628
549 HD12 LEU 67 HD12 LEU 67 7.234 20.144 -2.676
550 HD13 LEU 67 HD13 LEU 67 6.808 19.519 -4.256
551 HD21 LEU 67 HD21 LEU 67 4.142 19.021 -0.940
552 HD22 LEU 67 HD22 LEU 67 5.676 19.874 -0.744
553 HD23 LEU 67 HD23 LEU 67 4.339 20.650 -1.629
554 H SER 68 HN SER 68 3.687 16.512 -5.599
555 HA SER 68 HA SER 68 0.904 16.200 -6.456
556 HG SER 68 HG SER 68 1.500 19.447 -7.991
557 HB2 SER 68 HB2 SER 68 2.959 17.690 -8.167
558 HB3 SER 68 HB3 SER 68 1.310 17.262 -8.639
559 H ALA 69 HN ALA 69 0.838 14.567 -8.237
560 HA ALA 69 HA ALA 69 3.339 13.538 -9.245
561 HB1 ALA 69 HB1 ALA 69 2.931 11.186 -8.537
562 HB2 ALA 69 HB2 ALA 69 3.234 12.248 -7.155
563 HB3 ALA 69 HB3 ALA 69 1.569 11.729 -7.531
564 H SER 70 HN SER 70 2.976 11.980 -10.975
565 HA SER 70 HA SER 70 0.260 11.780 -12.121
566 HG SER 70 HG SER 70 2.753 14.240 -12.310
567 HB2 SER 70 HB2 SER 70 1.258 12.855 -14.290
568 HB3 SER 70 HB3 SER 70 0.672 13.902 -12.996
569 H SER 71 HN SER 71 0.200 10.326 -14.014
570 HA SER 71 HA SER 71 2.066 8.168 -14.033
571 HG SER 71 HG SER 71 -1.279 7.662 -15.271
572 HB2 SER 71 HB2 SER 71 0.211 9.109 -16.261
573 HB3 SER 71 HB3 SER 71 0.882 7.481 -16.042
574 H TYR 72 HN TYR 72 3.832 7.736 -15.528
575 HA TYR 72 HA TYR 72 5.326 10.094 -16.104
576 HD1 TYR 72 HD1 TYR 72 8.192 9.902 -15.959
577 HD2 TYR 72 HD2 TYR 72 6.667 7.438 -19.159
578 HE1 TYR 72 HE1 TYR 72 10.004 10.702 -17.438
579 HE2 TYR 72 HE2 TYR 72 8.475 8.235 -20.643
580 HH TYR 72 HH TYR 72 10.364 9.588 -20.834
581 HB2 TYR 72 HB2 TYR 72 6.494 8.078 -15.551
582 HB3 TYR 72 HB3 TYR 72 5.774 7.214 -16.916
583 H SER 73 HN SER 73 5.584 11.275 -17.851
584 HA SER 73 HA SER 73 5.117 10.297 -20.520
585 HG SER 73 HG SER 73 1.822 11.706 -20.234
586 HB2 SER 73 HB2 SER 73 3.691 12.774 -19.442
587 HB3 SER 73 HB3 SER 73 3.816 12.358 -21.159
588 HA PRO 74 HA PRO 74 8.951 12.328 -20.492
589 HB2 PRO 74 HB2 PRO 74 9.274 13.200 -23.142
590 HB3 PRO 74 HB3 PRO 74 9.561 11.539 -22.534
591 HG2 PRO 74 HG2 PRO 74 7.129 12.662 -23.925
592 HG3 PRO 74 HG3 PRO 74 7.899 11.060 -24.144
593 HD2 PRO 74 HD2 PRO 74 5.654 11.381 -22.644
594 HD3 PRO 74 HD3 PRO 74 6.932 10.225 -22.157
595 H ASP 75 HN ASP 75 6.676 14.351 -22.438
596 HA ASP 75 HA ASP 75 7.978 16.809 -21.898
597 HB2 ASP 75 HB2 ASP 75 6.350 16.578 -23.699
598 HB3 ASP 75 HB3 ASP 75 5.061 16.234 -22.542
599 H GLU 76 HN GLU 76 5.253 15.206 -20.208
600 HA GLU 76 HA GLU 76 4.783 17.241 -18.312
601 HB2 GLU 76 HB2 GLU 76 3.413 15.081 -19.029
602 HB3 GLU 76 HB3 GLU 76 4.332 14.299 -17.745
603 HG2 GLU 76 HG2 GLU 76 2.371 14.951 -16.672
604 HG3 GLU 76 HG3 GLU 76 3.476 16.251 -16.235
605 H TRP 77 HN TRP 77 7.076 14.517 -18.320
606 HA TRP 77 HA TRP 77 7.983 14.710 -15.619
607 HD1 TRP 77 HD1 TRP 77 10.344 13.700 -14.579
608 HE1 TRP 77 HE1 TRP 77 12.886 13.468 -14.617
609 HE3 TRP 77 HE3 TRP 77 11.009 13.065 -19.610
610 HZ2 TRP 77 HZ2 TRP 77 14.981 13.275 -16.620
611 HZ3 TRP 77 HZ3 TRP 77 13.288 12.871 -20.560
612 HH2 TRP 77 HH2 TRP 77 15.282 12.995 -19.079
613 HB2 TRP 77 HB2 TRP 77 8.505 12.729 -16.794
614 HB3 TRP 77 HB3 TRP 77 9.038 13.584 -18.213
615 H GLU 78 HN GLU 78 9.424 16.029 -18.686
616 HA GLU 78 HA GLU 78 11.403 17.460 -17.238
617 HB2 GLU 78 HB2 GLU 78 10.343 17.868 -20.065
618 HB3 GLU 78 HB3 GLU 78 11.755 18.701 -19.392
619 HG2 GLU 78 HG2 GLU 78 12.776 16.447 -18.885
620 HG3 GLU 78 HG3 GLU 78 11.442 15.695 -19.752
621 H ARG 79 HN ARG 79 8.173 18.455 -18.317
622 HA ARG 79 HA ARG 79 8.253 21.192 -17.678
623 HE ARG 79 HE ARG 79 3.418 22.747 -17.416
624 HB2 ARG 79 HB2 ARG 79 6.434 19.979 -18.834
625 HB3 ARG 79 HB3 ARG 79 6.047 19.122 -17.341
626 HG2 ARG 79 HG2 ARG 79 5.486 21.401 -16.310
627 HG3 ARG 79 HG3 ARG 79 5.695 22.086 -17.940
628 HD2 ARG 79 HD2 ARG 79 3.984 20.391 -18.763
629 HD3 ARG 79 HD3 ARG 79 3.758 19.900 -17.076
630 HH11 ARG 79 HH11 ARG 79 1.735 19.625 -17.807
631 HH12 ARG 79 HH12 ARG 79 0.153 20.334 -17.755
632 HH21 ARG 79 HH21 ARG 79 1.311 23.661 -17.308
633 HH22 ARG 79 HH22 ARG 79 -0.087 22.667 -17.443
634 H GLN 80 HN GLN 80 7.393 18.397 -15.515
635 HA GLN 80 HA GLN 80 7.052 20.076 -13.230
636 HB2 GLN 80 HB2 GLN 80 7.429 17.081 -13.578
637 HB3 GLN 80 HB3 GLN 80 7.223 17.835 -11.988
638 HG2 GLN 80 HG2 GLN 80 5.070 18.740 -12.563
639 HG3 GLN 80 HG3 GLN 80 5.241 18.276 -14.253
640 HE21 GLN 80 HE22 GLN 80 5.113 16.044 -14.846
641 HE22 GLN 80 HE21 GLN 80 4.186 14.931 -13.830
642 H CYS 81 HN CYS 81 9.918 18.347 -14.534
643 HA CYS 81 HA CYS 81 11.572 18.519 -12.265
644 HG CYS 81 HG CYS 81 10.896 16.562 -14.686
645 HB2 CYS 81 HB2 CYS 81 12.292 18.735 -15.215
646 HB3 CYS 81 HB3 CYS 81 13.463 18.507 -13.905
647 H LYS 82 HN LYS 82 10.680 21.097 -14.522
648 HA LYS 82 HA LYS 82 12.833 22.869 -13.998
649 HB2 LYS 82 HB2 LYS 82 9.955 23.423 -14.840
650 HB3 LYS 82 HB3 LYS 82 11.225 24.649 -14.783
651 HG2 LYS 82 HG2 LYS 82 12.527 23.553 -16.485
652 HG3 LYS 82 HG3 LYS 82 11.508 22.122 -16.441
653 HD2 LYS 82 HD2 LYS 82 10.952 23.378 -18.416
654 HD3 LYS 82 HD3 LYS 82 9.591 23.390 -17.306
655 HE2 LYS 82 HE2 LYS 82 9.823 25.576 -18.313
656 HE3 LYS 82 HE3 LYS 82 10.171 25.699 -16.587
657 HZ1 LYS 82 HZ1 LYS 82 12.506 25.816 -17.078
658 HZ2 LYS 82 HZ2 LYS 82 12.254 25.547 -18.700
659 HZ3 LYS 82 HZ3 LYS 82 11.767 26.926 -17.946
660 H VAL 83 HN VAL 83 9.994 22.026 -12.069
661 HA VAL 83 HA VAL 83 9.882 24.388 -10.577
662 HB VAL 83 HB VAL 83 8.987 21.574 -9.838
663 HG11 VAL 83 HG11 VAL 83 7.382 22.702 -8.309
664 HG12 VAL 83 HG12 VAL 83 9.057 22.960 -7.816
665 HG13 VAL 83 HG13 VAL 83 8.171 24.259 -8.642
666 HG21 VAL 83 HG21 VAL 83 7.913 22.416 -11.928
667 HG22 VAL 83 HG22 VAL 83 6.754 22.367 -10.603
668 HG23 VAL 83 HG23 VAL 83 7.467 23.916 -11.095
669 H ALA 84 HN ALA 84 12.023 21.549 -10.333
670 HA ALA 84 HA ALA 84 13.058 22.058 -7.711
671 HB1 ALA 84 HB1 ALA 84 14.822 20.569 -8.357
672 HB2 ALA 84 HB2 ALA 84 13.360 19.952 -9.109
673 HB3 ALA 84 HB3 ALA 84 14.539 20.852 -10.087
674 H GLY 85 HN GLY 85 13.556 23.633 -10.802
675 HA2 GLY 85 HA2 GLY 85 15.701 25.382 -9.716
676 HA3 GLY 85 HA3 GLY 85 15.300 25.146 -11.424
677 H LYS 86 HN LYS 86 12.782 25.487 -8.954
678 HA LYS 86 HA LYS 86 11.118 26.891 -8.670
679 HB2 LYS 86 HB2 LYS 86 11.525 29.199 -8.160
680 HB3 LYS 86 HB3 LYS 86 12.709 28.146 -7.405
681 HG2 LYS 86 HG2 LYS 86 14.445 28.841 -8.936
682 HG3 LYS 86 HG3 LYS 86 13.278 29.683 -9.965
683 HD2 LYS 86 HD2 LYS 86 14.529 31.289 -8.666
684 HD3 LYS 86 HD3 LYS 86 12.828 31.310 -8.177
685 HE2 LYS 86 HE2 LYS 86 13.391 29.893 -6.200
686 HE3 LYS 86 HE3 LYS 86 15.082 29.868 -6.701
687 HZ1 LYS 86 HZ1 LYS 86 15.144 32.276 -6.381
688 HZ2 LYS 86 HZ2 LYS 86 13.574 32.298 -5.920
689 HZ3 LYS 86 HZ3 LYS 86 14.684 31.532 -5.007
690 H THR 87 HN THR 87 11.419 25.922 -11.263
691 HA THR 87 HA THR 87 10.296 25.961 -13.148
692 HB THR 87 HB THR 87 8.581 28.261 -12.222
693 HG1 THR 87 HG1 THR 87 7.572 26.923 -10.806
694 HG21 THR 87 HG21 THR 87 7.957 25.565 -13.537
695 HG22 THR 87 HG22 THR 87 6.773 26.829 -13.139
696 HG23 THR 87 HG23 THR 87 7.997 27.130 -14.376
697 H GLN 88 HN GLN 88 12.714 27.668 -12.843
698 HA GLN 88 HA GLN 88 12.485 29.820 -14.805
699 HB2 GLN 88 HB2 GLN 88 14.830 28.229 -13.677
700 HB3 GLN 88 HB3 GLN 88 15.016 29.499 -14.889
701 HG2 GLN 88 HG2 GLN 88 14.193 31.205 -13.409
702 HG3 GLN 88 HG3 GLN 88 13.652 30.019 -12.222
703 HE21 GLN 88 HE22 GLN 88 15.358 28.589 -11.266
704 HE22 GLN 88 HE21 GLN 88 16.920 29.301 -10.874
Start of MODEL 9
1 HA MET 1 HA MET 1 3.474 -1.165 -2.692
2 H1 MET 1 H1 MET 1 3.135 -1.018 -0.359
3 H2 MET 1 H2 MET 1 2.075 0.220 -0.526
4 H3 MET 1 H3 MET 1 1.695 -1.267 -1.127
5 HB2 MET 1 HB2 MET 1 1.274 -0.230 -3.405
6 HB3 MET 1 HB3 MET 1 1.790 1.375 -2.861
7 HG2 MET 1 HG2 MET 1 2.081 1.097 -5.288
8 HG3 MET 1 HG3 MET 1 3.628 1.367 -4.494
9 HE1 MET 1 HE1 MET 1 4.988 0.622 -6.571
10 HE2 MET 1 HE2 MET 1 4.705 -0.885 -7.471
11 HE3 MET 1 HE3 MET 1 3.468 0.392 -7.468
12 H GLU 2 HN GLU 2 5.486 -0.384 -3.224
13 HA GLU 2 HA GLU 2 6.527 1.997 -1.811
14 HB2 GLU 2 HB2 GLU 2 7.993 -0.676 -2.047
15 HB3 GLU 2 HB3 GLU 2 8.575 0.807 -1.304
16 HG2 GLU 2 HG2 GLU 2 7.972 -0.468 0.541
17 HG3 GLU 2 HG3 GLU 2 6.581 0.593 0.333
18 H TRP 3 HN TRP 3 8.319 2.918 -3.056
19 HA TRP 3 HA TRP 3 8.073 2.212 -5.934
20 HD1 TRP 3 HD1 TRP 3 6.522 5.417 -3.148
21 HE1 TRP 3 HE1 TRP 3 3.967 5.421 -3.231
22 HE3 TRP 3 HE3 TRP 3 5.893 3.213 -7.721
23 HZ2 TRP 3 HZ2 TRP 3 1.893 4.540 -5.065
24 HZ3 TRP 3 HZ3 TRP 3 3.617 2.831 -8.625
25 HH2 TRP 3 HH2 TRP 3 1.614 3.481 -7.307
26 HB2 TRP 3 HB2 TRP 3 8.419 5.004 -4.816
27 HB3 TRP 3 HB3 TRP 3 8.001 4.546 -6.451
28 H LEU 4 HN LEU 4 9.846 2.961 -7.254
29 HA LEU 4 HA LEU 4 12.486 3.139 -5.875
30 HG LEU 4 HG LEU 4 13.968 3.114 -8.686
31 HB2 LEU 4 HB2 LEU 4 12.185 1.120 -7.227
32 HB3 LEU 4 HB3 LEU 4 11.670 2.107 -8.602
33 HD11 LEU 4 HD11 LEU 4 14.756 2.720 -6.406
34 HD12 LEU 4 HD12 LEU 4 14.581 0.965 -6.604
35 HD13 LEU 4 HD13 LEU 4 15.800 1.854 -7.535
36 HD21 LEU 4 HD21 LEU 4 14.992 1.148 -9.738
37 HD22 LEU 4 HD22 LEU 4 13.844 0.073 -8.909
38 HD23 LEU 4 HD23 LEU 4 13.269 1.222 -10.137
39 H VAL 5 HN VAL 5 13.496 4.946 -6.184
40 HA VAL 5 HA VAL 5 12.572 7.142 -7.965
41 HB VAL 5 HB VAL 5 15.095 6.958 -6.253
42 HG11 VAL 5 HG11 VAL 5 15.263 8.663 -7.983
43 HG12 VAL 5 HG12 VAL 5 13.683 9.329 -7.516
44 HG13 VAL 5 HG13 VAL 5 15.072 9.420 -6.407
45 HG21 VAL 5 HG21 VAL 5 12.347 8.112 -5.568
46 HG22 VAL 5 HG22 VAL 5 13.182 6.796 -4.728
47 HG23 VAL 5 HG23 VAL 5 13.825 8.432 -4.628
48 H LYS 6 HN LYS 6 12.972 6.723 -10.021
49 HA LYS 6 HA LYS 6 15.476 5.387 -10.924
50 HB2 LYS 6 HB2 LYS 6 12.760 5.828 -12.090
51 HB3 LYS 6 HB3 LYS 6 14.094 5.618 -13.194
52 HG2 LYS 6 HG2 LYS 6 13.896 3.617 -10.959
53 HG3 LYS 6 HG3 LYS 6 12.680 3.528 -12.219
54 HD2 LYS 6 HD2 LYS 6 14.651 2.046 -12.604
55 HD3 LYS 6 HD3 LYS 6 14.267 3.136 -13.938
56 HE2 LYS 6 HE2 LYS 6 16.099 4.646 -13.316
57 HE3 LYS 6 HE3 LYS 6 16.468 3.649 -11.893
58 HZ1 LYS 6 HZ1 LYS 6 17.947 3.151 -13.733
59 HZ2 LYS 6 HZ2 LYS 6 17.050 1.835 -13.399
60 HZ3 LYS 6 HZ3 LYS 6 16.708 2.752 -14.710
61 H LYS 7 HN LYS 7 14.036 8.562 -10.732
62 HA LYS 7 HA LYS 7 16.412 9.755 -11.896
63 HB2 LYS 7 HB2 LYS 7 13.679 10.546 -12.993
64 HB3 LYS 7 HB3 LYS 7 15.197 11.410 -13.228
65 HG2 LYS 7 HG2 LYS 7 16.137 9.268 -14.270
66 HG3 LYS 7 HG3 LYS 7 14.466 8.658 -14.277
67 HD2 LYS 7 HD2 LYS 7 13.830 10.742 -15.580
68 HD3 LYS 7 HD3 LYS 7 15.544 11.127 -15.707
69 HE2 LYS 7 HE2 LYS 7 14.327 8.484 -16.620
70 HE3 LYS 7 HE3 LYS 7 14.465 9.904 -17.674
71 HZ1 LYS 7 HZ1 LYS 7 16.324 8.405 -17.985
72 HZ2 LYS 7 HZ2 LYS 7 16.875 9.809 -17.376
73 HZ3 LYS 7 HZ3 LYS 7 16.750 8.488 -16.416
74 H SER 8 HN SER 8 16.696 11.865 -10.899
75 HA SER 8 HA SER 8 14.672 12.841 -8.977
76 HG SER 8 HG SER 8 18.240 12.129 -8.781
77 HB2 SER 8 HB2 SER 8 16.631 12.842 -7.278
78 HB3 SER 8 HB3 SER 8 15.791 11.315 -7.583
79 H CYS 9 HN CYS 9 14.759 15.001 -8.884
80 HA CYS 9 HA CYS 9 16.869 16.537 -10.280
81 HG CYS 9 HG CYS 9 13.570 15.888 -10.529
82 HB2 CYS 9 HB2 CYS 9 14.414 17.480 -8.718
83 HB3 CYS 9 HB3 CYS 9 15.453 18.477 -9.749
84 H CYS 10 HN CYS 10 17.790 18.440 -9.011
85 HA CYS 10 HA CYS 10 17.983 18.061 -6.074
86 HG CYS 10 HG CYS 10 19.677 16.173 -5.899
87 HB2 CYS 10 HB2 CYS 10 20.320 18.726 -7.927
88 HB3 CYS 10 HB3 CYS 10 20.356 18.719 -6.159
89 H ASN 11 HN ASN 11 17.412 20.017 -5.112
90 HA ASN 11 HA ASN 11 17.641 22.552 -6.618
91 HB2 ASN 11 HB2 ASN 11 15.460 22.913 -7.025
92 HB3 ASN 11 HB3 ASN 11 15.309 21.169 -7.018
93 HD21 ASN 11 HD22 ASN 11 14.815 20.217 -4.695
94 HD22 ASN 11 HD21 ASN 11 13.573 21.076 -3.853
95 H LYS 12 HN LYS 12 17.753 24.301 -5.323
96 HA LYS 12 HA LYS 12 16.619 24.153 -2.622
97 HB2 LYS 12 HB2 LYS 12 19.446 24.671 -3.370
98 HB3 LYS 12 HB3 LYS 12 18.785 25.990 -2.413
99 HG2 LYS 12 HG2 LYS 12 18.566 23.066 -1.671
100 HG3 LYS 12 HG3 LYS 12 19.830 24.153 -1.069
101 HD2 LYS 12 HD2 LYS 12 18.101 25.627 -0.044
102 HD3 LYS 12 HD3 LYS 12 16.822 24.557 -0.606
103 HE2 LYS 12 HE2 LYS 12 17.987 22.654 0.663
104 HE3 LYS 12 HE3 LYS 12 19.032 23.885 1.383
105 HZ1 LYS 12 HZ1 LYS 12 16.960 24.935 2.246
106 HZ2 LYS 12 HZ2 LYS 12 16.089 23.649 1.691
107 HZ3 LYS 12 HZ3 LYS 12 17.220 23.443 2.843
108 H GLN 13 HN GLN 13 16.226 25.456 -5.568
109 HA GLN 13 HA GLN 13 15.974 28.238 -4.853
110 HB2 GLN 13 HB2 GLN 13 14.904 26.610 -7.218
111 HB3 GLN 13 HB3 GLN 13 14.743 28.359 -7.094
112 HG2 GLN 13 HG2 GLN 13 17.405 26.861 -7.198
113 HG3 GLN 13 HG3 GLN 13 16.627 27.650 -8.561
114 HE21 GLN 13 HE22 GLN 13 18.991 28.142 -6.210
115 HE22 GLN 13 HE21 GLN 13 18.994 29.885 -6.206
116 H ASP 14 HN ASP 14 13.832 25.389 -4.681
117 HA ASP 14 HA ASP 14 12.104 27.143 -3.038
118 HB2 ASP 14 HB2 ASP 14 11.305 26.944 -5.555
119 HB3 ASP 14 HB3 ASP 14 10.733 25.357 -5.058
120 H ASN 15 HN ASN 15 13.727 24.347 -3.248
121 HA ASN 15 HA ASN 15 14.035 22.596 -1.964
122 HB2 ASN 15 HB2 ASN 15 13.158 24.259 -0.111
123 HB3 ASN 15 HB3 ASN 15 11.773 23.173 -0.079
124 HD21 ASN 15 HD22 ASN 15 12.791 20.652 -0.258
125 HD22 ASN 15 HD21 ASN 15 13.832 20.349 1.131
126 H ARG 16 HN ARG 16 11.174 23.156 -3.610
127 HA ARG 16 HA ARG 16 9.933 20.538 -3.335
128 HE ARG 16 HE ARG 16 7.653 25.261 -4.825
129 HB2 ARG 16 HB2 ARG 16 9.653 22.721 -5.432
130 HB3 ARG 16 HB3 ARG 16 8.658 21.257 -5.356
131 HG2 ARG 16 HG2 ARG 16 7.920 21.929 -3.040
132 HG3 ARG 16 HG3 ARG 16 8.783 23.451 -3.231
133 HD2 ARG 16 HD2 ARG 16 6.519 22.500 -5.038
134 HD3 ARG 16 HD3 ARG 16 6.347 23.635 -3.704
135 HH11 ARG 16 HH21 ARG 16 6.826 22.573 -7.031
136 HH12 ARG 16 HH22 ARG 16 7.663 23.287 -8.364
137 HH21 ARG 16 HH11 ARG 16 8.558 26.197 -6.484
138 HH22 ARG 16 HH12 ARG 16 8.743 25.449 -8.067
139 H HIS 17 HN HIS 17 11.161 18.816 -3.919
140 HA HIS 17 HA HIS 17 12.920 18.853 -6.306
141 HD1 HIS 17 HD1 HIS 17 13.761 17.936 -2.172
142 HD2 HIS 17 HD2 HIS 17 15.551 17.954 -5.974
143 HE1 HIS 17 HE1 HIS 17 16.080 18.983 -1.875
144 HB2 HIS 17 HB2 HIS 17 12.338 16.810 -4.109
145 HB3 HIS 17 HB3 HIS 17 13.279 16.420 -5.546
146 H VAL 18 HN VAL 18 12.623 16.904 -7.795
147 HA VAL 18 HA VAL 18 9.934 15.798 -7.856
148 HB VAL 18 HB VAL 18 11.197 16.656 -10.469
149 HG11 VAL 18 HG11 VAL 18 8.262 16.216 -9.780
150 HG12 VAL 18 HG12 VAL 18 8.974 16.429 -11.394
151 HG13 VAL 18 HG13 VAL 18 9.334 14.978 -10.470
152 HG21 VAL 18 HG21 VAL 18 10.920 18.801 -9.343
153 HG22 VAL 18 HG22 VAL 18 9.739 18.637 -10.636
154 HG23 VAL 18 HG23 VAL 18 9.231 18.407 -8.954
155 H LEU 19 HN LEU 19 9.945 13.748 -8.607
156 HA LEU 19 HA LEU 19 12.472 12.589 -9.574
157 HG LEU 19 HG LEU 19 10.536 12.392 -6.221
158 HB2 LEU 19 HB2 LEU 19 11.601 10.660 -7.762
159 HB3 LEU 19 HB3 LEU 19 13.074 11.585 -7.713
160 HD11 LEU 19 HD11 LEU 19 13.015 10.886 -5.314
161 HD12 LEU 19 HD12 LEU 19 11.669 11.421 -4.271
162 HD13 LEU 19 HD13 LEU 19 11.388 10.216 -5.535
163 HD21 LEU 19 HD21 LEU 19 11.836 14.358 -6.199
164 HD22 LEU 19 HD22 LEU 19 12.509 13.537 -4.807
165 HD23 LEU 19 HD23 LEU 19 13.378 13.480 -6.356
166 H MET 20 HN MET 20 12.084 10.222 -10.144
167 HA MET 20 HA MET 20 9.345 9.964 -11.297
168 HB2 MET 20 HB2 MET 20 12.020 9.107 -12.388
169 HB3 MET 20 HB3 MET 20 10.558 8.165 -12.744
170 HG2 MET 20 HG2 MET 20 9.385 10.084 -13.564
171 HG3 MET 20 HG3 MET 20 10.687 11.173 -13.099
172 HE1 MET 20 HE1 MET 20 11.466 7.661 -14.889
173 HE2 MET 20 HE2 MET 20 9.811 8.087 -15.389
174 HE3 MET 20 HE3 MET 20 11.137 8.113 -16.573
175 H LEU 21 HN LEU 21 8.205 8.822 -10.118
176 HA LEU 21 HA LEU 21 9.291 6.860 -8.154
177 HG LEU 21 HG LEU 21 8.156 7.221 -6.087
178 HB2 LEU 21 HB2 LEU 21 6.668 8.339 -8.499
179 HB3 LEU 21 HB3 LEU 21 6.600 6.698 -7.862
180 HD11 LEU 21 HD11 LEU 21 8.223 9.966 -7.381
181 HD12 LEU 21 HD12 LEU 21 8.623 9.750 -5.662
182 HD13 LEU 21 HD13 LEU 21 9.577 8.935 -6.910
183 HD21 LEU 21 HD21 LEU 21 5.800 9.156 -6.266
184 HD22 LEU 21 HD22 LEU 21 5.737 7.472 -5.723
185 HD23 LEU 21 HD23 LEU 21 6.628 8.667 -4.767
186 H CYS 22 HN CYS 22 9.206 4.754 -8.609
187 HA CYS 22 HA CYS 22 7.618 3.847 -10.963
188 HG CYS 22 HG CYS 22 10.524 5.723 -10.826
189 HB2 CYS 22 HB2 CYS 22 10.550 3.210 -10.399
190 HB3 CYS 22 HB3 CYS 22 9.597 2.707 -11.804
191 H ASP 23 HN ASP 23 7.527 1.471 -11.062
192 HA ASP 23 HA ASP 23 6.889 0.104 -8.619
193 HB2 ASP 23 HB2 ASP 23 6.067 -0.966 -10.522
194 HB3 ASP 23 HB3 ASP 23 7.493 -0.594 -11.480
195 H ALA 24 HN ALA 24 8.192 -1.351 -7.361
196 HA ALA 24 HA ALA 24 10.978 -0.726 -7.058
197 HB1 ALA 24 HB1 ALA 24 9.581 -1.398 -5.167
198 HB2 ALA 24 HB2 ALA 24 9.299 -2.991 -5.909
199 HB3 ALA 24 HB3 ALA 24 10.931 -2.528 -5.381
200 H GLY 25 HN GLY 25 11.513 -1.032 -9.346
201 HA2 GLY 25 HA2 GLY 25 13.068 -3.099 -10.211
202 HA3 GLY 25 HA3 GLY 25 11.416 -3.686 -10.518
203 H GLY 26 HN GLY 26 10.713 -0.672 -10.886
204 HA2 GLY 26 HA2 GLY 26 10.880 1.003 -12.457
205 HA3 GLY 26 HA3 GLY 26 12.048 0.058 -13.382
206 H ALA 27 HN ALA 27 9.247 -1.869 -12.714
207 HA ALA 27 HA ALA 27 8.777 -2.087 -15.520
208 HB1 ALA 27 HB1 ALA 27 7.052 -3.699 -14.874
209 HB2 ALA 27 HB2 ALA 27 8.503 -3.938 -13.884
210 HB3 ALA 27 HB3 ALA 27 7.081 -3.110 -13.202
211 H ILE 28 HN ILE 28 7.442 0.150 -13.279
212 HA ILE 28 HA ILE 28 5.452 1.161 -15.199
213 HB ILE 28 HB ILE 28 4.910 0.586 -12.237
214 HG12 ILE 28 HG12 ILE 28 3.581 -0.559 -14.736
215 HG13 ILE 28 HG13 ILE 28 4.650 -1.427 -13.630
216 HG21 ILE 28 HG21 ILE 28 3.936 2.771 -12.891
217 HG22 ILE 28 HG22 ILE 28 3.102 1.993 -14.258
218 HG23 ILE 28 HG23 ILE 28 2.684 1.604 -12.575
219 HD11 ILE 28 HD11 ILE 28 1.855 -0.435 -13.014
220 HD12 ILE 28 HD12 ILE 28 2.438 -2.100 -13.115
221 HD13 ILE 28 HD13 ILE 28 2.986 -1.060 -11.785
222 H LYS 29 HN LYS 29 5.384 3.523 -14.945
223 HA LYS 29 HA LYS 29 7.259 4.668 -12.958
224 HB2 LYS 29 HB2 LYS 29 7.436 5.281 -15.938
225 HB3 LYS 29 HB3 LYS 29 8.335 6.058 -14.631
226 HG2 LYS 29 HG2 LYS 29 9.173 3.626 -14.076
227 HG3 LYS 29 HG3 LYS 29 8.621 3.231 -15.702
228 HD2 LYS 29 HD2 LYS 29 10.160 4.881 -16.668
229 HD3 LYS 29 HD3 LYS 29 10.544 5.509 -15.063
230 HE2 LYS 29 HE2 LYS 29 12.383 4.158 -15.806
231 HE3 LYS 29 HE3 LYS 29 11.624 3.411 -14.407
232 HZ1 LYS 29 HZ1 LYS 29 10.590 1.788 -15.858
233 HZ2 LYS 29 HZ2 LYS 29 11.090 2.577 -17.215
234 HZ3 LYS 29 HZ3 LYS 29 12.170 1.845 -16.244
235 H MET 30 HN MET 30 6.880 6.755 -12.417
236 HA MET 30 HA MET 30 4.525 8.258 -13.367
237 HB2 MET 30 HB2 MET 30 5.162 7.437 -10.490
238 HB3 MET 30 HB3 MET 30 3.954 8.617 -10.957
239 HG2 MET 30 HG2 MET 30 2.658 6.908 -12.131
240 HG3 MET 30 HG3 MET 30 3.904 5.701 -11.802
241 HE1 MET 30 HE1 MET 30 1.231 8.072 -10.207
242 HE2 MET 30 HE2 MET 30 1.174 7.512 -8.519
243 HE3 MET 30 HE3 MET 30 2.594 8.400 -9.104
244 H ILE 31 HN ILE 31 4.695 10.490 -12.224
245 HA ILE 31 HA ILE 31 7.514 11.295 -11.669
246 HB ILE 31 HB ILE 31 5.413 12.901 -13.119
247 HG12 ILE 31 HG12 ILE 31 8.102 12.189 -14.329
248 HG13 ILE 31 HG13 ILE 31 6.842 10.966 -14.367
249 HG21 ILE 31 HG21 ILE 31 6.804 14.389 -11.770
250 HG22 ILE 31 HG22 ILE 31 8.288 13.568 -12.311
251 HG23 ILE 31 HG23 ILE 31 7.338 14.542 -13.441
252 HD11 ILE 31 HD11 ILE 31 5.278 12.480 -15.433
253 HD12 ILE 31 HD12 ILE 31 6.481 13.783 -15.407
254 HD13 ILE 31 HD13 ILE 31 6.773 12.330 -16.387
255 H ALA 32 HN ALA 32 7.610 12.449 -9.674
256 HA ALA 32 HA ALA 32 5.053 13.369 -8.499
257 HB1 ALA 32 HB1 ALA 32 5.598 11.107 -7.519
258 HB2 ALA 32 HB2 ALA 32 7.133 11.812 -6.929
259 HB3 ALA 32 HB3 ALA 32 5.589 12.436 -6.337
260 H GLU 33 HN GLU 33 5.265 15.246 -7.470
261 HA GLU 33 HA GLU 33 7.951 16.503 -7.271
262 HB2 GLU 33 HB2 GLU 33 6.196 17.717 -8.590
263 HB3 GLU 33 HB3 GLU 33 5.155 17.752 -7.154
264 HG2 GLU 33 HG2 GLU 33 6.799 19.095 -5.950
265 HG3 GLU 33 HG3 GLU 33 7.939 18.986 -7.279
266 H VAL 34 HN VAL 34 8.650 17.004 -5.180
267 HA VAL 34 HA VAL 34 6.968 16.241 -2.882
268 HB VAL 34 HB VAL 34 8.571 14.656 -2.054
269 HG11 VAL 34 HG11 VAL 34 8.195 13.866 -4.972
270 HG12 VAL 34 HG12 VAL 34 8.390 12.803 -3.568
271 HG13 VAL 34 HG13 VAL 34 6.916 13.762 -3.754
272 HG21 VAL 34 HG21 VAL 34 10.281 15.224 -4.506
273 HG22 VAL 34 HG22 VAL 34 10.690 15.583 -2.812
274 HG23 VAL 34 HG23 VAL 34 10.557 13.908 -3.342
275 H LYS 35 HN LYS 35 8.173 16.823 -0.812
276 HA LYS 35 HA LYS 35 10.287 18.888 -1.233
277 HB2 LYS 35 HB2 LYS 35 8.006 19.748 -0.284
278 HB3 LYS 35 HB3 LYS 35 8.429 18.859 1.180
279 HG2 LYS 35 HG2 LYS 35 10.551 20.150 1.324
280 HG3 LYS 35 HG3 LYS 35 10.137 21.021 -0.163
281 HD2 LYS 35 HD2 LYS 35 8.525 21.099 2.427
282 HD3 LYS 35 HD3 LYS 35 9.725 22.304 1.940
283 HE2 LYS 35 HE2 LYS 35 8.396 22.800 -0.113
284 HE3 LYS 35 HE3 LYS 35 7.169 21.636 0.407
285 HZ1 LYS 35 HZ1 LYS 35 6.558 23.887 1.018
286 HZ2 LYS 35 HZ2 LYS 35 6.792 23.017 2.373
287 HZ3 LYS 35 HZ3 LYS 35 7.920 24.094 1.884
288 H SER 36 HN SER 36 11.999 18.686 0.375
289 HA SER 36 HA SER 36 12.113 16.019 1.698
290 HG SER 36 HG SER 36 13.497 15.684 -1.686
291 HB2 SER 36 HB2 SER 36 14.491 16.925 0.132
292 HB3 SER 36 HB3 SER 36 13.865 15.297 0.439
293 H ASP 37 HN ASP 37 13.372 15.943 3.522
294 HA ASP 37 HA ASP 37 14.792 18.452 4.330
295 HB2 ASP 37 HB2 ASP 37 12.869 17.729 5.739
296 HB3 ASP 37 HB3 ASP 37 13.705 16.213 6.067
297 H PHE 38 HN PHE 38 15.469 15.695 2.810
298 HA PHE 38 HA PHE 38 18.218 15.422 3.806
299 HD1 PHE 38 HD2 PHE 38 14.627 13.886 4.999
300 HD2 PHE 38 HD1 PHE 38 18.724 13.151 6.135
301 HE1 PHE 38 HE2 PHE 38 13.958 13.850 7.389
302 HE2 PHE 38 HE1 PHE 38 18.047 13.108 8.523
303 HZ PHE 38 HZ PHE 38 15.665 13.454 9.153
304 HB2 PHE 38 HB2 PHE 38 16.345 13.060 3.361
305 HB3 PHE 38 HB3 PHE 38 18.036 12.969 3.808
306 H ALA 39 HN ALA 39 19.507 14.271 2.091
307 HA ALA 39 HA ALA 39 18.823 15.069 -0.566
308 HB1 ALA 39 HB1 ALA 39 20.840 13.785 -1.197
309 HB2 ALA 39 HB2 ALA 39 21.160 14.822 0.205
310 HB3 ALA 39 HB3 ALA 39 20.908 13.072 0.427
311 H VAL 40 HN VAL 40 18.363 13.700 -2.386
312 HA VAL 40 HA VAL 40 17.510 10.917 -1.937
313 HB VAL 40 HB VAL 40 15.798 12.888 -3.521
314 HG11 VAL 40 HG11 VAL 40 14.087 11.071 -3.269
315 HG12 VAL 40 HG12 VAL 40 15.523 10.546 -4.160
316 HG13 VAL 40 HG13 VAL 40 15.306 10.069 -2.465
317 HG21 VAL 40 HG21 VAL 40 15.245 11.981 -0.679
318 HG22 VAL 40 HG22 VAL 40 15.603 13.645 -1.197
319 HG23 VAL 40 HG23 VAL 40 14.123 12.863 -1.735
320 H LYS 41 HN LYS 41 17.997 9.672 -3.846
321 HA LYS 41 HA LYS 41 18.670 11.092 -6.303
322 HB2 LYS 41 HB2 LYS 41 20.947 10.006 -6.470
323 HB3 LYS 41 HB3 LYS 41 20.779 11.387 -5.416
324 HG2 LYS 41 HG2 LYS 41 22.240 9.761 -4.404
325 HG3 LYS 41 HG3 LYS 41 20.788 9.944 -3.417
326 HD2 LYS 41 HD2 LYS 41 19.860 7.881 -4.396
327 HD3 LYS 41 HD3 LYS 41 21.302 7.716 -5.423
328 HE2 LYS 41 HE2 LYS 41 22.705 7.331 -3.498
329 HE3 LYS 41 HE3 LYS 41 21.396 7.781 -2.386
330 HZ1 LYS 41 HZ1 LYS 41 21.659 5.370 -2.599
331 HZ2 LYS 41 HZ2 LYS 41 20.158 5.881 -3.056
332 HZ3 LYS 41 HZ3 LYS 41 21.272 5.440 -4.189
333 H VAL 42 HN VAL 42 19.172 9.548 -8.082
334 HA VAL 42 HA VAL 42 17.328 7.557 -8.392
335 HB VAL 42 HB VAL 42 20.092 7.721 -9.694
336 HG11 VAL 42 HG11 VAL 42 19.168 5.575 -10.257
337 HG12 VAL 42 HG12 VAL 42 17.543 6.252 -10.458
338 HG13 VAL 42 HG13 VAL 42 18.832 6.620 -11.635
339 HG21 VAL 42 HG21 VAL 42 17.421 9.049 -10.175
340 HG22 VAL 42 HG22 VAL 42 19.014 9.814 -10.033
341 HG23 VAL 42 HG23 VAL 42 18.626 8.902 -11.490
342 H GLY 43 HN GLY 43 17.231 5.336 -8.331
343 HA2 GLY 43 HA2 GLY 43 17.635 3.221 -7.596
344 HA3 GLY 43 HA3 GLY 43 19.318 3.650 -7.220
345 H ASP 44 HN ASP 44 16.258 5.243 -6.089
346 HA ASP 44 HA ASP 44 17.086 4.425 -3.272
347 HB2 ASP 44 HB2 ASP 44 15.922 7.076 -4.158
348 HB3 ASP 44 HB3 ASP 44 15.599 6.418 -2.567
349 H LEU 45 HN LEU 45 15.452 3.631 -1.880
350 HA LEU 45 HA LEU 45 12.932 2.892 -3.223
351 HG LEU 45 HG LEU 45 11.339 1.951 -1.025
352 HB2 LEU 45 HB2 LEU 45 14.300 1.412 -1.557
353 HB3 LEU 45 HB3 LEU 45 13.752 2.542 -0.320
354 HD11 LEU 45 HD11 LEU 45 11.015 -0.208 -2.133
355 HD12 LEU 45 HD12 LEU 45 11.883 0.887 -3.213
356 HD13 LEU 45 HD13 LEU 45 12.770 -0.389 -2.358
357 HD21 LEU 45 HD21 LEU 45 13.158 -0.149 0.208
358 HD22 LEU 45 HD22 LEU 45 12.305 1.181 1.039
359 HD23 LEU 45 HD23 LEU 45 11.379 -0.132 0.306
360 H LEU 46 HN LEU 46 10.906 3.681 -2.456
361 HA LEU 46 HA LEU 46 10.872 5.706 -0.290
362 HG LEU 46 HG LEU 46 11.454 6.866 -3.163
363 HB2 LEU 46 HB2 LEU 46 9.260 5.803 -2.878
364 HB3 LEU 46 HB3 LEU 46 8.953 6.803 -1.465
365 HD11 LEU 46 HD11 LEU 46 9.079 8.777 -2.936
366 HD12 LEU 46 HD12 LEU 46 10.560 9.134 -3.834
367 HD13 LEU 46 HD13 LEU 46 9.534 7.785 -4.338
368 HD21 LEU 46 HD21 LEU 46 12.035 7.516 -0.920
369 HD22 LEU 46 HD22 LEU 46 11.955 8.989 -1.892
370 HD23 LEU 46 HD23 LEU 46 10.618 8.562 -0.783
371 H SER 47 HN SER 47 9.651 4.863 1.283
372 HA SER 47 HA SER 47 7.340 3.117 0.525
373 HG SER 47 HG SER 47 9.817 0.927 1.974
374 HB2 SER 47 HB2 SER 47 8.965 2.750 3.053
375 HB3 SER 47 HB3 SER 47 7.702 1.705 2.402
376 HA PRO 48 HA PRO 48 5.146 6.255 2.646
377 HB2 PRO 48 HB2 PRO 48 2.779 5.040 3.326
378 HB3 PRO 48 HB3 PRO 48 3.232 5.454 1.647
379 HG2 PRO 48 HG2 PRO 48 3.507 2.779 3.045
380 HG3 PRO 48 HG3 PRO 48 2.844 3.116 1.413
381 HD2 PRO 48 HD2 PRO 48 5.415 2.277 1.797
382 HD3 PRO 48 HD3 PRO 48 4.997 3.447 0.510
383 H LEU 49 HN LEU 49 4.609 7.027 4.685
384 HA LEU 49 HA LEU 49 5.212 5.273 7.060
385 HG LEU 49 HG LEU 49 7.486 6.751 5.650
386 HB2 LEU 49 HB2 LEU 49 5.680 8.251 6.600
387 HB3 LEU 49 HB3 LEU 49 5.881 7.446 8.153
388 HD11 LEU 49 HD11 LEU 49 8.186 8.481 8.056
389 HD12 LEU 49 HD12 LEU 49 9.325 7.956 6.797
390 HD13 LEU 49 HD13 LEU 49 7.969 9.023 6.380
391 HD21 LEU 49 HD21 LEU 49 7.387 4.865 7.211
392 HD22 LEU 49 HD22 LEU 49 8.985 5.610 7.288
393 HD23 LEU 49 HD23 LEU 49 7.804 5.932 8.575
394 H GLN 50 HN GLN 50 3.284 7.835 5.653
395 HA GLN 50 HA GLN 50 0.839 7.137 6.960
396 HB2 GLN 50 HB2 GLN 50 0.483 9.481 7.879
397 HB3 GLN 50 HB3 GLN 50 1.613 8.509 8.808
398 HG2 GLN 50 HG2 GLN 50 3.491 9.732 8.109
399 HG3 GLN 50 HG3 GLN 50 2.697 10.315 6.651
400 HE21 GLN 50 HE22 GLN 50 1.688 12.271 6.648
401 HE22 GLN 50 HE21 GLN 50 1.522 13.293 8.067
402 H ASN 51 HN ASN 51 -0.562 9.509 6.101
403 HA ASN 51 HA ASN 51 -0.236 9.406 3.211
404 HB2 ASN 51 HB2 ASN 51 -2.395 10.089 4.375
405 HB3 ASN 51 HB3 ASN 51 -1.588 11.624 4.767
406 HD21 ASN 51 HD22 ASN 51 -1.436 13.230 3.110
407 HD22 ASN 51 HD21 ASN 51 -1.944 12.945 1.469
408 H ALA 52 HN ALA 52 0.541 11.068 1.953
409 HA ALA 52 HA ALA 52 2.059 12.330 1.059
410 HB1 ALA 52 HB1 ALA 52 1.943 14.001 3.580
411 HB2 ALA 52 HB2 ALA 52 2.470 14.510 1.956
412 HB3 ALA 52 HB3 ALA 52 0.782 14.068 2.230
413 H LEU 53 HN LEU 53 3.177 11.543 4.406
414 HA LEU 53 HA LEU 53 5.930 12.010 3.606
415 HG LEU 53 HG LEU 53 4.795 13.306 6.010
416 HB2 LEU 53 HB2 LEU 53 4.797 10.766 6.118
417 HB3 LEU 53 HB3 LEU 53 6.513 10.806 5.776
418 HD11 LEU 53 HD11 LEU 53 5.912 13.599 8.191
419 HD12 LEU 53 HD12 LEU 53 4.999 12.084 8.160
420 HD13 LEU 53 HD13 LEU 53 6.766 12.054 7.981
421 HD21 LEU 53 HD21 LEU 53 6.794 13.708 4.620
422 HD22 LEU 53 HD22 LEU 53 7.013 14.460 6.196
423 HD23 LEU 53 HD23 LEU 53 7.832 12.929 5.828
424 H TYR 54 HN TYR 54 7.358 10.663 2.839
425 HA TYR 54 HA TYR 54 6.945 7.730 2.994
426 HD1 TYR 54 HD2 TYR 54 5.022 9.655 0.691
427 HD2 TYR 54 HD1 TYR 54 7.139 5.996 -0.118
428 HE1 TYR 54 HE2 TYR 54 3.023 8.754 -0.458
429 HE2 TYR 54 HE1 TYR 54 5.136 5.054 -1.204
430 HH TYR 54 HH TYR 54 2.115 6.930 -1.636
431 HB2 TYR 54 HB2 TYR 54 7.685 9.411 0.574
432 HB3 TYR 54 HB3 TYR 54 8.313 7.789 0.760
433 H CYS 55 HN CYS 55 8.893 6.654 3.433
434 HA CYS 55 HA CYS 55 11.092 8.256 4.510
435 HG CYS 55 HG CYS 55 11.122 3.753 4.689
436 HB2 CYS 55 HB2 CYS 55 12.098 6.144 5.043
437 HB3 CYS 55 HB3 CYS 55 10.405 6.115 5.556
438 H ILE 56 HN ILE 56 13.378 7.695 3.690
439 HA ILE 56 HA ILE 56 13.434 7.398 0.716
440 HB ILE 56 HB ILE 56 15.361 8.922 2.501
441 HG12 ILE 56 HG12 ILE 56 13.544 10.292 0.495
442 HG13 ILE 56 HG13 ILE 56 12.980 10.001 2.140
443 HG21 ILE 56 HG21 ILE 56 16.213 9.860 0.277
444 HG22 ILE 56 HG22 ILE 56 16.554 8.166 0.498
445 HG23 ILE 56 HG23 ILE 56 15.203 8.659 -0.539
446 HD11 ILE 56 HD11 ILE 56 15.541 11.522 1.519
447 HD12 ILE 56 HD12 ILE 56 13.985 12.242 1.935
448 HD13 ILE 56 HD13 ILE 56 14.824 11.224 3.103
449 H ASN 57 HN ASN 57 15.003 6.167 -0.127
450 HA ASN 57 HA ASN 57 16.783 4.910 -0.481
451 HB2 ASN 57 HB2 ASN 57 18.024 6.495 1.018
452 HB3 ASN 57 HB3 ASN 57 17.686 5.434 2.392
453 HD21 ASN 57 HD22 ASN 57 19.009 5.412 -0.946
454 HD22 ASN 57 HD21 ASN 57 20.208 4.151 -0.634
455 H ARG 58 HN ARG 58 15.960 4.171 2.877
456 HA ARG 58 HA ARG 58 14.490 1.857 2.431
457 HE ARG 58 HE ARG 58 17.519 -1.245 4.413
458 HB2 ARG 58 HB2 ARG 58 15.936 0.039 3.140
459 HB3 ARG 58 HB3 ARG 58 16.607 0.771 1.705
460 HG2 ARG 58 HG2 ARG 58 18.213 2.068 3.162
461 HG3 ARG 58 HG3 ARG 58 17.600 1.199 4.567
462 HD2 ARG 58 HD2 ARG 58 18.868 -0.086 2.115
463 HD3 ARG 58 HD3 ARG 58 19.703 0.237 3.644
464 HH11 ARG 58 HH11 ARG 58 20.199 -1.798 2.154
465 HH12 ARG 58 HH12 ARG 58 20.182 -3.513 2.326
466 HH21 ARG 58 HH21 ARG 58 17.483 -3.533 4.638
467 HH22 ARG 58 HH22 ARG 58 18.605 -4.517 3.779
468 H GLU 59 HN GLU 59 15.261 4.411 4.372
469 HA GLU 59 HA GLU 59 14.742 2.918 6.877
470 HB2 GLU 59 HB2 GLU 59 16.466 4.051 8.058
471 HB3 GLU 59 HB3 GLU 59 17.158 3.138 6.716
472 HG2 GLU 59 HG2 GLU 59 17.282 5.307 5.398
473 HG3 GLU 59 HG3 GLU 59 16.773 6.163 6.860
474 H LYS 60 HN LYS 60 13.573 3.930 8.339
475 HA LYS 60 HA LYS 60 11.652 5.712 7.290
476 HB2 LYS 60 HB2 LYS 60 12.103 4.876 10.181
477 HB3 LYS 60 HB3 LYS 60 10.661 5.683 9.553
478 HG2 LYS 60 HG2 LYS 60 10.311 3.747 7.974
479 HG3 LYS 60 HG3 LYS 60 11.659 2.913 8.765
480 HD2 LYS 60 HD2 LYS 60 10.445 3.007 10.938
481 HD3 LYS 60 HD3 LYS 60 9.132 3.895 10.161
482 HE2 LYS 60 HE2 LYS 60 8.419 1.630 10.355
483 HE3 LYS 60 HE3 LYS 60 8.715 1.955 8.646
484 HZ1 LYS 60 HZ1 LYS 60 10.572 0.515 10.461
485 HZ2 LYS 60 HZ2 LYS 60 9.609 -0.182 9.351
486 HZ3 LYS 60 HZ3 LYS 60 10.831 0.776 8.864
487 H LEU 61 HN LEU 61 14.541 6.441 9.143
488 HA LEU 61 HA LEU 61 13.644 8.833 10.342
489 HG LEU 61 HG LEU 61 15.714 6.285 10.875
490 HB2 LEU 61 HB2 LEU 61 16.491 8.129 9.485
491 HB3 LEU 61 HB3 LEU 61 16.029 9.311 10.707
492 HD11 LEU 61 HD11 LEU 61 17.449 8.236 12.440
493 HD12 LEU 61 HD12 LEU 61 17.369 6.473 12.673
494 HD13 LEU 61 HD13 LEU 61 17.998 7.138 11.156
495 HD21 LEU 61 HD21 LEU 61 13.810 7.274 12.007
496 HD22 LEU 61 HD22 LEU 61 14.952 6.678 13.216
497 HD23 LEU 61 HD23 LEU 61 14.861 8.423 12.871
498 H HIS 62 HN HIS 62 14.985 8.210 7.153
499 HA HIS 62 HA HIS 62 15.350 11.099 6.587
500 HD1 HIS 62 HD1 HIS 62 18.622 8.221 4.535
501 HD2 HIS 62 HD2 HIS 62 17.347 10.418 7.891
502 HE1 HIS 62 HE1 HIS 62 20.579 8.254 6.158
503 HB2 HIS 62 HB2 HIS 62 15.880 8.636 4.874
504 HB3 HIS 62 HB3 HIS 62 16.340 10.295 4.492
505 H THR 63 HN THR 63 13.527 12.204 5.750
506 HA THR 63 HA THR 63 11.466 10.582 4.374
507 HB THR 63 HB THR 63 9.907 12.132 5.598
508 HG1 THR 63 HG1 THR 63 11.224 13.814 6.216
509 HG21 THR 63 HG21 THR 63 11.738 10.586 7.482
510 HG22 THR 63 HG22 THR 63 10.003 10.923 7.669
511 HG23 THR 63 HG23 THR 63 10.563 9.820 6.397
512 H VAL 64 HN VAL 64 10.124 11.503 2.918
513 HA VAL 64 HA VAL 64 10.624 14.245 1.915
514 HB VAL 64 HB VAL 64 9.623 13.188 -0.267
515 HG11 VAL 64 HG11 VAL 64 11.751 14.275 -0.202
516 HG12 VAL 64 HG12 VAL 64 12.545 12.804 0.403
517 HG13 VAL 64 HG13 VAL 64 11.831 12.839 -1.227
518 HG21 VAL 64 HG21 VAL 64 9.296 10.905 0.633
519 HG22 VAL 64 HG22 VAL 64 10.264 10.958 -0.847
520 HG23 VAL 64 HG23 VAL 64 11.055 10.700 0.723
521 H LYS 65 HN LYS 65 8.608 15.180 1.103
522 HA LYS 65 HA LYS 65 6.123 13.802 2.045
523 HB2 LYS 65 HB2 LYS 65 6.820 15.790 3.457
524 HB3 LYS 65 HB3 LYS 65 6.626 16.800 2.013
525 HG2 LYS 65 HG2 LYS 65 4.241 16.121 1.871
526 HG3 LYS 65 HG3 LYS 65 4.453 15.096 3.310
527 HD2 LYS 65 HD2 LYS 65 5.028 17.102 4.648
528 HD3 LYS 65 HD3 LYS 65 4.823 18.122 3.204
529 HE2 LYS 65 HE2 LYS 65 2.450 17.387 3.032
530 HE3 LYS 65 HE3 LYS 65 2.655 16.387 4.476
531 HZ1 LYS 65 HZ1 LYS 65 2.903 19.341 4.402
532 HZ2 LYS 65 HZ2 LYS 65 1.642 18.510 5.009
533 HZ3 LYS 65 HZ3 LYS 65 3.096 18.417 5.737
534 H VAL 66 HN VAL 66 4.757 13.428 0.386
535 HA VAL 66 HA VAL 66 5.436 14.283 -2.305
536 HB VAL 66 HB VAL 66 3.027 12.795 -1.173
537 HG11 VAL 66 HG11 VAL 66 3.863 13.192 -4.087
538 HG12 VAL 66 HG12 VAL 66 2.624 12.049 -3.520
539 HG13 VAL 66 HG13 VAL 66 2.368 13.778 -3.316
540 HG21 VAL 66 HG21 VAL 66 5.498 11.777 -2.658
541 HG22 VAL 66 HG22 VAL 66 5.167 11.551 -0.930
542 HG23 VAL 66 HG23 VAL 66 4.120 10.791 -2.126
543 H LEU 67 HN LEU 67 4.417 15.813 -3.579
544 HA LEU 67 HA LEU 67 2.536 17.690 -2.196
545 HG LEU 67 HG LEU 67 5.696 17.865 -2.134
546 HB2 LEU 67 HB2 LEU 67 4.593 18.269 -4.361
547 HB3 LEU 67 HB3 LEU 67 3.531 19.443 -3.597
548 HD11 LEU 67 HD11 LEU 67 5.699 20.726 -3.156
549 HD12 LEU 67 HD12 LEU 67 6.967 19.968 -2.163
550 HD13 LEU 67 HD13 LEU 67 6.665 19.372 -3.785
551 HD21 LEU 67 HD21 LEU 67 3.915 18.580 -0.600
552 HD22 LEU 67 HD22 LEU 67 5.390 19.507 -0.326
553 HD23 LEU 67 HD23 LEU 67 4.035 20.245 -1.212
554 H SER 68 HN SER 68 3.402 16.087 -5.308
555 HA SER 68 HA SER 68 0.638 15.682 -5.983
556 HG SER 68 HG SER 68 0.680 18.151 -5.798
557 HB2 SER 68 HB2 SER 68 2.324 17.629 -7.641
558 HB3 SER 68 HB3 SER 68 0.857 16.840 -8.244
559 H ALA 69 HN ALA 69 0.556 14.173 -7.900
560 HA ALA 69 HA ALA 69 3.044 13.457 -9.167
561 HB1 ALA 69 HB1 ALA 69 3.186 12.063 -7.105
562 HB2 ALA 69 HB2 ALA 69 1.604 11.345 -7.488
563 HB3 ALA 69 HB3 ALA 69 2.999 11.067 -8.557
564 H SER 70 HN SER 70 2.737 11.990 -10.942
565 HA SER 70 HA SER 70 0.000 11.540 -11.975
566 HG SER 70 HG SER 70 0.581 14.918 -13.173
567 HB2 SER 70 HB2 SER 70 2.100 13.223 -13.421
568 HB3 SER 70 HB3 SER 70 0.493 12.798 -14.028
569 H SER 71 HN SER 71 0.119 10.225 -14.041
570 HA SER 71 HA SER 71 2.065 8.163 -14.088
571 HG SER 71 HG SER 71 -1.161 7.685 -15.628
572 HB2 SER 71 HB2 SER 71 0.377 9.212 -16.396
573 HB3 SER 71 HB3 SER 71 1.060 7.585 -16.218
574 H TYR 72 HN TYR 72 3.859 7.814 -15.585
575 HA TYR 72 HA TYR 72 5.444 10.175 -15.946
576 HD1 TYR 72 HD1 TYR 72 8.090 10.226 -16.226
577 HD2 TYR 72 HD2 TYR 72 6.893 7.005 -18.840
578 HE1 TYR 72 HE1 TYR 72 9.905 10.825 -17.789
579 HE2 TYR 72 HE2 TYR 72 8.737 7.569 -20.383
580 HH TYR 72 HH TYR 72 10.564 8.962 -20.787
581 HB2 TYR 72 HB2 TYR 72 6.584 8.141 -15.482
582 HB3 TYR 72 HB3 TYR 72 5.770 7.289 -16.795
583 H SER 73 HN SER 73 5.992 11.327 -17.760
584 HA SER 73 HA SER 73 5.504 10.372 -20.409
585 HG SER 73 HG SER 73 3.222 10.470 -19.560
586 HB2 SER 73 HB2 SER 73 4.059 12.830 -19.331
587 HB3 SER 73 HB3 SER 73 4.317 12.550 -21.066
588 HA PRO 74 HA PRO 74 9.440 12.216 -20.167
589 HB2 PRO 74 HB2 PRO 74 9.995 12.880 -22.844
590 HB3 PRO 74 HB3 PRO 74 10.180 11.265 -22.100
591 HG2 PRO 74 HG2 PRO 74 7.896 12.342 -23.749
592 HG3 PRO 74 HG3 PRO 74 8.624 10.707 -23.784
593 HD2 PRO 74 HD2 PRO 74 6.284 11.210 -22.495
594 HD3 PRO 74 HD3 PRO 74 7.480 10.060 -21.821
595 H ASP 75 HN ASP 75 7.402 14.130 -22.441
596 HA ASP 75 HA ASP 75 8.739 16.585 -22.044
597 HB2 ASP 75 HB2 ASP 75 7.219 16.130 -23.920
598 HB3 ASP 75 HB3 ASP 75 5.847 16.039 -22.811
599 H GLU 76 HN GLU 76 6.043 15.084 -20.241
600 HA GLU 76 HA GLU 76 5.497 17.432 -18.681
601 HB2 GLU 76 HB2 GLU 76 3.935 15.450 -19.265
602 HB3 GLU 76 HB3 GLU 76 4.714 14.602 -17.918
603 HG2 GLU 76 HG2 GLU 76 4.055 16.481 -16.406
604 HG3 GLU 76 HG3 GLU 76 3.316 17.317 -17.766
605 H TRP 77 HN TRP 77 7.633 14.609 -18.266
606 HA TRP 77 HA TRP 77 8.432 15.117 -15.554
607 HD1 TRP 77 HD1 TRP 77 10.909 14.378 -14.427
608 HE1 TRP 77 HE1 TRP 77 13.455 14.113 -14.485
609 HE3 TRP 77 HE3 TRP 77 11.453 12.924 -19.301
610 HZ2 TRP 77 HZ2 TRP 77 15.496 13.542 -16.466
611 HZ3 TRP 77 HZ3 TRP 77 13.705 12.537 -20.253
612 HH2 TRP 77 HH2 TRP 77 15.735 12.860 -18.852
613 HB2 TRP 77 HB2 TRP 77 9.037 13.012 -16.378
614 HB3 TRP 77 HB3 TRP 77 9.498 13.621 -17.942
615 H GLU 78 HN GLU 78 9.837 16.100 -18.742
616 HA GLU 78 HA GLU 78 11.858 17.649 -17.522
617 HB2 GLU 78 HB2 GLU 78 10.687 17.703 -20.334
618 HB3 GLU 78 HB3 GLU 78 12.094 18.665 -19.852
619 HG2 GLU 78 HG2 GLU 78 13.267 16.572 -19.136
620 HG3 GLU 78 HG3 GLU 78 11.922 15.625 -19.759
621 H ARG 79 HN ARG 79 8.611 18.620 -18.471
622 HA ARG 79 HA ARG 79 8.872 21.412 -17.967
623 HE ARG 79 HE ARG 79 5.202 19.591 -21.448
624 HB2 ARG 79 HB2 ARG 79 6.680 19.363 -17.674
625 HB3 ARG 79 HB3 ARG 79 6.393 21.039 -17.168
626 HG2 ARG 79 HG2 ARG 79 6.884 21.856 -19.440
627 HG3 ARG 79 HG3 ARG 79 7.247 20.209 -19.969
628 HD2 ARG 79 HD2 ARG 79 4.844 19.630 -19.122
629 HD3 ARG 79 HD3 ARG 79 4.563 21.372 -19.127
630 HH11 ARG 79 HH21 ARG 79 4.066 22.822 -20.439
631 HH12 ARG 79 HH22 ARG 79 3.602 23.265 -22.041
632 HH21 ARG 79 HH11 ARG 79 4.653 20.121 -23.395
633 HH22 ARG 79 HH12 ARG 79 3.934 21.660 -23.833
634 H GLN 80 HN GLN 80 8.029 18.718 -15.675
635 HA GLN 80 HA GLN 80 7.630 20.469 -13.489
636 HB2 GLN 80 HB2 GLN 80 8.211 17.489 -13.626
637 HB3 GLN 80 HB3 GLN 80 7.878 18.347 -12.107
638 HG2 GLN 80 HG2 GLN 80 5.704 19.045 -12.840
639 HG3 GLN 80 HG3 GLN 80 5.995 18.482 -14.482
640 HE21 GLN 80 HE22 GLN 80 5.670 16.368 -15.028
641 HE22 GLN 80 HE21 GLN 80 4.916 15.208 -13.937
642 H CYS 81 HN CYS 81 10.635 18.958 -14.690
643 HA CYS 81 HA CYS 81 12.329 19.591 -12.527
644 HG CYS 81 HG CYS 81 13.343 17.345 -13.214
645 HB2 CYS 81 HB2 CYS 81 12.927 19.696 -15.518
646 HB3 CYS 81 HB3 CYS 81 14.131 19.610 -14.222
647 H LYS 82 HN LYS 82 10.972 21.764 -15.041
648 HA LYS 82 HA LYS 82 12.766 23.947 -14.483
649 HB2 LYS 82 HB2 LYS 82 9.977 24.152 -15.693
650 HB3 LYS 82 HB3 LYS 82 11.317 25.279 -15.853
651 HG2 LYS 82 HG2 LYS 82 11.166 22.515 -17.068
652 HG3 LYS 82 HG3 LYS 82 10.949 24.049 -17.900
653 HD2 LYS 82 HD2 LYS 82 13.278 24.698 -17.368
654 HD3 LYS 82 HD3 LYS 82 13.555 23.142 -16.563
655 HE2 LYS 82 HE2 LYS 82 12.567 23.393 -19.422
656 HE3 LYS 82 HE3 LYS 82 14.290 23.375 -19.028
657 HZ1 LYS 82 HZ1 LYS 82 12.428 21.171 -18.301
658 HZ2 LYS 82 HZ2 LYS 82 13.417 21.168 -19.613
659 HZ3 LYS 82 HZ3 LYS 82 14.057 21.185 -18.117
660 H VAL 83 HN VAL 83 9.502 22.957 -13.381
661 HA VAL 83 HA VAL 83 8.997 25.358 -12.023
662 HB VAL 83 HB VAL 83 7.775 22.663 -11.310
663 HG11 VAL 83 HG11 VAL 83 6.606 25.490 -11.293
664 HG12 VAL 83 HG12 VAL 83 5.779 24.003 -10.781
665 HG13 VAL 83 HG13 VAL 83 7.148 24.620 -9.852
666 HG21 VAL 83 HG21 VAL 83 7.028 24.539 -13.605
667 HG22 VAL 83 HG22 VAL 83 7.586 22.860 -13.749
668 HG23 VAL 83 HG23 VAL 83 6.022 23.194 -13.024
669 H ALA 84 HN ALA 84 10.722 22.421 -10.959
670 HA ALA 84 HA ALA 84 11.013 23.059 -8.198
671 HB1 ALA 84 HB1 ALA 84 12.997 21.604 -8.318
672 HB2 ALA 84 HB2 ALA 84 11.619 20.891 -9.170
673 HB3 ALA 84 HB3 ALA 84 12.945 21.644 -10.089
674 H GLY 85 HN GLY 85 12.533 24.464 -11.054
675 HA2 GLY 85 HA2 GLY 85 14.436 26.053 -9.405
676 HA3 GLY 85 HA3 GLY 85 14.554 25.726 -11.139
677 H LYS 86 HN LYS 86 11.329 26.450 -10.076
678 HA LYS 86 HA LYS 86 9.910 28.103 -10.605
679 HB2 LYS 86 HB2 LYS 86 12.236 29.800 -9.611
680 HB3 LYS 86 HB3 LYS 86 10.644 30.470 -9.973
681 HG2 LYS 86 HG2 LYS 86 9.557 29.150 -8.320
682 HG3 LYS 86 HG3 LYS 86 10.996 28.163 -8.029
683 HD2 LYS 86 HD2 LYS 86 12.188 29.997 -7.036
684 HD3 LYS 86 HD3 LYS 86 10.904 31.160 -7.459
685 HE2 LYS 86 HE2 LYS 86 9.385 30.286 -5.903
686 HE3 LYS 86 HE3 LYS 86 10.145 28.702 -5.921
687 HZ1 LYS 86 HZ1 LYS 86 10.601 29.653 -3.868
688 HZ2 LYS 86 HZ2 LYS 86 12.021 29.678 -4.666
689 HZ3 LYS 86 HZ3 LYS 86 11.160 31.078 -4.496
690 H THR 87 HN THR 87 11.452 27.018 -12.744
691 HA THR 87 HA THR 87 11.905 27.267 -14.921
692 HB THR 87 HB THR 87 9.602 29.246 -14.841
693 HG1 THR 87 HG1 THR 87 8.273 27.518 -14.620
694 HG21 THR 87 HG21 THR 87 10.372 27.101 -16.884
695 HG22 THR 87 HG22 THR 87 8.884 28.068 -16.919
696 HG23 THR 87 HG23 THR 87 10.446 28.855 -17.132
697 H GLN 88 HN GLN 88 13.617 28.797 -13.307
698 HA GLN 88 HA GLN 88 14.035 31.424 -14.505
699 HB2 GLN 88 HB2 GLN 88 15.684 29.694 -12.613
700 HB3 GLN 88 HB3 GLN 88 16.210 31.278 -13.193
701 HG2 GLN 88 HG2 GLN 88 14.292 32.385 -12.184
702 HG3 GLN 88 HG3 GLN 88 13.580 30.844 -11.710
703 HE21 GLN 88 HE22 GLN 88 14.788 29.486 -10.159
704 HE22 GLN 88 HE21 GLN 88 15.797 30.278 -8.931
Start of MODEL 10
1 HA MET 1 HA MET 1 4.222 -2.276 -2.245
2 H1 MET 1 H1 MET 1 4.169 -2.310 0.116
3 H2 MET 1 H2 MET 1 2.948 -1.218 0.169
4 H3 MET 1 H3 MET 1 2.684 -2.706 -0.490
5 HB2 MET 1 HB2 MET 1 1.860 -1.628 -2.644
6 HB3 MET 1 HB3 MET 1 2.195 -0.008 -2.010
7 HG2 MET 1 HG2 MET 1 2.234 -0.016 -4.455
8 HG3 MET 1 HG3 MET 1 3.825 0.381 -3.817
9 HE1 MET 1 HE1 MET 1 4.806 -1.341 -7.125
10 HE2 MET 1 HE2 MET 1 3.407 -0.283 -6.839
11 HE3 MET 1 HE3 MET 1 4.970 0.088 -6.079
12 H GLU 2 HN GLU 2 6.025 -1.219 -2.945
13 HA GLU 2 HA GLU 2 6.944 1.208 -1.531
14 HB2 GLU 2 HB2 GLU 2 8.686 -1.244 -2.045
15 HB3 GLU 2 HB3 GLU 2 9.147 0.277 -1.289
16 HG2 GLU 2 HG2 GLU 2 8.919 -1.095 0.550
17 HG3 GLU 2 HG3 GLU 2 7.366 -0.268 0.516
18 H TRP 3 HN TRP 3 8.664 2.283 -2.864
19 HA TRP 3 HA TRP 3 8.298 1.764 -5.763
20 HD1 TRP 3 HD1 TRP 3 6.139 3.610 -2.613
21 HE1 TRP 3 HE1 TRP 3 3.647 3.106 -2.880
22 HE3 TRP 3 HE3 TRP 3 5.942 3.251 -7.711
23 HZ2 TRP 3 HZ2 TRP 3 1.793 2.570 -5.051
24 HZ3 TRP 3 HZ3 TRP 3 3.810 2.716 -8.856
25 HH2 TRP 3 HH2 TRP 3 1.729 2.375 -7.535
26 HB2 TRP 3 HB2 TRP 3 8.020 4.407 -4.289
27 HB3 TRP 3 HB3 TRP 3 7.781 4.154 -5.998
28 H LEU 4 HN LEU 4 9.861 3.260 -6.977
29 HA LEU 4 HA LEU 4 12.510 3.370 -5.611
30 HG LEU 4 HG LEU 4 14.055 3.162 -8.366
31 HB2 LEU 4 HB2 LEU 4 12.237 1.269 -6.827
32 HB3 LEU 4 HB3 LEU 4 11.746 2.163 -8.275
33 HD11 LEU 4 HD11 LEU 4 14.797 2.878 -6.055
34 HD12 LEU 4 HD12 LEU 4 14.628 1.116 -6.175
35 HD13 LEU 4 HD13 LEU 4 15.862 1.970 -7.125
36 HD21 LEU 4 HD21 LEU 4 13.363 1.197 -9.726
37 HD22 LEU 4 HD22 LEU 4 15.079 1.132 -9.293
38 HD23 LEU 4 HD23 LEU 4 13.909 0.114 -8.427
39 H VAL 5 HN VAL 5 13.508 5.152 -5.990
40 HA VAL 5 HA VAL 5 12.650 7.223 -7.945
41 HB VAL 5 HB VAL 5 15.103 7.145 -6.128
42 HG11 VAL 5 HG11 VAL 5 15.315 8.764 -7.920
43 HG12 VAL 5 HG12 VAL 5 13.685 9.381 -7.598
44 HG13 VAL 5 HG13 VAL 5 14.998 9.624 -6.416
45 HG21 VAL 5 HG21 VAL 5 13.211 7.012 -4.628
46 HG22 VAL 5 HG22 VAL 5 13.747 8.685 -4.625
47 HG23 VAL 5 HG23 VAL 5 12.308 8.207 -5.567
48 H LYS 6 HN LYS 6 13.156 6.737 -9.953
49 HA LYS 6 HA LYS 6 15.637 5.252 -10.671
50 HB2 LYS 6 HB2 LYS 6 12.993 5.720 -11.992
51 HB3 LYS 6 HB3 LYS 6 14.384 5.323 -12.985
52 HG2 LYS 6 HG2 LYS 6 13.863 3.567 -10.601
53 HG3 LYS 6 HG3 LYS 6 12.771 3.437 -11.967
54 HD2 LYS 6 HD2 LYS 6 14.583 1.782 -12.077
55 HD3 LYS 6 HD3 LYS 6 14.526 2.843 -13.486
56 HE2 LYS 6 HE2 LYS 6 16.424 4.159 -12.628
57 HE3 LYS 6 HE3 LYS 6 16.461 3.174 -11.152
58 HZ1 LYS 6 HZ1 LYS 6 16.986 2.165 -13.892
59 HZ2 LYS 6 HZ2 LYS 6 18.114 2.443 -12.753
60 HZ3 LYS 6 HZ3 LYS 6 17.024 1.254 -12.535
61 H LYS 7 HN LYS 7 14.222 8.448 -10.771
62 HA LYS 7 HA LYS 7 16.664 9.589 -11.835
63 HB2 LYS 7 HB2 LYS 7 14.021 10.099 -13.249
64 HB3 LYS 7 HB3 LYS 7 15.416 11.175 -13.315
65 HG2 LYS 7 HG2 LYS 7 16.812 9.405 -14.286
66 HG3 LYS 7 HG3 LYS 7 15.446 8.284 -14.247
67 HD2 LYS 7 HD2 LYS 7 14.167 9.800 -15.760
68 HD3 LYS 7 HD3 LYS 7 15.602 10.851 -15.867
69 HE2 LYS 7 HE2 LYS 7 16.934 8.933 -16.725
70 HE3 LYS 7 HE3 LYS 7 15.523 7.883 -16.602
71 HZ1 LYS 7 HZ1 LYS 7 15.749 10.241 -18.390
72 HZ2 LYS 7 HZ2 LYS 7 15.829 8.684 -18.855
73 HZ3 LYS 7 HZ3 LYS 7 14.428 9.281 -18.275
74 H SER 8 HN SER 8 16.820 11.789 -10.981
75 HA SER 8 HA SER 8 14.654 12.850 -9.266
76 HG SER 8 HG SER 8 18.264 12.341 -8.754
77 HB2 SER 8 HB2 SER 8 16.507 13.103 -7.488
78 HB3 SER 8 HB3 SER 8 15.758 11.514 -7.686
79 H CYS 9 HN CYS 9 14.879 15.103 -9.036
80 HA CYS 9 HA CYS 9 17.078 16.425 -10.579
81 HG CYS 9 HG CYS 9 13.996 16.874 -13.006
82 HB2 CYS 9 HB2 CYS 9 14.117 17.103 -10.400
83 HB3 CYS 9 HB3 CYS 9 15.356 18.173 -11.091
84 H CYS 10 HN CYS 10 18.389 16.744 -8.844
85 HA CYS 10 HA CYS 10 17.739 17.583 -6.265
86 HG CYS 10 HG CYS 10 19.449 15.730 -5.831
87 HB2 CYS 10 HB2 CYS 10 20.237 18.233 -7.876
88 HB3 CYS 10 HB3 CYS 10 20.086 18.256 -6.112
89 H ASN 11 HN ASN 11 17.445 19.600 -5.278
90 HA ASN 11 HA ASN 11 17.829 22.089 -6.783
91 HB2 ASN 11 HB2 ASN 11 15.699 22.769 -7.015
92 HB3 ASN 11 HB3 ASN 11 15.348 21.055 -7.123
93 HD21 ASN 11 HD22 ASN 11 14.659 19.974 -5.026
94 HD22 ASN 11 HD21 ASN 11 13.785 20.907 -3.865
95 H LYS 12 HN LYS 12 17.951 23.857 -5.463
96 HA LYS 12 HA LYS 12 17.222 23.643 -2.626
97 HB2 LYS 12 HB2 LYS 12 19.319 24.777 -1.898
98 HB3 LYS 12 HB3 LYS 12 19.481 23.110 -2.405
99 HG2 LYS 12 HG2 LYS 12 21.367 24.399 -3.162
100 HG3 LYS 12 HG3 LYS 12 20.459 23.776 -4.545
101 HD2 LYS 12 HD2 LYS 12 19.519 25.964 -5.003
102 HD3 LYS 12 HD3 LYS 12 20.067 26.584 -3.444
103 HE2 LYS 12 HE2 LYS 12 21.501 27.473 -5.173
104 HE3 LYS 12 HE3 LYS 12 22.426 26.374 -4.150
105 HZ1 LYS 12 HZ1 LYS 12 22.231 24.690 -5.887
106 HZ2 LYS 12 HZ2 LYS 12 21.343 25.697 -6.829
107 HZ3 LYS 12 HZ3 LYS 12 22.895 26.043 -6.493
108 H GLN 13 HN GLN 13 16.598 25.052 -5.433
109 HA GLN 13 HA GLN 13 16.650 27.882 -4.777
110 HB2 GLN 13 HB2 GLN 13 15.342 26.115 -6.875
111 HB3 GLN 13 HB3 GLN 13 15.022 27.842 -6.806
112 HG2 GLN 13 HG2 GLN 13 17.883 26.820 -7.008
113 HG3 GLN 13 HG3 GLN 13 16.854 26.927 -8.432
114 HE21 GLN 13 HE22 GLN 13 15.759 29.067 -8.851
115 HE22 GLN 13 HE21 GLN 13 16.682 30.523 -8.503
116 H ASP 14 HN ASP 14 14.312 25.141 -4.597
117 HA ASP 14 HA ASP 14 12.404 26.969 -3.171
118 HB2 ASP 14 HB2 ASP 14 12.053 26.900 -5.674
119 HB3 ASP 14 HB3 ASP 14 11.705 25.178 -5.521
120 H ASN 15 HN ASN 15 13.928 24.004 -3.142
121 HA ASN 15 HA ASN 15 13.966 22.316 -1.713
122 HB2 ASN 15 HB2 ASN 15 12.845 24.057 -0.083
123 HB3 ASN 15 HB3 ASN 15 11.412 23.066 -0.324
124 HD21 ASN 15 HD22 ASN 15 12.804 20.411 -0.406
125 HD22 ASN 15 HD21 ASN 15 13.368 20.174 1.244
126 H ARG 16 HN ARG 16 11.291 23.060 -3.695
127 HA ARG 16 HA ARG 16 9.906 20.501 -3.583
128 HE ARG 16 HE ARG 16 6.164 22.148 -6.290
129 HB2 ARG 16 HB2 ARG 16 9.849 22.840 -5.518
130 HB3 ARG 16 HB3 ARG 16 8.944 21.333 -5.769
131 HG2 ARG 16 HG2 ARG 16 7.739 21.634 -3.687
132 HG3 ARG 16 HG3 ARG 16 8.631 23.098 -3.303
133 HD2 ARG 16 HD2 ARG 16 6.222 23.283 -4.255
134 HD3 ARG 16 HD3 ARG 16 7.437 24.389 -4.843
135 HH11 ARG 16 HH11 ARG 16 8.598 24.797 -6.425
136 HH12 ARG 16 HH12 ARG 16 8.882 24.578 -8.133
137 HH21 ARG 16 HH21 ARG 16 6.594 21.913 -8.533
138 HH22 ARG 16 HH22 ARG 16 7.682 23.012 -9.331
139 H HIS 17 HN HIS 17 11.281 18.860 -3.926
140 HA HIS 17 HA HIS 17 13.048 18.658 -6.281
141 HD1 HIS 17 HD1 HIS 17 13.907 18.304 -2.225
142 HD2 HIS 17 HD2 HIS 17 15.581 17.019 -5.856
143 HE1 HIS 17 HE1 HIS 17 16.362 18.916 -2.129
144 HB2 HIS 17 HB2 HIS 17 12.286 16.865 -3.930
145 HB3 HIS 17 HB3 HIS 17 13.120 16.223 -5.343
146 H VAL 18 HN VAL 18 12.659 16.850 -7.805
147 HA VAL 18 HA VAL 18 9.965 15.750 -7.825
148 HB VAL 18 HB VAL 18 11.072 16.699 -10.463
149 HG11 VAL 18 HG11 VAL 18 8.833 16.407 -11.248
150 HG12 VAL 18 HG12 VAL 18 9.140 15.013 -10.230
151 HG13 VAL 18 HG13 VAL 18 8.167 16.345 -9.601
152 HG21 VAL 18 HG21 VAL 18 9.225 18.399 -8.740
153 HG22 VAL 18 HG22 VAL 18 10.883 18.810 -9.205
154 HG23 VAL 18 HG23 VAL 18 9.628 18.705 -10.435
155 H LEU 19 HN LEU 19 9.992 13.711 -8.626
156 HA LEU 19 HA LEU 19 12.557 12.593 -9.575
157 HG LEU 19 HG LEU 19 10.631 12.414 -6.215
158 HB2 LEU 19 HB2 LEU 19 11.498 10.663 -7.791
159 HB3 LEU 19 HB3 LEU 19 13.057 11.458 -7.790
160 HD11 LEU 19 HD11 LEU 19 11.470 10.261 -5.505
161 HD12 LEU 19 HD12 LEU 19 13.113 10.921 -5.342
162 HD13 LEU 19 HD13 LEU 19 11.796 11.503 -4.293
163 HD21 LEU 19 HD21 LEU 19 12.755 13.534 -4.949
164 HD22 LEU 19 HD22 LEU 19 13.465 13.460 -6.581
165 HD23 LEU 19 HD23 LEU 19 11.956 14.355 -6.270
166 H MET 20 HN MET 20 12.248 10.264 -10.238
167 HA MET 20 HA MET 20 9.636 10.023 -11.657
168 HB2 MET 20 HB2 MET 20 11.662 10.236 -13.108
169 HB3 MET 20 HB3 MET 20 12.297 8.750 -12.375
170 HG2 MET 20 HG2 MET 20 10.306 7.519 -13.200
171 HG3 MET 20 HG3 MET 20 9.643 9.020 -13.839
172 HE1 MET 20 HE1 MET 20 13.385 7.634 -14.002
173 HE2 MET 20 HE2 MET 20 12.343 6.223 -14.226
174 HE3 MET 20 HE3 MET 20 13.336 6.814 -15.578
175 H LEU 21 HN LEU 21 8.480 9.018 -10.156
176 HA LEU 21 HA LEU 21 9.655 7.150 -8.206
177 HG LEU 21 HG LEU 21 8.063 6.706 -6.339
178 HB2 LEU 21 HB2 LEU 21 8.194 9.023 -7.536
179 HB3 LEU 21 HB3 LEU 21 6.887 8.416 -8.554
180 HD11 LEU 21 HD11 LEU 21 5.798 8.739 -6.055
181 HD12 LEU 21 HD12 LEU 21 6.364 7.609 -4.803
182 HD13 LEU 21 HD13 LEU 21 7.421 8.914 -5.362
183 HD21 LEU 21 HD21 LEU 21 5.660 5.857 -6.308
184 HD22 LEU 21 HD22 LEU 21 5.332 6.868 -7.729
185 HD23 LEU 21 HD23 LEU 21 6.495 5.536 -7.828
186 H CYS 22 HN CYS 22 9.550 4.999 -8.641
187 HA CYS 22 HA CYS 22 7.714 4.028 -10.783
188 HG CYS 22 HG CYS 22 10.688 5.778 -10.851
189 HB2 CYS 22 HB2 CYS 22 10.629 3.280 -10.266
190 HB3 CYS 22 HB3 CYS 22 9.613 2.739 -11.611
191 H ASP 23 HN ASP 23 7.575 1.614 -10.751
192 HA ASP 23 HA ASP 23 6.893 0.409 -8.237
193 HB2 ASP 23 HB2 ASP 23 6.060 -0.738 -10.082
194 HB3 ASP 23 HB3 ASP 23 7.503 -0.458 -11.048
195 H ALA 24 HN ALA 24 8.162 -0.993 -6.870
196 HA ALA 24 HA ALA 24 10.981 -0.472 -6.641
197 HB1 ALA 24 HB1 ALA 24 9.195 -2.534 -5.300
198 HB2 ALA 24 HB2 ALA 24 10.889 -2.205 -4.873
199 HB3 ALA 24 HB3 ALA 24 9.671 -0.940 -4.666
200 H GLY 25 HN GLY 25 11.506 -0.939 -8.876
201 HA2 GLY 25 HA2 GLY 25 12.944 -3.133 -9.622
202 HA3 GLY 25 HA3 GLY 25 11.261 -3.640 -9.907
203 H GLY 26 HN GLY 26 10.734 -0.611 -10.419
204 HA2 GLY 26 HA2 GLY 26 10.912 0.955 -12.084
205 HA3 GLY 26 HA3 GLY 26 12.102 -0.041 -12.927
206 H ALA 27 HN ALA 27 9.250 -1.893 -12.193
207 HA ALA 27 HA ALA 27 8.852 -2.302 -14.996
208 HB1 ALA 27 HB1 ALA 27 7.094 -3.147 -12.652
209 HB2 ALA 27 HB2 ALA 27 7.086 -3.842 -14.284
210 HB3 ALA 27 HB3 ALA 27 8.515 -4.038 -13.252
211 H ILE 28 HN ILE 28 7.490 0.072 -12.903
212 HA ILE 28 HA ILE 28 5.567 1.003 -14.927
213 HB ILE 28 HB ILE 28 4.911 0.605 -11.961
214 HG12 ILE 28 HG12 ILE 28 3.737 -0.790 -14.409
215 HG13 ILE 28 HG13 ILE 28 4.755 -1.528 -13.168
216 HG21 ILE 28 HG21 ILE 28 3.922 2.699 -12.866
217 HG22 ILE 28 HG22 ILE 28 3.166 1.771 -14.183
218 HG23 ILE 28 HG23 ILE 28 2.683 1.533 -12.489
219 HD11 ILE 28 HD11 ILE 28 1.912 -0.549 -12.808
220 HD12 ILE 28 HD12 ILE 28 2.532 -2.201 -12.717
221 HD13 ILE 28 HD13 ILE 28 2.982 -1.027 -11.462
222 H LYS 29 HN LYS 29 5.482 3.374 -14.769
223 HA LYS 29 HA LYS 29 7.389 4.594 -12.845
224 HB2 LYS 29 HB2 LYS 29 7.516 5.019 -15.861
225 HB3 LYS 29 HB3 LYS 29 8.444 5.871 -14.624
226 HG2 LYS 29 HG2 LYS 29 9.272 3.480 -13.918
227 HG3 LYS 29 HG3 LYS 29 8.684 2.964 -15.493
228 HD2 LYS 29 HD2 LYS 29 10.233 4.417 -16.642
229 HD3 LYS 29 HD3 LYS 29 10.563 5.324 -15.172
230 HE2 LYS 29 HE2 LYS 29 12.481 3.964 -15.597
231 HE3 LYS 29 HE3 LYS 29 11.694 3.362 -14.151
232 HZ1 LYS 29 HZ1 LYS 29 12.373 1.597 -15.739
233 HZ2 LYS 29 HZ2 LYS 29 10.768 1.536 -15.466
234 HZ3 LYS 29 HZ3 LYS 29 11.352 2.173 -16.864
235 H MET 30 HN MET 30 6.987 6.685 -12.325
236 HA MET 30 HA MET 30 4.689 8.173 -13.436
237 HB2 MET 30 HB2 MET 30 5.135 7.418 -10.501
238 HB3 MET 30 HB3 MET 30 4.004 8.623 -11.058
239 HG2 MET 30 HG2 MET 30 2.808 6.866 -12.383
240 HG3 MET 30 HG3 MET 30 3.925 5.665 -11.733
241 HE1 MET 30 HE1 MET 30 0.654 7.882 -9.301
242 HE2 MET 30 HE2 MET 30 2.090 8.749 -9.876
243 HE3 MET 30 HE3 MET 30 0.937 8.065 -11.047
244 H ILE 31 HN ILE 31 4.765 10.412 -12.316
245 HA ILE 31 HA ILE 31 7.564 11.305 -11.776
246 HB ILE 31 HB ILE 31 5.282 12.869 -12.974
247 HG12 ILE 31 HG12 ILE 31 7.955 12.477 -14.371
248 HG13 ILE 31 HG13 ILE 31 6.798 11.155 -14.422
249 HG21 ILE 31 HG21 ILE 31 7.145 14.641 -13.255
250 HG22 ILE 31 HG22 ILE 31 6.546 14.396 -11.615
251 HG23 ILE 31 HG23 ILE 31 8.089 13.672 -12.113
252 HD11 ILE 31 HD11 ILE 31 5.044 12.636 -15.260
253 HD12 ILE 31 HD12 ILE 31 6.192 13.992 -15.268
254 HD13 ILE 31 HD13 ILE 31 6.457 12.590 -16.331
255 H ALA 32 HN ALA 32 7.715 12.354 -9.712
256 HA ALA 32 HA ALA 32 5.186 12.966 -8.290
257 HB1 ALA 32 HB1 ALA 32 6.069 11.943 -6.232
258 HB2 ALA 32 HB2 ALA 32 5.872 10.726 -7.510
259 HB3 ALA 32 HB3 ALA 32 7.493 11.354 -7.114
260 H GLU 33 HN GLU 33 5.306 14.889 -7.329
261 HA GLU 33 HA GLU 33 7.898 16.341 -7.209
262 HB2 GLU 33 HB2 GLU 33 5.947 17.440 -8.395
263 HB3 GLU 33 HB3 GLU 33 5.025 17.360 -6.879
264 HG2 GLU 33 HG2 GLU 33 6.731 18.760 -5.768
265 HG3 GLU 33 HG3 GLU 33 7.655 18.844 -7.257
266 H VAL 34 HN VAL 34 8.701 16.825 -5.164
267 HA VAL 34 HA VAL 34 7.095 16.134 -2.800
268 HB VAL 34 HB VAL 34 8.757 14.628 -1.923
269 HG11 VAL 34 HG11 VAL 34 7.006 13.621 -3.419
270 HG12 VAL 34 HG12 VAL 34 8.185 13.640 -4.743
271 HG13 VAL 34 HG13 VAL 34 8.492 12.672 -3.290
272 HG21 VAL 34 HG21 VAL 34 10.333 15.041 -4.494
273 HG22 VAL 34 HG22 VAL 34 10.826 15.472 -2.836
274 HG23 VAL 34 HG23 VAL 34 10.665 13.777 -3.291
275 H LYS 35 HN LYS 35 8.226 16.789 -0.820
276 HA LYS 35 HA LYS 35 10.266 18.922 -1.202
277 HB2 LYS 35 HB2 LYS 35 7.716 19.248 -0.029
278 HB3 LYS 35 HB3 LYS 35 8.768 18.987 1.360
279 HG2 LYS 35 HG2 LYS 35 10.210 20.808 0.701
280 HG3 LYS 35 HG3 LYS 35 9.400 20.975 -0.866
281 HD2 LYS 35 HD2 LYS 35 7.279 21.596 0.313
282 HD3 LYS 35 HD3 LYS 35 8.150 21.535 1.863
283 HE2 LYS 35 HE2 LYS 35 9.684 23.312 1.078
284 HE3 LYS 35 HE3 LYS 35 8.875 23.337 -0.497
285 HZ1 LYS 35 HZ1 LYS 35 6.860 24.100 0.626
286 HZ2 LYS 35 HZ2 LYS 35 7.608 24.073 2.081
287 HZ3 LYS 35 HZ3 LYS 35 8.094 25.115 0.932
288 H SER 36 HN SER 36 11.760 18.932 0.832
289 HA SER 36 HA SER 36 12.151 16.152 1.822
290 HG SER 36 HG SER 36 14.858 18.313 0.146
291 HB2 SER 36 HB2 SER 36 14.485 16.314 0.822
292 HB3 SER 36 HB3 SER 36 13.173 16.170 -0.352
293 H ASP 37 HN ASP 37 13.482 15.965 3.587
294 HA ASP 37 HA ASP 37 14.809 18.432 4.630
295 HB2 ASP 37 HB2 ASP 37 12.773 17.819 5.935
296 HB3 ASP 37 HB3 ASP 37 13.490 16.246 6.276
297 H PHE 38 HN PHE 38 15.397 15.671 3.090
298 HA PHE 38 HA PHE 38 18.083 15.254 4.175
299 HD1 PHE 38 HD2 PHE 38 14.367 13.795 5.190
300 HD2 PHE 38 HD1 PHE 38 18.382 13.028 6.568
301 HE1 PHE 38 HE2 PHE 38 13.554 13.766 7.530
302 HE2 PHE 38 HE1 PHE 38 17.564 13.001 8.912
303 HZ PHE 38 HZ PHE 38 15.150 13.363 9.398
304 HB2 PHE 38 HB2 PHE 38 16.153 12.954 3.660
305 HB3 PHE 38 HB3 PHE 38 17.814 12.820 4.197
306 H ALA 39 HN ALA 39 19.393 14.156 2.455
307 HA ALA 39 HA ALA 39 18.749 14.997 -0.188
308 HB1 ALA 39 HB1 ALA 39 20.734 13.668 -0.833
309 HB2 ALA 39 HB2 ALA 39 21.070 14.669 0.592
310 HB3 ALA 39 HB3 ALA 39 20.771 12.923 0.777
311 H VAL 40 HN VAL 40 18.099 13.766 -2.015
312 HA VAL 40 HA VAL 40 17.383 10.950 -1.720
313 HB VAL 40 HB VAL 40 15.336 12.030 -1.016
314 HG11 VAL 40 HG11 VAL 40 14.013 13.528 -2.444
315 HG12 VAL 40 HG12 VAL 40 15.551 14.272 -2.003
316 HG13 VAL 40 HG13 VAL 40 15.327 13.594 -3.632
317 HG21 VAL 40 HG21 VAL 40 14.994 11.048 -3.872
318 HG22 VAL 40 HG22 VAL 40 15.193 10.007 -2.451
319 HG23 VAL 40 HG23 VAL 40 13.774 11.056 -2.581
320 H LYS 41 HN LYS 41 17.656 9.879 -3.689
321 HA LYS 41 HA LYS 41 18.277 11.324 -6.145
322 HB2 LYS 41 HB2 LYS 41 20.662 10.372 -6.167
323 HB3 LYS 41 HB3 LYS 41 20.331 11.819 -5.248
324 HG2 LYS 41 HG2 LYS 41 21.843 10.416 -4.016
325 HG3 LYS 41 HG3 LYS 41 20.328 10.572 -3.140
326 HD2 LYS 41 HD2 LYS 41 19.661 8.296 -4.112
327 HD3 LYS 41 HD3 LYS 41 21.287 8.196 -4.788
328 HE2 LYS 41 HE2 LYS 41 21.274 6.955 -2.740
329 HE3 LYS 41 HE3 LYS 41 22.205 8.431 -2.444
330 HZ1 LYS 41 HZ1 LYS 41 20.220 9.355 -1.367
331 HZ2 LYS 41 HZ2 LYS 41 19.357 7.999 -1.707
332 HZ3 LYS 41 HZ3 LYS 41 20.623 7.934 -0.658
333 H VAL 42 HN VAL 42 19.191 9.705 -7.787
334 HA VAL 42 HA VAL 42 17.379 7.659 -8.188
335 HB VAL 42 HB VAL 42 20.221 7.918 -9.274
336 HG11 VAL 42 HG11 VAL 42 17.811 6.298 -10.197
337 HG12 VAL 42 HG12 VAL 42 19.179 6.691 -11.273
338 HG13 VAL 42 HG13 VAL 42 19.445 5.704 -9.838
339 HG21 VAL 42 HG21 VAL 42 18.830 8.955 -11.224
340 HG22 VAL 42 HG22 VAL 42 17.538 9.098 -9.990
341 HG23 VAL 42 HG23 VAL 42 19.089 9.933 -9.781
342 H GLY 43 HN GLY 43 17.352 5.460 -8.043
343 HA2 GLY 43 HA2 GLY 43 17.792 3.371 -7.274
344 HA3 GLY 43 HA3 GLY 43 19.422 3.873 -6.770
345 H ASP 44 HN ASP 44 16.343 5.527 -5.824
346 HA ASP 44 HA ASP 44 17.042 4.721 -2.971
347 HB2 ASP 44 HB2 ASP 44 15.783 7.303 -3.931
348 HB3 ASP 44 HB3 ASP 44 15.406 6.609 -2.359
349 H LEU 45 HN LEU 45 15.446 3.778 -1.709
350 HA LEU 45 HA LEU 45 13.016 2.918 -3.139
351 HG LEU 45 HG LEU 45 11.357 1.869 -1.242
352 HB2 LEU 45 HB2 LEU 45 14.379 1.519 -1.388
353 HB3 LEU 45 HB3 LEU 45 13.674 2.608 -0.196
354 HD11 LEU 45 HD11 LEU 45 11.360 -0.395 -2.173
355 HD12 LEU 45 HD12 LEU 45 12.333 0.670 -3.193
356 HD13 LEU 45 HD13 LEU 45 13.133 -0.463 -2.086
357 HD21 LEU 45 HD21 LEU 45 11.291 -0.048 0.300
358 HD22 LEU 45 HD22 LEU 45 13.063 0.029 0.472
359 HD23 LEU 45 HD23 LEU 45 12.036 1.384 1.019
360 H LEU 46 HN LEU 46 10.917 3.607 -2.438
361 HA LEU 46 HA LEU 46 10.734 5.714 -0.363
362 HG LEU 46 HG LEU 46 11.309 6.666 -3.341
363 HB2 LEU 46 HB2 LEU 46 9.124 5.668 -2.944
364 HB3 LEU 46 HB3 LEU 46 8.855 6.751 -1.588
365 HD11 LEU 46 HD11 LEU 46 8.951 8.609 -3.229
366 HD12 LEU 46 HD12 LEU 46 10.426 8.920 -4.149
367 HD13 LEU 46 HD13 LEU 46 9.408 7.539 -4.574
368 HD21 LEU 46 HD21 LEU 46 11.902 7.509 -1.112
369 HD22 LEU 46 HD22 LEU 46 11.865 8.878 -2.229
370 HD23 LEU 46 HD23 LEU 46 10.510 8.591 -1.102
371 H SER 47 HN SER 47 9.411 5.016 1.168
372 HA SER 47 HA SER 47 7.254 3.054 0.503
373 HG SER 47 HG SER 47 9.737 1.032 2.047
374 HB2 SER 47 HB2 SER 47 9.017 3.001 2.982
375 HB3 SER 47 HB3 SER 47 7.691 1.886 2.598
376 HA PRO 48 HA PRO 48 4.976 6.322 2.375
377 HB2 PRO 48 HB2 PRO 48 2.553 5.128 2.941
378 HB3 PRO 48 HB3 PRO 48 3.095 5.532 1.290
379 HG2 PRO 48 HG2 PRO 48 3.277 2.863 2.710
380 HG3 PRO 48 HG3 PRO 48 2.711 3.196 1.041
381 HD2 PRO 48 HD2 PRO 48 5.244 2.335 1.561
382 HD3 PRO 48 HD3 PRO 48 4.916 3.523 0.263
383 H LEU 49 HN LEU 49 4.378 7.196 4.254
384 HA LEU 49 HA LEU 49 4.393 5.570 6.776
385 HG LEU 49 HG LEU 49 7.005 6.642 5.742
386 HB2 LEU 49 HB2 LEU 49 5.287 8.441 6.262
387 HB3 LEU 49 HB3 LEU 49 5.107 7.739 7.866
388 HD11 LEU 49 HD11 LEU 49 7.643 8.924 6.340
389 HD12 LEU 49 HD12 LEU 49 7.586 8.518 8.070
390 HD13 LEU 49 HD13 LEU 49 8.796 7.759 7.009
391 HD21 LEU 49 HD21 LEU 49 8.075 5.536 7.730
392 HD22 LEU 49 HD22 LEU 49 6.748 6.127 8.749
393 HD23 LEU 49 HD23 LEU 49 6.433 4.964 7.439
394 H GLN 50 HN GLN 50 3.094 8.263 4.878
395 HA GLN 50 HA GLN 50 0.394 7.658 5.620
396 HB2 GLN 50 HB2 GLN 50 -0.165 10.043 6.248
397 HB3 GLN 50 HB3 GLN 50 0.708 9.142 7.479
398 HG2 GLN 50 HG2 GLN 50 2.761 10.301 7.039
399 HG3 GLN 50 HG3 GLN 50 2.127 10.998 5.545
400 HE21 GLN 50 HE22 GLN 50 2.247 13.197 5.988
401 HE22 GLN 50 HE21 GLN 50 1.422 13.959 7.323
402 H ASN 51 HN ASN 51 -0.978 9.425 4.231
403 HA ASN 51 HA ASN 51 -0.413 8.987 1.560
404 HB2 ASN 51 HB2 ASN 51 -2.599 9.728 2.350
405 HB3 ASN 51 HB3 ASN 51 -1.944 11.296 2.830
406 HD21 ASN 51 HD22 ASN 51 -1.751 12.945 1.233
407 HD22 ASN 51 HD21 ASN 51 -2.175 12.693 -0.436
408 H ALA 52 HN ALA 52 0.853 11.662 3.537
409 HA ALA 52 HA ALA 52 2.072 12.869 1.167
410 HB1 ALA 52 HB1 ALA 52 1.205 14.168 3.772
411 HB2 ALA 52 HB2 ALA 52 1.889 14.992 2.356
412 HB3 ALA 52 HB3 ALA 52 0.308 14.207 2.235
413 H LEU 53 HN LEU 53 3.218 10.749 3.389
414 HA LEU 53 HA LEU 53 5.828 12.058 3.321
415 HG LEU 53 HG LEU 53 4.636 13.458 5.553
416 HB2 LEU 53 HB2 LEU 53 4.634 10.884 5.849
417 HB3 LEU 53 HB3 LEU 53 6.364 10.953 5.588
418 HD11 LEU 53 HD11 LEU 53 5.414 13.834 7.864
419 HD12 LEU 53 HD12 LEU 53 4.457 12.352 7.758
420 HD13 LEU 53 HD13 LEU 53 6.227 12.253 7.863
421 HD21 LEU 53 HD21 LEU 53 7.648 13.047 5.936
422 HD22 LEU 53 HD22 LEU 53 6.876 13.669 4.471
423 HD23 LEU 53 HD23 LEU 53 6.791 14.603 5.963
424 H TYR 54 HN TYR 54 7.364 10.682 2.702
425 HA TYR 54 HA TYR 54 6.873 7.764 2.917
426 HD1 TYR 54 HD2 TYR 54 4.910 9.655 0.927
427 HD2 TYR 54 HD1 TYR 54 6.882 6.102 -0.514
428 HE1 TYR 54 HE2 TYR 54 2.802 8.912 -0.091
429 HE2 TYR 54 HE1 TYR 54 4.783 5.372 -1.577
430 HH TYR 54 HH TYR 54 2.533 5.865 -1.977
431 HB2 TYR 54 HB2 TYR 54 7.666 9.326 0.433
432 HB3 TYR 54 HB3 TYR 54 8.140 7.659 0.663
433 H CYS 55 HN CYS 55 8.671 6.650 3.362
434 HA CYS 55 HA CYS 55 11.016 7.776 4.547
435 HG CYS 55 HG CYS 55 8.512 5.102 4.290
436 HB2 CYS 55 HB2 CYS 55 10.855 5.031 3.244
437 HB3 CYS 55 HB3 CYS 55 11.788 5.527 4.654
438 H ILE 56 HN ILE 56 13.253 7.584 3.643
439 HA ILE 56 HA ILE 56 13.410 7.366 0.663
440 HB ILE 56 HB ILE 56 15.257 8.882 2.539
441 HG12 ILE 56 HG12 ILE 56 13.481 10.270 0.499
442 HG13 ILE 56 HG13 ILE 56 12.881 9.946 2.126
443 HG21 ILE 56 HG21 ILE 56 15.202 8.662 -0.507
444 HG22 ILE 56 HG22 ILE 56 16.161 9.870 0.354
445 HG23 ILE 56 HG23 ILE 56 16.528 8.180 0.568
446 HD11 ILE 56 HD11 ILE 56 13.838 12.173 2.066
447 HD12 ILE 56 HD12 ILE 56 14.776 11.123 3.124
448 HD13 ILE 56 HD13 ILE 56 15.388 11.552 1.512
449 H ASN 57 HN ASN 57 15.075 6.191 -0.136
450 HA ASN 57 HA ASN 57 16.835 4.889 -0.424
451 HB2 ASN 57 HB2 ASN 57 18.033 6.522 1.060
452 HB3 ASN 57 HB3 ASN 57 17.698 5.483 2.449
453 HD21 ASN 57 HD22 ASN 57 19.016 5.451 -0.854
454 HD22 ASN 57 HD21 ASN 57 20.264 4.234 -0.581
455 H ARG 58 HN ARG 58 16.178 4.166 2.978
456 HA ARG 58 HA ARG 58 15.291 1.470 2.542
457 HE ARG 58 HE ARG 58 19.919 -1.212 0.769
458 HB2 ARG 58 HB2 ARG 58 18.065 2.028 3.724
459 HB3 ARG 58 HB3 ARG 58 17.237 0.484 3.869
460 HG2 ARG 58 HG2 ARG 58 17.354 0.129 1.439
461 HG3 ARG 58 HG3 ARG 58 18.215 1.670 1.252
462 HD2 ARG 58 HD2 ARG 58 19.974 0.857 2.837
463 HD3 ARG 58 HD3 ARG 58 19.161 -0.707 2.880
464 HH11 ARG 58 HH11 ARG 58 20.607 2.252 1.338
465 HH12 ARG 58 HH12 ARG 58 21.929 2.285 0.222
466 HH21 ARG 58 HH21 ARG 58 21.534 -1.069 -0.847
467 HH22 ARG 58 HH22 ARG 58 22.360 0.412 -1.144
468 H GLU 59 HN GLU 59 15.301 4.354 4.381
469 HA GLU 59 HA GLU 59 14.710 2.898 6.885
470 HB2 GLU 59 HB2 GLU 59 16.248 4.225 8.155
471 HB3 GLU 59 HB3 GLU 59 17.103 3.350 6.887
472 HG2 GLU 59 HG2 GLU 59 16.899 5.596 5.523
473 HG3 GLU 59 HG3 GLU 59 16.555 6.326 7.090
474 H LYS 60 HN LYS 60 13.375 3.867 8.244
475 HA LYS 60 HA LYS 60 11.425 5.501 6.988
476 HB2 LYS 60 HB2 LYS 60 11.658 4.675 9.911
477 HB3 LYS 60 HB3 LYS 60 10.226 5.386 9.157
478 HG2 LYS 60 HG2 LYS 60 10.151 3.450 7.551
479 HG3 LYS 60 HG3 LYS 60 11.462 2.686 8.453
480 HD2 LYS 60 HD2 LYS 60 8.727 3.436 9.578
481 HD3 LYS 60 HD3 LYS 60 9.224 1.818 9.061
482 HE2 LYS 60 HE2 LYS 60 11.033 1.828 10.779
483 HE3 LYS 60 HE3 LYS 60 10.497 3.422 11.327
484 HZ1 LYS 60 HZ1 LYS 60 9.585 1.665 12.698
485 HZ2 LYS 60 HZ2 LYS 60 8.367 2.424 11.929
486 HZ3 LYS 60 HZ3 LYS 60 8.867 0.949 11.425
487 H LEU 61 HN LEU 61 13.992 6.347 9.248
488 HA LEU 61 HA LEU 61 12.762 8.722 10.169
489 HG LEU 61 HG LEU 61 16.210 7.970 9.195
490 HB2 LEU 61 HB2 LEU 61 14.895 9.347 11.099
491 HB3 LEU 61 HB3 LEU 61 14.395 7.733 11.568
492 HD11 LEU 61 HD11 LEU 61 17.203 8.357 12.052
493 HD12 LEU 61 HD12 LEU 61 18.226 8.130 10.615
494 HD13 LEU 61 HD13 LEU 61 17.227 9.579 10.763
495 HD21 LEU 61 HD21 LEU 61 17.225 5.932 10.170
496 HD22 LEU 61 HD22 LEU 61 16.170 6.074 11.588
497 HD23 LEU 61 HD23 LEU 61 15.483 5.725 9.992
498 H HIS 62 HN HIS 62 14.642 8.108 7.297
499 HA HIS 62 HA HIS 62 15.047 10.995 6.749
500 HD1 HIS 62 HD1 HIS 62 18.582 8.452 4.814
501 HD2 HIS 62 HD2 HIS 62 16.915 10.305 8.206
502 HE1 HIS 62 HE1 HIS 62 20.454 8.640 6.523
503 HB2 HIS 62 HB2 HIS 62 15.732 8.496 5.139
504 HB3 HIS 62 HB3 HIS 62 16.117 10.152 4.680
505 H THR 63 HN THR 63 13.248 12.072 5.875
506 HA THR 63 HA THR 63 11.335 10.480 4.271
507 HB THR 63 HB THR 63 9.662 12.005 5.398
508 HG1 THR 63 HG1 THR 63 10.358 13.100 7.226
509 HG21 THR 63 HG21 THR 63 10.163 9.647 6.144
510 HG22 THR 63 HG22 THR 63 11.311 10.320 7.320
511 HG23 THR 63 HG23 THR 63 9.580 10.707 7.442
512 H VAL 64 HN VAL 64 10.108 11.458 2.730
513 HA VAL 64 HA VAL 64 10.747 14.245 1.906
514 HB VAL 64 HB VAL 64 9.734 13.354 -0.337
515 HG11 VAL 64 HG11 VAL 64 11.938 14.311 -0.118
516 HG12 VAL 64 HG12 VAL 64 12.610 12.739 0.367
517 HG13 VAL 64 HG13 VAL 64 11.944 12.960 -1.262
518 HG21 VAL 64 HG21 VAL 64 10.963 10.732 0.586
519 HG22 VAL 64 HG22 VAL 64 9.226 11.058 0.405
520 HG23 VAL 64 HG23 VAL 64 10.285 11.110 -1.010
521 H LYS 65 HN LYS 65 8.879 15.445 1.338
522 HA LYS 65 HA LYS 65 6.346 14.320 2.459
523 HB2 LYS 65 HB2 LYS 65 7.319 16.513 3.392
524 HB3 LYS 65 HB3 LYS 65 6.893 17.237 1.828
525 HG2 LYS 65 HG2 LYS 65 4.506 16.550 2.210
526 HG3 LYS 65 HG3 LYS 65 4.992 15.826 3.750
527 HD2 LYS 65 HD2 LYS 65 3.970 17.903 4.231
528 HD3 LYS 65 HD3 LYS 65 5.697 18.049 4.587
529 HE2 LYS 65 HE2 LYS 65 6.043 19.248 2.441
530 HE3 LYS 65 HE3 LYS 65 4.334 19.026 2.031
531 HZ1 LYS 65 HZ1 LYS 65 4.729 21.224 2.951
532 HZ2 LYS 65 HZ2 LYS 65 3.763 20.391 3.959
533 HZ3 LYS 65 HZ3 LYS 65 5.339 20.607 4.332
534 H VAL 66 HN VAL 66 4.704 13.869 0.935
535 HA VAL 66 HA VAL 66 5.544 14.283 -1.890
536 HB VAL 66 HB VAL 66 3.209 12.698 -0.761
537 HG11 VAL 66 HG11 VAL 66 3.081 11.734 -3.063
538 HG12 VAL 66 HG12 VAL 66 2.693 13.453 -3.054
539 HG13 VAL 66 HG13 VAL 66 4.289 12.912 -3.619
540 HG21 VAL 66 HG21 VAL 66 5.393 11.676 -0.216
541 HG22 VAL 66 HG22 VAL 66 4.583 10.744 -1.482
542 HG23 VAL 66 HG23 VAL 66 5.912 11.836 -1.905
543 H LEU 67 HN LEU 67 4.499 15.630 -3.313
544 HA LEU 67 HA LEU 67 2.541 17.544 -2.099
545 HG LEU 67 HG LEU 67 5.696 17.781 -1.951
546 HB2 LEU 67 HB2 LEU 67 4.662 18.011 -4.227
547 HB3 LEU 67 HB3 LEU 67 3.554 19.216 -3.588
548 HD11 LEU 67 HD11 LEU 67 5.626 20.575 -3.143
549 HD12 LEU 67 HD12 LEU 67 6.876 19.960 -2.035
550 HD13 LEU 67 HD13 LEU 67 6.680 19.232 -3.631
551 HD21 LEU 67 HD21 LEU 67 3.884 20.127 -1.233
552 HD22 LEU 67 HD22 LEU 67 3.849 18.503 -0.507
553 HD23 LEU 67 HD23 LEU 67 5.253 19.546 -0.260
554 H SER 68 HN SER 68 3.457 15.739 -5.079
555 HA SER 68 HA SER 68 0.715 15.369 -5.836
556 HG SER 68 HG SER 68 0.768 17.851 -5.738
557 HB2 SER 68 HB2 SER 68 2.470 17.261 -7.488
558 HB3 SER 68 HB3 SER 68 1.032 16.455 -8.132
559 H ALA 69 HN ALA 69 0.663 13.836 -7.725
560 HA ALA 69 HA ALA 69 3.155 13.117 -8.965
561 HB1 ALA 69 HB1 ALA 69 1.688 11.003 -7.313
562 HB2 ALA 69 HB2 ALA 69 3.055 10.705 -8.414
563 HB3 ALA 69 HB3 ALA 69 3.300 11.673 -6.952
564 H SER 70 HN SER 70 2.819 11.778 -10.820
565 HA SER 70 HA SER 70 0.055 11.355 -11.801
566 HG SER 70 HG SER 70 -0.327 13.911 -11.936
567 HB2 SER 70 HB2 SER 70 2.074 13.128 -13.255
568 HB3 SER 70 HB3 SER 70 0.424 12.757 -13.773
569 H SER 71 HN SER 71 0.075 10.075 -13.845
570 HA SER 71 HA SER 71 2.061 8.093 -14.125
571 HG SER 71 HG SER 71 -1.234 7.637 -15.515
572 HB2 SER 71 HB2 SER 71 0.240 9.227 -16.287
573 HB3 SER 71 HB3 SER 71 0.953 7.604 -16.225
574 H TYR 72 HN TYR 72 3.850 7.896 -15.605
575 HA TYR 72 HA TYR 72 5.321 10.328 -15.908
576 HD1 TYR 72 HD1 TYR 72 8.259 9.865 -15.534
577 HD2 TYR 72 HD2 TYR 72 6.747 8.273 -19.249
578 HE1 TYR 72 HE1 TYR 72 10.167 10.870 -16.735
579 HE2 TYR 72 HE2 TYR 72 8.655 9.272 -20.459
580 HH TYR 72 HH TYR 72 10.624 10.515 -20.284
581 HB2 TYR 72 HB2 TYR 72 6.440 8.184 -15.565
582 HB3 TYR 72 HB3 TYR 72 5.796 7.568 -17.089
583 H SER 73 HN SER 73 5.735 11.612 -17.683
584 HA SER 73 HA SER 73 5.193 10.715 -20.353
585 HG SER 73 HG SER 73 2.962 10.632 -19.442
586 HB2 SER 73 HB2 SER 73 3.642 13.028 -19.122
587 HB3 SER 73 HB3 SER 73 3.854 12.852 -20.878
588 HA PRO 74 HA PRO 74 8.992 12.788 -20.384
589 HB2 PRO 74 HB2 PRO 74 9.295 13.598 -23.044
590 HB3 PRO 74 HB3 PRO 74 9.556 11.940 -22.418
591 HG2 PRO 74 HG2 PRO 74 7.121 13.089 -23.790
592 HG3 PRO 74 HG3 PRO 74 7.876 11.481 -24.020
593 HD2 PRO 74 HD2 PRO 74 5.658 11.819 -22.484
594 HD3 PRO 74 HD3 PRO 74 6.934 10.653 -22.021
595 H ASP 75 HN ASP 75 6.694 14.740 -22.372
596 HA ASP 75 HA ASP 75 7.884 17.256 -21.916
597 HB2 ASP 75 HB2 ASP 75 6.199 16.939 -23.626
598 HB3 ASP 75 HB3 ASP 75 4.992 16.470 -22.425
599 H GLU 76 HN GLU 76 5.454 15.484 -20.013
600 HA GLU 76 HA GLU 76 4.893 17.591 -18.176
601 HB2 GLU 76 HB2 GLU 76 3.577 15.384 -18.821
602 HB3 GLU 76 HB3 GLU 76 4.607 14.606 -17.635
603 HG2 GLU 76 HG2 GLU 76 2.546 15.107 -16.563
604 HG3 GLU 76 HG3 GLU 76 3.749 16.209 -15.905
605 H TRP 77 HN TRP 77 7.222 14.892 -18.168
606 HA TRP 77 HA TRP 77 8.227 15.303 -15.510
607 HD1 TRP 77 HD1 TRP 77 11.560 13.076 -18.171
608 HE1 TRP 77 HE1 TRP 77 13.593 12.752 -16.662
609 HE3 TRP 77 HE3 TRP 77 9.491 14.541 -13.731
610 HZ2 TRP 77 HZ2 TRP 77 14.217 13.008 -13.844
611 HZ3 TRP 77 HZ3 TRP 77 10.800 14.387 -11.636
612 HH2 TRP 77 HH2 TRP 77 13.165 13.641 -11.676
613 HB2 TRP 77 HB2 TRP 77 8.568 13.209 -16.682
614 HB3 TRP 77 HB3 TRP 77 9.309 14.014 -18.036
615 H GLU 78 HN GLU 78 9.408 16.372 -18.775
616 HA GLU 78 HA GLU 78 11.597 17.783 -17.692
617 HB2 GLU 78 HB2 GLU 78 10.163 17.992 -20.366
618 HB3 GLU 78 HB3 GLU 78 11.592 18.958 -19.975
619 HG2 GLU 78 HG2 GLU 78 12.887 16.892 -19.516
620 HG3 GLU 78 HG3 GLU 78 11.499 15.909 -19.969
621 H ARG 79 HN ARG 79 8.303 18.948 -18.342
622 HA ARG 79 HA ARG 79 8.860 21.675 -17.698
623 HE ARG 79 HE ARG 79 4.175 22.270 -18.276
624 HB2 ARG 79 HB2 ARG 79 6.510 19.829 -17.781
625 HB3 ARG 79 HB3 ARG 79 6.297 21.372 -16.932
626 HG2 ARG 79 HG2 ARG 79 6.769 22.676 -18.862
627 HG3 ARG 79 HG3 ARG 79 7.494 21.316 -19.728
628 HD2 ARG 79 HD2 ARG 79 5.229 21.975 -20.579
629 HD3 ARG 79 HD3 ARG 79 5.438 20.284 -20.118
630 HH11 ARG 79 HH11 ARG 79 3.773 19.282 -20.196
631 HH12 ARG 79 HH12 ARG 79 2.614 18.592 -19.080
632 HH21 ARG 79 HH21 ARG 79 2.645 21.306 -16.827
633 HH22 ARG 79 HH22 ARG 79 2.144 19.662 -17.075
634 H GLN 80 HN GLN 80 7.805 18.914 -15.573
635 HA GLN 80 HA GLN 80 7.847 20.505 -13.219
636 HB2 GLN 80 HB2 GLN 80 8.127 17.501 -13.621
637 HB3 GLN 80 HB3 GLN 80 8.027 18.291 -12.035
638 HG2 GLN 80 HG2 GLN 80 5.852 19.179 -12.467
639 HG3 GLN 80 HG3 GLN 80 5.905 18.682 -14.158
640 HE21 GLN 80 HE22 GLN 80 5.536 16.548 -14.738
641 HE22 GLN 80 HE21 GLN 80 4.809 15.394 -13.624
642 H CYS 81 HN CYS 81 10.510 18.855 -14.948
643 HA CYS 81 HA CYS 81 12.444 19.015 -12.883
644 HG CYS 81 HG CYS 81 11.438 17.051 -15.124
645 HB2 CYS 81 HB2 CYS 81 12.846 19.202 -15.905
646 HB3 CYS 81 HB3 CYS 81 14.124 18.953 -14.716
647 H LYS 82 HN LYS 82 11.462 21.539 -15.316
648 HA LYS 82 HA LYS 82 13.561 23.273 -14.350
649 HB2 LYS 82 HB2 LYS 82 12.502 25.035 -15.722
650 HB3 LYS 82 HB3 LYS 82 13.064 23.608 -16.606
651 HG2 LYS 82 HG2 LYS 82 10.764 22.824 -16.871
652 HG3 LYS 82 HG3 LYS 82 10.169 24.193 -15.898
653 HD2 LYS 82 HD2 LYS 82 11.147 25.755 -17.564
654 HD3 LYS 82 HD3 LYS 82 11.611 24.372 -18.575
655 HE2 LYS 82 HE2 LYS 82 9.256 23.746 -18.854
656 HE3 LYS 82 HE3 LYS 82 8.757 24.981 -17.683
657 HZ1 LYS 82 HZ1 LYS 82 9.643 26.670 -19.199
658 HZ2 LYS 82 HZ2 LYS 82 9.979 25.519 -20.324
659 HZ3 LYS 82 HZ3 LYS 82 8.430 25.808 -19.896
660 H VAL 83 HN VAL 83 10.027 22.959 -13.798
661 HA VAL 83 HA VAL 83 10.019 25.321 -12.204
662 HB VAL 83 HB VAL 83 7.889 23.167 -12.346
663 HG11 VAL 83 HG11 VAL 83 7.794 26.118 -11.536
664 HG12 VAL 83 HG12 VAL 83 6.355 25.111 -11.826
665 HG13 VAL 83 HG13 VAL 83 7.434 24.738 -10.490
666 HG21 VAL 83 HG21 VAL 83 8.348 24.006 -14.610
667 HG22 VAL 83 HG22 VAL 83 6.874 24.773 -14.051
668 HG23 VAL 83 HG23 VAL 83 8.415 25.664 -14.038
669 H ALA 84 HN ALA 84 11.274 22.250 -11.488
670 HA ALA 84 HA ALA 84 11.011 22.119 -8.678
671 HB1 ALA 84 HB1 ALA 84 13.006 20.780 -8.749
672 HB2 ALA 84 HB2 ALA 84 12.100 20.420 -10.233
673 HB3 ALA 84 HB3 ALA 84 13.516 21.491 -10.288
674 H GLY 85 HN GLY 85 12.688 24.573 -10.617
675 HA2 GLY 85 HA2 GLY 85 13.321 26.013 -8.195
676 HA3 GLY 85 HA3 GLY 85 14.758 25.245 -8.880
677 H LYS 86 HN LYS 86 13.503 25.917 -11.746
678 HA LYS 86 HA LYS 86 14.189 28.795 -11.609
679 HB2 LYS 86 HB2 LYS 86 15.366 26.763 -13.561
680 HB3 LYS 86 HB3 LYS 86 15.634 28.506 -13.651
681 HG2 LYS 86 HG2 LYS 86 16.702 28.454 -11.394
682 HG3 LYS 86 HG3 LYS 86 16.536 26.686 -11.381
683 HD2 LYS 86 HD2 LYS 86 17.916 26.533 -13.433
684 HD3 LYS 86 HD3 LYS 86 18.087 28.302 -13.450
685 HE2 LYS 86 HE2 LYS 86 19.173 28.211 -11.214
686 HE3 LYS 86 HE3 LYS 86 19.011 26.450 -11.204
687 HZ1 LYS 86 HZ1 LYS 86 20.618 28.003 -13.155
688 HZ2 LYS 86 HZ2 LYS 86 21.214 27.134 -11.914
689 HZ3 LYS 86 HZ3 LYS 86 20.469 26.373 -13.146
690 H THR 87 HN THR 87 11.942 26.866 -12.581
691 HA THR 87 HA THR 87 10.197 26.983 -14.169
692 HB THR 87 HB THR 87 10.187 29.658 -12.726
693 HG1 THR 87 HG1 THR 87 9.579 28.540 -10.948
694 HG21 THR 87 HG21 THR 87 7.882 27.763 -13.408
695 HG22 THR 87 HG22 THR 87 7.762 29.267 -12.479
696 HG23 THR 87 HG23 THR 87 8.189 29.323 -14.190
697 H GLN 88 HN GLN 88 12.199 27.244 -15.859
698 HA GLN 88 HA GLN 88 12.687 29.758 -16.992
699 HB2 GLN 88 HB2 GLN 88 13.032 27.006 -18.267
700 HB3 GLN 88 HB3 GLN 88 13.705 28.515 -18.879
701 HG2 GLN 88 HG2 GLN 88 14.995 28.801 -16.759
702 HG3 GLN 88 HG3 GLN 88 14.369 27.257 -16.179
703 HE21 GLN 88 HE22 GLN 88 15.558 25.407 -16.694
704 HE22 GLN 88 HE21 GLN 88 16.810 25.350 -17.905
Start of MODEL 11
1 HA MET 1 HA MET 1 3.565 -1.449 -2.307
2 H1 MET 1 H1 MET 1 1.509 -1.178 -1.117
3 H2 MET 1 H2 MET 1 2.798 -0.925 -0.130
4 H3 MET 1 H3 MET 1 1.930 0.349 -0.671
5 HB2 MET 1 HB2 MET 1 1.608 -0.627 -3.559
6 HB3 MET 1 HB3 MET 1 2.022 1.046 -3.159
7 HG2 MET 1 HG2 MET 1 4.091 0.892 -4.437
8 HG3 MET 1 HG3 MET 1 3.852 -0.842 -4.696
9 HE1 MET 1 HE1 MET 1 3.583 0.770 -8.262
10 HE2 MET 1 HE2 MET 1 4.625 1.260 -6.907
11 HE3 MET 1 HE3 MET 1 4.394 -0.465 -7.272
12 H GLU 2 HN GLU 2 5.648 -0.748 -2.779
13 HA GLU 2 HA GLU 2 6.578 1.801 -1.560
14 HB2 GLU 2 HB2 GLU 2 8.130 -0.818 -1.816
15 HB3 GLU 2 HB3 GLU 2 8.736 0.717 -1.207
16 HG2 GLU 2 HG2 GLU 2 8.322 -0.497 0.734
17 HG3 GLU 2 HG3 GLU 2 6.936 0.585 0.613
18 H TRP 3 HN TRP 3 8.360 2.744 -2.869
19 HA TRP 3 HA TRP 3 8.050 2.050 -5.752
20 HD1 TRP 3 HD1 TRP 3 5.882 4.162 -2.981
21 HE1 TRP 3 HE1 TRP 3 3.392 4.117 -3.542
22 HE3 TRP 3 HE3 TRP 3 6.215 3.998 -8.083
23 HZ2 TRP 3 HZ2 TRP 3 1.734 4.071 -5.927
24 HZ3 TRP 3 HZ3 TRP 3 4.171 3.966 -9.479
25 HH2 TRP 3 HH2 TRP 3 1.925 4.004 -8.412
26 HB2 TRP 3 HB2 TRP 3 8.048 4.820 -4.502
27 HB3 TRP 3 HB3 TRP 3 7.939 4.458 -6.209
28 H LEU 4 HN LEU 4 9.737 3.030 -7.076
29 HA LEU 4 HA LEU 4 12.407 3.134 -5.739
30 HG LEU 4 HG LEU 4 13.726 2.968 -8.737
31 HB2 LEU 4 HB2 LEU 4 12.069 1.084 -6.998
32 HB3 LEU 4 HB3 LEU 4 11.466 1.997 -8.388
33 HD11 LEU 4 HD11 LEU 4 15.660 1.856 -7.585
34 HD12 LEU 4 HD12 LEU 4 14.692 2.854 -6.500
35 HD13 LEU 4 HD13 LEU 4 14.519 1.088 -6.464
36 HD21 LEU 4 HD21 LEU 4 13.628 -0.079 -8.614
37 HD22 LEU 4 HD22 LEU 4 12.983 0.933 -9.928
38 HD23 LEU 4 HD23 LEU 4 14.725 0.893 -9.613
39 H VAL 5 HN VAL 5 13.529 4.856 -6.165
40 HA VAL 5 HA VAL 5 12.581 7.035 -7.947
41 HB VAL 5 HB VAL 5 14.969 6.860 -6.058
42 HG11 VAL 5 HG11 VAL 5 13.686 9.246 -7.410
43 HG12 VAL 5 HG12 VAL 5 14.986 9.320 -6.196
44 HG13 VAL 5 HG13 VAL 5 15.291 8.570 -7.762
45 HG21 VAL 5 HG21 VAL 5 13.566 8.331 -4.542
46 HG22 VAL 5 HG22 VAL 5 12.176 8.000 -5.605
47 HG23 VAL 5 HG23 VAL 5 12.951 6.690 -4.702
48 H LYS 6 HN LYS 6 13.032 6.532 -9.972
49 HA LYS 6 HA LYS 6 15.519 5.147 -10.825
50 HB2 LYS 6 HB2 LYS 6 12.947 6.010 -12.156
51 HB3 LYS 6 HB3 LYS 6 14.331 5.514 -13.107
52 HG2 LYS 6 HG2 LYS 6 12.971 3.772 -11.013
53 HG3 LYS 6 HG3 LYS 6 12.651 3.740 -12.738
54 HD2 LYS 6 HD2 LYS 6 15.092 2.763 -11.293
55 HD3 LYS 6 HD3 LYS 6 13.979 1.919 -12.398
56 HE2 LYS 6 HE2 LYS 6 14.865 3.247 -14.304
57 HE3 LYS 6 HE3 LYS 6 15.982 4.074 -13.215
58 HZ1 LYS 6 HZ1 LYS 6 17.060 2.249 -14.361
59 HZ2 LYS 6 HZ2 LYS 6 17.038 1.934 -12.766
60 HZ3 LYS 6 HZ3 LYS 6 16.005 1.160 -13.772
61 H LYS 7 HN LYS 7 14.215 8.377 -10.552
62 HA LYS 7 HA LYS 7 16.660 9.588 -11.541
63 HB2 LYS 7 HB2 LYS 7 13.957 10.199 -12.812
64 HB3 LYS 7 HB3 LYS 7 15.282 11.356 -12.777
65 HG2 LYS 7 HG2 LYS 7 16.733 9.794 -14.018
66 HG3 LYS 7 HG3 LYS 7 15.409 8.621 -14.108
67 HD2 LYS 7 HD2 LYS 7 14.008 10.329 -15.287
68 HD3 LYS 7 HD3 LYS 7 15.390 11.428 -15.294
69 HE2 LYS 7 HE2 LYS 7 15.320 8.658 -16.588
70 HE3 LYS 7 HE3 LYS 7 15.034 10.179 -17.442
71 HZ1 LYS 7 HZ1 LYS 7 17.304 10.848 -16.882
72 HZ2 LYS 7 HZ2 LYS 7 17.579 9.422 -16.125
73 HZ3 LYS 7 HZ3 LYS 7 17.301 9.457 -17.727
74 H SER 8 HN SER 8 16.919 11.577 -10.350
75 HA SER 8 HA SER 8 14.642 12.704 -8.890
76 HG SER 8 HG SER 8 18.023 11.652 -7.849
77 HB2 SER 8 HB2 SER 8 16.355 12.898 -6.892
78 HB3 SER 8 HB3 SER 8 15.300 11.496 -7.066
79 H CYS 9 HN CYS 9 14.871 14.922 -8.755
80 HA CYS 9 HA CYS 9 17.214 16.091 -10.194
81 HG CYS 9 HG CYS 9 14.226 16.150 -12.832
82 HB2 CYS 9 HB2 CYS 9 14.257 16.815 -10.309
83 HB3 CYS 9 HB3 CYS 9 15.565 17.656 -11.158
84 H CYS 10 HN CYS 10 18.402 17.211 -8.819
85 HA CYS 10 HA CYS 10 17.577 18.187 -6.287
86 HG CYS 10 HG CYS 10 21.488 17.331 -6.668
87 HB2 CYS 10 HB2 CYS 10 19.964 18.998 -8.003
88 HB3 CYS 10 HB3 CYS 10 19.781 19.277 -6.265
89 H ASN 11 HN ASN 11 17.352 20.336 -5.548
90 HA ASN 11 HA ASN 11 17.344 22.642 -7.298
91 HB2 ASN 11 HB2 ASN 11 15.138 23.361 -7.068
92 HB3 ASN 11 HB3 ASN 11 14.977 21.694 -7.605
93 HD21 ASN 11 HD22 ASN 11 14.811 20.053 -5.695
94 HD22 ASN 11 HD21 ASN 11 13.772 20.521 -4.385
95 H LYS 12 HN LYS 12 17.582 24.493 -6.068
96 HA LYS 12 HA LYS 12 17.837 24.127 -3.114
97 HB2 LYS 12 HB2 LYS 12 19.689 25.190 -5.173
98 HB3 LYS 12 HB3 LYS 12 19.408 26.353 -3.892
99 HG2 LYS 12 HG2 LYS 12 20.185 23.462 -3.387
100 HG3 LYS 12 HG3 LYS 12 21.352 24.789 -3.540
101 HD2 LYS 12 HD2 LYS 12 20.201 26.000 -1.671
102 HD3 LYS 12 HD3 LYS 12 19.154 24.612 -1.412
103 HE2 LYS 12 HE2 LYS 12 22.204 24.588 -1.219
104 HE3 LYS 12 HE3 LYS 12 21.106 24.733 0.153
105 HZ1 LYS 12 HZ1 LYS 12 21.275 22.380 -1.640
106 HZ2 LYS 12 HZ2 LYS 12 21.841 22.470 -0.117
107 HZ3 LYS 12 HZ3 LYS 12 20.237 22.530 -0.380
108 H GLN 13 HN GLN 13 16.211 25.752 -5.656
109 HA GLN 13 HA GLN 13 15.862 28.269 -4.420
110 HB2 GLN 13 HB2 GLN 13 14.149 26.826 -6.516
111 HB3 GLN 13 HB3 GLN 13 14.067 28.536 -6.110
112 HG2 GLN 13 HG2 GLN 13 15.358 28.654 -7.974
113 HG3 GLN 13 HG3 GLN 13 16.617 28.601 -6.754
114 HE21 GLN 13 HE22 GLN 13 16.947 27.947 -9.562
115 HE22 GLN 13 HE21 GLN 13 17.380 26.257 -9.655
116 H ASP 14 HN ASP 14 14.054 25.167 -4.168
117 HA ASP 14 HA ASP 14 12.558 26.385 -1.886
118 HB2 ASP 14 HB2 ASP 14 11.298 26.749 -4.068
119 HB3 ASP 14 HB3 ASP 14 11.149 24.999 -4.195
120 H ASN 15 HN ASN 15 14.485 23.978 -2.655
121 HA ASN 15 HA ASN 15 14.770 21.812 -2.384
122 HB2 ASN 15 HB2 ASN 15 14.782 20.958 -0.187
123 HB3 ASN 15 HB3 ASN 15 15.276 22.638 -0.154
124 HD21 ASN 15 HD22 ASN 15 13.081 20.303 1.100
125 HD22 ASN 15 HD21 ASN 15 12.125 21.398 2.085
126 H ARG 16 HN ARG 16 12.297 22.502 -3.626
127 HA ARG 16 HA ARG 16 10.383 20.335 -3.048
128 HE ARG 16 HE ARG 16 8.182 24.553 -4.320
129 HB2 ARG 16 HB2 ARG 16 9.489 22.461 -3.180
130 HB3 ARG 16 HB3 ARG 16 10.362 22.837 -4.690
131 HG2 ARG 16 HG2 ARG 16 8.925 21.478 -5.998
132 HG3 ARG 16 HG3 ARG 16 8.259 20.666 -4.585
133 HD2 ARG 16 HD2 ARG 16 6.705 22.380 -5.617
134 HD3 ARG 16 HD3 ARG 16 7.050 22.629 -3.906
135 HH11 ARG 16 HH11 ARG 16 7.719 22.904 -7.488
136 HH12 ARG 16 HH12 ARG 16 8.429 24.236 -8.363
137 HH21 ARG 16 HH21 ARG 16 8.908 26.322 -5.578
138 HH22 ARG 16 HH22 ARG 16 9.076 26.179 -7.292
139 H HIS 17 HN HIS 17 11.579 18.733 -3.690
140 HA HIS 17 HA HIS 17 13.110 18.553 -6.173
141 HD1 HIS 17 HD1 HIS 17 13.750 18.484 -2.315
142 HD2 HIS 17 HD2 HIS 17 15.805 16.781 -5.568
143 HE1 HIS 17 HE1 HIS 17 16.209 19.075 -1.997
144 HB2 HIS 17 HB2 HIS 17 12.409 16.581 -3.963
145 HB3 HIS 17 HB3 HIS 17 13.333 16.118 -5.386
146 H VAL 18 HN VAL 18 12.794 16.683 -7.674
147 HA VAL 18 HA VAL 18 10.046 15.668 -7.851
148 HB VAL 18 HB VAL 18 11.478 16.598 -10.355
149 HG11 VAL 18 HG11 VAL 18 9.328 16.388 -11.463
150 HG12 VAL 18 HG12 VAL 18 9.703 14.872 -10.654
151 HG13 VAL 18 HG13 VAL 18 8.523 15.987 -9.932
152 HG21 VAL 18 HG21 VAL 18 9.273 18.134 -8.927
153 HG22 VAL 18 HG22 VAL 18 10.968 18.636 -9.045
154 HG23 VAL 18 HG23 VAL 18 9.975 18.540 -10.502
155 H LEU 19 HN LEU 19 9.997 13.647 -8.633
156 HA LEU 19 HA LEU 19 12.518 12.368 -9.473
157 HG LEU 19 HG LEU 19 10.399 12.219 -6.227
158 HB2 LEU 19 HB2 LEU 19 11.552 10.478 -7.693
159 HB3 LEU 19 HB3 LEU 19 13.013 11.412 -7.569
160 HD11 LEU 19 HD11 LEU 19 11.243 10.060 -5.449
161 HD12 LEU 19 HD12 LEU 19 12.840 10.757 -5.136
162 HD13 LEU 19 HD13 LEU 19 11.423 11.295 -4.197
163 HD21 LEU 19 HD21 LEU 19 13.204 13.367 -6.268
164 HD22 LEU 19 HD22 LEU 19 11.642 14.193 -6.105
165 HD23 LEU 19 HD23 LEU 19 12.331 13.375 -4.723
166 H MET 20 HN MET 20 12.180 10.087 -10.142
167 HA MET 20 HA MET 20 9.573 9.889 -11.564
168 HB2 MET 20 HB2 MET 20 11.651 10.038 -12.956
169 HB3 MET 20 HB3 MET 20 12.190 8.498 -12.258
170 HG2 MET 20 HG2 MET 20 10.267 7.357 -13.227
171 HG3 MET 20 HG3 MET 20 9.550 8.894 -13.703
172 HE1 MET 20 HE1 MET 20 13.364 7.851 -14.141
173 HE2 MET 20 HE2 MET 20 12.500 6.341 -14.484
174 HE3 MET 20 HE3 MET 20 13.336 7.200 -15.795
175 H LEU 21 HN LEU 21 8.317 8.867 -10.134
176 HA LEU 21 HA LEU 21 9.353 6.863 -8.225
177 HG LEU 21 HG LEU 21 8.276 7.257 -6.169
178 HB2 LEU 21 HB2 LEU 21 6.799 8.443 -8.563
179 HB3 LEU 21 HB3 LEU 21 6.639 6.810 -7.923
180 HD11 LEU 21 HD11 LEU 21 8.342 10.024 -7.430
181 HD12 LEU 21 HD12 LEU 21 8.814 9.753 -5.735
182 HD13 LEU 21 HD13 LEU 21 9.695 8.953 -7.050
183 HD21 LEU 21 HD21 LEU 21 6.809 8.722 -4.808
184 HD22 LEU 21 HD22 LEU 21 5.950 9.225 -6.282
185 HD23 LEU 21 HD23 LEU 21 5.880 7.537 -5.742
186 H CYS 22 HN CYS 22 9.301 4.773 -8.642
187 HA CYS 22 HA CYS 22 7.642 3.773 -10.908
188 HG CYS 22 HG CYS 22 10.562 5.630 -10.809
189 HB2 CYS 22 HB2 CYS 22 10.561 3.126 -10.291
190 HB3 CYS 22 HB3 CYS 22 9.617 2.578 -11.684
191 H ASP 23 HN ASP 23 7.507 1.423 -10.940
192 HA ASP 23 HA ASP 23 6.792 0.098 -8.505
193 HB2 ASP 23 HB2 ASP 23 6.006 -0.938 -10.443
194 HB3 ASP 23 HB3 ASP 23 7.495 -0.647 -11.334
195 H ALA 24 HN ALA 24 8.044 -1.318 -7.163
196 HA ALA 24 HA ALA 24 10.848 -0.760 -6.858
197 HB1 ALA 24 HB1 ALA 24 9.424 -1.287 -4.946
198 HB2 ALA 24 HB2 ALA 24 9.088 -2.906 -5.609
199 HB3 ALA 24 HB3 ALA 24 10.735 -2.472 -5.098
200 H GLY 25 HN GLY 25 11.406 -1.187 -9.095
201 HA2 GLY 25 HA2 GLY 25 12.887 -3.351 -9.858
202 HA3 GLY 25 HA3 GLY 25 11.215 -3.871 -10.180
203 H GLY 26 HN GLY 26 10.638 -0.856 -10.659
204 HA2 GLY 26 HA2 GLY 26 10.867 0.759 -12.275
205 HA3 GLY 26 HA3 GLY 26 12.064 -0.222 -13.125
206 H ALA 27 HN ALA 27 9.171 -2.057 -12.482
207 HA ALA 27 HA ALA 27 8.811 -2.401 -15.293
208 HB1 ALA 27 HB1 ALA 27 8.371 -4.151 -13.588
209 HB2 ALA 27 HB2 ALA 27 6.971 -3.218 -13.002
210 HB3 ALA 27 HB3 ALA 27 6.973 -3.885 -14.645
211 H ILE 28 HN ILE 28 7.453 -0.034 -13.170
212 HA ILE 28 HA ILE 28 5.621 1.011 -15.224
213 HB ILE 28 HB ILE 28 4.852 0.496 -12.304
214 HG12 ILE 28 HG12 ILE 28 3.746 -0.763 -14.855
215 HG13 ILE 28 HG13 ILE 28 4.696 -1.576 -13.608
216 HG21 ILE 28 HG21 ILE 28 3.208 1.794 -14.530
217 HG22 ILE 28 HG22 ILE 28 2.662 1.493 -12.866
218 HG23 ILE 28 HG23 ILE 28 3.935 2.650 -13.149
219 HD11 ILE 28 HD11 ILE 28 1.862 -0.553 -13.324
220 HD12 ILE 28 HD12 ILE 28 2.444 -2.221 -13.278
221 HD13 ILE 28 HD13 ILE 28 2.863 -1.111 -11.956
222 H LYS 29 HN LYS 29 5.575 3.373 -14.985
223 HA LYS 29 HA LYS 29 7.377 4.513 -12.923
224 HB2 LYS 29 HB2 LYS 29 7.734 5.027 -15.907
225 HB3 LYS 29 HB3 LYS 29 8.624 5.766 -14.575
226 HG2 LYS 29 HG2 LYS 29 9.310 3.302 -13.961
227 HG3 LYS 29 HG3 LYS 29 8.775 2.903 -15.593
228 HD2 LYS 29 HD2 LYS 29 10.407 4.464 -16.550
229 HD3 LYS 29 HD3 LYS 29 10.791 5.084 -14.948
230 HE2 LYS 29 HE2 LYS 29 12.587 3.664 -15.629
231 HE3 LYS 29 HE3 LYS 29 11.773 2.898 -14.277
232 HZ1 LYS 29 HZ1 LYS 29 10.716 1.364 -15.793
233 HZ2 LYS 29 HZ2 LYS 29 11.263 2.174 -17.120
234 HZ3 LYS 29 HZ3 LYS 29 12.301 1.377 -16.154
235 H MET 30 HN MET 30 6.960 6.621 -12.405
236 HA MET 30 HA MET 30 4.797 8.163 -13.692
237 HB2 MET 30 HB2 MET 30 4.986 7.539 -10.706
238 HB3 MET 30 HB3 MET 30 3.810 8.576 -11.491
239 HG2 MET 30 HG2 MET 30 3.268 6.342 -12.856
240 HG3 MET 30 HG3 MET 30 3.967 5.599 -11.416
241 HE1 MET 30 HE1 MET 30 1.453 7.263 -8.679
242 HE2 MET 30 HE2 MET 30 3.103 6.637 -8.906
243 HE3 MET 30 HE3 MET 30 2.691 8.290 -9.426
244 H ILE 31 HN ILE 31 4.803 10.397 -12.456
245 HA ILE 31 HA ILE 31 7.587 11.244 -11.790
246 HB ILE 31 HB ILE 31 5.394 12.856 -13.088
247 HG12 ILE 31 HG12 ILE 31 8.054 12.306 -14.435
248 HG13 ILE 31 HG13 ILE 31 6.835 11.040 -14.494
249 HG21 ILE 31 HG21 ILE 31 7.240 14.576 -13.367
250 HG22 ILE 31 HG22 ILE 31 6.793 14.297 -11.691
251 HG23 ILE 31 HG23 ILE 31 8.277 13.566 -12.347
252 HD11 ILE 31 HD11 ILE 31 5.179 12.537 -15.410
253 HD12 ILE 31 HD12 ILE 31 6.319 13.893 -15.343
254 HD13 ILE 31 HD13 ILE 31 6.643 12.515 -16.421
255 H ALA 32 HN ALA 32 7.657 12.421 -9.772
256 HA ALA 32 HA ALA 32 5.087 13.346 -8.665
257 HB1 ALA 32 HB1 ALA 32 5.548 11.136 -7.567
258 HB2 ALA 32 HB2 ALA 32 7.104 11.806 -6.990
259 HB3 ALA 32 HB3 ALA 32 5.576 12.511 -6.441
260 H GLU 33 HN GLU 33 5.289 15.296 -7.789
261 HA GLU 33 HA GLU 33 7.988 16.507 -7.488
262 HB2 GLU 33 HB2 GLU 33 6.372 17.808 -8.898
263 HB3 GLU 33 HB3 GLU 33 5.201 17.785 -7.558
264 HG2 GLU 33 HG2 GLU 33 6.706 19.103 -6.170
265 HG3 GLU 33 HG3 GLU 33 7.962 19.053 -7.391
266 H VAL 34 HN VAL 34 8.573 17.055 -5.397
267 HA VAL 34 HA VAL 34 6.801 16.346 -3.149
268 HB VAL 34 HB VAL 34 8.415 14.786 -2.276
269 HG11 VAL 34 HG11 VAL 34 6.740 13.869 -3.977
270 HG12 VAL 34 HG12 VAL 34 8.058 13.879 -5.152
271 HG13 VAL 34 HG13 VAL 34 8.182 12.892 -3.680
272 HG21 VAL 34 HG21 VAL 34 10.373 14.008 -3.599
273 HG22 VAL 34 HG22 VAL 34 10.081 15.309 -4.767
274 HG23 VAL 34 HG23 VAL 34 10.510 15.687 -3.081
275 H LYS 35 HN LYS 35 8.251 16.790 -1.049
276 HA LYS 35 HA LYS 35 10.244 18.926 -1.516
277 HB2 LYS 35 HB2 LYS 35 8.028 19.922 -0.755
278 HB3 LYS 35 HB3 LYS 35 8.194 19.008 0.741
279 HG2 LYS 35 HG2 LYS 35 10.241 20.200 1.288
280 HG3 LYS 35 HG3 LYS 35 10.274 21.010 -0.292
281 HD2 LYS 35 HD2 LYS 35 7.971 21.324 1.676
282 HD3 LYS 35 HD3 LYS 35 9.388 22.363 1.744
283 HE2 LYS 35 HE2 LYS 35 7.897 22.050 -0.882
284 HE3 LYS 35 HE3 LYS 35 7.222 23.082 0.380
285 HZ1 LYS 35 HZ1 LYS 35 8.691 24.262 -1.234
286 HZ2 LYS 35 HZ2 LYS 35 9.142 24.448 0.328
287 HZ3 LYS 35 HZ3 LYS 35 9.976 23.454 -0.668
288 H SER 36 HN SER 36 12.054 18.528 -0.399
289 HA SER 36 HA SER 36 12.076 16.115 1.384
290 HG SER 36 HG SER 36 13.040 15.178 -2.061
291 HB2 SER 36 HB2 SER 36 14.214 16.603 -0.686
292 HB3 SER 36 HB3 SER 36 13.735 15.090 0.098
293 H ASP 37 HN ASP 37 13.683 16.069 2.947
294 HA ASP 37 HA ASP 37 15.262 18.594 3.277
295 HB2 ASP 37 HB2 ASP 37 13.454 18.148 4.914
296 HB3 ASP 37 HB3 ASP 37 14.266 16.657 5.383
297 H PHE 38 HN PHE 38 15.705 15.446 2.341
298 HA PHE 38 HA PHE 38 18.504 15.353 3.307
299 HD1 PHE 38 HD2 PHE 38 14.759 14.017 4.429
300 HD2 PHE 38 HD1 PHE 38 18.792 13.406 5.819
301 HE1 PHE 38 HE2 PHE 38 13.983 14.259 6.776
302 HE2 PHE 38 HE1 PHE 38 18.012 13.637 8.164
303 HZ PHE 38 HZ PHE 38 15.607 14.057 8.647
304 HB2 PHE 38 HB2 PHE 38 16.502 13.141 2.904
305 HB3 PHE 38 HB3 PHE 38 18.141 12.856 3.488
306 H ALA 39 HN ALA 39 16.715 15.531 0.882
307 HA ALA 39 HA ALA 39 16.578 15.202 -1.394
308 HB1 ALA 39 HB1 ALA 39 18.572 16.654 -1.221
309 HB2 ALA 39 HB2 ALA 39 19.609 15.209 -1.275
310 HB3 ALA 39 HB3 ALA 39 18.585 15.633 -2.666
311 H VAL 40 HN VAL 40 17.965 13.800 -3.290
312 HA VAL 40 HA VAL 40 18.015 10.962 -2.569
313 HB VAL 40 HB VAL 40 16.390 10.814 -4.747
314 HG11 VAL 40 HG11 VAL 40 16.183 9.563 -2.695
315 HG12 VAL 40 HG12 VAL 40 15.429 10.957 -1.878
316 HG13 VAL 40 HG13 VAL 40 14.602 10.158 -3.236
317 HG21 VAL 40 HG21 VAL 40 14.504 12.262 -4.629
318 HG22 VAL 40 HG22 VAL 40 15.100 13.087 -3.182
319 HG23 VAL 40 HG23 VAL 40 15.927 13.308 -4.740
320 H LYS 41 HN LYS 41 18.657 9.662 -4.502
321 HA LYS 41 HA LYS 41 20.167 11.154 -6.514
322 HB2 LYS 41 HB2 LYS 41 22.382 10.653 -5.869
323 HB3 LYS 41 HB3 LYS 41 21.610 11.475 -4.538
324 HG2 LYS 41 HG2 LYS 41 22.257 8.497 -4.687
325 HG3 LYS 41 HG3 LYS 41 23.111 9.730 -3.760
326 HD2 LYS 41 HD2 LYS 41 21.036 10.125 -2.416
327 HD3 LYS 41 HD3 LYS 41 20.261 8.820 -3.335
328 HE2 LYS 41 HE2 LYS 41 22.038 7.246 -2.583
329 HE3 LYS 41 HE3 LYS 41 22.664 8.513 -1.515
330 HZ1 LYS 41 HZ1 LYS 41 21.106 6.993 -0.404
331 HZ2 LYS 41 HZ2 LYS 41 20.532 8.525 -0.382
332 HZ3 LYS 41 HZ3 LYS 41 19.898 7.430 -1.439
333 H VAL 42 HN VAL 42 18.158 9.203 -6.592
334 HA VAL 42 HA VAL 42 17.485 7.546 -7.869
335 HB VAL 42 HB VAL 42 20.210 7.767 -9.215
336 HG11 VAL 42 HG11 VAL 42 19.220 5.737 -9.997
337 HG12 VAL 42 HG12 VAL 42 17.608 6.481 -10.088
338 HG13 VAL 42 HG13 VAL 42 18.899 6.950 -11.227
339 HG21 VAL 42 HG21 VAL 42 19.129 9.925 -9.228
340 HG22 VAL 42 HG22 VAL 42 18.859 9.211 -10.815
341 HG23 VAL 42 HG23 VAL 42 17.559 9.181 -9.585
342 H GLY 43 HN GLY 43 17.392 5.339 -8.236
343 HA2 GLY 43 HA2 GLY 43 17.525 3.170 -7.593
344 HA3 GLY 43 HA3 GLY 43 19.210 3.409 -7.078
345 H ASP 44 HN ASP 44 16.383 5.359 -5.981
346 HA ASP 44 HA ASP 44 17.141 4.521 -3.167
347 HB2 ASP 44 HB2 ASP 44 15.821 7.101 -4.106
348 HB3 ASP 44 HB3 ASP 44 15.815 6.512 -2.441
349 H LEU 45 HN LEU 45 15.424 3.717 -1.769
350 HA LEU 45 HA LEU 45 12.948 2.977 -3.232
351 HG LEU 45 HG LEU 45 11.269 1.810 -1.422
352 HB2 LEU 45 HB2 LEU 45 14.295 1.428 -1.571
353 HB3 LEU 45 HB3 LEU 45 13.545 2.432 -0.329
354 HD11 LEU 45 HD11 LEU 45 12.986 -0.410 -2.622
355 HD12 LEU 45 HD12 LEU 45 11.213 -0.295 -2.668
356 HD13 LEU 45 HD13 LEU 45 12.197 0.876 -3.550
357 HD21 LEU 45 HD21 LEU 45 11.160 -0.276 -0.161
358 HD22 LEU 45 HD22 LEU 45 12.941 -0.342 -0.074
359 HD23 LEU 45 HD23 LEU 45 12.042 0.967 0.732
360 H LEU 46 HN LEU 46 10.889 3.627 -2.361
361 HA LEU 46 HA LEU 46 10.848 5.675 -0.228
362 HG LEU 46 HG LEU 46 11.326 6.839 -3.067
363 HB2 LEU 46 HB2 LEU 46 9.192 5.677 -2.780
364 HB3 LEU 46 HB3 LEU 46 8.833 6.659 -1.367
365 HD11 LEU 46 HD11 LEU 46 9.354 7.693 -4.212
366 HD12 LEU 46 HD12 LEU 46 8.891 8.668 -2.801
367 HD13 LEU 46 HD13 LEU 46 10.349 9.069 -3.720
368 HD21 LEU 46 HD21 LEU 46 10.448 8.522 -0.683
369 HD22 LEU 46 HD22 LEU 46 11.886 7.496 -0.794
370 HD23 LEU 46 HD23 LEU 46 11.785 8.944 -1.790
371 H SER 47 HN SER 47 9.823 4.767 1.418
372 HA SER 47 HA SER 47 7.564 2.892 0.859
373 HG SER 47 HG SER 47 10.094 0.984 2.494
374 HB2 SER 47 HB2 SER 47 9.310 2.971 3.339
375 HB3 SER 47 HB3 SER 47 8.019 1.817 2.974
376 HA PRO 48 HA PRO 48 5.277 6.260 2.547
377 HB2 PRO 48 HB2 PRO 48 2.875 5.083 3.200
378 HB3 PRO 48 HB3 PRO 48 3.404 5.398 1.523
379 HG2 PRO 48 HG2 PRO 48 3.613 2.813 3.090
380 HG3 PRO 48 HG3 PRO 48 3.036 3.049 1.409
381 HD2 PRO 48 HD2 PRO 48 5.580 2.237 1.968
382 HD3 PRO 48 HD3 PRO 48 5.235 3.341 0.601
383 H LEU 49 HN LEU 49 4.672 7.208 4.447
384 HA LEU 49 HA LEU 49 4.943 5.669 7.013
385 HG LEU 49 HG LEU 49 7.434 7.023 5.631
386 HB2 LEU 49 HB2 LEU 49 5.626 8.578 6.416
387 HB3 LEU 49 HB3 LEU 49 5.685 7.825 8.005
388 HD11 LEU 49 HD11 LEU 49 8.015 8.713 8.099
389 HD12 LEU 49 HD12 LEU 49 9.230 8.139 6.939
390 HD13 LEU 49 HD13 LEU 49 7.967 9.263 6.409
391 HD21 LEU 49 HD21 LEU 49 7.127 5.136 7.176
392 HD22 LEU 49 HD22 LEU 49 8.758 5.789 7.336
393 HD23 LEU 49 HD23 LEU 49 7.529 6.174 8.564
394 H GLN 50 HN GLN 50 3.355 8.250 5.171
395 HA GLN 50 HA GLN 50 0.787 7.563 6.209
396 HB2 GLN 50 HB2 GLN 50 0.141 9.865 6.942
397 HB3 GLN 50 HB3 GLN 50 1.237 9.028 8.024
398 HG2 GLN 50 HG2 GLN 50 3.130 10.356 7.264
399 HG3 GLN 50 HG3 GLN 50 2.133 11.131 6.022
400 HE21 GLN 50 HE22 GLN 50 2.218 13.293 6.764
401 HE22 GLN 50 HE21 GLN 50 1.637 13.786 8.331
402 H ASN 51 HN ASN 51 -0.606 9.763 5.074
403 HA ASN 51 HA ASN 51 -0.857 8.839 2.523
404 HB2 ASN 51 HB2 ASN 51 -2.554 10.222 3.585
405 HB3 ASN 51 HB3 ASN 51 -1.498 11.637 3.542
406 HD21 ASN 51 HD22 ASN 51 -1.381 12.871 1.591
407 HD22 ASN 51 HD21 ASN 51 -2.272 12.447 0.158
408 H ALA 52 HN ALA 52 1.186 11.689 3.380
409 HA ALA 52 HA ALA 52 2.176 11.716 0.621
410 HB1 ALA 52 HB1 ALA 52 0.884 13.704 1.239
411 HB2 ALA 52 HB2 ALA 52 1.945 13.975 2.644
412 HB3 ALA 52 HB3 ALA 52 2.588 14.111 0.998
413 H LEU 53 HN LEU 53 3.224 11.339 4.015
414 HA LEU 53 HA LEU 53 5.976 12.023 3.305
415 HG LEU 53 HG LEU 53 4.839 13.508 5.465
416 HB2 LEU 53 HB2 LEU 53 4.743 10.969 5.852
417 HB3 LEU 53 HB3 LEU 53 6.480 10.956 5.601
418 HD11 LEU 53 HD11 LEU 53 6.511 12.379 7.758
419 HD12 LEU 53 HD12 LEU 53 5.723 13.971 7.724
420 HD13 LEU 53 HD13 LEU 53 4.741 12.500 7.733
421 HD21 LEU 53 HD21 LEU 53 7.065 14.593 5.765
422 HD22 LEU 53 HD22 LEU 53 7.852 13.006 5.709
423 HD23 LEU 53 HD23 LEU 53 7.023 13.642 4.280
424 H TYR 54 HN TYR 54 7.478 10.640 2.652
425 HA TYR 54 HA TYR 54 7.110 7.719 3.056
426 HD1 TYR 54 HD1 TYR 54 5.643 9.952 0.494
427 HD2 TYR 54 HD2 TYR 54 6.937 5.876 0.008
428 HE1 TYR 54 HE1 TYR 54 3.463 9.390 -0.531
429 HE2 TYR 54 HE2 TYR 54 4.781 5.304 -1.042
430 HH TYR 54 HH TYR 54 2.667 6.081 -1.681
431 HB2 TYR 54 HB2 TYR 54 8.175 9.170 0.586
432 HB3 TYR 54 HB3 TYR 54 8.441 7.469 0.907
433 H CYS 55 HN CYS 55 9.136 6.675 3.559
434 HA CYS 55 HA CYS 55 11.293 8.526 4.394
435 HG CYS 55 HG CYS 55 11.434 4.260 5.598
436 HB2 CYS 55 HB2 CYS 55 12.380 6.427 5.241
437 HB3 CYS 55 HB3 CYS 55 10.918 6.930 6.092
438 H ILE 56 HN ILE 56 13.480 8.085 3.633
439 HA ILE 56 HA ILE 56 13.438 7.434 0.733
440 HB ILE 56 HB ILE 56 15.390 9.053 2.421
441 HG12 ILE 56 HG12 ILE 56 13.410 10.127 0.367
442 HG13 ILE 56 HG13 ILE 56 13.035 10.044 2.088
443 HG21 ILE 56 HG21 ILE 56 16.287 9.866 0.197
444 HG22 ILE 56 HG22 ILE 56 16.602 8.175 0.458
445 HG23 ILE 56 HG23 ILE 56 15.271 8.653 -0.606
446 HD11 ILE 56 HD11 ILE 56 15.298 11.675 0.905
447 HD12 ILE 56 HD12 ILE 56 13.779 12.270 1.560
448 HD13 ILE 56 HD13 ILE 56 14.935 11.481 2.638
449 H ASN 57 HN ASN 57 14.970 6.148 -0.175
450 HA ASN 57 HA ASN 57 16.660 4.793 -0.567
451 HB2 ASN 57 HB2 ASN 57 18.061 6.475 0.626
452 HB3 ASN 57 HB3 ASN 57 17.891 5.546 2.116
453 HD21 ASN 57 HD22 ASN 57 18.904 5.410 -1.273
454 HD22 ASN 57 HD21 ASN 57 20.051 4.071 -1.103
455 H ARG 58 HN ARG 58 16.497 4.243 2.960
456 HA ARG 58 HA ARG 58 14.797 1.984 2.785
457 HE ARG 58 HE ARG 58 20.548 1.337 4.468
458 HB2 ARG 58 HB2 ARG 58 16.324 0.229 3.556
459 HB3 ARG 58 HB3 ARG 58 16.879 0.864 2.016
460 HG2 ARG 58 HG2 ARG 58 18.516 2.343 3.349
461 HG3 ARG 58 HG3 ARG 58 18.054 1.402 4.777
462 HD2 ARG 58 HD2 ARG 58 18.746 -0.681 3.595
463 HD3 ARG 58 HD3 ARG 58 19.243 0.301 2.197
464 HH11 ARG 58 HH21 ARG 58 20.590 -1.650 2.549
465 HH12 ARG 58 HH22 ARG 58 22.236 -2.022 2.899
466 HH21 ARG 58 HH11 ARG 58 22.745 0.842 4.939
467 HH22 ARG 58 HH12 ARG 58 23.486 -0.569 4.290
468 H GLU 59 HN GLU 59 15.436 4.688 4.197
469 HA GLU 59 HA GLU 59 16.192 3.925 6.926
470 HB2 GLU 59 HB2 GLU 59 16.511 6.220 5.094
471 HB3 GLU 59 HB3 GLU 59 15.800 6.764 6.587
472 HG2 GLU 59 HG2 GLU 59 18.290 5.048 6.312
473 HG3 GLU 59 HG3 GLU 59 18.297 6.802 6.521
474 H LYS 60 HN LYS 60 14.992 5.588 8.471
475 HA LYS 60 HA LYS 60 12.129 5.804 7.852
476 HB2 LYS 60 HB2 LYS 60 13.273 5.218 10.622
477 HB3 LYS 60 HB3 LYS 60 11.566 5.372 10.214
478 HG2 LYS 60 HG2 LYS 60 13.442 3.174 9.241
479 HG3 LYS 60 HG3 LYS 60 12.292 3.018 10.556
480 HD2 LYS 60 HD2 LYS 60 10.411 3.100 9.160
481 HD3 LYS 60 HD3 LYS 60 11.268 3.807 7.801
482 HE2 LYS 60 HE2 LYS 60 11.789 1.011 8.873
483 HE3 LYS 60 HE3 LYS 60 10.701 1.392 7.524
484 HZ1 LYS 60 HZ1 LYS 60 12.726 0.798 6.554
485 HZ2 LYS 60 HZ2 LYS 60 12.736 2.442 6.468
486 HZ3 LYS 60 HZ3 LYS 60 13.632 1.666 7.589
487 H LEU 61 HN LEU 61 15.074 7.083 9.415
488 HA LEU 61 HA LEU 61 13.898 9.463 10.425
489 HG LEU 61 HG LEU 61 16.231 7.240 11.209
490 HB2 LEU 61 HB2 LEU 61 16.778 8.956 9.551
491 HB3 LEU 61 HB3 LEU 61 16.217 10.234 10.623
492 HD11 LEU 61 HD11 LEU 61 17.788 9.560 12.410
493 HD12 LEU 61 HD12 LEU 61 17.907 7.846 12.883
494 HD13 LEU 61 HD13 LEU 61 18.411 8.354 11.260
495 HD21 LEU 61 HD21 LEU 61 15.180 9.531 12.903
496 HD22 LEU 61 HD22 LEU 61 14.266 8.150 12.244
497 HD23 LEU 61 HD23 LEU 61 15.487 7.878 13.493
498 H HIS 62 HN HIS 62 15.491 8.654 7.337
499 HA HIS 62 HA HIS 62 15.482 11.430 6.412
500 HD1 HIS 62 HD1 HIS 62 18.763 8.772 4.182
501 HD2 HIS 62 HD2 HIS 62 17.590 10.875 7.636
502 HE1 HIS 62 HE1 HIS 62 20.857 9.058 5.597
503 HB2 HIS 62 HB2 HIS 62 16.002 8.843 4.888
504 HB3 HIS 62 HB3 HIS 62 16.282 10.473 4.291
505 H THR 63 HN THR 63 13.540 12.388 5.735
506 HA THR 63 HA THR 63 11.509 10.680 4.426
507 HB THR 63 HB THR 63 9.923 12.202 5.648
508 HG1 THR 63 HG1 THR 63 10.764 13.417 7.339
509 HG21 THR 63 HG21 THR 63 10.087 11.001 7.742
510 HG22 THR 63 HG22 THR 63 10.608 9.903 6.448
511 HG23 THR 63 HG23 THR 63 11.816 10.678 7.484
512 H VAL 64 HN VAL 64 9.987 11.710 3.078
513 HA VAL 64 HA VAL 64 10.610 14.346 1.925
514 HB VAL 64 HB VAL 64 11.886 12.858 0.549
515 HG11 VAL 64 HG11 VAL 64 10.993 10.649 1.152
516 HG12 VAL 64 HG12 VAL 64 9.490 11.016 0.283
517 HG13 VAL 64 HG13 VAL 64 11.027 10.879 -0.594
518 HG21 VAL 64 HG21 VAL 64 10.939 13.085 -1.604
519 HG22 VAL 64 HG22 VAL 64 9.284 13.149 -0.963
520 HG23 VAL 64 HG23 VAL 64 10.418 14.488 -0.664
521 H LYS 65 HN LYS 65 8.630 15.259 1.029
522 HA LYS 65 HA LYS 65 6.149 13.785 1.804
523 HB2 LYS 65 HB2 LYS 65 6.835 15.764 3.251
524 HB3 LYS 65 HB3 LYS 65 6.573 16.794 1.836
525 HG2 LYS 65 HG2 LYS 65 4.211 15.943 1.708
526 HG3 LYS 65 HG3 LYS 65 4.489 14.999 3.174
527 HD2 LYS 65 HD2 LYS 65 4.654 18.038 2.940
528 HD3 LYS 65 HD3 LYS 65 3.279 17.125 3.577
529 HE2 LYS 65 HE2 LYS 65 4.727 16.206 5.388
530 HE3 LYS 65 HE3 LYS 65 6.088 17.154 4.774
531 HZ1 LYS 65 HZ1 LYS 65 4.816 19.167 5.253
532 HZ2 LYS 65 HZ2 LYS 65 3.561 18.291 5.826
533 HZ3 LYS 65 HZ3 LYS 65 4.991 18.276 6.603
534 H VAL 66 HN VAL 66 4.745 13.457 0.169
535 HA VAL 66 HA VAL 66 5.347 14.333 -2.515
536 HB VAL 66 HB VAL 66 2.990 12.856 -1.254
537 HG11 VAL 66 HG11 VAL 66 2.376 12.195 -3.597
538 HG12 VAL 66 HG12 VAL 66 2.136 13.915 -3.307
539 HG13 VAL 66 HG13 VAL 66 3.556 13.365 -4.226
540 HG21 VAL 66 HG21 VAL 66 5.309 11.915 -3.021
541 HG22 VAL 66 HG22 VAL 66 5.153 11.618 -1.281
542 HG23 VAL 66 HG23 VAL 66 3.995 10.898 -2.401
543 H LEU 67 HN LEU 67 4.318 15.867 -3.790
544 HA LEU 67 HA LEU 67 2.414 17.725 -2.410
545 HG LEU 67 HG LEU 67 5.580 17.963 -2.359
546 HB2 LEU 67 HB2 LEU 67 4.442 18.356 -4.579
547 HB3 LEU 67 HB3 LEU 67 3.367 19.501 -3.791
548 HD11 LEU 67 HD11 LEU 67 6.847 20.071 -2.495
549 HD12 LEU 67 HD12 LEU 67 6.458 19.426 -4.079
550 HD13 LEU 67 HD13 LEU 67 5.528 20.803 -3.444
551 HD21 LEU 67 HD21 LEU 67 3.823 18.705 -0.803
552 HD22 LEU 67 HD22 LEU 67 5.313 19.627 -0.574
553 HD23 LEU 67 HD23 LEU 67 3.941 20.361 -1.441
554 H SER 68 HN SER 68 3.373 16.159 -5.521
555 HA SER 68 HA SER 68 0.626 15.775 -6.310
556 HG SER 68 HG SER 68 0.661 18.222 -6.042
557 HB2 SER 68 HB2 SER 68 2.389 17.764 -7.834
558 HB3 SER 68 HB3 SER 68 0.945 17.004 -8.522
559 H ALA 69 HN ALA 69 0.601 14.335 -8.269
560 HA ALA 69 HA ALA 69 3.131 13.504 -9.402
561 HB1 ALA 69 HB1 ALA 69 2.888 11.114 -8.735
562 HB2 ALA 69 HB2 ALA 69 3.135 12.158 -7.327
563 HB3 ALA 69 HB3 ALA 69 1.506 11.542 -7.705
564 H SER 70 HN SER 70 2.819 11.949 -11.155
565 HA SER 70 HA SER 70 0.117 11.472 -12.186
566 HG SER 70 HG SER 70 2.172 14.316 -14.248
567 HB2 SER 70 HB2 SER 70 0.742 12.714 -14.344
568 HB3 SER 70 HB3 SER 70 0.283 13.710 -12.963
569 H SER 71 HN SER 71 0.165 10.014 -14.057
570 HA SER 71 HA SER 71 2.232 8.124 -14.255
571 HG SER 71 HG SER 71 -1.067 7.425 -15.536
572 HB2 SER 71 HB2 SER 71 0.325 9.007 -16.459
573 HB3 SER 71 HB3 SER 71 1.108 7.425 -16.285
574 H TYR 72 HN TYR 72 3.982 7.874 -15.795
575 HA TYR 72 HA TYR 72 5.427 10.282 -16.102
576 HD1 TYR 72 HD2 TYR 72 8.343 9.871 -15.774
577 HD2 TYR 72 HD1 TYR 72 6.862 8.223 -19.479
578 HE1 TYR 72 HE2 TYR 72 10.261 10.860 -16.970
579 HE2 TYR 72 HE1 TYR 72 8.789 9.204 -20.685
580 HH TYR 72 HH TYR 72 11.357 11.083 -19.019
581 HB2 TYR 72 HB2 TYR 72 6.541 8.140 -15.807
582 HB3 TYR 72 HB3 TYR 72 5.891 7.545 -17.335
583 H SER 73 HN SER 73 5.917 11.594 -17.830
584 HA SER 73 HA SER 73 5.368 10.844 -20.537
585 HG SER 73 HG SER 73 3.130 10.828 -19.598
586 HB2 SER 73 HB2 SER 73 3.931 13.191 -19.222
587 HB3 SER 73 HB3 SER 73 4.118 13.033 -20.982
588 HA PRO 74 HA PRO 74 9.262 12.758 -20.359
589 HB2 PRO 74 HB2 PRO 74 9.665 13.651 -22.984
590 HB3 PRO 74 HB3 PRO 74 9.879 11.968 -22.400
591 HG2 PRO 74 HG2 PRO 74 7.520 13.207 -23.820
592 HG3 PRO 74 HG3 PRO 74 8.237 11.583 -24.058
593 HD2 PRO 74 HD2 PRO 74 5.974 11.959 -22.594
594 HD3 PRO 74 HD3 PRO 74 7.196 10.741 -22.115
595 H ASP 75 HN ASP 75 7.066 14.843 -22.324
596 HA ASP 75 HA ASP 75 8.346 17.293 -21.718
597 HB2 ASP 75 HB2 ASP 75 6.674 17.159 -23.487
598 HB3 ASP 75 HB3 ASP 75 5.418 16.706 -22.329
599 H GLU 76 HN GLU 76 5.656 15.610 -20.021
600 HA GLU 76 HA GLU 76 5.265 17.721 -18.177
601 HB2 GLU 76 HB2 GLU 76 3.725 15.697 -18.878
602 HB3 GLU 76 HB3 GLU 76 4.496 14.881 -17.506
603 HG2 GLU 76 HG2 GLU 76 3.829 16.870 -16.074
604 HG3 GLU 76 HG3 GLU 76 3.007 17.553 -17.470
605 H TRP 77 HN TRP 77 7.464 14.948 -18.145
606 HA TRP 77 HA TRP 77 8.320 15.129 -15.412
607 HD1 TRP 77 HD1 TRP 77 10.656 14.216 -14.329
608 HE1 TRP 77 HE1 TRP 77 13.196 14.003 -14.296
609 HE3 TRP 77 HE3 TRP 77 11.445 13.510 -19.332
610 HZ2 TRP 77 HZ2 TRP 77 15.339 13.663 -16.232
611 HZ3 TRP 77 HZ3 TRP 77 13.747 13.250 -20.214
612 HH2 TRP 77 HH2 TRP 77 15.701 13.338 -18.678
613 HB2 TRP 77 HB2 TRP 77 8.883 13.148 -16.575
614 HB3 TRP 77 HB3 TRP 77 9.431 14.008 -17.989
615 H GLU 78 HN GLU 78 9.742 16.492 -18.478
616 HA GLU 78 HA GLU 78 11.757 17.893 -17.015
617 HB2 GLU 78 HB2 GLU 78 10.688 18.306 -19.840
618 HB3 GLU 78 HB3 GLU 78 12.102 19.138 -19.166
619 HG2 GLU 78 HG2 GLU 78 13.132 16.890 -18.669
620 HG3 GLU 78 HG3 GLU 78 11.791 16.128 -19.515
621 H ARG 79 HN ARG 79 8.532 18.875 -18.129
622 HA ARG 79 HA ARG 79 8.528 21.604 -17.445
623 HE ARG 79 HE ARG 79 4.601 19.938 -19.622
624 HB2 ARG 79 HB2 ARG 79 6.812 20.431 -18.697
625 HB3 ARG 79 HB3 ARG 79 6.462 19.387 -17.318
626 HG2 ARG 79 HG2 ARG 79 5.582 21.389 -16.079
627 HG3 ARG 79 HG3 ARG 79 5.791 22.341 -17.565
628 HD2 ARG 79 HD2 ARG 79 4.170 19.758 -17.311
629 HD3 ARG 79 HD3 ARG 79 3.463 21.372 -17.273
630 HH11 ARG 79 HH11 ARG 79 3.151 22.986 -18.465
631 HH12 ARG 79 HH12 ARG 79 2.825 23.560 -20.059
632 HH21 ARG 79 HH21 ARG 79 4.216 20.648 -21.597
633 HH22 ARG 79 HH22 ARG 79 3.437 22.182 -21.940
634 H GLN 80 HN GLN 80 7.635 18.755 -15.343
635 HA GLN 80 HA GLN 80 7.277 20.351 -13.020
636 HB2 GLN 80 HB2 GLN 80 7.843 17.392 -13.424
637 HB3 GLN 80 HB3 GLN 80 7.628 18.109 -11.817
638 HG2 GLN 80 HG2 GLN 80 5.408 18.874 -12.330
639 HG3 GLN 80 HG3 GLN 80 5.576 18.465 -14.032
640 HE21 GLN 80 HE22 GLN 80 5.294 16.345 -14.726
641 HE22 GLN 80 HE21 GLN 80 4.536 15.130 -13.697
642 H CYS 81 HN CYS 81 10.218 18.741 -14.341
643 HA CYS 81 HA CYS 81 11.879 19.344 -12.102
644 HG CYS 81 HG CYS 81 11.200 16.954 -14.269
645 HB2 CYS 81 HB2 CYS 81 12.612 18.977 -15.036
646 HB3 CYS 81 HB3 CYS 81 13.753 18.981 -13.679
647 H LYS 82 HN LYS 82 10.986 21.384 -14.938
648 HA LYS 82 HA LYS 82 12.869 23.454 -14.268
649 HB2 LYS 82 HB2 LYS 82 10.359 23.397 -16.001
650 HB3 LYS 82 HB3 LYS 82 11.318 24.859 -15.736
651 HG2 LYS 82 HG2 LYS 82 13.321 23.751 -16.631
652 HG3 LYS 82 HG3 LYS 82 12.384 22.279 -16.944
653 HD2 LYS 82 HD2 LYS 82 10.858 23.562 -18.429
654 HD3 LYS 82 HD3 LYS 82 11.803 25.028 -18.148
655 HE2 LYS 82 HE2 LYS 82 12.778 22.461 -19.468
656 HE3 LYS 82 HE3 LYS 82 12.354 23.969 -20.290
657 HZ1 LYS 82 HZ1 LYS 82 14.171 25.025 -18.931
658 HZ2 LYS 82 HZ2 LYS 82 14.656 23.524 -18.498
659 HZ3 LYS 82 HZ3 LYS 82 14.685 23.954 -20.072
660 H VAL 83 HN VAL 83 9.389 22.852 -13.630
661 HA VAL 83 HA VAL 83 8.920 25.212 -12.202
662 HB VAL 83 HB VAL 83 7.583 22.491 -12.170
663 HG11 VAL 83 HG11 VAL 83 5.601 23.597 -11.119
664 HG12 VAL 83 HG12 VAL 83 6.971 23.446 -10.025
665 HG13 VAL 83 HG13 VAL 83 6.613 25.020 -10.776
666 HG21 VAL 83 HG21 VAL 83 6.645 25.165 -13.289
667 HG22 VAL 83 HG22 VAL 83 7.461 23.932 -14.264
668 HG23 VAL 83 HG23 VAL 83 5.892 23.575 -13.533
669 H ALA 84 HN ALA 84 10.391 22.174 -11.101
670 HA ALA 84 HA ALA 84 10.415 22.478 -8.355
671 HB1 ALA 84 HB1 ALA 84 11.396 20.615 -9.808
672 HB2 ALA 84 HB2 ALA 84 12.842 21.627 -9.985
673 HB3 ALA 84 HB3 ALA 84 12.364 21.071 -8.387
674 H GLY 85 HN GLY 85 12.412 24.240 -10.736
675 HA2 GLY 85 HA2 GLY 85 13.991 25.504 -8.548
676 HA3 GLY 85 HA3 GLY 85 14.415 25.440 -10.260
677 H LYS 86 HN LYS 86 12.740 26.556 -11.758
678 HA LYS 86 HA LYS 86 11.414 28.861 -10.623
679 HB2 LYS 86 HB2 LYS 86 12.841 30.616 -11.346
680 HB3 LYS 86 HB3 LYS 86 13.840 29.505 -10.447
681 HG2 LYS 86 HG2 LYS 86 13.804 29.969 -13.444
682 HG3 LYS 86 HG3 LYS 86 15.085 30.321 -12.295
683 HD2 LYS 86 HD2 LYS 86 15.318 27.807 -11.915
684 HD3 LYS 86 HD3 LYS 86 14.188 27.591 -13.274
685 HE2 LYS 86 HE2 LYS 86 15.792 29.075 -14.638
686 HE3 LYS 86 HE3 LYS 86 16.948 28.875 -13.316
687 HZ1 LYS 86 HZ1 LYS 86 16.806 26.455 -13.703
688 HZ2 LYS 86 HZ2 LYS 86 15.744 26.705 -14.942
689 HZ3 LYS 86 HZ3 LYS 86 17.291 27.235 -15.053
690 H THR 87 HN THR 87 10.909 26.675 -12.529
691 HA THR 87 HA THR 87 9.771 26.278 -14.442
692 HB THR 87 HB THR 87 8.616 29.052 -14.013
693 HG1 THR 87 HG1 THR 87 7.454 28.201 -12.380
694 HG21 THR 87 HG21 THR 87 6.461 27.812 -14.578
695 HG22 THR 87 HG22 THR 87 7.578 27.993 -15.928
696 HG23 THR 87 HG23 THR 87 7.466 26.436 -15.092
697 H GLN 88 HN GLN 88 12.429 27.131 -14.949
698 HA GLN 88 HA GLN 88 12.159 27.969 -17.715
699 HB2 GLN 88 HB2 GLN 88 14.002 29.385 -15.736
700 HB3 GLN 88 HB3 GLN 88 14.176 29.486 -17.479
701 HG2 GLN 88 HG2 GLN 88 11.714 30.474 -15.976
702 HG3 GLN 88 HG3 GLN 88 13.099 31.467 -16.383
703 HE21 GLN 88 HE22 GLN 88 10.392 29.628 -17.772
704 HE22 GLN 88 HE21 GLN 88 10.400 30.435 -19.337
Start of MODEL 12
1 HA MET 1 HA MET 1 3.878 -1.836 -2.553
2 H1 MET 1 H1 MET 1 2.108 -2.047 -0.988
3 H2 MET 1 H2 MET 1 3.514 -1.641 -0.221
4 H3 MET 1 H3 MET 1 2.348 -0.512 -0.436
5 HB2 MET 1 HB2 MET 1 1.627 -1.129 -3.326
6 HB3 MET 1 HB3 MET 1 1.960 0.524 -2.789
7 HG2 MET 1 HG2 MET 1 2.324 0.304 -5.195
8 HG3 MET 1 HG3 MET 1 3.839 0.682 -4.384
9 HE1 MET 1 HE1 MET 1 5.100 -1.371 -7.403
10 HE2 MET 1 HE2 MET 1 3.738 -0.227 -7.370
11 HE3 MET 1 HE3 MET 1 5.226 0.137 -6.469
12 H GLU 2 HN GLU 2 5.809 -0.929 -3.077
13 HA GLU 2 HA GLU 2 6.648 1.592 -1.779
14 HB2 GLU 2 HB2 GLU 2 8.312 -0.968 -1.875
15 HB3 GLU 2 HB3 GLU 2 8.785 0.598 -1.229
16 HG2 GLU 2 HG2 GLU 2 8.280 -0.561 0.702
17 HG3 GLU 2 HG3 GLU 2 6.796 0.342 0.416
18 H TRP 3 HN TRP 3 8.456 2.547 -3.018
19 HA TRP 3 HA TRP 3 8.294 1.786 -5.897
20 HD1 TRP 3 HD1 TRP 3 6.108 4.129 -3.096
21 HE1 TRP 3 HE1 TRP 3 3.612 3.715 -3.472
22 HE3 TRP 3 HE3 TRP 3 6.221 3.064 -8.098
23 HZ2 TRP 3 HZ2 TRP 3 1.870 3.009 -5.683
24 HZ3 TRP 3 HZ3 TRP 3 4.137 2.499 -9.311
25 HH2 TRP 3 HH2 TRP 3 1.957 2.469 -8.116
26 HB2 TRP 3 HB2 TRP 3 8.159 4.580 -4.709
27 HB3 TRP 3 HB3 TRP 3 7.987 4.148 -6.400
28 H LEU 4 HN LEU 4 9.990 2.943 -7.164
29 HA LEU 4 HA LEU 4 12.587 3.083 -5.705
30 HG LEU 4 HG LEU 4 14.120 2.954 -8.509
31 HB2 LEU 4 HB2 LEU 4 12.341 1.024 -6.967
32 HB3 LEU 4 HB3 LEU 4 11.833 1.934 -8.397
33 HD11 LEU 4 HD11 LEU 4 14.898 2.684 -6.214
34 HD12 LEU 4 HD12 LEU 4 14.750 0.919 -6.326
35 HD13 LEU 4 HD13 LEU 4 15.961 1.786 -7.295
36 HD21 LEU 4 HD21 LEU 4 13.449 0.990 -9.873
37 HD22 LEU 4 HD22 LEU 4 15.168 0.949 -9.458
38 HD23 LEU 4 HD23 LEU 4 14.024 -0.093 -8.586
39 H VAL 5 HN VAL 5 13.637 4.856 -6.025
40 HA VAL 5 HA VAL 5 12.809 7.002 -7.899
41 HB VAL 5 HB VAL 5 15.249 6.869 -6.057
42 HG11 VAL 5 HG11 VAL 5 15.471 8.538 -7.807
43 HG12 VAL 5 HG12 VAL 5 13.850 9.163 -7.455
44 HG13 VAL 5 HG13 VAL 5 15.165 9.347 -6.270
45 HG21 VAL 5 HG21 VAL 5 13.892 8.357 -4.518
46 HG22 VAL 5 HG22 VAL 5 12.457 7.992 -5.509
47 HG23 VAL 5 HG23 VAL 5 13.280 6.710 -4.607
48 H LYS 6 HN LYS 6 13.322 6.566 -9.907
49 HA LYS 6 HA LYS 6 15.844 5.175 -10.701
50 HB2 LYS 6 HB2 LYS 6 13.162 5.565 -11.925
51 HB3 LYS 6 HB3 LYS 6 14.537 5.278 -12.969
52 HG2 LYS 6 HG2 LYS 6 14.523 3.408 -10.684
53 HG3 LYS 6 HG3 LYS 6 13.043 3.305 -11.611
54 HD2 LYS 6 HD2 LYS 6 14.740 1.705 -12.358
55 HD3 LYS 6 HD3 LYS 6 14.238 2.807 -13.644
56 HE2 LYS 6 HE2 LYS 6 16.285 4.147 -13.381
57 HE3 LYS 6 HE3 LYS 6 16.769 3.183 -11.975
58 HZ1 LYS 6 HZ1 LYS 6 16.986 1.263 -13.447
59 HZ2 LYS 6 HZ2 LYS 6 16.541 2.151 -14.748
60 HZ3 LYS 6 HZ3 LYS 6 17.929 2.482 -13.966
61 H LYS 7 HN LYS 7 14.387 8.348 -10.624
62 HA LYS 7 HA LYS 7 16.805 9.530 -11.744
63 HB2 LYS 7 HB2 LYS 7 14.057 10.186 -12.873
64 HB3 LYS 7 HB3 LYS 7 15.438 11.265 -12.978
65 HG2 LYS 7 HG2 LYS 7 16.711 9.639 -14.278
66 HG3 LYS 7 HG3 LYS 7 15.391 8.464 -14.158
67 HD2 LYS 7 HD2 LYS 7 13.867 10.150 -15.261
68 HD3 LYS 7 HD3 LYS 7 15.273 11.179 -15.545
69 HE2 LYS 7 HE2 LYS 7 14.989 8.295 -16.514
70 HE3 LYS 7 HE3 LYS 7 14.542 9.719 -17.473
71 HZ1 LYS 7 HZ1 LYS 7 17.282 9.110 -16.509
72 HZ2 LYS 7 HZ2 LYS 7 16.752 8.958 -18.040
73 HZ3 LYS 7 HZ3 LYS 7 16.861 10.437 -17.373
74 H SER 8 HN SER 8 17.080 11.620 -10.756
75 HA SER 8 HA SER 8 14.995 12.699 -8.975
76 HG SER 8 HG SER 8 18.622 12.187 -8.561
77 HB2 SER 8 HB2 SER 8 16.902 12.951 -7.252
78 HB3 SER 8 HB3 SER 8 16.146 11.361 -7.423
79 H CYS 9 HN CYS 9 15.214 14.941 -8.822
80 HA CYS 9 HA CYS 9 17.197 16.222 -10.652
81 HG CYS 9 HG CYS 9 13.704 16.399 -12.585
82 HB2 CYS 9 HB2 CYS 9 14.297 16.955 -10.076
83 HB3 CYS 9 HB3 CYS 9 15.397 17.806 -11.172
84 H CYS 10 HN CYS 10 18.709 16.748 -9.114
85 HA CYS 10 HA CYS 10 18.329 17.809 -6.549
86 HG CYS 10 HG CYS 10 22.016 16.467 -7.442
87 HB2 CYS 10 HB2 CYS 10 20.581 18.382 -8.522
88 HB3 CYS 10 HB3 CYS 10 20.643 18.595 -6.766
89 H ASN 11 HN ASN 11 18.257 19.940 -5.725
90 HA ASN 11 HA ASN 11 18.012 22.268 -7.508
91 HB2 ASN 11 HB2 ASN 11 15.819 22.681 -7.332
92 HB3 ASN 11 HB3 ASN 11 15.709 20.926 -7.331
93 HD21 ASN 11 HD22 ASN 11 15.750 19.905 -4.995
94 HD22 ASN 11 HD21 ASN 11 14.799 20.738 -3.821
95 H LYS 12 HN LYS 12 18.053 24.186 -6.385
96 HA LYS 12 HA LYS 12 18.247 24.143 -3.420
97 HB2 LYS 12 HB2 LYS 12 20.258 25.043 -5.455
98 HB3 LYS 12 HB3 LYS 12 19.927 26.246 -4.222
99 HG2 LYS 12 HG2 LYS 12 20.576 23.365 -3.543
100 HG3 LYS 12 HG3 LYS 12 21.816 24.616 -3.749
101 HD2 LYS 12 HD2 LYS 12 20.768 25.997 -1.970
102 HD3 LYS 12 HD3 LYS 12 19.496 24.807 -1.765
103 HE2 LYS 12 HE2 LYS 12 21.064 24.469 0.008
104 HE3 LYS 12 HE3 LYS 12 21.192 23.095 -1.094
105 HZ1 LYS 12 HZ1 LYS 12 23.200 24.114 -2.013
106 HZ2 LYS 12 HZ2 LYS 12 23.059 25.401 -1.011
107 HZ3 LYS 12 HZ3 LYS 12 23.358 23.922 -0.405
108 H GLN 13 HN GLN 13 16.910 25.481 -6.292
109 HA GLN 13 HA GLN 13 16.669 28.152 -5.388
110 HB2 GLN 13 HB2 GLN 13 15.009 26.778 -7.557
111 HB3 GLN 13 HB3 GLN 13 15.315 28.493 -7.370
112 HG2 GLN 13 HG2 GLN 13 16.797 28.076 -9.023
113 HG3 GLN 13 HG3 GLN 13 17.869 27.780 -7.668
114 HE21 GLN 13 HE22 GLN 13 17.147 26.612 -10.660
115 HE22 GLN 13 HE21 GLN 13 17.461 24.912 -10.418
116 H ASP 14 HN ASP 14 14.578 25.292 -5.031
117 HA ASP 14 HA ASP 14 12.764 26.986 -3.322
118 HB2 ASP 14 HB2 ASP 14 11.839 26.630 -5.662
119 HB3 ASP 14 HB3 ASP 14 11.776 24.906 -5.311
120 H ASN 15 HN ASN 15 14.808 24.439 -3.330
121 HA ASN 15 HA ASN 15 15.221 22.585 -2.282
122 HB2 ASN 15 HB2 ASN 15 14.932 23.912 -0.263
123 HB3 ASN 15 HB3 ASN 15 13.217 23.503 -0.216
124 HD21 ASN 15 HD22 ASN 15 12.660 21.701 0.858
125 HD22 ASN 15 HD21 ASN 15 13.756 20.442 1.416
126 H ARG 16 HN ARG 16 12.416 23.062 -3.845
127 HA ARG 16 HA ARG 16 10.979 20.581 -3.447
128 HE ARG 16 HE ARG 16 8.871 23.979 -5.372
129 HB2 ARG 16 HB2 ARG 16 9.963 22.625 -4.161
130 HB3 ARG 16 HB3 ARG 16 10.996 22.691 -5.605
131 HG2 ARG 16 HG2 ARG 16 9.860 20.560 -6.398
132 HG3 ARG 16 HG3 ARG 16 8.771 20.718 -5.020
133 HD2 ARG 16 HD2 ARG 16 9.122 22.591 -7.381
134 HD3 ARG 16 HD3 ARG 16 7.672 21.711 -6.928
135 HH11 ARG 16 HH21 ARG 16 5.815 22.313 -6.352
136 HH12 ARG 16 HH22 ARG 16 4.857 23.525 -5.577
137 HH21 ARG 16 HH11 ARG 16 7.668 25.385 -4.405
138 HH22 ARG 16 HH12 ARG 16 5.918 25.343 -4.418
139 H HIS 17 HN HIS 17 12.023 18.847 -3.890
140 HA HIS 17 HA HIS 17 13.782 18.504 -6.265
141 HD1 HIS 17 HD1 HIS 17 14.484 18.119 -2.200
142 HD2 HIS 17 HD2 HIS 17 16.332 17.103 -5.829
143 HE1 HIS 17 HE1 HIS 17 16.918 18.880 -2.000
144 HB2 HIS 17 HB2 HIS 17 13.009 16.671 -3.959
145 HB3 HIS 17 HB3 HIS 17 13.888 16.102 -5.379
146 H VAL 18 HN VAL 18 13.273 16.634 -7.730
147 HA VAL 18 HA VAL 18 10.482 15.748 -7.744
148 HB VAL 18 HB VAL 18 11.793 16.588 -10.349
149 HG11 VAL 18 HG11 VAL 18 9.553 16.511 -11.292
150 HG12 VAL 18 HG12 VAL 18 9.912 14.976 -10.511
151 HG13 VAL 18 HG13 VAL 18 8.846 16.142 -9.707
152 HG21 VAL 18 HG21 VAL 18 11.581 18.688 -9.164
153 HG22 VAL 18 HG22 VAL 18 10.303 18.606 -10.376
154 HG23 VAL 18 HG23 VAL 18 9.915 18.302 -8.678
155 H LEU 19 HN LEU 19 10.332 13.690 -8.573
156 HA LEU 19 HA LEU 19 12.825 12.377 -9.450
157 HG LEU 19 HG LEU 19 10.848 12.345 -6.136
158 HB2 LEU 19 HB2 LEU 19 11.736 10.515 -7.657
159 HB3 LEU 19 HB3 LEU 19 13.293 11.296 -7.616
160 HD11 LEU 19 HD11 LEU 19 13.203 10.698 -5.147
161 HD12 LEU 19 HD12 LEU 19 11.845 11.313 -4.172
162 HD13 LEU 19 HD13 LEU 19 11.555 10.102 -5.426
163 HD21 LEU 19 HD21 LEU 19 13.772 13.181 -6.295
164 HD22 LEU 19 HD22 LEU 19 12.317 14.192 -6.127
165 HD23 LEU 19 HD23 LEU 19 12.932 13.324 -4.737
166 H MET 20 HN MET 20 12.412 10.075 -10.076
167 HA MET 20 HA MET 20 9.774 9.896 -11.467
168 HB2 MET 20 HB2 MET 20 11.746 10.171 -12.960
169 HB3 MET 20 HB3 MET 20 12.425 8.674 -12.286
170 HG2 MET 20 HG2 MET 20 10.415 7.443 -13.109
171 HG3 MET 20 HG3 MET 20 9.773 8.959 -13.741
172 HE1 MET 20 HE1 MET 20 13.489 7.490 -13.868
173 HE2 MET 20 HE2 MET 20 12.399 6.123 -14.127
174 HE3 MET 20 HE3 MET 20 13.433 6.696 -15.457
175 H LEU 21 HN LEU 21 8.595 8.728 -10.129
176 HA LEU 21 HA LEU 21 9.719 6.704 -8.290
177 HG LEU 21 HG LEU 21 8.529 7.064 -6.246
178 HB2 LEU 21 HB2 LEU 21 7.023 8.042 -8.707
179 HB3 LEU 21 HB3 LEU 21 7.050 6.410 -8.044
180 HD11 LEU 21 HD11 LEU 21 9.824 8.885 -7.085
181 HD12 LEU 21 HD12 LEU 21 8.387 9.812 -7.543
182 HD13 LEU 21 HD13 LEU 21 8.813 9.610 -5.829
183 HD21 LEU 21 HD21 LEU 21 6.865 8.447 -4.988
184 HD22 LEU 21 HD22 LEU 21 6.016 8.774 -6.517
185 HD23 LEU 21 HD23 LEU 21 6.117 7.121 -5.889
186 H CYS 22 HN CYS 22 9.567 4.549 -8.684
187 HA CYS 22 HA CYS 22 8.035 3.627 -11.054
188 HG CYS 22 HG CYS 22 10.878 5.473 -11.028
189 HB2 CYS 22 HB2 CYS 22 10.955 2.961 -10.429
190 HB3 CYS 22 HB3 CYS 22 10.007 2.378 -11.806
191 H ASP 23 HN ASP 23 7.904 1.243 -11.080
192 HA ASP 23 HA ASP 23 7.166 -0.043 -8.621
193 HB2 ASP 23 HB2 ASP 23 6.405 -1.172 -10.508
194 HB3 ASP 23 HB3 ASP 23 7.858 -0.831 -11.435
195 H ALA 24 HN ALA 24 8.424 -1.512 -7.304
196 HA ALA 24 HA ALA 24 11.195 -0.855 -6.894
197 HB1 ALA 24 HB1 ALA 24 9.469 -3.085 -5.747
198 HB2 ALA 24 HB2 ALA 24 11.082 -2.610 -5.170
199 HB3 ALA 24 HB3 ALA 24 9.727 -1.473 -5.039
200 H GLY 25 HN GLY 25 11.823 -1.216 -9.144
201 HA2 GLY 25 HA2 GLY 25 13.401 -3.300 -9.907
202 HA3 GLY 25 HA3 GLY 25 11.763 -3.905 -10.248
203 H GLY 26 HN GLY 26 11.093 -0.883 -10.720
204 HA2 GLY 26 HA2 GLY 26 11.344 0.741 -12.337
205 HA3 GLY 26 HA3 GLY 26 12.494 -0.268 -13.212
206 H ALA 27 HN ALA 27 9.656 -2.128 -12.571
207 HA ALA 27 HA ALA 27 9.264 -2.375 -15.384
208 HB1 ALA 27 HB1 ALA 27 7.513 -3.389 -13.105
209 HB2 ALA 27 HB2 ALA 27 7.538 -3.997 -14.770
210 HB3 ALA 27 HB3 ALA 27 8.964 -4.209 -13.737
211 H ILE 28 HN ILE 28 7.868 -0.088 -13.244
212 HA ILE 28 HA ILE 28 5.863 0.816 -15.202
213 HB ILE 28 HB ILE 28 5.303 0.328 -12.229
214 HG12 ILE 28 HG12 ILE 28 4.077 -1.013 -14.681
215 HG13 ILE 28 HG13 ILE 28 5.160 -1.768 -13.509
216 HG21 ILE 28 HG21 ILE 28 3.465 1.531 -14.351
217 HG22 ILE 28 HG22 ILE 28 3.036 1.214 -12.656
218 HG23 ILE 28 HG23 ILE 28 4.236 2.424 -13.016
219 HD11 ILE 28 HD11 ILE 28 2.975 -2.516 -12.996
220 HD12 ILE 28 HD12 ILE 28 3.445 -1.375 -11.718
221 HD13 ILE 28 HD13 ILE 28 2.310 -0.878 -13.003
222 H LYS 29 HN LYS 29 5.694 3.195 -14.975
223 HA LYS 29 HA LYS 29 7.616 4.415 -13.069
224 HB2 LYS 29 HB2 LYS 29 7.673 4.922 -16.074
225 HB3 LYS 29 HB3 LYS 29 8.585 5.785 -14.831
226 HG2 LYS 29 HG2 LYS 29 9.475 3.388 -14.176
227 HG3 LYS 29 HG3 LYS 29 8.927 2.916 -15.778
228 HD2 LYS 29 HD2 LYS 29 10.472 4.415 -16.848
229 HD3 LYS 29 HD3 LYS 29 10.721 5.324 -15.364
230 HE2 LYS 29 HE2 LYS 29 12.703 4.026 -15.742
231 HE3 LYS 29 HE3 LYS 29 11.903 3.408 -14.313
232 HZ1 LYS 29 HZ1 LYS 29 11.648 2.198 -17.029
233 HZ2 LYS 29 HZ2 LYS 29 12.669 1.656 -15.888
234 HZ3 LYS 29 HZ3 LYS 29 11.062 1.544 -15.639
235 H MET 30 HN MET 30 7.272 6.495 -12.560
236 HA MET 30 HA MET 30 4.842 7.984 -13.280
237 HB2 MET 30 HB2 MET 30 5.543 6.863 -10.521
238 HB3 MET 30 HB3 MET 30 4.367 8.136 -10.809
239 HG2 MET 30 HG2 MET 30 3.027 6.594 -12.212
240 HG3 MET 30 HG3 MET 30 4.194 5.309 -11.899
241 HE1 MET 30 HE1 MET 30 1.326 7.096 -8.718
242 HE2 MET 30 HE2 MET 30 2.791 7.979 -9.188
243 HE3 MET 30 HE3 MET 30 1.502 7.691 -10.385
244 H ILE 31 HN ILE 31 4.971 10.068 -11.828
245 HA ILE 31 HA ILE 31 7.784 11.006 -11.493
246 HB ILE 31 HB ILE 31 5.465 12.567 -12.611
247 HG12 ILE 31 HG12 ILE 31 7.990 12.089 -14.207
248 HG13 ILE 31 HG13 ILE 31 6.835 10.766 -14.134
249 HG21 ILE 31 HG21 ILE 31 8.390 13.328 -12.144
250 HG22 ILE 31 HG22 ILE 31 7.242 14.300 -13.079
251 HG23 ILE 31 HG23 ILE 31 6.958 14.043 -11.364
252 HD11 ILE 31 HD11 ILE 31 6.049 13.579 -14.898
253 HD12 ILE 31 HD12 ILE 31 6.400 12.258 -16.041
254 HD13 ILE 31 HD13 ILE 31 5.033 12.131 -14.908
255 H ALA 32 HN ALA 32 7.979 12.303 -9.537
256 HA ALA 32 HA ALA 32 5.476 13.148 -8.246
257 HB1 ALA 32 HB1 ALA 32 6.102 11.035 -7.066
258 HB2 ALA 32 HB2 ALA 32 7.679 11.778 -6.659
259 HB3 ALA 32 HB3 ALA 32 6.178 12.472 -6.029
260 H GLU 33 HN GLU 33 5.657 15.166 -7.631
261 HA GLU 33 HA GLU 33 8.269 16.571 -7.616
262 HB2 GLU 33 HB2 GLU 33 6.227 17.459 -8.913
263 HB3 GLU 33 HB3 GLU 33 5.380 17.593 -7.366
264 HG2 GLU 33 HG2 GLU 33 7.211 19.163 -6.607
265 HG3 GLU 33 HG3 GLU 33 7.846 19.130 -8.252
266 H VAL 34 HN VAL 34 9.108 17.090 -5.556
267 HA VAL 34 HA VAL 34 7.442 16.482 -3.192
268 HB VAL 34 HB VAL 34 9.046 14.955 -2.295
269 HG11 VAL 34 HG11 VAL 34 7.337 14.012 -3.899
270 HG12 VAL 34 HG12 VAL 34 8.598 14.005 -5.145
271 HG13 VAL 34 HG13 VAL 34 8.791 13.026 -3.681
272 HG21 VAL 34 HG21 VAL 34 11.142 15.809 -3.109
273 HG22 VAL 34 HG22 VAL 34 10.991 14.111 -3.548
274 HG23 VAL 34 HG23 VAL 34 10.727 15.361 -4.785
275 H LYS 35 HN LYS 35 8.831 16.981 -1.162
276 HA LYS 35 HA LYS 35 10.918 18.984 -1.618
277 HB2 LYS 35 HB2 LYS 35 8.713 20.190 -1.159
278 HB3 LYS 35 HB3 LYS 35 8.714 19.471 0.451
279 HG2 LYS 35 HG2 LYS 35 10.615 20.694 1.120
280 HG3 LYS 35 HG3 LYS 35 11.164 20.959 -0.535
281 HD2 LYS 35 HD2 LYS 35 8.736 22.332 0.687
282 HD3 LYS 35 HD3 LYS 35 10.363 23.019 0.558
283 HE2 LYS 35 HE2 LYS 35 10.155 22.447 -1.994
284 HE3 LYS 35 HE3 LYS 35 8.415 22.352 -1.679
285 HZ1 LYS 35 HZ1 LYS 35 10.188 24.686 -1.258
286 HZ2 LYS 35 HZ2 LYS 35 9.114 24.552 -2.435
287 HZ3 LYS 35 HZ3 LYS 35 8.573 24.684 -0.874
288 H SER 36 HN SER 36 12.475 18.823 0.053
289 HA SER 36 HA SER 36 12.239 16.257 1.582
290 HG SER 36 HG SER 36 14.068 15.856 -1.579
291 HB2 SER 36 HB2 SER 36 14.823 17.073 0.318
292 HB3 SER 36 HB3 SER 36 14.138 15.463 0.606
293 H ASP 37 HN ASP 37 13.476 15.994 3.442
294 HA ASP 37 HA ASP 37 14.900 18.423 4.467
295 HB2 ASP 37 HB2 ASP 37 12.761 17.915 5.642
296 HB3 ASP 37 HB3 ASP 37 13.402 16.331 6.078
297 H PHE 38 HN PHE 38 15.492 15.605 3.038
298 HA PHE 38 HA PHE 38 18.084 15.134 4.306
299 HD1 PHE 38 HD2 PHE 38 14.226 13.771 5.080
300 HD2 PHE 38 HD1 PHE 38 18.103 13.128 6.853
301 HE1 PHE 38 HE2 PHE 38 13.206 13.884 7.341
302 HE2 PHE 38 HE1 PHE 38 17.082 13.249 9.112
303 HZ PHE 38 HZ PHE 38 14.633 13.615 9.361
304 HB2 PHE 38 HB2 PHE 38 16.125 12.867 3.762
305 HB3 PHE 38 HB3 PHE 38 17.729 12.727 4.451
306 H ALA 39 HN ALA 39 19.436 13.873 2.728
307 HA ALA 39 HA ALA 39 19.013 14.646 0.016
308 HB1 ALA 39 HB1 ALA 39 20.987 13.226 -0.437
309 HB2 ALA 39 HB2 ALA 39 21.260 14.269 0.971
310 HB3 ALA 39 HB3 ALA 39 20.883 12.543 1.197
311 H VAL 40 HN VAL 40 18.452 13.368 -1.801
312 HA VAL 40 HA VAL 40 17.635 10.586 -1.514
313 HB VAL 40 HB VAL 40 15.576 11.664 -0.890
314 HG11 VAL 40 HG11 VAL 40 14.354 13.275 -2.282
315 HG12 VAL 40 HG12 VAL 40 15.885 13.950 -1.721
316 HG13 VAL 40 HG13 VAL 40 15.726 13.382 -3.399
317 HG21 VAL 40 HG21 VAL 40 14.041 10.852 -2.566
318 HG22 VAL 40 HG22 VAL 40 15.307 10.868 -3.811
319 HG23 VAL 40 HG23 VAL 40 15.410 9.738 -2.447
320 H LYS 41 HN LYS 41 18.037 9.512 -3.493
321 HA LYS 41 HA LYS 41 18.467 11.046 -5.927
322 HB2 LYS 41 HB2 LYS 41 20.731 10.694 -6.255
323 HB3 LYS 41 HB3 LYS 41 20.629 11.278 -4.610
324 HG2 LYS 41 HG2 LYS 41 21.145 8.442 -5.548
325 HG3 LYS 41 HG3 LYS 41 22.272 9.531 -4.740
326 HD2 LYS 41 HD2 LYS 41 20.872 9.409 -2.677
327 HD3 LYS 41 HD3 LYS 41 19.791 8.282 -3.530
328 HE2 LYS 41 HE2 LYS 41 21.689 6.735 -3.904
329 HE3 LYS 41 HE3 LYS 41 22.723 7.786 -2.918
330 HZ1 LYS 41 HZ1 LYS 41 20.213 6.507 -1.983
331 HZ2 LYS 41 HZ2 LYS 41 21.728 5.938 -1.660
332 HZ3 LYS 41 HZ3 LYS 41 21.251 7.379 -1.053
333 H VAL 42 HN VAL 42 19.352 9.434 -7.663
334 HA VAL 42 HA VAL 42 17.517 7.416 -8.086
335 HB VAL 42 HB VAL 42 20.362 7.678 -9.154
336 HG11 VAL 42 HG11 VAL 42 17.950 6.096 -10.147
337 HG12 VAL 42 HG12 VAL 42 19.349 6.481 -11.181
338 HG13 VAL 42 HG13 VAL 42 19.562 5.468 -9.756
339 HG21 VAL 42 HG21 VAL 42 17.697 8.876 -9.894
340 HG22 VAL 42 HG22 VAL 42 19.246 9.702 -9.642
341 HG23 VAL 42 HG23 VAL 42 19.008 8.748 -11.104
342 H GLY 43 HN GLY 43 17.482 5.204 -7.984
343 HA2 GLY 43 HA2 GLY 43 17.930 3.094 -7.273
344 HA3 GLY 43 HA3 GLY 43 19.548 3.593 -6.731
345 H ASP 44 HN ASP 44 16.433 5.172 -5.790
346 HA ASP 44 HA ASP 44 17.085 4.297 -2.938
347 HB2 ASP 44 HB2 ASP 44 15.892 6.921 -3.875
348 HB3 ASP 44 HB3 ASP 44 15.552 6.248 -2.290
349 H LEU 45 HN LEU 45 15.366 3.437 -1.662
350 HA LEU 45 HA LEU 45 12.926 2.750 -3.180
351 HG LEU 45 HG LEU 45 11.142 1.774 -1.384
352 HB2 LEU 45 HB2 LEU 45 14.136 1.214 -1.435
353 HB3 LEU 45 HB3 LEU 45 13.454 2.315 -0.238
354 HD11 LEU 45 HD11 LEU 45 11.000 -0.445 -2.389
355 HD12 LEU 45 HD12 LEU 45 12.100 0.561 -3.341
356 HD13 LEU 45 HD13 LEU 45 12.759 -0.664 -2.239
357 HD21 LEU 45 HD21 LEU 45 12.627 -0.262 0.309
358 HD22 LEU 45 HD22 LEU 45 11.743 1.176 0.883
359 HD23 LEU 45 HD23 LEU 45 10.859 -0.140 0.108
360 H LEU 46 HN LEU 46 10.845 3.558 -2.480
361 HA LEU 46 HA LEU 46 10.796 5.613 -0.347
362 HG LEU 46 HG LEU 46 11.293 6.725 -3.344
363 HB2 LEU 46 HB2 LEU 46 9.153 5.694 -2.908
364 HB3 LEU 46 HB3 LEU 46 8.905 6.719 -1.505
365 HD11 LEU 46 HD11 LEU 46 9.084 8.781 -2.824
366 HD12 LEU 46 HD12 LEU 46 10.431 8.997 -3.952
367 HD13 LEU 46 HD13 LEU 46 9.226 7.733 -4.244
368 HD21 LEU 46 HD21 LEU 46 10.749 8.514 -0.933
369 HD22 LEU 46 HD22 LEU 46 12.075 7.355 -1.108
370 HD23 LEU 46 HD23 LEU 46 12.033 8.787 -2.140
371 H SER 47 HN SER 47 9.434 5.008 1.182
372 HA SER 47 HA SER 47 7.277 3.021 0.576
373 HG SER 47 HG SER 47 9.711 1.259 2.483
374 HB2 SER 47 HB2 SER 47 8.871 3.291 3.152
375 HB3 SER 47 HB3 SER 47 7.609 2.094 2.798
376 HA PRO 48 HA PRO 48 4.913 6.529 1.915
377 HB2 PRO 48 HB2 PRO 48 2.408 5.412 2.284
378 HB3 PRO 48 HB3 PRO 48 3.126 5.747 0.686
379 HG2 PRO 48 HG2 PRO 48 3.085 3.128 2.204
380 HG3 PRO 48 HG3 PRO 48 2.722 3.413 0.471
381 HD2 PRO 48 HD2 PRO 48 5.150 2.507 1.308
382 HD3 PRO 48 HD3 PRO 48 5.012 3.655 -0.058
383 H LEU 49 HN LEU 49 4.114 7.527 3.677
384 HA LEU 49 HA LEU 49 3.839 6.033 6.263
385 HG LEU 49 HG LEU 49 6.593 7.053 5.417
386 HB2 LEU 49 HB2 LEU 49 4.857 8.857 5.722
387 HB3 LEU 49 HB3 LEU 49 4.512 8.215 7.325
388 HD11 LEU 49 HD11 LEU 49 6.941 8.905 7.810
389 HD12 LEU 49 HD12 LEU 49 8.252 8.119 6.901
390 HD13 LEU 49 HD13 LEU 49 7.211 9.312 6.100
391 HD21 LEU 49 HD21 LEU 49 7.430 5.933 7.501
392 HD22 LEU 49 HD22 LEU 49 5.996 6.532 8.371
393 HD23 LEU 49 HD23 LEU 49 5.821 5.378 7.021
394 H GLN 50 HN GLN 50 2.811 8.679 4.136
395 HA GLN 50 HA GLN 50 0.034 8.162 4.641
396 HB2 GLN 50 HB2 GLN 50 -0.516 10.580 5.140
397 HB3 GLN 50 HB3 GLN 50 0.216 9.701 6.473
398 HG2 GLN 50 HG2 GLN 50 2.328 10.799 6.197
399 HG3 GLN 50 HG3 GLN 50 1.864 11.446 4.621
400 HE21 GLN 50 HE22 GLN 50 2.059 13.654 5.022
401 HE22 GLN 50 HE21 GLN 50 1.107 14.496 6.216
402 H ASN 51 HN ASN 51 -1.173 9.896 3.083
403 HA ASN 51 HA ASN 51 -0.353 9.408 0.479
404 HB2 ASN 51 HB2 ASN 51 -2.601 10.168 1.043
405 HB3 ASN 51 HB3 ASN 51 -1.988 11.740 1.563
406 HD21 ASN 51 HD22 ASN 51 -1.622 13.364 -0.030
407 HD22 ASN 51 HD21 ASN 51 -1.888 13.091 -1.728
408 H ALA 52 HN ALA 52 0.733 12.088 2.549
409 HA ALA 52 HA ALA 52 2.184 13.273 0.305
410 HB1 ALA 52 HB1 ALA 52 0.360 14.639 1.222
411 HB2 ALA 52 HB2 ALA 52 1.115 14.574 2.833
412 HB3 ALA 52 HB3 ALA 52 1.937 15.395 1.491
413 H LEU 53 HN LEU 53 3.108 11.104 2.556
414 HA LEU 53 HA LEU 53 5.744 12.325 2.691
415 HG LEU 53 HG LEU 53 4.465 13.847 4.771
416 HB2 LEU 53 HB2 LEU 53 4.338 11.271 5.165
417 HB3 LEU 53 HB3 LEU 53 6.086 11.294 5.027
418 HD11 LEU 53 HD11 LEU 53 5.736 12.645 7.271
419 HD12 LEU 53 HD12 LEU 53 5.014 14.264 7.140
420 HD13 LEU 53 HD13 LEU 53 3.996 12.827 6.973
421 HD21 LEU 53 HD21 LEU 53 7.387 13.336 5.537
422 HD22 LEU 53 HD22 LEU 53 6.846 13.859 3.940
423 HD23 LEU 53 HD23 LEU 53 6.604 14.917 5.331
424 H TYR 54 HN TYR 54 7.279 10.861 2.249
425 HA TYR 54 HA TYR 54 6.695 7.965 2.565
426 HD1 TYR 54 HD1 TYR 54 5.186 10.082 0.152
427 HD2 TYR 54 HD2 TYR 54 6.710 6.127 -0.641
428 HE1 TYR 54 HE1 TYR 54 3.090 9.520 -1.014
429 HE2 TYR 54 HE2 TYR 54 4.627 5.566 -1.836
430 HH TYR 54 HH TYR 54 2.518 6.313 -2.527
431 HB2 TYR 54 HB2 TYR 54 7.833 9.359 0.103
432 HB3 TYR 54 HB3 TYR 54 8.088 7.663 0.451
433 H CYS 55 HN CYS 55 8.525 6.804 3.124
434 HA CYS 55 HA CYS 55 10.749 8.156 4.391
435 HG CYS 55 HG CYS 55 8.293 5.463 4.391
436 HB2 CYS 55 HB2 CYS 55 10.723 5.237 3.563
437 HB3 CYS 55 HB3 CYS 55 11.521 6.005 4.939
438 H ILE 56 HN ILE 56 13.044 7.757 3.662
439 HA ILE 56 HA ILE 56 13.322 7.385 0.708
440 HB ILE 56 HB ILE 56 15.133 8.858 2.656
441 HG12 ILE 56 HG12 ILE 56 13.545 10.193 0.432
442 HG13 ILE 56 HG13 ILE 56 12.840 9.981 2.033
443 HG21 ILE 56 HG21 ILE 56 16.267 9.701 0.536
444 HG22 ILE 56 HG22 ILE 56 16.499 7.992 0.788
445 HG23 ILE 56 HG23 ILE 56 15.298 8.546 -0.385
446 HD11 ILE 56 HD11 ILE 56 13.844 12.182 1.881
447 HD12 ILE 56 HD12 ILE 56 14.677 11.196 3.084
448 HD13 ILE 56 HD13 ILE 56 15.419 11.495 1.499
449 H ASN 57 HN ASN 57 14.838 6.054 -0.022
450 HA ASN 57 HA ASN 57 16.513 4.667 -0.312
451 HB2 ASN 57 HB2 ASN 57 17.862 6.243 1.051
452 HB3 ASN 57 HB3 ASN 57 17.483 5.311 2.504
453 HD21 ASN 57 HD22 ASN 57 18.850 5.135 -0.754
454 HD22 ASN 57 HD21 ASN 57 19.931 3.766 -0.450
455 H ARG 58 HN ARG 58 15.726 4.110 3.094
456 HA ARG 58 HA ARG 58 14.386 1.645 2.774
457 HE ARG 58 HE ARG 58 19.960 -0.049 5.447
458 HB2 ARG 58 HB2 ARG 58 16.011 0.062 3.626
459 HB3 ARG 58 HB3 ARG 58 16.721 0.850 2.232
460 HG2 ARG 58 HG2 ARG 58 17.878 2.445 3.960
461 HG3 ARG 58 HG3 ARG 58 17.380 1.254 5.170
462 HD2 ARG 58 HD2 ARG 58 18.522 -0.519 3.751
463 HD3 ARG 58 HD3 ARG 58 19.186 0.782 2.759
464 HH11 ARG 58 HH11 ARG 58 20.137 2.687 3.156
465 HH12 ARG 58 HH12 ARG 58 21.583 3.327 3.856
466 HH21 ARG 58 HH21 ARG 58 21.839 0.853 6.382
467 HH22 ARG 58 HH22 ARG 58 22.548 2.283 5.737
468 H GLU 59 HN GLU 59 14.729 4.421 4.382
469 HA GLU 59 HA GLU 59 15.124 3.443 7.140
470 HB2 GLU 59 HB2 GLU 59 14.972 6.230 5.891
471 HB3 GLU 59 HB3 GLU 59 15.298 5.911 7.587
472 HG2 GLU 59 HG2 GLU 59 17.078 5.170 5.240
473 HG3 GLU 59 HG3 GLU 59 17.348 6.436 6.431
474 H LYS 60 HN LYS 60 13.666 5.081 8.620
475 HA LYS 60 HA LYS 60 10.889 5.156 7.658
476 HB2 LYS 60 HB2 LYS 60 10.988 3.522 9.391
477 HB3 LYS 60 HB3 LYS 60 12.271 4.360 10.238
478 HG2 LYS 60 HG2 LYS 60 10.451 4.555 11.629
479 HG3 LYS 60 HG3 LYS 60 10.717 6.133 10.922
480 HD2 LYS 60 HD2 LYS 60 8.335 5.727 11.005
481 HD3 LYS 60 HD3 LYS 60 8.814 5.647 9.301
482 HE2 LYS 60 HE2 LYS 60 8.825 3.182 9.386
483 HE3 LYS 60 HE3 LYS 60 8.550 3.212 11.131
484 HZ1 LYS 60 HZ1 LYS 60 6.609 4.120 9.088
485 HZ2 LYS 60 HZ2 LYS 60 6.517 2.752 9.963
486 HZ3 LYS 60 HZ3 LYS 60 6.368 4.189 10.709
487 H LEU 61 HN LEU 61 13.452 6.692 9.673
488 HA LEU 61 HA LEU 61 11.923 9.034 10.102
489 HG LEU 61 HG LEU 61 15.533 8.625 9.657
490 HB2 LEU 61 HB2 LEU 61 13.802 9.923 11.241
491 HB3 LEU 61 HB3 LEU 61 13.452 8.294 11.791
492 HD11 LEU 61 HD11 LEU 61 16.064 9.317 12.575
493 HD12 LEU 61 HD12 LEU 61 17.296 9.151 11.302
494 HD13 LEU 61 HD13 LEU 61 16.102 10.451 11.206
495 HD21 LEU 61 HD21 LEU 61 15.420 6.872 12.145
496 HD22 LEU 61 HD22 LEU 61 15.026 6.352 10.495
497 HD23 LEU 61 HD23 LEU 61 16.676 6.822 10.892
498 H HIS 62 HN HIS 62 14.305 8.283 7.592
499 HA HIS 62 HA HIS 62 14.637 11.116 6.866
500 HD1 HIS 62 HD1 HIS 62 18.361 8.677 5.241
501 HD2 HIS 62 HD2 HIS 62 16.411 10.541 8.472
502 HE1 HIS 62 HE1 HIS 62 20.117 9.002 7.051
503 HB2 HIS 62 HB2 HIS 62 15.476 8.560 5.433
504 HB3 HIS 62 HB3 HIS 62 15.840 10.194 4.898
505 H THR 63 HN THR 63 12.934 12.154 5.814
506 HA THR 63 HA THR 63 11.154 10.547 4.078
507 HB THR 63 HB THR 63 9.407 12.106 5.046
508 HG1 THR 63 HG1 THR 63 9.969 13.188 6.932
509 HG21 THR 63 HG21 THR 63 9.744 9.759 5.832
510 HG22 THR 63 HG22 THR 63 10.882 10.355 7.056
511 HG23 THR 63 HG23 THR 63 9.174 10.837 7.120
512 H VAL 64 HN VAL 64 9.960 11.607 2.496
513 HA VAL 64 HA VAL 64 10.751 14.360 1.668
514 HB VAL 64 HB VAL 64 9.799 13.405 -0.629
515 HG11 VAL 64 HG11 VAL 64 12.088 13.137 -1.435
516 HG12 VAL 64 HG12 VAL 64 11.878 14.537 -0.371
517 HG13 VAL 64 HG13 VAL 64 12.675 13.069 0.242
518 HG21 VAL 64 HG21 VAL 64 10.550 11.191 -1.234
519 HG22 VAL 64 HG22 VAL 64 11.179 10.896 0.396
520 HG23 VAL 64 HG23 VAL 64 9.433 11.079 0.134
521 H LYS 65 HN LYS 65 9.005 15.630 1.252
522 HA LYS 65 HA LYS 65 6.315 14.629 1.992
523 HB2 LYS 65 HB2 LYS 65 7.178 16.727 3.054
524 HB3 LYS 65 HB3 LYS 65 7.307 17.460 1.444
525 HG2 LYS 65 HG2 LYS 65 4.827 17.111 1.147
526 HG3 LYS 65 HG3 LYS 65 4.744 16.502 2.803
527 HD2 LYS 65 HD2 LYS 65 5.661 19.293 1.985
528 HD3 LYS 65 HD3 LYS 65 4.047 18.870 2.573
529 HE2 LYS 65 HE2 LYS 65 5.044 18.070 4.719
530 HE3 LYS 65 HE3 LYS 65 6.644 18.559 4.148
531 HZ1 LYS 65 HZ1 LYS 65 5.658 20.247 5.555
532 HZ2 LYS 65 HZ2 LYS 65 5.836 20.849 4.053
533 HZ3 LYS 65 HZ3 LYS 65 4.358 20.394 4.586
534 H VAL 66 HN VAL 66 4.803 14.305 0.317
535 HA VAL 66 HA VAL 66 5.838 14.799 -2.444
536 HB VAL 66 HB VAL 66 3.461 13.149 -1.508
537 HG11 VAL 66 HG11 VAL 66 3.445 12.301 -3.857
538 HG12 VAL 66 HG12 VAL 66 3.042 14.016 -3.769
539 HG13 VAL 66 HG13 VAL 66 4.666 13.518 -4.294
540 HG21 VAL 66 HG21 VAL 66 4.851 11.224 -2.231
541 HG22 VAL 66 HG22 VAL 66 6.200 12.318 -2.577
542 HG23 VAL 66 HG23 VAL 66 5.629 12.108 -0.912
543 H LEU 67 HN LEU 67 4.890 16.276 -3.780
544 HA LEU 67 HA LEU 67 2.917 18.135 -2.512
545 HG LEU 67 HG LEU 67 6.274 18.236 -2.896
546 HB2 LEU 67 HB2 LEU 67 4.815 18.737 -4.793
547 HB3 LEU 67 HB3 LEU 67 3.889 19.878 -3.828
548 HD11 LEU 67 HD11 LEU 67 6.056 21.229 -3.351
549 HD12 LEU 67 HD12 LEU 67 7.518 20.280 -2.972
550 HD13 LEU 67 HD13 LEU 67 6.705 20.066 -4.525
551 HD21 LEU 67 HD21 LEU 67 4.787 18.634 -0.978
552 HD22 LEU 67 HD22 LEU 67 6.281 19.568 -0.849
553 HD23 LEU 67 HD23 LEU 67 4.771 20.373 -1.344
554 H SER 68 HN SER 68 3.812 16.367 -5.507
555 HA SER 68 HA SER 68 1.062 16.060 -6.313
556 HG SER 68 HG SER 68 1.254 18.508 -6.253
557 HB2 SER 68 HB2 SER 68 2.971 17.780 -7.981
558 HB3 SER 68 HB3 SER 68 1.477 17.065 -8.610
559 H ALA 69 HN ALA 69 1.039 14.514 -8.240
560 HA ALA 69 HA ALA 69 3.560 13.406 -9.109
561 HB1 ALA 69 HB1 ALA 69 3.343 12.177 -6.998
562 HB2 ALA 69 HB2 ALA 69 1.665 11.718 -7.399
563 HB3 ALA 69 HB3 ALA 69 3.023 11.074 -8.344
564 H SER 70 HN SER 70 3.213 11.718 -10.752
565 HA SER 70 HA SER 70 0.589 11.775 -12.152
566 HG SER 70 HG SER 70 1.264 14.424 -12.471
567 HB2 SER 70 HB2 SER 70 3.134 12.605 -13.583
568 HB3 SER 70 HB3 SER 70 1.464 12.827 -14.106
569 H SER 71 HN SER 71 0.550 10.234 -13.999
570 HA SER 71 HA SER 71 2.350 7.950 -13.836
571 HG SER 71 HG SER 71 -0.969 7.384 -15.124
572 HB2 SER 71 HB2 SER 71 0.509 8.850 -16.098
573 HB3 SER 71 HB3 SER 71 1.203 7.234 -15.870
574 H TYR 72 HN TYR 72 4.159 7.548 -15.411
575 HA TYR 72 HA TYR 72 5.551 10.010 -15.848
576 HD1 TYR 72 HD2 TYR 72 8.474 9.869 -15.500
577 HD2 TYR 72 HD1 TYR 72 7.109 7.814 -19.041
578 HE1 TYR 72 HE2 TYR 72 10.277 10.937 -16.801
579 HE2 TYR 72 HE1 TYR 72 8.912 8.887 -20.357
580 HH TYR 72 HH TYR 72 11.285 11.152 -18.898
581 HB2 TYR 72 HB2 TYR 72 6.817 8.033 -15.362
582 HB3 TYR 72 HB3 TYR 72 6.218 7.226 -16.820
583 H SER 73 HN SER 73 5.636 11.332 -17.484
584 HA SER 73 HA SER 73 5.392 10.400 -20.215
585 HG SER 73 HG SER 73 1.969 11.480 -19.995
586 HB2 SER 73 HB2 SER 73 3.706 12.709 -19.145
587 HB3 SER 73 HB3 SER 73 3.918 12.322 -20.860
588 HA PRO 74 HA PRO 74 9.017 12.800 -20.004
589 HB2 PRO 74 HB2 PRO 74 9.287 13.793 -22.623
590 HB3 PRO 74 HB3 PRO 74 9.779 12.166 -22.047
591 HG2 PRO 74 HG2 PRO 74 7.267 13.002 -23.492
592 HG3 PRO 74 HG3 PRO 74 8.232 11.509 -23.704
593 HD2 PRO 74 HD2 PRO 74 5.913 11.541 -22.278
594 HD3 PRO 74 HD3 PRO 74 7.299 10.527 -21.773
595 H ASP 75 HN ASP 75 6.535 14.561 -21.918
596 HA ASP 75 HA ASP 75 7.435 17.172 -21.328
597 HB2 ASP 75 HB2 ASP 75 5.831 16.670 -23.102
598 HB3 ASP 75 HB3 ASP 75 4.634 16.145 -21.913
599 H GLU 76 HN GLU 76 5.150 15.066 -19.551
600 HA GLU 76 HA GLU 76 4.376 17.021 -17.616
601 HB2 GLU 76 HB2 GLU 76 3.145 14.900 -18.336
602 HB3 GLU 76 HB3 GLU 76 4.317 13.988 -17.383
603 HG2 GLU 76 HG2 GLU 76 2.342 14.213 -16.083
604 HG3 GLU 76 HG3 GLU 76 3.563 15.234 -15.349
605 H TRP 77 HN TRP 77 6.995 14.636 -17.786
606 HA TRP 77 HA TRP 77 7.968 14.858 -15.102
607 HD1 TRP 77 HD1 TRP 77 10.427 13.957 -14.165
608 HE1 TRP 77 HE1 TRP 77 12.975 13.718 -14.271
609 HE3 TRP 77 HE3 TRP 77 11.003 13.707 -19.242
610 HZ2 TRP 77 HZ2 TRP 77 15.022 13.542 -16.309
611 HZ3 TRP 77 HZ3 TRP 77 13.260 13.498 -20.240
612 HH2 TRP 77 HH2 TRP 77 15.277 13.423 -18.788
613 HB2 TRP 77 HB2 TRP 77 8.612 12.981 -16.398
614 HB3 TRP 77 HB3 TRP 77 9.043 13.948 -17.775
615 H GLU 78 HN GLU 78 9.040 16.428 -18.192
616 HA GLU 78 HA GLU 78 10.913 18.038 -16.782
617 HB2 GLU 78 HB2 GLU 78 9.761 18.286 -19.585
618 HB3 GLU 78 HB3 GLU 78 11.071 19.306 -18.959
619 HG2 GLU 78 HG2 GLU 78 12.385 17.219 -18.421
620 HG3 GLU 78 HG3 GLU 78 11.146 16.268 -19.221
621 H ARG 79 HN ARG 79 7.562 18.696 -17.716
622 HA ARG 79 HA ARG 79 7.353 21.400 -16.939
623 HE ARG 79 HE ARG 79 2.947 18.771 -17.149
624 HB2 ARG 79 HB2 ARG 79 5.592 18.964 -16.865
625 HB3 ARG 79 HB3 ARG 79 5.035 20.403 -16.009
626 HG2 ARG 79 HG2 ARG 79 4.944 21.727 -17.966
627 HG3 ARG 79 HG3 ARG 79 5.903 20.582 -18.911
628 HD2 ARG 79 HD2 ARG 79 3.404 20.590 -19.418
629 HD3 ARG 79 HD3 ARG 79 4.146 19.028 -19.080
630 HH11 ARG 79 HH21 ARG 79 2.358 22.111 -18.247
631 HH12 ARG 79 HH22 ARG 79 1.082 22.361 -17.112
632 HH21 ARG 79 HH12 ARG 79 1.401 19.044 -15.786
633 HH22 ARG 79 HH11 ARG 79 0.483 20.532 -15.619
634 H GLN 80 HN GLN 80 7.027 18.461 -14.820
635 HA GLN 80 HA GLN 80 6.762 20.010 -12.445
636 HB2 GLN 80 HB2 GLN 80 7.517 17.104 -12.943
637 HB3 GLN 80 HB3 GLN 80 7.358 17.793 -11.316
638 HG2 GLN 80 HG2 GLN 80 5.054 18.414 -11.698
639 HG3 GLN 80 HG3 GLN 80 5.147 17.996 -13.402
640 HE21 GLN 80 HE22 GLN 80 5.009 15.827 -14.067
641 HE22 GLN 80 HE21 GLN 80 4.199 14.695 -12.990
642 H CYS 81 HN CYS 81 9.647 18.653 -14.096
643 HA CYS 81 HA CYS 81 11.551 19.295 -12.090
644 HG CYS 81 HG CYS 81 10.799 17.001 -14.279
645 HB2 CYS 81 HB2 CYS 81 11.872 19.248 -15.113
646 HB3 CYS 81 HB3 CYS 81 13.194 19.274 -13.940
647 H LYS 82 HN LYS 82 10.014 21.437 -14.527
648 HA LYS 82 HA LYS 82 11.928 23.539 -14.204
649 HB2 LYS 82 HB2 LYS 82 9.072 23.464 -15.252
650 HB3 LYS 82 HB3 LYS 82 9.926 24.980 -15.057
651 HG2 LYS 82 HG2 LYS 82 11.000 22.698 -16.766
652 HG3 LYS 82 HG3 LYS 82 9.994 24.024 -17.369
653 HD2 LYS 82 HD2 LYS 82 11.701 25.648 -16.442
654 HD3 LYS 82 HD3 LYS 82 12.765 24.265 -16.118
655 HE2 LYS 82 HE2 LYS 82 12.728 23.678 -18.530
656 HE3 LYS 82 HE3 LYS 82 11.630 25.033 -18.841
657 HZ1 LYS 82 HZ1 LYS 82 14.414 25.256 -17.866
658 HZ2 LYS 82 HZ2 LYS 82 13.860 25.698 -19.336
659 HZ3 LYS 82 HZ3 LYS 82 13.385 26.528 -17.998
660 H VAL 83 HN VAL 83 9.018 22.578 -12.395
661 HA VAL 83 HA VAL 83 8.705 25.031 -11.073
662 HB VAL 83 HB VAL 83 7.915 22.299 -10.009
663 HG11 VAL 83 HG11 VAL 83 6.100 23.524 -8.877
664 HG12 VAL 83 HG12 VAL 83 7.649 24.226 -8.398
665 HG13 VAL 83 HG13 VAL 83 6.648 25.056 -9.596
666 HG21 VAL 83 HG21 VAL 83 7.008 22.489 -12.268
667 HG22 VAL 83 HG22 VAL 83 5.705 22.746 -11.119
668 HG23 VAL 83 HG23 VAL 83 6.434 24.140 -11.946
669 H ALA 84 HN ALA 84 10.872 22.286 -10.432
670 HA ALA 84 HA ALA 84 11.806 22.977 -7.848
671 HB1 ALA 84 HB1 ALA 84 12.314 20.858 -9.062
672 HB2 ALA 84 HB2 ALA 84 13.392 21.766 -10.155
673 HB3 ALA 84 HB3 ALA 84 13.760 21.660 -8.436
674 H GLY 85 HN GLY 85 12.336 24.557 -10.929
675 HA2 GLY 85 HA2 GLY 85 14.413 26.356 -9.781
676 HA3 GLY 85 HA3 GLY 85 14.244 25.944 -11.495
677 H LYS 86 HN LYS 86 11.472 26.574 -9.338
678 HA LYS 86 HA LYS 86 9.870 28.145 -9.301
679 HB2 LYS 86 HB2 LYS 86 12.049 30.096 -10.158
680 HB3 LYS 86 HB3 LYS 86 10.495 30.536 -9.479
681 HG2 LYS 86 HG2 LYS 86 12.632 28.958 -7.978
682 HG3 LYS 86 HG3 LYS 86 12.386 30.701 -7.905
683 HD2 LYS 86 HD2 LYS 86 9.991 30.236 -7.132
684 HD3 LYS 86 HD3 LYS 86 10.486 28.539 -6.919
685 HE2 LYS 86 HE2 LYS 86 12.304 29.269 -5.392
686 HE3 LYS 86 HE3 LYS 86 11.869 30.959 -5.665
687 HZ1 LYS 86 HZ1 LYS 86 10.231 28.923 -4.272
688 HZ2 LYS 86 HZ2 LYS 86 10.929 30.241 -3.621
689 HZ3 LYS 86 HZ3 LYS 86 9.680 30.433 -4.653
690 H THR 87 HN THR 87 10.138 26.587 -11.660
691 HA THR 87 HA THR 87 9.051 26.311 -13.566
692 HB THR 87 HB THR 87 7.326 28.696 -12.893
693 HG1 THR 87 HG1 THR 87 6.349 27.474 -11.355
694 HG21 THR 87 HG21 THR 87 6.708 25.895 -13.972
695 HG22 THR 87 HG22 THR 87 5.519 27.181 -13.669
696 HG23 THR 87 HG23 THR 87 6.730 27.384 -14.939
697 H GLN 88 HN GLN 88 11.471 27.613 -13.849
698 HA GLN 88 HA GLN 88 11.110 29.300 -16.263
699 HB2 GLN 88 HB2 GLN 88 12.666 29.985 -13.732
700 HB3 GLN 88 HB3 GLN 88 13.036 30.717 -15.293
701 HG2 GLN 88 HG2 GLN 88 10.947 31.839 -15.423
702 HG3 GLN 88 HG3 GLN 88 10.226 30.862 -14.151
703 HE21 GLN 88 HE22 GLN 88 10.559 31.347 -11.985
704 HE22 GLN 88 HE21 GLN 88 11.374 32.812 -11.450
Start of MODEL 13
1 HA MET 1 HA MET 1 3.321 -1.257 -2.873
2 H1 MET 1 H1 MET 1 2.641 -1.395 -0.605
3 H2 MET 1 H2 MET 1 1.851 0.032 -0.688
4 H3 MET 1 H3 MET 1 1.314 -1.255 -1.559
5 HB2 MET 1 HB2 MET 1 1.323 0.028 -3.655
6 HB3 MET 1 HB3 MET 1 1.955 1.473 -2.859
7 HG2 MET 1 HG2 MET 1 2.415 1.491 -5.254
8 HG3 MET 1 HG3 MET 1 3.919 1.457 -4.346
9 HE1 MET 1 HE1 MET 1 3.697 0.961 -7.453
10 HE2 MET 1 HE2 MET 1 5.228 0.917 -6.552
11 HE3 MET 1 HE3 MET 1 4.806 -0.411 -7.657
12 H GLU 2 HN GLU 2 5.420 -0.470 -3.257
13 HA GLU 2 HA GLU 2 6.453 1.783 -1.692
14 HB2 GLU 2 HB2 GLU 2 7.838 -0.938 -1.863
15 HB3 GLU 2 HB3 GLU 2 8.569 0.553 -1.257
16 HG2 GLU 2 HG2 GLU 2 6.901 0.644 0.573
17 HG3 GLU 2 HG3 GLU 2 6.163 -0.851 -0.008
18 H TRP 3 HN TRP 3 8.265 2.722 -2.940
19 HA TRP 3 HA TRP 3 8.054 1.984 -5.824
20 HD1 TRP 3 HD1 TRP 3 6.015 4.486 -3.092
21 HE1 TRP 3 HE1 TRP 3 3.515 4.511 -3.618
22 HE3 TRP 3 HE3 TRP 3 6.250 3.698 -8.142
23 HZ2 TRP 3 HZ2 TRP 3 1.814 4.202 -5.950
24 HZ3 TRP 3 HZ3 TRP 3 4.180 3.566 -9.494
25 HH2 TRP 3 HH2 TRP 3 1.956 3.810 -8.408
26 HB2 TRP 3 HB2 TRP 3 8.183 4.775 -4.633
27 HB3 TRP 3 HB3 TRP 3 8.029 4.368 -6.327
28 H LEU 4 HN LEU 4 9.791 2.921 -7.116
29 HA LEU 4 HA LEU 4 12.441 3.002 -5.750
30 HG LEU 4 HG LEU 4 13.731 2.940 -8.803
31 HB2 LEU 4 HB2 LEU 4 12.175 0.997 -7.039
32 HB3 LEU 4 HB3 LEU 4 11.516 1.905 -8.409
33 HD11 LEU 4 HD11 LEU 4 15.727 1.885 -7.707
34 HD12 LEU 4 HD12 LEU 4 14.761 2.864 -6.603
35 HD13 LEU 4 HD13 LEU 4 14.639 1.092 -6.549
36 HD21 LEU 4 HD21 LEU 4 13.029 0.884 -9.981
37 HD22 LEU 4 HD22 LEU 4 14.779 0.910 -9.716
38 HD23 LEU 4 HD23 LEU 4 13.748 -0.107 -8.690
39 H VAL 5 HN VAL 5 13.479 4.775 -6.039
40 HA VAL 5 HA VAL 5 12.636 6.986 -7.819
41 HB VAL 5 HB VAL 5 15.129 6.770 -6.080
42 HG11 VAL 5 HG11 VAL 5 13.725 9.146 -7.330
43 HG12 VAL 5 HG12 VAL 5 15.106 9.236 -6.211
44 HG13 VAL 5 HG13 VAL 5 15.305 8.482 -7.794
45 HG21 VAL 5 HG21 VAL 5 13.840 8.243 -4.458
46 HG22 VAL 5 HG22 VAL 5 12.373 7.927 -5.414
47 HG23 VAL 5 HG23 VAL 5 13.201 6.605 -4.570
48 H LYS 6 HN LYS 6 13.052 6.560 -9.867
49 HA LYS 6 HA LYS 6 15.517 5.189 -10.818
50 HB2 LYS 6 HB2 LYS 6 12.883 6.006 -12.050
51 HB3 LYS 6 HB3 LYS 6 14.242 5.609 -13.066
52 HG2 LYS 6 HG2 LYS 6 13.016 3.730 -11.013
53 HG3 LYS 6 HG3 LYS 6 12.711 3.720 -12.744
54 HD2 LYS 6 HD2 LYS 6 15.232 2.912 -11.303
55 HD3 LYS 6 HD3 LYS 6 14.181 1.966 -12.375
56 HE2 LYS 6 HE2 LYS 6 14.905 3.370 -14.310
57 HE3 LYS 6 HE3 LYS 6 15.974 4.284 -13.246
58 HZ1 LYS 6 HZ1 LYS 6 16.223 1.381 -13.807
59 HZ2 LYS 6 HZ2 LYS 6 17.173 2.552 -14.418
60 HZ3 LYS 6 HZ3 LYS 6 17.211 2.235 -12.823
61 H LYS 7 HN LYS 7 14.200 8.430 -10.480
62 HA LYS 7 HA LYS 7 16.578 9.608 -11.710
63 HB2 LYS 7 HB2 LYS 7 13.781 10.474 -12.579
64 HB3 LYS 7 HB3 LYS 7 15.284 11.338 -12.884
65 HG2 LYS 7 HG2 LYS 7 16.113 9.258 -14.126
66 HG3 LYS 7 HG3 LYS 7 14.439 8.658 -14.029
67 HD2 LYS 7 HD2 LYS 7 13.720 10.870 -15.085
68 HD3 LYS 7 HD3 LYS 7 15.421 11.227 -15.365
69 HE2 LYS 7 HE2 LYS 7 13.972 8.750 -16.406
70 HE3 LYS 7 HE3 LYS 7 14.159 10.251 -17.322
71 HZ1 LYS 7 HZ1 LYS 7 15.859 8.662 -17.922
72 HZ2 LYS 7 HZ2 LYS 7 16.567 9.944 -17.216
73 HZ3 LYS 7 HZ3 LYS 7 16.397 8.540 -16.391
74 H SER 8 HN SER 8 16.985 11.638 -10.637
75 HA SER 8 HA SER 8 15.039 12.635 -8.651
76 HG SER 8 HG SER 8 18.607 12.022 -8.531
77 HB2 SER 8 HB2 SER 8 17.004 12.620 -6.993
78 HB3 SER 8 HB3 SER 8 16.215 11.070 -7.330
79 H CYS 9 HN CYS 9 14.815 14.551 -9.697
80 HA CYS 9 HA CYS 9 17.081 16.004 -10.865
81 HG CYS 9 HG CYS 9 13.841 16.366 -13.120
82 HB2 CYS 9 HB2 CYS 9 14.146 16.768 -10.512
83 HB3 CYS 9 HB3 CYS 9 15.350 17.636 -11.481
84 H CYS 10 HN CYS 10 18.458 16.754 -9.307
85 HA CYS 10 HA CYS 10 17.798 17.543 -6.672
86 HG CYS 10 HG CYS 10 21.813 18.038 -8.647
87 HB2 CYS 10 HB2 CYS 10 20.097 18.599 -6.750
88 HB3 CYS 10 HB3 CYS 10 20.020 16.880 -7.145
89 H ASN 11 HN ASN 11 17.926 19.714 -5.707
90 HA ASN 11 HA ASN 11 17.524 22.058 -7.424
91 HB2 ASN 11 HB2 ASN 11 15.349 22.412 -7.121
92 HB3 ASN 11 HB3 ASN 11 15.212 20.700 -6.785
93 HD21 ASN 11 HD22 ASN 11 15.383 20.073 -4.373
94 HD22 ASN 11 HD21 ASN 11 14.543 21.133 -3.298
95 H LYS 12 HN LYS 12 17.468 23.991 -6.209
96 HA LYS 12 HA LYS 12 17.982 23.915 -3.307
97 HB2 LYS 12 HB2 LYS 12 19.793 25.057 -5.450
98 HB3 LYS 12 HB3 LYS 12 19.559 26.041 -4.014
99 HG2 LYS 12 HG2 LYS 12 20.395 23.132 -3.858
100 HG3 LYS 12 HG3 LYS 12 21.552 24.469 -3.990
101 HD2 LYS 12 HD2 LYS 12 20.601 25.518 -1.947
102 HD3 LYS 12 HD3 LYS 12 19.486 24.158 -1.758
103 HE2 LYS 12 HE2 LYS 12 21.413 22.591 -1.590
104 HE3 LYS 12 HE3 LYS 12 22.533 23.946 -1.780
105 HZ1 LYS 12 HZ1 LYS 12 20.642 23.607 0.477
106 HZ2 LYS 12 HZ2 LYS 12 22.249 23.355 0.538
107 HZ3 LYS 12 HZ3 LYS 12 21.678 24.860 0.299
108 H GLN 13 HN GLN 13 17.038 25.725 -6.236
109 HA GLN 13 HA GLN 13 16.565 28.111 -4.889
110 HB2 GLN 13 HB2 GLN 13 15.613 26.983 -7.556
111 HB3 GLN 13 HB3 GLN 13 15.084 28.567 -7.030
112 HG2 GLN 13 HG2 GLN 13 17.999 27.762 -7.342
113 HG3 GLN 13 HG3 GLN 13 17.062 28.657 -8.533
114 HE21 GLN 13 HE22 GLN 13 19.516 29.586 -7.214
115 HE22 GLN 13 HE21 GLN 13 19.086 31.025 -6.327
116 H ASP 14 HN ASP 14 14.385 25.307 -5.018
117 HA ASP 14 HA ASP 14 12.320 27.075 -3.728
118 HB2 ASP 14 HB2 ASP 14 11.893 26.515 -6.170
119 HB3 ASP 14 HB3 ASP 14 11.695 24.837 -5.670
120 H ASN 15 HN ASN 15 14.232 24.401 -3.268
121 HA ASN 15 HA ASN 15 14.466 22.859 -1.691
122 HB2 ASN 15 HB2 ASN 15 13.248 24.539 -0.144
123 HB3 ASN 15 HB3 ASN 15 11.836 23.510 -0.360
124 HD21 ASN 15 HD22 ASN 15 13.298 20.901 -0.323
125 HD22 ASN 15 HD21 ASN 15 13.770 20.690 1.348
126 H ARG 16 HN ARG 16 11.641 23.180 -3.594
127 HA ARG 16 HA ARG 16 10.577 20.495 -3.322
128 HE ARG 16 HE ARG 16 8.497 23.770 -5.873
129 HB2 ARG 16 HB2 ARG 16 9.008 22.036 -3.975
130 HB3 ARG 16 HB3 ARG 16 10.128 22.906 -5.036
131 HG2 ARG 16 HG2 ARG 16 9.905 21.348 -6.796
132 HG3 ARG 16 HG3 ARG 16 9.090 20.160 -5.776
133 HD2 ARG 16 HD2 ARG 16 7.720 21.639 -7.459
134 HD3 ARG 16 HD3 ARG 16 7.082 21.237 -5.856
135 HH11 ARG 16 HH21 ARG 16 5.314 22.261 -6.550
136 HH12 ARG 16 HH22 ARG 16 4.444 23.689 -6.081
137 HH21 ARG 16 HH11 ARG 16 7.441 25.511 -5.333
138 HH22 ARG 16 HH12 ARG 16 5.691 25.663 -5.394
139 H HIS 17 HN HIS 17 11.061 18.734 -4.440
140 HA HIS 17 HA HIS 17 13.186 18.753 -6.543
141 HD1 HIS 17 HD1 HIS 17 14.029 17.503 -2.301
142 HD2 HIS 17 HD2 HIS 17 15.733 18.037 -6.095
143 HE1 HIS 17 HE1 HIS 17 16.406 18.365 -1.906
144 HB2 HIS 17 HB2 HIS 17 12.529 16.750 -4.322
145 HB3 HIS 17 HB3 HIS 17 13.515 16.335 -5.717
146 H VAL 18 HN VAL 18 12.916 16.726 -7.952
147 HA VAL 18 HA VAL 18 10.199 15.643 -7.980
148 HB VAL 18 HB VAL 18 11.504 16.345 -10.621
149 HG11 VAL 18 HG11 VAL 18 9.279 16.118 -11.556
150 HG12 VAL 18 HG12 VAL 18 9.630 14.693 -10.585
151 HG13 VAL 18 HG13 VAL 18 8.558 15.953 -9.940
152 HG21 VAL 18 HG21 VAL 18 9.594 18.197 -9.147
153 HG22 VAL 18 HG22 VAL 18 11.264 18.540 -9.673
154 HG23 VAL 18 HG23 VAL 18 10.000 18.302 -10.869
155 H LEU 19 HN LEU 19 10.164 13.581 -8.585
156 HA LEU 19 HA LEU 19 12.688 12.317 -9.451
157 HG LEU 19 HG LEU 19 10.664 12.294 -6.145
158 HB2 LEU 19 HB2 LEU 19 11.713 10.482 -7.599
159 HB3 LEU 19 HB3 LEU 19 13.210 11.374 -7.542
160 HD11 LEU 19 HD11 LEU 19 11.521 10.115 -5.358
161 HD12 LEU 19 HD12 LEU 19 13.114 10.835 -5.071
162 HD13 LEU 19 HD13 LEU 19 11.701 11.378 -4.133
163 HD21 LEU 19 HD21 LEU 19 12.581 13.487 -4.736
164 HD22 LEU 19 HD22 LEU 19 13.548 13.296 -6.202
165 HD23 LEU 19 HD23 LEU 19 12.035 14.233 -6.226
166 H MET 20 HN MET 20 12.288 10.004 -10.079
167 HA MET 20 HA MET 20 9.548 9.773 -11.254
168 HB2 MET 20 HB2 MET 20 12.209 8.753 -12.258
169 HB3 MET 20 HB3 MET 20 10.703 7.891 -12.612
170 HG2 MET 20 HG2 MET 20 9.673 9.959 -13.455
171 HG3 MET 20 HG3 MET 20 11.174 10.838 -13.172
172 HE1 MET 20 HE1 MET 20 10.879 7.117 -14.734
173 HE2 MET 20 HE2 MET 20 9.396 7.999 -15.165
174 HE3 MET 20 HE3 MET 20 10.577 7.571 -16.425
175 H LEU 21 HN LEU 21 8.294 8.494 -10.252
176 HA LEU 21 HA LEU 21 9.344 6.648 -8.150
177 HG LEU 21 HG LEU 21 8.345 7.076 -6.119
178 HB2 LEU 21 HB2 LEU 21 6.785 8.227 -8.473
179 HB3 LEU 21 HB3 LEU 21 6.650 6.599 -7.806
180 HD11 LEU 21 HD11 LEU 21 9.735 8.773 -6.998
181 HD12 LEU 21 HD12 LEU 21 8.372 9.801 -7.452
182 HD13 LEU 21 HD13 LEU 21 8.829 9.629 -5.741
183 HD21 LEU 21 HD21 LEU 21 6.897 8.550 -4.720
184 HD22 LEU 21 HD22 LEU 21 5.971 8.989 -6.174
185 HD23 LEU 21 HD23 LEU 21 5.975 7.316 -5.593
186 H CYS 22 HN CYS 22 9.381 4.610 -8.645
187 HA CYS 22 HA CYS 22 7.722 3.610 -10.918
188 HG CYS 22 HG CYS 22 10.617 5.539 -10.700
189 HB2 CYS 22 HB2 CYS 22 10.663 3.035 -10.336
190 HB3 CYS 22 HB3 CYS 22 9.737 2.534 -11.756
191 H ASP 23 HN ASP 23 7.680 1.233 -11.009
192 HA ASP 23 HA ASP 23 6.989 -0.115 -8.571
193 HB2 ASP 23 HB2 ASP 23 6.212 -1.183 -10.504
194 HB3 ASP 23 HB3 ASP 23 7.674 -0.834 -11.416
195 H ALA 24 HN ALA 24 8.260 -1.541 -7.265
196 HA ALA 24 HA ALA 24 11.043 -0.911 -6.920
197 HB1 ALA 24 HB1 ALA 24 9.610 -1.523 -5.038
198 HB2 ALA 24 HB2 ALA 24 9.333 -3.135 -5.740
199 HB3 ALA 24 HB3 ALA 24 10.959 -2.664 -5.198
200 H GLY 25 HN GLY 25 11.640 -1.274 -9.160
201 HA2 GLY 25 HA2 GLY 25 13.200 -3.374 -9.946
202 HA3 GLY 25 HA3 GLY 25 11.551 -3.947 -10.293
203 H GLY 26 HN GLY 26 10.847 -0.965 -10.734
204 HA2 GLY 26 HA2 GLY 26 11.015 0.688 -12.317
205 HA3 GLY 26 HA3 GLY 26 12.275 -0.215 -13.167
206 H ALA 27 HN ALA 27 9.438 -2.174 -12.568
207 HA ALA 27 HA ALA 27 9.125 -2.538 -15.381
208 HB1 ALA 27 HB1 ALA 27 7.263 -3.372 -13.114
209 HB2 ALA 27 HB2 ALA 27 7.298 -4.047 -14.754
210 HB3 ALA 27 HB3 ALA 27 8.685 -4.287 -13.674
211 H ILE 28 HN ILE 28 7.679 -0.213 -13.266
212 HA ILE 28 HA ILE 28 5.915 0.851 -15.367
213 HB ILE 28 HB ILE 28 5.055 0.277 -12.482
214 HG12 ILE 28 HG12 ILE 28 4.023 -0.906 -15.100
215 HG13 ILE 28 HG13 ILE 28 4.931 -1.757 -13.846
216 HG21 ILE 28 HG21 ILE 28 2.884 1.299 -13.082
217 HG22 ILE 28 HG22 ILE 28 4.168 2.458 -13.295
218 HG23 ILE 28 HG23 ILE 28 3.480 1.643 -14.720
219 HD11 ILE 28 HD11 ILE 28 2.091 -0.731 -13.624
220 HD12 ILE 28 HD12 ILE 28 2.666 -2.402 -13.607
221 HD13 ILE 28 HD13 ILE 28 3.046 -1.332 -12.242
222 H LYS 29 HN LYS 29 5.864 3.210 -15.099
223 HA LYS 29 HA LYS 29 7.580 4.312 -12.948
224 HB2 LYS 29 HB2 LYS 29 8.037 4.922 -15.898
225 HB3 LYS 29 HB3 LYS 29 8.877 5.615 -14.509
226 HG2 LYS 29 HG2 LYS 29 9.595 3.166 -13.958
227 HG3 LYS 29 HG3 LYS 29 9.064 2.782 -15.596
228 HD2 LYS 29 HD2 LYS 29 10.677 4.429 -16.510
229 HD3 LYS 29 HD3 LYS 29 11.122 4.915 -14.876
230 HE2 LYS 29 HE2 LYS 29 12.844 3.501 -15.758
231 HE3 LYS 29 HE3 LYS 29 12.080 2.700 -14.394
232 HZ1 LYS 29 HZ1 LYS 29 11.400 2.108 -17.232
233 HZ2 LYS 29 HZ2 LYS 29 12.480 1.255 -16.365
234 HZ3 LYS 29 HZ3 LYS 29 10.920 1.249 -15.907
235 H MET 30 HN MET 30 7.101 6.380 -12.362
236 HA MET 30 HA MET 30 5.013 7.967 -13.718
237 HB2 MET 30 HB2 MET 30 5.033 7.445 -10.723
238 HB3 MET 30 HB3 MET 30 3.845 8.326 -11.672
239 HG2 MET 30 HG2 MET 30 3.497 6.000 -12.870
240 HG3 MET 30 HG3 MET 30 4.245 5.372 -11.399
241 HE1 MET 30 HE1 MET 30 1.601 6.948 -8.734
242 HE2 MET 30 HE2 MET 30 3.297 6.450 -8.939
243 HE3 MET 30 HE3 MET 30 2.750 8.039 -9.531
244 H ILE 31 HN ILE 31 4.981 10.143 -12.281
245 HA ILE 31 HA ILE 31 7.767 10.987 -11.650
246 HB ILE 31 HB ILE 31 5.572 12.602 -12.929
247 HG12 ILE 31 HG12 ILE 31 8.188 12.029 -14.344
248 HG13 ILE 31 HG13 ILE 31 6.975 10.757 -14.366
249 HG21 ILE 31 HG21 ILE 31 8.488 13.268 -12.285
250 HG22 ILE 31 HG22 ILE 31 7.425 14.285 -13.272
251 HG23 ILE 31 HG23 ILE 31 7.037 14.024 -11.579
252 HD11 ILE 31 HD11 ILE 31 6.725 12.269 -16.289
253 HD12 ILE 31 HD12 ILE 31 5.287 12.231 -15.237
254 HD13 ILE 31 HD13 ILE 31 6.394 13.608 -15.168
255 H ALA 32 HN ALA 32 7.843 12.192 -9.649
256 HA ALA 32 HA ALA 32 5.280 13.091 -8.506
257 HB1 ALA 32 HB1 ALA 32 5.826 12.337 -6.282
258 HB2 ALA 32 HB2 ALA 32 5.836 10.927 -7.363
259 HB3 ALA 32 HB3 ALA 32 7.374 11.675 -6.825
260 H GLU 33 HN GLU 33 5.454 15.058 -7.755
261 HA GLU 33 HA GLU 33 8.064 16.458 -7.657
262 HB2 GLU 33 HB2 GLU 33 6.035 17.371 -8.957
263 HB3 GLU 33 HB3 GLU 33 5.161 17.450 -7.419
264 HG2 GLU 33 HG2 GLU 33 6.890 19.030 -6.578
265 HG3 GLU 33 HG3 GLU 33 7.638 19.032 -8.175
266 H VAL 34 HN VAL 34 8.833 16.973 -5.557
267 HA VAL 34 HA VAL 34 7.141 16.347 -3.217
268 HB VAL 34 HB VAL 34 8.714 14.790 -2.292
269 HG11 VAL 34 HG11 VAL 34 8.552 12.872 -3.714
270 HG12 VAL 34 HG12 VAL 34 7.084 13.825 -3.967
271 HG13 VAL 34 HG13 VAL 34 8.383 13.866 -5.170
272 HG21 VAL 34 HG21 VAL 34 10.844 15.678 -3.042
273 HG22 VAL 34 HG22 VAL 34 10.709 13.981 -3.484
274 HG23 VAL 34 HG23 VAL 34 10.472 15.236 -4.728
275 H LYS 35 HN LYS 35 8.561 16.847 -1.173
276 HA LYS 35 HA LYS 35 10.641 18.883 -1.654
277 HB2 LYS 35 HB2 LYS 35 8.462 20.018 -0.979
278 HB3 LYS 35 HB3 LYS 35 8.523 19.130 0.543
279 HG2 LYS 35 HG2 LYS 35 10.622 20.232 1.139
280 HG3 LYS 35 HG3 LYS 35 10.736 20.989 -0.455
281 HD2 LYS 35 HD2 LYS 35 8.514 21.541 1.554
282 HD3 LYS 35 HD3 LYS 35 9.986 22.508 1.391
283 HE2 LYS 35 HE2 LYS 35 9.401 22.983 -0.999
284 HE3 LYS 35 HE3 LYS 35 7.894 22.082 -0.794
285 HZ1 LYS 35 HZ1 LYS 35 7.233 23.703 0.892
286 HZ2 LYS 35 HZ2 LYS 35 8.625 24.538 0.701
287 HZ3 LYS 35 HZ3 LYS 35 7.549 24.453 -0.518
288 H SER 36 HN SER 36 12.200 18.806 0.146
289 HA SER 36 HA SER 36 12.172 16.190 1.577
290 HG SER 36 HG SER 36 13.644 15.405 -1.522
291 HB2 SER 36 HB2 SER 36 14.603 17.098 0.042
292 HB3 SER 36 HB3 SER 36 14.136 15.473 0.568
293 H ASP 37 HN ASP 37 13.548 16.048 3.356
294 HA ASP 37 HA ASP 37 14.958 18.555 4.191
295 HB2 ASP 37 HB2 ASP 37 12.912 18.042 5.518
296 HB3 ASP 37 HB3 ASP 37 13.619 16.491 5.971
297 H PHE 38 HN PHE 38 15.558 15.715 2.829
298 HA PHE 38 HA PHE 38 18.215 15.334 4.011
299 HD1 PHE 38 HD2 PHE 38 14.467 14.006 5.011
300 HD2 PHE 38 HD1 PHE 38 18.440 13.193 6.482
301 HE1 PHE 38 HE2 PHE 38 13.618 14.081 7.338
302 HE2 PHE 38 HE1 PHE 38 17.587 13.272 8.811
303 HZ PHE 38 HZ PHE 38 15.175 13.707 9.244
304 HB2 PHE 38 HB2 PHE 38 16.256 13.047 3.546
305 HB3 PHE 38 HB3 PHE 38 17.904 12.901 4.119
306 H ALA 39 HN ALA 39 19.553 14.075 2.433
307 HA ALA 39 HA ALA 39 19.043 14.715 -0.306
308 HB1 ALA 39 HB1 ALA 39 21.327 14.440 0.602
309 HB2 ALA 39 HB2 ALA 39 20.996 12.722 0.936
310 HB3 ALA 39 HB3 ALA 39 21.037 13.314 -0.737
311 H VAL 40 HN VAL 40 18.515 13.293 -2.029
312 HA VAL 40 HA VAL 40 17.725 10.529 -1.558
313 HB VAL 40 HB VAL 40 15.643 11.594 -1.026
314 HG11 VAL 40 HG11 VAL 40 15.829 13.243 -3.576
315 HG12 VAL 40 HG12 VAL 40 14.427 13.146 -2.497
316 HG13 VAL 40 HG13 VAL 40 15.931 13.856 -1.909
317 HG21 VAL 40 HG21 VAL 40 14.129 10.734 -2.693
318 HG22 VAL 40 HG22 VAL 40 15.408 10.717 -3.925
319 HG23 VAL 40 HG23 VAL 40 15.494 9.625 -2.531
320 H LYS 41 HN LYS 41 18.105 9.342 -3.511
321 HA LYS 41 HA LYS 41 18.663 10.850 -5.945
322 HB2 LYS 41 HB2 LYS 41 20.882 10.382 -6.238
323 HB3 LYS 41 HB3 LYS 41 20.811 10.872 -4.559
324 HG2 LYS 41 HG2 LYS 41 21.043 8.042 -5.639
325 HG3 LYS 41 HG3 LYS 41 22.324 8.983 -4.895
326 HD2 LYS 41 HD2 LYS 41 21.223 8.921 -2.737
327 HD3 LYS 41 HD3 LYS 41 19.802 8.129 -3.432
328 HE2 LYS 41 HE2 LYS 41 22.530 6.842 -3.677
329 HE3 LYS 41 HE3 LYS 41 21.580 6.676 -2.192
330 HZ1 LYS 41 HZ1 LYS 41 20.545 5.919 -4.864
331 HZ2 LYS 41 HZ2 LYS 41 21.158 4.865 -3.757
332 HZ3 LYS 41 HZ3 LYS 41 19.802 5.724 -3.405
333 H VAL 42 HN VAL 42 19.184 9.349 -7.785
334 HA VAL 42 HA VAL 42 17.381 7.348 -8.169
335 HB VAL 42 HB VAL 42 20.190 7.504 -9.357
336 HG11 VAL 42 HG11 VAL 42 18.999 6.436 -11.366
337 HG12 VAL 42 HG12 VAL 42 19.258 5.370 -9.990
338 HG13 VAL 42 HG13 VAL 42 17.652 6.078 -10.255
339 HG21 VAL 42 HG21 VAL 42 17.570 8.885 -9.927
340 HG22 VAL 42 HG22 VAL 42 19.186 9.601 -9.753
341 HG23 VAL 42 HG23 VAL 42 18.797 8.700 -11.215
342 H GLY 43 HN GLY 43 17.284 5.128 -8.149
343 HA2 GLY 43 HA2 GLY 43 17.655 2.999 -7.417
344 HA3 GLY 43 HA3 GLY 43 19.318 3.425 -6.962
345 H ASP 44 HN ASP 44 16.303 5.129 -5.900
346 HA ASP 44 HA ASP 44 17.015 4.236 -3.080
347 HB2 ASP 44 HB2 ASP 44 15.878 6.884 -4.001
348 HB3 ASP 44 HB3 ASP 44 15.470 6.228 -2.429
349 H LEU 45 HN LEU 45 15.370 3.449 -1.733
350 HA LEU 45 HA LEU 45 12.870 2.687 -3.103
351 HG LEU 45 HG LEU 45 11.251 1.830 -0.924
352 HB2 LEU 45 HB2 LEU 45 14.205 1.217 -1.414
353 HB3 LEU 45 HB3 LEU 45 13.696 2.374 -0.192
354 HD11 LEU 45 HD11 LEU 45 11.822 0.645 -3.038
355 HD12 LEU 45 HD12 LEU 45 12.666 -0.604 -2.099
356 HD13 LEU 45 HD13 LEU 45 10.911 -0.379 -1.923
357 HD21 LEU 45 HD21 LEU 45 13.002 -0.223 0.471
358 HD22 LEU 45 HD22 LEU 45 12.148 1.170 1.195
359 HD23 LEU 45 HD23 LEU 45 11.221 -0.170 0.522
360 H LEU 46 HN LEU 46 10.831 3.554 -2.418
361 HA LEU 46 HA LEU 46 10.832 5.610 -0.280
362 HG LEU 46 HG LEU 46 11.302 6.738 -3.251
363 HB2 LEU 46 HB2 LEU 46 9.159 5.693 -2.816
364 HB3 LEU 46 HB3 LEU 46 8.911 6.709 -1.408
365 HD11 LEU 46 HD11 LEU 46 10.427 9.011 -3.844
366 HD12 LEU 46 HD12 LEU 46 9.255 7.728 -4.174
367 HD13 LEU 46 HD13 LEU 46 9.062 8.758 -2.745
368 HD21 LEU 46 HD21 LEU 46 12.015 8.804 -2.032
369 HD22 LEU 46 HD22 LEU 46 10.745 8.490 -0.819
370 HD23 LEU 46 HD23 LEU 46 12.088 7.354 -1.030
371 H SER 47 HN SER 47 9.584 4.939 1.306
372 HA SER 47 HA SER 47 7.370 2.999 0.768
373 HG SER 47 HG SER 47 9.315 0.922 1.845
374 HB2 SER 47 HB2 SER 47 9.067 3.188 3.283
375 HB3 SER 47 HB3 SER 47 7.865 1.949 2.886
376 HA PRO 48 HA PRO 48 5.068 6.420 2.352
377 HB2 PRO 48 HB2 PRO 48 2.634 5.267 2.976
378 HB3 PRO 48 HB3 PRO 48 3.194 5.578 1.309
379 HG2 PRO 48 HG2 PRO 48 3.355 2.994 2.880
380 HG3 PRO 48 HG3 PRO 48 2.810 3.231 1.189
381 HD2 PRO 48 HD2 PRO 48 5.331 2.392 1.784
382 HD3 PRO 48 HD3 PRO 48 5.027 3.513 0.421
383 H LEU 49 HN LEU 49 4.309 7.398 4.201
384 HA LEU 49 HA LEU 49 4.569 5.941 6.812
385 HG LEU 49 HG LEU 49 7.125 6.802 5.722
386 HB2 LEU 49 HB2 LEU 49 5.475 8.726 5.989
387 HB3 LEU 49 HB3 LEU 49 5.294 8.255 7.674
388 HD11 LEU 49 HD11 LEU 49 8.960 8.063 6.809
389 HD12 LEU 49 HD12 LEU 49 7.844 9.119 5.927
390 HD13 LEU 49 HD13 LEU 49 7.759 9.030 7.700
391 HD21 LEU 49 HD21 LEU 49 8.197 6.005 7.860
392 HD22 LEU 49 HD22 LEU 49 6.898 6.792 8.776
393 HD23 LEU 49 HD23 LEU 49 6.534 5.439 7.681
394 H GLN 50 HN GLN 50 3.094 8.635 4.968
395 HA GLN 50 HA GLN 50 0.528 8.028 5.985
396 HB2 GLN 50 HB2 GLN 50 -0.020 10.335 6.866
397 HB3 GLN 50 HB3 GLN 50 0.920 9.288 7.879
398 HG2 GLN 50 HG2 GLN 50 1.836 11.325 8.256
399 HG3 GLN 50 HG3 GLN 50 3.006 10.585 7.176
400 HE21 GLN 50 HE22 GLN 50 1.917 13.505 7.905
401 HE22 GLN 50 HE21 GLN 50 1.843 14.237 6.323
402 H ASN 51 HN ASN 51 -0.660 10.430 5.085
403 HA ASN 51 HA ASN 51 -1.232 9.795 2.547
404 HB2 ASN 51 HB2 ASN 51 -2.502 11.386 3.911
405 HB3 ASN 51 HB3 ASN 51 -1.169 12.538 3.878
406 HD21 ASN 51 HD22 ASN 51 -0.931 13.916 2.012
407 HD22 ASN 51 HD21 ASN 51 -2.066 13.901 0.691
408 H ALA 52 HN ALA 52 1.460 11.991 3.377
409 HA ALA 52 HA ALA 52 2.184 12.181 0.543
410 HB1 ALA 52 HB1 ALA 52 2.829 14.532 1.029
411 HB2 ALA 52 HB2 ALA 52 1.099 14.260 1.273
412 HB3 ALA 52 HB3 ALA 52 2.191 14.352 2.679
413 H LEU 53 HN LEU 53 3.250 11.722 3.916
414 HA LEU 53 HA LEU 53 6.034 12.213 3.247
415 HG LEU 53 HG LEU 53 4.739 13.548 5.518
416 HB2 LEU 53 HB2 LEU 53 4.738 11.003 5.698
417 HB3 LEU 53 HB3 LEU 53 6.487 11.057 5.476
418 HD11 LEU 53 HD11 LEU 53 6.491 12.332 7.708
419 HD12 LEU 53 HD12 LEU 53 5.631 13.886 7.796
420 HD13 LEU 53 HD13 LEU 53 4.716 12.377 7.707
421 HD21 LEU 53 HD21 LEU 53 6.914 14.713 5.885
422 HD22 LEU 53 HD22 LEU 53 7.777 13.175 5.680
423 HD23 LEU 53 HD23 LEU 53 6.881 13.890 4.329
424 H TYR 54 HN TYR 54 7.556 10.774 2.662
425 HA TYR 54 HA TYR 54 6.993 7.876 2.867
426 HD1 TYR 54 HD2 TYR 54 5.504 10.113 0.385
427 HD2 TYR 54 HD1 TYR 54 6.773 6.038 -0.172
428 HE1 TYR 54 HE2 TYR 54 3.304 9.577 -0.612
429 HE2 TYR 54 HE1 TYR 54 4.593 5.489 -1.190
430 HH TYR 54 HH TYR 54 2.466 6.283 -1.775
431 HB2 TYR 54 HB2 TYR 54 8.033 9.316 0.391
432 HB3 TYR 54 HB3 TYR 54 8.292 7.613 0.694
433 H CYS 55 HN CYS 55 8.768 6.727 3.370
434 HA CYS 55 HA CYS 55 11.118 7.846 4.596
435 HG CYS 55 HG CYS 55 8.524 5.296 4.510
436 HB2 CYS 55 HB2 CYS 55 10.794 5.072 3.343
437 HB3 CYS 55 HB3 CYS 55 11.828 5.528 4.687
438 H ILE 56 HN ILE 56 13.325 7.738 3.677
439 HA ILE 56 HA ILE 56 13.464 7.447 0.700
440 HB ILE 56 HB ILE 56 15.292 8.919 2.635
441 HG12 ILE 56 HG12 ILE 56 13.657 10.183 0.402
442 HG13 ILE 56 HG13 ILE 56 12.991 9.999 2.024
443 HG21 ILE 56 HG21 ILE 56 15.472 8.619 -0.402
444 HG22 ILE 56 HG22 ILE 56 16.439 9.764 0.538
445 HG23 ILE 56 HG23 ILE 56 16.665 8.053 0.775
446 HD11 ILE 56 HD11 ILE 56 14.865 11.250 2.992
447 HD12 ILE 56 HD12 ILE 56 15.514 11.564 1.371
448 HD13 ILE 56 HD13 ILE 56 13.949 12.218 1.837
449 H ASN 57 HN ASN 57 14.967 6.117 -0.111
450 HA ASN 57 HA ASN 57 16.685 4.766 -0.437
451 HB2 ASN 57 HB2 ASN 57 17.984 6.258 1.105
452 HB3 ASN 57 HB3 ASN 57 17.564 5.189 2.452
453 HD21 ASN 57 HD22 ASN 57 18.982 5.219 -0.835
454 HD22 ASN 57 HD21 ASN 57 20.128 3.912 -0.542
455 H ARG 58 HN ARG 58 15.356 4.147 2.739
456 HA ARG 58 HA ARG 58 13.837 2.031 2.606
457 HE ARG 58 HE ARG 58 17.270 1.014 0.420
458 HB2 ARG 58 HB2 ARG 58 15.042 -0.052 3.037
459 HB3 ARG 58 HB3 ARG 58 15.405 0.590 1.472
460 HG2 ARG 58 HG2 ARG 58 17.515 1.678 2.817
461 HG3 ARG 58 HG3 ARG 58 17.149 0.371 3.937
462 HD2 ARG 58 HD2 ARG 58 18.840 -0.374 2.385
463 HD3 ARG 58 HD3 ARG 58 17.340 -1.257 2.025
464 HH11 ARG 58 HH11 ARG 58 19.466 -1.764 0.712
465 HH12 ARG 58 HH12 ARG 58 20.002 -1.693 -0.925
466 HH21 ARG 58 HH21 ARG 58 17.967 1.115 -1.738
467 HH22 ARG 58 HH22 ARG 58 19.118 -0.008 -2.359
468 H GLU 59 HN GLU 59 14.905 4.400 4.331
469 HA GLU 59 HA GLU 59 14.537 2.988 6.900
470 HB2 GLU 59 HB2 GLU 59 16.242 4.236 7.988
471 HB3 GLU 59 HB3 GLU 59 16.945 3.304 6.664
472 HG2 GLU 59 HG2 GLU 59 16.947 5.420 5.266
473 HG3 GLU 59 HG3 GLU 59 16.418 6.311 6.699
474 H LYS 60 HN LYS 60 13.368 4.091 8.384
475 HA LYS 60 HA LYS 60 11.431 5.804 7.204
476 HB2 LYS 60 HB2 LYS 60 11.829 5.037 10.127
477 HB3 LYS 60 HB3 LYS 60 10.394 5.826 9.463
478 HG2 LYS 60 HG2 LYS 60 10.015 3.873 7.962
479 HG3 LYS 60 HG3 LYS 60 11.399 3.048 8.704
480 HD2 LYS 60 HD2 LYS 60 10.279 3.218 10.927
481 HD3 LYS 60 HD3 LYS 60 8.868 3.954 10.160
482 HE2 LYS 60 HE2 LYS 60 9.982 1.179 9.525
483 HE3 LYS 60 HE3 LYS 60 8.649 1.494 10.635
484 HZ1 LYS 60 HZ1 LYS 60 7.383 2.400 8.780
485 HZ2 LYS 60 HZ2 LYS 60 8.610 2.096 7.735
486 HZ3 LYS 60 HZ3 LYS 60 7.833 0.868 8.470
487 H LEU 61 HN LEU 61 14.280 6.583 9.088
488 HA LEU 61 HA LEU 61 13.299 8.964 10.254
489 HG LEU 61 HG LEU 61 15.392 6.443 10.862
490 HB2 LEU 61 HB2 LEU 61 16.201 8.327 9.534
491 HB3 LEU 61 HB3 LEU 61 15.646 9.478 10.744
492 HD11 LEU 61 HD11 LEU 61 16.974 6.638 12.722
493 HD12 LEU 61 HD12 LEU 61 17.648 7.332 11.235
494 HD13 LEU 61 HD13 LEU 61 17.033 8.406 12.512
495 HD21 LEU 61 HD21 LEU 61 13.429 7.390 11.929
496 HD22 LEU 61 HD22 LEU 61 14.532 6.793 13.173
497 HD23 LEU 61 HD23 LEU 61 14.427 8.542 12.848
498 H HIS 62 HN HIS 62 14.990 8.368 7.216
499 HA HIS 62 HA HIS 62 15.206 11.241 6.586
500 HD1 HIS 62 HD1 HIS 62 18.712 8.595 4.658
501 HD2 HIS 62 HD2 HIS 62 17.140 10.572 8.027
502 HE1 HIS 62 HE1 HIS 62 20.597 8.726 6.358
503 HB2 HIS 62 HB2 HIS 62 15.901 8.757 4.961
504 HB3 HIS 62 HB3 HIS 62 16.297 10.420 4.533
505 H THR 63 HN THR 63 13.404 12.273 5.657
506 HA THR 63 HA THR 63 11.487 10.601 4.137
507 HB THR 63 HB THR 63 9.795 12.096 5.247
508 HG1 THR 63 HG1 THR 63 11.029 13.799 5.989
509 HG21 THR 63 HG21 THR 63 10.414 9.793 6.046
510 HG22 THR 63 HG22 THR 63 11.528 10.543 7.211
511 HG23 THR 63 HG23 THR 63 9.783 10.863 7.317
512 H VAL 64 HN VAL 64 10.220 11.553 2.564
513 HA VAL 64 HA VAL 64 10.809 14.325 1.699
514 HB VAL 64 HB VAL 64 9.969 13.555 -0.525
515 HG11 VAL 64 HG11 VAL 64 12.575 12.193 0.117
516 HG12 VAL 64 HG12 VAL 64 12.053 12.911 -1.416
517 HG13 VAL 64 HG13 VAL 64 12.384 13.953 -0.021
518 HG21 VAL 64 HG21 VAL 64 8.943 11.428 0.040
519 HG22 VAL 64 HG22 VAL 64 10.144 11.238 -1.241
520 HG23 VAL 64 HG23 VAL 64 10.538 10.728 0.415
521 H LYS 65 HN LYS 65 8.804 15.261 0.743
522 HA LYS 65 HA LYS 65 6.292 13.972 1.701
523 HB2 LYS 65 HB2 LYS 65 7.042 15.909 3.177
524 HB3 LYS 65 HB3 LYS 65 6.809 16.965 1.774
525 HG2 LYS 65 HG2 LYS 65 4.424 16.320 1.665
526 HG3 LYS 65 HG3 LYS 65 4.668 15.138 2.961
527 HD2 LYS 65 HD2 LYS 65 3.579 17.082 3.864
528 HD3 LYS 65 HD3 LYS 65 5.212 16.968 4.540
529 HE2 LYS 65 HE2 LYS 65 5.999 18.691 2.926
530 HE3 LYS 65 HE3 LYS 65 4.384 18.766 2.208
531 HZ1 LYS 65 HZ1 LYS 65 5.040 19.507 5.004
532 HZ2 LYS 65 HZ2 LYS 65 4.736 20.552 3.793
533 HZ3 LYS 65 HZ3 LYS 65 3.549 19.581 4.338
534 H VAL 66 HN VAL 66 4.909 13.695 0.069
535 HA VAL 66 HA VAL 66 5.544 14.502 -2.620
536 HB VAL 66 HB VAL 66 3.146 13.147 -1.304
537 HG11 VAL 66 HG11 VAL 66 2.445 12.463 -3.605
538 HG12 VAL 66 HG12 VAL 66 2.288 14.200 -3.362
539 HG13 VAL 66 HG13 VAL 66 3.660 13.557 -4.298
540 HG21 VAL 66 HG21 VAL 66 5.379 12.087 -3.114
541 HG22 VAL 66 HG22 VAL 66 5.276 11.842 -1.362
542 HG23 VAL 66 HG23 VAL 66 4.055 11.133 -2.421
543 H LEU 67 HN LEU 67 4.595 16.028 -3.922
544 HA LEU 67 HA LEU 67 2.798 18.055 -2.647
545 HG LEU 67 HG LEU 67 5.997 18.113 -2.621
546 HB2 LEU 67 HB2 LEU 67 4.867 18.453 -4.838
547 HB3 LEU 67 HB3 LEU 67 3.864 19.700 -4.115
548 HD11 LEU 67 HD11 LEU 67 6.082 20.923 -3.783
549 HD12 LEU 67 HD12 LEU 67 7.363 20.154 -2.820
550 HD13 LEU 67 HD13 LEU 67 6.949 19.489 -4.393
551 HD21 LEU 67 HD21 LEU 67 5.809 19.848 -0.892
552 HD22 LEU 67 HD22 LEU 67 4.469 20.611 -1.783
553 HD23 LEU 67 HD23 LEU 67 4.281 18.984 -1.089
554 H SER 68 HN SER 68 3.665 16.236 -5.637
555 HA SER 68 HA SER 68 0.910 15.978 -6.437
556 HG SER 68 HG SER 68 1.115 18.432 -6.352
557 HB2 SER 68 HB2 SER 68 2.814 17.722 -8.086
558 HB3 SER 68 HB3 SER 68 1.325 17.011 -8.730
559 H ALA 69 HN ALA 69 0.875 14.519 -8.477
560 HA ALA 69 HA ALA 69 3.392 13.430 -9.375
561 HB1 ALA 69 HB1 ALA 69 3.116 12.072 -7.329
562 HB2 ALA 69 HB2 ALA 69 1.457 11.644 -7.816
563 HB3 ALA 69 HB3 ALA 69 2.845 11.066 -8.759
564 H SER 70 HN SER 70 3.078 11.928 -11.175
565 HA SER 70 HA SER 70 0.423 11.590 -12.334
566 HG SER 70 HG SER 70 2.463 14.661 -14.003
567 HB2 SER 70 HB2 SER 70 1.218 12.785 -14.493
568 HB3 SER 70 HB3 SER 70 0.635 13.771 -13.153
569 H SER 71 HN SER 71 0.452 10.042 -14.090
570 HA SER 71 HA SER 71 2.465 8.095 -14.202
571 HG SER 71 HG SER 71 -0.869 7.432 -15.419
572 HB2 SER 71 HB2 SER 71 0.565 8.916 -16.436
573 HB3 SER 71 HB3 SER 71 1.299 7.321 -16.181
574 H TYR 72 HN TYR 72 4.207 7.726 -15.734
575 HA TYR 72 HA TYR 72 5.647 10.135 -16.133
576 HD1 TYR 72 HD1 TYR 72 8.331 10.312 -16.243
577 HD2 TYR 72 HD2 TYR 72 7.295 7.245 -19.096
578 HE1 TYR 72 HE1 TYR 72 10.081 11.150 -17.766
579 HE2 TYR 72 HE2 TYR 72 9.064 8.061 -20.617
580 HH TYR 72 HH TYR 72 10.764 9.627 -20.947
581 HB2 TYR 72 HB2 TYR 72 6.894 8.174 -15.642
582 HB3 TYR 72 HB3 TYR 72 6.190 7.293 -17.002
583 H SER 73 HN SER 73 6.049 11.404 -17.834
584 HA SER 73 HA SER 73 5.942 10.431 -20.519
585 HG SER 73 HG SER 73 3.594 10.168 -19.940
586 HB2 SER 73 HB2 SER 73 4.008 12.580 -19.573
587 HB3 SER 73 HB3 SER 73 4.520 12.458 -21.270
588 HA PRO 74 HA PRO 74 9.533 12.761 -20.179
589 HB2 PRO 74 HB2 PRO 74 9.956 13.806 -22.756
590 HB3 PRO 74 HB3 PRO 74 10.342 12.144 -22.209
591 HG2 PRO 74 HG2 PRO 74 7.921 13.135 -23.712
592 HG3 PRO 74 HG3 PRO 74 8.834 11.613 -23.947
593 HD2 PRO 74 HD2 PRO 74 6.477 11.673 -22.598
594 HD3 PRO 74 HD3 PRO 74 7.814 10.606 -22.068
595 H ASP 75 HN ASP 75 7.250 14.730 -22.190
596 HA ASP 75 HA ASP 75 8.373 17.195 -21.332
597 HB2 ASP 75 HB2 ASP 75 6.988 16.876 -23.384
598 HB3 ASP 75 HB3 ASP 75 5.556 16.716 -22.362
599 H GLU 76 HN GLU 76 5.745 15.196 -19.985
600 HA GLU 76 HA GLU 76 4.804 17.080 -18.057
601 HB2 GLU 76 HB2 GLU 76 3.478 15.163 -18.779
602 HB3 GLU 76 HB3 GLU 76 4.728 14.060 -18.215
603 HG2 GLU 76 HG2 GLU 76 2.859 13.993 -16.730
604 HG3 GLU 76 HG3 GLU 76 4.283 14.585 -15.903
605 H TRP 77 HN TRP 77 7.467 14.715 -18.026
606 HA TRP 77 HA TRP 77 8.161 15.020 -15.247
607 HD1 TRP 77 HD1 TRP 77 10.580 14.451 -14.083
608 HE1 TRP 77 HE1 TRP 77 13.132 14.296 -13.974
609 HE3 TRP 77 HE3 TRP 77 11.536 13.445 -19.008
610 HZ2 TRP 77 HZ2 TRP 77 15.328 13.838 -15.803
611 HZ3 TRP 77 HZ3 TRP 77 13.867 13.159 -19.800
612 HH2 TRP 77 HH2 TRP 77 15.771 13.360 -18.211
613 HB2 TRP 77 HB2 TRP 77 8.961 13.098 -16.364
614 HB3 TRP 77 HB3 TRP 77 9.483 13.991 -17.760
615 H GLU 78 HN GLU 78 9.408 16.539 -18.285
616 HA GLU 78 HA GLU 78 11.192 18.200 -16.837
617 HB2 GLU 78 HB2 GLU 78 10.121 18.362 -19.674
618 HB3 GLU 78 HB3 GLU 78 11.364 19.456 -19.037
619 HG2 GLU 78 HG2 GLU 78 12.773 17.476 -18.423
620 HG3 GLU 78 HG3 GLU 78 11.602 16.414 -19.184
621 H ARG 79 HN ARG 79 7.864 18.840 -17.870
622 HA ARG 79 HA ARG 79 7.571 21.546 -17.157
623 HE ARG 79 HE ARG 79 4.512 19.546 -20.579
624 HB2 ARG 79 HB2 ARG 79 5.871 19.076 -16.792
625 HB3 ARG 79 HB3 ARG 79 5.280 20.640 -16.217
626 HG2 ARG 79 HG2 ARG 79 5.252 21.559 -18.455
627 HG3 ARG 79 HG3 ARG 79 6.061 20.140 -19.110
628 HD2 ARG 79 HD2 ARG 79 3.880 19.005 -17.797
629 HD3 ARG 79 HD3 ARG 79 3.205 20.533 -18.356
630 HH11 ARG 79 HH21 ARG 79 2.218 17.812 -18.435
631 HH12 ARG 79 HH22 ARG 79 1.327 17.170 -19.772
632 HH21 ARG 79 HH11 ARG 79 3.602 18.482 -22.178
633 HH22 ARG 79 HH12 ARG 79 2.198 17.448 -21.993
634 H GLN 80 HN GLN 80 7.308 18.678 -14.977
635 HA GLN 80 HA GLN 80 6.901 20.219 -12.627
636 HB2 GLN 80 HB2 GLN 80 7.832 17.346 -13.050
637 HB3 GLN 80 HB3 GLN 80 7.454 18.036 -11.461
638 HG2 GLN 80 HG2 GLN 80 5.162 18.491 -12.116
639 HG3 GLN 80 HG3 GLN 80 5.481 18.033 -13.782
640 HE21 GLN 80 HE22 GLN 80 5.336 15.910 -14.421
641 HE22 GLN 80 HE21 GLN 80 4.657 14.685 -13.356
642 H CYS 81 HN CYS 81 9.878 19.025 -14.213
643 HA CYS 81 HA CYS 81 11.692 19.669 -12.123
644 HG CYS 81 HG CYS 81 11.033 17.431 -14.424
645 HB2 CYS 81 HB2 CYS 81 12.131 19.731 -15.134
646 HB3 CYS 81 HB3 CYS 81 13.400 19.715 -13.903
647 H LYS 82 HN LYS 82 10.138 21.811 -14.549
648 HA LYS 82 HA LYS 82 11.958 23.989 -14.203
649 HB2 LYS 82 HB2 LYS 82 8.986 24.239 -14.842
650 HB3 LYS 82 HB3 LYS 82 10.251 25.420 -15.145
651 HG2 LYS 82 HG2 LYS 82 9.751 22.821 -16.593
652 HG3 LYS 82 HG3 LYS 82 9.645 24.456 -17.216
653 HD2 LYS 82 HD2 LYS 82 12.110 24.722 -16.970
654 HD3 LYS 82 HD3 LYS 82 12.221 23.039 -16.387
655 HE2 LYS 82 HE2 LYS 82 11.207 22.227 -18.481
656 HE3 LYS 82 HE3 LYS 82 11.070 23.889 -19.074
657 HZ1 LYS 82 HZ1 LYS 82 13.627 22.503 -18.484
658 HZ2 LYS 82 HZ2 LYS 82 13.027 22.791 -19.971
659 HZ3 LYS 82 HZ3 LYS 82 13.493 24.037 -19.034
660 H VAL 83 HN VAL 83 9.041 22.879 -12.478
661 HA VAL 83 HA VAL 83 8.797 25.209 -10.927
662 HB VAL 83 HB VAL 83 7.833 22.448 -10.104
663 HG11 VAL 83 HG11 VAL 83 6.017 23.688 -9.033
664 HG12 VAL 83 HG12 VAL 83 7.558 24.387 -8.500
665 HG13 VAL 83 HG13 VAL 83 6.595 25.221 -9.724
666 HG21 VAL 83 HG21 VAL 83 7.086 22.697 -12.412
667 HG22 VAL 83 HG22 VAL 83 5.717 22.976 -11.346
668 HG23 VAL 83 HG23 VAL 83 6.539 24.360 -12.103
669 H ALA 84 HN ALA 84 10.477 22.084 -10.298
670 HA ALA 84 HA ALA 84 11.549 22.715 -7.718
671 HB1 ALA 84 HB1 ALA 84 11.632 20.466 -8.588
672 HB2 ALA 84 HB2 ALA 84 12.618 20.972 -9.988
673 HB3 ALA 84 HB3 ALA 84 13.294 21.030 -8.355
674 H GLY 85 HN GLY 85 12.744 23.470 -11.015
675 HA2 GLY 85 HA2 GLY 85 15.111 24.846 -10.094
676 HA3 GLY 85 HA3 GLY 85 14.420 24.847 -11.723
677 H LYS 86 HN LYS 86 11.982 25.806 -9.544
678 HA LYS 86 HA LYS 86 10.798 27.670 -9.440
679 HB2 LYS 86 HB2 LYS 86 12.691 27.968 -7.741
680 HB3 LYS 86 HB3 LYS 86 13.380 29.146 -8.854
681 HG2 LYS 86 HG2 LYS 86 11.423 30.600 -8.597
682 HG3 LYS 86 HG3 LYS 86 10.531 29.318 -7.767
683 HD2 LYS 86 HD2 LYS 86 11.304 30.970 -6.152
684 HD3 LYS 86 HD3 LYS 86 12.086 29.410 -5.878
685 HE2 LYS 86 HE2 LYS 86 14.045 30.339 -7.304
686 HE3 LYS 86 HE3 LYS 86 13.284 31.917 -7.152
687 HZ1 LYS 86 HZ1 LYS 86 15.042 31.323 -5.495
688 HZ2 LYS 86 HZ2 LYS 86 13.627 31.825 -4.798
689 HZ3 LYS 86 HZ3 LYS 86 14.035 30.225 -4.838
690 H THR 87 HN THR 87 11.642 26.953 -12.046
691 HA THR 87 HA THR 87 11.865 27.614 -14.157
692 HB THR 87 HB THR 87 9.976 29.876 -13.435
693 HG1 THR 87 HG1 THR 87 9.262 28.029 -12.378
694 HG21 THR 87 HG21 THR 87 8.889 29.231 -15.569
695 HG22 THR 87 HG22 THR 87 10.574 29.683 -15.848
696 HG23 THR 87 HG23 THR 87 10.114 27.969 -15.827
697 H GLN 88 HN GLN 88 14.111 28.321 -12.858
698 HA GLN 88 HA GLN 88 14.977 30.591 -14.456
699 HB2 GLN 88 HB2 GLN 88 16.266 31.602 -12.603
700 HB3 GLN 88 HB3 GLN 88 14.529 31.712 -12.343
701 HG2 GLN 88 HG2 GLN 88 14.596 29.886 -10.727
702 HG3 GLN 88 HG3 GLN 88 16.313 29.608 -11.042
703 HE21 GLN 88 HE22 GLN 88 17.870 31.262 -10.310
704 HE22 GLN 88 HE21 GLN 88 17.421 32.366 -9.035
Start of MODEL 14
1 HA MET 1 HA MET 1 3.475 -1.134 -3.047
2 H1 MET 1 H1 MET 1 1.637 -1.293 -1.558
3 H2 MET 1 H2 MET 1 3.048 -1.103 -0.721
4 H3 MET 1 H3 MET 1 2.009 0.156 -0.866
5 HB2 MET 1 HB2 MET 1 1.332 -0.132 -3.813
6 HB3 MET 1 HB3 MET 1 1.819 1.427 -3.133
7 HG2 MET 1 HG2 MET 1 2.239 1.360 -5.540
8 HG3 MET 1 HG3 MET 1 3.758 1.506 -4.666
9 HE1 MET 1 HE1 MET 1 4.873 -0.429 -7.820
10 HE2 MET 1 HE2 MET 1 3.672 0.875 -7.699
11 HE3 MET 1 HE3 MET 1 5.170 0.958 -6.747
12 H GLU 2 HN GLU 2 5.503 -0.390 -3.441
13 HA GLU 2 HA GLU 2 6.540 1.938 -1.945
14 HB2 GLU 2 HB2 GLU 2 7.980 -0.746 -2.192
15 HB3 GLU 2 HB3 GLU 2 8.545 0.714 -1.393
16 HG2 GLU 2 HG2 GLU 2 7.869 -0.597 0.400
17 HG3 GLU 2 HG3 GLU 2 6.488 0.469 0.166
18 H TRP 3 HN TRP 3 8.303 2.916 -3.168
19 HA TRP 3 HA TRP 3 8.167 2.185 -6.050
20 HD1 TRP 3 HD1 TRP 3 6.025 4.585 -3.323
21 HE1 TRP 3 HE1 TRP 3 3.532 4.478 -3.871
22 HE3 TRP 3 HE3 TRP 3 6.348 3.851 -8.375
23 HZ2 TRP 3 HZ2 TRP 3 1.871 4.062 -6.216
24 HZ3 TRP 3 HZ3 TRP 3 4.299 3.579 -9.742
25 HH2 TRP 3 HH2 TRP 3 2.056 3.679 -8.673
26 HB2 TRP 3 HB2 TRP 3 8.201 4.967 -4.826
27 HB3 TRP 3 HB3 TRP 3 8.087 4.575 -6.532
28 H LEU 4 HN LEU 4 9.936 3.010 -7.308
29 HA LEU 4 HA LEU 4 12.525 3.210 -5.844
30 HG LEU 4 HG LEU 4 14.144 3.061 -8.543
31 HB2 LEU 4 HB2 LEU 4 12.240 1.144 -7.134
32 HB3 LEU 4 HB3 LEU 4 11.822 2.096 -8.567
33 HD11 LEU 4 HD11 LEU 4 15.882 1.798 -7.259
34 HD12 LEU 4 HD12 LEU 4 14.794 2.710 -6.214
35 HD13 LEU 4 HD13 LEU 4 14.593 0.955 -6.379
36 HD21 LEU 4 HD21 LEU 4 13.974 0.020 -8.699
37 HD22 LEU 4 HD22 LEU 4 13.489 1.146 -9.986
38 HD23 LEU 4 HD23 LEU 4 15.184 1.052 -9.488
39 H VAL 5 HN VAL 5 13.521 5.007 -6.143
40 HA VAL 5 HA VAL 5 12.700 7.136 -8.050
41 HB VAL 5 HB VAL 5 15.141 7.008 -6.215
42 HG11 VAL 5 HG11 VAL 5 13.810 9.324 -7.647
43 HG12 VAL 5 HG12 VAL 5 15.122 9.471 -6.451
44 HG13 VAL 5 HG13 VAL 5 15.420 8.645 -7.975
45 HG21 VAL 5 HG21 VAL 5 13.169 6.892 -4.774
46 HG22 VAL 5 HG22 VAL 5 13.779 8.541 -4.708
47 HG23 VAL 5 HG23 VAL 5 12.353 8.153 -5.705
48 H LYS 6 HN LYS 6 13.218 6.705 -10.073
49 HA LYS 6 HA LYS 6 15.754 5.313 -10.797
50 HB2 LYS 6 HB2 LYS 6 13.119 5.716 -12.138
51 HB3 LYS 6 HB3 LYS 6 14.532 5.423 -13.133
52 HG2 LYS 6 HG2 LYS 6 14.119 3.556 -10.815
53 HG3 LYS 6 HG3 LYS 6 13.005 3.421 -12.164
54 HD2 LYS 6 HD2 LYS 6 14.915 1.870 -12.350
55 HD3 LYS 6 HD3 LYS 6 14.742 2.953 -13.734
56 HE2 LYS 6 HE2 LYS 6 16.581 4.372 -12.910
57 HE3 LYS 6 HE3 LYS 6 16.732 3.361 -11.458
58 HZ1 LYS 6 HZ1 LYS 6 17.224 2.440 -14.235
59 HZ2 LYS 6 HZ2 LYS 6 18.371 2.770 -13.129
60 HZ3 LYS 6 HZ3 LYS 6 17.368 1.510 -12.898
61 H LYS 7 HN LYS 7 14.278 8.486 -10.818
62 HA LYS 7 HA LYS 7 16.717 9.694 -11.832
63 HB2 LYS 7 HB2 LYS 7 14.063 10.164 -13.247
64 HB3 LYS 7 HB3 LYS 7 15.409 11.303 -13.271
65 HG2 LYS 7 HG2 LYS 7 16.887 9.632 -14.285
66 HG3 LYS 7 HG3 LYS 7 15.577 8.444 -14.284
67 HD2 LYS 7 HD2 LYS 7 14.220 9.942 -15.734
68 HD3 LYS 7 HD3 LYS 7 15.590 11.056 -15.848
69 HE2 LYS 7 HE2 LYS 7 15.700 8.096 -16.621
70 HE3 LYS 7 HE3 LYS 7 15.313 9.387 -17.767
71 HZ1 LYS 7 HZ1 LYS 7 17.876 9.140 -16.298
72 HZ2 LYS 7 HZ2 LYS 7 17.639 8.815 -17.875
73 HZ3 LYS 7 HZ3 LYS 7 17.501 10.344 -17.342
74 H SER 8 HN SER 8 16.863 11.849 -10.931
75 HA SER 8 HA SER 8 14.720 12.859 -9.170
76 HG SER 8 HG SER 8 18.311 12.137 -8.692
77 HB2 SER 8 HB2 SER 8 16.616 12.966 -7.383
78 HB3 SER 8 HB3 SER 8 15.758 11.444 -7.641
79 H CYS 9 HN CYS 9 15.145 15.053 -8.547
80 HA CYS 9 HA CYS 9 17.328 16.493 -9.986
81 HG CYS 9 HG CYS 9 16.144 16.780 -12.240
82 HB2 CYS 9 HB2 CYS 9 14.462 17.417 -9.451
83 HB3 CYS 9 HB3 CYS 9 15.737 18.387 -10.202
84 H CYS 10 HN CYS 10 17.983 18.496 -8.849
85 HA CYS 10 HA CYS 10 17.666 18.318 -5.884
86 HG CYS 10 HG CYS 10 21.382 16.927 -6.466
87 HB2 CYS 10 HB2 CYS 10 20.160 19.009 -7.490
88 HB3 CYS 10 HB3 CYS 10 20.013 19.034 -5.728
89 H ASN 11 HN ASN 11 17.714 20.355 -4.768
90 HA ASN 11 HA ASN 11 17.566 22.894 -6.278
91 HB2 ASN 11 HB2 ASN 11 15.378 23.181 -6.224
92 HB3 ASN 11 HB3 ASN 11 15.222 21.448 -6.018
93 HD21 ASN 11 HD22 ASN 11 15.089 20.646 -3.685
94 HD22 ASN 11 HD21 ASN 11 14.274 21.665 -2.546
95 H LYS 12 HN LYS 12 17.422 24.671 -4.939
96 HA LYS 12 HA LYS 12 17.222 24.394 -2.056
97 HB2 LYS 12 HB2 LYS 12 19.181 25.895 -1.596
98 HB3 LYS 12 HB3 LYS 12 19.526 24.234 -2.021
99 HG2 LYS 12 HG2 LYS 12 21.127 25.760 -3.032
100 HG3 LYS 12 HG3 LYS 12 20.237 24.848 -4.257
101 HD2 LYS 12 HD2 LYS 12 18.886 26.782 -4.816
102 HD3 LYS 12 HD3 LYS 12 19.474 27.667 -3.407
103 HE2 LYS 12 HE2 LYS 12 20.561 28.538 -5.387
104 HE3 LYS 12 HE3 LYS 12 21.750 27.739 -4.361
105 HZ1 LYS 12 HZ1 LYS 12 21.681 25.833 -5.858
106 HZ2 LYS 12 HZ2 LYS 12 20.544 26.550 -6.799
107 HZ3 LYS 12 HZ3 LYS 12 22.039 27.180 -6.692
108 H GLN 13 HN GLN 13 16.188 25.761 -4.831
109 HA GLN 13 HA GLN 13 16.056 28.548 -4.074
110 HB2 GLN 13 HB2 GLN 13 14.595 26.991 -6.248
111 HB3 GLN 13 HB3 GLN 13 14.689 28.736 -6.098
112 HG2 GLN 13 HG2 GLN 13 16.259 28.440 -7.697
113 HG3 GLN 13 HG3 GLN 13 17.304 28.366 -6.292
114 HE21 GLN 13 HE22 GLN 13 17.377 27.129 -9.178
115 HE22 GLN 13 HE21 GLN 13 17.771 25.458 -8.847
116 H ASP 14 HN ASP 14 13.891 25.669 -3.927
117 HA ASP 14 HA ASP 14 11.964 27.324 -2.350
118 HB2 ASP 14 HB2 ASP 14 11.462 27.361 -4.885
119 HB3 ASP 14 HB3 ASP 14 11.024 25.660 -4.701
120 H ASN 15 HN ASN 15 13.694 24.607 -2.331
121 HA ASN 15 HA ASN 15 13.773 22.795 -1.106
122 HB2 ASN 15 HB2 ASN 15 12.391 24.307 0.566
123 HB3 ASN 15 HB3 ASN 15 11.120 23.141 0.215
124 HD21 ASN 15 HD22 ASN 15 12.626 20.723 0.046
125 HD22 ASN 15 HD21 ASN 15 13.329 20.407 1.635
126 H ARG 16 HN ARG 16 11.439 23.318 -3.460
127 HA ARG 16 HA ARG 16 10.071 20.749 -3.400
128 HE ARG 16 HE ARG 16 7.367 25.410 -4.662
129 HB2 ARG 16 HB2 ARG 16 10.461 22.773 -5.654
130 HB3 ARG 16 HB3 ARG 16 9.414 21.349 -5.738
131 HG2 ARG 16 HG2 ARG 16 8.037 22.236 -3.877
132 HG3 ARG 16 HG3 ARG 16 9.090 23.661 -3.781
133 HD2 ARG 16 HD2 ARG 16 8.554 24.150 -6.186
134 HD3 ARG 16 HD3 ARG 16 7.368 22.846 -6.164
135 HH11 ARG 16 HH11 ARG 16 5.480 22.470 -5.568
136 HH12 ARG 16 HH12 ARG 16 3.994 23.125 -4.973
137 HH21 ARG 16 HH21 ARG 16 5.376 26.223 -3.936
138 HH22 ARG 16 HH22 ARG 16 3.927 25.292 -4.029
139 H HIS 17 HN HIS 17 10.667 18.865 -4.357
140 HA HIS 17 HA HIS 17 12.967 18.824 -6.246
141 HD1 HIS 17 HD1 HIS 17 13.963 17.579 -1.952
142 HD2 HIS 17 HD2 HIS 17 15.325 18.711 -5.762
143 HE1 HIS 17 HE1 HIS 17 16.213 18.744 -1.590
144 HB2 HIS 17 HB2 HIS 17 12.379 16.931 -3.927
145 HB3 HIS 17 HB3 HIS 17 13.412 16.489 -5.285
146 H VAL 18 HN VAL 18 12.814 16.816 -7.635
147 HA VAL 18 HA VAL 18 10.095 15.776 -7.886
148 HB VAL 18 HB VAL 18 11.339 16.651 -10.468
149 HG11 VAL 18 HG11 VAL 18 9.185 15.334 -10.312
150 HG12 VAL 18 HG12 VAL 18 8.430 16.732 -9.541
151 HG13 VAL 18 HG13 VAL 18 9.048 16.851 -11.203
152 HG21 VAL 18 HG21 VAL 18 9.843 18.677 -8.757
153 HG22 VAL 18 HG22 VAL 18 11.546 18.768 -9.270
154 HG23 VAL 18 HG23 VAL 18 10.268 18.856 -10.464
155 H LEU 19 HN LEU 19 10.078 13.744 -8.675
156 HA LEU 19 HA LEU 19 12.600 12.562 -9.633
157 HG LEU 19 HG LEU 19 10.686 12.424 -6.277
158 HB2 LEU 19 HB2 LEU 19 11.646 10.653 -7.821
159 HB3 LEU 19 HB3 LEU 19 13.162 11.503 -7.803
160 HD11 LEU 19 HD11 LEU 19 13.135 10.877 -5.370
161 HD12 LEU 19 HD12 LEU 19 11.796 11.447 -4.335
162 HD13 LEU 19 HD13 LEU 19 11.496 10.232 -5.582
163 HD21 LEU 19 HD21 LEU 19 13.539 13.445 -6.492
164 HD22 LEU 19 HD22 LEU 19 12.024 14.351 -6.254
165 HD23 LEU 19 HD23 LEU 19 12.743 13.504 -4.904
166 H MET 20 HN MET 20 12.240 10.217 -10.204
167 HA MET 20 HA MET 20 9.629 10.013 -11.632
168 HB2 MET 20 HB2 MET 20 11.657 10.314 -13.051
169 HB3 MET 20 HB3 MET 20 12.323 8.820 -12.368
170 HG2 MET 20 HG2 MET 20 10.388 7.561 -13.280
171 HG3 MET 20 HG3 MET 20 9.696 9.068 -13.879
172 HE1 MET 20 HE1 MET 20 13.487 7.787 -14.001
173 HE2 MET 20 HE2 MET 20 12.480 6.364 -14.305
174 HE3 MET 20 HE3 MET 20 13.489 7.032 -15.610
175 H LEU 21 HN LEU 21 8.435 8.867 -10.256
176 HA LEU 21 HA LEU 21 9.606 6.861 -8.418
177 HG LEU 21 HG LEU 21 8.604 7.238 -6.320
178 HB2 LEU 21 HB2 LEU 21 6.971 8.338 -8.645
179 HB3 LEU 21 HB3 LEU 21 6.931 6.702 -7.993
180 HD11 LEU 21 HD11 LEU 21 8.555 9.976 -7.628
181 HD12 LEU 21 HD12 LEU 21 9.044 9.785 -5.931
182 HD13 LEU 21 HD13 LEU 21 9.946 8.965 -7.217
183 HD21 LEU 21 HD21 LEU 21 7.144 8.677 -4.905
184 HD22 LEU 21 HD22 LEU 21 6.201 9.115 -6.345
185 HD23 LEU 21 HD23 LEU 21 6.228 7.437 -5.775
186 H CYS 22 HN CYS 22 9.555 4.771 -8.856
187 HA CYS 22 HA CYS 22 7.896 3.808 -11.140
188 HG CYS 22 HG CYS 22 10.808 5.658 -11.001
189 HB2 CYS 22 HB2 CYS 22 10.807 3.131 -10.528
190 HB3 CYS 22 HB3 CYS 22 9.861 2.624 -11.938
191 H ASP 23 HN ASP 23 7.789 1.428 -11.203
192 HA ASP 23 HA ASP 23 7.058 0.100 -8.774
193 HB2 ASP 23 HB2 ASP 23 6.310 -1.001 -10.684
194 HB3 ASP 23 HB3 ASP 23 7.762 -0.629 -11.602
195 H ALA 24 HN ALA 24 8.300 -1.390 -7.477
196 HA ALA 24 HA ALA 24 11.060 -0.733 -7.015
197 HB1 ALA 24 HB1 ALA 24 9.561 -1.399 -5.200
198 HB2 ALA 24 HB2 ALA 24 9.330 -3.000 -5.944
199 HB3 ALA 24 HB3 ALA 24 10.927 -2.523 -5.328
200 H GLY 25 HN GLY 25 11.717 -1.051 -9.269
201 HA2 GLY 25 HA2 GLY 25 13.327 -3.122 -10.029
202 HA3 GLY 25 HA3 GLY 25 11.696 -3.713 -10.427
203 H GLY 26 HN GLY 26 10.968 -0.734 -10.859
204 HA2 GLY 26 HA2 GLY 26 11.240 0.955 -12.408
205 HA3 GLY 26 HA3 GLY 26 12.451 0.010 -13.274
206 H ALA 27 HN ALA 27 9.614 -1.915 -12.741
207 HA ALA 27 HA ALA 27 9.333 -2.158 -15.570
208 HB1 ALA 27 HB1 ALA 27 7.500 -3.178 -13.357
209 HB2 ALA 27 HB2 ALA 27 7.578 -3.778 -15.024
210 HB3 ALA 27 HB3 ALA 27 8.968 -4.000 -13.945
211 H ILE 28 HN ILE 28 7.813 0.070 -13.424
212 HA ILE 28 HA ILE 28 5.917 1.030 -15.461
213 HB ILE 28 HB ILE 28 5.178 0.422 -12.551
214 HG12 ILE 28 HG12 ILE 28 4.173 -0.897 -15.114
215 HG13 ILE 28 HG13 ILE 28 5.182 -1.646 -13.874
216 HG21 ILE 28 HG21 ILE 28 2.920 1.253 -13.119
217 HG22 ILE 28 HG22 ILE 28 4.103 2.506 -13.381
218 HG23 ILE 28 HG23 ILE 28 3.451 1.611 -14.776
219 HD11 ILE 28 HD11 ILE 28 2.988 -2.464 -13.551
220 HD12 ILE 28 HD12 ILE 28 3.322 -1.338 -12.218
221 HD13 ILE 28 HD13 ILE 28 2.278 -0.846 -13.579
222 H LYS 29 HN LYS 29 5.676 3.396 -15.132
223 HA LYS 29 HA LYS 29 7.495 4.576 -13.101
224 HB2 LYS 29 HB2 LYS 29 7.669 5.185 -16.084
225 HB3 LYS 29 HB3 LYS 29 8.550 5.981 -14.777
226 HG2 LYS 29 HG2 LYS 29 9.440 3.578 -14.209
227 HG3 LYS 29 HG3 LYS 29 8.889 3.143 -15.823
228 HD2 LYS 29 HD2 LYS 29 10.410 4.702 -16.858
229 HD3 LYS 29 HD3 LYS 29 10.689 5.532 -15.335
230 HE2 LYS 29 HE2 LYS 29 12.655 4.256 -15.821
231 HE3 LYS 29 HE3 LYS 29 11.879 3.565 -14.407
232 HZ1 LYS 29 HZ1 LYS 29 12.629 1.905 -16.079
233 HZ2 LYS 29 HZ2 LYS 29 11.031 1.767 -15.796
234 HZ3 LYS 29 HZ3 LYS 29 11.575 2.488 -17.170
235 H MET 30 HN MET 30 7.062 6.662 -12.536
236 HA MET 30 HA MET 30 4.774 8.161 -13.617
237 HB2 MET 30 HB2 MET 30 5.149 7.440 -10.673
238 HB3 MET 30 HB3 MET 30 3.938 8.521 -11.342
239 HG2 MET 30 HG2 MET 30 3.300 6.354 -12.777
240 HG3 MET 30 HG3 MET 30 4.058 5.540 -11.411
241 HE1 MET 30 HE1 MET 30 3.332 6.486 -8.818
242 HE2 MET 30 HE2 MET 30 2.913 8.164 -9.245
243 HE3 MET 30 HE3 MET 30 1.702 7.117 -8.485
244 H ILE 31 HN ILE 31 4.779 10.337 -12.333
245 HA ILE 31 HA ILE 31 7.556 11.342 -11.893
246 HB ILE 31 HB ILE 31 5.141 12.674 -13.127
247 HG12 ILE 31 HG12 ILE 31 7.879 12.450 -14.452
248 HG13 ILE 31 HG13 ILE 31 6.786 11.071 -14.497
249 HG21 ILE 31 HG21 ILE 31 6.789 14.625 -13.460
250 HG22 ILE 31 HG22 ILE 31 6.164 14.388 -11.831
251 HG23 ILE 31 HG23 ILE 31 7.803 13.835 -12.232
252 HD11 ILE 31 HD11 ILE 31 6.414 12.388 -16.457
253 HD12 ILE 31 HD12 ILE 31 4.983 12.463 -15.412
254 HD13 ILE 31 HD13 ILE 31 6.102 13.842 -15.482
255 H ALA 32 HN ALA 32 7.723 12.446 -9.839
256 HA ALA 32 HA ALA 32 5.208 13.277 -8.547
257 HB1 ALA 32 HB1 ALA 32 7.322 11.702 -7.038
258 HB2 ALA 32 HB2 ALA 32 5.800 12.339 -6.400
259 HB3 ALA 32 HB3 ALA 32 5.763 11.021 -7.591
260 H GLU 33 HN GLU 33 5.412 15.129 -7.499
261 HA GLU 33 HA GLU 33 8.060 16.459 -7.302
262 HB2 GLU 33 HB2 GLU 33 6.110 17.617 -8.515
263 HB3 GLU 33 HB3 GLU 33 5.250 17.629 -6.968
264 HG2 GLU 33 HG2 GLU 33 7.223 18.910 -6.001
265 HG3 GLU 33 HG3 GLU 33 7.874 19.025 -7.633
266 H VAL 34 HN VAL 34 8.767 16.934 -5.217
267 HA VAL 34 HA VAL 34 7.130 16.157 -2.901
268 HB VAL 34 HB VAL 34 8.809 14.671 -2.022
269 HG11 VAL 34 HG11 VAL 34 7.112 13.667 -3.575
270 HG12 VAL 34 HG12 VAL 34 8.310 13.756 -4.881
271 HG13 VAL 34 HG13 VAL 34 8.621 12.752 -3.455
272 HG21 VAL 34 HG21 VAL 34 10.768 13.911 -3.347
273 HG22 VAL 34 HG22 VAL 34 10.430 15.178 -4.547
274 HG23 VAL 34 HG23 VAL 34 10.872 15.603 -2.872
275 H LYS 35 HN LYS 35 8.649 16.578 -0.893
276 HA LYS 35 HA LYS 35 10.412 18.914 -1.209
277 HB2 LYS 35 HB2 LYS 35 7.857 19.297 -0.376
278 HB3 LYS 35 HB3 LYS 35 8.503 18.702 1.143
279 HG2 LYS 35 HG2 LYS 35 10.176 20.527 1.144
280 HG3 LYS 35 HG3 LYS 35 9.586 21.089 -0.438
281 HD2 LYS 35 HD2 LYS 35 7.295 21.395 0.593
282 HD3 LYS 35 HD3 LYS 35 7.994 20.980 2.171
283 HE2 LYS 35 HE2 LYS 35 9.557 22.918 1.948
284 HE3 LYS 35 HE3 LYS 35 8.810 23.317 0.388
285 HZ1 LYS 35 HZ1 LYS 35 6.722 23.701 1.567
286 HZ2 LYS 35 HZ2 LYS 35 7.411 23.332 3.004
287 HZ3 LYS 35 HZ3 LYS 35 7.893 24.650 2.180
288 H SER 36 HN SER 36 12.074 18.759 0.523
289 HA SER 36 HA SER 36 12.133 16.105 1.893
290 HG SER 36 HG SER 36 13.553 15.472 -1.275
291 HB2 SER 36 HB2 SER 36 14.574 17.021 0.417
292 HB3 SER 36 HB3 SER 36 14.009 15.388 0.808
293 H ASP 37 HN ASP 37 13.551 15.907 3.632
294 HA ASP 37 HA ASP 37 14.921 18.410 4.541
295 HB2 ASP 37 HB2 ASP 37 12.968 17.719 5.924
296 HB3 ASP 37 HB3 ASP 37 13.764 16.179 6.243
297 H PHE 38 HN PHE 38 15.587 15.716 2.952
298 HA PHE 38 HA PHE 38 18.310 15.369 3.974
299 HD1 PHE 38 HD1 PHE 38 14.673 13.789 5.061
300 HD2 PHE 38 HD2 PHE 38 18.745 13.094 6.304
301 HE1 PHE 38 HE1 PHE 38 13.941 13.746 7.432
302 HE2 PHE 38 HE2 PHE 38 18.005 13.033 8.671
303 HZ PHE 38 HZ PHE 38 15.606 13.364 9.240
304 HB2 PHE 38 HB2 PHE 38 16.442 13.020 3.461
305 HB3 PHE 38 HB3 PHE 38 18.118 12.925 3.952
306 H ALA 39 HN ALA 39 19.580 14.192 2.237
307 HA ALA 39 HA ALA 39 18.923 15.062 -0.406
308 HB1 ALA 39 HB1 ALA 39 21.252 14.738 0.361
309 HB2 ALA 39 HB2 ALA 39 20.953 12.993 0.551
310 HB3 ALA 39 HB3 ALA 39 20.906 13.734 -1.059
311 H VAL 40 HN VAL 40 18.420 13.738 -2.250
312 HA VAL 40 HA VAL 40 17.476 10.975 -1.846
313 HB VAL 40 HB VAL 40 15.844 13.060 -3.370
314 HG11 VAL 40 HG11 VAL 40 14.066 11.321 -3.232
315 HG12 VAL 40 HG12 VAL 40 15.494 10.748 -4.104
316 HG13 VAL 40 HG13 VAL 40 15.209 10.229 -2.431
317 HG21 VAL 40 HG21 VAL 40 15.261 12.051 -0.567
318 HG22 VAL 40 HG22 VAL 40 15.672 13.722 -1.019
319 HG23 VAL 40 HG23 VAL 40 14.163 13.009 -1.581
320 H LYS 41 HN LYS 41 18.008 9.733 -3.741
321 HA LYS 41 HA LYS 41 18.624 11.136 -6.210
322 HB2 LYS 41 HB2 LYS 41 20.865 10.630 -6.456
323 HB3 LYS 41 HB3 LYS 41 20.773 11.233 -4.816
324 HG2 LYS 41 HG2 LYS 41 21.021 8.341 -5.700
325 HG3 LYS 41 HG3 LYS 41 22.280 9.330 -4.981
326 HD2 LYS 41 HD2 LYS 41 21.104 9.400 -2.856
327 HD3 LYS 41 HD3 LYS 41 19.723 8.533 -3.544
328 HE2 LYS 41 HE2 LYS 41 22.484 7.295 -3.616
329 HE3 LYS 41 HE3 LYS 41 21.485 7.202 -2.158
330 HZ1 LYS 41 HZ1 LYS 41 20.559 6.259 -4.810
331 HZ2 LYS 41 HZ2 LYS 41 21.154 5.288 -3.622
332 HZ3 LYS 41 HZ3 LYS 41 19.768 6.137 -3.369
333 H VAL 42 HN VAL 42 19.330 9.469 -7.907
334 HA VAL 42 HA VAL 42 17.457 7.489 -8.262
335 HB VAL 42 HB VAL 42 20.294 7.668 -9.388
336 HG11 VAL 42 HG11 VAL 42 19.233 6.456 -11.365
337 HG12 VAL 42 HG12 VAL 42 19.480 5.466 -9.927
338 HG13 VAL 42 HG13 VAL 42 17.858 6.087 -10.294
339 HG21 VAL 42 HG21 VAL 42 18.917 8.739 -11.313
340 HG22 VAL 42 HG22 VAL 42 17.607 8.864 -10.100
341 HG23 VAL 42 HG23 VAL 42 19.145 9.710 -9.859
342 H GLY 43 HN GLY 43 17.377 5.274 -8.150
343 HA2 GLY 43 HA2 GLY 43 17.717 3.188 -7.315
344 HA3 GLY 43 HA3 GLY 43 19.374 3.627 -6.842
345 H ASP 44 HN ASP 44 16.320 5.362 -5.935
346 HA ASP 44 HA ASP 44 16.966 4.590 -3.060
347 HB2 ASP 44 HB2 ASP 44 15.767 7.172 -4.092
348 HB3 ASP 44 HB3 ASP 44 15.398 6.549 -2.491
349 H LEU 45 HN LEU 45 15.325 3.760 -1.763
350 HA LEU 45 HA LEU 45 12.851 2.968 -3.159
351 HG LEU 45 HG LEU 45 11.218 2.094 -0.950
352 HB2 LEU 45 HB2 LEU 45 14.173 1.500 -1.465
353 HB3 LEU 45 HB3 LEU 45 13.655 2.652 -0.239
354 HD11 LEU 45 HD11 LEU 45 12.635 -0.300 -2.197
355 HD12 LEU 45 HD12 LEU 45 10.882 -0.103 -1.985
356 HD13 LEU 45 HD13 LEU 45 11.758 0.959 -3.091
357 HD21 LEU 45 HD21 LEU 45 11.213 0.055 0.448
358 HD22 LEU 45 HD22 LEU 45 12.993 0.027 0.391
359 HD23 LEU 45 HD23 LEU 45 12.126 1.393 1.152
360 H LEU 46 HN LEU 46 10.801 3.780 -2.486
361 HA LEU 46 HA LEU 46 10.683 5.797 -0.310
362 HG LEU 46 HG LEU 46 11.389 6.935 -3.208
363 HB2 LEU 46 HB2 LEU 46 9.170 5.942 -2.956
364 HB3 LEU 46 HB3 LEU 46 8.859 6.949 -1.548
365 HD11 LEU 46 HD11 LEU 46 9.496 7.926 -4.369
366 HD12 LEU 46 HD12 LEU 46 9.091 8.939 -2.967
367 HD13 LEU 46 HD13 LEU 46 10.586 9.226 -3.872
368 HD21 LEU 46 HD21 LEU 46 11.946 7.568 -0.931
369 HD22 LEU 46 HD22 LEU 46 11.966 9.026 -1.927
370 HD23 LEU 46 HD23 LEU 46 10.583 8.685 -0.849
371 H SER 47 HN SER 47 9.338 5.013 1.170
372 HA SER 47 HA SER 47 7.018 3.338 0.314
373 HG SER 47 HG SER 47 9.411 1.042 1.771
374 HB2 SER 47 HB2 SER 47 8.590 2.866 2.864
375 HB3 SER 47 HB3 SER 47 7.306 1.869 2.175
376 HA PRO 48 HA PRO 48 4.881 6.508 2.432
377 HB2 PRO 48 HB2 PRO 48 2.481 5.328 3.105
378 HB3 PRO 48 HB3 PRO 48 2.940 5.780 1.439
379 HG2 PRO 48 HG2 PRO 48 3.156 3.064 2.762
380 HG3 PRO 48 HG3 PRO 48 2.511 3.458 1.136
381 HD2 PRO 48 HD2 PRO 48 5.052 2.547 1.495
382 HD3 PRO 48 HD3 PRO 48 4.678 3.782 0.257
383 H LEU 49 HN LEU 49 4.441 7.328 4.428
384 HA LEU 49 HA LEU 49 4.764 5.584 6.849
385 HG LEU 49 HG LEU 49 7.242 6.877 5.372
386 HB2 LEU 49 HB2 LEU 49 5.640 8.474 6.441
387 HB3 LEU 49 HB3 LEU 49 5.758 7.573 7.948
388 HD11 LEU 49 HD11 LEU 49 8.021 8.981 6.335
389 HD12 LEU 49 HD12 LEU 49 8.210 8.220 7.928
390 HD13 LEU 49 HD13 LEU 49 9.238 7.714 6.571
391 HD21 LEU 49 HD21 LEU 49 8.553 5.345 6.785
392 HD22 LEU 49 HD22 LEU 49 7.522 5.727 8.186
393 HD23 LEU 49 HD23 LEU 49 6.859 4.880 6.772
394 H GLN 50 HN GLN 50 3.250 8.392 5.313
395 HA GLN 50 HA GLN 50 0.720 7.777 6.466
396 HB2 GLN 50 HB2 GLN 50 0.250 10.050 7.409
397 HB3 GLN 50 HB3 GLN 50 1.328 9.050 8.360
398 HG2 GLN 50 HG2 GLN 50 3.272 10.313 7.647
399 HG3 GLN 50 HG3 GLN 50 2.289 11.259 6.513
400 HE21 GLN 50 HE21 GLN 50 2.680 13.321 7.474
401 HE22 GLN 50 HE22 GLN 50 2.141 13.720 9.082
402 H ASN 51 HN ASN 51 -0.580 10.172 5.600
403 HA ASN 51 HA ASN 51 -1.100 9.449 3.037
404 HB2 ASN 51 HB2 ASN 51 -2.569 10.918 4.305
405 HB3 ASN 51 HB3 ASN 51 -1.389 12.230 4.247
406 HD21 ASN 51 HD22 ASN 51 -1.214 13.503 2.298
407 HD22 ASN 51 HD21 ASN 51 -2.293 13.275 0.952
408 H ALA 52 HN ALA 52 1.256 12.057 3.858
409 HA ALA 52 HA ALA 52 2.123 12.038 1.058
410 HB1 ALA 52 HB1 ALA 52 0.954 14.106 1.641
411 HB2 ALA 52 HB2 ALA 52 2.044 14.353 3.028
412 HB3 ALA 52 HB3 ALA 52 2.672 14.417 1.369
413 H LEU 53 HN LEU 53 3.210 11.592 4.425
414 HA LEU 53 HA LEU 53 5.973 12.146 3.692
415 HG LEU 53 HG LEU 53 4.816 13.351 6.204
416 HB2 LEU 53 HB2 LEU 53 4.803 10.840 6.152
417 HB3 LEU 53 HB3 LEU 53 6.521 10.862 5.824
418 HD11 LEU 53 HD11 LEU 53 5.162 12.016 8.277
419 HD12 LEU 53 HD12 LEU 53 6.916 12.057 8.005
420 HD13 LEU 53 HD13 LEU 53 6.026 13.558 8.338
421 HD21 LEU 53 HD21 LEU 53 7.832 13.032 5.802
422 HD22 LEU 53 HD22 LEU 53 6.702 13.894 4.740
423 HD23 LEU 53 HD23 LEU 53 7.041 14.522 6.349
424 H TYR 54 HN TYR 54 7.403 10.746 2.908
425 HA TYR 54 HA TYR 54 6.854 7.839 3.036
426 HD1 TYR 54 HD1 TYR 54 5.048 9.933 0.979
427 HD2 TYR 54 HD2 TYR 54 6.787 6.243 -0.400
428 HE1 TYR 54 HE1 TYR 54 2.885 9.300 -0.019
429 HE2 TYR 54 HE2 TYR 54 4.640 5.610 -1.430
430 HH TYR 54 HH TYR 54 2.408 6.216 -1.799
431 HB2 TYR 54 HB2 TYR 54 7.741 9.418 0.588
432 HB3 TYR 54 HB3 TYR 54 8.125 7.726 0.799
433 H CYS 55 HN CYS 55 8.772 6.657 3.358
434 HA CYS 55 HA CYS 55 11.019 8.048 4.575
435 HG CYS 55 HG CYS 55 11.026 3.568 3.990
436 HB2 CYS 55 HB2 CYS 55 12.021 5.854 4.746
437 HB3 CYS 55 HB3 CYS 55 10.323 5.737 5.246
438 H ILE 56 HN ILE 56 13.297 7.702 3.684
439 HA ILE 56 HA ILE 56 13.382 7.564 0.700
440 HB ILE 56 HB ILE 56 15.311 8.982 2.570
441 HG12 ILE 56 HG12 ILE 56 13.526 10.463 0.613
442 HG13 ILE 56 HG13 ILE 56 12.955 10.121 2.246
443 HG21 ILE 56 HG21 ILE 56 16.202 9.984 0.394
444 HG22 ILE 56 HG22 ILE 56 16.488 8.274 0.541
445 HG23 ILE 56 HG23 ILE 56 15.160 8.856 -0.479
446 HD11 ILE 56 HD11 ILE 56 15.547 11.609 1.672
447 HD12 ILE 56 HD12 ILE 56 14.018 12.340 2.145
448 HD13 ILE 56 HD13 ILE 56 14.847 11.241 3.252
449 H ASN 57 HN ASN 57 14.918 6.290 -0.140
450 HA ASN 57 HA ASN 57 16.683 4.998 -0.495
451 HB2 ASN 57 HB2 ASN 57 17.907 6.545 1.088
452 HB3 ASN 57 HB3 ASN 57 17.560 5.407 2.398
453 HD21 ASN 57 HD22 ASN 57 18.903 5.543 -0.952
454 HD22 ASN 57 HD21 ASN 57 20.115 4.292 -0.684
455 H ARG 58 HN ARG 58 15.562 4.282 2.793
456 HA ARG 58 HA ARG 58 14.672 1.636 2.321
457 HE ARG 58 HE ARG 58 19.018 -0.840 3.827
458 HB2 ARG 58 HB2 ARG 58 16.461 0.356 3.412
459 HB3 ARG 58 HB3 ARG 58 17.129 1.192 2.020
460 HG2 ARG 58 HG2 ARG 58 17.937 3.022 3.613
461 HG3 ARG 58 HG3 ARG 58 17.404 2.011 4.948
462 HD2 ARG 58 HD2 ARG 58 19.470 1.190 2.878
463 HD3 ARG 58 HD3 ARG 58 19.848 1.862 4.462
464 HH11 ARG 58 HH11 ARG 58 19.105 1.547 6.515
465 HH12 ARG 58 HH12 ARG 58 19.112 0.317 7.729
466 HH21 ARG 58 HH21 ARG 58 18.987 -2.412 5.501
467 HH22 ARG 58 HH22 ARG 58 19.024 -1.936 7.155
468 H GLU 59 HN GLU 59 15.088 4.434 4.377
469 HA GLU 59 HA GLU 59 13.960 2.958 6.663
470 HB2 GLU 59 HB2 GLU 59 15.702 3.846 8.172
471 HB3 GLU 59 HB3 GLU 59 16.274 2.645 7.020
472 HG2 GLU 59 HG2 GLU 59 17.139 4.619 5.594
473 HG3 GLU 59 HG3 GLU 59 16.786 5.644 6.985
474 H LYS 60 HN LYS 60 12.821 4.060 8.007
475 HA LYS 60 HA LYS 60 11.494 6.343 6.972
476 HB2 LYS 60 HB2 LYS 60 9.967 6.079 8.821
477 HB3 LYS 60 HB3 LYS 60 10.359 4.499 8.141
478 HG2 LYS 60 HG2 LYS 60 11.956 4.101 10.025
479 HG3 LYS 60 HG3 LYS 60 11.528 5.683 10.703
480 HD2 LYS 60 HD2 LYS 60 9.160 4.959 10.902
481 HD3 LYS 60 HD3 LYS 60 9.597 3.368 10.245
482 HE2 LYS 60 HE2 LYS 60 11.175 3.023 12.140
483 HE3 LYS 60 HE3 LYS 60 10.737 4.605 12.795
484 HZ1 LYS 60 HZ1 LYS 60 9.523 2.831 13.885
485 HZ2 LYS 60 HZ2 LYS 60 8.471 3.784 13.086
486 HZ3 LYS 60 HZ3 LYS 60 8.877 2.320 12.481
487 H LEU 61 HN LEU 61 14.266 6.322 8.962
488 HA LEU 61 HA LEU 61 13.666 8.695 10.434
489 HG LEU 61 HG LEU 61 15.321 5.772 10.819
490 HB2 LEU 61 HB2 LEU 61 16.389 7.570 9.624
491 HB3 LEU 61 HB3 LEU 61 16.075 8.717 10.926
492 HD11 LEU 61 HD11 LEU 61 17.656 6.295 11.384
493 HD12 LEU 61 HD12 LEU 61 17.113 7.349 12.708
494 HD13 LEU 61 HD13 LEU 61 16.795 5.598 12.767
495 HD21 LEU 61 HD21 LEU 61 13.449 6.898 11.863
496 HD22 LEU 61 HD22 LEU 61 14.387 6.071 13.109
497 HD23 LEU 61 HD23 LEU 61 14.536 7.835 12.916
498 H HIS 62 HN HIS 62 14.449 8.120 7.150
499 HA HIS 62 HA HIS 62 15.290 10.958 6.709
500 HD1 HIS 62 HD1 HIS 62 18.390 7.757 4.817
501 HD2 HIS 62 HD2 HIS 62 17.276 10.266 8.006
502 HE1 HIS 62 HE1 HIS 62 20.303 7.681 6.492
503 HB2 HIS 62 HB2 HIS 62 15.745 8.467 5.007
504 HB3 HIS 62 HB3 HIS 62 16.306 10.101 4.637
505 H THR 63 HN THR 63 13.513 12.130 5.858
506 HA THR 63 HA THR 63 11.429 10.572 4.449
507 HB THR 63 HB THR 63 9.885 12.094 5.721
508 HG1 THR 63 HG1 THR 63 10.743 13.247 7.439
509 HG21 THR 63 HG21 THR 63 10.544 9.754 6.475
510 HG22 THR 63 HG22 THR 63 11.714 10.507 7.583
511 HG23 THR 63 HG23 THR 63 9.975 10.827 7.766
512 H VAL 64 HN VAL 64 10.099 11.562 3.033
513 HA VAL 64 HA VAL 64 10.694 14.307 2.083
514 HB VAL 64 HB VAL 64 9.675 13.343 -0.119
515 HG11 VAL 64 HG11 VAL 64 12.550 12.717 0.564
516 HG12 VAL 64 HG12 VAL 64 11.856 12.886 -1.066
517 HG13 VAL 64 HG13 VAL 64 11.884 14.273 0.031
518 HG21 VAL 64 HG21 VAL 64 9.174 11.076 0.733
519 HG22 VAL 64 HG22 VAL 64 10.167 11.082 -0.731
520 HG23 VAL 64 HG23 VAL 64 10.914 10.743 0.844
521 H LYS 65 HN LYS 65 8.713 15.323 1.264
522 HA LYS 65 HA LYS 65 6.185 14.014 2.177
523 HB2 LYS 65 HB2 LYS 65 6.870 16.032 3.536
524 HB3 LYS 65 HB3 LYS 65 6.719 17.007 2.065
525 HG2 LYS 65 HG2 LYS 65 4.334 16.306 1.867
526 HG3 LYS 65 HG3 LYS 65 4.490 15.350 3.345
527 HD2 LYS 65 HD2 LYS 65 4.847 18.374 3.142
528 HD3 LYS 65 HD3 LYS 65 3.377 17.547 3.679
529 HE2 LYS 65 HE2 LYS 65 4.655 16.508 5.558
530 HE3 LYS 65 HE3 LYS 65 6.101 17.392 5.053
531 HZ1 LYS 65 HZ1 LYS 65 4.946 18.538 6.832
532 HZ2 LYS 65 HZ2 LYS 65 4.908 19.463 5.492
533 HZ3 LYS 65 HZ3 LYS 65 3.573 18.645 5.964
534 H VAL 66 HN VAL 66 4.780 13.668 0.533
535 HA VAL 66 HA VAL 66 5.489 14.298 -2.199
536 HB VAL 66 HB VAL 66 3.046 13.062 -0.839
537 HG11 VAL 66 HG11 VAL 66 2.348 12.302 -3.119
538 HG12 VAL 66 HG12 VAL 66 2.236 14.052 -2.949
539 HG13 VAL 66 HG13 VAL 66 3.598 13.337 -3.844
540 HG21 VAL 66 HG21 VAL 66 3.914 10.979 -1.851
541 HG22 VAL 66 HG22 VAL 66 5.267 11.869 -2.577
542 HG23 VAL 66 HG23 VAL 66 5.145 11.709 -0.816
543 H LEU 67 HN LEU 67 4.717 15.916 -3.522
544 HA LEU 67 HA LEU 67 2.840 17.916 -2.330
545 HG LEU 67 HG LEU 67 6.027 18.098 -2.226
546 HB2 LEU 67 HB2 LEU 67 4.976 18.311 -4.458
547 HB3 LEU 67 HB3 LEU 67 3.887 19.545 -3.839
548 HD11 LEU 67 HD11 LEU 67 5.909 20.968 -3.252
549 HD12 LEU 67 HD12 LEU 67 7.210 20.269 -2.262
550 HD13 LEU 67 HD13 LEU 67 6.934 19.673 -3.896
551 HD21 LEU 67 HD21 LEU 67 5.577 19.820 -0.474
552 HD22 LEU 67 HD22 LEU 67 4.181 20.389 -1.414
553 HD23 LEU 67 HD23 LEU 67 4.202 18.749 -0.727
554 H SER 68 HN SER 68 3.667 16.033 -5.297
555 HA SER 68 HA SER 68 0.893 15.740 -5.994
556 HG SER 68 HG SER 68 1.039 18.215 -5.954
557 HB2 SER 68 HB2 SER 68 2.683 17.523 -7.725
558 HB3 SER 68 HB3 SER 68 1.202 16.758 -8.320
559 H ALA 69 HN ALA 69 0.743 14.163 -7.877
560 HA ALA 69 HA ALA 69 3.191 13.310 -9.129
561 HB1 ALA 69 HB1 ALA 69 3.033 10.928 -8.459
562 HB2 ALA 69 HB2 ALA 69 3.328 11.962 -7.051
563 HB3 ALA 69 HB3 ALA 69 1.694 11.320 -7.355
564 H SER 70 HN SER 70 2.821 11.896 -10.915
565 HA SER 70 HA SER 70 0.069 11.390 -11.855
566 HG SER 70 HG SER 70 0.429 14.800 -13.040
567 HB2 SER 70 HB2 SER 70 2.034 13.204 -13.338
568 HB3 SER 70 HB3 SER 70 0.448 12.684 -13.927
569 H SER 71 HN SER 71 0.094 9.913 -13.723
570 HA SER 71 HA SER 71 2.167 8.056 -13.991
571 HG SER 71 HG SER 71 -1.167 7.339 -15.160
572 HB2 SER 71 HB2 SER 71 0.192 8.915 -16.142
573 HB3 SER 71 HB3 SER 71 0.983 7.336 -15.976
574 H TYR 72 HN TYR 72 3.834 7.761 -15.631
575 HA TYR 72 HA TYR 72 5.248 10.209 -16.046
576 HD1 TYR 72 HD1 TYR 72 8.227 9.796 -15.624
577 HD2 TYR 72 HD2 TYR 72 6.739 7.995 -19.254
578 HE1 TYR 72 HE1 TYR 72 10.171 10.684 -16.849
579 HE2 TYR 72 HE2 TYR 72 8.700 8.868 -20.488
580 HH TYR 72 HH TYR 72 11.304 10.757 -18.890
581 HB2 TYR 72 HB2 TYR 72 6.415 8.134 -15.572
582 HB3 TYR 72 HB3 TYR 72 5.795 7.396 -17.049
583 H SER 73 HN SER 73 5.623 11.413 -17.809
584 HA SER 73 HA SER 73 5.129 10.480 -20.487
585 HG SER 73 HG SER 73 1.908 12.032 -20.232
586 HB2 SER 73 HB2 SER 73 3.809 13.005 -19.395
587 HB3 SER 73 HB3 SER 73 3.944 12.611 -21.118
588 HA PRO 74 HA PRO 74 9.081 12.334 -20.223
589 HB2 PRO 74 HB2 PRO 74 9.664 12.936 -22.894
590 HB3 PRO 74 HB3 PRO 74 9.807 11.321 -22.128
591 HG2 PRO 74 HG2 PRO 74 7.569 12.435 -23.821
592 HG3 PRO 74 HG3 PRO 74 8.267 10.786 -23.840
593 HD2 PRO 74 HD2 PRO 74 5.922 11.351 -22.574
594 HD3 PRO 74 HD3 PRO 74 7.079 10.163 -21.901
595 H ASP 75 HN ASP 75 7.044 14.205 -22.528
596 HA ASP 75 HA ASP 75 8.368 16.676 -22.149
597 HB2 ASP 75 HB2 ASP 75 6.857 16.209 -24.028
598 HB3 ASP 75 HB3 ASP 75 5.481 16.117 -22.925
599 H GLU 76 HN GLU 76 5.641 15.196 -20.376
600 HA GLU 76 HA GLU 76 5.062 17.504 -18.789
601 HB2 GLU 76 HB2 GLU 76 3.624 15.353 -19.303
602 HB3 GLU 76 HB3 GLU 76 4.480 14.670 -17.913
603 HG2 GLU 76 HG2 GLU 76 3.702 16.924 -16.729
604 HG3 GLU 76 HG3 GLU 76 2.570 17.024 -18.059
605 H TRP 77 HN TRP 77 7.228 14.689 -18.370
606 HA TRP 77 HA TRP 77 8.035 15.202 -15.672
607 HD1 TRP 77 HD1 TRP 77 11.550 13.135 -18.189
608 HE1 TRP 77 HE1 TRP 77 13.593 12.908 -16.667
609 HE3 TRP 77 HE3 TRP 77 9.346 14.348 -13.754
610 HZ2 TRP 77 HZ2 TRP 77 14.177 13.168 -13.835
611 HZ3 TRP 77 HZ3 TRP 77 10.644 14.262 -11.643
612 HH2 TRP 77 HH2 TRP 77 13.064 13.706 -11.671
613 HB2 TRP 77 HB2 TRP 77 8.514 13.070 -16.641
614 HB3 TRP 77 HB3 TRP 77 9.230 13.774 -18.054
615 H GLU 78 HN GLU 78 9.443 16.233 -18.858
616 HA GLU 78 HA GLU 78 11.491 17.738 -17.605
617 HB2 GLU 78 HB2 GLU 78 10.296 17.876 -20.404
618 HB3 GLU 78 HB3 GLU 78 11.660 18.882 -19.892
619 HG2 GLU 78 HG2 GLU 78 12.954 16.851 -19.298
620 HG3 GLU 78 HG3 GLU 78 11.636 15.833 -19.873
621 H ARG 79 HN ARG 79 8.242 18.770 -18.583
622 HA ARG 79 HA ARG 79 8.500 21.515 -17.872
623 HE ARG 79 HE ARG 79 4.884 19.708 -21.532
624 HB2 ARG 79 HB2 ARG 79 6.290 19.470 -17.746
625 HB3 ARG 79 HB3 ARG 79 6.005 21.140 -17.212
626 HG2 ARG 79 HG2 ARG 79 6.569 21.984 -19.464
627 HG3 ARG 79 HG3 ARG 79 6.939 20.339 -20.000
628 HD2 ARG 79 HD2 ARG 79 4.506 19.770 -19.226
629 HD3 ARG 79 HD3 ARG 79 4.236 21.512 -19.240
630 HH11 ARG 79 HH11 ARG 79 3.924 23.013 -20.582
631 HH12 ARG 79 HH12 ARG 79 3.539 23.471 -22.200
632 HH21 ARG 79 HH21 ARG 79 4.431 20.255 -23.501
633 HH22 ARG 79 HH22 ARG 79 3.824 21.834 -23.971
634 H GLN 80 HN GLN 80 7.481 18.692 -15.849
635 HA GLN 80 HA GLN 80 7.172 20.226 -13.498
636 HB2 GLN 80 HB2 GLN 80 7.473 17.258 -14.023
637 HB3 GLN 80 HB3 GLN 80 7.354 17.890 -12.372
638 HG2 GLN 80 HG2 GLN 80 5.230 18.885 -12.740
639 HG3 GLN 80 HG3 GLN 80 5.331 18.672 -14.488
640 HE21 GLN 80 HE22 GLN 80 5.329 16.481 -15.334
641 HE22 GLN 80 HE21 GLN 80 4.120 15.416 -14.643
642 H CYS 81 HN CYS 81 10.117 18.683 -14.815
643 HA CYS 81 HA CYS 81 11.716 18.695 -12.516
644 HG CYS 81 HG CYS 81 11.247 16.963 -15.034
645 HB2 CYS 81 HB2 CYS 81 12.474 19.318 -15.406
646 HB3 CYS 81 HB3 CYS 81 13.637 19.054 -14.097
647 H LYS 82 HN LYS 82 10.818 21.470 -14.603
648 HA LYS 82 HA LYS 82 12.824 23.222 -13.574
649 HB2 LYS 82 HB2 LYS 82 10.170 23.808 -14.944
650 HB3 LYS 82 HB3 LYS 82 11.372 25.039 -14.530
651 HG2 LYS 82 HG2 LYS 82 13.063 23.945 -15.925
652 HG3 LYS 82 HG3 LYS 82 11.928 22.665 -16.372
653 HD2 LYS 82 HD2 LYS 82 11.547 25.628 -16.986
654 HD3 LYS 82 HD3 LYS 82 12.229 24.438 -18.106
655 HE2 LYS 82 HE2 LYS 82 10.132 23.124 -18.022
656 HE3 LYS 82 HE3 LYS 82 9.423 24.304 -16.910
657 HZ1 LYS 82 HZ1 LYS 82 10.274 24.884 -19.691
658 HZ2 LYS 82 HZ2 LYS 82 8.734 24.732 -19.183
659 HZ3 LYS 82 HZ3 LYS 82 9.636 25.980 -18.661
660 H VAL 83 HN VAL 83 9.657 22.223 -12.411
661 HA VAL 83 HA VAL 83 9.183 24.497 -10.815
662 HB VAL 83 HB VAL 83 7.972 21.719 -10.493
663 HG11 VAL 83 HG11 VAL 83 7.316 23.199 -8.657
664 HG12 VAL 83 HG12 VAL 83 6.910 24.499 -9.798
665 HG13 VAL 83 HG13 VAL 83 5.952 23.003 -9.747
666 HG21 VAL 83 HG21 VAL 83 7.724 22.432 -12.862
667 HG22 VAL 83 HG22 VAL 83 6.179 22.521 -12.030
668 HG23 VAL 83 HG23 VAL 83 7.103 24.007 -12.332
669 H ALA 84 HN ALA 84 11.467 21.960 -10.383
670 HA ALA 84 HA ALA 84 11.657 21.757 -7.574
671 HB1 ALA 84 HB1 ALA 84 13.018 20.436 -9.200
672 HB2 ALA 84 HB2 ALA 84 13.903 21.910 -9.641
673 HB3 ALA 84 HB3 ALA 84 14.027 21.253 -7.998
674 H GLY 85 HN GLY 85 12.674 24.395 -9.796
675 HA2 GLY 85 HA2 GLY 85 12.836 26.315 -7.656
676 HA3 GLY 85 HA3 GLY 85 14.444 25.685 -8.063
677 H LYS 86 HN LYS 86 11.882 26.137 -10.429
678 HA LYS 86 HA LYS 86 11.745 27.127 -12.350
679 HB2 LYS 86 HB2 LYS 86 12.029 29.543 -12.603
680 HB3 LYS 86 HB3 LYS 86 11.017 29.039 -11.274
681 HG2 LYS 86 HG2 LYS 86 12.178 30.930 -10.559
682 HG3 LYS 86 HG3 LYS 86 12.847 29.581 -9.662
683 HD2 LYS 86 HD2 LYS 86 14.820 29.580 -11.225
684 HD3 LYS 86 HD3 LYS 86 14.130 30.958 -12.081
685 HE2 LYS 86 HE2 LYS 86 14.885 30.893 -9.120
686 HE3 LYS 86 HE3 LYS 86 15.928 31.506 -10.405
687 HZ1 LYS 86 HZ1 LYS 86 14.261 33.200 -10.882
688 HZ2 LYS 86 HZ2 LYS 86 13.299 32.657 -9.672
689 HZ3 LYS 86 HZ3 LYS 86 14.755 33.301 -9.335
690 H THR 87 HN THR 87 13.897 25.464 -11.864
691 HA THR 87 HA THR 87 15.824 26.345 -13.837
692 HB THR 87 HB THR 87 16.720 25.440 -11.062
693 HG1 THR 87 HG1 THR 87 15.839 27.477 -10.814
694 HG21 THR 87 HG21 THR 87 18.928 26.380 -11.752
695 HG22 THR 87 HG22 THR 87 18.420 25.031 -12.769
696 HG23 THR 87 HG23 THR 87 18.267 26.699 -13.371
697 H GLN 88 HN GLN 88 16.940 24.484 -14.747
698 HA GLN 88 HA GLN 88 16.365 21.803 -13.719
699 HB2 GLN 88 HB2 GLN 88 14.523 22.199 -15.313
700 HB3 GLN 88 HB3 GLN 88 15.677 22.740 -16.545
701 HG2 GLN 88 HG2 GLN 88 16.684 20.442 -16.553
702 HG3 GLN 88 HG3 GLN 88 15.497 19.945 -15.347
703 HE21 GLN 88 HE22 GLN 88 14.817 18.273 -16.917
704 HE22 GLN 88 HE21 GLN 88 13.812 18.713 -18.278
Start of MODEL 15
1 HA MET 1 HA MET 1 3.888 -1.877 -2.353
2 H1 MET 1 H1 MET 1 2.480 -0.466 -0.210
3 H2 MET 1 H2 MET 1 2.148 -1.990 -0.745
4 H3 MET 1 H3 MET 1 3.593 -1.654 -0.020
5 HB2 MET 1 HB2 MET 1 1.644 -1.080 -3.055
6 HB3 MET 1 HB3 MET 1 2.079 0.572 -2.584
7 HG2 MET 1 HG2 MET 1 3.865 0.621 -4.268
8 HG3 MET 1 HG3 MET 1 3.613 -1.091 -4.626
9 HE1 MET 1 HE1 MET 1 2.558 0.600 -7.949
10 HE2 MET 1 HE2 MET 1 3.902 0.991 -6.851
11 HE3 MET 1 HE3 MET 1 3.502 -0.707 -7.198
12 H GLU 2 HN GLU 2 5.875 -1.083 -2.897
13 HA GLU 2 HA GLU 2 6.833 1.403 -1.589
14 HB2 GLU 2 HB2 GLU 2 8.389 -1.212 -1.840
15 HB3 GLU 2 HB3 GLU 2 8.946 0.311 -1.154
16 HG2 GLU 2 HG2 GLU 2 8.463 -0.939 0.740
17 HG3 GLU 2 HG3 GLU 2 7.034 0.075 0.567
18 H TRP 3 HN TRP 3 8.608 2.369 -2.892
19 HA TRP 3 HA TRP 3 8.286 1.674 -5.771
20 HD1 TRP 3 HD1 TRP 3 6.262 3.787 -2.846
21 HE1 TRP 3 HE1 TRP 3 3.738 3.752 -3.251
22 HE3 TRP 3 HE3 TRP 3 6.271 3.562 -7.953
23 HZ2 TRP 3 HZ2 TRP 3 1.937 3.820 -5.529
24 HZ3 TRP 3 HZ3 TRP 3 4.143 3.621 -9.224
25 HH2 TRP 3 HH2 TRP 3 1.971 3.761 -8.021
26 HB2 TRP 3 HB2 TRP 3 8.330 4.434 -4.497
27 HB3 TRP 3 HB3 TRP 3 8.117 4.075 -6.196
28 H LEU 4 HN LEU 4 9.970 2.559 -7.104
29 HA LEU 4 HA LEU 4 12.632 2.803 -5.770
30 HG LEU 4 HG LEU 4 13.897 2.794 -8.842
31 HB2 LEU 4 HB2 LEU 4 12.445 0.783 -7.067
32 HB3 LEU 4 HB3 LEU 4 11.741 1.670 -8.432
33 HD11 LEU 4 HD11 LEU 4 14.935 1.023 -6.582
34 HD12 LEU 4 HD12 LEU 4 15.957 1.906 -7.739
35 HD13 LEU 4 HD13 LEU 4 14.924 2.799 -6.629
36 HD21 LEU 4 HD21 LEU 4 14.059 -0.248 -8.681
37 HD22 LEU 4 HD22 LEU 4 13.314 0.691 -9.993
38 HD23 LEU 4 HD23 LEU 4 15.059 0.794 -9.711
39 H VAL 5 HN VAL 5 13.592 4.618 -6.088
40 HA VAL 5 HA VAL 5 12.606 6.777 -7.848
41 HB VAL 5 HB VAL 5 15.122 6.679 -6.127
42 HG11 VAL 5 HG11 VAL 5 15.151 8.388 -7.897
43 HG12 VAL 5 HG12 VAL 5 13.583 8.975 -7.354
44 HG13 VAL 5 HG13 VAL 5 15.011 9.137 -6.302
45 HG21 VAL 5 HG21 VAL 5 12.325 7.726 -5.455
46 HG22 VAL 5 HG22 VAL 5 13.205 6.442 -4.609
47 HG23 VAL 5 HG23 VAL 5 13.783 8.104 -4.508
48 H LYS 6 HN LYS 6 12.980 6.269 -9.896
49 HA LYS 6 HA LYS 6 15.409 4.870 -10.875
50 HB2 LYS 6 HB2 LYS 6 12.732 5.679 -12.014
51 HB3 LYS 6 HB3 LYS 6 14.028 5.305 -13.107
52 HG2 LYS 6 HG2 LYS 6 12.945 3.378 -11.022
53 HG3 LYS 6 HG3 LYS 6 12.548 3.392 -12.733
54 HD2 LYS 6 HD2 LYS 6 15.147 2.590 -11.436
55 HD3 LYS 6 HD3 LYS 6 14.076 1.667 -12.508
56 HE2 LYS 6 HE2 LYS 6 14.723 3.142 -14.411
57 HE3 LYS 6 HE3 LYS 6 15.807 4.039 -13.347
58 HZ1 LYS 6 HZ1 LYS 6 17.086 1.999 -13.026
59 HZ2 LYS 6 HZ2 LYS 6 16.084 1.161 -14.009
60 HZ3 LYS 6 HZ3 LYS 6 16.998 2.367 -14.607
61 H LYS 7 HN LYS 7 14.311 8.121 -10.461
62 HA LYS 7 HA LYS 7 16.705 9.166 -11.694
63 HB2 LYS 7 HB2 LYS 7 13.975 10.212 -12.620
64 HB3 LYS 7 HB3 LYS 7 15.530 10.987 -12.899
65 HG2 LYS 7 HG2 LYS 7 16.235 8.936 -14.219
66 HG3 LYS 7 HG3 LYS 7 14.544 8.383 -14.102
67 HD2 LYS 7 HD2 LYS 7 13.849 10.619 -15.082
68 HD3 LYS 7 HD3 LYS 7 15.548 10.976 -15.376
69 HE2 LYS 7 HE2 LYS 7 14.033 8.569 -16.492
70 HE3 LYS 7 HE3 LYS 7 14.282 10.091 -17.357
71 HZ1 LYS 7 HZ1 LYS 7 15.921 8.458 -18.006
72 HZ2 LYS 7 HZ2 LYS 7 16.677 9.687 -17.255
73 HZ3 LYS 7 HZ3 LYS 7 16.448 8.263 -16.479
74 H SER 8 HN SER 8 17.171 11.202 -10.657
75 HA SER 8 HA SER 8 15.124 12.388 -8.853
76 HG SER 8 HG SER 8 18.824 12.346 -8.692
77 HB2 SER 8 HB2 SER 8 17.081 12.854 -7.313
78 HB3 SER 8 HB3 SER 8 16.575 11.159 -7.419
79 H CYS 9 HN CYS 9 15.283 14.682 -8.817
80 HA CYS 9 HA CYS 9 17.174 15.974 -10.728
81 HG CYS 9 HG CYS 9 14.342 17.884 -12.698
82 HB2 CYS 9 HB2 CYS 9 14.874 15.586 -11.702
83 HB3 CYS 9 HB3 CYS 9 14.202 16.584 -10.399
84 H CYS 10 HN CYS 10 18.498 16.828 -9.190
85 HA CYS 10 HA CYS 10 17.814 17.900 -6.667
86 HG CYS 10 HG CYS 10 21.689 16.976 -7.247
87 HB2 CYS 10 HB2 CYS 10 20.119 18.649 -8.518
88 HB3 CYS 10 HB3 CYS 10 20.033 18.950 -6.777
89 H ASN 11 HN ASN 11 17.650 20.170 -6.001
90 HA ASN 11 HA ASN 11 16.834 22.031 -8.197
91 HB2 ASN 11 HB2 ASN 11 14.806 22.467 -7.427
92 HB3 ASN 11 HB3 ASN 11 14.887 20.784 -6.965
93 HD21 ASN 11 HD22 ASN 11 14.967 20.297 -4.621
94 HD22 ASN 11 HD21 ASN 11 14.683 21.528 -3.451
95 H LYS 12 HN LYS 12 17.527 21.962 -4.669
96 HA LYS 12 HA LYS 12 17.810 23.734 -3.324
97 HB2 LYS 12 HB2 LYS 12 20.184 24.357 -3.195
98 HB3 LYS 12 HB3 LYS 12 19.767 22.661 -3.183
99 HG2 LYS 12 HG2 LYS 12 21.764 22.941 -4.506
100 HG3 LYS 12 HG3 LYS 12 20.445 22.396 -5.526
101 HD2 LYS 12 HD2 LYS 12 21.565 24.071 -6.785
102 HD3 LYS 12 HD3 LYS 12 20.059 24.773 -6.203
103 HE2 LYS 12 HE2 LYS 12 21.776 26.437 -5.980
104 HE3 LYS 12 HE3 LYS 12 21.292 25.921 -4.366
105 HZ1 LYS 12 HZ1 LYS 12 23.727 25.008 -5.799
106 HZ2 LYS 12 HZ2 LYS 12 23.695 26.089 -4.584
107 HZ3 LYS 12 HZ3 LYS 12 23.299 24.538 -4.291
108 H GLN 13 HN GLN 13 16.186 24.776 -5.221
109 HA GLN 13 HA GLN 13 17.006 27.651 -5.219
110 HB2 GLN 13 HB2 GLN 13 15.844 25.964 -7.468
111 HB3 GLN 13 HB3 GLN 13 15.657 27.718 -7.436
112 HG2 GLN 13 HG2 GLN 13 17.993 28.120 -7.602
113 HG3 GLN 13 HG3 GLN 13 18.409 26.453 -7.223
114 HE21 GLN 13 HE22 GLN 13 17.899 24.762 -8.774
115 HE22 GLN 13 HE21 GLN 13 17.832 25.145 -10.491
116 H ASP 14 HN ASP 14 14.381 25.191 -5.069
117 HA ASP 14 HA ASP 14 12.784 27.247 -3.617
118 HB2 ASP 14 HB2 ASP 14 12.189 26.857 -6.159
119 HB3 ASP 14 HB3 ASP 14 11.436 25.376 -5.575
120 H ASN 15 HN ASN 15 14.241 24.339 -3.350
121 HA ASN 15 HA ASN 15 14.247 22.703 -1.880
122 HB2 ASN 15 HB2 ASN 15 13.121 24.487 -0.317
123 HB3 ASN 15 HB3 ASN 15 11.695 23.474 -0.504
124 HD21 ASN 15 HD22 ASN 15 13.042 20.860 -0.529
125 HD22 ASN 15 HD21 ASN 15 13.685 20.622 1.094
126 H ARG 16 HN ARG 16 11.662 23.310 -3.988
127 HA ARG 16 HA ARG 16 10.246 20.770 -3.725
128 HE ARG 16 HE ARG 16 6.876 22.297 -6.109
129 HB2 ARG 16 HB2 ARG 16 10.266 22.818 -5.991
130 HB3 ARG 16 HB3 ARG 16 9.122 21.480 -5.820
131 HG2 ARG 16 HG2 ARG 16 8.244 22.516 -3.727
132 HG3 ARG 16 HG3 ARG 16 9.449 23.782 -3.846
133 HD2 ARG 16 HD2 ARG 16 7.530 24.781 -4.612
134 HD3 ARG 16 HD3 ARG 16 8.460 24.449 -6.079
135 HH11 ARG 16 HH21 ARG 16 5.945 25.664 -5.370
136 HH12 ARG 16 HH22 ARG 16 4.327 25.456 -5.931
137 HH21 ARG 16 HH11 ARG 16 4.901 22.055 -6.860
138 HH22 ARG 16 HH12 ARG 16 3.664 23.305 -6.804
139 H HIS 17 HN HIS 17 11.069 18.867 -4.477
140 HA HIS 17 HA HIS 17 13.205 18.812 -6.579
141 HD1 HIS 17 HD1 HIS 17 14.189 17.854 -2.275
142 HD2 HIS 17 HD2 HIS 17 15.720 18.278 -6.152
143 HE1 HIS 17 HE1 HIS 17 16.530 18.859 -2.020
144 HB2 HIS 17 HB2 HIS 17 12.604 17.023 -4.178
145 HB3 HIS 17 HB3 HIS 17 13.571 16.458 -5.533
146 H VAL 18 HN VAL 18 13.088 16.603 -7.799
147 HA VAL 18 HA VAL 18 10.388 15.527 -7.956
148 HB VAL 18 HB VAL 18 11.774 16.077 -10.586
149 HG11 VAL 18 HG11 VAL 18 8.803 15.987 -9.876
150 HG12 VAL 18 HG12 VAL 18 9.511 16.028 -11.508
151 HG13 VAL 18 HG13 VAL 18 9.749 14.615 -10.485
152 HG21 VAL 18 HG21 VAL 18 11.778 18.317 -9.782
153 HG22 VAL 18 HG22 VAL 18 10.531 18.128 -11.005
154 HG23 VAL 18 HG23 VAL 18 10.062 18.208 -9.297
155 H LEU 19 HN LEU 19 10.346 13.442 -8.587
156 HA LEU 19 HA LEU 19 12.847 12.179 -9.471
157 HG LEU 19 HG LEU 19 10.850 12.177 -6.146
158 HB2 LEU 19 HB2 LEU 19 11.865 10.360 -7.609
159 HB3 LEU 19 HB3 LEU 19 13.380 11.241 -7.567
160 HD11 LEU 19 HD11 LEU 19 13.272 10.663 -5.095
161 HD12 LEU 19 HD12 LEU 19 11.880 11.238 -4.142
162 HD13 LEU 19 HD13 LEU 19 11.659 9.985 -5.370
163 HD21 LEU 19 HD21 LEU 19 13.714 13.178 -6.308
164 HD22 LEU 19 HD22 LEU 19 12.196 14.100 -6.148
165 HD23 LEU 19 HD23 LEU 19 12.873 13.293 -4.746
166 H MET 20 HN MET 20 12.377 9.830 -10.060
167 HA MET 20 HA MET 20 9.624 9.672 -11.213
168 HB2 MET 20 HB2 MET 20 12.260 8.623 -12.247
169 HB3 MET 20 HB3 MET 20 10.746 7.771 -12.592
170 HG2 MET 20 HG2 MET 20 9.724 9.847 -13.419
171 HG3 MET 20 HG3 MET 20 11.235 10.715 -13.143
172 HE1 MET 20 HE1 MET 20 10.591 7.470 -16.412
173 HE2 MET 20 HE2 MET 20 10.874 7.002 -14.723
174 HE3 MET 20 HE3 MET 20 9.409 7.913 -15.158
175 H LEU 21 HN LEU 21 8.350 8.438 -10.180
176 HA LEU 21 HA LEU 21 9.381 6.544 -8.110
177 HG LEU 21 HG LEU 21 8.393 6.987 -6.074
178 HB2 LEU 21 HB2 LEU 21 6.839 8.156 -8.422
179 HB3 LEU 21 HB3 LEU 21 6.689 6.531 -7.751
180 HD11 LEU 21 HD11 LEU 21 8.922 9.538 -5.711
181 HD12 LEU 21 HD12 LEU 21 9.811 8.658 -6.964
182 HD13 LEU 21 HD13 LEU 21 8.464 9.706 -7.421
183 HD21 LEU 21 HD21 LEU 21 6.032 7.274 -5.536
184 HD22 LEU 21 HD22 LEU 21 6.983 8.494 -4.672
185 HD23 LEU 21 HD23 LEU 21 6.056 8.945 -6.122
186 H CYS 22 HN CYS 22 9.365 4.485 -8.585
187 HA CYS 22 HA CYS 22 7.659 3.513 -10.836
188 HG CYS 22 HG CYS 22 10.536 5.452 -10.745
189 HB2 CYS 22 HB2 CYS 22 10.618 2.952 -10.339
190 HB3 CYS 22 HB3 CYS 22 9.654 2.424 -11.726
191 H ASP 23 HN ASP 23 7.626 1.154 -10.950
192 HA ASP 23 HA ASP 23 7.014 -0.262 -8.538
193 HB2 ASP 23 HB2 ASP 23 6.225 -1.270 -10.496
194 HB3 ASP 23 HB3 ASP 23 7.691 -0.912 -11.401
195 H ALA 24 HN ALA 24 8.331 -1.656 -7.256
196 HA ALA 24 HA ALA 24 11.116 -1.011 -6.976
197 HB1 ALA 24 HB1 ALA 24 9.449 -3.253 -5.765
198 HB2 ALA 24 HB2 ALA 24 11.084 -2.775 -5.256
199 HB3 ALA 24 HB3 ALA 24 9.732 -1.642 -5.062
200 H GLY 25 HN GLY 25 11.652 -1.367 -9.248
201 HA2 GLY 25 HA2 GLY 25 13.206 -3.459 -10.071
202 HA3 GLY 25 HA3 GLY 25 11.549 -4.034 -10.380
203 H GLY 26 HN GLY 26 10.814 -1.062 -10.797
204 HA2 GLY 26 HA2 GLY 26 10.948 0.605 -12.372
205 HA3 GLY 26 HA3 GLY 26 12.190 -0.290 -13.256
206 H ALA 27 HN ALA 27 9.365 -2.252 -12.598
207 HA ALA 27 HA ALA 27 8.985 -2.609 -15.403
208 HB1 ALA 27 HB1 ALA 27 7.160 -4.103 -14.738
209 HB2 ALA 27 HB2 ALA 27 8.567 -4.357 -13.689
210 HB3 ALA 27 HB3 ALA 27 7.166 -3.430 -13.097
211 H ILE 28 HN ILE 28 7.591 -0.286 -13.244
212 HA ILE 28 HA ILE 28 5.806 0.808 -15.311
213 HB ILE 28 HB ILE 28 4.986 0.208 -12.421
214 HG12 ILE 28 HG12 ILE 28 3.903 -0.922 -15.041
215 HG13 ILE 28 HG13 ILE 28 4.815 -1.801 -13.812
216 HG21 ILE 28 HG21 ILE 28 4.113 2.413 -13.187
217 HG22 ILE 28 HG22 ILE 28 3.389 1.626 -14.611
218 HG23 ILE 28 HG23 ILE 28 2.819 1.266 -12.966
219 HD11 ILE 28 HD11 ILE 28 2.957 -1.376 -12.177
220 HD12 ILE 28 HD12 ILE 28 1.993 -0.744 -13.539
221 HD13 ILE 28 HD13 ILE 28 2.546 -2.422 -13.554
222 H LYS 29 HN LYS 29 5.795 3.158 -15.042
223 HA LYS 29 HA LYS 29 7.565 4.236 -12.920
224 HB2 LYS 29 HB2 LYS 29 7.968 4.830 -15.882
225 HB3 LYS 29 HB3 LYS 29 8.851 5.513 -14.517
226 HG2 LYS 29 HG2 LYS 29 9.549 3.052 -13.980
227 HG3 LYS 29 HG3 LYS 29 8.968 2.677 -15.603
228 HD2 LYS 29 HD2 LYS 29 10.567 4.325 -16.556
229 HD3 LYS 29 HD3 LYS 29 11.076 4.779 -14.931
230 HE2 LYS 29 HE2 LYS 29 12.740 3.357 -15.908
231 HE3 LYS 29 HE3 LYS 29 12.024 2.545 -14.521
232 HZ1 LYS 29 HZ1 LYS 29 12.323 1.123 -16.526
233 HZ2 LYS 29 HZ2 LYS 29 10.784 1.133 -16.003
234 HZ3 LYS 29 HZ3 LYS 29 11.219 2.004 -17.335
235 H MET 30 HN MET 30 7.139 6.317 -12.328
236 HA MET 30 HA MET 30 5.049 7.930 -13.650
237 HB2 MET 30 HB2 MET 30 5.114 7.392 -10.656
238 HB3 MET 30 HB3 MET 30 3.913 8.283 -11.575
239 HG2 MET 30 HG2 MET 30 3.514 5.982 -12.787
240 HG3 MET 30 HG3 MET 30 4.311 5.322 -11.354
241 HE1 MET 30 HE1 MET 30 1.767 6.837 -8.565
242 HE2 MET 30 HE2 MET 30 3.447 6.319 -8.837
243 HE3 MET 30 HE3 MET 30 2.909 7.931 -9.367
244 H ILE 31 HN ILE 31 5.051 10.104 -12.214
245 HA ILE 31 HA ILE 31 7.851 10.934 -11.623
246 HB ILE 31 HB ILE 31 5.630 12.588 -12.797
247 HG12 ILE 31 HG12 ILE 31 8.187 12.047 -14.323
248 HG13 ILE 31 HG13 ILE 31 6.981 10.768 -14.319
249 HG21 ILE 31 HG21 ILE 31 8.569 13.224 -12.232
250 HG22 ILE 31 HG22 ILE 31 7.482 14.272 -13.155
251 HG23 ILE 31 HG23 ILE 31 7.149 13.970 -11.461
252 HD11 ILE 31 HD11 ILE 31 6.645 12.308 -16.198
253 HD12 ILE 31 HD12 ILE 31 5.251 12.252 -15.089
254 HD13 ILE 31 HD13 ILE 31 6.358 13.634 -15.047
255 H ALA 32 HN ALA 32 7.973 12.161 -9.628
256 HA ALA 32 HA ALA 32 5.443 13.069 -8.438
257 HB1 ALA 32 HB1 ALA 32 5.975 10.896 -7.300
258 HB2 ALA 32 HB2 ALA 32 7.534 11.613 -6.784
259 HB3 ALA 32 HB3 ALA 32 6.007 12.304 -6.218
260 H GLU 33 HN GLU 33 5.672 15.058 -7.716
261 HA GLU 33 HA GLU 33 8.349 16.325 -7.564
262 HB2 GLU 33 HB2 GLU 33 6.471 17.374 -8.974
263 HB3 GLU 33 HB3 GLU 33 5.569 17.591 -7.465
264 HG2 GLU 33 HG2 GLU 33 7.633 18.884 -6.615
265 HG3 GLU 33 HG3 GLU 33 8.216 18.853 -8.277
266 H VAL 34 HN VAL 34 9.015 16.969 -5.498
267 HA VAL 34 HA VAL 34 7.288 16.355 -3.180
268 HB VAL 34 HB VAL 34 8.997 14.903 -2.213
269 HG11 VAL 34 HG11 VAL 34 8.704 12.912 -3.522
270 HG12 VAL 34 HG12 VAL 34 7.216 13.861 -3.644
271 HG13 VAL 34 HG13 VAL 34 8.368 13.840 -4.994
272 HG21 VAL 34 HG21 VAL 34 10.539 15.224 -4.813
273 HG22 VAL 34 HG22 VAL 34 11.039 15.741 -3.180
274 HG23 VAL 34 HG23 VAL 34 10.883 14.025 -3.547
275 H LYS 35 HN LYS 35 8.710 16.907 -1.118
276 HA LYS 35 HA LYS 35 10.677 19.042 -1.621
277 HB2 LYS 35 HB2 LYS 35 8.422 20.091 -1.003
278 HB3 LYS 35 HB3 LYS 35 8.531 19.254 0.547
279 HG2 LYS 35 HG2 LYS 35 10.693 20.456 0.981
280 HG3 LYS 35 HG3 LYS 35 10.509 21.313 -0.556
281 HD2 LYS 35 HD2 LYS 35 8.549 21.467 1.774
282 HD3 LYS 35 HD3 LYS 35 9.842 22.631 1.454
283 HE2 LYS 35 HE2 LYS 35 8.837 23.138 -0.774
284 HE3 LYS 35 HE3 LYS 35 7.514 22.016 -0.424
285 HZ1 LYS 35 HZ1 LYS 35 8.122 24.471 1.125
286 HZ2 LYS 35 HZ2 LYS 35 6.892 24.295 0.073
287 HZ3 LYS 35 HZ3 LYS 35 6.902 23.435 1.455
288 H SER 36 HN SER 36 12.363 18.831 -0.070
289 HA SER 36 HA SER 36 12.212 16.326 1.552
290 HG SER 36 HG SER 36 13.847 15.706 -1.610
291 HB2 SER 36 HB2 SER 36 14.767 17.068 0.210
292 HB3 SER 36 HB3 SER 36 14.046 15.483 0.535
293 H ASP 37 HN ASP 37 13.303 16.250 3.451
294 HA ASP 37 HA ASP 37 14.773 18.708 4.332
295 HB2 ASP 37 HB2 ASP 37 12.649 18.224 5.541
296 HB3 ASP 37 HB3 ASP 37 13.304 16.661 6.027
297 H PHE 38 HN PHE 38 15.359 15.817 3.034
298 HA PHE 38 HA PHE 38 17.964 15.402 4.325
299 HD1 PHE 38 HD1 PHE 38 14.148 14.153 5.190
300 HD2 PHE 38 HD2 PHE 38 18.061 13.317 6.804
301 HE1 PHE 38 HE1 PHE 38 13.221 14.254 7.483
302 HE2 PHE 38 HE2 PHE 38 17.129 13.426 9.102
303 HZ PHE 38 HZ PHE 38 14.706 13.883 9.447
304 HB2 PHE 38 HB2 PHE 38 15.966 13.158 3.795
305 HB3 PHE 38 HB3 PHE 38 17.590 12.974 4.428
306 H ALA 39 HN ALA 39 19.333 14.088 2.814
307 HA ALA 39 HA ALA 39 18.990 14.772 0.067
308 HB1 ALA 39 HB1 ALA 39 21.206 14.368 1.082
309 HB2 ALA 39 HB2 ALA 39 20.773 12.664 1.370
310 HB3 ALA 39 HB3 ALA 39 20.929 13.276 -0.288
311 H VAL 40 HN VAL 40 18.388 13.478 -1.692
312 HA VAL 40 HA VAL 40 17.562 10.705 -1.379
313 HB VAL 40 HB VAL 40 15.479 11.775 -0.821
314 HG11 VAL 40 HG11 VAL 40 14.293 13.385 -2.240
315 HG12 VAL 40 HG12 VAL 40 15.801 14.062 -1.620
316 HG13 VAL 40 HG13 VAL 40 15.702 13.509 -3.307
317 HG21 VAL 40 HG21 VAL 40 15.283 11.002 -3.749
318 HG22 VAL 40 HG22 VAL 40 15.362 9.857 -2.397
319 HG23 VAL 40 HG23 VAL 40 13.992 10.967 -2.530
320 H LYS 41 HN LYS 41 17.966 9.627 -3.387
321 HA LYS 41 HA LYS 41 18.434 11.243 -5.767
322 HB2 LYS 41 HB2 LYS 41 20.675 10.846 -6.110
323 HB3 LYS 41 HB3 LYS 41 20.618 11.291 -4.417
324 HG2 LYS 41 HG2 LYS 41 20.952 8.521 -5.599
325 HG3 LYS 41 HG3 LYS 41 22.172 9.468 -4.766
326 HD2 LYS 41 HD2 LYS 41 20.985 9.238 -2.649
327 HD3 LYS 41 HD3 LYS 41 19.653 8.388 -3.448
328 HE2 LYS 41 HE2 LYS 41 22.456 7.294 -3.683
329 HE3 LYS 41 HE3 LYS 41 21.513 7.015 -2.211
330 HZ1 LYS 41 HZ1 LYS 41 20.521 6.308 -4.910
331 HZ2 LYS 41 HZ2 LYS 41 21.205 5.245 -3.854
332 HZ3 LYS 41 HZ3 LYS 41 19.804 5.998 -3.454
333 H VAL 42 HN VAL 42 18.981 9.796 -7.641
334 HA VAL 42 HA VAL 42 17.170 7.722 -7.905
335 HB VAL 42 HB VAL 42 17.992 8.949 -9.733
336 HG11 VAL 42 HG11 VAL 42 20.230 9.551 -9.128
337 HG12 VAL 42 HG12 VAL 42 20.769 7.853 -9.205
338 HG13 VAL 42 HG13 VAL 42 20.267 8.717 -10.679
339 HG21 VAL 42 HG21 VAL 42 18.334 7.245 -11.344
340 HG22 VAL 42 HG22 VAL 42 19.009 6.127 -10.147
341 HG23 VAL 42 HG23 VAL 42 17.291 6.585 -10.051
342 H GLY 43 HN GLY 43 17.346 5.459 -8.188
343 HA2 GLY 43 HA2 GLY 43 17.896 3.368 -7.485
344 HA3 GLY 43 HA3 GLY 43 19.537 3.916 -7.079
345 H ASP 44 HN ASP 44 16.326 5.172 -5.936
346 HA ASP 44 HA ASP 44 17.167 4.352 -3.129
347 HB2 ASP 44 HB2 ASP 44 15.910 6.951 -4.038
348 HB3 ASP 44 HB3 ASP 44 15.470 6.282 -2.488
349 H LEU 45 HN LEU 45 15.516 3.537 -1.721
350 HA LEU 45 HA LEU 45 13.040 2.678 -3.089
351 HG LEU 45 HG LEU 45 11.395 1.777 -1.132
352 HB2 LEU 45 HB2 LEU 45 14.399 1.284 -1.335
353 HB3 LEU 45 HB3 LEU 45 13.781 2.439 -0.161
354 HD11 LEU 45 HD11 LEU 45 11.262 -0.518 -1.947
355 HD12 LEU 45 HD12 LEU 45 12.255 0.457 -3.039
356 HD13 LEU 45 HD13 LEU 45 13.032 -0.669 -1.904
357 HD21 LEU 45 HD21 LEU 45 13.021 -0.047 0.662
358 HD22 LEU 45 HD22 LEU 45 12.050 1.375 1.139
359 HD23 LEU 45 HD23 LEU 45 11.246 -0.056 0.494
360 H LEU 46 HN LEU 46 10.975 3.485 -2.378
361 HA LEU 46 HA LEU 46 10.913 5.515 -0.224
362 HG LEU 46 HG LEU 46 11.398 6.641 -3.197
363 HB2 LEU 46 HB2 LEU 46 9.237 5.632 -2.767
364 HB3 LEU 46 HB3 LEU 46 9.021 6.644 -1.350
365 HD11 LEU 46 HD11 LEU 46 10.530 8.913 -3.839
366 HD12 LEU 46 HD12 LEU 46 9.383 7.611 -4.181
367 HD13 LEU 46 HD13 LEU 46 9.140 8.660 -2.772
368 HD21 LEU 46 HD21 LEU 46 10.787 8.466 -0.821
369 HD22 LEU 46 HD22 LEU 46 12.120 7.312 -0.951
370 HD23 LEU 46 HD23 LEU 46 12.100 8.733 -2.000
371 H SER 47 HN SER 47 9.385 4.966 1.259
372 HA SER 47 HA SER 47 7.183 3.148 0.414
373 HG SER 47 HG SER 47 9.453 1.038 2.303
374 HB2 SER 47 HB2 SER 47 8.520 2.948 3.125
375 HB3 SER 47 HB3 SER 47 7.312 1.874 2.421
376 HA PRO 48 HA PRO 48 4.892 6.515 2.052
377 HB2 PRO 48 HB2 PRO 48 2.432 5.394 2.584
378 HB3 PRO 48 HB3 PRO 48 3.044 5.704 0.935
379 HG2 PRO 48 HG2 PRO 48 3.114 3.107 2.492
380 HG3 PRO 48 HG3 PRO 48 2.625 3.366 0.787
381 HD2 PRO 48 HD2 PRO 48 5.117 2.486 1.463
382 HD3 PRO 48 HD3 PRO 48 4.865 3.600 0.086
383 H LEU 49 HN LEU 49 4.345 7.479 3.928
384 HA LEU 49 HA LEU 49 4.343 5.907 6.487
385 HG LEU 49 HG LEU 49 6.943 7.268 5.203
386 HB2 LEU 49 HB2 LEU 49 5.153 8.807 6.008
387 HB3 LEU 49 HB3 LEU 49 5.135 7.980 7.562
388 HD11 LEU 49 HD11 LEU 49 7.514 8.731 7.810
389 HD12 LEU 49 HD12 LEU 49 8.734 8.211 6.633
390 HD13 LEU 49 HD13 LEU 49 7.522 9.422 6.173
391 HD21 LEU 49 HD21 LEU 49 6.515 5.284 6.592
392 HD22 LEU 49 HD22 LEU 49 8.162 5.861 6.831
393 HD23 LEU 49 HD23 LEU 49 6.921 6.199 8.061
394 H GLN 50 HN GLN 50 2.995 8.516 4.526
395 HA GLN 50 HA GLN 50 0.314 7.937 5.344
396 HB2 GLN 50 HB2 GLN 50 -0.261 10.328 5.894
397 HB3 GLN 50 HB3 GLN 50 0.659 9.498 7.139
398 HG2 GLN 50 HG2 GLN 50 2.662 10.681 6.633
399 HG3 GLN 50 HG3 GLN 50 2.028 11.255 5.086
400 HE21 GLN 50 HE22 GLN 50 2.094 13.479 5.344
401 HE22 GLN 50 HE21 GLN 50 1.258 14.330 6.617
402 H ASN 51 HN ASN 51 -1.063 9.742 3.943
403 HA ASN 51 HA ASN 51 -0.655 9.116 1.291
404 HB2 ASN 51 HB2 ASN 51 -2.752 10.032 2.123
405 HB3 ASN 51 HB3 ASN 51 -1.992 11.588 2.465
406 HD21 ASN 51 HD22 ASN 51 -1.714 13.100 0.734
407 HD22 ASN 51 HD21 ASN 51 -2.256 12.769 -0.888
408 H ALA 52 HN ALA 52 0.808 11.915 2.986
409 HA ALA 52 HA ALA 52 2.096 12.719 0.495
410 HB1 ALA 52 HB1 ALA 52 1.863 15.035 1.255
411 HB2 ALA 52 HB2 ALA 52 0.284 14.243 1.179
412 HB3 ALA 52 HB3 ALA 52 1.082 14.485 2.752
413 H LEU 53 HN LEU 53 3.148 10.931 2.878
414 HA LEU 53 HA LEU 53 5.730 12.279 2.843
415 HG LEU 53 HG LEU 53 4.552 13.796 4.959
416 HB2 LEU 53 HB2 LEU 53 4.473 11.228 5.394
417 HB3 LEU 53 HB3 LEU 53 6.209 11.260 5.174
418 HD11 LEU 53 HD11 LEU 53 5.223 14.257 7.292
419 HD12 LEU 53 HD12 LEU 53 4.224 12.801 7.205
420 HD13 LEU 53 HD13 LEU 53 5.981 12.652 7.404
421 HD21 LEU 53 HD21 LEU 53 7.522 13.319 5.556
422 HD22 LEU 53 HD22 LEU 53 6.869 13.859 4.004
423 HD23 LEU 53 HD23 LEU 53 6.714 14.895 5.421
424 H TYR 54 HN TYR 54 7.303 10.868 2.373
425 HA TYR 54 HA TYR 54 6.801 7.957 2.683
426 HD1 TYR 54 HD1 TYR 54 5.194 10.040 0.319
427 HD2 TYR 54 HD2 TYR 54 6.847 6.150 -0.528
428 HE1 TYR 54 HE1 TYR 54 3.069 9.377 -0.747
429 HE2 TYR 54 HE2 TYR 54 4.749 5.500 -1.646
430 HH TYR 54 HH TYR 54 2.578 6.151 -2.241
431 HB2 TYR 54 HB2 TYR 54 7.859 9.417 0.224
432 HB3 TYR 54 HB3 TYR 54 8.188 7.728 0.547
433 H CYS 55 HN CYS 55 8.650 6.868 3.358
434 HA CYS 55 HA CYS 55 10.882 8.485 4.367
435 HG CYS 55 HG CYS 55 10.573 4.056 5.125
436 HB2 CYS 55 HB2 CYS 55 11.796 6.326 5.088
437 HB3 CYS 55 HB3 CYS 55 10.173 6.614 5.725
438 H ILE 56 HN ILE 56 13.138 7.850 3.734
439 HA ILE 56 HA ILE 56 13.334 7.412 0.791
440 HB ILE 56 HB ILE 56 15.118 8.994 2.678
441 HG12 ILE 56 HG12 ILE 56 13.415 10.198 0.469
442 HG13 ILE 56 HG13 ILE 56 12.779 10.006 2.102
443 HG21 ILE 56 HG21 ILE 56 16.173 9.873 0.539
444 HG22 ILE 56 HG22 ILE 56 16.496 8.189 0.807
445 HG23 ILE 56 HG23 ILE 56 15.249 8.660 -0.357
446 HD11 ILE 56 HD11 ILE 56 13.662 12.245 1.838
447 HD12 ILE 56 HD12 ILE 56 14.596 11.354 3.035
448 HD13 ILE 56 HD13 ILE 56 15.256 11.635 1.419
449 H ASN 57 HN ASN 57 14.933 6.191 0.000
450 HA ASN 57 HA ASN 57 16.706 4.930 -0.319
451 HB2 ASN 57 HB2 ASN 57 17.927 6.544 1.149
452 HB3 ASN 57 HB3 ASN 57 17.581 5.516 2.547
453 HD21 ASN 57 HD22 ASN 57 18.977 5.476 -0.759
454 HD22 ASN 57 HD21 ASN 57 20.189 4.246 -0.416
455 H ARG 58 HN ARG 58 15.797 4.239 3.018
456 HA ARG 58 HA ARG 58 14.377 1.930 2.765
457 HE ARG 58 HE ARG 58 16.828 0.352 5.475
458 HB2 ARG 58 HB2 ARG 58 15.886 0.095 3.382
459 HB3 ARG 58 HB3 ARG 58 16.267 0.699 1.810
460 HG2 ARG 58 HG2 ARG 58 18.361 1.349 2.386
461 HG3 ARG 58 HG3 ARG 58 17.860 2.070 3.913
462 HD2 ARG 58 HD2 ARG 58 18.255 -0.911 3.436
463 HD3 ARG 58 HD3 ARG 58 19.411 0.181 4.228
464 HH11 ARG 58 HH11 ARG 58 19.657 -1.795 5.324
465 HH12 ARG 58 HH12 ARG 58 19.388 -2.492 6.878
466 HH21 ARG 58 HH21 ARG 58 16.469 -0.560 7.528
467 HH22 ARG 58 HH22 ARG 58 17.522 -1.768 8.165
468 H GLU 59 HN GLU 59 14.915 4.470 4.492
469 HA GLU 59 HA GLU 59 14.743 3.093 7.083
470 HB2 GLU 59 HB2 GLU 59 16.370 4.471 8.154
471 HB3 GLU 59 HB3 GLU 59 17.125 3.538 6.860
472 HG2 GLU 59 HG2 GLU 59 17.013 5.616 5.400
473 HG3 GLU 59 HG3 GLU 59 16.460 6.516 6.818
474 H LYS 60 HN LYS 60 13.504 4.114 8.527
475 HA LYS 60 HA LYS 60 11.400 5.613 7.380
476 HB2 LYS 60 HB2 LYS 60 12.021 5.128 10.325
477 HB3 LYS 60 HB3 LYS 60 10.480 5.688 9.693
478 HG2 LYS 60 HG2 LYS 60 11.740 2.969 9.136
479 HG3 LYS 60 HG3 LYS 60 10.428 3.312 10.264
480 HD2 LYS 60 HD2 LYS 60 9.048 4.156 8.335
481 HD3 LYS 60 HD3 LYS 60 10.304 3.593 7.227
482 HE2 LYS 60 HE2 LYS 60 8.753 1.859 9.206
483 HE3 LYS 60 HE3 LYS 60 8.385 2.012 7.488
484 HZ1 LYS 60 HZ1 LYS 60 10.885 0.869 8.595
485 HZ2 LYS 60 HZ2 LYS 60 9.668 0.038 7.909
486 HZ3 LYS 60 HZ3 LYS 60 10.561 1.045 6.996
487 H LEU 61 HN LEU 61 14.152 6.712 9.308
488 HA LEU 61 HA LEU 61 13.004 9.088 10.277
489 HG LEU 61 HG LEU 61 15.210 6.753 11.076
490 HB2 LEU 61 HB2 LEU 61 15.954 8.598 9.645
491 HB3 LEU 61 HB3 LEU 61 15.308 9.785 10.773
492 HD11 LEU 61 HD11 LEU 61 16.750 8.892 12.599
493 HD12 LEU 61 HD12 LEU 61 16.773 7.141 12.923
494 HD13 LEU 61 HD13 LEU 61 17.420 7.768 11.395
495 HD21 LEU 61 HD21 LEU 61 14.140 8.929 12.921
496 HD22 LEU 61 HD22 LEU 61 13.198 7.680 12.072
497 HD23 LEU 61 HD23 LEU 61 14.318 7.211 13.356
498 H HIS 62 HN HIS 62 14.827 8.510 7.300
499 HA HIS 62 HA HIS 62 14.961 11.369 6.645
500 HD1 HIS 62 HD1 HIS 62 18.529 8.832 4.717
501 HD2 HIS 62 HD2 HIS 62 16.883 10.735 8.092
502 HE1 HIS 62 HE1 HIS 62 20.409 9.032 6.417
503 HB2 HIS 62 HB2 HIS 62 15.698 8.884 5.037
504 HB3 HIS 62 HB3 HIS 62 16.059 10.547 4.582
505 H THR 63 HN THR 63 13.145 12.395 5.733
506 HA THR 63 HA THR 63 11.258 10.739 4.159
507 HB THR 63 HB THR 63 9.559 12.240 5.246
508 HG1 THR 63 HG1 THR 63 10.221 13.412 7.041
509 HG21 THR 63 HG21 THR 63 11.247 10.660 7.237
510 HG22 THR 63 HG22 THR 63 9.506 10.999 7.324
511 HG23 THR 63 HG23 THR 63 10.142 9.927 6.061
512 H VAL 64 HN VAL 64 10.008 11.693 2.604
513 HA VAL 64 HA VAL 64 10.661 14.457 1.697
514 HB VAL 64 HB VAL 64 9.684 13.409 -0.555
515 HG11 VAL 64 HG11 VAL 64 11.968 13.216 -1.421
516 HG12 VAL 64 HG12 VAL 64 11.697 14.649 -0.418
517 HG13 VAL 64 HG13 VAL 64 12.596 13.266 0.242
518 HG21 VAL 64 HG21 VAL 64 10.530 11.223 -1.135
519 HG22 VAL 64 HG22 VAL 64 11.197 10.994 0.491
520 HG23 VAL 64 HG23 VAL 64 9.444 11.098 0.255
521 H LYS 65 HN LYS 65 8.848 15.665 1.270
522 HA LYS 65 HA LYS 65 6.215 14.524 2.040
523 HB2 LYS 65 HB2 LYS 65 6.989 16.723 3.075
524 HB3 LYS 65 HB3 LYS 65 6.948 17.424 1.447
525 HG2 LYS 65 HG2 LYS 65 4.491 16.604 1.355
526 HG3 LYS 65 HG3 LYS 65 4.633 16.299 3.082
527 HD2 LYS 65 HD2 LYS 65 5.017 18.648 3.524
528 HD3 LYS 65 HD3 LYS 65 5.144 19.027 1.798
529 HE2 LYS 65 HE2 LYS 65 2.657 17.804 3.076
530 HE3 LYS 65 HE3 LYS 65 2.893 19.546 2.924
531 HZ1 LYS 65 HZ1 LYS 65 2.886 19.359 0.567
532 HZ2 LYS 65 HZ2 LYS 65 2.889 17.719 0.571
533 HZ3 LYS 65 HZ3 LYS 65 1.581 18.553 1.102
534 H VAL 66 HN VAL 66 4.607 14.265 0.413
535 HA VAL 66 HA VAL 66 5.506 14.563 -2.378
536 HB VAL 66 HB VAL 66 2.773 13.781 -1.275
537 HG11 VAL 66 HG11 VAL 66 2.468 12.739 -3.533
538 HG12 VAL 66 HG12 VAL 66 2.613 14.491 -3.625
539 HG13 VAL 66 HG13 VAL 66 3.999 13.469 -4.063
540 HG21 VAL 66 HG21 VAL 66 4.468 12.151 -0.533
541 HG22 VAL 66 HG22 VAL 66 3.471 11.452 -1.809
542 HG23 VAL 66 HG23 VAL 66 5.106 12.030 -2.186
543 H LEU 67 HN LEU 67 4.805 16.146 -3.814
544 HA LEU 67 HA LEU 67 3.043 18.320 -2.749
545 HG LEU 67 HG LEU 67 6.283 18.330 -2.768
546 HB2 LEU 67 HB2 LEU 67 5.135 18.504 -4.949
547 HB3 LEU 67 HB3 LEU 67 4.134 19.813 -4.337
548 HD11 LEU 67 HD11 LEU 67 7.574 20.400 -2.984
549 HD12 LEU 67 HD12 LEU 67 7.161 19.769 -4.570
550 HD13 LEU 67 HD13 LEU 67 6.251 21.146 -3.916
551 HD21 LEU 67 HD21 LEU 67 4.624 20.756 -1.962
552 HD22 LEU 67 HD22 LEU 67 4.569 19.137 -1.226
553 HD23 LEU 67 HD23 LEU 67 6.024 20.114 -1.070
554 H SER 68 HN SER 68 3.996 16.398 -5.655
555 HA SER 68 HA SER 68 1.220 16.251 -6.587
556 HG SER 68 HG SER 68 2.135 19.342 -8.300
557 HB2 SER 68 HB2 SER 68 3.420 17.439 -8.349
558 HB3 SER 68 HB3 SER 68 1.737 17.156 -8.803
559 H ALA 69 HN ALA 69 1.110 14.588 -8.402
560 HA ALA 69 HA ALA 69 3.552 13.355 -9.276
561 HB1 ALA 69 HB1 ALA 69 3.300 12.113 -7.154
562 HB2 ALA 69 HB2 ALA 69 1.615 11.709 -7.573
563 HB3 ALA 69 HB3 ALA 69 2.963 11.045 -8.525
564 H SER 70 HN SER 70 3.163 11.828 -11.010
565 HA SER 70 HA SER 70 0.476 11.497 -12.104
566 HG SER 70 HG SER 70 2.529 14.574 -13.740
567 HB2 SER 70 HB2 SER 70 1.235 12.692 -14.277
568 HB3 SER 70 HB3 SER 70 0.684 13.679 -12.924
569 H SER 71 HN SER 71 0.462 9.948 -13.856
570 HA SER 71 HA SER 71 2.509 8.028 -14.057
571 HG SER 71 HG SER 71 -0.849 7.298 -15.160
572 HB2 SER 71 HB2 SER 71 0.506 8.833 -16.206
573 HB3 SER 71 HB3 SER 71 1.290 7.255 -16.006
574 H TYR 72 HN TYR 72 4.195 7.723 -15.681
575 HA TYR 72 HA TYR 72 5.604 10.136 -16.049
576 HD1 TYR 72 HD2 TYR 72 8.375 10.137 -16.075
577 HD2 TYR 72 HD1 TYR 72 7.012 7.738 -19.395
578 HE1 TYR 72 HE2 TYR 72 10.123 11.132 -17.496
579 HE2 TYR 72 HE1 TYR 72 8.772 8.727 -20.828
580 HH TYR 72 HH TYR 72 11.136 11.140 -19.600
581 HB2 TYR 72 HB2 TYR 72 6.824 8.092 -15.776
582 HB3 TYR 72 HB3 TYR 72 6.079 7.383 -17.213
583 H SER 73 HN SER 73 5.920 11.513 -17.696
584 HA SER 73 HA SER 73 5.519 10.780 -20.430
585 HG SER 73 HG SER 73 3.248 10.524 -19.578
586 HB2 SER 73 HB2 SER 73 3.800 12.924 -19.108
587 HB3 SER 73 HB3 SER 73 4.074 12.861 -20.864
588 HA PRO 74 HA PRO 74 9.184 13.087 -20.109
589 HB2 PRO 74 HB2 PRO 74 9.514 14.137 -22.695
590 HB3 PRO 74 HB3 PRO 74 9.928 12.473 -22.170
591 HG2 PRO 74 HG2 PRO 74 7.457 13.464 -23.590
592 HG3 PRO 74 HG3 PRO 74 8.367 11.946 -23.862
593 HD2 PRO 74 HD2 PRO 74 6.053 12.000 -22.436
594 HD3 PRO 74 HD3 PRO 74 7.404 10.924 -21.966
595 H ASP 75 HN ASP 75 6.787 14.978 -22.020
596 HA ASP 75 HA ASP 75 7.749 17.544 -21.350
597 HB2 ASP 75 HB2 ASP 75 6.128 17.190 -23.127
598 HB3 ASP 75 HB3 ASP 75 4.929 16.596 -21.975
599 H GLU 76 HN GLU 76 5.402 15.444 -19.629
600 HA GLU 76 HA GLU 76 4.691 17.430 -17.710
601 HB2 GLU 76 HB2 GLU 76 3.385 15.332 -18.450
602 HB3 GLU 76 HB3 GLU 76 4.461 14.409 -17.399
603 HG2 GLU 76 HG2 GLU 76 2.429 14.838 -16.207
604 HG3 GLU 76 HG3 GLU 76 3.686 15.815 -15.464
605 H TRP 77 HN TRP 77 7.185 14.912 -17.804
606 HA TRP 77 HA TRP 77 8.139 15.147 -15.112
607 HD1 TRP 77 HD1 TRP 77 10.577 14.456 -14.139
608 HE1 TRP 77 HE1 TRP 77 13.117 14.208 -14.192
609 HE3 TRP 77 HE3 TRP 77 11.213 13.674 -19.157
610 HZ2 TRP 77 HZ2 TRP 77 15.178 13.618 -16.144
611 HZ3 TRP 77 HZ3 TRP 77 13.473 13.259 -20.086
612 HH2 TRP 77 HH2 TRP 77 15.461 13.227 -18.592
613 HB2 TRP 77 HB2 TRP 77 8.783 13.252 -16.398
614 HB3 TRP 77 HB3 TRP 77 9.253 14.218 -17.766
615 H GLU 78 HN GLU 78 9.105 16.771 -18.199
616 HA GLU 78 HA GLU 78 11.049 18.341 -16.826
617 HB2 GLU 78 HB2 GLU 78 9.830 18.554 -19.596
618 HB3 GLU 78 HB3 GLU 78 11.118 19.630 -19.019
619 HG2 GLU 78 HG2 GLU 78 12.535 17.625 -18.487
620 HG3 GLU 78 HG3 GLU 78 11.322 16.585 -19.207
621 H ARG 79 HN ARG 79 7.666 19.086 -17.653
622 HA ARG 79 HA ARG 79 7.659 21.771 -16.756
623 HE ARG 79 HE ARG 79 3.171 22.764 -18.209
624 HB2 ARG 79 HB2 ARG 79 5.702 19.477 -16.613
625 HB3 ARG 79 HB3 ARG 79 5.291 21.066 -15.932
626 HG2 ARG 79 HG2 ARG 79 5.698 22.117 -18.170
627 HG3 ARG 79 HG3 ARG 79 6.034 20.523 -18.840
628 HD2 ARG 79 HD2 ARG 79 3.799 20.836 -19.387
629 HD3 ARG 79 HD3 ARG 79 3.705 19.837 -17.941
630 HH11 ARG 79 HH12 ARG 79 2.672 19.817 -16.204
631 HH12 ARG 79 HH11 ARG 79 1.820 20.692 -14.986
632 HH21 ARG 79 HH21 ARG 79 1.954 23.825 -16.618
633 HH22 ARG 79 HH22 ARG 79 1.342 22.971 -15.257
634 H GLN 80 HN GLN 80 7.269 18.733 -14.795
635 HA GLN 80 HA GLN 80 7.085 20.122 -12.320
636 HB2 GLN 80 HB2 GLN 80 7.889 17.266 -13.006
637 HB3 GLN 80 HB3 GLN 80 7.750 17.862 -11.342
638 HG2 GLN 80 HG2 GLN 80 5.420 18.390 -11.612
639 HG3 GLN 80 HG3 GLN 80 5.479 18.118 -13.349
640 HE21 GLN 80 HE22 GLN 80 5.364 16.037 -14.196
641 HE22 GLN 80 HE21 GLN 80 4.794 14.692 -13.204
642 H CYS 81 HN CYS 81 9.945 18.951 -14.165
643 HA CYS 81 HA CYS 81 11.872 19.658 -12.177
644 HG CYS 81 HG CYS 81 11.175 17.286 -14.335
645 HB2 CYS 81 HB2 CYS 81 12.160 19.547 -15.206
646 HB3 CYS 81 HB3 CYS 81 13.489 19.651 -14.046
647 H LYS 82 HN LYS 82 10.268 21.692 -14.696
648 HA LYS 82 HA LYS 82 11.981 23.937 -14.254
649 HB2 LYS 82 HB2 LYS 82 9.201 23.609 -15.442
650 HB3 LYS 82 HB3 LYS 82 9.840 25.207 -15.109
651 HG2 LYS 82 HG2 LYS 82 11.240 23.173 -16.897
652 HG3 LYS 82 HG3 LYS 82 10.145 24.444 -17.461
653 HD2 LYS 82 HD2 LYS 82 11.669 26.154 -16.363
654 HD3 LYS 82 HD3 LYS 82 12.830 24.841 -16.070
655 HE2 LYS 82 HE2 LYS 82 12.892 24.377 -18.519
656 HE3 LYS 82 HE3 LYS 82 11.744 25.698 -18.786
657 HZ1 LYS 82 HZ1 LYS 82 13.958 26.480 -19.166
658 HZ2 LYS 82 HZ2 LYS 82 13.410 27.219 -17.806
659 HZ3 LYS 82 HZ3 LYS 82 14.484 25.980 -17.706
660 H VAL 83 HN VAL 83 8.836 22.880 -12.846
661 HA VAL 83 HA VAL 83 8.589 25.136 -11.221
662 HB VAL 83 HB VAL 83 7.517 22.315 -10.835
663 HG11 VAL 83 HG11 VAL 83 7.447 23.423 -8.644
664 HG12 VAL 83 HG12 VAL 83 6.710 24.871 -9.367
665 HG13 VAL 83 HG13 VAL 83 5.821 23.330 -9.320
666 HG21 VAL 83 HG21 VAL 83 6.201 24.873 -11.871
667 HG22 VAL 83 HG22 VAL 83 6.715 23.513 -12.879
668 HG23 VAL 83 HG23 VAL 83 5.419 23.286 -11.705
669 H ALA 84 HN ALA 84 10.248 22.014 -10.534
670 HA ALA 84 HA ALA 84 11.203 22.576 -7.940
671 HB1 ALA 84 HB1 ALA 84 11.439 20.405 -8.902
672 HB2 ALA 84 HB2 ALA 84 12.442 21.015 -10.243
673 HB3 ALA 84 HB3 ALA 84 13.073 21.020 -8.598
674 H GLY 85 HN GLY 85 12.613 23.511 -11.108
675 HA2 GLY 85 HA2 GLY 85 14.834 24.955 -9.949
676 HA3 GLY 85 HA3 GLY 85 14.317 24.933 -11.641
677 H LYS 86 HN LYS 86 11.663 25.838 -9.640
678 HA LYS 86 HA LYS 86 10.534 27.741 -9.407
679 HB2 LYS 86 HB2 LYS 86 12.715 28.238 -8.011
680 HB3 LYS 86 HB3 LYS 86 13.068 29.387 -9.300
681 HG2 LYS 86 HG2 LYS 86 10.628 30.282 -8.815
682 HG3 LYS 86 HG3 LYS 86 10.765 29.370 -7.315
683 HD2 LYS 86 HD2 LYS 86 12.582 31.608 -8.299
684 HD3 LYS 86 HD3 LYS 86 11.406 31.744 -7.001
685 HE2 LYS 86 HE2 LYS 86 13.774 29.822 -6.894
686 HE3 LYS 86 HE3 LYS 86 13.899 31.498 -6.374
687 HZ1 LYS 86 HZ1 LYS 86 11.912 29.637 -5.186
688 HZ2 LYS 86 HZ2 LYS 86 13.426 29.837 -4.620
689 HZ3 LYS 86 HZ3 LYS 86 12.383 31.112 -4.634
690 H THR 87 HN THR 87 11.095 26.789 -12.004
691 HA THR 87 HA THR 87 10.893 27.245 -14.167
692 HB THR 87 HB THR 87 9.080 29.462 -13.183
693 HG1 THR 87 HG1 THR 87 7.649 27.885 -12.641
694 HG21 THR 87 HG21 THR 87 8.807 27.425 -15.454
695 HG22 THR 87 HG22 THR 87 7.607 28.656 -15.004
696 HG23 THR 87 HG23 THR 87 9.172 29.150 -15.661
697 H GLN 88 HN GLN 88 13.280 27.960 -13.871
698 HA GLN 88 HA GLN 88 14.007 30.666 -14.478
699 HB2 GLN 88 HB2 GLN 88 15.417 28.114 -15.372
700 HB3 GLN 88 HB3 GLN 88 16.094 29.737 -15.332
701 HG2 GLN 88 HG2 GLN 88 15.339 28.002 -12.961
702 HG3 GLN 88 HG3 GLN 88 16.954 28.441 -13.472
703 HE21 GLN 88 HE22 GLN 88 14.827 29.069 -11.097
704 HE22 GLN 88 HE21 GLN 88 15.217 30.747 -10.729
Start of MODEL 16
1 HA MET 1 HA MET 1 3.246 -1.194 -2.671
2 H1 MET 1 H1 MET 1 1.483 -1.228 -1.086
3 H2 MET 1 H2 MET 1 2.928 -0.930 -0.343
4 H3 MET 1 H3 MET 1 1.857 0.291 -0.565
5 HB2 MET 1 HB2 MET 1 1.034 -0.291 -3.404
6 HB3 MET 1 HB3 MET 1 1.563 1.336 -2.950
7 HG2 MET 1 HG2 MET 1 1.834 0.952 -5.357
8 HG3 MET 1 HG3 MET 1 3.399 1.218 -4.594
9 HE1 MET 1 HE1 MET 1 3.165 0.124 -7.520
10 HE2 MET 1 HE2 MET 1 4.711 0.342 -6.665
11 HE3 MET 1 HE3 MET 1 4.361 -1.189 -7.496
12 H GLU 2 HN GLU 2 5.255 -0.456 -3.222
13 HA GLU 2 HA GLU 2 6.301 1.990 -1.912
14 HB2 GLU 2 HB2 GLU 2 7.739 -0.702 -2.078
15 HB3 GLU 2 HB3 GLU 2 8.375 0.801 -1.427
16 HG2 GLU 2 HG2 GLU 2 7.795 -0.335 0.501
17 HG3 GLU 2 HG3 GLU 2 6.406 0.719 0.259
18 H TRP 3 HN TRP 3 8.217 2.766 -3.098
19 HA TRP 3 HA TRP 3 8.029 2.108 -5.992
20 HD1 TRP 3 HD1 TRP 3 6.388 5.489 -3.358
21 HE1 TRP 3 HE1 TRP 3 3.840 5.478 -3.522
22 HE3 TRP 3 HE3 TRP 3 5.912 2.904 -7.744
23 HZ2 TRP 3 HZ2 TRP 3 1.824 4.435 -5.344
24 HZ3 TRP 3 HZ3 TRP 3 3.667 2.448 -8.695
25 HH2 TRP 3 HH2 TRP 3 1.620 3.200 -7.500
26 HB2 TRP 3 HB2 TRP 3 8.343 4.903 -4.877
27 HB3 TRP 3 HB3 TRP 3 7.978 4.441 -6.516
28 H LEU 4 HN LEU 4 9.867 3.062 -7.217
29 HA LEU 4 HA LEU 4 12.433 3.120 -5.704
30 HG LEU 4 HG LEU 4 14.009 3.081 -8.510
31 HB2 LEU 4 HB2 LEU 4 12.219 1.101 -7.048
32 HB3 LEU 4 HB3 LEU 4 11.713 2.045 -8.444
33 HD11 LEU 4 HD11 LEU 4 15.826 1.825 -7.317
34 HD12 LEU 4 HD12 LEU 4 14.777 2.727 -6.224
35 HD13 LEU 4 HD13 LEU 4 14.587 0.969 -6.380
36 HD21 LEU 4 HD21 LEU 4 13.880 0.037 -8.690
37 HD22 LEU 4 HD22 LEU 4 13.351 1.173 -9.947
38 HD23 LEU 4 HD23 LEU 4 15.061 1.088 -9.503
39 H VAL 5 HN VAL 5 13.573 4.882 -6.057
40 HA VAL 5 HA VAL 5 12.702 7.100 -7.874
41 HB VAL 5 HB VAL 5 15.150 6.888 -6.054
42 HG11 VAL 5 HG11 VAL 5 15.427 8.584 -7.757
43 HG12 VAL 5 HG12 VAL 5 13.810 9.230 -7.420
44 HG13 VAL 5 HG13 VAL 5 15.114 9.376 -6.216
45 HG21 VAL 5 HG21 VAL 5 13.209 6.742 -4.588
46 HG22 VAL 5 HG22 VAL 5 13.812 8.392 -4.492
47 HG23 VAL 5 HG23 VAL 5 12.374 8.023 -5.476
48 H LYS 6 HN LYS 6 13.165 6.647 -9.898
49 HA LYS 6 HA LYS 6 15.627 5.204 -10.708
50 HB2 LYS 6 HB2 LYS 6 12.905 5.623 -11.854
51 HB3 LYS 6 HB3 LYS 6 14.233 5.499 -13.000
52 HG2 LYS 6 HG2 LYS 6 14.090 3.438 -10.812
53 HG3 LYS 6 HG3 LYS 6 12.921 3.357 -12.113
54 HD2 LYS 6 HD2 LYS 6 14.916 1.929 -12.493
55 HD3 LYS 6 HD3 LYS 6 14.557 3.061 -13.798
56 HE2 LYS 6 HE2 LYS 6 16.358 4.565 -13.065
57 HE3 LYS 6 HE3 LYS 6 16.699 3.514 -11.676
58 HZ1 LYS 6 HZ1 LYS 6 17.334 1.769 -13.240
59 HZ2 LYS 6 HZ2 LYS 6 17.013 2.735 -14.520
60 HZ3 LYS 6 HZ3 LYS 6 18.225 3.106 -13.501
61 H LYS 7 HN LYS 7 14.338 8.429 -10.575
62 HA LYS 7 HA LYS 7 16.788 9.534 -11.664
63 HB2 LYS 7 HB2 LYS 7 14.102 10.259 -12.890
64 HB3 LYS 7 HB3 LYS 7 15.487 11.336 -12.904
65 HG2 LYS 7 HG2 LYS 7 16.826 9.734 -14.162
66 HG3 LYS 7 HG3 LYS 7 15.500 8.564 -14.148
67 HD2 LYS 7 HD2 LYS 7 14.048 10.234 -15.327
68 HD3 LYS 7 HD3 LYS 7 15.436 11.316 -15.462
69 HE2 LYS 7 HE2 LYS 7 15.323 8.466 -16.559
70 HE3 LYS 7 HE3 LYS 7 14.929 9.915 -17.501
71 HZ1 LYS 7 HZ1 LYS 7 17.195 9.226 -17.894
72 HZ2 LYS 7 HZ2 LYS 7 17.211 10.679 -17.162
73 HZ3 LYS 7 HZ3 LYS 7 17.584 9.326 -16.318
74 H SER 8 HN SER 8 17.057 11.680 -10.693
75 HA SER 8 HA SER 8 14.968 12.716 -8.879
76 HG SER 8 HG SER 8 18.608 12.200 -8.498
77 HB2 SER 8 HB2 SER 8 16.902 12.961 -7.177
78 HB3 SER 8 HB3 SER 8 16.135 11.379 -7.354
79 H CYS 9 HN CYS 9 15.172 14.958 -8.669
80 HA CYS 9 HA CYS 9 17.178 16.342 -10.396
81 HG CYS 9 HG CYS 9 13.891 16.355 -12.696
82 HB2 CYS 9 HB2 CYS 9 14.191 16.894 -10.118
83 HB3 CYS 9 HB3 CYS 9 15.337 17.800 -11.116
84 H CYS 10 HN CYS 10 18.421 17.478 -9.046
85 HA CYS 10 HA CYS 10 17.753 18.272 -6.400
86 HG CYS 10 HG CYS 10 21.662 17.659 -7.153
87 HB2 CYS 10 HB2 CYS 10 19.942 19.308 -8.254
88 HB3 CYS 10 HB3 CYS 10 19.894 19.474 -6.493
89 H ASN 11 HN ASN 11 17.606 20.440 -5.544
90 HA ASN 11 HA ASN 11 17.224 22.773 -7.241
91 HB2 ASN 11 HB2 ASN 11 15.066 23.254 -6.960
92 HB3 ASN 11 HB3 ASN 11 14.894 21.512 -7.090
93 HD21 ASN 11 HD22 ASN 11 14.974 20.328 -4.861
94 HD22 ASN 11 HD21 ASN 11 14.108 21.094 -3.575
95 H LYS 12 HN LYS 12 17.134 24.661 -5.982
96 HA LYS 12 HA LYS 12 17.452 24.399 -3.045
97 HB2 LYS 12 HB2 LYS 12 18.948 26.587 -4.494
98 HB3 LYS 12 HB3 LYS 12 19.098 26.036 -2.840
99 HG2 LYS 12 HG2 LYS 12 21.033 25.218 -3.723
100 HG3 LYS 12 HG3 LYS 12 19.996 23.796 -3.916
101 HD2 LYS 12 HD2 LYS 12 19.530 24.526 -6.274
102 HD3 LYS 12 HD3 LYS 12 20.568 25.919 -6.056
103 HE2 LYS 12 HE2 LYS 12 21.464 22.999 -5.836
104 HE3 LYS 12 HE3 LYS 12 21.634 23.992 -7.285
105 HZ1 LYS 12 HZ1 LYS 12 22.956 24.544 -4.693
106 HZ2 LYS 12 HZ2 LYS 12 23.675 23.961 -6.031
107 HZ3 LYS 12 HZ3 LYS 12 23.086 25.477 -6.032
108 H GLN 13 HN GLN 13 15.933 25.719 -5.784
109 HA GLN 13 HA GLN 13 15.505 28.361 -4.970
110 HB2 GLN 13 HB2 GLN 13 14.044 26.632 -7.036
111 HB3 GLN 13 HB3 GLN 13 13.864 28.373 -6.845
112 HG2 GLN 13 HG2 GLN 13 15.368 28.314 -8.552
113 HG3 GLN 13 HG3 GLN 13 16.450 28.506 -7.184
114 HE21 GLN 13 HE22 GLN 13 17.327 27.599 -9.704
115 HE22 GLN 13 HE21 GLN 13 17.802 25.912 -9.570
116 H ASP 14 HN ASP 14 13.594 25.353 -4.463
117 HA ASP 14 HA ASP 14 11.854 26.922 -2.598
118 HB2 ASP 14 HB2 ASP 14 10.900 26.992 -4.985
119 HB3 ASP 14 HB3 ASP 14 10.636 25.261 -4.820
120 H ASN 15 HN ASN 15 13.734 24.440 -2.720
121 HA ASN 15 HA ASN 15 14.034 22.454 -1.817
122 HB2 ASN 15 HB2 ASN 15 13.271 23.414 0.298
123 HB3 ASN 15 HB3 ASN 15 11.604 22.973 -0.083
124 HD21 ASN 15 HD22 ASN 15 14.873 21.304 0.039
125 HD22 ASN 15 HD21 ASN 15 14.224 19.909 0.880
126 H ARG 16 HN ARG 16 11.561 23.081 -3.861
127 HA ARG 16 HA ARG 16 10.151 20.592 -4.030
128 HE ARG 16 HE ARG 16 6.431 22.358 -6.664
129 HB2 ARG 16 HB2 ARG 16 10.680 22.752 -6.106
130 HB3 ARG 16 HB3 ARG 16 9.608 21.353 -6.320
131 HG2 ARG 16 HG2 ARG 16 8.222 22.126 -4.432
132 HG3 ARG 16 HG3 ARG 16 9.248 23.542 -4.239
133 HD2 ARG 16 HD2 ARG 16 8.161 24.632 -5.936
134 HD3 ARG 16 HD3 ARG 16 8.502 23.316 -7.040
135 HH11 ARG 16 HH11 ARG 16 6.840 25.041 -4.324
136 HH12 ARG 16 HH12 ARG 16 5.186 24.939 -3.800
137 HH21 ARG 16 HH21 ARG 16 4.478 22.162 -5.971
138 HH22 ARG 16 HH22 ARG 16 3.734 23.231 -4.792
139 H HIS 17 HN HIS 17 11.604 18.900 -4.006
140 HA HIS 17 HA HIS 17 13.535 18.558 -6.235
141 HD1 HIS 17 HD1 HIS 17 13.905 18.523 -2.204
142 HD2 HIS 17 HD2 HIS 17 16.055 17.114 -5.522
143 HE1 HIS 17 HE1 HIS 17 16.328 19.282 -1.859
144 HB2 HIS 17 HB2 HIS 17 12.599 16.821 -3.913
145 HB3 HIS 17 HB3 HIS 17 13.593 16.190 -5.230
146 H VAL 18 HN VAL 18 13.140 16.708 -7.727
147 HA VAL 18 HA VAL 18 10.381 15.711 -7.810
148 HB VAL 18 HB VAL 18 11.753 16.649 -10.350
149 HG11 VAL 18 HG11 VAL 18 9.586 16.353 -11.432
150 HG12 VAL 18 HG12 VAL 18 10.074 14.845 -10.680
151 HG13 VAL 18 HG13 VAL 18 8.841 15.859 -9.895
152 HG21 VAL 18 HG21 VAL 18 11.131 18.634 -8.980
153 HG22 VAL 18 HG22 VAL 18 10.169 18.515 -10.460
154 HG23 VAL 18 HG23 VAL 18 9.465 18.041 -8.903
155 H LEU 19 HN LEU 19 10.287 13.689 -8.647
156 HA LEU 19 HA LEU 19 12.816 12.408 -9.465
157 HG LEU 19 HG LEU 19 10.691 12.289 -6.242
158 HB2 LEU 19 HB2 LEU 19 11.716 10.495 -7.758
159 HB3 LEU 19 HB3 LEU 19 13.238 11.340 -7.618
160 HD11 LEU 19 HD11 LEU 19 11.605 11.231 -4.255
161 HD12 LEU 19 HD12 LEU 19 11.372 10.050 -5.551
162 HD13 LEU 19 HD13 LEU 19 13.007 10.640 -5.183
163 HD21 LEU 19 HD21 LEU 19 13.608 13.170 -6.234
164 HD22 LEU 19 HD22 LEU 19 12.134 14.158 -6.117
165 HD23 LEU 19 HD23 LEU 19 12.687 13.264 -4.718
166 H MET 20 HN MET 20 12.445 10.157 -10.204
167 HA MET 20 HA MET 20 9.833 10.005 -11.650
168 HB2 MET 20 HB2 MET 20 11.802 10.230 -13.165
169 HB3 MET 20 HB3 MET 20 12.467 8.732 -12.470
170 HG2 MET 20 HG2 MET 20 10.488 7.487 -13.248
171 HG3 MET 20 HG3 MET 20 9.760 8.986 -13.825
172 HE1 MET 20 HE1 MET 20 13.526 7.719 -14.214
173 HE2 MET 20 HE2 MET 20 12.539 6.272 -14.445
174 HE3 MET 20 HE3 MET 20 13.431 6.960 -15.818
175 H LEU 21 HN LEU 21 8.646 8.813 -10.379
176 HA LEU 21 HA LEU 21 9.723 6.794 -8.538
177 HG LEU 21 HG LEU 21 8.359 7.052 -6.528
178 HB2 LEU 21 HB2 LEU 21 7.023 8.013 -9.099
179 HB3 LEU 21 HB3 LEU 21 7.068 6.364 -8.472
180 HD11 LEU 21 HD11 LEU 21 9.689 8.900 -7.297
181 HD12 LEU 21 HD12 LEU 21 8.254 9.829 -7.769
182 HD13 LEU 21 HD13 LEU 21 8.617 9.543 -6.051
183 HD21 LEU 21 HD21 LEU 21 5.880 8.764 -6.996
184 HD22 LEU 21 HD22 LEU 21 5.910 7.088 -6.418
185 HD23 LEU 21 HD23 LEU 21 6.590 8.373 -5.412
186 H CYS 22 HN CYS 22 9.069 4.606 -8.712
187 HA CYS 22 HA CYS 22 8.273 3.508 -11.291
188 HG CYS 22 HG CYS 22 10.577 0.941 -10.371
189 HB2 CYS 22 HB2 CYS 22 10.630 3.988 -11.647
190 HB3 CYS 22 HB3 CYS 22 11.065 3.420 -10.043
191 H ASP 23 HN ASP 23 8.174 1.050 -10.977
192 HA ASP 23 HA ASP 23 7.021 0.265 -8.411
193 HB2 ASP 23 HB2 ASP 23 6.397 -1.040 -10.305
194 HB3 ASP 23 HB3 ASP 23 8.076 -1.228 -10.832
195 H ALA 24 HN ALA 24 8.060 -0.761 -6.705
196 HA ALA 24 HA ALA 24 10.906 -0.438 -6.304
197 HB1 ALA 24 HB1 ALA 24 8.785 -1.932 -4.718
198 HB2 ALA 24 HB2 ALA 24 10.472 -1.686 -4.211
199 HB3 ALA 24 HB3 ALA 24 9.403 -0.288 -4.417
200 H GLY 25 HN GLY 25 11.493 -1.468 -8.316
201 HA2 GLY 25 HA2 GLY 25 12.545 -4.057 -8.305
202 HA3 GLY 25 HA3 GLY 25 10.865 -4.202 -8.870
203 H GLY 26 HN GLY 26 11.188 -1.355 -10.074
204 HA2 GLY 26 HA2 GLY 26 12.630 -0.386 -11.714
205 HA3 GLY 26 HA3 GLY 26 13.073 -1.975 -12.298
206 H ALA 27 HN ALA 27 9.715 -2.181 -12.044
207 HA ALA 27 HA ALA 27 9.636 -2.133 -14.948
208 HB1 ALA 27 HB1 ALA 27 7.529 -2.909 -12.884
209 HB2 ALA 27 HB2 ALA 27 7.405 -3.150 -14.639
210 HB3 ALA 27 HB3 ALA 27 8.666 -3.988 -13.718
211 H ILE 28 HN ILE 28 7.286 -0.773 -12.618
212 HA ILE 28 HA ILE 28 5.906 0.743 -14.609
213 HB ILE 28 HB ILE 28 5.820 0.888 -11.563
214 HG12 ILE 28 HG12 ILE 28 4.023 -0.576 -13.557
215 HG13 ILE 28 HG13 ILE 28 5.257 -1.340 -12.565
216 HG21 ILE 28 HG21 ILE 28 3.803 2.033 -13.540
217 HG22 ILE 28 HG22 ILE 28 3.567 1.907 -11.786
218 HG23 ILE 28 HG23 ILE 28 4.814 2.952 -12.388
219 HD11 ILE 28 HD11 ILE 28 3.205 -1.792 -11.505
220 HD12 ILE 28 HD12 ILE 28 4.006 -0.566 -10.503
221 HD13 ILE 28 HD13 ILE 28 2.668 -0.113 -11.590
222 H LYS 29 HN LYS 29 5.629 3.230 -14.600
223 HA LYS 29 HA LYS 29 7.879 4.682 -13.381
224 HB2 LYS 29 HB2 LYS 29 7.123 4.943 -16.330
225 HB3 LYS 29 HB3 LYS 29 8.182 6.058 -15.467
226 HG2 LYS 29 HG2 LYS 29 8.752 3.106 -15.896
227 HG3 LYS 29 HG3 LYS 29 9.408 4.411 -16.871
228 HD2 LYS 29 HD2 LYS 29 10.690 5.312 -15.104
229 HD3 LYS 29 HD3 LYS 29 9.881 4.378 -13.861
230 HE2 LYS 29 HE2 LYS 29 11.769 3.269 -15.968
231 HE3 LYS 29 HE3 LYS 29 12.097 3.485 -14.239
232 HZ1 LYS 29 HZ1 LYS 29 10.086 1.622 -15.414
233 HZ2 LYS 29 HZ2 LYS 29 11.450 1.187 -14.627
234 HZ3 LYS 29 HZ3 LYS 29 10.211 1.919 -13.830
235 H MET 30 HN MET 30 7.372 6.636 -12.652
236 HA MET 30 HA MET 30 4.838 8.003 -13.236
237 HB2 MET 30 HB2 MET 30 5.631 6.856 -10.525
238 HB3 MET 30 HB3 MET 30 4.511 8.204 -10.706
239 HG2 MET 30 HG2 MET 30 3.102 6.700 -12.200
240 HG3 MET 30 HG3 MET 30 4.163 5.373 -11.728
241 HE1 MET 30 HE1 MET 30 2.545 8.424 -9.626
242 HE2 MET 30 HE2 MET 30 1.311 7.811 -10.750
243 HE3 MET 30 HE3 MET 30 1.122 7.569 -9.000
244 H ILE 31 HN ILE 31 4.958 10.166 -11.902
245 HA ILE 31 HA ILE 31 7.774 11.067 -11.494
246 HB ILE 31 HB ILE 31 5.541 12.644 -12.756
247 HG12 ILE 31 HG12 ILE 31 8.195 12.105 -14.129
248 HG13 ILE 31 HG13 ILE 31 6.983 10.832 -14.158
249 HG21 ILE 31 HG21 ILE 31 6.935 14.144 -11.418
250 HG22 ILE 31 HG22 ILE 31 8.421 13.416 -12.069
251 HG23 ILE 31 HG23 ILE 31 7.365 14.387 -13.104
252 HD11 ILE 31 HD11 ILE 31 6.448 13.668 -15.040
253 HD12 ILE 31 HD12 ILE 31 6.755 12.273 -16.102
254 HD13 ILE 31 HD13 ILE 31 5.308 12.311 -15.064
255 H ALA 32 HN ALA 32 7.942 12.343 -9.556
256 HA ALA 32 HA ALA 32 5.430 13.228 -8.297
257 HB1 ALA 32 HB1 ALA 32 6.123 12.518 -6.075
258 HB2 ALA 32 HB2 ALA 32 6.012 11.095 -7.129
259 HB3 ALA 32 HB3 ALA 32 7.607 11.797 -6.721
260 H GLU 33 HN GLU 33 5.641 15.237 -7.624
261 HA GLU 33 HA GLU 33 8.292 16.570 -7.524
262 HB2 GLU 33 HB2 GLU 33 6.440 17.604 -8.902
263 HB3 GLU 33 HB3 GLU 33 5.395 17.609 -7.474
264 HG2 GLU 33 HG2 GLU 33 7.039 19.149 -6.360
265 HG3 GLU 33 HG3 GLU 33 7.915 19.261 -7.879
266 H VAL 34 HN VAL 34 9.051 17.009 -5.411
267 HA VAL 34 HA VAL 34 7.263 16.420 -3.134
268 HB VAL 34 HB VAL 34 8.754 14.793 -2.218
269 HG11 VAL 34 HG11 VAL 34 8.513 12.918 -3.685
270 HG12 VAL 34 HG12 VAL 34 7.106 13.955 -3.949
271 HG13 VAL 34 HG13 VAL 34 8.433 13.952 -5.122
272 HG21 VAL 34 HG21 VAL 34 10.574 15.231 -4.612
273 HG22 VAL 34 HG22 VAL 34 10.934 15.572 -2.901
274 HG23 VAL 34 HG23 VAL 34 10.729 13.907 -3.433
275 H LYS 35 HN LYS 35 8.305 16.971 -1.059
276 HA LYS 35 HA LYS 35 10.518 18.971 -1.251
277 HB2 LYS 35 HB2 LYS 35 8.092 18.875 0.586
278 HB3 LYS 35 HB3 LYS 35 9.631 19.491 1.203
279 HG2 LYS 35 HG2 LYS 35 9.789 21.020 -0.776
280 HG3 LYS 35 HG3 LYS 35 8.185 20.476 -1.258
281 HD2 LYS 35 HD2 LYS 35 7.225 21.396 0.829
282 HD3 LYS 35 HD3 LYS 35 8.855 21.884 1.360
283 HE2 LYS 35 HE2 LYS 35 9.065 23.322 -0.676
284 HE3 LYS 35 HE3 LYS 35 7.425 22.873 -1.155
285 HZ1 LYS 35 HZ1 LYS 35 8.134 24.337 1.325
286 HZ2 LYS 35 HZ2 LYS 35 7.476 24.998 -0.010
287 HZ3 LYS 35 HZ3 LYS 35 6.614 23.934 0.876
288 H SER 36 HN SER 36 12.051 18.731 0.513
289 HA SER 36 HA SER 36 12.228 15.949 1.554
290 HG SER 36 HG SER 36 13.741 15.956 -1.881
291 HB2 SER 36 HB2 SER 36 14.590 16.937 -0.002
292 HB3 SER 36 HB3 SER 36 13.998 15.291 0.288
293 H ASP 37 HN ASP 37 12.874 16.117 3.624
294 HA ASP 37 HA ASP 37 14.416 18.481 4.512
295 HB2 ASP 37 HB2 ASP 37 12.464 17.632 5.814
296 HB3 ASP 37 HB3 ASP 37 13.333 16.124 6.097
297 H PHE 38 HN PHE 38 15.132 15.632 3.016
298 HA PHE 38 HA PHE 38 17.876 15.444 4.055
299 HD1 PHE 38 HD1 PHE 38 14.286 13.906 5.204
300 HD2 PHE 38 HD2 PHE 38 18.360 13.182 6.423
301 HE1 PHE 38 HE1 PHE 38 13.561 13.826 7.575
302 HE2 PHE 38 HE2 PHE 38 17.632 13.117 8.796
303 HZ PHE 38 HZ PHE 38 15.232 13.430 9.374
304 HB2 PHE 38 HB2 PHE 38 16.040 13.054 3.609
305 HB3 PHE 38 HB3 PHE 38 17.722 12.986 4.089
306 H ALA 39 HN ALA 39 19.240 14.317 2.391
307 HA ALA 39 HA ALA 39 18.584 14.998 -0.306
308 HB1 ALA 39 HB1 ALA 39 20.701 13.094 0.796
309 HB2 ALA 39 HB2 ALA 39 20.641 13.739 -0.856
310 HB3 ALA 39 HB3 ALA 39 20.913 14.840 0.508
311 H VAL 40 HN VAL 40 18.119 13.571 -2.069
312 HA VAL 40 HA VAL 40 17.414 10.778 -1.577
313 HB VAL 40 HB VAL 40 15.324 11.839 -1.050
314 HG11 VAL 40 HG11 VAL 40 14.072 13.312 -2.565
315 HG12 VAL 40 HG12 VAL 40 15.577 14.066 -2.045
316 HG13 VAL 40 HG13 VAL 40 15.453 13.372 -3.678
317 HG21 VAL 40 HG21 VAL 40 15.099 10.831 -3.908
318 HG22 VAL 40 HG22 VAL 40 15.232 9.800 -2.471
319 HG23 VAL 40 HG23 VAL 40 13.828 10.858 -2.667
320 H LYS 41 HN LYS 41 17.771 9.563 -3.476
321 HA LYS 41 HA LYS 41 18.586 10.960 -5.928
322 HB2 LYS 41 HB2 LYS 41 20.874 9.892 -5.840
323 HB3 LYS 41 HB3 LYS 41 20.582 11.282 -4.823
324 HG2 LYS 41 HG2 LYS 41 21.924 9.732 -3.617
325 HG3 LYS 41 HG3 LYS 41 20.353 9.829 -2.826
326 HD2 LYS 41 HD2 LYS 41 19.681 7.720 -3.982
327 HD3 LYS 41 HD3 LYS 41 21.289 7.609 -4.702
328 HE2 LYS 41 HE2 LYS 41 20.646 7.621 -1.714
329 HE3 LYS 41 HE3 LYS 41 20.916 6.169 -2.674
330 HZ1 LYS 41 HZ1 LYS 41 22.917 6.802 -1.507
331 HZ2 LYS 41 HZ2 LYS 41 23.180 6.941 -3.107
332 HZ3 LYS 41 HZ3 LYS 41 22.944 8.278 -2.191
333 H VAL 42 HN VAL 42 19.334 9.396 -7.607
334 HA VAL 42 HA VAL 42 17.446 7.443 -8.083
335 HB VAL 42 HB VAL 42 20.290 7.565 -9.195
336 HG11 VAL 42 HG11 VAL 42 19.112 6.563 -11.243
337 HG12 VAL 42 HG12 VAL 42 19.299 5.472 -9.873
338 HG13 VAL 42 HG13 VAL 42 17.727 6.240 -10.169
339 HG21 VAL 42 HG21 VAL 42 19.335 9.707 -9.562
340 HG22 VAL 42 HG22 VAL 42 19.001 8.843 -11.059
341 HG23 VAL 42 HG23 VAL 42 17.719 9.023 -9.822
342 H GLY 43 HN GLY 43 17.336 5.231 -8.036
343 HA2 GLY 43 HA2 GLY 43 17.694 3.097 -7.344
344 HA3 GLY 43 HA3 GLY 43 19.323 3.520 -6.781
345 H ASP 44 HN ASP 44 16.325 5.297 -5.820
346 HA ASP 44 HA ASP 44 16.970 4.389 -2.985
347 HB2 ASP 44 HB2 ASP 44 15.794 7.012 -3.923
348 HB3 ASP 44 HB3 ASP 44 15.365 6.336 -2.368
349 H LEU 45 HN LEU 45 15.299 3.537 -1.689
350 HA LEU 45 HA LEU 45 12.849 2.758 -3.133
351 HG LEU 45 HG LEU 45 11.182 1.873 -0.956
352 HB2 LEU 45 HB2 LEU 45 14.145 1.286 -1.415
353 HB3 LEU 45 HB3 LEU 45 13.604 2.437 -0.199
354 HD11 LEU 45 HD11 LEU 45 12.618 -0.536 -2.155
355 HD12 LEU 45 HD12 LEU 45 10.860 -0.311 -2.000
356 HD13 LEU 45 HD13 LEU 45 11.790 0.727 -3.087
357 HD21 LEU 45 HD21 LEU 45 11.157 -0.166 0.443
358 HD22 LEU 45 HD22 LEU 45 12.939 -0.198 0.409
359 HD23 LEU 45 HD23 LEU 45 12.064 1.167 1.158
360 H LEU 46 HN LEU 46 10.782 3.575 -2.499
361 HA LEU 46 HA LEU 46 10.685 5.654 -0.380
362 HG LEU 46 HG LEU 46 11.241 6.747 -3.333
363 HB2 LEU 46 HB2 LEU 46 9.087 5.646 -2.964
364 HB3 LEU 46 HB3 LEU 46 8.772 6.685 -1.588
365 HD11 LEU 46 HD11 LEU 46 10.294 8.976 -4.021
366 HD12 LEU 46 HD12 LEU 46 9.228 7.623 -4.431
367 HD13 LEU 46 HD13 LEU 46 8.868 8.652 -3.029
368 HD21 LEU 46 HD21 LEU 46 11.893 7.437 -1.107
369 HD22 LEU 46 HD22 LEU 46 11.775 8.880 -2.119
370 HD23 LEU 46 HD23 LEU 46 10.477 8.488 -0.958
371 H SER 47 HN SER 47 9.461 4.906 1.196
372 HA SER 47 HA SER 47 7.238 2.991 0.591
373 HG SER 47 HG SER 47 9.736 1.052 2.226
374 HB2 SER 47 HB2 SER 47 8.960 3.043 3.095
375 HB3 SER 47 HB3 SER 47 7.673 1.886 2.703
376 HA PRO 48 HA PRO 48 4.989 6.372 2.260
377 HB2 PRO 48 HB2 PRO 48 2.524 5.275 2.820
378 HB3 PRO 48 HB3 PRO 48 3.131 5.568 1.164
379 HG2 PRO 48 HG2 PRO 48 3.202 2.984 2.748
380 HG3 PRO 48 HG3 PRO 48 2.688 3.229 1.047
381 HD2 PRO 48 HD2 PRO 48 5.186 2.344 1.689
382 HD3 PRO 48 HD3 PRO 48 4.922 3.462 0.315
383 H LEU 49 HN LEU 49 4.195 7.322 4.109
384 HA LEU 49 HA LEU 49 4.398 5.833 6.710
385 HG LEU 49 HG LEU 49 6.975 6.723 5.642
386 HB2 LEU 49 HB2 LEU 49 5.320 8.635 5.961
387 HB3 LEU 49 HB3 LEU 49 5.129 8.110 7.629
388 HD11 LEU 49 HD11 LEU 49 7.692 9.036 5.933
389 HD12 LEU 49 HD12 LEU 49 7.618 8.871 7.703
390 HD13 LEU 49 HD13 LEU 49 8.809 7.940 6.764
391 HD21 LEU 49 HD21 LEU 49 8.036 5.851 7.748
392 HD22 LEU 49 HD22 LEU 49 6.736 6.605 8.691
393 HD23 LEU 49 HD23 LEU 49 6.375 5.292 7.546
394 H GLN 50 HN GLN 50 2.987 8.507 4.845
395 HA GLN 50 HA GLN 50 0.363 7.928 5.813
396 HB2 GLN 50 HB2 GLN 50 -0.189 10.248 6.560
397 HB3 GLN 50 HB3 GLN 50 0.843 9.351 7.655
398 HG2 GLN 50 HG2 GLN 50 2.809 10.597 6.954
399 HG3 GLN 50 HG3 GLN 50 1.879 11.431 5.698
400 HE21 GLN 50 HE22 GLN 50 2.093 13.581 6.486
401 HE22 GLN 50 HE21 GLN 50 1.479 14.083 8.036
402 H ASN 51 HN ASN 51 -0.889 10.210 4.675
403 HA ASN 51 HA ASN 51 -1.127 9.330 2.108
404 HB2 ASN 51 HB2 ASN 51 -2.771 10.794 3.148
405 HB3 ASN 51 HB3 ASN 51 -1.637 12.148 3.147
406 HD21 ASN 51 HD22 ASN 51 -1.397 13.393 1.214
407 HD22 ASN 51 HD21 ASN 51 -2.281 13.041 -0.244
408 H ALA 52 HN ALA 52 1.081 12.014 3.068
409 HA ALA 52 HA ALA 52 2.149 12.004 0.335
410 HB1 ALA 52 HB1 ALA 52 2.662 14.374 0.715
411 HB2 ALA 52 HB2 ALA 52 0.933 14.056 0.900
412 HB3 ALA 52 HB3 ALA 52 1.957 14.282 2.341
413 H LEU 53 HN LEU 53 3.056 11.569 3.761
414 HA LEU 53 HA LEU 53 5.853 12.152 3.170
415 HG LEU 53 HG LEU 53 4.561 13.482 5.468
416 HB2 LEU 53 HB2 LEU 53 4.545 10.944 5.612
417 HB3 LEU 53 HB3 LEU 53 6.287 10.979 5.395
418 HD11 LEU 53 HD11 LEU 53 5.509 13.803 7.723
419 HD12 LEU 53 HD12 LEU 53 4.598 12.289 7.646
420 HD13 LEU 53 HD13 LEU 53 6.374 12.255 7.600
421 HD21 LEU 53 HD21 LEU 53 6.654 13.864 4.226
422 HD22 LEU 53 HD22 LEU 53 6.761 14.634 5.803
423 HD23 LEU 53 HD23 LEU 53 7.600 13.098 5.514
424 H TYR 54 HN TYR 54 7.360 10.740 2.564
425 HA TYR 54 HA TYR 54 6.826 7.829 2.744
426 HD1 TYR 54 HD1 TYR 54 5.167 9.866 0.196
427 HD2 TYR 54 HD2 TYR 54 6.934 5.963 -0.213
428 HE1 TYR 54 HE1 TYR 54 3.155 9.085 -1.016
429 HE2 TYR 54 HE2 TYR 54 4.921 5.153 -1.380
430 HH TYR 54 HH TYR 54 2.136 7.282 -2.128
431 HB2 TYR 54 HB2 TYR 54 7.760 9.380 0.304
432 HB3 TYR 54 HB3 TYR 54 8.246 7.725 0.568
433 H CYS 55 HN CYS 55 8.612 6.690 3.248
434 HA CYS 55 HA CYS 55 10.930 7.816 4.528
435 HG CYS 55 HG CYS 55 8.386 5.228 4.372
436 HB2 CYS 55 HB2 CYS 55 10.671 5.063 3.224
437 HB3 CYS 55 HB3 CYS 55 11.682 5.517 4.587
438 H ILE 56 HN ILE 56 13.159 7.688 3.637
439 HA ILE 56 HA ILE 56 13.339 7.422 0.660
440 HB ILE 56 HB ILE 56 15.159 8.893 2.601
441 HG12 ILE 56 HG12 ILE 56 13.498 10.218 0.420
442 HG13 ILE 56 HG13 ILE 56 12.852 9.990 2.045
443 HG21 ILE 56 HG21 ILE 56 16.270 9.780 0.496
444 HG22 ILE 56 HG22 ILE 56 16.516 8.068 0.722
445 HG23 ILE 56 HG23 ILE 56 15.301 8.631 -0.438
446 HD11 ILE 56 HD11 ILE 56 15.366 11.563 1.394
447 HD12 ILE 56 HD12 ILE 56 13.816 12.197 1.930
448 HD13 ILE 56 HD13 ILE 56 14.759 11.188 3.022
449 H ASN 57 HN ASN 57 14.923 6.133 -0.109
450 HA ASN 57 HA ASN 57 16.647 4.782 -0.368
451 HB2 ASN 57 HB2 ASN 57 17.873 6.281 1.226
452 HB3 ASN 57 HB3 ASN 57 17.414 5.205 2.553
453 HD21 ASN 57 HD22 ASN 57 18.910 5.225 -0.687
454 HD22 ASN 57 HD21 ASN 57 20.075 3.934 -0.366
455 H ARG 58 HN ARG 58 15.271 4.116 2.791
456 HA ARG 58 HA ARG 58 13.799 1.935 2.542
457 HE ARG 58 HE ARG 58 17.278 1.137 0.509
458 HB2 ARG 58 HB2 ARG 58 15.098 -0.087 3.052
459 HB3 ARG 58 HB3 ARG 58 15.493 0.567 1.503
460 HG2 ARG 58 HG2 ARG 58 17.454 1.794 2.992
461 HG3 ARG 58 HG3 ARG 58 17.139 0.408 4.025
462 HD2 ARG 58 HD2 ARG 58 18.964 -0.093 2.516
463 HD3 ARG 58 HD3 ARG 58 17.574 -1.105 2.069
464 HH11 ARG 58 HH21 ARG 58 19.945 -1.178 0.891
465 HH12 ARG 58 HH22 ARG 58 20.584 -0.915 -0.690
466 HH21 ARG 58 HH11 ARG 58 18.098 1.480 -1.571
467 HH22 ARG 58 HH12 ARG 58 19.493 0.638 -2.135
468 H GLU 59 HN GLU 59 14.713 4.341 4.351
469 HA GLU 59 HA GLU 59 14.255 2.894 6.883
470 HB2 GLU 59 HB2 GLU 59 15.945 4.100 8.050
471 HB3 GLU 59 HB3 GLU 59 16.676 3.178 6.733
472 HG2 GLU 59 HG2 GLU 59 16.750 5.318 5.370
473 HG3 GLU 59 HG3 GLU 59 16.194 6.192 6.804
474 H LYS 60 HN LYS 60 13.063 3.987 8.353
475 HA LYS 60 HA LYS 60 11.185 5.756 7.164
476 HB2 LYS 60 HB2 LYS 60 11.516 4.953 10.084
477 HB3 LYS 60 HB3 LYS 60 10.104 5.768 9.401
478 HG2 LYS 60 HG2 LYS 60 9.778 3.827 7.836
479 HG3 LYS 60 HG3 LYS 60 11.076 2.968 8.670
480 HD2 LYS 60 HD2 LYS 60 8.483 3.951 9.944
481 HD3 LYS 60 HD3 LYS 60 8.816 2.293 9.422
482 HE2 LYS 60 HE2 LYS 60 10.720 2.171 11.029
483 HE3 LYS 60 HE3 LYS 60 10.348 3.809 11.584
484 HZ1 LYS 60 HZ1 LYS 60 8.531 1.480 11.817
485 HZ2 LYS 60 HZ2 LYS 60 9.381 2.147 13.034
486 HZ3 LYS 60 HZ3 LYS 60 8.185 2.995 12.326
487 H LEU 61 HN LEU 61 14.028 6.463 9.073
488 HA LEU 61 HA LEU 61 13.090 8.846 10.271
489 HG LEU 61 HG LEU 61 15.140 6.279 10.847
490 HB2 LEU 61 HB2 LEU 61 15.978 8.163 9.540
491 HB3 LEU 61 HB3 LEU 61 15.446 9.310 10.764
492 HD11 LEU 61 HD11 LEU 61 16.720 6.427 12.714
493 HD12 LEU 61 HD12 LEU 61 17.408 7.127 11.237
494 HD13 LEU 61 HD13 LEU 61 16.807 8.196 12.524
495 HD21 LEU 61 HD21 LEU 61 13.189 7.244 11.922
496 HD22 LEU 61 HD22 LEU 61 14.280 6.617 13.161
497 HD23 LEU 61 HD23 LEU 61 14.204 8.370 12.856
498 H HIS 62 HN HIS 62 14.726 8.243 7.208
499 HA HIS 62 HA HIS 62 15.026 11.121 6.625
500 HD1 HIS 62 HD1 HIS 62 18.478 8.372 4.731
501 HD2 HIS 62 HD2 HIS 62 16.936 10.435 8.061
502 HE1 HIS 62 HE1 HIS 62 20.344 8.449 6.457
503 HB2 HIS 62 HB2 HIS 62 15.685 8.653 4.965
504 HB3 HIS 62 HB3 HIS 62 16.128 10.315 4.581
505 H THR 63 HN THR 63 13.241 12.202 5.705
506 HA THR 63 HA THR 63 11.294 10.582 4.180
507 HB THR 63 HB THR 63 9.655 12.131 5.306
508 HG1 THR 63 HG1 THR 63 10.391 13.283 7.082
509 HG21 THR 63 HG21 THR 63 10.214 9.792 6.103
510 HG22 THR 63 HG22 THR 63 11.344 10.517 7.267
511 HG23 THR 63 HG23 THR 63 9.607 10.876 7.369
512 H VAL 64 HN VAL 64 10.056 11.534 2.635
513 HA VAL 64 HA VAL 64 10.690 14.269 1.673
514 HB VAL 64 HB VAL 64 9.720 13.277 -0.537
515 HG11 VAL 64 HG11 VAL 64 11.926 12.782 -1.424
516 HG12 VAL 64 HG12 VAL 64 11.924 14.202 -0.373
517 HG13 VAL 64 HG13 VAL 64 12.580 12.662 0.221
518 HG21 VAL 64 HG21 VAL 64 9.182 11.036 0.342
519 HG22 VAL 64 HG22 VAL 64 10.220 10.998 -1.090
520 HG23 VAL 64 HG23 VAL 64 10.917 10.690 0.514
521 H LYS 65 HN LYS 65 8.703 15.302 0.784
522 HA LYS 65 HA LYS 65 6.163 13.986 1.687
523 HB2 LYS 65 HB2 LYS 65 6.760 15.997 3.112
524 HB3 LYS 65 HB3 LYS 65 6.733 16.974 1.635
525 HG2 LYS 65 HG2 LYS 65 4.341 16.067 1.275
526 HG3 LYS 65 HG3 LYS 65 4.419 15.450 2.921
527 HD2 LYS 65 HD2 LYS 65 4.618 17.693 3.805
528 HD3 LYS 65 HD3 LYS 65 4.864 18.388 2.195
529 HE2 LYS 65 HE2 LYS 65 2.329 16.906 3.034
530 HE3 LYS 65 HE3 LYS 65 2.523 18.653 3.172
531 HZ1 LYS 65 HZ1 LYS 65 2.703 17.188 0.580
532 HZ2 LYS 65 HZ2 LYS 65 1.391 18.001 1.124
533 HZ3 LYS 65 HZ3 LYS 65 2.759 18.813 0.802
534 H VAL 66 HN VAL 66 4.819 13.639 -0.010
535 HA VAL 66 HA VAL 66 5.475 14.518 -2.689
536 HB VAL 66 HB VAL 66 3.005 13.186 -1.487
537 HG11 VAL 66 HG11 VAL 66 2.311 14.317 -3.563
538 HG12 VAL 66 HG12 VAL 66 3.714 13.648 -4.431
539 HG13 VAL 66 HG13 VAL 66 2.420 12.580 -3.846
540 HG21 VAL 66 HG21 VAL 66 5.297 12.070 -3.182
541 HG22 VAL 66 HG22 VAL 66 5.079 11.795 -1.445
542 HG23 VAL 66 HG23 VAL 66 3.897 11.157 -2.586
543 H LEU 67 HN LEU 67 4.683 16.201 -3.855
544 HA LEU 67 HA LEU 67 2.802 18.108 -2.513
545 HG LEU 67 HG LEU 67 6.161 18.237 -3.071
546 HB2 LEU 67 HB2 LEU 67 4.614 18.721 -4.865
547 HB3 LEU 67 HB3 LEU 67 3.713 19.849 -3.862
548 HD11 LEU 67 HD11 LEU 67 7.403 20.198 -3.211
549 HD12 LEU 67 HD12 LEU 67 6.363 20.271 -4.623
550 HD13 LEU 67 HD13 LEU 67 5.957 21.247 -3.204
551 HD21 LEU 67 HD21 LEU 67 6.197 19.471 -0.952
552 HD22 LEU 67 HD22 LEU 67 4.644 20.243 -1.357
553 HD23 LEU 67 HD23 LEU 67 4.751 18.489 -1.076
554 H SER 68 HN SER 68 3.754 16.516 -5.597
555 HA SER 68 HA SER 68 0.962 16.048 -6.338
556 HG SER 68 HG SER 68 1.377 19.202 -8.099
557 HB2 SER 68 HB2 SER 68 2.920 17.509 -8.184
558 HB3 SER 68 HB3 SER 68 1.288 16.971 -8.606
559 H ALA 69 HN ALA 69 0.910 14.214 -7.879
560 HA ALA 69 HA ALA 69 3.399 13.268 -8.992
561 HB1 ALA 69 HB1 ALA 69 3.251 10.983 -8.041
562 HB2 ALA 69 HB2 ALA 69 3.524 12.185 -6.769
563 HB3 ALA 69 HB3 ALA 69 1.899 11.493 -7.004
564 H SER 70 HN SER 70 3.063 11.699 -10.628
565 HA SER 70 HA SER 70 0.306 11.243 -11.624
566 HG SER 70 HG SER 70 0.910 14.599 -12.901
567 HB2 SER 70 HB2 SER 70 2.392 12.855 -13.171
568 HB3 SER 70 HB3 SER 70 0.745 12.473 -13.692
569 H SER 71 HN SER 71 0.391 9.976 -13.733
570 HA SER 71 HA SER 71 2.352 7.898 -13.841
571 HG SER 71 HG SER 71 -0.907 7.385 -15.298
572 HB2 SER 71 HB2 SER 71 0.570 8.969 -16.068
573 HB3 SER 71 HB3 SER 71 1.298 7.354 -15.960
574 H TYR 72 HN TYR 72 4.099 7.648 -15.479
575 HA TYR 72 HA TYR 72 5.556 10.118 -15.786
576 HD1 TYR 72 HD1 TYR 72 8.455 9.991 -15.741
577 HD2 TYR 72 HD2 TYR 72 6.890 7.754 -19.084
578 HE1 TYR 72 HE1 TYR 72 10.191 10.970 -17.204
579 HE2 TYR 72 HE2 TYR 72 8.632 8.715 -20.549
580 HH TYR 72 HH TYR 72 10.478 10.132 -20.687
581 HB2 TYR 72 HB2 TYR 72 6.806 8.111 -15.430
582 HB3 TYR 72 HB3 TYR 72 6.074 7.327 -16.837
583 H SER 73 HN SER 73 5.799 11.424 -17.491
584 HA SER 73 HA SER 73 5.211 10.584 -20.186
585 HG SER 73 HG SER 73 2.182 12.307 -18.857
586 HB2 SER 73 HB2 SER 73 4.035 13.145 -19.051
587 HB3 SER 73 HB3 SER 73 3.850 12.568 -20.709
588 HA PRO 74 HA PRO 74 9.062 12.759 -20.285
589 HB2 PRO 74 HB2 PRO 74 9.102 13.752 -22.913
590 HB3 PRO 74 HB3 PRO 74 9.579 12.098 -22.401
591 HG2 PRO 74 HG2 PRO 74 6.976 13.060 -23.583
592 HG3 PRO 74 HG3 PRO 74 7.843 11.526 -23.895
593 HD2 PRO 74 HD2 PRO 74 5.680 11.667 -22.243
594 HD3 PRO 74 HD3 PRO 74 7.048 10.567 -21.894
595 H ASP 75 HN ASP 75 6.454 14.605 -21.944
596 HA ASP 75 HA ASP 75 7.528 17.177 -21.476
597 HB2 ASP 75 HB2 ASP 75 5.692 16.834 -23.052
598 HB3 ASP 75 HB3 ASP 75 4.623 16.294 -21.754
599 H GLU 76 HN GLU 76 5.182 15.285 -19.508
600 HA GLU 76 HA GLU 76 4.823 17.317 -17.565
601 HB2 GLU 76 HB2 GLU 76 4.425 14.314 -17.277
602 HB3 GLU 76 HB3 GLU 76 3.860 15.538 -16.140
603 HG2 GLU 76 HG2 GLU 76 2.490 16.593 -17.926
604 HG3 GLU 76 HG3 GLU 76 2.997 15.341 -19.059
605 H TRP 77 HN TRP 77 7.274 14.752 -17.846
606 HA TRP 77 HA TRP 77 8.407 15.033 -15.229
607 HD1 TRP 77 HD1 TRP 77 10.837 14.259 -14.344
608 HE1 TRP 77 HE1 TRP 77 13.375 14.006 -14.492
609 HE3 TRP 77 HE3 TRP 77 11.263 13.457 -19.378
610 HZ2 TRP 77 HZ2 TRP 77 15.367 13.605 -16.562
611 HZ3 TRP 77 HZ3 TRP 77 13.493 13.160 -20.417
612 HH2 TRP 77 HH2 TRP 77 15.551 13.238 -19.022
613 HB2 TRP 77 HB2 TRP 77 8.935 13.090 -16.482
614 HB3 TRP 77 HB3 TRP 77 9.353 14.003 -17.910
615 H GLU 78 HN GLU 78 9.359 16.503 -18.426
616 HA GLU 78 HA GLU 78 11.404 18.066 -17.156
617 HB2 GLU 78 HB2 GLU 78 10.094 18.296 -19.895
618 HB3 GLU 78 HB3 GLU 78 11.484 19.260 -19.362
619 HG2 GLU 78 HG2 GLU 78 12.732 17.129 -18.878
620 HG3 GLU 78 HG3 GLU 78 11.399 16.216 -19.570
621 H ARG 79 HN ARG 79 8.020 18.757 -17.957
622 HA ARG 79 HA ARG 79 7.881 21.499 -17.298
623 HE ARG 79 HE ARG 79 3.855 19.548 -19.080
624 HB2 ARG 79 HB2 ARG 79 6.139 20.189 -18.373
625 HB3 ARG 79 HB3 ARG 79 5.993 19.148 -16.956
626 HG2 ARG 79 HG2 ARG 79 5.104 21.102 -15.657
627 HG3 ARG 79 HG3 ARG 79 5.125 22.054 -17.159
628 HD2 ARG 79 HD2 ARG 79 3.664 19.395 -16.746
629 HD3 ARG 79 HD3 ARG 79 2.888 20.975 -16.660
630 HH11 ARG 79 HH21 ARG 79 2.448 22.584 -17.843
631 HH12 ARG 79 HH22 ARG 79 1.954 23.117 -19.407
632 HH21 ARG 79 HH11 ARG 79 3.266 20.208 -21.018
633 HH22 ARG 79 HH12 ARG 79 2.420 21.717 -21.314
634 H GLN 80 HN GLN 80 7.464 18.589 -15.138
635 HA GLN 80 HA GLN 80 7.262 20.184 -12.785
636 HB2 GLN 80 HB2 GLN 80 7.871 17.248 -13.249
637 HB3 GLN 80 HB3 GLN 80 7.831 17.963 -11.625
638 HG2 GLN 80 HG2 GLN 80 5.555 18.654 -11.840
639 HG3 GLN 80 HG3 GLN 80 5.523 18.312 -13.567
640 HE21 GLN 80 HE22 GLN 80 5.400 16.169 -14.314
641 HE22 GLN 80 HE21 GLN 80 4.742 14.900 -13.280
642 H CYS 81 HN CYS 81 10.140 18.897 -14.519
643 HA CYS 81 HA CYS 81 12.013 19.571 -12.473
644 HG CYS 81 HG CYS 81 11.386 17.250 -14.625
645 HB2 CYS 81 HB2 CYS 81 12.390 19.532 -15.492
646 HB3 CYS 81 HB3 CYS 81 13.686 19.622 -14.293
647 H LYS 82 HN LYS 82 10.464 21.666 -14.976
648 HA LYS 82 HA LYS 82 12.144 23.934 -14.418
649 HB2 LYS 82 HB2 LYS 82 9.310 23.792 -15.542
650 HB3 LYS 82 HB3 LYS 82 10.263 25.268 -15.387
651 HG2 LYS 82 HG2 LYS 82 11.995 24.361 -16.884
652 HG3 LYS 82 HG3 LYS 82 11.101 22.841 -17.035
653 HD2 LYS 82 HD2 LYS 82 9.184 24.058 -18.039
654 HD3 LYS 82 HD3 LYS 82 10.094 25.583 -17.910
655 HE2 LYS 82 HE2 LYS 82 11.880 24.626 -19.356
656 HE3 LYS 82 HE3 LYS 82 10.970 23.117 -19.488
657 HZ1 LYS 82 HZ1 LYS 82 10.048 25.756 -20.477
658 HZ2 LYS 82 HZ2 LYS 82 10.608 24.540 -21.401
659 HZ3 LYS 82 HZ3 LYS 82 9.203 24.361 -20.600
660 H VAL 83 HN VAL 83 8.983 22.759 -13.152
661 HA VAL 83 HA VAL 83 8.692 24.908 -11.372
662 HB VAL 83 HB VAL 83 7.529 22.098 -11.191
663 HG11 VAL 83 HG11 VAL 83 5.726 23.177 -9.833
664 HG12 VAL 83 HG12 VAL 83 7.287 23.196 -9.018
665 HG13 VAL 83 HG13 VAL 83 6.679 24.678 -9.790
666 HG21 VAL 83 HG21 VAL 83 6.381 24.686 -12.346
667 HG22 VAL 83 HG22 VAL 83 6.903 23.283 -13.292
668 HG23 VAL 83 HG23 VAL 83 5.521 23.138 -12.211
669 H ALA 84 HN ALA 84 10.516 21.857 -11.021
670 HA ALA 84 HA ALA 84 11.207 21.986 -8.322
671 HB1 ALA 84 HB1 ALA 84 13.285 21.314 -10.438
672 HB2 ALA 84 HB2 ALA 84 13.027 20.573 -8.867
673 HB3 ALA 84 HB3 ALA 84 11.886 20.267 -10.194
674 H GLY 85 HN GLY 85 12.750 23.596 -11.117
675 HA2 GLY 85 HA2 GLY 85 14.552 25.193 -9.477
676 HA3 GLY 85 HA3 GLY 85 14.349 25.250 -11.235
677 H LYS 86 HN LYS 86 11.350 25.498 -9.483
678 HA LYS 86 HA LYS 86 9.804 27.091 -9.430
679 HB2 LYS 86 HB2 LYS 86 11.492 27.677 -7.549
680 HB3 LYS 86 HB3 LYS 86 11.939 29.058 -8.558
681 HG2 LYS 86 HG2 LYS 86 9.518 29.788 -8.497
682 HG3 LYS 86 HG3 LYS 86 9.164 28.400 -7.454
683 HD2 LYS 86 HD2 LYS 86 10.802 29.269 -5.781
684 HD3 LYS 86 HD3 LYS 86 11.095 30.681 -6.797
685 HE2 LYS 86 HE2 LYS 86 8.391 29.891 -5.608
686 HE3 LYS 86 HE3 LYS 86 9.498 31.063 -4.892
687 HZ1 LYS 86 HZ1 LYS 86 7.805 32.167 -6.178
688 HZ2 LYS 86 HZ2 LYS 86 9.249 32.434 -6.877
689 HZ3 LYS 86 HZ3 LYS 86 8.200 31.364 -7.537
690 H THR 87 HN THR 87 10.925 26.669 -11.980
691 HA THR 87 HA THR 87 11.140 27.445 -14.041
692 HB THR 87 HB THR 87 9.038 29.505 -13.328
693 HG1 THR 87 HG1 THR 87 7.555 27.891 -13.253
694 HG21 THR 87 HG21 THR 87 9.378 27.622 -15.720
695 HG22 THR 87 HG22 THR 87 8.061 28.795 -15.494
696 HG23 THR 87 HG23 THR 87 9.715 29.364 -15.729
697 H GLN 88 HN GLN 88 13.119 28.441 -12.318
698 HA GLN 88 HA GLN 88 13.731 31.202 -12.735
699 HB2 GLN 88 HB2 GLN 88 14.783 29.793 -11.008
700 HB3 GLN 88 HB3 GLN 88 15.535 28.787 -12.257
701 HG2 GLN 88 HG2 GLN 88 16.887 30.715 -13.001
702 HG3 GLN 88 HG3 GLN 88 16.054 31.757 -11.843
703 HE21 GLN 88 HE22 GLN 88 18.262 32.238 -11.004
704 HE22 GLN 88 HE21 GLN 88 19.004 31.122 -9.885
Start of MODEL 17
1 HA MET 1 HA MET 1 3.851 -1.888 -2.179
2 H1 MET 1 H1 MET 1 2.200 -2.203 -0.507
3 H2 MET 1 H2 MET 1 3.645 -1.787 0.176
4 H3 MET 1 H3 MET 1 2.438 -0.682 0.084
5 HB2 MET 1 HB2 MET 1 1.535 -1.220 -2.771
6 HB3 MET 1 HB3 MET 1 1.862 0.422 -2.198
7 HG2 MET 1 HG2 MET 1 2.058 0.308 -4.624
8 HG3 MET 1 HG3 MET 1 3.623 0.684 -3.913
9 HE1 MET 1 HE1 MET 1 3.291 -0.106 -6.932
10 HE2 MET 1 HE2 MET 1 4.838 0.265 -6.142
11 HE3 MET 1 HE3 MET 1 4.673 -1.207 -7.122
12 H GLU 2 HN GLU 2 5.710 -0.921 -2.801
13 HA GLU 2 HA GLU 2 6.599 1.568 -1.475
14 HB2 GLU 2 HB2 GLU 2 8.298 -0.947 -1.816
15 HB3 GLU 2 HB3 GLU 2 8.794 0.602 -1.143
16 HG2 GLU 2 HG2 GLU 2 8.470 -0.659 0.767
17 HG3 GLU 2 HG3 GLU 2 6.959 0.237 0.649
18 H TRP 3 HN TRP 3 8.383 2.548 -2.815
19 HA TRP 3 HA TRP 3 8.018 1.911 -5.698
20 HD1 TRP 3 HD1 TRP 3 5.906 3.997 -2.669
21 HE1 TRP 3 HE1 TRP 3 3.403 3.542 -2.904
22 HE3 TRP 3 HE3 TRP 3 5.682 3.368 -7.744
23 HZ2 TRP 3 HZ2 TRP 3 1.529 2.943 -5.038
24 HZ3 TRP 3 HZ3 TRP 3 3.531 2.834 -8.851
25 HH2 TRP 3 HH2 TRP 3 1.448 2.619 -7.509
26 HB2 TRP 3 HB2 TRP 3 7.807 4.651 -4.403
27 HB3 TRP 3 HB3 TRP 3 7.556 4.273 -6.088
28 H LEU 4 HN LEU 4 9.588 3.214 -7.014
29 HA LEU 4 HA LEU 4 12.260 3.338 -5.680
30 HG LEU 4 HG LEU 4 13.759 3.071 -8.471
31 HB2 LEU 4 HB2 LEU 4 11.892 1.243 -6.902
32 HB3 LEU 4 HB3 LEU 4 11.426 2.162 -8.342
33 HD11 LEU 4 HD11 LEU 4 14.276 1.068 -6.222
34 HD12 LEU 4 HD12 LEU 4 15.536 1.846 -7.200
35 HD13 LEU 4 HD13 LEU 4 14.509 2.826 -6.156
36 HD21 LEU 4 HD21 LEU 4 14.726 0.975 -9.337
37 HD22 LEU 4 HD22 LEU 4 13.513 0.028 -8.454
38 HD23 LEU 4 HD23 LEU 4 13.014 1.100 -9.781
39 H VAL 5 HN VAL 5 13.287 5.088 -6.063
40 HA VAL 5 HA VAL 5 12.432 7.215 -7.938
41 HB VAL 5 HB VAL 5 14.844 6.978 -6.108
42 HG11 VAL 5 HG11 VAL 5 13.614 9.409 -7.426
43 HG12 VAL 5 HG12 VAL 5 14.985 9.422 -6.295
44 HG13 VAL 5 HG13 VAL 5 15.158 8.657 -7.875
45 HG21 VAL 5 HG21 VAL 5 12.935 6.920 -4.658
46 HG22 VAL 5 HG22 VAL 5 13.532 8.572 -4.607
47 HG23 VAL 5 HG23 VAL 5 12.101 8.168 -5.591
48 H LYS 6 HN LYS 6 12.819 6.630 -9.986
49 HA LYS 6 HA LYS 6 15.358 5.272 -10.768
50 HB2 LYS 6 HB2 LYS 6 12.780 5.815 -12.246
51 HB3 LYS 6 HB3 LYS 6 14.221 5.268 -13.076
52 HG2 LYS 6 HG2 LYS 6 13.219 3.665 -10.719
53 HG3 LYS 6 HG3 LYS 6 12.406 3.554 -12.273
54 HD2 LYS 6 HD2 LYS 6 13.977 1.747 -12.075
55 HD3 LYS 6 HD3 LYS 6 14.425 2.821 -13.398
56 HE2 LYS 6 HE2 LYS 6 16.192 3.841 -12.002
57 HE3 LYS 6 HE3 LYS 6 15.718 2.821 -10.633
58 HZ1 LYS 6 HZ1 LYS 6 16.363 0.881 -11.966
59 HZ2 LYS 6 HZ2 LYS 6 16.796 1.838 -13.219
60 HZ3 LYS 6 HZ3 LYS 6 17.619 1.907 -11.818
61 H LYS 7 HN LYS 7 13.950 8.426 -10.610
62 HA LYS 7 HA LYS 7 16.356 9.590 -11.780
63 HB2 LYS 7 HB2 LYS 7 13.636 10.681 -12.593
64 HB3 LYS 7 HB3 LYS 7 15.220 11.233 -13.099
65 HG2 LYS 7 HG2 LYS 7 14.001 8.571 -13.931
66 HG3 LYS 7 HG3 LYS 7 13.901 10.082 -14.840
67 HD2 LYS 7 HD2 LYS 7 16.291 10.175 -15.157
68 HD3 LYS 7 HD3 LYS 7 16.520 8.756 -14.127
69 HE2 LYS 7 HE2 LYS 7 16.681 7.973 -16.365
70 HE3 LYS 7 HE3 LYS 7 15.144 7.396 -15.718
71 HZ1 LYS 7 HZ1 LYS 7 14.045 9.198 -16.943
72 HZ2 LYS 7 HZ2 LYS 7 15.486 9.725 -17.527
73 HZ3 LYS 7 HZ3 LYS 7 14.914 8.266 -17.960
74 H SER 8 HN SER 8 16.733 11.623 -10.588
75 HA SER 8 HA SER 8 14.542 12.837 -9.063
76 HG SER 8 HG SER 8 17.892 11.704 -8.077
77 HB2 SER 8 HB2 SER 8 16.254 12.976 -7.083
78 HB3 SER 8 HB3 SER 8 15.184 11.587 -7.253
79 H CYS 9 HN CYS 9 14.860 15.062 -9.059
80 HA CYS 9 HA CYS 9 17.386 16.070 -10.316
81 HG CYS 9 HG CYS 9 14.752 16.385 -13.236
82 HB2 CYS 9 HB2 CYS 9 14.486 16.876 -10.744
83 HB3 CYS 9 HB3 CYS 9 15.870 17.855 -11.269
84 H CYS 10 HN CYS 10 18.523 16.962 -8.761
85 HA CYS 10 HA CYS 10 17.651 17.767 -6.252
86 HG CYS 10 HG CYS 10 21.548 16.875 -6.638
87 HB2 CYS 10 HB2 CYS 10 20.097 18.737 -7.784
88 HB3 CYS 10 HB3 CYS 10 19.867 18.789 -6.029
89 H ASN 11 HN ASN 11 17.139 19.740 -5.294
90 HA ASN 11 HA ASN 11 17.422 22.255 -6.767
91 HB2 ASN 11 HB2 ASN 11 15.278 22.884 -6.977
92 HB3 ASN 11 HB3 ASN 11 14.947 21.163 -7.061
93 HD21 ASN 11 HD21 ASN 11 14.335 20.094 -4.935
94 HD22 ASN 11 HD22 ASN 11 13.445 21.029 -3.785
95 H LYS 12 HN LYS 12 17.537 24.005 -5.375
96 HA LYS 12 HA LYS 12 16.882 23.624 -2.548
97 HB2 LYS 12 HB2 LYS 12 18.982 24.742 -1.778
98 HB3 LYS 12 HB3 LYS 12 19.120 23.094 -2.341
99 HG2 LYS 12 HG2 LYS 12 21.022 24.386 -3.107
100 HG3 LYS 12 HG3 LYS 12 20.074 23.791 -4.460
101 HD2 LYS 12 HD2 LYS 12 20.707 26.045 -4.979
102 HD3 LYS 12 HD3 LYS 12 18.979 25.993 -4.659
103 HE2 LYS 12 HE2 LYS 12 19.867 27.988 -3.635
104 HE3 LYS 12 HE3 LYS 12 19.387 26.881 -2.349
105 HZ1 LYS 12 HZ1 LYS 12 21.544 27.885 -1.926
106 HZ2 LYS 12 HZ2 LYS 12 21.735 26.278 -2.096
107 HZ3 LYS 12 HZ3 LYS 12 22.166 27.292 -3.307
108 H GLN 13 HN GLN 13 16.094 25.210 -5.206
109 HA GLN 13 HA GLN 13 16.207 27.952 -4.123
110 HB2 GLN 13 HB2 GLN 13 15.063 26.774 -6.691
111 HB3 GLN 13 HB3 GLN 13 14.991 28.482 -6.243
112 HG2 GLN 13 HG2 GLN 13 17.442 28.638 -6.204
113 HG3 GLN 13 HG3 GLN 13 17.585 26.921 -6.597
114 HE21 GLN 13 HE22 GLN 13 17.291 26.237 -8.760
115 HE22 GLN 13 HE21 GLN 13 16.802 27.306 -10.057
116 H ASP 14 HN ASP 14 13.940 25.198 -4.382
117 HA ASP 14 HA ASP 14 11.873 26.907 -3.042
118 HB2 ASP 14 HB2 ASP 14 11.677 26.835 -5.576
119 HB3 ASP 14 HB3 ASP 14 11.344 25.110 -5.428
120 H ASN 15 HN ASN 15 13.529 24.007 -2.956
121 HA ASN 15 HA ASN 15 13.575 22.323 -1.518
122 HB2 ASN 15 HB2 ASN 15 12.309 24.013 0.053
123 HB3 ASN 15 HB3 ASN 15 10.925 22.970 -0.257
124 HD21 ASN 15 HD22 ASN 15 12.492 20.368 -0.276
125 HD22 ASN 15 HD21 ASN 15 12.967 20.156 1.401
126 H ARG 16 HN ARG 16 10.944 22.965 -3.587
127 HA ARG 16 HA ARG 16 9.687 20.330 -3.517
128 HE ARG 16 HE ARG 16 5.824 21.970 -5.675
129 HB2 ARG 16 HB2 ARG 16 9.430 22.743 -5.357
130 HB3 ARG 16 HB3 ARG 16 8.543 21.221 -5.583
131 HG2 ARG 16 HG2 ARG 16 7.468 21.421 -3.440
132 HG3 ARG 16 HG3 ARG 16 8.435 22.810 -2.980
133 HD2 ARG 16 HD2 ARG 16 6.053 23.290 -3.640
134 HD3 ARG 16 HD3 ARG 16 7.280 24.268 -4.405
135 HH11 ARG 16 HH11 ARG 16 7.563 25.080 -6.124
136 HH12 ARG 16 HH12 ARG 16 6.914 25.328 -7.708
137 HH21 ARG 16 HH21 ARG 16 5.352 22.136 -7.869
138 HH22 ARG 16 HH22 ARG 16 5.605 23.630 -8.716
139 H HIS 17 HN HIS 17 11.114 18.789 -3.965
140 HA HIS 17 HA HIS 17 12.857 18.734 -6.339
141 HD1 HIS 17 HD1 HIS 17 13.695 18.403 -2.339
142 HD2 HIS 17 HD2 HIS 17 15.476 17.011 -5.876
143 HE1 HIS 17 HE1 HIS 17 16.149 19.004 -2.178
144 HB2 HIS 17 HB2 HIS 17 12.156 16.836 -4.042
145 HB3 HIS 17 HB3 HIS 17 13.013 16.270 -5.471
146 H VAL 18 HN VAL 18 12.547 16.882 -7.845
147 HA VAL 18 HA VAL 18 9.867 15.739 -7.916
148 HB VAL 18 HB VAL 18 11.022 16.648 -10.541
149 HG11 VAL 18 HG11 VAL 18 8.101 16.385 -9.697
150 HG12 VAL 18 HG12 VAL 18 8.779 16.408 -11.341
151 HG13 VAL 18 HG13 VAL 18 9.042 15.018 -10.302
152 HG21 VAL 18 HG21 VAL 18 9.250 18.442 -8.841
153 HG22 VAL 18 HG22 VAL 18 10.905 18.779 -9.403
154 HG23 VAL 18 HG23 VAL 18 9.591 18.671 -10.563
155 H LEU 19 HN LEU 19 9.904 13.696 -8.716
156 HA LEU 19 HA LEU 19 12.475 12.558 -9.618
157 HG LEU 19 HG LEU 19 10.284 12.284 -6.404
158 HB2 LEU 19 HB2 LEU 19 11.485 10.612 -7.892
159 HB3 LEU 19 HB3 LEU 19 12.936 11.554 -7.719
160 HD11 LEU 19 HD11 LEU 19 12.744 10.885 -5.306
161 HD12 LEU 19 HD12 LEU 19 11.310 11.391 -4.375
162 HD13 LEU 19 HD13 LEU 19 11.151 10.167 -5.638
163 HD21 LEU 19 HD21 LEU 19 11.450 14.302 -6.250
164 HD22 LEU 19 HD22 LEU 19 12.201 13.490 -4.895
165 HD23 LEU 19 HD23 LEU 19 13.043 13.537 -6.461
166 H MET 20 HN MET 20 12.108 10.210 -10.264
167 HA MET 20 HA MET 20 9.411 9.957 -11.495
168 HB2 MET 20 HB2 MET 20 12.086 9.019 -12.506
169 HB3 MET 20 HB3 MET 20 10.616 8.083 -12.836
170 HG2 MET 20 HG2 MET 20 9.474 10.037 -13.706
171 HG3 MET 20 HG3 MET 20 10.871 11.059 -13.375
172 HE1 MET 20 HE1 MET 20 9.563 7.988 -15.435
173 HE2 MET 20 HE2 MET 20 10.810 7.786 -16.685
174 HE3 MET 20 HE3 MET 20 11.176 7.361 -14.999
175 H LEU 21 HN LEU 21 8.263 8.895 -10.248
176 HA LEU 21 HA LEU 21 9.361 7.148 -8.116
177 HG LEU 21 HG LEU 21 7.768 6.851 -6.259
178 HB2 LEU 21 HB2 LEU 21 7.992 9.118 -7.545
179 HB3 LEU 21 HB3 LEU 21 6.656 8.525 -8.536
180 HD11 LEU 21 HD11 LEU 21 7.268 9.139 -5.371
181 HD12 LEU 21 HD12 LEU 21 5.624 9.020 -6.024
182 HD13 LEU 21 HD13 LEU 21 6.156 7.916 -4.734
183 HD21 LEU 21 HD21 LEU 21 5.330 6.123 -6.191
184 HD22 LEU 21 HD22 LEU 21 5.032 7.126 -7.624
185 HD23 LEU 21 HD23 LEU 21 6.127 5.740 -7.722
186 H CYS 22 HN CYS 22 9.258 5.019 -8.585
187 HA CYS 22 HA CYS 22 7.482 4.090 -10.799
188 HG CYS 22 HG CYS 22 10.498 5.835 -10.580
189 HB2 CYS 22 HB2 CYS 22 10.375 3.339 -10.182
190 HB3 CYS 22 HB3 CYS 22 9.444 2.878 -11.607
191 H ASP 23 HN ASP 23 7.375 1.687 -10.879
192 HA ASP 23 HA ASP 23 6.590 0.362 -8.453
193 HB2 ASP 23 HB2 ASP 23 5.856 -0.692 -10.405
194 HB3 ASP 23 HB3 ASP 23 7.372 -0.410 -11.255
195 H ALA 24 HN ALA 24 7.796 -1.052 -7.073
196 HA ALA 24 HA ALA 24 10.596 -0.516 -6.688
197 HB1 ALA 24 HB1 ALA 24 9.163 -1.000 -4.795
198 HB2 ALA 24 HB2 ALA 24 8.752 -2.600 -5.459
199 HB3 ALA 24 HB3 ALA 24 10.411 -2.246 -4.928
200 H GLY 25 HN GLY 25 11.209 -0.980 -8.914
201 HA2 GLY 25 HA2 GLY 25 12.698 -3.189 -9.563
202 HA3 GLY 25 HA3 GLY 25 11.031 -3.664 -9.972
203 H GLY 26 HN GLY 26 10.456 -0.706 -10.505
204 HA2 GLY 26 HA2 GLY 26 10.849 0.950 -12.072
205 HA3 GLY 26 HA3 GLY 26 12.032 -0.069 -12.902
206 H ALA 27 HN ALA 27 9.119 -1.855 -12.323
207 HA ALA 27 HA ALA 27 8.779 -2.133 -15.148
208 HB1 ALA 27 HB1 ALA 27 8.393 -3.940 -13.483
209 HB2 ALA 27 HB2 ALA 27 6.961 -3.064 -12.884
210 HB3 ALA 27 HB3 ALA 27 6.992 -3.692 -14.542
211 H ILE 28 HN ILE 28 7.522 0.308 -13.111
212 HA ILE 28 HA ILE 28 5.520 1.169 -15.081
213 HB ILE 28 HB ILE 28 4.987 0.955 -12.074
214 HG12 ILE 28 HG12 ILE 28 3.726 -0.635 -14.354
215 HG13 ILE 28 HG13 ILE 28 4.795 -1.269 -13.099
216 HG21 ILE 28 HG21 ILE 28 2.739 1.837 -12.584
217 HG22 ILE 28 HG22 ILE 28 3.956 2.968 -13.112
218 HG23 ILE 28 HG23 ILE 28 3.147 1.929 -14.311
219 HD11 ILE 28 HD11 ILE 28 2.595 -1.905 -12.508
220 HD12 ILE 28 HD12 ILE 28 3.088 -0.633 -11.371
221 HD13 ILE 28 HD13 ILE 28 1.966 -0.266 -12.709
222 H LYS 29 HN LYS 29 5.491 3.499 -15.060
223 HA LYS 29 HA LYS 29 7.586 4.814 -13.375
224 HB2 LYS 29 HB2 LYS 29 6.989 5.226 -16.341
225 HB3 LYS 29 HB3 LYS 29 8.086 6.208 -15.385
226 HG2 LYS 29 HG2 LYS 29 8.472 3.281 -16.121
227 HG3 LYS 29 HG3 LYS 29 9.283 4.681 -16.836
228 HD2 LYS 29 HD2 LYS 29 10.170 5.205 -14.494
229 HD3 LYS 29 HD3 LYS 29 9.618 3.583 -14.029
230 HE2 LYS 29 HE2 LYS 29 11.733 4.344 -16.085
231 HE3 LYS 29 HE3 LYS 29 12.000 3.568 -14.527
232 HZ1 LYS 29 HZ1 LYS 29 10.628 2.361 -16.873
233 HZ2 LYS 29 HZ2 LYS 29 12.081 1.938 -16.284
234 HZ3 LYS 29 HZ3 LYS 29 10.730 1.623 -15.417
235 H MET 30 HN MET 30 6.894 6.689 -12.436
236 HA MET 30 HA MET 30 4.672 8.240 -13.606
237 HB2 MET 30 HB2 MET 30 4.934 7.525 -10.643
238 HB3 MET 30 HB3 MET 30 3.849 8.715 -11.307
239 HG2 MET 30 HG2 MET 30 2.715 6.936 -12.639
240 HG3 MET 30 HG3 MET 30 3.797 5.743 -11.917
241 HE1 MET 30 HE1 MET 30 1.979 8.851 -10.066
242 HE2 MET 30 HE2 MET 30 0.863 8.267 -11.326
243 HE3 MET 30 HE3 MET 30 0.476 8.030 -9.608
244 H ILE 31 HN ILE 31 4.778 10.485 -12.536
245 HA ILE 31 HA ILE 31 7.577 11.284 -11.858
246 HB ILE 31 HB ILE 31 5.405 12.882 -13.211
247 HG12 ILE 31 HG12 ILE 31 8.165 12.462 -14.421
248 HG13 ILE 31 HG13 ILE 31 7.014 11.136 -14.528
249 HG21 ILE 31 HG21 ILE 31 7.273 14.645 -13.376
250 HG22 ILE 31 HG22 ILE 31 6.584 14.402 -11.772
251 HG23 ILE 31 HG23 ILE 31 8.153 13.677 -12.177
252 HD11 ILE 31 HD11 ILE 31 5.314 12.629 -15.496
253 HD12 ILE 31 HD12 ILE 31 6.477 13.973 -15.451
254 HD13 ILE 31 HD13 ILE 31 6.790 12.553 -16.474
255 H ALA 32 HN ALA 32 7.659 12.342 -9.804
256 HA ALA 32 HA ALA 32 5.084 13.024 -8.500
257 HB1 ALA 32 HB1 ALA 32 7.312 11.385 -7.215
258 HB2 ALA 32 HB2 ALA 32 5.849 11.987 -6.406
259 HB3 ALA 32 HB3 ALA 32 5.705 10.769 -7.692
260 H GLU 33 HN GLU 33 5.205 14.914 -7.479
261 HA GLU 33 HA GLU 33 7.807 16.344 -7.304
262 HB2 GLU 33 HB2 GLU 33 5.813 17.463 -8.441
263 HB3 GLU 33 HB3 GLU 33 4.932 17.337 -6.907
264 HG2 GLU 33 HG2 GLU 33 6.797 18.696 -5.837
265 HG3 GLU 33 HG3 GLU 33 7.457 18.946 -7.450
266 H VAL 34 HN VAL 34 8.611 16.763 -5.212
267 HA VAL 34 HA VAL 34 6.927 16.074 -2.899
268 HB VAL 34 HB VAL 34 8.403 14.474 -2.001
269 HG11 VAL 34 HG11 VAL 34 6.948 13.526 -3.845
270 HG12 VAL 34 HG12 VAL 34 8.336 13.648 -4.935
271 HG13 VAL 34 HG13 VAL 34 8.414 12.598 -3.510
272 HG21 VAL 34 HG21 VAL 34 10.593 15.368 -2.527
273 HG22 VAL 34 HG22 VAL 34 10.515 13.713 -3.133
274 HG23 VAL 34 HG23 VAL 34 10.345 15.077 -4.261
275 H LYS 35 HN LYS 35 7.695 16.985 -0.968
276 HA LYS 35 HA LYS 35 9.887 18.982 -1.212
277 HB2 LYS 35 HB2 LYS 35 7.379 19.035 0.196
278 HB3 LYS 35 HB3 LYS 35 8.624 18.821 1.434
279 HG2 LYS 35 HG2 LYS 35 9.848 20.751 0.609
280 HG3 LYS 35 HG3 LYS 35 8.737 20.932 -0.759
281 HD2 LYS 35 HD2 LYS 35 6.853 21.327 0.849
282 HD3 LYS 35 HD3 LYS 35 8.009 21.233 2.196
283 HE2 LYS 35 HE2 LYS 35 9.251 23.170 1.262
284 HE3 LYS 35 HE3 LYS 35 8.122 23.244 -0.102
285 HZ1 LYS 35 HZ1 LYS 35 7.396 23.681 2.742
286 HZ2 LYS 35 HZ2 LYS 35 7.552 24.844 1.615
287 HZ3 LYS 35 HZ3 LYS 35 6.353 23.752 1.486
288 H SER 36 HN SER 36 11.423 18.834 0.813
289 HA SER 36 HA SER 36 11.958 15.978 1.460
290 HG SER 36 HG SER 36 14.452 18.500 0.093
291 HB2 SER 36 HB2 SER 36 14.263 16.380 0.460
292 HB3 SER 36 HB3 SER 36 12.933 16.286 -0.704
293 H ASP 37 HN ASP 37 13.305 15.628 3.187
294 HA ASP 37 HA ASP 37 14.473 18.033 4.531
295 HB2 ASP 37 HB2 ASP 37 12.740 16.770 5.832
296 HB3 ASP 37 HB3 ASP 37 13.798 15.356 5.786
297 H PHE 38 HN PHE 38 15.121 15.101 2.835
298 HA PHE 38 HA PHE 38 18.006 15.650 2.944
299 HD1 PHE 38 HD2 PHE 38 15.646 13.541 5.312
300 HD2 PHE 38 HD1 PHE 38 19.929 13.676 4.823
301 HE1 PHE 38 HE2 PHE 38 15.918 13.596 7.762
302 HE2 PHE 38 HE1 PHE 38 20.202 13.716 7.289
303 HZ PHE 38 HZ PHE 38 18.201 13.677 8.770
304 HB2 PHE 38 HB2 PHE 38 16.802 12.856 3.154
305 HB3 PHE 38 HB3 PHE 38 18.499 13.224 2.930
306 H ALA 39 HN ALA 39 19.008 14.988 0.927
307 HA ALA 39 HA ALA 39 17.332 15.373 -1.358
308 HB1 ALA 39 HB1 ALA 39 19.450 15.222 -2.602
309 HB2 ALA 39 HB2 ALA 39 19.654 16.233 -1.166
310 HB3 ALA 39 HB3 ALA 39 20.266 14.561 -1.171
311 H VAL 40 HN VAL 40 17.805 13.910 -3.353
312 HA VAL 40 HA VAL 40 17.889 11.023 -2.774
313 HB VAL 40 HB VAL 40 16.191 11.021 -4.868
314 HG11 VAL 40 HG11 VAL 40 14.423 10.432 -3.276
315 HG12 VAL 40 HG12 VAL 40 16.003 9.729 -2.866
316 HG13 VAL 40 HG13 VAL 40 15.386 11.134 -1.951
317 HG21 VAL 40 HG21 VAL 40 15.832 13.505 -4.851
318 HG22 VAL 40 HG22 VAL 40 14.363 12.543 -4.644
319 HG23 VAL 40 HG23 VAL 40 15.085 13.345 -3.242
320 H LYS 41 HN LYS 41 18.535 9.792 -4.631
321 HA LYS 41 HA LYS 41 19.980 11.260 -6.738
322 HB2 LYS 41 HB2 LYS 41 22.242 10.396 -5.976
323 HB3 LYS 41 HB3 LYS 41 21.544 11.716 -5.077
324 HG2 LYS 41 HG2 LYS 41 22.634 10.147 -3.590
325 HG3 LYS 41 HG3 LYS 41 20.913 10.267 -3.236
326 HD2 LYS 41 HD2 LYS 41 20.529 8.111 -4.444
327 HD3 LYS 41 HD3 LYS 41 22.252 8.033 -4.823
328 HE2 LYS 41 HE2 LYS 41 21.816 6.591 -2.940
329 HE3 LYS 41 HE3 LYS 41 22.777 7.968 -2.387
330 HZ1 LYS 41 HZ1 LYS 41 19.837 7.657 -2.059
331 HZ2 LYS 41 HZ2 LYS 41 20.961 7.475 -0.876
332 HZ3 LYS 41 HZ3 LYS 41 20.711 8.950 -1.531
333 H VAL 42 HN VAL 42 17.956 9.332 -6.806
334 HA VAL 42 HA VAL 42 17.280 7.607 -8.000
335 HB VAL 42 HB VAL 42 19.989 7.811 -9.385
336 HG11 VAL 42 HG11 VAL 42 17.395 6.472 -10.205
337 HG12 VAL 42 HG12 VAL 42 18.683 6.909 -11.357
338 HG13 VAL 42 HG13 VAL 42 19.012 5.740 -10.085
339 HG21 VAL 42 HG21 VAL 42 18.609 9.179 -11.022
340 HG22 VAL 42 HG22 VAL 42 17.310 9.165 -9.794
341 HG23 VAL 42 HG23 VAL 42 18.865 9.952 -9.460
342 H GLY 43 HN GLY 43 17.211 5.383 -8.287
343 HA2 GLY 43 HA2 GLY 43 17.387 3.234 -7.589
344 HA3 GLY 43 HA3 GLY 43 19.072 3.519 -7.096
345 H ASP 44 HN ASP 44 16.197 5.431 -6.033
346 HA ASP 44 HA ASP 44 17.007 4.679 -3.213
347 HB2 ASP 44 HB2 ASP 44 15.760 7.266 -4.203
348 HB3 ASP 44 HB3 ASP 44 15.686 6.698 -2.533
349 H LEU 45 HN LEU 45 15.407 3.890 -1.819
350 HA LEU 45 HA LEU 45 12.909 3.001 -3.116
351 HG LEU 45 HG LEU 45 11.360 2.046 -0.890
352 HB2 LEU 45 HB2 LEU 45 14.331 1.617 -1.443
353 HB3 LEU 45 HB3 LEU 45 13.761 2.746 -0.212
354 HD11 LEU 45 HD11 LEU 45 11.947 0.942 -3.049
355 HD12 LEU 45 HD12 LEU 45 12.891 -0.268 -2.159
356 HD13 LEU 45 HD13 LEU 45 11.131 -0.158 -1.934
357 HD21 LEU 45 HD21 LEU 45 11.504 0.011 0.505
358 HD22 LEU 45 HD22 LEU 45 13.281 0.069 0.392
359 HD23 LEU 45 HD23 LEU 45 12.377 1.387 1.188
360 H LEU 46 HN LEU 46 10.846 3.687 -2.389
361 HA LEU 46 HA LEU 46 10.683 5.832 -0.345
362 HG LEU 46 HG LEU 46 11.132 6.786 -3.320
363 HB2 LEU 46 HB2 LEU 46 9.030 5.641 -2.892
364 HB3 LEU 46 HB3 LEU 46 8.689 6.721 -1.547
365 HD11 LEU 46 HD11 LEU 46 10.127 8.966 -4.122
366 HD12 LEU 46 HD12 LEU 46 9.137 7.548 -4.493
367 HD13 LEU 46 HD13 LEU 46 8.694 8.617 -3.143
368 HD21 LEU 46 HD21 LEU 46 11.785 7.635 -1.152
369 HD22 LEU 46 HD22 LEU 46 11.560 9.032 -2.207
370 HD23 LEU 46 HD23 LEU 46 10.307 8.591 -1.012
371 H SER 47 HN SER 47 9.606 5.015 1.294
372 HA SER 47 HA SER 47 7.414 3.036 0.815
373 HG SER 47 HG SER 47 10.066 1.107 2.180
374 HB2 SER 47 HB2 SER 47 9.351 3.064 3.158
375 HB3 SER 47 HB3 SER 47 8.044 1.899 2.867
376 HA PRO 48 HA PRO 48 5.251 6.328 2.856
377 HB2 PRO 48 HB2 PRO 48 2.849 5.131 3.483
378 HB3 PRO 48 HB3 PRO 48 3.324 5.596 1.825
379 HG2 PRO 48 HG2 PRO 48 3.538 2.873 3.133
380 HG3 PRO 48 HG3 PRO 48 2.902 3.274 1.505
381 HD2 PRO 48 HD2 PRO 48 5.449 2.372 1.891
382 HD3 PRO 48 HD3 PRO 48 5.073 3.593 0.639
383 H LEU 49 HN LEU 49 4.607 7.060 4.874
384 HA LEU 49 HA LEU 49 5.084 5.282 7.255
385 HG LEU 49 HG LEU 49 7.474 6.490 6.074
386 HB2 LEU 49 HB2 LEU 49 5.725 8.225 6.766
387 HB3 LEU 49 HB3 LEU 49 5.744 7.499 8.368
388 HD11 LEU 49 HD11 LEU 49 8.039 8.820 6.565
389 HD12 LEU 49 HD12 LEU 49 8.167 8.454 8.298
390 HD13 LEU 49 HD13 LEU 49 9.319 7.739 7.143
391 HD21 LEU 49 HD21 LEU 49 7.097 4.848 7.899
392 HD22 LEU 49 HD22 LEU 49 8.754 5.420 7.907
393 HD23 LEU 49 HD23 LEU 49 7.605 6.054 9.102
394 H GLN 50 HN GLN 50 3.322 7.955 5.811
395 HA GLN 50 HA GLN 50 0.815 7.390 7.073
396 HB2 GLN 50 HB2 GLN 50 0.608 9.722 8.047
397 HB3 GLN 50 HB3 GLN 50 1.677 8.667 8.954
398 HG2 GLN 50 HG2 GLN 50 3.624 9.799 8.298
399 HG3 GLN 50 HG3 GLN 50 2.884 10.453 6.841
400 HE21 GLN 50 HE22 GLN 50 1.860 12.424 6.875
401 HE22 GLN 50 HE21 GLN 50 1.733 13.425 8.315
402 H ASN 51 HN ASN 51 -0.464 9.787 6.265
403 HA ASN 51 HA ASN 51 -0.156 9.806 3.395
404 HB2 ASN 51 HB2 ASN 51 -2.250 10.553 4.219
405 HB3 ASN 51 HB3 ASN 51 -1.487 11.760 5.286
406 HD21 ASN 51 HD22 ASN 51 -1.717 10.902 1.742
407 HD22 ASN 51 HD21 ASN 51 -1.607 12.556 1.210
408 H ALA 52 HN ALA 52 0.738 11.274 2.165
409 HA ALA 52 HA ALA 52 2.351 12.339 1.189
410 HB1 ALA 52 HB1 ALA 52 1.207 14.250 2.140
411 HB2 ALA 52 HB2 ALA 52 2.230 14.172 3.592
412 HB3 ALA 52 HB3 ALA 52 2.947 14.559 2.009
413 H LEU 53 HN LEU 53 3.430 11.589 4.560
414 HA LEU 53 HA LEU 53 6.193 12.007 3.769
415 HG LEU 53 HG LEU 53 4.933 13.273 6.179
416 HB2 LEU 53 HB2 LEU 53 5.063 10.752 6.278
417 HB3 LEU 53 HB3 LEU 53 6.782 10.865 5.936
418 HD11 LEU 53 HD11 LEU 53 7.017 12.160 8.112
419 HD12 LEU 53 HD12 LEU 53 6.068 13.647 8.335
420 HD13 LEU 53 HD13 LEU 53 5.257 12.075 8.326
421 HD21 LEU 53 HD21 LEU 53 6.872 13.798 4.736
422 HD22 LEU 53 HD22 LEU 53 7.071 14.569 6.306
423 HD23 LEU 53 HD23 LEU 53 7.979 13.094 5.931
424 H TYR 54 HN TYR 54 7.547 10.652 2.876
425 HA TYR 54 HA TYR 54 7.135 7.729 3.154
426 HD1 TYR 54 HD2 TYR 54 5.250 9.846 1.021
427 HD2 TYR 54 HD1 TYR 54 6.787 5.984 -0.096
428 HE1 TYR 54 HE2 TYR 54 3.040 9.249 0.099
429 HE2 TYR 54 HE1 TYR 54 4.590 5.376 -1.040
430 HH TYR 54 HH TYR 54 2.390 6.064 -1.436
431 HB2 TYR 54 HB2 TYR 54 7.869 9.238 0.612
432 HB3 TYR 54 HB3 TYR 54 8.241 7.548 0.859
433 H CYS 55 HN CYS 55 9.006 6.651 3.495
434 HA CYS 55 HA CYS 55 11.376 7.880 4.539
435 HG CYS 55 HG CYS 55 8.970 5.141 4.549
436 HB2 CYS 55 HB2 CYS 55 11.187 5.117 3.256
437 HB3 CYS 55 HB3 CYS 55 12.252 5.641 4.555
438 H ILE 56 HN ILE 56 13.554 7.787 3.503
439 HA ILE 56 HA ILE 56 13.538 7.537 0.519
440 HB ILE 56 HB ILE 56 15.465 9.058 2.313
441 HG12 ILE 56 HG12 ILE 56 13.597 10.372 0.302
442 HG13 ILE 56 HG13 ILE 56 13.093 10.111 1.972
443 HG21 ILE 56 HG21 ILE 56 15.334 8.795 -0.725
444 HG22 ILE 56 HG22 ILE 56 16.340 9.993 0.103
445 HG23 ILE 56 HG23 ILE 56 16.675 8.298 0.323
446 HD11 ILE 56 HD11 ILE 56 15.542 11.717 1.147
447 HD12 ILE 56 HD12 ILE 56 14.029 12.343 1.794
448 HD13 ILE 56 HD13 ILE 56 15.044 11.332 2.810
449 H ASN 57 HN ASN 57 15.106 6.289 -0.353
450 HA ASN 57 HA ASN 57 16.869 4.999 -0.726
451 HB2 ASN 57 HB2 ASN 57 18.148 6.599 0.721
452 HB3 ASN 57 HB3 ASN 57 17.867 5.533 2.104
453 HD21 ASN 57 HD22 ASN 57 19.034 5.546 -1.270
454 HD22 ASN 57 HD21 ASN 57 20.262 4.290 -1.060
455 H ARG 58 HN ARG 58 16.091 4.351 2.666
456 HA ARG 58 HA ARG 58 14.849 1.849 2.326
457 HE ARG 58 HE ARG 58 19.271 -0.812 4.479
458 HB2 ARG 58 HB2 ARG 58 16.538 0.295 3.135
459 HB3 ARG 58 HB3 ARG 58 17.154 1.086 1.701
460 HG2 ARG 58 HG2 ARG 58 18.376 2.717 3.318
461 HG3 ARG 58 HG3 ARG 58 17.962 1.580 4.597
462 HD2 ARG 58 HD2 ARG 58 19.602 0.966 2.102
463 HD3 ARG 58 HD3 ARG 58 20.231 1.214 3.722
464 HH11 ARG 58 HH11 ARG 58 19.011 -0.449 0.951
465 HH12 ARG 58 HH12 ARG 58 18.730 -2.125 0.662
466 HH21 ARG 58 HH21 ARG 58 18.899 -3.036 4.089
467 HH22 ARG 58 HH22 ARG 58 18.673 -3.624 2.486
468 H GLU 59 HN GLU 59 15.389 4.612 4.135
469 HA GLU 59 HA GLU 59 14.878 3.245 6.705
470 HB2 GLU 59 HB2 GLU 59 16.637 4.423 7.810
471 HB3 GLU 59 HB3 GLU 59 17.298 3.462 6.486
472 HG2 GLU 59 HG2 GLU 59 17.160 5.716 5.112
473 HG3 GLU 59 HG3 GLU 59 17.055 6.477 6.699
474 H LYS 60 HN LYS 60 13.731 4.351 8.131
475 HA LYS 60 HA LYS 60 11.965 6.262 6.952
476 HB2 LYS 60 HB2 LYS 60 10.646 6.043 8.980
477 HB3 LYS 60 HB3 LYS 60 11.129 4.466 8.353
478 HG2 LYS 60 HG2 LYS 60 12.904 4.334 10.107
479 HG3 LYS 60 HG3 LYS 60 12.404 5.924 10.717
480 HD2 LYS 60 HD2 LYS 60 10.128 5.017 11.197
481 HD3 LYS 60 HD3 LYS 60 10.624 3.452 10.551
482 HE2 LYS 60 HE2 LYS 60 10.728 3.281 12.925
483 HE3 LYS 60 HE3 LYS 60 12.385 3.283 12.319
484 HZ1 LYS 60 HZ1 LYS 60 12.548 5.618 12.984
485 HZ2 LYS 60 HZ2 LYS 60 10.996 5.620 13.511
486 HZ3 LYS 60 HZ3 LYS 60 12.113 4.705 14.257
487 H LEU 61 HN LEU 61 14.765 6.802 8.905
488 HA LEU 61 HA LEU 61 13.808 9.214 10.103
489 HG LEU 61 HG LEU 61 17.009 8.168 8.671
490 HB2 LEU 61 HB2 LEU 61 16.105 9.670 10.703
491 HB3 LEU 61 HB3 LEU 61 15.527 8.114 11.276
492 HD11 LEU 61 HD11 LEU 61 18.386 9.663 10.074
493 HD12 LEU 61 HD12 LEU 61 18.407 8.451 11.373
494 HD13 LEU 61 HD13 LEU 61 19.208 8.119 9.819
495 HD21 LEU 61 HD21 LEU 61 16.174 6.003 9.617
496 HD22 LEU 61 HD22 LEU 61 17.935 6.034 9.532
497 HD23 LEU 61 HD23 LEU 61 17.122 6.290 11.083
498 H HIS 62 HN HIS 62 14.984 8.458 6.983
499 HA HIS 62 HA HIS 62 15.473 11.322 6.318
500 HD1 HIS 62 HD1 HIS 62 18.748 8.316 4.417
501 HD2 HIS 62 HD2 HIS 62 17.544 10.808 7.587
502 HE1 HIS 62 HE1 HIS 62 20.740 8.495 5.984
503 HB2 HIS 62 HB2 HIS 62 16.043 8.792 4.716
504 HB3 HIS 62 HB3 HIS 62 16.472 10.437 4.257
505 H THR 63 HN THR 63 13.602 12.349 5.504
506 HA THR 63 HA THR 63 11.611 10.645 4.126
507 HB THR 63 HB THR 63 9.973 12.155 5.319
508 HG1 THR 63 HG1 THR 63 11.319 13.850 5.949
509 HG21 THR 63 HG21 THR 63 10.099 10.960 7.422
510 HG22 THR 63 HG22 THR 63 10.595 9.853 6.127
511 HG23 THR 63 HG23 THR 63 11.824 10.611 7.168
512 H VAL 64 HN VAL 64 10.224 11.535 2.662
513 HA VAL 64 HA VAL 64 10.657 14.299 1.700
514 HB VAL 64 HB VAL 64 9.715 13.322 -0.485
515 HG11 VAL 64 HG11 VAL 64 11.942 12.835 -1.392
516 HG12 VAL 64 HG12 VAL 64 11.943 14.249 -0.327
517 HG13 VAL 64 HG13 VAL 64 12.579 12.697 0.253
518 HG21 VAL 64 HG21 VAL 64 10.216 11.059 -1.092
519 HG22 VAL 64 HG22 VAL 64 10.913 10.715 0.505
520 HG23 VAL 64 HG23 VAL 64 9.177 11.064 0.339
521 H LYS 65 HN LYS 65 8.651 15.225 0.869
522 HA LYS 65 HA LYS 65 6.194 14.105 2.192
523 HB2 LYS 65 HB2 LYS 65 7.213 16.145 3.284
524 HB3 LYS 65 HB3 LYS 65 7.100 16.985 1.752
525 HG2 LYS 65 HG2 LYS 65 5.259 17.809 2.798
526 HG3 LYS 65 HG3 LYS 65 4.518 16.474 1.914
527 HD2 LYS 65 HD2 LYS 65 4.572 15.086 3.984
528 HD3 LYS 65 HD3 LYS 65 5.428 16.390 4.834
529 HE2 LYS 65 HE2 LYS 65 3.503 17.930 4.351
530 HE3 LYS 65 HE3 LYS 65 2.617 16.573 3.653
531 HZ1 LYS 65 HZ1 LYS 65 2.000 16.957 5.953
532 HZ2 LYS 65 HZ2 LYS 65 2.715 15.496 5.851
533 HZ3 LYS 65 HZ3 LYS 65 3.528 16.776 6.472
534 H VAL 66 HN VAL 66 5.106 13.180 0.379
535 HA VAL 66 HA VAL 66 5.603 14.163 -2.289
536 HB VAL 66 HB VAL 66 3.442 12.278 -1.249
537 HG11 VAL 66 HG11 VAL 66 2.847 13.126 -3.486
538 HG12 VAL 66 HG12 VAL 66 4.476 12.758 -4.091
539 HG13 VAL 66 HG13 VAL 66 3.377 11.448 -3.606
540 HG21 VAL 66 HG21 VAL 66 5.722 11.409 -0.782
541 HG22 VAL 66 HG22 VAL 66 4.934 10.470 -2.048
542 HG23 VAL 66 HG23 VAL 66 6.174 11.662 -2.478
543 H LEU 67 HN LEU 67 4.373 15.504 -3.567
544 HA LEU 67 HA LEU 67 2.295 17.124 -2.138
545 HG LEU 67 HG LEU 67 5.440 17.610 -2.091
546 HB2 LEU 67 HB2 LEU 67 4.297 17.966 -4.267
547 HB3 LEU 67 HB3 LEU 67 3.121 19.012 -3.477
548 HD11 LEU 67 HD11 LEU 67 6.473 19.811 -1.960
549 HD12 LEU 67 HD12 LEU 67 6.187 19.326 -3.641
550 HD13 LEU 67 HD13 LEU 67 5.115 20.515 -2.874
551 HD21 LEU 67 HD21 LEU 67 4.940 19.102 -0.173
552 HD22 LEU 67 HD22 LEU 67 3.485 19.688 -1.013
553 HD23 LEU 67 HD23 LEU 67 3.611 17.990 -0.495
554 H SER 68 HN SER 68 3.263 15.637 -5.258
555 HA SER 68 HA SER 68 0.535 15.171 -6.012
556 HG SER 68 HG SER 68 0.478 17.634 -5.756
557 HB2 SER 68 HB2 SER 68 2.189 17.232 -7.563
558 HB3 SER 68 HB3 SER 68 0.775 16.405 -8.236
559 H ALA 69 HN ALA 69 0.545 13.734 -7.961
560 HA ALA 69 HA ALA 69 3.073 13.174 -9.224
561 HB1 ALA 69 HB1 ALA 69 3.059 10.739 -8.779
562 HB2 ALA 69 HB2 ALA 69 3.238 11.648 -7.271
563 HB3 ALA 69 HB3 ALA 69 1.662 10.930 -7.695
564 H SER 70 HN SER 70 2.803 11.919 -11.144
565 HA SER 70 HA SER 70 0.062 11.451 -12.171
566 HG SER 70 HG SER 70 1.120 14.485 -11.913
567 HB2 SER 70 HB2 SER 70 2.059 13.314 -13.545
568 HB3 SER 70 HB3 SER 70 0.459 12.858 -14.140
569 H SER 71 HN SER 71 0.150 10.238 -14.267
570 HA SER 71 HA SER 71 2.104 8.232 -14.474
571 HG SER 71 HG SER 71 -1.130 7.871 -16.027
572 HB2 SER 71 HB2 SER 71 0.426 9.416 -16.722
573 HB3 SER 71 HB3 SER 71 1.089 7.774 -16.625
574 H TYR 72 HN TYR 72 3.963 7.988 -15.828
575 HA TYR 72 HA TYR 72 5.522 10.363 -16.098
576 HD1 TYR 72 HD1 TYR 72 8.204 10.427 -16.380
577 HD2 TYR 72 HD2 TYR 72 6.987 7.269 -19.060
578 HE1 TYR 72 HE1 TYR 72 9.980 11.089 -17.958
579 HE2 TYR 72 HE2 TYR 72 8.788 7.902 -20.627
580 HH TYR 72 HH TYR 72 10.573 9.346 -21.044
581 HB2 TYR 72 HB2 TYR 72 6.684 8.348 -15.670
582 HB3 TYR 72 HB3 TYR 72 5.886 7.500 -16.996
583 H SER 73 HN SER 73 6.088 11.598 -17.850
584 HA SER 73 HA SER 73 5.712 10.733 -20.546
585 HG SER 73 HG SER 73 3.403 10.729 -19.772
586 HB2 SER 73 HB2 SER 73 4.154 13.100 -19.422
587 HB3 SER 73 HB3 SER 73 4.475 12.900 -21.159
588 HA PRO 74 HA PRO 74 9.571 12.751 -20.201
589 HB2 PRO 74 HB2 PRO 74 10.077 13.568 -22.844
590 HB3 PRO 74 HB3 PRO 74 10.356 11.932 -22.172
591 HG2 PRO 74 HG2 PRO 74 8.024 12.957 -23.785
592 HG3 PRO 74 HG3 PRO 74 8.831 11.362 -23.880
593 HD2 PRO 74 HD2 PRO 74 6.464 11.704 -22.586
594 HD3 PRO 74 HD3 PRO 74 7.707 10.579 -21.959
595 H ASP 75 HN ASP 75 7.398 14.644 -22.347
596 HA ASP 75 HA ASP 75 8.614 17.154 -21.922
597 HB2 ASP 75 HB2 ASP 75 7.073 16.670 -23.764
598 HB3 ASP 75 HB3 ASP 75 5.743 16.429 -22.628
599 H GLU 76 HN GLU 76 5.874 15.614 -20.200
600 HA GLU 76 HA GLU 76 5.375 17.690 -18.354
601 HB2 GLU 76 HB2 GLU 76 4.026 15.509 -19.041
602 HB3 GLU 76 HB3 GLU 76 4.969 14.743 -17.768
603 HG2 GLU 76 HG2 GLU 76 3.061 15.357 -16.625
604 HG3 GLU 76 HG3 GLU 76 4.093 16.744 -16.280
605 H TRP 77 HN TRP 77 7.708 14.981 -18.296
606 HA TRP 77 HA TRP 77 8.487 15.282 -15.545
607 HD1 TRP 77 HD1 TRP 77 11.996 13.059 -18.004
608 HE1 TRP 77 HE1 TRP 77 13.949 12.773 -16.372
609 HE3 TRP 77 HE3 TRP 77 9.641 14.492 -13.710
610 HZ2 TRP 77 HZ2 TRP 77 14.439 13.224 -13.554
611 HZ3 TRP 77 HZ3 TRP 77 10.838 14.428 -11.549
612 HH2 TRP 77 HH2 TRP 77 13.248 13.837 -11.456
613 HB2 TRP 77 HB2 TRP 77 8.910 13.210 -16.692
614 HB3 TRP 77 HB3 TRP 77 9.733 14.013 -18.000
615 H GLU 78 HN GLU 78 9.968 16.442 -18.650
616 HA GLU 78 HA GLU 78 12.036 17.900 -17.341
617 HB2 GLU 78 HB2 GLU 78 10.793 18.172 -20.110
618 HB3 GLU 78 HB3 GLU 78 12.184 19.123 -19.564
619 HG2 GLU 78 HG2 GLU 78 13.435 17.021 -19.090
620 HG3 GLU 78 HG3 GLU 78 12.092 16.078 -19.727
621 H ARG 79 HN ARG 79 8.765 18.887 -18.357
622 HA ARG 79 HA ARG 79 8.851 21.619 -17.689
623 HE ARG 79 HE ARG 79 4.727 22.606 -19.292
624 HB2 ARG 79 HB2 ARG 79 7.033 20.625 -18.846
625 HB3 ARG 79 HB3 ARG 79 6.737 19.454 -17.565
626 HG2 ARG 79 HG2 ARG 79 5.872 21.185 -16.073
627 HG3 ARG 79 HG3 ARG 79 6.223 22.443 -17.274
628 HD2 ARG 79 HD2 ARG 79 4.429 20.035 -17.770
629 HD3 ARG 79 HD3 ARG 79 3.809 21.607 -17.226
630 HH11 ARG 79 HH21 ARG 79 3.794 19.140 -19.403
631 HH12 ARG 79 HH22 ARG 79 4.325 18.999 -21.083
632 HH21 ARG 79 HH11 ARG 79 5.188 22.307 -21.578
633 HH22 ARG 79 HH12 ARG 79 5.018 20.696 -22.245
634 H GLN 80 HN GLN 80 7.982 18.831 -15.516
635 HA GLN 80 HA GLN 80 7.678 20.529 -13.253
636 HB2 GLN 80 HB2 GLN 80 8.133 17.534 -13.511
637 HB3 GLN 80 HB3 GLN 80 7.834 18.358 -11.964
638 HG2 GLN 80 HG2 GLN 80 5.682 19.134 -12.639
639 HG3 GLN 80 HG3 GLN 80 5.934 18.632 -14.309
640 HE21 GLN 80 HE22 GLN 80 5.680 16.499 -14.915
641 HE22 GLN 80 HE21 GLN 80 4.883 15.322 -13.873
642 H CYS 81 HN CYS 81 10.563 18.790 -14.529
643 HA CYS 81 HA CYS 81 12.301 19.435 -12.363
644 HG CYS 81 HG CYS 81 11.602 17.073 -14.554
645 HB2 CYS 81 HB2 CYS 81 12.955 19.166 -15.335
646 HB3 CYS 81 HB3 CYS 81 14.124 19.161 -14.007
647 H LYS 82 HN LYS 82 11.337 21.386 -15.250
648 HA LYS 82 HA LYS 82 13.195 23.486 -14.697
649 HB2 LYS 82 HB2 LYS 82 10.777 23.173 -16.507
650 HB3 LYS 82 HB3 LYS 82 11.563 24.735 -16.303
651 HG2 LYS 82 HG2 LYS 82 13.691 23.900 -17.059
652 HG3 LYS 82 HG3 LYS 82 13.057 22.243 -17.176
653 HD2 LYS 82 HD2 LYS 82 11.441 22.984 -18.908
654 HD3 LYS 82 HD3 LYS 82 12.077 24.642 -18.791
655 HE2 LYS 82 HE2 LYS 82 14.331 23.809 -19.452
656 HE3 LYS 82 HE3 LYS 82 13.684 22.170 -19.586
657 HZ1 LYS 82 HZ1 LYS 82 13.791 23.257 -21.735
658 HZ2 LYS 82 HZ2 LYS 82 12.232 22.964 -21.368
659 HZ3 LYS 82 HZ3 LYS 82 12.836 24.480 -21.242
660 H VAL 83 HN VAL 83 9.833 22.789 -13.686
661 HA VAL 83 HA VAL 83 9.452 25.326 -12.506
662 HB VAL 83 HB VAL 83 8.202 22.621 -11.932
663 HG11 VAL 83 HG11 VAL 83 6.419 23.837 -10.708
664 HG12 VAL 83 HG12 VAL 83 7.970 23.891 -9.858
665 HG13 VAL 83 HG13 VAL 83 7.403 25.319 -10.760
666 HG21 VAL 83 HG21 VAL 83 7.097 25.133 -13.271
667 HG22 VAL 83 HG22 VAL 83 7.697 23.716 -14.144
668 HG23 VAL 83 HG23 VAL 83 6.275 23.566 -13.110
669 H ALA 84 HN ALA 84 10.794 22.272 -11.119
670 HA ALA 84 HA ALA 84 11.388 23.283 -8.528
671 HB1 ALA 84 HB1 ALA 84 12.824 21.139 -10.152
672 HB2 ALA 84 HB2 ALA 84 12.974 21.411 -8.405
673 HB3 ALA 84 HB3 ALA 84 11.416 20.918 -9.083
674 H GLY 85 HN GLY 85 13.383 23.286 -11.504
675 HA2 GLY 85 HA2 GLY 85 15.659 24.595 -10.379
676 HA3 GLY 85 HA3 GLY 85 15.281 24.374 -12.095
677 H LYS 86 HN LYS 86 12.591 25.906 -11.222
678 HA LYS 86 HA LYS 86 11.733 27.902 -11.560
679 HB2 LYS 86 HB2 LYS 86 14.211 29.079 -10.242
680 HB3 LYS 86 HB3 LYS 86 12.687 29.908 -10.562
681 HG2 LYS 86 HG2 LYS 86 11.522 28.192 -9.086
682 HG3 LYS 86 HG3 LYS 86 13.118 27.551 -8.677
683 HD2 LYS 86 HD2 LYS 86 12.479 29.003 -6.906
684 HD3 LYS 86 HD3 LYS 86 13.757 29.833 -7.815
685 HE2 LYS 86 HE2 LYS 86 12.032 31.186 -8.994
686 HE3 LYS 86 HE3 LYS 86 10.756 30.327 -8.122
687 HZ1 LYS 86 HZ1 LYS 86 11.259 32.450 -7.097
688 HZ2 LYS 86 HZ2 LYS 86 11.638 31.256 -6.058
689 HZ3 LYS 86 HZ3 LYS 86 12.819 32.049 -6.867
690 H THR 87 HN THR 87 13.202 26.553 -13.555
691 HA THR 87 HA THR 87 14.230 28.725 -15.235
692 HB THR 87 HB THR 87 14.989 26.586 -16.593
693 HG1 THR 87 HG1 THR 87 15.367 24.841 -15.233
694 HG21 THR 87 HG21 THR 87 16.531 28.182 -15.522
695 HG22 THR 87 HG22 THR 87 16.285 27.393 -13.951
696 HG23 THR 87 HG23 THR 87 17.079 26.516 -15.278
697 H GLN 88 HN GLN 88 11.399 26.948 -14.687
698 HA GLN 88 HA GLN 88 10.360 26.785 -17.351
699 HB2 GLN 88 HB2 GLN 88 9.336 25.540 -15.515
700 HB3 GLN 88 HB3 GLN 88 8.988 27.035 -14.644
701 HG2 GLN 88 HG2 GLN 88 6.970 26.143 -15.652
702 HG3 GLN 88 HG3 GLN 88 7.362 27.697 -16.363
703 HE21 GLN 88 HE22 GLN 88 8.482 27.654 -18.531
704 HE22 GLN 88 HE21 GLN 88 8.037 26.366 -19.654
Start of MODEL 18
1 HA MET 1 HA MET 1 3.660 -1.322 -2.813
2 H1 MET 1 H1 MET 1 2.130 -0.057 -0.659
3 H2 MET 1 H2 MET 1 1.842 -1.544 -1.310
4 H3 MET 1 H3 MET 1 3.239 -1.248 -0.479
5 HB2 MET 1 HB2 MET 1 1.473 -0.443 -3.598
6 HB3 MET 1 HB3 MET 1 1.876 1.151 -2.940
7 HG2 MET 1 HG2 MET 1 2.308 1.085 -5.341
8 HG3 MET 1 HG3 MET 1 3.820 1.298 -4.467
9 HE1 MET 1 HE1 MET 1 5.001 -0.625 -7.610
10 HE2 MET 1 HE2 MET 1 3.757 0.639 -7.494
11 HE3 MET 1 HE3 MET 1 5.257 0.781 -6.549
12 H GLU 2 HN GLU 2 5.661 -0.499 -3.207
13 HA GLU 2 HA GLU 2 6.565 1.934 -1.805
14 HB2 GLU 2 HB2 GLU 2 8.120 -0.697 -1.882
15 HB3 GLU 2 HB3 GLU 2 8.627 0.829 -1.172
16 HG2 GLU 2 HG2 GLU 2 7.984 -0.348 0.705
17 HG3 GLU 2 HG3 GLU 2 6.543 0.603 0.367
18 H TRP 3 HN TRP 3 8.347 2.903 -3.044
19 HA TRP 3 HA TRP 3 8.208 2.056 -5.906
20 HD1 TRP 3 HD1 TRP 3 6.082 4.538 -3.252
21 HE1 TRP 3 HE1 TRP 3 3.587 4.363 -3.773
22 HE3 TRP 3 HE3 TRP 3 6.373 3.636 -8.278
23 HZ2 TRP 3 HZ2 TRP 3 1.915 3.823 -6.083
24 HZ3 TRP 3 HZ3 TRP 3 4.319 3.273 -9.615
25 HH2 TRP 3 HH2 TRP 3 2.084 3.360 -8.526
26 HB2 TRP 3 HB2 TRP 3 8.246 4.878 -4.779
27 HB3 TRP 3 HB3 TRP 3 8.126 4.425 -6.471
28 H LEU 4 HN LEU 4 9.982 2.757 -7.208
29 HA LEU 4 HA LEU 4 12.580 2.983 -5.768
30 HG LEU 4 HG LEU 4 14.168 2.841 -8.497
31 HB2 LEU 4 HB2 LEU 4 12.272 0.933 -7.072
32 HB3 LEU 4 HB3 LEU 4 11.841 1.898 -8.492
33 HD11 LEU 4 HD11 LEU 4 14.839 2.461 -6.169
34 HD12 LEU 4 HD12 LEU 4 14.665 0.708 -6.371
35 HD13 LEU 4 HD13 LEU 4 15.927 1.596 -7.252
36 HD21 LEU 4 HD21 LEU 4 15.175 0.832 -9.473
37 HD22 LEU 4 HD22 LEU 4 13.985 -0.201 -8.654
38 HD23 LEU 4 HD23 LEU 4 13.465 0.923 -9.928
39 H VAL 5 HN VAL 5 13.612 4.773 -6.085
40 HA VAL 5 HA VAL 5 12.764 6.926 -7.944
41 HB VAL 5 HB VAL 5 15.268 6.763 -6.193
42 HG11 VAL 5 HG11 VAL 5 13.881 9.099 -7.546
43 HG12 VAL 5 HG12 VAL 5 15.256 9.231 -6.424
44 HG13 VAL 5 HG13 VAL 5 15.462 8.420 -7.973
45 HG21 VAL 5 HG21 VAL 5 13.322 6.653 -4.691
46 HG22 VAL 5 HG22 VAL 5 14.010 8.272 -4.611
47 HG23 VAL 5 HG23 VAL 5 12.533 7.977 -5.561
48 H LYS 6 HN LYS 6 13.189 6.460 -9.994
49 HA LYS 6 HA LYS 6 15.669 5.014 -10.813
50 HB2 LYS 6 HB2 LYS 6 13.008 5.534 -12.071
51 HB3 LYS 6 HB3 LYS 6 14.381 5.120 -13.084
52 HG2 LYS 6 HG2 LYS 6 13.911 3.348 -10.708
53 HG3 LYS 6 HG3 LYS 6 12.732 3.260 -12.003
54 HD2 LYS 6 HD2 LYS 6 14.498 1.568 -12.214
55 HD3 LYS 6 HD3 LYS 6 14.329 2.611 -13.627
56 HE2 LYS 6 HE2 LYS 6 16.309 3.919 -12.967
57 HE3 LYS 6 HE3 LYS 6 16.468 2.966 -11.479
58 HZ1 LYS 6 HZ1 LYS 6 16.897 1.012 -12.860
59 HZ2 LYS 6 HZ2 LYS 6 16.752 1.893 -14.229
60 HZ3 LYS 6 HZ3 LYS 6 17.973 2.186 -13.195
61 H LYS 7 HN LYS 7 14.255 8.214 -10.782
62 HA LYS 7 HA LYS 7 16.665 9.383 -11.893
63 HB2 LYS 7 HB2 LYS 7 13.979 9.889 -13.223
64 HB3 LYS 7 HB3 LYS 7 15.336 11.009 -13.290
65 HG2 LYS 7 HG2 LYS 7 16.765 9.314 -14.340
66 HG3 LYS 7 HG3 LYS 7 15.441 8.142 -14.288
67 HD2 LYS 7 HD2 LYS 7 14.060 9.655 -15.709
68 HD3 LYS 7 HD3 LYS 7 15.451 10.731 -15.888
69 HE2 LYS 7 HE2 LYS 7 15.477 7.753 -16.595
70 HE3 LYS 7 HE3 LYS 7 15.061 9.018 -17.760
71 HZ1 LYS 7 HZ1 LYS 7 17.678 8.770 -16.387
72 HZ2 LYS 7 HZ2 LYS 7 17.373 8.407 -17.945
73 HZ3 LYS 7 HZ3 LYS 7 17.279 9.953 -17.448
74 H SER 8 HN SER 8 16.852 11.552 -11.028
75 HA SER 8 HA SER 8 14.802 12.534 -9.128
76 HG SER 8 HG SER 8 18.474 12.047 -8.944
77 HB2 SER 8 HB2 SER 8 16.843 12.824 -7.543
78 HB3 SER 8 HB3 SER 8 16.064 11.243 -7.666
79 H CYS 9 HN CYS 9 15.050 14.778 -8.758
80 HA CYS 9 HA CYS 9 16.914 16.270 -10.540
81 HG CYS 9 HG CYS 9 14.111 18.342 -12.272
82 HB2 CYS 9 HB2 CYS 9 14.594 16.024 -11.479
83 HB3 CYS 9 HB3 CYS 9 13.959 16.847 -10.042
84 H CYS 10 HN CYS 10 18.307 16.765 -8.887
85 HA CYS 10 HA CYS 10 17.649 17.674 -6.276
86 HG CYS 10 HG CYS 10 19.451 15.908 -5.750
87 HB2 CYS 10 HB2 CYS 10 20.101 18.292 -7.977
88 HB3 CYS 10 HB3 CYS 10 19.978 18.434 -6.217
89 H ASN 11 HN ASN 11 17.636 19.832 -5.419
90 HA ASN 11 HA ASN 11 17.742 22.153 -7.204
91 HB2 ASN 11 HB2 ASN 11 15.606 22.842 -7.170
92 HB3 ASN 11 HB3 ASN 11 15.262 21.120 -7.157
93 HD21 ASN 11 HD22 ASN 11 15.064 20.142 -4.843
94 HD22 ASN 11 HD21 ASN 11 14.223 21.103 -3.681
95 H LYS 12 HN LYS 12 17.791 24.076 -6.057
96 HA LYS 12 HA LYS 12 17.715 24.027 -3.089
97 HB2 LYS 12 HB2 LYS 12 19.924 24.867 -4.931
98 HB3 LYS 12 HB3 LYS 12 19.496 26.086 -3.741
99 HG2 LYS 12 HG2 LYS 12 20.033 23.203 -2.982
100 HG3 LYS 12 HG3 LYS 12 21.313 24.431 -3.072
101 HD2 LYS 12 HD2 LYS 12 20.089 25.862 -1.453
102 HD3 LYS 12 HD3 LYS 12 18.822 24.641 -1.306
103 HE2 LYS 12 HE2 LYS 12 20.500 22.987 -0.489
104 HE3 LYS 12 HE3 LYS 12 21.771 24.206 -0.634
105 HZ1 LYS 12 HZ1 LYS 12 19.437 24.391 1.183
106 HZ2 LYS 12 HZ2 LYS 12 20.962 24.041 1.629
107 HZ3 LYS 12 HZ3 LYS 12 20.613 25.520 1.046
108 H GLN 13 HN GLN 13 16.744 25.372 -6.094
109 HA GLN 13 HA GLN 13 16.531 28.068 -5.335
110 HB2 GLN 13 HB2 GLN 13 15.024 26.550 -7.543
111 HB3 GLN 13 HB3 GLN 13 15.223 28.292 -7.413
112 HG2 GLN 13 HG2 GLN 13 16.794 27.867 -8.951
113 HG3 GLN 13 HG3 GLN 13 17.808 27.773 -7.522
114 HE21 GLN 13 HE22 GLN 13 17.987 26.550 -10.329
115 HE22 GLN 13 HE21 GLN 13 18.216 24.832 -10.036
116 H ASP 14 HN ASP 14 14.290 25.314 -5.002
117 HA ASP 14 HA ASP 14 12.343 27.190 -3.694
118 HB2 ASP 14 HB2 ASP 14 11.895 26.738 -6.185
119 HB3 ASP 14 HB3 ASP 14 11.509 25.086 -5.715
120 H ASN 15 HN ASN 15 14.115 24.477 -3.284
121 HA ASN 15 HA ASN 15 14.250 22.819 -1.817
122 HB2 ASN 15 HB2 ASN 15 12.959 24.460 -0.241
123 HB3 ASN 15 HB3 ASN 15 11.592 23.387 -0.520
124 HD21 ASN 15 HD22 ASN 15 13.082 20.833 -0.545
125 HD22 ASN 15 HD21 ASN 15 13.611 20.593 1.118
126 H ARG 16 HN ARG 16 11.548 23.301 -3.801
127 HA ARG 16 HA ARG 16 10.238 20.756 -3.795
128 HE ARG 16 HE ARG 16 8.521 24.467 -6.282
129 HB2 ARG 16 HB2 ARG 16 9.324 22.880 -4.566
130 HB3 ARG 16 HB3 ARG 16 10.522 22.932 -5.874
131 HG2 ARG 16 HG2 ARG 16 9.423 20.782 -6.773
132 HG3 ARG 16 HG3 ARG 16 8.127 21.097 -5.606
133 HD2 ARG 16 HD2 ARG 16 9.057 22.861 -7.894
134 HD3 ARG 16 HD3 ARG 16 7.486 22.098 -7.746
135 HH11 ARG 16 HH11 ARG 16 5.647 22.319 -6.674
136 HH12 ARG 16 HH12 ARG 16 4.626 23.459 -5.867
137 HH21 ARG 16 HH21 ARG 16 7.294 25.742 -5.211
138 HH22 ARG 16 HH22 ARG 16 5.568 25.503 -4.989
139 H HIS 17 HN HIS 17 11.113 18.986 -4.375
140 HA HIS 17 HA HIS 17 13.221 18.661 -6.462
141 HD1 HIS 17 HD1 HIS 17 13.554 18.787 -2.421
142 HD2 HIS 17 HD2 HIS 17 15.711 17.013 -5.538
143 HE1 HIS 17 HE1 HIS 17 16.020 19.216 -1.906
144 HB2 HIS 17 HB2 HIS 17 12.227 16.988 -4.098
145 HB3 HIS 17 HB3 HIS 17 13.237 16.311 -5.370
146 H VAL 18 HN VAL 18 12.897 16.650 -7.778
147 HA VAL 18 HA VAL 18 10.183 15.616 -7.886
148 HB VAL 18 HB VAL 18 11.469 16.210 -10.549
149 HG11 VAL 18 HG11 VAL 18 9.228 16.171 -11.419
150 HG12 VAL 18 HG12 VAL 18 9.337 14.830 -10.281
151 HG13 VAL 18 HG13 VAL 18 8.512 16.317 -9.798
152 HG21 VAL 18 HG21 VAL 18 11.590 18.423 -9.708
153 HG22 VAL 18 HG22 VAL 18 10.293 18.317 -10.887
154 HG23 VAL 18 HG23 VAL 18 9.889 18.383 -9.162
155 H LEU 19 HN LEU 19 10.137 13.517 -8.542
156 HA LEU 19 HA LEU 19 12.655 12.319 -9.497
157 HG LEU 19 HG LEU 19 10.811 12.282 -6.116
158 HB2 LEU 19 HB2 LEU 19 11.685 10.455 -7.627
159 HB3 LEU 19 HB3 LEU 19 13.228 11.261 -7.673
160 HD11 LEU 19 HD11 LEU 19 13.299 10.772 -5.219
161 HD12 LEU 19 HD12 LEU 19 11.984 11.363 -4.169
162 HD13 LEU 19 HD13 LEU 19 11.665 10.099 -5.365
163 HD21 LEU 19 HD21 LEU 19 12.911 13.407 -4.851
164 HD22 LEU 19 HD22 LEU 19 13.645 13.291 -6.471
165 HD23 LEU 19 HD23 LEU 19 12.131 14.200 -6.203
166 H MET 20 HN MET 20 12.284 9.994 -10.099
167 HA MET 20 HA MET 20 9.643 9.828 -11.470
168 HB2 MET 20 HB2 MET 20 11.670 10.107 -12.907
169 HB3 MET 20 HB3 MET 20 12.281 8.567 -12.274
170 HG2 MET 20 HG2 MET 20 10.248 7.436 -13.176
171 HG3 MET 20 HG3 MET 20 9.657 8.993 -13.750
172 HE1 MET 20 HE1 MET 20 13.362 7.488 -13.932
173 HE2 MET 20 HE2 MET 20 12.260 6.132 -14.209
174 HE3 MET 20 HE3 MET 20 13.286 6.728 -15.536
175 H LEU 21 HN LEU 21 8.449 8.694 -10.081
176 HA LEU 21 HA LEU 21 9.615 6.663 -8.276
177 HG LEU 21 HG LEU 21 8.693 7.063 -6.172
178 HB2 LEU 21 HB2 LEU 21 6.996 8.175 -8.449
179 HB3 LEU 21 HB3 LEU 21 6.954 6.539 -7.791
180 HD11 LEU 21 HD11 LEU 21 9.149 9.608 -5.791
181 HD12 LEU 21 HD12 LEU 21 9.995 8.800 -7.119
182 HD13 LEU 21 HD13 LEU 21 8.585 9.812 -7.463
183 HD21 LEU 21 HD21 LEU 21 6.291 8.943 -6.115
184 HD22 LEU 21 HD22 LEU 21 6.329 7.262 -5.556
185 HD23 LEU 21 HD23 LEU 21 7.274 8.492 -4.706
186 H CYS 22 HN CYS 22 9.595 4.606 -8.764
187 HA CYS 22 HA CYS 22 7.873 3.650 -11.006
188 HG CYS 22 HG CYS 22 10.718 5.553 -10.994
189 HB2 CYS 22 HB2 CYS 22 10.825 3.041 -10.498
190 HB3 CYS 22 HB3 CYS 22 9.843 2.479 -11.862
191 H ASP 23 HN ASP 23 7.774 1.264 -11.082
192 HA ASP 23 HA ASP 23 7.085 -0.043 -8.627
193 HB2 ASP 23 HB2 ASP 23 6.276 -1.148 -10.510
194 HB3 ASP 23 HB3 ASP 23 7.708 -0.800 -11.467
195 H ALA 24 HN ALA 24 8.327 -1.529 -7.341
196 HA ALA 24 HA ALA 24 11.106 -0.931 -6.945
197 HB1 ALA 24 HB1 ALA 24 9.361 -3.168 -5.841
198 HB2 ALA 24 HB2 ALA 24 10.978 -2.718 -5.257
199 HB3 ALA 24 HB3 ALA 24 9.635 -1.572 -5.101
200 H GLY 25 HN GLY 25 11.713 -1.258 -9.215
201 HA2 GLY 25 HA2 GLY 25 13.277 -3.353 -10.005
202 HA3 GLY 25 HA3 GLY 25 11.630 -3.921 -10.368
203 H GLY 26 HN GLY 26 10.910 -0.950 -10.797
204 HA2 GLY 26 HA2 GLY 26 11.173 0.741 -12.347
205 HA3 GLY 26 HA3 GLY 26 12.355 -0.217 -13.241
206 H ALA 27 HN ALA 27 9.507 -2.106 -12.635
207 HA ALA 27 HA ALA 27 9.152 -2.353 -15.455
208 HB1 ALA 27 HB1 ALA 27 7.359 -3.337 -13.193
209 HB2 ALA 27 HB2 ALA 27 7.386 -3.944 -14.859
210 HB3 ALA 27 HB3 ALA 27 8.798 -4.183 -13.814
211 H ILE 28 HN ILE 28 7.733 -0.083 -13.292
212 HA ILE 28 HA ILE 28 5.796 0.893 -15.282
213 HB ILE 28 HB ILE 28 5.133 0.335 -12.343
214 HG12 ILE 28 HG12 ILE 28 4.022 -0.989 -14.859
215 HG13 ILE 28 HG13 ILE 28 5.052 -1.747 -13.641
216 HG21 ILE 28 HG21 ILE 28 4.081 2.433 -13.164
217 HG22 ILE 28 HG22 ILE 28 3.366 1.539 -14.528
218 HG23 ILE 28 HG23 ILE 28 2.879 1.211 -12.850
219 HD11 ILE 28 HD11 ILE 28 3.248 -1.377 -11.934
220 HD12 ILE 28 HD12 ILE 28 2.177 -0.877 -13.270
221 HD13 ILE 28 HD13 ILE 28 2.850 -2.511 -13.242
222 H LYS 29 HN LYS 29 5.624 3.265 -14.984
223 HA LYS 29 HA LYS 29 7.529 4.430 -13.023
224 HB2 LYS 29 HB2 LYS 29 7.620 4.986 -16.021
225 HB3 LYS 29 HB3 LYS 29 8.563 5.782 -14.757
226 HG2 LYS 29 HG2 LYS 29 9.439 3.385 -14.183
227 HG3 LYS 29 HG3 LYS 29 8.793 2.909 -15.749
228 HD2 LYS 29 HD2 LYS 29 10.293 4.363 -16.926
229 HD3 LYS 29 HD3 LYS 29 10.643 5.292 -15.478
230 HE2 LYS 29 HE2 LYS 29 12.580 3.978 -15.935
231 HE3 LYS 29 HE3 LYS 29 11.846 3.357 -14.468
232 HZ1 LYS 29 HZ1 LYS 29 11.464 2.159 -17.172
233 HZ2 LYS 29 HZ2 LYS 29 12.532 1.612 -16.077
234 HZ3 LYS 29 HZ3 LYS 29 10.938 1.506 -15.759
235 H MET 30 HN MET 30 7.071 6.468 -12.368
236 HA MET 30 HA MET 30 4.841 8.028 -13.501
237 HB2 MET 30 HB2 MET 30 5.186 7.393 -10.539
238 HB3 MET 30 HB3 MET 30 3.943 8.389 -11.275
239 HG2 MET 30 HG2 MET 30 3.361 6.165 -12.598
240 HG3 MET 30 HG3 MET 30 4.211 5.406 -11.253
241 HE1 MET 30 HE1 MET 30 3.107 7.916 -9.019
242 HE2 MET 30 HE2 MET 30 1.939 6.842 -8.226
243 HE3 MET 30 HE3 MET 30 3.556 6.234 -8.646
244 H ILE 31 HN ILE 31 4.898 10.234 -12.263
245 HA ILE 31 HA ILE 31 7.691 11.087 -11.650
246 HB ILE 31 HB ILE 31 5.446 12.645 -12.924
247 HG12 ILE 31 HG12 ILE 31 8.162 12.384 -14.253
248 HG13 ILE 31 HG13 ILE 31 7.127 10.961 -14.283
249 HG21 ILE 31 HG21 ILE 31 7.240 14.471 -13.126
250 HG22 ILE 31 HG22 ILE 31 6.605 14.193 -11.509
251 HG23 ILE 31 HG23 ILE 31 8.186 13.525 -11.954
252 HD11 ILE 31 HD11 ILE 31 5.259 12.268 -15.172
253 HD12 ILE 31 HD12 ILE 31 6.288 13.716 -15.200
254 HD13 ILE 31 HD13 ILE 31 6.688 12.311 -16.224
255 H ALA 32 HN ALA 32 7.798 12.199 -9.621
256 HA ALA 32 HA ALA 32 5.255 13.058 -8.407
257 HB1 ALA 32 HB1 ALA 32 5.863 12.241 -6.208
258 HB2 ALA 32 HB2 ALA 32 5.813 10.869 -7.335
259 HB3 ALA 32 HB3 ALA 32 7.378 11.566 -6.821
260 H GLU 33 HN GLU 33 5.457 15.043 -7.657
261 HA GLU 33 HA GLU 33 8.101 16.384 -7.553
262 HB2 GLU 33 HB2 GLU 33 6.145 17.363 -8.900
263 HB3 GLU 33 HB3 GLU 33 5.262 17.528 -7.374
264 HG2 GLU 33 HG2 GLU 33 7.125 18.984 -6.531
265 HG3 GLU 33 HG3 GLU 33 7.891 18.873 -8.115
266 H VAL 34 HN VAL 34 8.848 16.959 -5.490
267 HA VAL 34 HA VAL 34 7.152 16.366 -3.148
268 HB VAL 34 HB VAL 34 8.749 14.793 -2.224
269 HG11 VAL 34 HG11 VAL 34 8.130 13.803 -5.032
270 HG12 VAL 34 HG12 VAL 34 8.372 12.844 -3.562
271 HG13 VAL 34 HG13 VAL 34 6.942 13.870 -3.717
272 HG21 VAL 34 HG21 VAL 34 10.600 13.824 -3.579
273 HG22 VAL 34 HG22 VAL 34 10.346 15.096 -4.794
274 HG23 VAL 34 HG23 VAL 34 10.857 15.506 -3.135
275 H LYS 35 HN LYS 35 8.428 16.896 -1.123
276 HA LYS 35 HA LYS 35 10.540 18.943 -1.549
277 HB2 LYS 35 HB2 LYS 35 8.258 19.881 -0.753
278 HB3 LYS 35 HB3 LYS 35 8.545 19.019 0.759
279 HG2 LYS 35 HG2 LYS 35 10.635 20.295 1.093
280 HG3 LYS 35 HG3 LYS 35 10.429 21.093 -0.475
281 HD2 LYS 35 HD2 LYS 35 8.497 21.347 1.871
282 HD3 LYS 35 HD3 LYS 35 9.806 22.481 1.515
283 HE2 LYS 35 HE2 LYS 35 8.801 22.932 -0.729
284 HE3 LYS 35 HE3 LYS 35 7.458 21.851 -0.334
285 HZ1 LYS 35 HZ1 LYS 35 6.887 24.157 0.087
286 HZ2 LYS 35 HZ2 LYS 35 6.887 23.345 1.499
287 HZ3 LYS 35 HZ3 LYS 35 8.125 24.344 1.127
288 H SER 36 HN SER 36 12.055 18.853 0.428
289 HA SER 36 HA SER 36 12.032 16.262 1.809
290 HG SER 36 HG SER 36 15.069 15.037 0.728
291 HB2 SER 36 HB2 SER 36 13.138 15.997 -0.544
292 HB3 SER 36 HB3 SER 36 14.447 16.992 0.118
293 H ASP 37 HN ASP 37 13.578 16.136 3.417
294 HA ASP 37 HA ASP 37 14.994 18.677 4.149
295 HB2 ASP 37 HB2 ASP 37 13.110 18.132 5.682
296 HB3 ASP 37 HB3 ASP 37 13.889 16.598 6.063
297 H PHE 38 HN PHE 38 15.554 15.866 2.683
298 HA PHE 38 HA PHE 38 18.297 15.547 3.720
299 HD1 PHE 38 HD2 PHE 38 14.540 13.975 4.673
300 HD2 PHE 38 HD1 PHE 38 18.517 13.552 6.293
301 HE1 PHE 38 HE2 PHE 38 13.618 14.114 6.977
302 HE2 PHE 38 HE1 PHE 38 17.585 13.656 8.591
303 HZ PHE 38 HZ PHE 38 15.137 13.938 8.937
304 HB2 PHE 38 HB2 PHE 38 16.462 13.173 3.282
305 HB3 PHE 38 HB3 PHE 38 18.088 13.147 3.916
306 H ALA 39 HN ALA 39 19.629 14.319 2.102
307 HA ALA 39 HA ALA 39 19.016 15.037 -0.600
308 HB1 ALA 39 HB1 ALA 39 21.103 13.107 0.512
309 HB2 ALA 39 HB2 ALA 39 21.069 13.765 -1.135
310 HB3 ALA 39 HB3 ALA 39 21.333 14.853 0.240
311 H VAL 40 HN VAL 40 18.517 13.658 -2.376
312 HA VAL 40 HA VAL 40 17.893 10.824 -1.915
313 HB VAL 40 HB VAL 40 15.962 12.614 -3.457
314 HG11 VAL 40 HG11 VAL 40 15.761 9.776 -2.348
315 HG12 VAL 40 HG12 VAL 40 14.427 10.655 -3.115
316 HG13 VAL 40 HG13 VAL 40 15.863 10.251 -4.057
317 HG21 VAL 40 HG21 VAL 40 15.615 11.733 -0.574
318 HG22 VAL 40 HG22 VAL 40 15.768 13.406 -1.158
319 HG23 VAL 40 HG23 VAL 40 14.353 12.453 -1.594
320 H LYS 41 HN LYS 41 18.314 9.615 -3.886
321 HA LYS 41 HA LYS 41 18.753 11.027 -6.358
322 HB2 LYS 41 HB2 LYS 41 20.982 10.548 -6.751
323 HB3 LYS 41 HB3 LYS 41 20.990 11.156 -5.109
324 HG2 LYS 41 HG2 LYS 41 21.242 8.273 -6.024
325 HG3 LYS 41 HG3 LYS 41 22.497 9.283 -5.324
326 HD2 LYS 41 HD2 LYS 41 21.286 9.321 -3.172
327 HD3 LYS 41 HD3 LYS 41 20.019 8.281 -3.852
328 HE2 LYS 41 HE2 LYS 41 22.948 7.456 -3.881
329 HE3 LYS 41 HE3 LYS 41 21.910 7.155 -2.480
330 HZ1 LYS 41 HZ1 LYS 41 21.226 6.186 -5.196
331 HZ2 LYS 41 HZ2 LYS 41 21.959 5.272 -4.032
332 HZ3 LYS 41 HZ3 LYS 41 20.446 5.880 -3.803
333 H VAL 42 HN VAL 42 19.369 9.305 -8.068
334 HA VAL 42 HA VAL 42 17.495 7.318 -8.290
335 HB VAL 42 HB VAL 42 20.289 7.460 -9.521
336 HG11 VAL 42 HG11 VAL 42 17.809 5.895 -10.334
337 HG12 VAL 42 HG12 VAL 42 19.154 6.241 -11.452
338 HG13 VAL 42 HG13 VAL 42 19.436 5.262 -10.016
339 HG21 VAL 42 HG21 VAL 42 17.609 8.698 -10.148
340 HG22 VAL 42 HG22 VAL 42 19.180 9.504 -10.002
341 HG23 VAL 42 HG23 VAL 42 18.853 8.511 -11.420
342 H GLY 43 HN GLY 43 17.411 5.111 -8.156
343 HA2 GLY 43 HA2 GLY 43 17.974 2.972 -7.581
344 HA3 GLY 43 HA3 GLY 43 19.542 3.516 -6.948
345 H ASP 44 HN ASP 44 16.455 5.074 -5.988
346 HA ASP 44 HA ASP 44 17.114 4.097 -3.189
347 HB2 ASP 44 HB2 ASP 44 16.361 6.819 -4.184
348 HB3 ASP 44 HB3 ASP 44 15.710 6.295 -2.645
349 H LEU 45 HN LEU 45 15.429 3.612 -1.702
350 HA LEU 45 HA LEU 45 12.934 2.801 -3.072
351 HG LEU 45 HG LEU 45 11.335 1.887 -0.811
352 HB2 LEU 45 HB2 LEU 45 14.285 1.324 -1.403
353 HB3 LEU 45 HB3 LEU 45 13.745 2.453 -0.166
354 HD11 LEU 45 HD11 LEU 45 12.693 -0.396 -2.315
355 HD12 LEU 45 HD12 LEU 45 10.951 -0.238 -1.994
356 HD13 LEU 45 HD13 LEU 45 11.757 0.914 -3.059
357 HD21 LEU 45 HD21 LEU 45 12.373 0.991 1.178
358 HD22 LEU 45 HD22 LEU 45 11.359 -0.241 0.426
359 HD23 LEU 45 HD23 LEU 45 13.131 -0.328 0.246
360 H LEU 46 HN LEU 46 10.902 3.615 -2.392
361 HA LEU 46 HA LEU 46 10.823 5.647 -0.244
362 HG LEU 46 HG LEU 46 11.552 6.823 -3.008
363 HB2 LEU 46 HB2 LEU 46 9.348 5.749 -2.900
364 HB3 LEU 46 HB3 LEU 46 8.926 6.727 -1.500
365 HD11 LEU 46 HD11 LEU 46 9.181 8.745 -2.881
366 HD12 LEU 46 HD12 LEU 46 10.726 9.109 -3.666
367 HD13 LEU 46 HD13 LEU 46 9.727 7.782 -4.273
368 HD21 LEU 46 HD21 LEU 46 11.974 8.921 -1.664
369 HD22 LEU 46 HD22 LEU 46 10.584 8.477 -0.637
370 HD23 LEU 46 HD23 LEU 46 12.013 7.432 -0.723
371 H SER 47 HN SER 47 9.720 4.755 1.341
372 HA SER 47 HA SER 47 7.470 2.888 0.725
373 HG SER 47 HG SER 47 10.059 1.058 2.359
374 HB2 SER 47 HB2 SER 47 9.180 3.008 3.233
375 HB3 SER 47 HB3 SER 47 7.954 1.792 2.823
376 HA PRO 48 HA PRO 48 5.130 6.237 2.357
377 HB2 PRO 48 HB2 PRO 48 2.682 5.067 2.891
378 HB3 PRO 48 HB3 PRO 48 3.286 5.403 1.248
379 HG2 PRO 48 HG2 PRO 48 3.412 2.798 2.788
380 HG3 PRO 48 HG3 PRO 48 2.917 3.058 1.084
381 HD2 PRO 48 HD2 PRO 48 5.422 2.220 1.745
382 HD3 PRO 48 HD3 PRO 48 5.155 3.356 0.387
383 H LEU 49 HN LEU 49 4.311 7.191 4.142
384 HA LEU 49 HA LEU 49 4.290 5.726 6.759
385 HG LEU 49 HG LEU 49 6.934 6.730 5.847
386 HB2 LEU 49 HB2 LEU 49 5.192 8.561 6.090
387 HB3 LEU 49 HB3 LEU 49 4.904 7.999 7.734
388 HD11 LEU 49 HD11 LEU 49 7.536 9.058 6.273
389 HD12 LEU 49 HD12 LEU 49 7.359 8.815 8.026
390 HD13 LEU 49 HD13 LEU 49 8.640 7.968 7.128
391 HD21 LEU 49 HD21 LEU 49 6.474 6.488 8.865
392 HD22 LEU 49 HD22 LEU 49 6.257 5.208 7.649
393 HD23 LEU 49 HD23 LEU 49 7.875 5.821 8.005
394 H GLN 50 HN GLN 50 3.032 8.313 4.686
395 HA GLN 50 HA GLN 50 0.312 7.715 5.383
396 HB2 GLN 50 HB2 GLN 50 -0.283 10.119 5.876
397 HB3 GLN 50 HB3 GLN 50 0.575 9.298 7.171
398 HG2 GLN 50 HG2 GLN 50 2.611 10.464 6.734
399 HG3 GLN 50 HG3 GLN 50 2.036 11.039 5.167
400 HE21 GLN 50 HE22 GLN 50 2.072 13.261 5.408
401 HE22 GLN 50 HE21 GLN 50 1.206 14.117 6.657
402 H ASN 51 HN ASN 51 -1.024 9.450 3.900
403 HA ASN 51 HA ASN 51 -0.474 8.836 1.271
404 HB2 ASN 51 HB2 ASN 51 -2.632 9.699 2.003
405 HB3 ASN 51 HB3 ASN 51 -1.928 11.273 2.382
406 HD21 ASN 51 HD22 ASN 51 -1.616 12.797 0.669
407 HD22 ASN 51 HD21 ASN 51 -2.070 12.456 -0.977
408 H ALA 52 HN ALA 52 0.854 11.648 3.044
409 HA ALA 52 HA ALA 52 2.211 12.510 0.608
410 HB1 ALA 52 HB1 ALA 52 0.375 14.004 1.294
411 HB2 ALA 52 HB2 ALA 52 1.141 14.211 2.888
412 HB3 ALA 52 HB3 ALA 52 1.947 14.805 1.422
413 H LEU 53 HN LEU 53 3.221 10.686 3.005
414 HA LEU 53 HA LEU 53 5.798 12.049 3.044
415 HG LEU 53 HG LEU 53 4.383 13.467 5.230
416 HB2 LEU 53 HB2 LEU 53 4.497 10.923 5.543
417 HB3 LEU 53 HB3 LEU 53 6.232 11.057 5.374
418 HD11 LEU 53 HD11 LEU 53 4.261 12.378 7.453
419 HD12 LEU 53 HD12 LEU 53 6.034 12.401 7.568
420 HD13 LEU 53 HD13 LEU 53 5.114 13.923 7.544
421 HD21 LEU 53 HD21 LEU 53 6.566 13.863 4.169
422 HD22 LEU 53 HD22 LEU 53 6.491 14.726 5.698
423 HD23 LEU 53 HD23 LEU 53 7.419 13.215 5.580
424 H TYR 54 HN TYR 54 7.425 10.656 2.640
425 HA TYR 54 HA TYR 54 6.931 7.741 2.888
426 HD1 TYR 54 HD2 TYR 54 5.355 9.884 0.439
427 HD2 TYR 54 HD1 TYR 54 6.851 5.893 -0.206
428 HE1 TYR 54 HE2 TYR 54 3.194 9.239 -0.573
429 HE2 TYR 54 HE1 TYR 54 4.713 5.249 -1.248
430 HH TYR 54 HH TYR 54 2.543 5.936 -1.815
431 HB2 TYR 54 HB2 TYR 54 7.958 9.184 0.410
432 HB3 TYR 54 HB3 TYR 54 8.272 7.495 0.736
433 H CYS 55 HN CYS 55 8.680 6.656 3.517
434 HA CYS 55 HA CYS 55 10.969 7.858 4.771
435 HG CYS 55 HG CYS 55 8.446 5.190 4.634
436 HB2 CYS 55 HB2 CYS 55 10.766 5.029 3.625
437 HB3 CYS 55 HB3 CYS 55 11.711 5.569 5.005
438 H ILE 56 HN ILE 56 13.049 8.185 3.863
439 HA ILE 56 HA ILE 56 13.332 7.886 0.922
440 HB ILE 56 HB ILE 56 15.060 9.254 3.017
441 HG12 ILE 56 HG12 ILE 56 13.460 10.534 0.757
442 HG13 ILE 56 HG13 ILE 56 12.812 10.343 2.384
443 HG21 ILE 56 HG21 ILE 56 15.414 9.155 -0.020
444 HG22 ILE 56 HG22 ILE 56 16.360 10.177 1.084
445 HG23 ILE 56 HG23 ILE 56 16.507 8.447 1.176
446 HD11 ILE 56 HD11 ILE 56 14.665 11.668 3.322
447 HD12 ILE 56 HD12 ILE 56 15.279 11.973 1.682
448 HD13 ILE 56 HD13 ILE 56 13.703 12.582 2.159
449 H ASN 57 HN ASN 57 14.792 6.515 0.068
450 HA ASN 57 HA ASN 57 16.454 5.137 -0.303
451 HB2 ASN 57 HB2 ASN 57 17.784 6.609 1.268
452 HB3 ASN 57 HB3 ASN 57 17.431 5.457 2.563
453 HD21 ASN 57 HD22 ASN 57 18.799 5.806 -0.698
454 HD22 ASN 57 HD21 ASN 57 19.920 4.452 -0.596
455 H ARG 58 HN ARG 58 15.012 4.487 2.795
456 HA ARG 58 HA ARG 58 13.612 2.333 2.709
457 HE ARG 58 HE ARG 58 17.186 1.342 0.549
458 HB2 ARG 58 HB2 ARG 58 14.840 0.272 3.103
459 HB3 ARG 58 HB3 ARG 58 15.220 0.939 1.550
460 HG2 ARG 58 HG2 ARG 58 17.307 2.022 2.895
461 HG3 ARG 58 HG3 ARG 58 16.923 0.755 4.056
462 HD2 ARG 58 HD2 ARG 58 18.630 -0.056 2.557
463 HD3 ARG 58 HD3 ARG 58 17.129 -0.937 2.200
464 HH11 ARG 58 HH11 ARG 58 19.083 -1.644 0.894
465 HH12 ARG 58 HH12 ARG 58 19.577 -1.690 -0.757
466 HH21 ARG 58 HH21 ARG 58 17.833 1.286 -1.635
467 HH22 ARG 58 HH22 ARG 58 18.844 0.027 -2.235
468 H GLU 59 HN GLU 59 14.840 4.697 4.458
469 HA GLU 59 HA GLU 59 14.519 3.236 7.020
470 HB2 GLU 59 HB2 GLU 59 16.229 4.489 8.053
471 HB3 GLU 59 HB3 GLU 59 16.895 3.619 6.664
472 HG2 GLU 59 HG2 GLU 59 16.624 5.853 5.363
473 HG3 GLU 59 HG3 GLU 59 16.393 6.608 6.944
474 H LYS 60 HN LYS 60 13.327 4.223 8.531
475 HA LYS 60 HA LYS 60 11.307 5.897 7.427
476 HB2 LYS 60 HB2 LYS 60 11.739 5.049 10.321
477 HB3 LYS 60 HB3 LYS 60 10.273 5.796 9.676
478 HG2 LYS 60 HG2 LYS 60 10.014 3.872 8.091
479 HG3 LYS 60 HG3 LYS 60 11.403 3.083 8.861
480 HD2 LYS 60 HD2 LYS 60 10.201 3.169 11.051
481 HD3 LYS 60 HD3 LYS 60 8.791 3.865 10.246
482 HE2 LYS 60 HE2 LYS 60 10.033 1.147 9.603
483 HE3 LYS 60 HE3 LYS 60 8.651 1.390 10.671
484 HZ1 LYS 60 HZ1 LYS 60 7.934 0.775 8.470
485 HZ2 LYS 60 HZ2 LYS 60 7.415 2.284 8.789
486 HZ3 LYS 60 HZ3 LYS 60 8.689 2.043 7.782
487 H LEU 61 HN LEU 61 14.086 6.733 9.425
488 HA LEU 61 HA LEU 61 12.915 9.099 10.467
489 HG LEU 61 HG LEU 61 16.326 8.435 9.299
490 HB2 LEU 61 HB2 LEU 61 15.085 9.657 11.317
491 HB3 LEU 61 HB3 LEU 61 14.624 8.016 11.739
492 HD11 LEU 61 HD11 LEU 61 17.418 8.548 12.146
493 HD12 LEU 61 HD12 LEU 61 18.394 8.455 10.661
494 HD13 LEU 61 HD13 LEU 61 17.406 9.886 10.975
495 HD21 LEU 61 HD21 LEU 61 17.394 6.324 10.065
496 HD22 LEU 61 HD22 LEU 61 16.341 6.310 11.491
497 HD23 LEU 61 HD23 LEU 61 15.658 6.120 9.864
498 H HIS 62 HN HIS 62 14.495 8.484 7.471
499 HA HIS 62 HA HIS 62 14.875 11.390 6.920
500 HD1 HIS 62 HD1 HIS 62 18.482 8.829 5.070
501 HD2 HIS 62 HD2 HIS 62 16.806 10.857 8.356
502 HE1 HIS 62 HE1 HIS 62 20.348 9.098 6.774
503 HB2 HIS 62 HB2 HIS 62 15.671 8.916 5.329
504 HB3 HIS 62 HB3 HIS 62 15.998 10.589 4.874
505 H THR 63 HN THR 63 13.046 12.375 5.944
506 HA THR 63 HA THR 63 11.266 10.632 4.337
507 HB THR 63 HB THR 63 9.449 12.039 5.370
508 HG1 THR 63 HG1 THR 63 10.641 13.773 6.195
509 HG21 THR 63 HG21 THR 63 10.098 9.752 6.173
510 HG22 THR 63 HG22 THR 63 11.155 10.522 7.381
511 HG23 THR 63 HG23 THR 63 9.397 10.781 7.441
512 H VAL 64 HN VAL 64 10.146 11.503 2.683
513 HA VAL 64 HA VAL 64 10.779 14.282 1.774
514 HB VAL 64 HB VAL 64 9.698 13.301 -0.423
515 HG11 VAL 64 HG11 VAL 64 11.872 12.749 -1.375
516 HG12 VAL 64 HG12 VAL 64 11.908 14.205 -0.374
517 HG13 VAL 64 HG13 VAL 64 12.577 12.688 0.254
518 HG21 VAL 64 HG21 VAL 64 10.901 10.707 0.608
519 HG22 VAL 64 HG22 VAL 64 9.163 11.062 0.482
520 HG23 VAL 64 HG23 VAL 64 10.162 11.009 -0.977
521 H LYS 65 HN LYS 65 8.830 15.357 0.934
522 HA LYS 65 HA LYS 65 6.279 14.292 2.041
523 HB2 LYS 65 HB2 LYS 65 7.208 16.287 3.274
524 HB3 LYS 65 HB3 LYS 65 7.098 17.210 1.766
525 HG2 LYS 65 HG2 LYS 65 4.621 16.780 1.733
526 HG3 LYS 65 HG3 LYS 65 4.783 15.918 3.278
527 HD2 LYS 65 HD2 LYS 65 5.645 17.981 4.342
528 HD3 LYS 65 HD3 LYS 65 5.479 18.847 2.797
529 HE2 LYS 65 HE2 LYS 65 3.041 18.372 2.794
530 HE3 LYS 65 HE3 LYS 65 3.201 17.498 4.322
531 HZ1 LYS 65 HZ1 LYS 65 2.441 19.757 4.677
532 HZ2 LYS 65 HZ2 LYS 65 3.907 19.577 5.361
533 HZ3 LYS 65 HZ3 LYS 65 3.754 20.387 3.948
534 H VAL 66 HN VAL 66 4.585 14.171 0.534
535 HA VAL 66 HA VAL 66 5.447 14.532 -2.256
536 HB VAL 66 HB VAL 66 2.761 13.593 -1.176
537 HG11 VAL 66 HG11 VAL 66 4.037 13.319 -3.941
538 HG12 VAL 66 HG12 VAL 66 2.546 12.507 -3.416
539 HG13 VAL 66 HG13 VAL 66 2.585 14.263 -3.527
540 HG21 VAL 66 HG21 VAL 66 3.609 11.302 -1.669
541 HG22 VAL 66 HG22 VAL 66 5.208 11.976 -2.041
542 HG23 VAL 66 HG23 VAL 66 4.551 12.072 -0.394
543 H LEU 67 HN LEU 67 4.673 16.066 -3.712
544 HA LEU 67 HA LEU 67 2.891 18.214 -2.627
545 HG LEU 67 HG LEU 67 6.050 18.237 -2.509
546 HB2 LEU 67 HB2 LEU 67 5.014 18.404 -4.795
547 HB3 LEU 67 HB3 LEU 67 4.000 19.715 -4.218
548 HD11 LEU 67 HD11 LEU 67 6.214 20.943 -3.896
549 HD12 LEU 67 HD12 LEU 67 7.431 20.274 -2.784
550 HD13 LEU 67 HD13 LEU 67 7.113 19.470 -4.318
551 HD21 LEU 67 HD21 LEU 67 4.491 20.796 -1.947
552 HD22 LEU 67 HD22 LEU 67 4.270 19.233 -1.130
553 HD23 LEU 67 HD23 LEU 67 5.783 20.115 -0.931
554 H SER 68 HN SER 68 3.727 16.202 -5.510
555 HA SER 68 HA SER 68 0.948 15.864 -6.187
556 HG SER 68 HG SER 68 1.118 18.326 -6.284
557 HB2 SER 68 HB2 SER 68 2.762 17.516 -8.021
558 HB3 SER 68 HB3 SER 68 1.264 16.742 -8.563
559 H ALA 69 HN ALA 69 0.813 14.201 -8.006
560 HA ALA 69 HA ALA 69 3.279 13.226 -9.128
561 HB1 ALA 69 HB1 ALA 69 3.020 10.882 -8.353
562 HB2 ALA 69 HB2 ALA 69 3.304 11.969 -6.983
563 HB3 ALA 69 HB3 ALA 69 1.661 11.368 -7.314
564 H SER 70 HN SER 70 2.871 11.680 -10.850
565 HA SER 70 HA SER 70 0.181 10.907 -11.617
566 HG SER 70 HG SER 70 -0.112 13.313 -11.365
567 HB2 SER 70 HB2 SER 70 1.641 13.070 -13.215
568 HB3 SER 70 HB3 SER 70 0.272 12.135 -13.837
569 H SER 71 HN SER 71 0.256 9.478 -13.545
570 HA SER 71 HA SER 71 2.441 7.811 -13.889
571 HG SER 71 HG SER 71 -0.860 6.909 -15.024
572 HB2 SER 71 HB2 SER 71 0.401 8.560 -16.015
573 HB3 SER 71 HB3 SER 71 1.282 7.028 -15.856
574 H TYR 72 HN TYR 72 4.090 7.622 -15.559
575 HA TYR 72 HA TYR 72 5.421 10.102 -15.871
576 HD1 TYR 72 HD1 TYR 72 6.811 8.253 -19.320
577 HD2 TYR 72 HD2 TYR 72 8.420 9.719 -15.595
578 HE1 TYR 72 HE1 TYR 72 8.670 9.339 -20.547
579 HE2 TYR 72 HE2 TYR 72 10.266 10.813 -16.807
580 HH TYR 72 HH TYR 72 11.272 11.172 -18.885
581 HB2 TYR 72 HB2 TYR 72 6.639 8.019 -15.625
582 HB3 TYR 72 HB3 TYR 72 5.983 7.407 -17.144
583 H SER 73 HN SER 73 5.650 11.498 -17.504
584 HA SER 73 HA SER 73 5.082 10.805 -20.241
585 HG SER 73 HG SER 73 1.810 12.153 -19.698
586 HB2 SER 73 HB2 SER 73 3.700 13.145 -18.856
587 HB3 SER 73 HB3 SER 73 3.767 12.919 -20.613
588 HA PRO 74 HA PRO 74 8.955 12.827 -20.051
589 HB2 PRO 74 HB2 PRO 74 9.272 13.747 -22.684
590 HB3 PRO 74 HB3 PRO 74 9.597 12.079 -22.103
591 HG2 PRO 74 HG2 PRO 74 7.162 13.173 -23.509
592 HG3 PRO 74 HG3 PRO 74 7.959 11.585 -23.731
593 HD2 PRO 74 HD2 PRO 74 5.687 11.877 -22.258
594 HD3 PRO 74 HD3 PRO 74 6.960 10.713 -21.782
595 H ASP 75 HN ASP 75 6.604 14.773 -21.952
596 HA ASP 75 HA ASP 75 7.784 17.291 -21.478
597 HB2 ASP 75 HB2 ASP 75 6.055 16.956 -23.165
598 HB3 ASP 75 HB3 ASP 75 4.862 16.567 -21.918
599 H GLU 76 HN GLU 76 5.371 15.486 -19.523
600 HA GLU 76 HA GLU 76 4.906 17.609 -17.657
601 HB2 GLU 76 HB2 GLU 76 4.562 14.596 -17.356
602 HB3 GLU 76 HB3 GLU 76 3.969 15.782 -16.209
603 HG2 GLU 76 HG2 GLU 76 3.086 15.515 -19.112
604 HG3 GLU 76 HG3 GLU 76 2.189 14.978 -17.699
605 H TRP 77 HN TRP 77 7.251 14.910 -17.758
606 HA TRP 77 HA TRP 77 8.353 15.292 -15.141
607 HD1 TRP 77 HD1 TRP 77 11.674 13.489 -18.059
608 HE1 TRP 77 HE1 TRP 77 13.804 13.149 -16.684
609 HE3 TRP 77 HE3 TRP 77 9.712 14.216 -13.416
610 HZ2 TRP 77 HZ2 TRP 77 14.542 13.125 -13.877
611 HZ3 TRP 77 HZ3 TRP 77 11.112 13.895 -11.400
612 HH2 TRP 77 HH2 TRP 77 13.531 13.381 -11.608
613 HB2 TRP 77 HB2 TRP 77 8.735 13.252 -16.369
614 HB3 TRP 77 HB3 TRP 77 9.365 14.111 -17.741
615 H GLU 78 HN GLU 78 9.283 16.587 -18.388
616 HA GLU 78 HA GLU 78 11.433 18.149 -17.401
617 HB2 GLU 78 HB2 GLU 78 9.712 18.339 -19.899
618 HB3 GLU 78 HB3 GLU 78 11.049 19.448 -19.605
619 HG2 GLU 78 HG2 GLU 78 11.389 16.421 -19.687
620 HG3 GLU 78 HG3 GLU 78 11.571 17.468 -21.087
621 H ARG 79 HN ARG 79 8.038 19.089 -17.963
622 HA ARG 79 HA ARG 79 8.324 21.793 -17.160
623 HE ARG 79 HE ARG 79 8.217 22.791 -19.169
624 HB2 ARG 79 HB2 ARG 79 6.171 19.766 -17.439
625 HB3 ARG 79 HB3 ARG 79 5.808 21.056 -16.304
626 HG2 ARG 79 HG2 ARG 79 4.898 21.618 -18.452
627 HG3 ARG 79 HG3 ARG 79 6.148 22.776 -18.024
628 HD2 ARG 79 HD2 ARG 79 6.627 20.416 -19.880
629 HD3 ARG 79 HD3 ARG 79 6.031 21.970 -20.457
630 HH11 ARG 79 HH11 ARG 79 7.754 20.252 -21.628
631 HH12 ARG 79 HH12 ARG 79 9.401 20.302 -22.164
632 HH21 ARG 79 HH21 ARG 79 10.395 22.851 -19.909
633 HH22 ARG 79 HH22 ARG 79 10.914 21.822 -21.185
634 H GLN 80 HN GLN 80 7.519 18.901 -15.117
635 HA GLN 80 HA GLN 80 7.375 20.406 -12.717
636 HB2 GLN 80 HB2 GLN 80 7.960 17.471 -13.261
637 HB3 GLN 80 HB3 GLN 80 7.852 18.141 -11.620
638 HG2 GLN 80 HG2 GLN 80 5.590 18.841 -11.915
639 HG3 GLN 80 HG3 GLN 80 5.634 18.540 -13.650
640 HE21 GLN 80 HE22 GLN 80 5.514 16.435 -14.453
641 HE22 GLN 80 HE21 GLN 80 4.814 15.139 -13.481
642 H CYS 81 HN CYS 81 10.220 18.911 -14.355
643 HA CYS 81 HA CYS 81 12.082 19.544 -12.288
644 HG CYS 81 HG CYS 81 11.402 17.096 -14.331
645 HB2 CYS 81 HB2 CYS 81 12.465 19.230 -15.296
646 HB3 CYS 81 HB3 CYS 81 13.783 19.383 -14.126
647 H LYS 82 HN LYS 82 10.803 21.598 -14.984
648 HA LYS 82 HA LYS 82 12.705 23.689 -14.490
649 HB2 LYS 82 HB2 LYS 82 9.959 23.760 -15.821
650 HB3 LYS 82 HB3 LYS 82 11.020 25.149 -15.693
651 HG2 LYS 82 HG2 LYS 82 11.556 22.587 -17.243
652 HG3 LYS 82 HG3 LYS 82 11.207 24.179 -17.898
653 HD2 LYS 82 HD2 LYS 82 13.740 23.306 -16.452
654 HD3 LYS 82 HD3 LYS 82 13.553 23.685 -18.165
655 HE2 LYS 82 HE2 LYS 82 12.982 26.048 -17.579
656 HE3 LYS 82 HE3 LYS 82 13.222 25.672 -15.869
657 HZ1 LYS 82 HZ1 LYS 82 15.546 25.126 -16.411
658 HZ2 LYS 82 HZ2 LYS 82 15.306 25.585 -17.965
659 HZ3 LYS 82 HZ3 LYS 82 15.175 26.682 -16.752
660 H VAL 83 HN VAL 83 9.407 22.953 -13.244
661 HA VAL 83 HA VAL 83 9.288 25.363 -11.789
662 HB VAL 83 HB VAL 83 7.824 22.746 -11.263
663 HG11 VAL 83 HG11 VAL 83 7.139 25.578 -10.329
664 HG12 VAL 83 HG12 VAL 83 6.147 24.122 -10.082
665 HG13 VAL 83 HG13 VAL 83 7.713 24.272 -9.285
666 HG21 VAL 83 HG21 VAL 83 6.964 25.261 -12.783
667 HG22 VAL 83 HG22 VAL 83 7.362 23.709 -13.530
668 HG23 VAL 83 HG23 VAL 83 5.954 23.829 -12.479
669 H ALA 84 HN ALA 84 10.597 22.131 -10.888
670 HA ALA 84 HA ALA 84 11.403 22.771 -8.227
671 HB1 ALA 84 HB1 ALA 84 13.159 20.996 -8.670
672 HB2 ALA 84 HB2 ALA 84 11.477 20.519 -8.974
673 HB3 ALA 84 HB3 ALA 84 12.570 20.900 -10.331
674 H GLY 85 HN GLY 85 13.046 23.337 -11.367
675 HA2 GLY 85 HA2 GLY 85 15.303 24.729 -10.218
676 HA3 GLY 85 HA3 GLY 85 14.826 24.661 -11.921
677 H LYS 86 HN LYS 86 12.219 25.712 -9.954
678 HA LYS 86 HA LYS 86 11.042 27.563 -9.930
679 HB2 LYS 86 HB2 LYS 86 12.841 27.848 -8.134
680 HB3 LYS 86 HB3 LYS 86 13.617 29.004 -9.207
681 HG2 LYS 86 HG2 LYS 86 12.276 30.044 -7.432
682 HG3 LYS 86 HG3 LYS 86 11.688 30.510 -9.022
683 HD2 LYS 86 HD2 LYS 86 9.780 29.054 -8.861
684 HD3 LYS 86 HD3 LYS 86 10.409 28.245 -7.424
685 HE2 LYS 86 HE2 LYS 86 9.669 31.205 -7.542
686 HE3 LYS 86 HE3 LYS 86 8.548 29.932 -7.052
687 HZ1 LYS 86 HZ1 LYS 86 11.075 30.563 -5.651
688 HZ2 LYS 86 HZ2 LYS 86 9.573 30.935 -5.137
689 HZ3 LYS 86 HZ3 LYS 86 10.027 29.365 -5.229
690 H THR 87 HN THR 87 11.864 26.856 -12.491
691 HA THR 87 HA THR 87 11.886 27.527 -14.597
692 HB THR 87 HB THR 87 10.381 30.006 -13.744
693 HG1 THR 87 HG1 THR 87 8.628 28.761 -13.282
694 HG21 THR 87 HG21 THR 87 10.591 29.535 -16.192
695 HG22 THR 87 HG22 THR 87 9.900 27.921 -15.936
696 HG23 THR 87 HG23 THR 87 8.921 29.376 -15.645
697 H GLN 88 HN GLN 88 14.276 28.268 -13.148
698 HA GLN 88 HA GLN 88 15.286 30.795 -14.067
699 HB2 GLN 88 HB2 GLN 88 16.610 28.144 -13.358
700 HB3 GLN 88 HB3 GLN 88 17.528 29.557 -13.888
701 HG2 GLN 88 HG2 GLN 88 16.674 30.892 -12.028
702 HG3 GLN 88 HG3 GLN 88 15.701 29.547 -11.444
703 HE21 GLN 88 HE22 GLN 88 18.062 31.087 -10.224
704 HE22 GLN 88 HE21 GLN 88 19.190 29.840 -9.754
Start of MODEL 19
1 HA MET 1 HA MET 1 3.744 -1.536 -2.489
2 H1 MET 1 H1 MET 1 1.998 -1.721 -0.897
3 H2 MET 1 H2 MET 1 3.410 -1.287 -0.159
4 H3 MET 1 H3 MET 1 2.233 -0.171 -0.386
5 HB2 MET 1 HB2 MET 1 1.462 -0.855 -3.217
6 HB3 MET 1 HB3 MET 1 1.823 0.822 -2.775
7 HG2 MET 1 HG2 MET 1 3.641 0.892 -4.440
8 HG3 MET 1 HG3 MET 1 3.415 -0.826 -4.787
9 HE1 MET 1 HE1 MET 1 3.693 1.201 -7.035
10 HE2 MET 1 HE2 MET 1 3.287 -0.499 -7.358
11 HE3 MET 1 HE3 MET 1 2.350 0.801 -8.129
12 H GLU 2 HN GLU 2 5.697 -0.637 -3.034
13 HA GLU 2 HA GLU 2 6.500 1.923 -1.772
14 HB2 GLU 2 HB2 GLU 2 8.186 -0.622 -1.893
15 HB3 GLU 2 HB3 GLU 2 8.658 0.943 -1.246
16 HG2 GLU 2 HG2 GLU 2 8.190 -0.261 0.676
17 HG3 GLU 2 HG3 GLU 2 6.718 0.673 0.438
18 H TRP 3 HN TRP 3 8.328 2.876 -3.027
19 HA TRP 3 HA TRP 3 8.104 2.117 -5.902
20 HD1 TRP 3 HD1 TRP 3 6.072 4.593 -3.115
21 HE1 TRP 3 HE1 TRP 3 3.555 4.547 -3.561
22 HE3 TRP 3 HE3 TRP 3 6.165 3.700 -8.149
23 HZ2 TRP 3 HZ2 TRP 3 1.790 4.246 -5.846
24 HZ3 TRP 3 HZ3 TRP 3 4.057 3.568 -9.447
25 HH2 TRP 3 HH2 TRP 3 1.865 3.845 -8.306
26 HB2 TRP 3 HB2 TRP 3 8.179 4.917 -4.723
27 HB3 TRP 3 HB3 TRP 3 7.987 4.495 -6.410
28 H LEU 4 HN LEU 4 9.857 3.045 -7.204
29 HA LEU 4 HA LEU 4 12.466 3.222 -5.762
30 HG LEU 4 HG LEU 4 14.049 3.125 -8.497
31 HB2 LEU 4 HB2 LEU 4 12.181 1.178 -7.083
32 HB3 LEU 4 HB3 LEU 4 11.733 2.147 -8.494
33 HD11 LEU 4 HD11 LEU 4 14.565 0.978 -6.389
34 HD12 LEU 4 HD12 LEU 4 15.823 1.867 -7.272
35 HD13 LEU 4 HD13 LEU 4 14.739 2.731 -6.182
36 HD21 LEU 4 HD21 LEU 4 13.369 1.222 -9.954
37 HD22 LEU 4 HD22 LEU 4 15.078 1.139 -9.498
38 HD23 LEU 4 HD23 LEU 4 13.897 0.085 -8.694
39 H VAL 5 HN VAL 5 13.497 5.010 -6.064
40 HA VAL 5 HA VAL 5 12.645 7.184 -7.889
41 HB VAL 5 HB VAL 5 15.118 7.006 -6.110
42 HG11 VAL 5 HG11 VAL 5 15.107 9.472 -6.282
43 HG12 VAL 5 HG12 VAL 5 15.345 8.693 -7.844
44 HG13 VAL 5 HG13 VAL 5 13.752 9.369 -7.430
45 HG21 VAL 5 HG21 VAL 5 12.346 8.146 -5.512
46 HG22 VAL 5 HG22 VAL 5 13.186 6.862 -4.628
47 HG23 VAL 5 HG23 VAL 5 13.795 8.513 -4.544
48 H LYS 6 HN LYS 6 13.070 6.692 -9.924
49 HA LYS 6 HA LYS 6 15.620 5.385 -10.751
50 HB2 LYS 6 HB2 LYS 6 12.934 5.782 -12.028
51 HB3 LYS 6 HB3 LYS 6 14.320 5.498 -13.051
52 HG2 LYS 6 HG2 LYS 6 13.967 3.607 -10.746
53 HG3 LYS 6 HG3 LYS 6 12.814 3.485 -12.062
54 HD2 LYS 6 HD2 LYS 6 14.741 1.940 -12.296
55 HD3 LYS 6 HD3 LYS 6 14.490 3.007 -13.680
56 HE2 LYS 6 HE2 LYS 6 16.331 4.469 -12.957
57 HE3 LYS 6 HE3 LYS 6 16.571 3.480 -11.502
58 HZ1 LYS 6 HZ1 LYS 6 18.145 2.902 -13.238
59 HZ2 LYS 6 HZ2 LYS 6 17.180 1.625 -12.949
60 HZ3 LYS 6 HZ3 LYS 6 16.958 2.537 -14.288
61 H LYS 7 HN LYS 7 14.082 8.519 -10.644
62 HA LYS 7 HA LYS 7 16.460 9.730 -11.839
63 HB2 LYS 7 HB2 LYS 7 13.697 10.630 -12.754
64 HB3 LYS 7 HB3 LYS 7 15.253 11.351 -13.157
65 HG2 LYS 7 HG2 LYS 7 15.885 9.110 -14.242
66 HG3 LYS 7 HG3 LYS 7 14.179 8.653 -14.042
67 HD2 LYS 7 HD2 LYS 7 13.628 10.832 -15.310
68 HD3 LYS 7 HD3 LYS 7 15.358 10.917 -15.697
69 HE2 LYS 7 HE2 LYS 7 15.240 8.662 -16.729
70 HE3 LYS 7 HE3 LYS 7 13.530 8.550 -16.303
71 HZ1 LYS 7 HZ1 LYS 7 13.099 10.442 -17.768
72 HZ2 LYS 7 HZ2 LYS 7 14.681 10.541 -18.175
73 HZ3 LYS 7 HZ3 LYS 7 13.811 9.230 -18.602
74 H SER 8 HN SER 8 16.731 11.875 -10.870
75 HA SER 8 HA SER 8 14.730 12.922 -9.021
76 HG SER 8 HG SER 8 16.687 12.952 -6.078
77 HB2 SER 8 HB2 SER 8 16.101 11.253 -7.670
78 HB3 SER 8 HB3 SER 8 17.524 12.255 -8.025
79 H CYS 9 HN CYS 9 15.185 15.137 -8.683
80 HA CYS 9 HA CYS 9 17.374 16.390 -10.287
81 HG CYS 9 HG CYS 9 14.156 16.655 -12.702
82 HB2 CYS 9 HB2 CYS 9 14.410 17.108 -10.208
83 HB3 CYS 9 HB3 CYS 9 15.672 18.098 -10.962
84 H CYS 10 HN CYS 10 18.594 16.803 -8.471
85 HA CYS 10 HA CYS 10 17.736 17.618 -5.945
86 HG CYS 10 HG CYS 10 21.468 16.150 -6.233
87 HB2 CYS 10 HB2 CYS 10 20.368 18.261 -7.339
88 HB3 CYS 10 HB3 CYS 10 20.074 18.274 -5.595
89 H ASN 11 HN ASN 11 17.810 19.687 -4.853
90 HA ASN 11 HA ASN 11 17.825 22.170 -6.455
91 HB2 ASN 11 HB2 ASN 11 15.640 22.550 -6.484
92 HB3 ASN 11 HB3 ASN 11 15.418 20.831 -6.246
93 HD21 ASN 11 HD22 ASN 11 15.267 20.115 -3.849
94 HD22 ASN 11 HD21 ASN 11 14.308 21.149 -2.843
95 H LYS 12 HN LYS 12 17.790 24.028 -5.194
96 HA LYS 12 HA LYS 12 17.407 23.883 -2.323
97 HB2 LYS 12 HB2 LYS 12 19.477 25.138 -1.756
98 HB3 LYS 12 HB3 LYS 12 19.689 23.464 -2.205
99 HG2 LYS 12 HG2 LYS 12 21.481 24.777 -3.109
100 HG3 LYS 12 HG3 LYS 12 20.527 24.097 -4.428
101 HD2 LYS 12 HD2 LYS 12 19.422 26.230 -4.802
102 HD3 LYS 12 HD3 LYS 12 20.201 26.952 -3.392
103 HE2 LYS 12 HE2 LYS 12 21.652 25.899 -5.874
104 HE3 LYS 12 HE3 LYS 12 21.207 27.588 -5.622
105 HZ1 LYS 12 HZ1 LYS 12 23.488 27.203 -4.998
106 HZ2 LYS 12 HZ2 LYS 12 22.646 27.621 -3.671
107 HZ3 LYS 12 HZ3 LYS 12 23.083 26.062 -3.912
108 H GLN 13 HN GLN 13 16.499 25.202 -5.097
109 HA GLN 13 HA GLN 13 16.623 28.046 -4.316
110 HB2 GLN 13 HB2 GLN 13 15.529 26.675 -6.813
111 HB3 GLN 13 HB3 GLN 13 15.546 28.416 -6.515
112 HG2 GLN 13 HG2 GLN 13 18.068 28.291 -6.280
113 HG3 GLN 13 HG3 GLN 13 17.980 26.604 -6.796
114 HE21 GLN 13 HE22 GLN 13 18.230 26.273 -9.011
115 HE22 GLN 13 HE21 GLN 13 17.919 27.481 -10.231
116 H ASP 14 HN ASP 14 14.314 25.316 -4.393
117 HA ASP 14 HA ASP 14 12.247 27.190 -3.269
118 HB2 ASP 14 HB2 ASP 14 12.014 26.789 -5.762
119 HB3 ASP 14 HB3 ASP 14 11.695 25.094 -5.393
120 H ASN 15 HN ASN 15 13.932 24.364 -2.808
121 HA ASN 15 HA ASN 15 13.922 22.725 -1.363
122 HB2 ASN 15 HB2 ASN 15 12.545 24.368 0.157
123 HB3 ASN 15 HB3 ASN 15 11.209 23.282 -0.206
124 HD21 ASN 15 HD22 ASN 15 12.812 20.763 -0.235
125 HD22 ASN 15 HD21 ASN 15 13.306 20.502 1.436
126 H ARG 16 HN ARG 16 11.415 23.287 -3.623
127 HA ARG 16 HA ARG 16 10.177 20.693 -3.693
128 HE ARG 16 HE ARG 16 5.735 22.383 -5.929
129 HB2 ARG 16 HB2 ARG 16 10.491 22.946 -5.716
130 HB3 ARG 16 HB3 ARG 16 9.837 21.379 -6.196
131 HG2 ARG 16 HG2 ARG 16 8.101 21.531 -4.462
132 HG3 ARG 16 HG3 ARG 16 8.659 23.159 -4.030
133 HD2 ARG 16 HD2 ARG 16 8.159 23.944 -6.329
134 HD3 ARG 16 HD3 ARG 16 7.793 22.297 -6.833
135 HH11 ARG 16 HH11 ARG 16 7.567 25.230 -4.750
136 HH12 ARG 16 HH12 ARG 16 6.168 25.999 -4.068
137 HH21 ARG 16 HH21 ARG 16 3.911 23.421 -5.029
138 HH22 ARG 16 HH22 ARG 16 4.039 24.943 -4.230
139 H HIS 17 HN HIS 17 11.024 18.823 -4.238
140 HA HIS 17 HA HIS 17 13.266 18.677 -6.213
141 HD1 HIS 17 HD1 HIS 17 14.039 17.012 -1.982
142 HD2 HIS 17 HD2 HIS 17 15.523 18.335 -5.675
143 HE1 HIS 17 HE1 HIS 17 16.366 17.984 -1.518
144 HB2 HIS 17 HB2 HIS 17 12.378 16.779 -3.989
145 HB3 HIS 17 HB3 HIS 17 13.373 16.253 -5.346
146 H VAL 18 HN VAL 18 12.917 16.931 -7.810
147 HA VAL 18 HA VAL 18 10.187 15.846 -7.912
148 HB VAL 18 HB VAL 18 11.476 16.867 -10.446
149 HG11 VAL 18 HG11 VAL 18 8.549 16.257 -9.856
150 HG12 VAL 18 HG12 VAL 18 9.275 16.660 -11.428
151 HG13 VAL 18 HG13 VAL 18 9.680 15.136 -10.647
152 HG21 VAL 18 HG21 VAL 18 11.106 18.918 -9.198
153 HG22 VAL 18 HG22 VAL 18 9.798 18.778 -10.376
154 HG23 VAL 18 HG23 VAL 18 9.493 18.369 -8.691
155 H LEU 19 HN LEU 19 10.149 13.855 -8.698
156 HA LEU 19 HA LEU 19 12.649 12.585 -9.610
157 HG LEU 19 HG LEU 19 10.598 12.417 -6.304
158 HB2 LEU 19 HB2 LEU 19 11.728 10.693 -7.811
159 HB3 LEU 19 HB3 LEU 19 13.188 11.632 -7.704
160 HD11 LEU 19 HD11 LEU 19 11.657 11.462 -4.315
161 HD12 LEU 19 HD12 LEU 19 11.452 10.245 -5.581
162 HD13 LEU 19 HD13 LEU 19 13.057 10.946 -5.292
163 HD21 LEU 19 HD21 LEU 19 13.438 13.510 -6.360
164 HD22 LEU 19 HD22 LEU 19 11.897 14.387 -6.237
165 HD23 LEU 19 HD23 LEU 19 12.536 13.565 -4.829
166 H MET 20 HN MET 20 12.178 10.196 -10.120
167 HA MET 20 HA MET 20 9.430 10.000 -11.255
168 HB2 MET 20 HB2 MET 20 12.044 9.034 -12.427
169 HB3 MET 20 HB3 MET 20 10.514 8.199 -12.744
170 HG2 MET 20 HG2 MET 20 9.469 10.315 -13.451
171 HG3 MET 20 HG3 MET 20 10.992 11.165 -13.206
172 HE1 MET 20 HE1 MET 20 10.711 7.509 -14.874
173 HE2 MET 20 HE2 MET 20 9.163 8.326 -15.184
174 HE3 MET 20 HE3 MET 20 10.279 7.987 -16.528
175 H LEU 21 HN LEU 21 8.252 8.668 -10.278
176 HA LEU 21 HA LEU 21 9.387 6.829 -8.218
177 HG LEU 21 HG LEU 21 8.405 7.262 -6.155
178 HB2 LEU 21 HB2 LEU 21 6.789 8.359 -8.493
179 HB3 LEU 21 HB3 LEU 21 6.709 6.736 -7.805
180 HD11 LEU 21 HD11 LEU 21 9.777 8.955 -7.098
181 HD12 LEU 21 HD12 LEU 21 8.399 9.983 -7.505
182 HD13 LEU 21 HD13 LEU 21 8.909 9.807 -5.812
183 HD21 LEU 21 HD21 LEU 21 6.026 7.541 -5.613
184 HD22 LEU 21 HD22 LEU 21 6.990 8.752 -4.752
185 HD23 LEU 21 HD23 LEU 21 6.060 9.217 -6.195
186 H CYS 22 HN CYS 22 9.413 4.783 -8.695
187 HA CYS 22 HA CYS 22 7.767 3.784 -10.979
188 HG CYS 22 HG CYS 22 10.649 5.716 -10.766
189 HB2 CYS 22 HB2 CYS 22 10.704 3.206 -10.385
190 HB3 CYS 22 HB3 CYS 22 9.782 2.702 -11.809
191 H ASP 23 HN ASP 23 7.753 1.402 -11.078
192 HA ASP 23 HA ASP 23 7.043 0.034 -8.663
193 HB2 ASP 23 HB2 ASP 23 6.336 -1.041 -10.616
194 HB3 ASP 23 HB3 ASP 23 7.815 -0.663 -11.488
195 H ALA 24 HN ALA 24 8.301 -1.352 -7.306
196 HA ALA 24 HA ALA 24 11.069 -0.715 -6.901
197 HB1 ALA 24 HB1 ALA 24 9.595 -1.362 -5.061
198 HB2 ALA 24 HB2 ALA 24 9.353 -2.969 -5.787
199 HB3 ALA 24 HB3 ALA 24 10.958 -2.489 -5.197
200 H GLY 25 HN GLY 25 11.700 -1.055 -9.160
201 HA2 GLY 25 HA2 GLY 25 13.306 -3.133 -9.915
202 HA3 GLY 25 HA3 GLY 25 11.670 -3.719 -10.301
203 H GLY 26 HN GLY 26 10.946 -0.742 -10.742
204 HA2 GLY 26 HA2 GLY 26 11.164 0.932 -12.303
205 HA3 GLY 26 HA3 GLY 26 12.421 0.024 -13.147
206 H ALA 27 HN ALA 27 9.595 -1.946 -12.618
207 HA ALA 27 HA ALA 27 9.335 -2.255 -15.441
208 HB1 ALA 27 HB1 ALA 27 7.540 -3.826 -14.873
209 HB2 ALA 27 HB2 ALA 27 8.916 -4.049 -13.776
210 HB3 ALA 27 HB3 ALA 27 7.460 -3.184 -13.221
211 H ILE 28 HN ILE 28 7.803 0.020 -13.333
212 HA ILE 28 HA ILE 28 5.996 1.018 -15.427
213 HB ILE 28 HB ILE 28 5.150 0.392 -12.549
214 HG12 ILE 28 HG12 ILE 28 4.192 -0.844 -15.169
215 HG13 ILE 28 HG13 ILE 28 5.133 -1.647 -13.909
216 HG21 ILE 28 HG21 ILE 28 4.163 2.525 -13.370
217 HG22 ILE 28 HG22 ILE 28 3.523 1.676 -14.798
218 HG23 ILE 28 HG23 ILE 28 2.936 1.304 -13.161
219 HD11 ILE 28 HD11 ILE 28 2.246 -0.762 -13.704
220 HD12 ILE 28 HD12 ILE 28 2.904 -2.402 -13.680
221 HD13 ILE 28 HD13 ILE 28 3.223 -1.311 -12.315
222 H LYS 29 HN LYS 29 5.820 3.380 -15.121
223 HA LYS 29 HA LYS 29 7.547 4.520 -12.991
224 HB2 LYS 29 HB2 LYS 29 7.909 5.153 -15.949
225 HB3 LYS 29 HB3 LYS 29 8.751 5.883 -14.579
226 HG2 LYS 29 HG2 LYS 29 9.557 3.455 -14.038
227 HG3 LYS 29 HG3 LYS 29 9.035 3.063 -15.676
228 HD2 LYS 29 HD2 LYS 29 10.593 4.715 -16.610
229 HD3 LYS 29 HD3 LYS 29 10.971 5.316 -14.994
230 HE2 LYS 29 HE2 LYS 29 12.802 3.974 -15.732
231 HE3 LYS 29 HE3 LYS 29 12.020 3.196 -14.363
232 HZ1 LYS 29 HZ1 LYS 29 11.512 2.428 -17.192
233 HZ2 LYS 29 HZ2 LYS 29 12.597 1.682 -16.237
234 HZ3 LYS 29 HZ3 LYS 29 11.020 1.605 -15.850
235 H MET 30 HN MET 30 7.083 6.593 -12.411
236 HA MET 30 HA MET 30 4.925 8.137 -13.690
237 HB2 MET 30 HB2 MET 30 5.090 7.609 -10.695
238 HB3 MET 30 HB3 MET 30 3.864 8.519 -11.561
239 HG2 MET 30 HG2 MET 30 3.400 6.234 -12.781
240 HG3 MET 30 HG3 MET 30 4.246 5.549 -11.391
241 HE1 MET 30 HE1 MET 30 3.508 6.481 -8.833
242 HE2 MET 30 HE2 MET 30 2.975 8.118 -9.287
243 HE3 MET 30 HE3 MET 30 1.851 7.016 -8.468
244 H ILE 31 HN ILE 31 4.920 10.351 -12.382
245 HA ILE 31 HA ILE 31 7.711 11.229 -11.802
246 HB ILE 31 HB ILE 31 5.474 12.764 -13.103
247 HG12 ILE 31 HG12 ILE 31 8.081 12.290 -14.548
248 HG13 ILE 31 HG13 ILE 31 6.980 10.923 -14.479
249 HG21 ILE 31 HG21 ILE 31 8.357 13.566 -12.486
250 HG22 ILE 31 HG22 ILE 31 7.250 14.503 -13.506
251 HG23 ILE 31 HG23 ILE 31 6.877 14.282 -11.802
252 HD11 ILE 31 HD11 ILE 31 6.552 12.324 -16.455
253 HD12 ILE 31 HD12 ILE 31 5.148 12.221 -15.362
254 HD13 ILE 31 HD13 ILE 31 6.142 13.684 -15.382
255 H ALA 32 HN ALA 32 7.804 12.494 -9.827
256 HA ALA 32 HA ALA 32 5.243 13.346 -8.646
257 HB1 ALA 32 HB1 ALA 32 7.355 11.878 -7.026
258 HB2 ALA 32 HB2 ALA 32 5.809 12.513 -6.442
259 HB3 ALA 32 HB3 ALA 32 5.817 11.141 -7.572
260 H GLU 33 HN GLU 33 5.415 15.274 -7.701
261 HA GLU 33 HA GLU 33 8.052 16.629 -7.505
262 HB2 GLU 33 HB2 GLU 33 6.150 17.761 -8.783
263 HB3 GLU 33 HB3 GLU 33 5.180 17.694 -7.304
264 HG2 GLU 33 HG2 GLU 33 6.932 19.109 -6.177
265 HG3 GLU 33 HG3 GLU 33 7.730 19.292 -7.728
266 H VAL 34 HN VAL 34 8.763 17.055 -5.388
267 HA VAL 34 HA VAL 34 7.017 16.366 -3.114
268 HB VAL 34 HB VAL 34 8.566 14.776 -2.207
269 HG11 VAL 34 HG11 VAL 34 8.280 13.940 -5.118
270 HG12 VAL 34 HG12 VAL 34 8.421 12.900 -3.691
271 HG13 VAL 34 HG13 VAL 34 6.962 13.866 -3.937
272 HG21 VAL 34 HG21 VAL 34 10.372 15.287 -4.594
273 HG22 VAL 34 HG22 VAL 34 10.711 15.663 -2.887
274 HG23 VAL 34 HG23 VAL 34 10.585 13.984 -3.401
275 H LYS 35 HN LYS 35 8.276 16.856 -1.043
276 HA LYS 35 HA LYS 35 10.339 18.963 -1.370
277 HB2 LYS 35 HB2 LYS 35 7.995 19.804 -0.567
278 HB3 LYS 35 HB3 LYS 35 8.338 18.940 0.930
279 HG2 LYS 35 HG2 LYS 35 10.396 20.275 1.221
280 HG3 LYS 35 HG3 LYS 35 10.112 21.109 -0.318
281 HD2 LYS 35 HD2 LYS 35 8.264 21.216 2.113
282 HD3 LYS 35 HD3 LYS 35 9.492 22.426 1.720
283 HE2 LYS 35 HE2 LYS 35 8.356 22.870 -0.460
284 HE3 LYS 35 HE3 LYS 35 7.096 21.705 -0.030
285 HZ1 LYS 35 HZ1 LYS 35 7.689 24.199 1.462
286 HZ2 LYS 35 HZ2 LYS 35 6.414 23.962 0.478
287 HZ3 LYS 35 HZ3 LYS 35 6.530 23.119 1.866
288 H SER 36 HN SER 36 11.801 18.867 0.644
289 HA SER 36 HA SER 36 11.907 16.172 1.862
290 HG SER 36 HG SER 36 12.102 15.568 -0.695
291 HB2 SER 36 HB2 SER 36 14.266 17.159 0.239
292 HB3 SER 36 HB3 SER 36 13.922 15.524 0.820
293 H ASP 37 HN ASP 37 13.355 16.021 3.596
294 HA ASP 37 HA ASP 37 14.738 18.548 4.420
295 HB2 ASP 37 HB2 ASP 37 12.822 17.886 5.868
296 HB3 ASP 37 HB3 ASP 37 13.625 16.351 6.196
297 H PHE 38 HN PHE 38 15.375 15.849 2.852
298 HA PHE 38 HA PHE 38 18.107 15.470 3.843
299 HD1 PHE 38 HD1 PHE 38 14.436 13.932 4.953
300 HD2 PHE 38 HD2 PHE 38 18.509 13.253 6.193
301 HE1 PHE 38 HE1 PHE 38 13.699 13.873 7.321
302 HE2 PHE 38 HE2 PHE 38 17.770 13.198 8.563
303 HZ PHE 38 HZ PHE 38 15.367 13.501 9.132
304 HB2 PHE 38 HB2 PHE 38 16.183 13.157 3.353
305 HB3 PHE 38 HB3 PHE 38 17.862 13.030 3.837
306 H ALA 39 HN ALA 39 19.370 14.357 2.081
307 HA ALA 39 HA ALA 39 18.601 15.125 -0.572
308 HB1 ALA 39 HB1 ALA 39 20.609 13.847 -1.248
309 HB2 ALA 39 HB2 ALA 39 20.967 14.919 0.120
310 HB3 ALA 39 HB3 ALA 39 20.742 13.172 0.389
311 H VAL 40 HN VAL 40 18.024 13.712 -2.342
312 HA VAL 40 HA VAL 40 17.382 10.913 -1.820
313 HB VAL 40 HB VAL 40 15.322 11.971 -1.136
314 HG11 VAL 40 HG11 VAL 40 15.452 14.162 -2.256
315 HG12 VAL 40 HG12 VAL 40 15.172 13.385 -3.830
316 HG13 VAL 40 HG13 VAL 40 13.918 13.360 -2.580
317 HG21 VAL 40 HG21 VAL 40 15.168 9.873 -2.417
318 HG22 VAL 40 HG22 VAL 40 13.738 10.894 -2.631
319 HG23 VAL 40 HG23 VAL 40 14.964 10.800 -3.915
320 H LYS 41 HN LYS 41 17.869 9.728 -3.674
321 HA LYS 41 HA LYS 41 18.273 11.150 -6.208
322 HB2 LYS 41 HB2 LYS 41 20.559 10.870 -6.434
323 HB3 LYS 41 HB3 LYS 41 20.362 11.521 -4.824
324 HG2 LYS 41 HG2 LYS 41 21.042 8.661 -5.598
325 HG3 LYS 41 HG3 LYS 41 22.087 9.846 -4.810
326 HD2 LYS 41 HD2 LYS 41 20.555 9.804 -2.819
327 HD3 LYS 41 HD3 LYS 41 19.621 8.536 -3.648
328 HE2 LYS 41 HE2 LYS 41 21.631 7.102 -3.744
329 HE3 LYS 41 HE3 LYS 41 22.524 8.308 -2.797
330 HZ1 LYS 41 HZ1 LYS 41 20.032 6.961 -1.908
331 HZ2 LYS 41 HZ2 LYS 41 21.551 6.521 -1.430
332 HZ3 LYS 41 HZ3 LYS 41 20.948 7.980 -1.002
333 H VAL 42 HN VAL 42 19.282 9.505 -7.834
334 HA VAL 42 HA VAL 42 17.366 7.520 -8.226
335 HB VAL 42 HB VAL 42 20.158 7.811 -9.430
336 HG11 VAL 42 HG11 VAL 42 17.723 6.203 -10.307
337 HG12 VAL 42 HG12 VAL 42 19.069 6.615 -11.401
338 HG13 VAL 42 HG13 VAL 42 19.360 5.596 -9.990
339 HG21 VAL 42 HG21 VAL 42 18.905 9.839 -9.786
340 HG22 VAL 42 HG22 VAL 42 18.729 8.911 -11.276
341 HG23 VAL 42 HG23 VAL 42 17.412 8.920 -10.068
342 H GLY 43 HN GLY 43 17.309 5.333 -8.109
343 HA2 GLY 43 HA2 GLY 43 17.757 3.221 -7.385
344 HA3 GLY 43 HA3 GLY 43 19.388 3.707 -6.877
345 H ASP 44 HN ASP 44 16.328 5.381 -5.895
346 HA ASP 44 HA ASP 44 17.028 4.519 -3.052
347 HB2 ASP 44 HB2 ASP 44 15.792 7.122 -3.981
348 HB3 ASP 44 HB3 ASP 44 15.454 6.444 -2.399
349 H LEU 45 HN LEU 45 15.374 3.633 -1.751
350 HA LEU 45 HA LEU 45 12.886 2.900 -3.168
351 HG LEU 45 HG LEU 45 11.229 1.949 -1.024
352 HB2 LEU 45 HB2 LEU 45 14.189 1.376 -1.513
353 HB3 LEU 45 HB3 LEU 45 13.635 2.485 -0.257
354 HD11 LEU 45 HD11 LEU 45 12.654 -0.395 -2.367
355 HD12 LEU 45 HD12 LEU 45 10.898 -0.186 -2.182
356 HD13 LEU 45 HD13 LEU 45 11.813 0.909 -3.223
357 HD21 LEU 45 HD21 LEU 45 12.206 1.114 1.037
358 HD22 LEU 45 HD22 LEU 45 11.194 -0.124 0.288
359 HD23 LEU 45 HD23 LEU 45 12.969 -0.244 0.170
360 H LEU 46 HN LEU 46 10.838 3.730 -2.486
361 HA LEU 46 HA LEU 46 10.785 5.761 -0.331
362 HG LEU 46 HG LEU 46 11.403 6.907 -3.190
363 HB2 LEU 46 HB2 LEU 46 9.219 5.868 -2.933
364 HB3 LEU 46 HB3 LEU 46 8.885 6.864 -1.524
365 HD11 LEU 46 HD11 LEU 46 9.486 7.904 -4.316
366 HD12 LEU 46 HD12 LEU 46 9.109 8.908 -2.901
367 HD13 LEU 46 HD13 LEU 46 10.585 9.201 -3.835
368 HD21 LEU 46 HD21 LEU 46 12.030 7.526 -0.939
369 HD22 LEU 46 HD22 LEU 46 11.970 9.003 -1.901
370 HD23 LEU 46 HD23 LEU 46 10.637 8.609 -0.781
371 H SER 47 HN SER 47 9.663 4.916 1.255
372 HA SER 47 HA SER 47 7.417 3.027 0.668
373 HG SER 47 HG SER 47 10.064 1.209 2.248
374 HB2 SER 47 HB2 SER 47 9.154 3.116 3.158
375 HB3 SER 47 HB3 SER 47 7.943 1.895 2.728
376 HA PRO 48 HA PRO 48 5.114 6.349 2.440
377 HB2 PRO 48 HB2 PRO 48 2.690 5.158 3.026
378 HB3 PRO 48 HB3 PRO 48 3.237 5.552 1.374
379 HG2 PRO 48 HG2 PRO 48 3.416 2.895 2.817
380 HG3 PRO 48 HG3 PRO 48 2.861 3.213 1.141
381 HD2 PRO 48 HD2 PRO 48 5.389 2.356 1.688
382 HD3 PRO 48 HD3 PRO 48 5.075 3.534 0.377
383 H LEU 49 HN LEU 49 4.367 7.238 4.317
384 HA LEU 49 HA LEU 49 4.591 5.686 6.880
385 HG LEU 49 HG LEU 49 7.149 6.637 5.826
386 HB2 LEU 49 HB2 LEU 49 5.468 8.518 6.184
387 HB3 LEU 49 HB3 LEU 49 5.289 7.962 7.843
388 HD11 LEU 49 HD11 LEU 49 7.835 8.954 6.150
389 HD12 LEU 49 HD12 LEU 49 7.764 8.766 7.917
390 HD13 LEU 49 HD13 LEU 49 8.969 7.867 6.966
391 HD21 LEU 49 HD21 LEU 49 6.587 5.164 7.704
392 HD22 LEU 49 HD22 LEU 49 8.234 5.760 7.928
393 HD23 LEU 49 HD23 LEU 49 6.911 6.465 8.874
394 H GLN 50 HN GLN 50 3.147 8.375 5.069
395 HA GLN 50 HA GLN 50 0.527 7.774 6.042
396 HB2 GLN 50 HB2 GLN 50 -0.022 10.091 6.804
397 HB3 GLN 50 HB3 GLN 50 1.028 9.196 7.885
398 HG2 GLN 50 HG2 GLN 50 2.984 10.452 7.141
399 HG3 GLN 50 HG3 GLN 50 2.018 11.292 5.918
400 HE21 GLN 50 HE22 GLN 50 2.182 13.438 6.702
401 HE22 GLN 50 HE21 GLN 50 1.631 13.917 8.284
402 H ASN 51 HN ASN 51 -0.766 10.006 4.905
403 HA ASN 51 HA ASN 51 -0.953 9.167 2.316
404 HB2 ASN 51 HB2 ASN 51 -2.645 10.569 3.363
405 HB3 ASN 51 HB3 ASN 51 -1.547 11.951 3.400
406 HD21 ASN 51 HD22 ASN 51 -1.320 13.238 1.492
407 HD22 ASN 51 HD21 ASN 51 -2.175 12.886 0.017
408 H ALA 52 HN ALA 52 1.164 11.893 3.358
409 HA ALA 52 HA ALA 52 2.233 12.005 0.633
410 HB1 ALA 52 HB1 ALA 52 2.731 14.359 1.123
411 HB2 ALA 52 HB2 ALA 52 1.007 14.012 1.316
412 HB3 ALA 52 HB3 ALA 52 2.048 14.177 2.750
413 H LEU 53 HN LEU 53 3.210 11.398 4.022
414 HA LEU 53 HA LEU 53 5.981 12.075 3.387
415 HG LEU 53 HG LEU 53 4.663 13.330 5.737
416 HB2 LEU 53 HB2 LEU 53 4.772 10.794 5.845
417 HB3 LEU 53 HB3 LEU 53 6.507 10.918 5.585
418 HD11 LEU 53 HD11 LEU 53 5.643 13.663 7.977
419 HD12 LEU 53 HD12 LEU 53 4.803 12.110 7.894
420 HD13 LEU 53 HD13 LEU 53 6.576 12.160 7.811
421 HD21 LEU 53 HD21 LEU 53 7.718 13.089 5.707
422 HD22 LEU 53 HD22 LEU 53 6.702 13.828 4.455
423 HD23 LEU 53 HD23 LEU 53 6.813 14.580 6.042
424 H TYR 54 HN TYR 54 7.526 10.685 2.748
425 HA TYR 54 HA TYR 54 7.024 7.770 2.902
426 HD1 TYR 54 HD1 TYR 54 5.444 10.037 0.530
427 HD2 TYR 54 HD2 TYR 54 6.790 6.014 -0.197
428 HE1 TYR 54 HE1 TYR 54 3.235 9.485 -0.436
429 HE2 TYR 54 HE2 TYR 54 4.602 5.451 -1.187
430 HH TYR 54 HH TYR 54 2.445 6.215 -1.698
431 HB2 TYR 54 HB2 TYR 54 7.995 9.295 0.450
432 HB3 TYR 54 HB3 TYR 54 8.293 7.588 0.701
433 H CYS 55 HN CYS 55 8.816 6.647 3.403
434 HA CYS 55 HA CYS 55 11.157 7.789 4.620
435 HG CYS 55 HG CYS 55 8.592 5.209 4.519
436 HB2 CYS 55 HB2 CYS 55 10.876 5.012 3.384
437 HB3 CYS 55 HB3 CYS 55 11.889 5.498 4.738
438 H ILE 56 HN ILE 56 13.370 7.669 3.692
439 HA ILE 56 HA ILE 56 13.499 7.347 0.723
440 HB ILE 56 HB ILE 56 15.324 8.876 2.611
441 HG12 ILE 56 HG12 ILE 56 13.603 10.076 0.415
442 HG13 ILE 56 HG13 ILE 56 12.979 9.892 2.053
443 HG21 ILE 56 HG21 ILE 56 16.675 8.053 0.714
444 HG22 ILE 56 HG22 ILE 56 15.436 8.580 -0.431
445 HG23 ILE 56 HG23 ILE 56 16.391 9.757 0.481
446 HD11 ILE 56 HD11 ILE 56 15.426 11.532 1.314
447 HD12 ILE 56 HD12 ILE 56 13.855 12.132 1.835
448 HD13 ILE 56 HD13 ILE 56 14.846 11.206 2.961
449 H ASN 57 HN ASN 57 15.007 6.083 -0.117
450 HA ASN 57 HA ASN 57 16.739 4.764 -0.500
451 HB2 ASN 57 HB2 ASN 57 18.066 6.321 0.951
452 HB3 ASN 57 HB3 ASN 57 17.734 5.279 2.342
453 HD21 ASN 57 HD22 ASN 57 18.951 5.243 -1.006
454 HD22 ASN 57 HD21 ASN 57 20.121 3.935 -0.776
455 H ARG 58 HN ARG 58 16.007 4.094 2.897
456 HA ARG 58 HA ARG 58 14.851 1.539 2.528
457 HE ARG 58 HE ARG 58 20.523 0.217 5.197
458 HB2 ARG 58 HB2 ARG 58 16.614 0.068 3.277
459 HB3 ARG 58 HB3 ARG 58 17.261 0.985 1.930
460 HG2 ARG 58 HG2 ARG 58 18.291 2.573 3.725
461 HG3 ARG 58 HG3 ARG 58 17.854 1.323 4.896
462 HD2 ARG 58 HD2 ARG 58 19.139 -0.339 3.483
463 HD3 ARG 58 HD3 ARG 58 19.723 1.011 2.508
464 HH11 ARG 58 HH11 ARG 58 20.532 2.966 2.919
465 HH12 ARG 58 HH12 ARG 58 21.881 3.738 3.674
466 HH21 ARG 58 HH21 ARG 58 22.293 1.272 6.188
467 HH22 ARG 58 HH22 ARG 58 22.893 2.760 5.567
468 H GLU 59 HN GLU 59 15.292 4.319 4.364
469 HA GLU 59 HA GLU 59 14.849 2.903 6.926
470 HB2 GLU 59 HB2 GLU 59 16.484 4.241 8.051
471 HB3 GLU 59 HB3 GLU 59 17.245 3.347 6.738
472 HG2 GLU 59 HG2 GLU 59 17.148 5.458 5.333
473 HG3 GLU 59 HG3 GLU 59 16.566 6.321 6.763
474 H LYS 60 HN LYS 60 13.655 3.953 8.392
475 HA LYS 60 HA LYS 60 11.574 5.505 7.259
476 HB2 LYS 60 HB2 LYS 60 12.085 5.073 10.229
477 HB3 LYS 60 HB3 LYS 60 10.546 5.424 9.455
478 HG2 LYS 60 HG2 LYS 60 12.138 2.832 9.254
479 HG3 LYS 60 HG3 LYS 60 10.650 3.111 10.155
480 HD2 LYS 60 HD2 LYS 60 9.443 3.541 7.994
481 HD3 LYS 60 HD3 LYS 60 10.949 3.210 7.124
482 HE2 LYS 60 HE2 LYS 60 9.627 1.231 7.018
483 HE3 LYS 60 HE3 LYS 60 11.003 0.913 8.075
484 HZ1 LYS 60 HZ1 LYS 60 9.512 1.206 9.978
485 HZ2 LYS 60 HZ2 LYS 60 8.244 1.525 8.990
486 HZ3 LYS 60 HZ3 LYS 60 8.936 0.052 8.986
487 H LEU 61 HN LEU 61 14.390 6.495 9.119
488 HA LEU 61 HA LEU 61 13.303 8.850 10.228
489 HG LEU 61 HG LEU 61 15.486 6.436 10.891
490 HB2 LEU 61 HB2 LEU 61 16.230 8.326 9.529
491 HB3 LEU 61 HB3 LEU 61 15.622 9.476 10.714
492 HD11 LEU 61 HD11 LEU 61 17.053 8.491 12.498
493 HD12 LEU 61 HD12 LEU 61 17.061 6.728 12.746
494 HD13 LEU 61 HD13 LEU 61 17.707 7.415 11.244
495 HD21 LEU 61 HD21 LEU 61 13.489 7.332 11.940
496 HD22 LEU 61 HD22 LEU 61 14.614 6.801 13.195
497 HD23 LEU 61 HD23 LEU 61 14.445 8.538 12.836
498 H HIS 62 HN HIS 62 15.074 8.310 7.215
499 HA HIS 62 HA HIS 62 15.211 11.176 6.579
500 HD1 HIS 62 HD1 HIS 62 18.730 8.603 4.596
501 HD2 HIS 62 HD2 HIS 62 17.158 10.528 7.994
502 HE1 HIS 62 HE1 HIS 62 20.632 8.766 6.274
503 HB2 HIS 62 HB2 HIS 62 15.915 8.708 4.936
504 HB3 HIS 62 HB3 HIS 62 16.281 10.380 4.507
505 H THR 63 HN THR 63 13.356 12.197 5.710
506 HA THR 63 HA THR 63 11.481 10.533 4.146
507 HB THR 63 HB THR 63 9.774 11.998 5.299
508 HG1 THR 63 HG1 THR 63 10.463 13.108 7.124
509 HG21 THR 63 HG21 THR 63 10.360 9.660 6.021
510 HG22 THR 63 HG22 THR 63 11.511 10.353 7.185
511 HG23 THR 63 HG23 THR 63 9.773 10.692 7.342
512 H VAL 64 HN VAL 64 10.191 11.483 2.599
513 HA VAL 64 HA VAL 64 10.715 14.289 1.803
514 HB VAL 64 HB VAL 64 9.956 13.618 -0.423
515 HG11 VAL 64 HG11 VAL 64 12.337 11.897 0.194
516 HG12 VAL 64 HG12 VAL 64 11.982 12.799 -1.283
517 HG13 VAL 64 HG13 VAL 64 12.433 13.665 0.203
518 HG21 VAL 64 HG21 VAL 64 10.166 10.726 0.466
519 HG22 VAL 64 HG22 VAL 64 8.679 11.601 0.022
520 HG23 VAL 64 HG23 VAL 64 9.917 11.296 -1.198
521 H LYS 65 HN LYS 65 8.670 15.222 0.849
522 HA LYS 65 HA LYS 65 6.186 13.926 1.862
523 HB2 LYS 65 HB2 LYS 65 6.882 15.884 3.297
524 HB3 LYS 65 HB3 LYS 65 6.718 16.917 1.867
525 HG2 LYS 65 HG2 LYS 65 4.324 16.270 1.681
526 HG3 LYS 65 HG3 LYS 65 4.501 15.216 3.099
527 HD2 LYS 65 HD2 LYS 65 5.071 17.186 4.490
528 HD3 LYS 65 HD3 LYS 65 4.925 18.238 3.063
529 HE2 LYS 65 HE2 LYS 65 2.543 17.556 2.812
530 HE3 LYS 65 HE3 LYS 65 2.687 16.523 4.240
531 HZ1 LYS 65 HZ1 LYS 65 3.135 18.517 5.555
532 HZ2 LYS 65 HZ2 LYS 65 2.999 19.472 4.234
533 HZ3 LYS 65 HZ3 LYS 65 1.705 18.656 4.790
534 H VAL 66 HN VAL 66 4.792 13.606 0.214
535 HA VAL 66 HA VAL 66 5.462 14.413 -2.483
536 HB VAL 66 HB VAL 66 3.046 13.015 -1.246
537 HG11 VAL 66 HG11 VAL 66 2.268 14.058 -3.338
538 HG12 VAL 66 HG12 VAL 66 3.693 13.451 -4.212
539 HG13 VAL 66 HG13 VAL 66 2.467 12.326 -3.587
540 HG21 VAL 66 HG21 VAL 66 5.186 11.732 -1.202
541 HG22 VAL 66 HG22 VAL 66 4.028 11.010 -2.321
542 HG23 VAL 66 HG23 VAL 66 5.375 11.980 -2.946
543 H LEU 67 HN LEU 67 4.535 15.984 -3.769
544 HA LEU 67 HA LEU 67 2.645 17.901 -2.460
545 HG LEU 67 HG LEU 67 5.810 18.102 -2.393
546 HB2 LEU 67 HB2 LEU 67 4.713 18.422 -4.625
547 HB3 LEU 67 HB3 LEU 67 3.633 19.612 -3.910
548 HD11 LEU 67 HD11 LEU 67 6.741 19.594 -4.070
549 HD12 LEU 67 HD12 LEU 67 5.759 20.946 -3.470
550 HD13 LEU 67 HD13 LEU 67 7.045 20.238 -2.464
551 HD21 LEU 67 HD21 LEU 67 4.104 20.472 -1.519
552 HD22 LEU 67 HD22 LEU 67 4.008 18.817 -0.875
553 HD23 LEU 67 HD23 LEU 67 5.468 19.771 -0.613
554 H SER 68 HN SER 68 3.582 16.241 -5.531
555 HA SER 68 HA SER 68 0.839 15.702 -6.153
556 HG SER 68 HG SER 68 2.210 18.797 -8.420
557 HB2 SER 68 HB2 SER 68 0.977 16.857 -8.447
558 HB3 SER 68 HB3 SER 68 0.647 17.881 -7.050
559 H ALA 69 HN ALA 69 0.767 14.316 -8.213
560 HA ALA 69 HA ALA 69 3.279 13.479 -9.354
561 HB1 ALA 69 HB1 ALA 69 3.315 12.105 -7.293
562 HB2 ALA 69 HB2 ALA 69 1.680 11.496 -7.655
563 HB3 ALA 69 HB3 ALA 69 3.046 11.079 -8.710
564 H SER 70 HN SER 70 2.923 11.921 -11.116
565 HA SER 70 HA SER 70 0.228 11.243 -11.979
566 HG SER 70 HG SER 70 0.038 13.638 -11.728
567 HB2 SER 70 HB2 SER 70 1.851 13.317 -13.539
568 HB3 SER 70 HB3 SER 70 0.441 12.462 -14.184
569 H SER 71 HN SER 71 0.304 9.760 -13.835
570 HA SER 71 HA SER 71 2.457 8.016 -14.062
571 HG SER 71 HG SER 71 -0.855 7.126 -15.178
572 HB2 SER 71 HB2 SER 71 0.444 8.703 -16.237
573 HB3 SER 71 HB3 SER 71 1.292 7.163 -16.001
574 H TYR 72 HN TYR 72 4.091 7.704 -15.741
575 HA TYR 72 HA TYR 72 5.481 10.132 -16.190
576 HD1 TYR 72 HD1 TYR 72 8.123 10.330 -16.529
577 HD2 TYR 72 HD2 TYR 72 6.914 7.265 -19.318
578 HE1 TYR 72 HE1 TYR 72 9.818 11.128 -18.139
579 HE2 TYR 72 HE2 TYR 72 8.610 8.059 -20.930
580 HH TYR 72 HH TYR 72 10.324 9.592 -21.342
581 HB2 TYR 72 HB2 TYR 72 6.751 8.157 -15.849
582 HB3 TYR 72 HB3 TYR 72 5.938 7.311 -17.167
583 H SER 73 HN SER 73 5.752 11.433 -17.887
584 HA SER 73 HA SER 73 5.176 10.606 -20.590
585 HG SER 73 HG SER 73 2.169 12.425 -19.336
586 HB2 SER 73 HB2 SER 73 4.063 13.202 -19.472
587 HB3 SER 73 HB3 SER 73 3.887 12.631 -21.131
588 HA PRO 74 HA PRO 74 9.097 12.607 -20.657
589 HB2 PRO 74 HB2 PRO 74 9.191 13.679 -23.256
590 HB3 PRO 74 HB3 PRO 74 9.585 11.993 -22.789
591 HG2 PRO 74 HG2 PRO 74 7.031 13.110 -23.939
592 HG3 PRO 74 HG3 PRO 74 7.825 11.544 -24.295
593 HD2 PRO 74 HD2 PRO 74 5.673 11.733 -22.639
594 HD3 PRO 74 HD3 PRO 74 6.996 10.573 -22.311
595 H ASP 75 HN ASP 75 6.610 14.670 -22.260
596 HA ASP 75 HA ASP 75 7.849 17.144 -21.626
597 HB2 ASP 75 HB2 ASP 75 6.057 17.036 -23.291
598 HB3 ASP 75 HB3 ASP 75 4.909 16.458 -22.081
599 H GLU 76 HN GLU 76 5.251 15.356 -19.882
600 HA GLU 76 HA GLU 76 4.948 17.322 -17.877
601 HB2 GLU 76 HB2 GLU 76 4.378 14.337 -17.674
602 HB3 GLU 76 HB3 GLU 76 3.814 15.571 -16.552
603 HG2 GLU 76 HG2 GLU 76 2.581 16.709 -18.380
604 HG3 GLU 76 HG3 GLU 76 3.090 15.452 -19.510
605 H TRP 77 HN TRP 77 7.282 14.664 -18.142
606 HA TRP 77 HA TRP 77 8.275 14.750 -15.464
607 HD1 TRP 77 HD1 TRP 77 10.559 13.844 -14.445
608 HE1 TRP 77 HE1 TRP 77 13.095 13.628 -14.395
609 HE3 TRP 77 HE3 TRP 77 11.407 13.341 -19.467
610 HZ2 TRP 77 HZ2 TRP 77 15.264 13.403 -16.317
611 HZ3 TRP 77 HZ3 TRP 77 13.721 13.147 -20.333
612 HH2 TRP 77 HH2 TRP 77 15.658 13.199 -18.771
613 HB2 TRP 77 HB2 TRP 77 8.825 12.879 -16.819
614 HB3 TRP 77 HB3 TRP 77 9.386 13.883 -18.137
615 H GLU 78 HN GLU 78 9.529 16.366 -18.487
616 HA GLU 78 HA GLU 78 11.529 17.732 -16.932
617 HB2 GLU 78 HB2 GLU 78 10.488 18.247 -19.750
618 HB3 GLU 78 HB3 GLU 78 11.892 19.048 -19.025
619 HG2 GLU 78 HG2 GLU 78 12.925 16.779 -18.637
620 HG3 GLU 78 HG3 GLU 78 11.589 16.055 -19.529
621 H ARG 79 HN ARG 79 8.310 18.632 -18.080
622 HA ARG 79 HA ARG 79 8.304 21.378 -17.454
623 HE ARG 79 HE ARG 79 3.172 22.503 -18.145
624 HB2 ARG 79 HB2 ARG 79 6.771 20.084 -18.853
625 HB3 ARG 79 HB3 ARG 79 6.106 19.279 -17.426
626 HG2 ARG 79 HG2 ARG 79 5.028 21.346 -16.717
627 HG3 ARG 79 HG3 ARG 79 5.869 22.265 -18.005
628 HD2 ARG 79 HD2 ARG 79 4.863 20.809 -19.721
629 HD3 ARG 79 HD3 ARG 79 4.018 19.872 -18.477
630 HH11 ARG 79 HH11 ARG 79 3.170 20.065 -20.765
631 HH12 ARG 79 HH12 ARG 79 1.688 20.634 -21.462
632 HH21 ARG 79 HH21 ARG 79 1.205 23.258 -19.114
633 HH22 ARG 79 HH22 ARG 79 0.561 22.490 -20.514
634 H GLN 80 HN GLN 80 7.472 18.524 -15.357
635 HA GLN 80 HA GLN 80 6.943 20.181 -13.064
636 HB2 GLN 80 HB2 GLN 80 7.534 17.219 -13.407
637 HB3 GLN 80 HB3 GLN 80 7.297 17.968 -11.818
638 HG2 GLN 80 HG2 GLN 80 5.071 18.696 -12.361
639 HG3 GLN 80 HG3 GLN 80 5.255 18.236 -14.051
640 HE21 GLN 80 HE22 GLN 80 5.250 16.022 -14.639
641 HE22 GLN 80 HE21 GLN 80 4.480 14.823 -13.598
642 H CYS 81 HN CYS 81 9.884 18.405 -14.230
643 HA CYS 81 HA CYS 81 11.459 18.884 -11.938
644 HG CYS 81 HG CYS 81 10.850 16.535 -14.112
645 HB2 CYS 81 HB2 CYS 81 12.273 18.543 -14.846
646 HB3 CYS 81 HB3 CYS 81 13.401 18.539 -13.478
647 H LYS 82 HN LYS 82 10.796 21.067 -14.653
648 HA LYS 82 HA LYS 82 12.923 22.894 -14.192
649 HB2 LYS 82 HB2 LYS 82 10.205 23.095 -15.534
650 HB3 LYS 82 HB3 LYS 82 11.272 24.497 -15.419
651 HG2 LYS 82 HG2 LYS 82 12.980 23.498 -16.729
652 HG3 LYS 82 HG3 LYS 82 12.285 21.880 -16.596
653 HD2 LYS 82 HD2 LYS 82 10.355 22.536 -17.953
654 HD3 LYS 82 HD3 LYS 82 10.943 24.208 -18.023
655 HE2 LYS 82 HE2 LYS 82 12.989 23.448 -19.194
656 HE3 LYS 82 HE3 LYS 82 12.407 21.777 -19.142
657 HZ1 LYS 82 HZ1 LYS 82 10.991 24.004 -20.506
658 HZ2 LYS 82 HZ2 LYS 82 11.946 22.909 -21.266
659 HZ3 LYS 82 HZ3 LYS 82 10.563 22.424 -20.550
660 H VAL 83 HN VAL 83 9.864 22.378 -12.483
661 HA VAL 83 HA VAL 83 9.695 24.979 -11.432
662 HB VAL 83 HB VAL 83 8.630 22.369 -10.285
663 HG11 VAL 83 HG11 VAL 83 7.722 25.241 -9.765
664 HG12 VAL 83 HG12 VAL 83 6.928 23.771 -9.158
665 HG13 VAL 83 HG13 VAL 83 8.550 24.188 -8.602
666 HG21 VAL 83 HG21 VAL 83 7.786 22.765 -12.583
667 HG22 VAL 83 HG22 VAL 83 6.502 23.010 -11.405
668 HG23 VAL 83 HG23 VAL 83 7.309 24.413 -12.138
669 H ALA 84 HN ALA 84 11.646 22.166 -10.488
670 HA ALA 84 HA ALA 84 12.285 22.819 -7.819
671 HB1 ALA 84 HB1 ALA 84 14.022 21.451 -9.920
672 HB2 ALA 84 HB2 ALA 84 14.211 21.351 -8.165
673 HB3 ALA 84 HB3 ALA 84 12.774 20.655 -8.926
674 H GLY 85 HN GLY 85 13.524 24.232 -10.837
675 HA2 GLY 85 HA2 GLY 85 15.382 25.960 -9.246
676 HA3 GLY 85 HA3 GLY 85 15.700 25.388 -10.890
677 H LYS 86 HN LYS 86 12.397 26.127 -10.474
678 HA LYS 86 HA LYS 86 11.086 27.498 -11.693
679 HB2 LYS 86 HB2 LYS 86 12.840 29.716 -10.566
680 HB3 LYS 86 HB3 LYS 86 11.193 29.885 -11.166
681 HG2 LYS 86 HG2 LYS 86 12.031 28.282 -8.708
682 HG3 LYS 86 HG3 LYS 86 11.332 29.896 -8.703
683 HD2 LYS 86 HD2 LYS 86 9.206 29.068 -9.582
684 HD3 LYS 86 HD3 LYS 86 9.891 27.460 -9.843
685 HE2 LYS 86 HE2 LYS 86 8.584 27.363 -7.836
686 HE3 LYS 86 HE3 LYS 86 10.290 27.185 -7.437
687 HZ1 LYS 86 HZ1 LYS 86 10.239 29.611 -6.842
688 HZ2 LYS 86 HZ2 LYS 86 8.608 29.584 -7.009
689 HZ3 LYS 86 HZ3 LYS 86 9.350 28.646 -5.874
690 H THR 87 HN THR 87 13.010 26.233 -13.151
691 HA THR 87 HA THR 87 14.713 27.888 -14.619
692 HB THR 87 HB THR 87 13.701 25.136 -15.395
693 HG1 THR 87 HG1 THR 87 15.233 24.332 -13.937
694 HG21 THR 87 HG21 THR 87 16.445 26.451 -15.655
695 HG22 THR 87 HG22 THR 87 16.055 24.774 -16.106
696 HG23 THR 87 HG23 THR 87 15.315 26.116 -16.986
697 H GLN 88 HN GLN 88 11.313 27.171 -15.065
698 HA GLN 88 HA GLN 88 11.200 28.990 -17.313
699 HB2 GLN 88 HB2 GLN 88 11.406 26.668 -18.326
700 HB3 GLN 88 HB3 GLN 88 9.910 26.224 -17.481
701 HG2 GLN 88 HG2 GLN 88 8.693 27.980 -18.728
702 HG3 GLN 88 HG3 GLN 88 10.182 28.445 -19.557
703 HE21 GLN 88 HE22 GLN 88 7.707 27.540 -20.830
704 HE22 GLN 88 HE21 GLN 88 8.090 26.070 -21.692
Start of MODEL 20
1 HA MET 1 HA MET 1 4.021 -2.184 -2.452
2 H1 MET 1 H1 MET 1 2.440 -2.557 -0.719
3 H2 MET 1 H2 MET 1 3.940 -2.253 -0.097
4 H3 MET 1 H3 MET 1 2.781 -1.095 -0.035
5 HB2 MET 1 HB2 MET 1 1.695 -1.417 -2.862
6 HB3 MET 1 HB3 MET 1 2.106 0.178 -2.213
7 HG2 MET 1 HG2 MET 1 2.164 0.176 -4.662
8 HG3 MET 1 HG3 MET 1 3.761 0.505 -4.003
9 HE1 MET 1 HE1 MET 1 4.722 -1.247 -7.300
10 HE2 MET 1 HE2 MET 1 3.369 -0.128 -7.031
11 HE3 MET 1 HE3 MET 1 4.935 0.167 -6.244
12 H GLU 2 HN GLU 2 5.875 -1.200 -3.133
13 HA GLU 2 HA GLU 2 6.908 1.149 -1.662
14 HB2 GLU 2 HB2 GLU 2 8.524 -1.379 -2.214
15 HB3 GLU 2 HB3 GLU 2 9.052 0.097 -1.416
16 HG2 GLU 2 HG2 GLU 2 8.734 -1.299 0.390
17 HG3 GLU 2 HG3 GLU 2 7.216 -0.409 0.355
18 H TRP 3 HN TRP 3 8.642 2.198 -2.972
19 HA TRP 3 HA TRP 3 8.311 1.701 -5.876
20 HD1 TRP 3 HD1 TRP 3 6.159 3.632 -2.746
21 HE1 TRP 3 HE1 TRP 3 3.647 3.258 -3.041
22 HE3 TRP 3 HE3 TRP 3 6.010 3.238 -7.842
23 HZ2 TRP 3 HZ2 TRP 3 1.798 2.789 -5.231
24 HZ3 TRP 3 HZ3 TRP 3 3.867 2.803 -9.011
25 HH2 TRP 3 HH2 TRP 3 1.755 2.580 -7.715
26 HB2 TRP 3 HB2 TRP 3 8.085 4.348 -4.401
27 HB3 TRP 3 HB3 TRP 3 7.853 4.102 -6.112
28 H LEU 4 HN LEU 4 9.913 3.154 -7.063
29 HA LEU 4 HA LEU 4 12.548 3.229 -5.674
30 HG LEU 4 HG LEU 4 14.143 2.993 -8.376
31 HB2 LEU 4 HB2 LEU 4 12.231 1.133 -6.908
32 HB3 LEU 4 HB3 LEU 4 11.803 2.055 -8.359
33 HD11 LEU 4 HD11 LEU 4 14.815 2.653 -6.050
34 HD12 LEU 4 HD12 LEU 4 14.585 0.900 -6.196
35 HD13 LEU 4 HD13 LEU 4 15.876 1.716 -7.102
36 HD21 LEU 4 HD21 LEU 4 13.430 1.068 -9.783
37 HD22 LEU 4 HD22 LEU 4 15.131 0.951 -9.309
38 HD23 LEU 4 HD23 LEU 4 13.913 -0.048 -8.487
39 H VAL 5 HN VAL 5 13.549 5.012 -6.028
40 HA VAL 5 HA VAL 5 12.741 7.111 -7.980
41 HB VAL 5 HB VAL 5 15.180 6.951 -6.154
42 HG11 VAL 5 HG11 VAL 5 15.479 8.572 -7.926
43 HG12 VAL 5 HG12 VAL 5 13.874 9.259 -7.612
44 HG13 VAL 5 HG13 VAL 5 15.183 9.426 -6.415
45 HG21 VAL 5 HG21 VAL 5 13.274 6.878 -4.670
46 HG22 VAL 5 HG22 VAL 5 13.866 8.532 -4.653
47 HG23 VAL 5 HG23 VAL 5 12.421 8.110 -5.610
48 H LYS 6 HN LYS 6 13.231 6.611 -9.991
49 HA LYS 6 HA LYS 6 15.708 5.117 -10.710
50 HB2 LYS 6 HB2 LYS 6 13.073 5.603 -12.038
51 HB3 LYS 6 HB3 LYS 6 14.466 5.198 -13.025
52 HG2 LYS 6 HG2 LYS 6 13.941 3.442 -10.643
53 HG3 LYS 6 HG3 LYS 6 12.838 3.319 -12.002
54 HD2 LYS 6 HD2 LYS 6 14.649 1.657 -12.124
55 HD3 LYS 6 HD3 LYS 6 14.575 2.716 -13.534
56 HE2 LYS 6 HE2 LYS 6 16.485 4.033 -12.702
57 HE3 LYS 6 HE3 LYS 6 16.540 3.050 -11.225
58 HZ1 LYS 6 HZ1 LYS 6 17.030 2.036 -13.969
59 HZ2 LYS 6 HZ2 LYS 6 18.172 2.315 -12.844
60 HZ3 LYS 6 HZ3 LYS 6 17.084 1.128 -12.610
61 H LYS 7 HN LYS 7 14.333 8.324 -10.779
62 HA LYS 7 HA LYS 7 16.795 9.439 -11.824
63 HB2 LYS 7 HB2 LYS 7 14.167 10.017 -13.237
64 HB3 LYS 7 HB3 LYS 7 15.568 11.084 -13.269
65 HG2 LYS 7 HG2 LYS 7 16.962 9.320 -14.261
66 HG3 LYS 7 HG3 LYS 7 15.585 8.211 -14.258
67 HD2 LYS 7 HD2 LYS 7 14.338 9.759 -15.761
68 HD3 LYS 7 HD3 LYS 7 15.778 10.805 -15.830
69 HE2 LYS 7 HE2 LYS 7 17.117 8.892 -16.696
70 HE3 LYS 7 HE3 LYS 7 15.698 7.849 -16.614
71 HZ1 LYS 7 HZ1 LYS 7 16.051 8.687 -18.848
72 HZ2 LYS 7 HZ2 LYS 7 14.640 9.274 -18.284
73 HZ3 LYS 7 HZ3 LYS 7 15.964 10.235 -18.358
74 H SER 8 HN SER 8 17.009 11.594 -10.921
75 HA SER 8 HA SER 8 14.896 12.654 -9.133
76 HG SER 8 HG SER 8 18.499 11.992 -8.753
77 HB2 SER 8 HB2 SER 8 16.827 12.813 -7.408
78 HB3 SER 8 HB3 SER 8 15.996 11.267 -7.610
79 H CYS 9 HN CYS 9 15.146 14.886 -8.899
80 HA CYS 9 HA CYS 9 17.346 16.221 -10.425
81 HG CYS 9 HG CYS 9 14.307 16.492 -12.966
82 HB2 CYS 9 HB2 CYS 9 14.356 16.798 -10.408
83 HB3 CYS 9 HB3 CYS 9 15.584 17.894 -11.071
84 H CYS 10 HN CYS 10 18.585 16.984 -8.840
85 HA CYS 10 HA CYS 10 17.797 17.878 -6.278
86 HG CYS 10 HG CYS 10 21.674 16.909 -6.705
87 HB2 CYS 10 HB2 CYS 10 20.209 18.697 -7.950
88 HB3 CYS 10 HB3 CYS 10 20.032 18.887 -6.199
89 H ASN 11 HN ASN 11 17.406 19.973 -5.456
90 HA ASN 11 HA ASN 11 17.564 22.336 -7.177
91 HB2 ASN 11 HB2 ASN 11 15.406 22.996 -7.257
92 HB3 ASN 11 HB3 ASN 11 15.162 21.269 -7.458
93 HD21 ASN 11 HD22 ASN 11 14.782 20.045 -5.301
94 HD22 ASN 11 HD21 ASN 11 13.763 20.817 -4.143
95 H LYS 12 HN LYS 12 17.735 24.174 -6.007
96 HA LYS 12 HA LYS 12 17.464 24.046 -3.044
97 HB2 LYS 12 HB2 LYS 12 19.739 24.880 -4.766
98 HB3 LYS 12 HB3 LYS 12 19.246 26.162 -3.674
99 HG2 LYS 12 HG2 LYS 12 19.740 23.317 -2.754
100 HG3 LYS 12 HG3 LYS 12 21.011 24.555 -2.807
101 HD2 LYS 12 HD2 LYS 12 19.675 26.023 -1.313
102 HD3 LYS 12 HD3 LYS 12 18.416 24.788 -1.201
103 HE2 LYS 12 HE2 LYS 12 20.061 23.189 -0.230
104 HE3 LYS 12 HE3 LYS 12 21.325 24.418 -0.346
105 HZ1 LYS 12 HZ1 LYS 12 20.392 24.324 1.872
106 HZ2 LYS 12 HZ2 LYS 12 20.060 25.777 1.217
107 HZ3 LYS 12 HZ3 LYS 12 18.890 24.640 1.329
108 H GLN 13 HN GLN 13 16.411 25.381 -5.992
109 HA GLN 13 HA GLN 13 16.070 28.059 -5.251
110 HB2 GLN 13 HB2 GLN 13 14.530 26.374 -7.301
111 HB3 GLN 13 HB3 GLN 13 14.519 28.134 -7.202
112 HG2 GLN 13 HG2 GLN 13 16.078 27.946 -8.812
113 HG3 GLN 13 HG3 GLN 13 17.172 27.856 -7.446
114 HE21 GLN 13 HE22 GLN 13 16.810 26.608 -10.390
115 HE22 GLN 13 HE21 GLN 13 17.387 24.980 -10.171
116 H ASP 14 HN ASP 14 13.938 25.198 -4.773
117 HA ASP 14 HA ASP 14 12.383 26.910 -2.897
118 HB2 ASP 14 HB2 ASP 14 11.404 26.927 -5.322
119 HB3 ASP 14 HB3 ASP 14 10.872 25.289 -4.956
120 H ASN 15 HN ASN 15 14.003 24.198 -3.191
121 HA ASN 15 HA ASN 15 14.304 22.309 -2.113
122 HB2 ASN 15 HB2 ASN 15 13.865 23.380 0.009
123 HB3 ASN 15 HB3 ASN 15 12.123 23.183 -0.201
124 HD21 ASN 15 HD22 ASN 15 15.174 21.199 0.020
125 HD22 ASN 15 HD21 ASN 15 14.341 19.772 0.601
126 H ARG 16 HN ARG 16 11.437 23.009 -3.708
127 HA ARG 16 HA ARG 16 10.150 20.410 -3.475
128 HE ARG 16 HE ARG 16 7.807 25.222 -4.566
129 HB2 ARG 16 HB2 ARG 16 9.743 22.626 -5.508
130 HB3 ARG 16 HB3 ARG 16 8.751 21.163 -5.342
131 HG2 ARG 16 HG2 ARG 16 8.233 21.837 -2.969
132 HG3 ARG 16 HG3 ARG 16 9.092 23.346 -3.229
133 HD2 ARG 16 HD2 ARG 16 6.686 22.468 -4.882
134 HD3 ARG 16 HD3 ARG 16 6.600 23.510 -3.461
135 HH11 ARG 16 HH11 ARG 16 7.005 22.568 -6.890
136 HH12 ARG 16 HH12 ARG 16 7.663 23.512 -8.210
137 HH21 ARG 16 HH21 ARG 16 8.513 26.303 -6.267
138 HH22 ARG 16 HH22 ARG 16 8.470 25.631 -7.904
139 H HIS 17 HN HIS 17 11.541 18.846 -3.943
140 HA HIS 17 HA HIS 17 13.213 18.650 -6.344
141 HD1 HIS 17 HD1 HIS 17 13.855 18.829 -2.491
142 HD2 HIS 17 HD2 HIS 17 15.881 16.891 -5.624
143 HE1 HIS 17 HE1 HIS 17 16.313 19.464 -2.257
144 HB2 HIS 17 HB2 HIS 17 12.484 16.834 -3.987
145 HB3 HIS 17 HB3 HIS 17 13.402 16.248 -5.369
146 H VAL 18 HN VAL 18 12.944 16.726 -7.748
147 HA VAL 18 HA VAL 18 10.227 15.693 -7.918
148 HB VAL 18 HB VAL 18 11.412 16.466 -10.550
149 HG11 VAL 18 HG11 VAL 18 9.077 16.656 -11.201
150 HG12 VAL 18 HG12 VAL 18 9.248 15.180 -10.252
151 HG13 VAL 18 HG13 VAL 18 8.537 16.609 -9.503
152 HG21 VAL 18 HG21 VAL 18 10.326 18.679 -10.602
153 HG22 VAL 18 HG22 VAL 18 10.093 18.605 -8.854
154 HG23 VAL 18 HG23 VAL 18 11.731 18.618 -9.541
155 H LEU 19 HN LEU 19 10.209 13.637 -8.666
156 HA LEU 19 HA LEU 19 12.750 12.450 -9.593
157 HG LEU 19 HG LEU 19 10.718 12.312 -6.301
158 HB2 LEU 19 HB2 LEU 19 11.664 10.541 -7.840
159 HB3 LEU 19 HB3 LEU 19 13.210 11.357 -7.774
160 HD11 LEU 19 HD11 LEU 19 13.127 10.745 -5.349
161 HD12 LEU 19 HD12 LEU 19 11.773 11.333 -4.344
162 HD13 LEU 19 HD13 LEU 19 11.480 10.130 -5.603
163 HD21 LEU 19 HD21 LEU 19 12.079 14.231 -6.255
164 HD22 LEU 19 HD22 LEU 19 12.792 13.371 -4.911
165 HD23 LEU 19 HD23 LEU 19 13.584 13.309 -6.507
166 H MET 20 HN MET 20 12.395 10.156 -10.281
167 HA MET 20 HA MET 20 9.787 9.963 -11.716
168 HB2 MET 20 HB2 MET 20 11.816 10.171 -13.163
169 HB3 MET 20 HB3 MET 20 12.442 8.677 -12.435
170 HG2 MET 20 HG2 MET 20 10.450 7.458 -13.276
171 HG3 MET 20 HG3 MET 20 9.799 8.966 -13.914
172 HE1 MET 20 HE1 MET 20 13.489 6.738 -15.633
173 HE2 MET 20 HE2 MET 20 13.528 7.538 -14.047
174 HE3 MET 20 HE3 MET 20 12.471 6.144 -14.301
175 H LEU 21 HN LEU 21 8.609 8.922 -10.279
176 HA LEU 21 HA LEU 21 9.773 7.082 -8.288
177 HG LEU 21 HG LEU 21 8.112 6.633 -6.457
178 HB2 LEU 21 HB2 LEU 21 8.332 8.957 -7.623
179 HB3 LEU 21 HB3 LEU 21 7.031 8.398 -8.670
180 HD11 LEU 21 HD11 LEU 21 5.899 8.725 -6.184
181 HD12 LEU 21 HD12 LEU 21 6.417 7.569 -4.937
182 HD13 LEU 21 HD13 LEU 21 7.514 8.852 -5.466
183 HD21 LEU 21 HD21 LEU 21 5.390 6.910 -7.872
184 HD22 LEU 21 HD22 LEU 21 6.509 5.544 -8.000
185 HD23 LEU 21 HD23 LEU 21 5.680 5.858 -6.477
186 H CYS 22 HN CYS 22 9.644 4.898 -8.705
187 HA CYS 22 HA CYS 22 7.799 3.966 -10.861
188 HG CYS 22 HG CYS 22 10.787 5.678 -10.922
189 HB2 CYS 22 HB2 CYS 22 10.702 3.173 -10.360
190 HB3 CYS 22 HB3 CYS 22 9.671 2.658 -11.706
191 H ASP 23 HN ASP 23 7.620 1.559 -10.857
192 HA ASP 23 HA ASP 23 6.908 0.340 -8.362
193 HB2 ASP 23 HB2 ASP 23 6.077 -0.785 -10.221
194 HB3 ASP 23 HB3 ASP 23 7.529 -0.511 -11.175
195 H ALA 24 HN ALA 24 8.142 -1.098 -7.000
196 HA ALA 24 HA ALA 24 10.960 -0.604 -6.720
197 HB1 ALA 24 HB1 ALA 24 9.139 -2.675 -5.439
198 HB2 ALA 24 HB2 ALA 24 10.822 -2.351 -4.972
199 HB3 ALA 24 HB3 ALA 24 9.600 -1.088 -4.778
200 H GLY 25 HN GLY 25 11.509 -1.050 -8.961
201 HA2 GLY 25 HA2 GLY 25 12.944 -3.248 -9.707
202 HA3 GLY 25 HA3 GLY 25 11.261 -3.737 -10.022
203 H GLY 26 HN GLY 26 10.729 -0.723 -10.519
204 HA2 GLY 26 HA2 GLY 26 10.974 0.878 -12.150
205 HA3 GLY 26 HA3 GLY 26 12.151 -0.127 -12.999
206 H ALA 27 HN ALA 27 9.273 -1.949 -12.320
207 HA ALA 27 HA ALA 27 8.909 -2.311 -15.131
208 HB1 ALA 27 HB1 ALA 27 8.540 -4.071 -13.419
209 HB2 ALA 27 HB2 ALA 27 7.118 -3.181 -12.822
210 HB3 ALA 27 HB3 ALA 27 7.125 -3.852 -14.464
211 H ILE 28 HN ILE 28 7.527 0.041 -13.027
212 HA ILE 28 HA ILE 28 5.623 0.998 -15.056
213 HB ILE 28 HB ILE 28 4.936 0.560 -12.104
214 HG12 ILE 28 HG12 ILE 28 3.805 -0.826 -14.577
215 HG13 ILE 28 HG13 ILE 28 4.811 -1.565 -13.329
216 HG21 ILE 28 HG21 ILE 28 3.940 2.652 -13.007
217 HG22 ILE 28 HG22 ILE 28 3.208 1.726 -14.339
218 HG23 ILE 28 HG23 ILE 28 2.706 1.473 -12.653
219 HD11 ILE 28 HD11 ILE 28 1.956 -0.612 -13.001
220 HD12 ILE 28 HD12 ILE 28 2.588 -2.260 -12.912
221 HD13 ILE 28 HD13 ILE 28 3.010 -1.091 -11.644
222 H LYS 29 HN LYS 29 5.517 3.374 -14.851
223 HA LYS 29 HA LYS 29 7.438 4.550 -12.912
224 HB2 LYS 29 HB2 LYS 29 7.547 5.030 -15.920
225 HB3 LYS 29 HB3 LYS 29 8.480 5.865 -14.674
226 HG2 LYS 29 HG2 LYS 29 9.295 3.452 -14.002
227 HG3 LYS 29 HG3 LYS 29 8.721 2.976 -15.597
228 HD2 LYS 29 HD2 LYS 29 10.289 4.452 -16.692
229 HD3 LYS 29 HD3 LYS 29 10.605 5.320 -15.196
230 HE2 LYS 29 HE2 LYS 29 12.522 3.957 -15.649
231 HE3 LYS 29 HE3 LYS 29 11.728 3.342 -14.211
232 HZ1 LYS 29 HZ1 LYS 29 11.376 2.188 -16.937
233 HZ2 LYS 29 HZ2 LYS 29 12.403 1.597 -15.825
234 HZ3 LYS 29 HZ3 LYS 29 10.800 1.534 -15.542
235 H MET 30 HN MET 30 7.103 6.631 -12.376
236 HA MET 30 HA MET 30 4.683 8.094 -13.246
237 HB2 MET 30 HB2 MET 30 5.523 7.674 -10.353
238 HB3 MET 30 HB3 MET 30 4.077 8.435 -10.923
239 HG2 MET 30 HG2 MET 30 4.683 5.471 -11.277
240 HG3 MET 30 HG3 MET 30 3.819 6.144 -9.914
241 HE1 MET 30 HE1 MET 30 1.818 8.265 -10.907
242 HE2 MET 30 HE2 MET 30 0.410 7.219 -11.195
243 HE3 MET 30 HE3 MET 30 1.486 6.913 -9.806
244 H ILE 31 HN ILE 31 4.855 10.328 -12.108
245 HA ILE 31 HA ILE 31 7.666 11.264 -11.742
246 HB ILE 31 HB ILE 31 5.323 12.718 -12.966
247 HG12 ILE 31 HG12 ILE 31 8.044 12.450 -14.302
248 HG13 ILE 31 HG13 ILE 31 6.971 11.058 -14.332
249 HG21 ILE 31 HG21 ILE 31 8.045 13.724 -12.056
250 HG22 ILE 31 HG22 ILE 31 7.067 14.594 -13.256
251 HG23 ILE 31 HG23 ILE 31 6.444 14.352 -11.624
252 HD11 ILE 31 HD11 ILE 31 6.585 12.413 -16.287
253 HD12 ILE 31 HD12 ILE 31 5.147 12.405 -15.248
254 HD13 ILE 31 HD13 ILE 31 6.210 13.828 -15.274
255 H ALA 32 HN ALA 32 7.866 12.364 -9.707
256 HA ALA 32 HA ALA 32 5.373 13.084 -8.284
257 HB1 ALA 32 HB1 ALA 32 5.958 10.843 -7.435
258 HB2 ALA 32 HB2 ALA 32 7.612 11.400 -7.071
259 HB3 ALA 32 HB3 ALA 32 6.227 12.083 -6.193
260 H GLU 33 HN GLU 33 5.590 15.001 -7.292
261 HA GLU 33 HA GLU 33 8.248 16.317 -7.170
262 HB2 GLU 33 HB2 GLU 33 6.345 17.359 -8.566
263 HB3 GLU 33 HB3 GLU 33 5.476 17.602 -7.043
264 HG2 GLU 33 HG2 GLU 33 7.515 18.900 -6.222
265 HG3 GLU 33 HG3 GLU 33 8.172 18.763 -7.843
266 H VAL 34 HN VAL 34 8.968 16.886 -5.103
267 HA VAL 34 HA VAL 34 7.207 16.398 -2.787
268 HB VAL 34 HB VAL 34 8.729 14.794 -1.819
269 HG11 VAL 34 HG11 VAL 34 8.167 13.781 -4.631
270 HG12 VAL 34 HG12 VAL 34 8.359 12.832 -3.146
271 HG13 VAL 34 HG13 VAL 34 6.952 13.885 -3.344
272 HG21 VAL 34 HG21 VAL 34 10.409 15.028 -4.350
273 HG22 VAL 34 HG22 VAL 34 10.883 15.480 -2.694
274 HG23 VAL 34 HG23 VAL 34 10.616 13.781 -3.103
275 H LYS 35 HN LYS 35 8.138 17.220 -0.786
276 HA LYS 35 HA LYS 35 10.498 19.040 -1.148
277 HB2 LYS 35 HB2 LYS 35 8.267 19.003 0.943
278 HB3 LYS 35 HB3 LYS 35 9.860 19.643 1.334
279 HG2 LYS 35 HG2 LYS 35 9.622 21.060 -0.832
280 HG3 LYS 35 HG3 LYS 35 7.900 20.650 -0.707
281 HD2 LYS 35 HD2 LYS 35 7.778 21.678 1.515
282 HD3 LYS 35 HD3 LYS 35 9.527 22.004 1.481
283 HE2 LYS 35 HE2 LYS 35 9.224 23.441 -0.527
284 HE3 LYS 35 HE3 LYS 35 7.480 23.140 -0.479
285 HZ1 LYS 35 HZ1 LYS 35 7.417 24.239 1.686
286 HZ2 LYS 35 HZ2 LYS 35 9.030 24.509 1.647
287 HZ3 LYS 35 HZ3 LYS 35 8.053 25.239 0.570
288 H SER 36 HN SER 36 12.030 18.875 0.768
289 HA SER 36 HA SER 36 12.310 16.051 1.662
290 HG SER 36 HG SER 36 15.194 17.579 -0.752
291 HB2 SER 36 HB2 SER 36 14.552 15.966 0.659
292 HB3 SER 36 HB3 SER 36 13.311 16.221 -0.582
293 H ASP 37 HN ASP 37 13.719 15.753 3.407
294 HA ASP 37 HA ASP 37 15.018 18.193 4.550
295 HB2 ASP 37 HB2 ASP 37 12.967 17.528 5.809
296 HB3 ASP 37 HB3 ASP 37 13.696 15.954 6.121
297 H PHE 38 HN PHE 38 15.667 15.521 2.914
298 HA PHE 38 HA PHE 38 18.321 15.052 4.054
299 HD1 PHE 38 HD1 PHE 38 14.610 13.627 4.995
300 HD2 PHE 38 HD2 PHE 38 18.604 12.709 6.339
301 HE1 PHE 38 HE1 PHE 38 13.809 13.588 7.342
302 HE2 PHE 38 HE2 PHE 38 17.795 12.654 8.685
303 HZ PHE 38 HZ PHE 38 15.398 13.092 9.192
304 HB2 PHE 38 HB2 PHE 38 16.384 12.785 3.432
305 HB3 PHE 38 HB3 PHE 38 18.042 12.613 3.970
306 H ALA 39 HN ALA 39 19.627 13.847 2.351
307 HA ALA 39 HA ALA 39 19.146 14.808 -0.293
308 HB1 ALA 39 HB1 ALA 39 21.065 13.369 -0.896
309 HB2 ALA 39 HB2 ALA 39 21.409 14.310 0.568
310 HB3 ALA 39 HB3 ALA 39 20.988 12.583 0.695
311 H VAL 40 HN VAL 40 18.612 13.591 -2.197
312 HA VAL 40 HA VAL 40 17.460 10.891 -1.903
313 HB VAL 40 HB VAL 40 16.002 13.087 -3.436
314 HG11 VAL 40 HG11 VAL 40 15.169 10.317 -2.459
315 HG12 VAL 40 HG12 VAL 40 14.114 11.467 -3.303
316 HG13 VAL 40 HG13 VAL 40 15.517 10.784 -4.137
317 HG21 VAL 40 HG21 VAL 40 14.301 13.194 -1.685
318 HG22 VAL 40 HG22 VAL 40 15.292 12.159 -0.632
319 HG23 VAL 40 HG23 VAL 40 15.841 13.788 -1.089
320 H LYS 41 HN LYS 41 17.942 9.667 -3.777
321 HA LYS 41 HA LYS 41 18.806 10.979 -6.223
322 HB2 LYS 41 HB2 LYS 41 21.057 9.706 -6.177
323 HB3 LYS 41 HB3 LYS 41 20.895 11.239 -5.355
324 HG2 LYS 41 HG2 LYS 41 22.209 9.743 -4.009
325 HG3 LYS 41 HG3 LYS 41 20.713 10.137 -3.177
326 HD2 LYS 41 HD2 LYS 41 19.788 7.901 -4.051
327 HD3 LYS 41 HD3 LYS 41 21.414 7.561 -4.642
328 HE2 LYS 41 HE2 LYS 41 21.177 6.474 -2.519
329 HE3 LYS 41 HE3 LYS 41 22.265 7.849 -2.276
330 HZ1 LYS 41 HZ1 LYS 41 19.360 7.790 -1.643
331 HZ2 LYS 41 HZ2 LYS 41 20.572 7.670 -0.536
332 HZ3 LYS 41 HZ3 LYS 41 20.354 9.070 -1.361
333 H VAL 42 HN VAL 42 19.390 9.353 -7.898
334 HA VAL 42 HA VAL 42 17.513 7.374 -8.231
335 HB VAL 42 HB VAL 42 20.342 7.496 -9.392
336 HG11 VAL 42 HG11 VAL 42 19.212 6.298 -11.345
337 HG12 VAL 42 HG12 VAL 42 19.462 5.313 -9.905
338 HG13 VAL 42 HG13 VAL 42 17.850 5.972 -10.243
339 HG21 VAL 42 HG21 VAL 42 17.683 8.770 -10.052
340 HG22 VAL 42 HG22 VAL 42 19.260 9.561 -9.871
341 HG23 VAL 42 HG23 VAL 42 18.949 8.584 -11.306
342 H GLY 43 HN GLY 43 17.388 5.184 -8.061
343 HA2 GLY 43 HA2 GLY 43 17.748 3.086 -7.263
344 HA3 GLY 43 HA3 GLY 43 19.393 3.529 -6.759
345 H ASP 44 HN ASP 44 16.389 5.343 -5.855
346 HA ASP 44 HA ASP 44 17.053 4.565 -2.985
347 HB2 ASP 44 HB2 ASP 44 15.881 7.156 -4.010
348 HB3 ASP 44 HB3 ASP 44 15.402 6.491 -2.451
349 H LEU 45 HN LEU 45 15.419 3.681 -1.706
350 HA LEU 45 HA LEU 45 12.997 2.814 -3.158
351 HG LEU 45 HG LEU 45 11.290 1.817 -1.338
352 HB2 LEU 45 HB2 LEU 45 14.305 1.422 -1.359
353 HB3 LEU 45 HB3 LEU 45 13.599 2.542 -0.196
354 HD11 LEU 45 HD11 LEU 45 13.068 -0.576 -1.963
355 HD12 LEU 45 HD12 LEU 45 11.304 -0.489 -2.147
356 HD13 LEU 45 HD13 LEU 45 12.345 0.514 -3.165
357 HD21 LEU 45 HD21 LEU 45 11.799 1.449 0.979
358 HD22 LEU 45 HD22 LEU 45 11.105 -0.021 0.291
359 HD23 LEU 45 HD23 LEU 45 12.860 0.066 0.580
360 H LEU 46 HN LEU 46 10.891 3.525 -2.485
361 HA LEU 46 HA LEU 46 10.692 5.634 -0.415
362 HG LEU 46 HG LEU 46 11.330 6.563 -3.430
363 HB2 LEU 46 HB2 LEU 46 9.109 5.635 -3.017
364 HB3 LEU 46 HB3 LEU 46 8.889 6.736 -1.668
365 HD11 LEU 46 HD11 LEU 46 10.471 8.821 -4.261
366 HD12 LEU 46 HD12 LEU 46 9.449 7.440 -4.680
367 HD13 LEU 46 HD13 LEU 46 8.989 8.527 -3.350
368 HD21 LEU 46 HD21 LEU 46 10.549 8.561 -1.244
369 HD22 LEU 46 HD22 LEU 46 11.898 7.430 -1.188
370 HD23 LEU 46 HD23 LEU 46 11.939 8.768 -2.347
371 H SER 47 HN SER 47 9.172 5.040 1.021
372 HA SER 47 HA SER 47 6.951 3.272 0.145
373 HG SER 47 HG SER 47 9.203 0.958 1.779
374 HB2 SER 47 HB2 SER 47 8.420 2.848 2.770
375 HB3 SER 47 HB3 SER 47 7.114 1.872 2.092
376 HA PRO 48 HA PRO 48 4.739 6.489 2.117
377 HB2 PRO 48 HB2 PRO 48 2.339 5.303 2.793
378 HB3 PRO 48 HB3 PRO 48 2.812 5.709 1.119
379 HG2 PRO 48 HG2 PRO 48 3.037 3.037 2.526
380 HG3 PRO 48 HG3 PRO 48 2.414 3.376 0.880
381 HD2 PRO 48 HD2 PRO 48 4.959 2.502 1.308
382 HD3 PRO 48 HD3 PRO 48 4.592 3.693 0.023
383 H LEU 49 HN LEU 49 4.341 7.379 4.056
384 HA LEU 49 HA LEU 49 4.489 5.711 6.547
385 HG LEU 49 HG LEU 49 7.042 6.926 5.177
386 HB2 LEU 49 HB2 LEU 49 5.391 8.587 6.095
387 HB3 LEU 49 HB3 LEU 49 5.417 7.737 7.636
388 HD11 LEU 49 HD11 LEU 49 7.783 9.077 6.047
389 HD12 LEU 49 HD12 LEU 49 7.875 8.419 7.695
390 HD13 LEU 49 HD13 LEU 49 8.973 7.822 6.436
391 HD21 LEU 49 HD21 LEU 49 7.157 5.941 8.064
392 HD22 LEU 49 HD22 LEU 49 6.619 5.003 6.651
393 HD23 LEU 49 HD23 LEU 49 8.303 5.512 6.775
394 H GLN 50 HN GLN 50 3.114 8.466 4.800
395 HA GLN 50 HA GLN 50 0.466 7.896 5.723
396 HB2 GLN 50 HB2 GLN 50 -0.014 10.259 6.474
397 HB3 GLN 50 HB3 GLN 50 0.927 9.303 7.608
398 HG2 GLN 50 HG2 GLN 50 2.954 10.454 7.092
399 HG3 GLN 50 HG3 GLN 50 2.253 11.197 5.650
400 HE21 GLN 50 HE22 GLN 50 2.419 13.379 6.124
401 HE22 GLN 50 HE21 GLN 50 1.689 14.125 7.522
402 H ASN 51 HN ASN 51 -0.956 9.791 4.521
403 HA ASN 51 HA ASN 51 -0.646 9.391 1.807
404 HB2 ASN 51 HB2 ASN 51 -2.717 10.211 2.797
405 HB3 ASN 51 HB3 ASN 51 -1.953 11.739 3.244
406 HD21 ASN 51 HD22 ASN 51 -1.807 13.408 1.660
407 HD22 ASN 51 HD21 ASN 51 -2.389 13.211 0.031
408 H ALA 52 HN ALA 52 0.888 11.995 3.698
409 HA ALA 52 HA ALA 52 2.003 13.139 1.252
410 HB1 ALA 52 HB1 ALA 52 1.933 15.294 2.404
411 HB2 ALA 52 HB2 ALA 52 0.325 14.555 2.364
412 HB3 ALA 52 HB3 ALA 52 1.285 14.517 3.863
413 H LEU 53 HN LEU 53 3.177 11.005 3.387
414 HA LEU 53 HA LEU 53 5.819 12.237 3.233
415 HG LEU 53 HG LEU 53 4.744 13.579 5.616
416 HB2 LEU 53 HB2 LEU 53 4.702 11.010 5.772
417 HB3 LEU 53 HB3 LEU 53 6.414 11.043 5.441
418 HD11 LEU 53 HD11 LEU 53 5.697 13.830 7.879
419 HD12 LEU 53 HD12 LEU 53 4.723 12.359 7.773
420 HD13 LEU 53 HD13 LEU 53 6.496 12.249 7.734
421 HD21 LEU 53 HD21 LEU 53 6.876 13.862 4.389
422 HD22 LEU 53 HD22 LEU 53 6.959 14.665 5.953
423 HD23 LEU 53 HD23 LEU 53 7.770 13.103 5.716
424 H TYR 54 HN TYR 54 7.290 10.819 2.540
425 HA TYR 54 HA TYR 54 6.721 7.914 2.719
426 HD1 TYR 54 HD1 TYR 54 4.767 9.706 0.774
427 HD2 TYR 54 HD2 TYR 54 6.880 6.274 -0.754
428 HE1 TYR 54 HE1 TYR 54 2.687 8.901 -0.256
429 HE2 TYR 54 HE2 TYR 54 4.807 5.480 -1.829
430 HH TYR 54 HH TYR 54 1.691 7.244 -1.572
431 HB2 TYR 54 HB2 TYR 54 7.550 9.489 0.257
432 HB3 TYR 54 HB3 TYR 54 8.067 7.835 0.486
433 H CYS 55 HN CYS 55 8.597 6.731 3.127
434 HA CYS 55 HA CYS 55 10.842 8.174 4.287
435 HG CYS 55 HG CYS 55 11.591 4.759 2.532
436 HB2 CYS 55 HB2 CYS 55 11.756 6.001 4.748
437 HB3 CYS 55 HB3 CYS 55 10.038 6.002 5.178
438 H ILE 56 HN ILE 56 13.129 7.583 3.532
439 HA ILE 56 HA ILE 56 13.326 7.317 0.563
440 HB ILE 56 HB ILE 56 15.230 8.791 2.414
441 HG12 ILE 56 HG12 ILE 56 13.483 10.277 0.433
442 HG13 ILE 56 HG13 ILE 56 12.881 9.953 2.057
443 HG21 ILE 56 HG21 ILE 56 16.099 9.770 0.202
444 HG22 ILE 56 HG22 ILE 56 16.425 8.072 0.413
445 HG23 ILE 56 HG23 ILE 56 15.083 8.592 -0.632
446 HD11 ILE 56 HD11 ILE 56 13.982 12.156 1.956
447 HD12 ILE 56 HD12 ILE 56 14.765 11.057 3.091
448 HD13 ILE 56 HD13 ILE 56 15.509 11.390 1.524
449 H ASN 57 HN ASN 57 15.025 6.115 -0.160
450 HA ASN 57 HA ASN 57 16.774 4.794 -0.366
451 HB2 ASN 57 HB2 ASN 57 17.893 6.392 1.229
452 HB3 ASN 57 HB3 ASN 57 17.482 5.298 2.559
453 HD21 ASN 57 HD21 ASN 57 18.952 5.297 -0.715
454 HD22 ASN 57 HD22 ASN 57 20.209 4.107 -0.355
455 H ARG 58 HN ARG 58 15.691 4.073 2.933
456 HA ARG 58 HA ARG 58 14.519 1.576 2.385
457 HE ARG 58 HE ARG 58 17.835 -1.133 4.509
458 HB2 ARG 58 HB2 ARG 58 16.130 -0.009 3.264
459 HB3 ARG 58 HB3 ARG 58 16.882 0.849 1.939
460 HG2 ARG 58 HG2 ARG 58 17.969 2.383 3.699
461 HG3 ARG 58 HG3 ARG 58 17.389 1.257 4.923
462 HD2 ARG 58 HD2 ARG 58 19.204 0.542 2.584
463 HD3 ARG 58 HD3 ARG 58 19.744 0.847 4.244
464 HH11 ARG 58 HH11 ARG 58 20.909 -0.836 2.761
465 HH12 ARG 58 HH12 ARG 58 21.268 -2.520 2.810
466 HH21 ARG 58 HH21 ARG 58 18.305 -3.385 4.570
467 HH22 ARG 58 HH22 ARG 58 19.753 -3.999 3.870
468 H GLU 59 HN GLU 59 14.956 4.240 4.412
469 HA GLU 59 HA GLU 59 14.128 2.717 6.802
470 HB2 GLU 59 HB2 GLU 59 15.757 3.764 8.205
471 HB3 GLU 59 HB3 GLU 59 16.559 2.850 6.928
472 HG2 GLU 59 HG2 GLU 59 16.903 5.039 5.680
473 HG3 GLU 59 HG3 GLU 59 16.268 5.884 7.097
474 H LYS 60 HN LYS 60 12.867 3.758 8.161
475 HA LYS 60 HA LYS 60 11.158 5.674 6.987
476 HB2 LYS 60 HB2 LYS 60 11.259 4.730 9.879
477 HB3 LYS 60 HB3 LYS 60 9.924 5.606 9.122
478 HG2 LYS 60 HG2 LYS 60 9.680 3.725 7.462
479 HG3 LYS 60 HG3 LYS 60 10.911 2.822 8.359
480 HD2 LYS 60 HD2 LYS 60 9.501 2.905 10.396
481 HD3 LYS 60 HD3 LYS 60 8.261 3.812 9.501
482 HE2 LYS 60 HE2 LYS 60 8.023 1.920 7.911
483 HE3 LYS 60 HE3 LYS 60 9.263 1.016 8.789
484 HZ1 LYS 60 HZ1 LYS 60 6.648 1.846 9.912
485 HZ2 LYS 60 HZ2 LYS 60 7.047 0.337 9.446
486 HZ3 LYS 60 HZ3 LYS 60 7.798 1.011 10.723
487 H LEU 61 HN LEU 61 13.923 6.187 9.060
488 HA LEU 61 HA LEU 61 13.102 8.611 10.262
489 HG LEU 61 HG LEU 61 15.010 5.941 10.858
490 HB2 LEU 61 HB2 LEU 61 15.945 7.760 9.537
491 HB3 LEU 61 HB3 LEU 61 15.483 8.950 10.751
492 HD11 LEU 61 HD11 LEU 61 16.738 7.790 12.552
493 HD12 LEU 61 HD12 LEU 61 16.563 6.029 12.752
494 HD13 LEU 61 HD13 LEU 61 17.312 6.684 11.284
495 HD21 LEU 61 HD21 LEU 61 14.142 8.093 12.833
496 HD22 LEU 61 HD22 LEU 61 13.091 7.004 11.895
497 HD23 LEU 61 HD23 LEU 61 14.134 6.342 13.157
498 H HIS 62 HN HIS 62 14.539 7.933 7.121
499 HA HIS 62 HA HIS 62 15.106 10.801 6.608
500 HD1 HIS 62 HD1 HIS 62 18.314 7.772 4.685
501 HD2 HIS 62 HD2 HIS 62 16.995 10.016 7.993
502 HE1 HIS 62 HE1 HIS 62 20.193 7.702 6.397
503 HB2 HIS 62 HB2 HIS 62 15.582 8.324 4.897
504 HB3 HIS 62 HB3 HIS 62 16.142 9.959 4.549
505 H THR 63 HN THR 63 13.378 12.009 5.717
506 HA THR 63 HA THR 63 11.328 10.516 4.186
507 HB THR 63 HB THR 63 9.755 12.079 5.381
508 HG1 THR 63 HG1 THR 63 11.101 13.695 6.116
509 HG21 THR 63 HG21 THR 63 9.698 10.812 7.416
510 HG22 THR 63 HG22 THR 63 10.290 9.724 6.145
511 HG23 THR 63 HG23 THR 63 11.430 10.423 7.311
512 H VAL 64 HN VAL 64 10.081 11.554 2.713
513 HA VAL 64 HA VAL 64 10.804 14.295 1.813
514 HB VAL 64 HB VAL 64 9.777 13.381 -0.410
515 HG11 VAL 64 HG11 VAL 64 11.992 12.873 -1.299
516 HG12 VAL 64 HG12 VAL 64 12.002 14.282 -0.225
517 HG13 VAL 64 HG13 VAL 64 12.626 12.721 0.353
518 HG21 VAL 64 HG21 VAL 64 9.205 11.113 0.383
519 HG22 VAL 64 HG22 VAL 64 10.262 11.111 -1.037
520 HG23 VAL 64 HG23 VAL 64 10.934 10.745 0.564
521 H LYS 65 HN LYS 65 8.889 15.472 1.085
522 HA LYS 65 HA LYS 65 6.382 14.421 2.344
523 HB2 LYS 65 HB2 LYS 65 7.418 16.440 3.439
524 HB3 LYS 65 HB3 LYS 65 7.194 17.310 1.912
525 HG2 LYS 65 HG2 LYS 65 4.711 16.854 2.095
526 HG3 LYS 65 HG3 LYS 65 5.022 16.139 3.692
527 HD2 LYS 65 HD2 LYS 65 5.963 18.289 4.476
528 HD3 LYS 65 HD3 LYS 65 5.648 19.007 2.877
529 HE2 LYS 65 HE2 LYS 65 3.223 18.538 3.146
530 HE3 LYS 65 HE3 LYS 65 3.533 17.815 4.730
531 HZ1 LYS 65 HZ1 LYS 65 2.792 20.100 4.932
532 HZ2 LYS 65 HZ2 LYS 65 4.316 19.984 5.493
533 HZ3 LYS 65 HZ3 LYS 65 4.028 20.653 4.029
534 H VAL 66 HN VAL 66 4.658 14.153 0.933
535 HA VAL 66 HA VAL 66 5.377 14.440 -1.903
536 HB VAL 66 HB VAL 66 2.724 13.476 -0.761
537 HG11 VAL 66 HG11 VAL 66 4.087 13.046 -3.473
538 HG12 VAL 66 HG12 VAL 66 2.566 12.290 -2.952
539 HG13 VAL 66 HG13 VAL 66 2.646 14.036 -3.186
540 HG21 VAL 66 HG21 VAL 66 5.223 11.865 -1.462
541 HG22 VAL 66 HG22 VAL 66 4.506 12.045 0.155
542 HG23 VAL 66 HG23 VAL 66 3.623 11.183 -1.105
543 H LEU 67 HN LEU 67 4.460 15.858 -3.382
544 HA LEU 67 HA LEU 67 2.675 18.004 -2.289
545 HG LEU 67 HG LEU 67 5.840 17.962 -2.199
546 HB2 LEU 67 HB2 LEU 67 4.755 18.241 -4.487
547 HB3 LEU 67 HB3 LEU 67 3.784 19.539 -3.816
548 HD11 LEU 67 HD11 LEU 67 7.376 19.768 -2.570
549 HD12 LEU 67 HD12 LEU 67 6.856 19.138 -4.117
550 HD13 LEU 67 HD13 LEU 67 6.157 20.659 -3.529
551 HD21 LEU 67 HD21 LEU 67 5.724 19.815 -0.615
552 HD22 LEU 67 HD22 LEU 67 4.492 20.627 -1.611
553 HD23 LEU 67 HD23 LEU 67 4.131 19.083 -0.808
554 H SER 68 HN SER 68 3.680 16.119 -5.193
555 HA SER 68 HA SER 68 0.954 15.970 -6.231
556 HG SER 68 HG SER 68 1.790 19.179 -7.759
557 HB2 SER 68 HB2 SER 68 3.177 17.354 -7.821
558 HB3 SER 68 HB3 SER 68 1.542 17.002 -8.392
559 H ALA 69 HN ALA 69 0.895 14.310 -7.951
560 HA ALA 69 HA ALA 69 3.360 13.299 -9.013
561 HB1 ALA 69 HB1 ALA 69 3.315 11.969 -6.929
562 HB2 ALA 69 HB2 ALA 69 1.652 11.437 -7.292
563 HB3 ALA 69 HB3 ALA 69 3.005 10.934 -8.334
564 H SER 70 HN SER 70 2.984 11.860 -10.790
565 HA SER 70 HA SER 70 0.238 11.595 -11.870
566 HG SER 70 HG SER 70 0.095 14.169 -12.172
567 HB2 SER 70 HB2 SER 70 2.446 13.089 -13.362
568 HB3 SER 70 HB3 SER 70 0.786 12.828 -13.908
569 H SER 71 HN SER 71 0.262 10.209 -13.873
570 HA SER 71 HA SER 71 2.186 8.103 -13.922
571 HG SER 71 HG SER 71 -1.096 7.610 -15.349
572 HB2 SER 71 HB2 SER 71 0.428 9.110 -16.198
573 HB3 SER 71 HB3 SER 71 1.107 7.483 -16.002
574 H TYR 72 HN TYR 72 3.980 7.763 -15.436
575 HA TYR 72 HA TYR 72 5.503 10.141 -15.836
576 HD1 TYR 72 HD2 TYR 72 8.370 9.788 -15.594
577 HD2 TYR 72 HD1 TYR 72 6.835 7.838 -19.125
578 HE1 TYR 72 HE2 TYR 72 10.238 10.718 -16.905
579 HE2 TYR 72 HE1 TYR 72 8.711 8.765 -20.451
580 HH TYR 72 HH TYR 72 11.272 10.823 -19.001
581 HB2 TYR 72 HB2 TYR 72 6.606 8.020 -15.458
582 HB3 TYR 72 HB3 TYR 72 5.899 7.337 -16.926
583 H SER 73 HN SER 73 5.913 11.379 -17.618
584 HA SER 73 HA SER 73 5.402 10.500 -20.284
585 HG SER 73 HG SER 73 3.133 10.397 -19.397
586 HB2 SER 73 HB2 SER 73 3.792 12.775 -19.058
587 HB3 SER 73 HB3 SER 73 4.047 12.633 -20.811
588 HA PRO 74 HA PRO 74 9.184 12.626 -20.157
589 HB2 PRO 74 HB2 PRO 74 9.547 13.456 -22.814
590 HB3 PRO 74 HB3 PRO 74 9.865 11.812 -22.167
591 HG2 PRO 74 HG2 PRO 74 7.444 12.844 -23.644
592 HG3 PRO 74 HG3 PRO 74 8.261 11.259 -23.812
593 HD2 PRO 74 HD2 PRO 74 5.968 11.553 -22.379
594 HD3 PRO 74 HD3 PRO 74 7.258 10.433 -21.842
595 H ASP 75 HN ASP 75 6.881 14.517 -22.187
596 HA ASP 75 HA ASP 75 8.093 17.027 -21.735
597 HB2 ASP 75 HB2 ASP 75 6.450 16.648 -23.511
598 HB3 ASP 75 HB3 ASP 75 5.180 16.371 -22.313
599 H GLU 76 HN GLU 76 5.482 15.375 -19.909
600 HA GLU 76 HA GLU 76 5.014 17.501 -18.069
601 HB2 GLU 76 HB2 GLU 76 4.535 14.504 -17.869
602 HB3 GLU 76 HB3 GLU 76 3.959 15.656 -16.674
603 HG2 GLU 76 HG2 GLU 76 3.171 15.830 -19.614
604 HG3 GLU 76 HG3 GLU 76 2.285 14.888 -18.426
605 H TRP 77 HN TRP 77 7.339 14.796 -18.081
606 HA TRP 77 HA TRP 77 8.237 15.098 -15.373
607 HD1 TRP 77 HD1 TRP 77 11.680 13.113 -18.079
608 HE1 TRP 77 HE1 TRP 77 13.732 12.803 -16.583
609 HE3 TRP 77 HE3 TRP 77 9.559 14.316 -13.601
610 HZ2 TRP 77 HZ2 TRP 77 14.347 12.984 -13.752
611 HZ3 TRP 77 HZ3 TRP 77 10.869 14.158 -11.512
612 HH2 TRP 77 HH2 TRP 77 13.272 13.521 -11.571
613 HB2 TRP 77 HB2 TRP 77 8.684 13.063 -16.575
614 HB3 TRP 77 HB3 TRP 77 9.400 13.918 -17.908
615 H GLU 78 HN GLU 78 9.565 16.329 -18.519
616 HA GLU 78 HA GLU 78 11.607 17.864 -17.269
617 HB2 GLU 78 HB2 GLU 78 10.264 18.118 -19.991
618 HB3 GLU 78 HB3 GLU 78 11.640 19.108 -19.481
619 HG2 GLU 78 HG2 GLU 78 12.974 17.042 -19.077
620 HG3 GLU 78 HG3 GLU 78 11.640 16.064 -19.678
621 H ARG 79 HN ARG 79 8.294 18.766 -18.233
622 HA ARG 79 HA ARG 79 8.334 21.496 -17.561
623 HE ARG 79 HE ARG 79 3.375 22.791 -16.953
624 HB2 ARG 79 HB2 ARG 79 6.526 20.311 -18.719
625 HB3 ARG 79 HB3 ARG 79 6.196 19.354 -17.274
626 HG2 ARG 79 HG2 ARG 79 5.517 21.498 -16.094
627 HG3 ARG 79 HG3 ARG 79 5.714 22.337 -17.653
628 HD2 ARG 79 HD2 ARG 79 4.080 20.705 -18.665
629 HD3 ARG 79 HD3 ARG 79 3.880 19.969 -17.065
630 HH11 ARG 79 HH11 ARG 79 1.895 19.720 -18.018
631 HH12 ARG 79 HH12 ARG 79 0.274 20.322 -17.900
632 HH21 ARG 79 HH21 ARG 79 1.211 23.559 -16.780
633 HH22 ARG 79 HH22 ARG 79 -0.119 22.539 -17.174
634 H GLN 80 HN GLN 80 7.487 18.683 -15.415
635 HA GLN 80 HA GLN 80 7.151 20.319 -13.126
636 HB2 GLN 80 HB2 GLN 80 7.647 17.347 -13.466
637 HB3 GLN 80 HB3 GLN 80 7.436 18.108 -11.875
638 HG2 GLN 80 HG2 GLN 80 5.248 18.915 -12.402
639 HG3 GLN 80 HG3 GLN 80 5.413 18.503 -14.106
640 HE21 GLN 80 HE22 GLN 80 5.319 16.312 -14.769
641 HE22 GLN 80 HE21 GLN 80 4.479 15.119 -13.777
642 H CYS 81 HN CYS 81 10.092 18.774 -14.485
643 HA CYS 81 HA CYS 81 11.799 19.322 -12.272
644 HG CYS 81 HG CYS 81 11.226 17.018 -14.449
645 HB2 CYS 81 HB2 CYS 81 12.457 19.193 -15.244
646 HB3 CYS 81 HB3 CYS 81 13.640 19.229 -13.930
647 H LYS 82 HN LYS 82 10.723 21.495 -14.968
648 HA LYS 82 HA LYS 82 12.512 23.587 -14.087
649 HB2 LYS 82 HB2 LYS 82 10.001 23.896 -15.781
650 HB3 LYS 82 HB3 LYS 82 11.286 25.074 -15.566
651 HG2 LYS 82 HG2 LYS 82 11.324 22.496 -17.139
652 HG3 LYS 82 HG3 LYS 82 11.630 24.131 -17.691
653 HD2 LYS 82 HD2 LYS 82 13.783 24.104 -16.316
654 HD3 LYS 82 HD3 LYS 82 13.472 22.387 -15.992
655 HE2 LYS 82 HE2 LYS 82 13.390 21.940 -18.431
656 HE3 LYS 82 HE3 LYS 82 13.720 23.648 -18.753
657 HZ1 LYS 82 HZ1 LYS 82 15.565 21.795 -17.355
658 HZ2 LYS 82 HZ2 LYS 82 15.735 22.336 -18.884
659 HZ3 LYS 82 HZ3 LYS 82 15.868 23.387 -17.636
660 H VAL 83 HN VAL 83 9.093 22.720 -13.540
661 HA VAL 83 HA VAL 83 8.470 24.986 -12.013
662 HB VAL 83 HB VAL 83 7.233 22.225 -12.116
663 HG11 VAL 83 HG11 VAL 83 5.168 23.278 -11.159
664 HG12 VAL 83 HG12 VAL 83 6.479 23.114 -9.995
665 HG13 VAL 83 HG13 VAL 83 6.144 24.703 -10.724
666 HG21 VAL 83 HG21 VAL 83 6.371 24.925 -13.260
667 HG22 VAL 83 HG22 VAL 83 7.168 23.659 -14.196
668 HG23 VAL 83 HG23 VAL 83 5.563 23.363 -13.523
669 H ALA 84 HN ALA 84 10.573 22.395 -11.084
670 HA ALA 84 HA ALA 84 10.496 22.499 -8.276
671 HB1 ALA 84 HB1 ALA 84 12.969 22.475 -10.050
672 HB2 ALA 84 HB2 ALA 84 12.853 21.928 -8.372
673 HB3 ALA 84 HB3 ALA 84 11.987 21.042 -9.643
674 H GLY 85 HN GLY 85 11.377 25.091 -10.536
675 HA2 GLY 85 HA2 GLY 85 11.032 27.016 -8.537
676 HA3 GLY 85 HA3 GLY 85 12.776 26.783 -8.691
677 H LYS 86 HN LYS 86 12.456 26.234 -11.727
678 HA LYS 86 HA LYS 86 11.535 28.539 -13.003
679 HB2 LYS 86 HB2 LYS 86 13.667 29.724 -13.511
680 HB3 LYS 86 HB3 LYS 86 13.199 29.870 -11.830
681 HG2 LYS 86 HG2 LYS 86 14.873 28.166 -11.176
682 HG3 LYS 86 HG3 LYS 86 15.279 27.899 -12.874
683 HD2 LYS 86 HD2 LYS 86 16.974 29.283 -11.868
684 HD3 LYS 86 HD3 LYS 86 16.085 30.226 -13.071
685 HE2 LYS 86 HE2 LYS 86 14.745 31.279 -11.253
686 HE3 LYS 86 HE3 LYS 86 15.607 30.312 -10.051
687 HZ1 LYS 86 HZ1 LYS 86 16.848 32.346 -11.817
688 HZ2 LYS 86 HZ2 LYS 86 16.529 32.533 -10.233
689 HZ3 LYS 86 HZ3 LYS 86 17.652 31.455 -10.706
690 H THR 87 HN THR 87 12.379 28.651 -15.259
691 HA THR 87 HA THR 87 12.937 26.158 -16.538
692 HB THR 87 HB THR 87 13.090 27.835 -18.526
693 HG1 THR 87 HG1 THR 87 13.420 29.746 -17.438
694 HG21 THR 87 HG21 THR 87 10.643 28.131 -18.557
695 HG22 THR 87 HG22 THR 87 11.083 26.497 -18.051
696 HG23 THR 87 HG23 THR 87 10.547 27.681 -16.840
697 H GLN 88 HN GLN 88 14.875 26.078 -14.828
698 HA GLN 88 HA GLN 88 17.294 27.431 -15.325
699 HB2 GLN 88 HB2 GLN 88 16.727 26.101 -13.281
700 HB3 GLN 88 HB3 GLN 88 16.827 24.613 -14.230
701 HG2 GLN 88 HG2 GLN 88 19.222 25.016 -14.647
702 HG3 GLN 88 HG3 GLN 88 19.120 26.576 -13.827
703 HE21 GLN 88 HE22 GLN 88 20.978 25.546 -12.577
704 HE22 GLN 88 HE21 GLN 88 20.565 24.587 -11.177
Start of MODEL 21
1 HA MET 1 HA MET 1 4.400 -1.718 -2.589
2 H1 MET 1 H1 MET 1 2.820 -0.594 -0.393
3 H2 MET 1 H2 MET 1 2.679 -2.116 -1.011
4 H3 MET 1 H3 MET 1 4.062 -1.651 -0.238
5 HB2 MET 1 HB2 MET 1 2.061 -1.076 -3.235
6 HB3 MET 1 HB3 MET 1 2.392 0.583 -2.701
7 HG2 MET 1 HG2 MET 1 4.217 0.752 -4.368
8 HG3 MET 1 HG3 MET 1 3.936 -0.923 -4.856
9 HE1 MET 1 HE1 MET 1 2.806 1.058 -8.022
10 HE2 MET 1 HE2 MET 1 4.172 1.393 -6.935
11 HE3 MET 1 HE3 MET 1 3.794 -0.281 -7.401
12 H GLU 2 HN GLU 2 6.368 -0.771 -2.904
13 HA GLU 2 HA GLU 2 6.959 1.810 -1.549
14 HB2 GLU 2 HB2 GLU 2 8.816 -0.613 -1.724
15 HB3 GLU 2 HB3 GLU 2 9.162 0.958 -1.012
16 HG2 GLU 2 HG2 GLU 2 8.739 -0.333 0.857
17 HG3 GLU 2 HG3 GLU 2 7.209 0.495 0.609
18 H TRP 3 HN TRP 3 8.036 3.211 -2.937
19 HA TRP 3 HA TRP 3 8.016 2.329 -5.764
20 HD1 TRP 3 HD1 TRP 3 6.495 5.273 -2.978
21 HE1 TRP 3 HE1 TRP 3 3.960 5.459 -3.215
22 HE3 TRP 3 HE3 TRP 3 6.081 3.906 -7.887
23 HZ2 TRP 3 HZ2 TRP 3 1.978 5.061 -5.313
24 HZ3 TRP 3 HZ3 TRP 3 3.864 3.851 -8.994
25 HH2 TRP 3 HH2 TRP 3 1.808 4.413 -7.714
26 HB2 TRP 3 HB2 TRP 3 8.483 5.131 -4.694
27 HB3 TRP 3 HB3 TRP 3 8.118 4.669 -6.335
28 H LEU 4 HN LEU 4 9.805 3.147 -7.135
29 HA LEU 4 HA LEU 4 12.474 3.272 -5.807
30 HG LEU 4 HG LEU 4 13.903 3.259 -8.651
31 HB2 LEU 4 HB2 LEU 4 12.172 1.248 -7.155
32 HB3 LEU 4 HB3 LEU 4 11.618 2.228 -8.520
33 HD11 LEU 4 HD11 LEU 4 14.745 2.854 -6.388
34 HD12 LEU 4 HD12 LEU 4 14.600 1.101 -6.606
35 HD13 LEU 4 HD13 LEU 4 15.779 2.030 -7.553
36 HD21 LEU 4 HD21 LEU 4 14.917 1.311 -9.739
37 HD22 LEU 4 HD22 LEU 4 13.813 0.218 -8.876
38 HD23 LEU 4 HD23 LEU 4 13.181 1.356 -10.086
39 H VAL 5 HN VAL 5 13.534 5.064 -6.215
40 HA VAL 5 HA VAL 5 12.507 7.239 -7.960
41 HB VAL 5 HB VAL 5 15.037 7.121 -6.254
42 HG11 VAL 5 HG11 VAL 5 15.194 8.816 -7.976
43 HG12 VAL 5 HG12 VAL 5 13.578 9.433 -7.565
44 HG13 VAL 5 HG13 VAL 5 14.930 9.602 -6.423
45 HG21 VAL 5 HG21 VAL 5 12.259 8.194 -5.575
46 HG22 VAL 5 HG22 VAL 5 13.144 6.917 -4.725
47 HG23 VAL 5 HG23 VAL 5 13.726 8.575 -4.640
48 H LYS 6 HN LYS 6 12.899 6.809 -10.005
49 HA LYS 6 HA LYS 6 15.407 5.492 -10.927
50 HB2 LYS 6 HB2 LYS 6 12.696 5.972 -12.133
51 HB3 LYS 6 HB3 LYS 6 14.059 5.674 -13.186
52 HG2 LYS 6 HG2 LYS 6 13.694 3.749 -10.909
53 HG3 LYS 6 HG3 LYS 6 12.520 3.684 -12.210
54 HD2 LYS 6 HD2 LYS 6 14.390 2.090 -12.513
55 HD3 LYS 6 HD3 LYS 6 14.169 3.203 -13.866
56 HE2 LYS 6 HE2 LYS 6 16.067 4.575 -13.118
57 HE3 LYS 6 HE3 LYS 6 16.274 3.543 -11.687
58 HZ1 LYS 6 HZ1 LYS 6 16.808 1.702 -13.180
59 HZ2 LYS 6 HZ2 LYS 6 16.615 2.652 -14.496
60 HZ3 LYS 6 HZ3 LYS 6 17.820 2.949 -13.443
61 H LYS 7 HN LYS 7 13.874 8.643 -10.766
62 HA LYS 7 HA LYS 7 16.232 9.900 -11.912
63 HB2 LYS 7 HB2 LYS 7 13.489 10.558 -13.065
64 HB3 LYS 7 HB3 LYS 7 14.976 11.478 -13.303
65 HG2 LYS 7 HG2 LYS 7 16.027 9.338 -14.232
66 HG3 LYS 7 HG3 LYS 7 14.387 8.653 -14.254
67 HD2 LYS 7 HD2 LYS 7 13.692 10.567 -15.732
68 HD3 LYS 7 HD3 LYS 7 15.374 11.097 -15.781
69 HE2 LYS 7 HE2 LYS 7 14.449 8.303 -16.596
70 HE3 LYS 7 HE3 LYS 7 14.558 9.654 -17.734
71 HZ1 LYS 7 HZ1 LYS 7 16.840 8.526 -16.214
72 HZ2 LYS 7 HZ2 LYS 7 16.544 8.307 -17.800
73 HZ3 LYS 7 HZ3 LYS 7 16.933 9.789 -17.253
74 H SER 8 HN SER 8 16.359 12.115 -11.045
75 HA SER 8 HA SER 8 14.360 13.004 -9.088
76 HG SER 8 HG SER 8 16.430 13.137 -6.250
77 HB2 SER 8 HB2 SER 8 15.944 11.454 -7.850
78 HB3 SER 8 HB3 SER 8 17.256 12.575 -8.273
79 H CYS 9 HN CYS 9 14.765 15.225 -8.595
80 HA CYS 9 HA CYS 9 16.476 16.710 -10.548
81 HG CYS 9 HG CYS 9 13.294 15.294 -10.709
82 HB2 CYS 9 HB2 CYS 9 13.692 17.528 -9.634
83 HB3 CYS 9 HB3 CYS 9 14.685 18.267 -10.897
84 H CYS 10 HN CYS 10 18.009 16.654 -8.763
85 HA CYS 10 HA CYS 10 17.683 17.485 -6.158
86 HG CYS 10 HG CYS 10 21.199 15.814 -7.142
87 HB2 CYS 10 HB2 CYS 10 20.070 18.036 -7.965
88 HB3 CYS 10 HB3 CYS 10 20.078 17.989 -6.196
89 H ASN 11 HN ASN 11 17.423 19.435 -5.085
90 HA ASN 11 HA ASN 11 17.663 21.994 -6.550
91 HB2 ASN 11 HB2 ASN 11 15.521 22.542 -6.651
92 HB3 ASN 11 HB3 ASN 11 15.223 20.816 -6.705
93 HD21 ASN 11 HD22 ASN 11 14.854 19.769 -4.454
94 HD22 ASN 11 HD21 ASN 11 13.904 20.683 -3.336
95 H LYS 12 HN LYS 12 17.675 23.740 -5.266
96 HA LYS 12 HA LYS 12 17.279 23.550 -2.370
97 HB2 LYS 12 HB2 LYS 12 19.389 24.833 -1.890
98 HB3 LYS 12 HB3 LYS 12 19.573 23.146 -2.314
99 HG2 LYS 12 HG2 LYS 12 21.323 24.467 -3.321
100 HG3 LYS 12 HG3 LYS 12 20.326 23.708 -4.567
101 HD2 LYS 12 HD2 LYS 12 19.222 25.818 -5.057
102 HD3 LYS 12 HD3 LYS 12 19.922 26.571 -3.624
103 HE2 LYS 12 HE2 LYS 12 21.117 27.386 -5.545
104 HE3 LYS 12 HE3 LYS 12 22.195 26.356 -4.606
105 HZ1 LYS 12 HZ1 LYS 12 20.785 25.538 -7.090
106 HZ2 LYS 12 HZ2 LYS 12 22.363 25.917 -6.969
107 HZ3 LYS 12 HZ3 LYS 12 21.807 24.585 -6.225
108 H GLN 13 HN GLN 13 16.482 24.895 -5.198
109 HA GLN 13 HA GLN 13 16.548 27.713 -4.592
110 HB2 GLN 13 HB2 GLN 13 15.051 26.118 -6.739
111 HB3 GLN 13 HB3 GLN 13 15.200 27.870 -6.650
112 HG2 GLN 13 HG2 GLN 13 16.789 27.370 -8.213
113 HG3 GLN 13 HG3 GLN 13 17.764 27.514 -6.759
114 HE21 GLN 13 HE22 GLN 13 18.831 26.258 -8.960
115 HE22 GLN 13 HE21 GLN 13 18.862 24.511 -8.747
116 H ASP 14 HN ASP 14 14.171 25.032 -4.266
117 HA ASP 14 HA ASP 14 12.430 26.911 -2.718
118 HB2 ASP 14 HB2 ASP 14 11.884 26.823 -5.223
119 HB3 ASP 14 HB3 ASP 14 11.314 25.181 -4.949
120 H ASN 15 HN ASN 15 13.965 24.063 -2.683
121 HA ASN 15 HA ASN 15 14.077 22.305 -1.377
122 HB2 ASN 15 HB2 ASN 15 12.971 23.889 0.377
123 HB3 ASN 15 HB3 ASN 15 11.526 22.923 0.105
124 HD21 ASN 15 HD22 ASN 15 12.945 20.305 -0.206
125 HD22 ASN 15 HD21 ASN 15 13.545 19.909 1.399
126 H ARG 16 HN ARG 16 11.345 23.040 -3.245
127 HA ARG 16 HA ARG 16 10.000 20.482 -3.241
128 HE ARG 16 HE ARG 16 6.377 22.459 -5.382
129 HB2 ARG 16 HB2 ARG 16 9.912 22.903 -5.080
130 HB3 ARG 16 HB3 ARG 16 8.920 21.456 -5.331
131 HG2 ARG 16 HG2 ARG 16 7.747 21.747 -3.278
132 HG3 ARG 16 HG3 ARG 16 8.892 22.937 -2.669
133 HD2 ARG 16 HD2 ARG 16 6.787 23.985 -3.375
134 HD3 ARG 16 HD3 ARG 16 8.189 24.573 -4.263
135 HH11 ARG 16 HH11 ARG 16 7.888 25.696 -5.777
136 HH12 ARG 16 HH12 ARG 16 7.193 25.913 -7.353
137 HH21 ARG 16 HH22 ARG 16 5.766 22.666 -7.519
138 HH22 ARG 16 HH21 ARG 16 5.927 24.184 -8.348
139 H HIS 17 HN HIS 17 11.150 18.761 -3.810
140 HA HIS 17 HA HIS 17 12.951 18.713 -6.166
141 HD1 HIS 17 HD1 HIS 17 13.662 17.809 -2.069
142 HD2 HIS 17 HD2 HIS 17 15.519 17.191 -5.769
143 HE1 HIS 17 HE1 HIS 17 16.133 18.404 -1.733
144 HB2 HIS 17 HB2 HIS 17 12.163 16.704 -3.998
145 HB3 HIS 17 HB3 HIS 17 13.064 16.241 -5.437
146 H VAL 18 HN VAL 18 12.490 16.955 -7.751
147 HA VAL 18 HA VAL 18 9.785 15.842 -7.729
148 HB VAL 18 HB VAL 18 11.088 16.907 -10.253
149 HG11 VAL 18 HG11 VAL 18 8.224 15.954 -9.911
150 HG12 VAL 18 HG12 VAL 18 9.059 16.398 -11.416
151 HG13 VAL 18 HG13 VAL 18 9.544 14.959 -10.564
152 HG21 VAL 18 HG21 VAL 18 8.649 18.117 -8.895
153 HG22 VAL 18 HG22 VAL 18 10.273 18.814 -8.799
154 HG23 VAL 18 HG23 VAL 18 9.458 18.711 -10.356
155 H LEU 19 HN LEU 19 9.786 13.827 -8.489
156 HA LEU 19 HA LEU 19 12.283 12.635 -9.492
157 HG LEU 19 HG LEU 19 10.413 12.417 -6.111
158 HB2 LEU 19 HB2 LEU 19 11.472 10.699 -7.670
159 HB3 LEU 19 HB3 LEU 19 12.935 11.644 -7.645
160 HD11 LEU 19 HD11 LEU 19 12.935 10.976 -5.218
161 HD12 LEU 19 HD12 LEU 19 11.585 11.484 -4.170
162 HD13 LEU 19 HD13 LEU 19 11.325 10.259 -5.418
163 HD21 LEU 19 HD21 LEU 19 11.671 14.395 -6.101
164 HD22 LEU 19 HD22 LEU 19 12.431 13.586 -4.751
165 HD23 LEU 19 HD23 LEU 19 13.219 13.554 -6.345
166 H MET 20 HN MET 20 11.913 10.305 -10.099
167 HA MET 20 HA MET 20 9.163 10.052 -11.210
168 HB2 MET 20 HB2 MET 20 11.829 9.175 -12.303
169 HB3 MET 20 HB3 MET 20 10.362 8.240 -12.661
170 HG2 MET 20 HG2 MET 20 9.201 10.154 -13.492
171 HG3 MET 20 HG3 MET 20 10.490 11.249 -13.004
172 HE1 MET 20 HE1 MET 20 10.997 8.231 -16.503
173 HE2 MET 20 HE2 MET 20 11.302 7.759 -14.818
174 HE3 MET 20 HE3 MET 20 9.652 8.187 -15.341
175 H LEU 21 HN LEU 21 7.996 8.869 -10.069
176 HA LEU 21 HA LEU 21 9.121 6.988 -8.046
177 HG LEU 21 HG LEU 21 8.120 7.356 -5.976
178 HB2 LEU 21 HB2 LEU 21 6.564 8.570 -8.297
179 HB3 LEU 21 HB3 LEU 21 6.420 6.933 -7.654
180 HD11 LEU 21 HD11 LEU 21 9.561 9.022 -6.886
181 HD12 LEU 21 HD12 LEU 21 8.224 10.129 -7.223
182 HD13 LEU 21 HD13 LEU 21 8.744 9.841 -5.548
183 HD21 LEU 21 HD21 LEU 21 6.759 8.844 -4.539
184 HD22 LEU 21 HD22 LEU 21 5.874 9.424 -5.970
185 HD23 LEU 21 HD23 LEU 21 5.737 7.731 -5.460
186 H CYS 22 HN CYS 22 9.217 4.960 -8.570
187 HA CYS 22 HA CYS 22 7.538 3.936 -10.816
188 HG CYS 22 HG CYS 22 10.397 5.939 -10.679
189 HB2 CYS 22 HB2 CYS 22 10.504 3.425 -10.315
190 HB3 CYS 22 HB3 CYS 22 9.551 2.916 -11.716
191 H ASP 23 HN ASP 23 7.611 1.558 -10.965
192 HA ASP 23 HA ASP 23 7.091 0.138 -8.504
193 HB2 ASP 23 HB2 ASP 23 6.181 -0.909 -10.388
194 HB3 ASP 23 HB3 ASP 23 7.550 -0.492 -11.410
195 H ALA 24 HN ALA 24 8.481 -1.371 -7.410
196 HA ALA 24 HA ALA 24 11.267 -0.692 -7.194
197 HB1 ALA 24 HB1 ALA 24 11.327 -2.565 -5.598
198 HB2 ALA 24 HB2 ALA 24 9.974 -1.465 -5.271
199 HB3 ALA 24 HB3 ALA 24 9.676 -3.029 -6.068
200 H GLY 25 HN GLY 25 11.678 -0.886 -9.526
201 HA2 GLY 25 HA2 GLY 25 13.241 -2.874 -10.545
202 HA3 GLY 25 HA3 GLY 25 11.594 -3.510 -10.778
203 H GLY 26 HN GLY 26 10.733 -0.542 -11.012
204 HA2 GLY 26 HA2 GLY 26 10.716 1.184 -12.533
205 HA3 GLY 26 HA3 GLY 26 11.910 0.352 -13.534
206 H ALA 27 HN ALA 27 9.233 -1.741 -12.775
207 HA ALA 27 HA ALA 27 8.581 -1.921 -15.555
208 HB1 ALA 27 HB1 ALA 27 6.944 -3.590 -14.825
209 HB2 ALA 27 HB2 ALA 27 8.469 -3.815 -13.949
210 HB3 ALA 27 HB3 ALA 27 7.082 -3.037 -13.145
211 H ILE 28 HN ILE 28 7.404 0.252 -13.192
212 HA ILE 28 HA ILE 28 5.208 1.246 -14.892
213 HB ILE 28 HB ILE 28 5.064 0.755 -11.873
214 HG12 ILE 28 HG12 ILE 28 4.657 -1.357 -13.096
215 HG13 ILE 28 HG13 ILE 28 3.285 -0.800 -12.168
216 HG21 ILE 28 HG21 ILE 28 2.704 1.579 -12.050
217 HG22 ILE 28 HG22 ILE 28 3.922 2.816 -12.344
218 HG23 ILE 28 HG23 ILE 28 3.049 2.098 -13.714
219 HD11 ILE 28 HD11 ILE 28 2.123 -0.052 -14.175
220 HD12 ILE 28 HD12 ILE 28 3.541 -0.424 -15.183
221 HD13 ILE 28 HD13 ILE 28 2.649 -1.728 -14.378
222 H LYS 29 HN LYS 29 5.237 3.616 -14.713
223 HA LYS 29 HA LYS 29 7.145 4.789 -12.783
224 HB2 LYS 29 HB2 LYS 29 7.298 5.363 -15.774
225 HB3 LYS 29 HB3 LYS 29 8.204 6.159 -14.487
226 HG2 LYS 29 HG2 LYS 29 9.094 3.756 -13.924
227 HG3 LYS 29 HG3 LYS 29 8.503 3.323 -15.529
228 HD2 LYS 29 HD2 LYS 29 9.976 5.023 -16.548
229 HD3 LYS 29 HD3 LYS 29 10.420 5.620 -14.946
230 HE2 LYS 29 HE2 LYS 29 12.242 4.307 -15.760
231 HE3 LYS 29 HE3 LYS 29 11.518 3.493 -14.382
232 HZ1 LYS 29 HZ1 LYS 29 10.448 1.940 -15.898
233 HZ2 LYS 29 HZ2 LYS 29 10.945 2.787 -17.219
234 HZ3 LYS 29 HZ3 LYS 29 12.028 2.008 -16.293
235 H MET 30 HN MET 30 6.638 6.816 -12.155
236 HA MET 30 HA MET 30 4.473 8.378 -13.411
237 HB2 MET 30 HB2 MET 30 4.714 7.800 -10.422
238 HB3 MET 30 HB3 MET 30 3.548 8.859 -11.201
239 HG2 MET 30 HG2 MET 30 2.939 6.609 -12.528
240 HG3 MET 30 HG3 MET 30 3.625 5.878 -11.076
241 HE1 MET 30 HE1 MET 30 2.796 6.905 -8.586
242 HE2 MET 30 HE2 MET 30 2.470 8.581 -9.091
243 HE3 MET 30 HE3 MET 30 1.183 7.615 -8.347
244 H ILE 31 HN ILE 31 4.569 10.640 -12.243
245 HA ILE 31 HA ILE 31 7.379 11.417 -11.615
246 HB ILE 31 HB ILE 31 5.312 13.031 -13.105
247 HG12 ILE 31 HG12 ILE 31 7.977 12.218 -14.307
248 HG13 ILE 31 HG13 ILE 31 6.659 11.052 -14.348
249 HG21 ILE 31 HG21 ILE 31 7.279 14.618 -13.447
250 HG22 ILE 31 HG22 ILE 31 6.740 14.498 -11.775
251 HG23 ILE 31 HG23 ILE 31 8.203 13.634 -12.306
252 HD11 ILE 31 HD11 ILE 31 6.448 13.879 -15.403
253 HD12 ILE 31 HD12 ILE 31 6.655 12.404 -16.372
254 HD13 ILE 31 HD13 ILE 31 5.173 12.647 -15.419
255 H ALA 32 HN ALA 32 7.449 12.575 -9.617
256 HA ALA 32 HA ALA 32 4.883 13.535 -8.484
257 HB1 ALA 32 HB1 ALA 32 6.916 11.888 -6.932
258 HB2 ALA 32 HB2 ALA 32 5.398 12.556 -6.319
259 HB3 ALA 32 HB3 ALA 32 5.358 11.252 -7.530
260 H GLU 33 HN GLU 33 5.109 15.435 -7.478
261 HA GLU 33 HA GLU 33 7.814 16.639 -7.206
262 HB2 GLU 33 HB2 GLU 33 6.014 17.980 -8.392
263 HB3 GLU 33 HB3 GLU 33 5.022 17.883 -6.929
264 HG2 GLU 33 HG2 GLU 33 6.957 19.019 -5.693
265 HG3 GLU 33 HG3 GLU 33 7.713 19.286 -7.249
266 H VAL 34 HN VAL 34 8.531 17.073 -5.091
267 HA VAL 34 HA VAL 34 6.847 16.261 -2.820
268 HB VAL 34 HB VAL 34 8.451 14.658 -2.040
269 HG11 VAL 34 HG11 VAL 34 8.229 12.816 -3.536
270 HG12 VAL 34 HG12 VAL 34 6.769 13.784 -3.730
271 HG13 VAL 34 HG13 VAL 34 8.044 13.874 -4.949
272 HG21 VAL 34 HG21 VAL 34 10.563 15.540 -2.814
273 HG22 VAL 34 HG22 VAL 34 10.392 13.903 -3.439
274 HG23 VAL 34 HG23 VAL 34 10.106 15.285 -4.516
275 H LYS 35 HN LYS 35 7.989 16.832 -0.717
276 HA LYS 35 HA LYS 35 10.201 18.812 -1.089
277 HB2 LYS 35 HB2 LYS 35 8.032 19.875 -0.213
278 HB3 LYS 35 HB3 LYS 35 8.227 18.883 1.235
279 HG2 LYS 35 HG2 LYS 35 10.474 19.912 1.590
280 HG3 LYS 35 HG3 LYS 35 10.267 20.887 0.126
281 HD2 LYS 35 HD2 LYS 35 8.492 21.033 2.607
282 HD3 LYS 35 HD3 LYS 35 9.841 22.121 2.254
283 HE2 LYS 35 HE2 LYS 35 8.707 22.845 0.151
284 HE3 LYS 35 HE3 LYS 35 7.337 21.792 0.535
285 HZ1 LYS 35 HZ1 LYS 35 6.968 23.116 2.539
286 HZ2 LYS 35 HZ2 LYS 35 8.229 24.092 2.181
287 HZ3 LYS 35 HZ3 LYS 35 6.917 24.066 1.219
288 H SER 36 HN SER 36 11.982 18.301 0.145
289 HA SER 36 HA SER 36 11.847 15.675 1.561
290 HG SER 36 HG SER 36 13.246 15.411 -1.800
291 HB2 SER 36 HB2 SER 36 14.249 16.561 0.004
292 HB3 SER 36 HB3 SER 36 13.646 14.927 0.350
293 H ASP 37 HN ASP 37 12.918 15.450 3.500
294 HA ASP 37 HA ASP 37 13.954 17.927 4.698
295 HB2 ASP 37 HB2 ASP 37 12.398 16.348 5.888
296 HB3 ASP 37 HB3 ASP 37 13.698 15.154 5.913
297 H PHE 38 HN PHE 38 15.178 15.180 3.059
298 HA PHE 38 HA PHE 38 17.941 16.104 3.415
299 HD1 PHE 38 HD2 PHE 38 15.671 13.524 5.498
300 HD2 PHE 38 HD1 PHE 38 19.882 14.454 5.483
301 HE1 PHE 38 HE2 PHE 38 15.669 13.569 7.973
302 HE2 PHE 38 HE1 PHE 38 19.883 14.467 7.965
303 HZ PHE 38 HZ PHE 38 17.779 14.026 9.219
304 HB2 PHE 38 HB2 PHE 38 17.127 13.162 3.464
305 HB3 PHE 38 HB3 PHE 38 18.766 13.774 3.444
306 H ALA 39 HN ALA 39 19.254 15.226 1.489
307 HA ALA 39 HA ALA 39 17.879 15.603 -0.978
308 HB1 ALA 39 HB1 ALA 39 20.009 14.873 -1.997
309 HB2 ALA 39 HB2 ALA 39 20.295 16.046 -0.698
310 HB3 ALA 39 HB3 ALA 39 20.587 14.311 -0.416
311 H VAL 40 HN VAL 40 17.487 14.040 -2.663
312 HA VAL 40 HA VAL 40 17.401 11.183 -1.974
313 HB VAL 40 HB VAL 40 15.258 11.932 -1.214
314 HG11 VAL 40 HG11 VAL 40 14.793 13.308 -3.889
315 HG12 VAL 40 HG12 VAL 40 13.600 13.105 -2.589
316 HG13 VAL 40 HG13 VAL 40 15.026 14.111 -2.321
317 HG21 VAL 40 HG21 VAL 40 13.730 10.663 -2.619
318 HG22 VAL 40 HG22 VAL 40 14.876 10.722 -3.974
319 HG23 VAL 40 HG23 VAL 40 15.282 9.823 -2.505
320 H LYS 41 HN LYS 41 17.740 9.919 -3.837
321 HA LYS 41 HA LYS 41 18.075 11.324 -6.410
322 HB2 LYS 41 HB2 LYS 41 20.486 10.599 -6.546
323 HB3 LYS 41 HB3 LYS 41 20.113 11.941 -5.491
324 HG2 LYS 41 HG2 LYS 41 21.796 10.516 -4.494
325 HG3 LYS 41 HG3 LYS 41 20.342 10.543 -3.496
326 HD2 LYS 41 HD2 LYS 41 19.668 8.353 -4.414
327 HD3 LYS 41 HD3 LYS 41 21.113 8.329 -5.446
328 HE2 LYS 41 HE2 LYS 41 22.560 8.213 -3.505
329 HE3 LYS 41 HE3 LYS 41 21.205 8.546 -2.411
330 HZ1 LYS 41 HZ1 LYS 41 21.423 6.113 -4.075
331 HZ2 LYS 41 HZ2 LYS 41 21.750 6.192 -2.473
332 HZ3 LYS 41 HZ3 LYS 41 20.218 6.466 -3.006
333 H VAL 42 HN VAL 42 19.103 9.716 -8.029
334 HA VAL 42 HA VAL 42 17.220 7.698 -8.417
335 HB VAL 42 HB VAL 42 19.987 8.047 -9.668
336 HG11 VAL 42 HG11 VAL 42 18.866 6.867 -11.635
337 HG12 VAL 42 HG12 VAL 42 19.225 5.834 -10.253
338 HG13 VAL 42 HG13 VAL 42 17.564 6.406 -10.510
339 HG21 VAL 42 HG21 VAL 42 18.486 9.146 -11.467
340 HG22 VAL 42 HG22 VAL 42 17.214 9.134 -10.210
341 HG23 VAL 42 HG23 VAL 42 18.709 10.061 -9.975
342 H GLY 43 HN GLY 43 17.215 5.504 -8.355
343 HA2 GLY 43 HA2 GLY 43 17.701 3.393 -7.656
344 HA3 GLY 43 HA3 GLY 43 19.350 3.891 -7.220
345 H ASP 44 HN ASP 44 16.303 5.490 -6.091
346 HA ASP 44 HA ASP 44 17.129 4.620 -3.286
347 HB2 ASP 44 HB2 ASP 44 15.810 7.215 -4.134
348 HB3 ASP 44 HB3 ASP 44 15.590 6.526 -2.539
349 H LEU 45 HN LEU 45 15.513 3.711 -1.936
350 HA LEU 45 HA LEU 45 13.013 2.959 -3.337
351 HG LEU 45 HG LEU 45 11.415 1.722 -1.488
352 HB2 LEU 45 HB2 LEU 45 14.447 1.441 -1.685
353 HB3 LEU 45 HB3 LEU 45 13.656 2.417 -0.447
354 HD11 LEU 45 HD11 LEU 45 12.291 0.918 -3.696
355 HD12 LEU 45 HD12 LEU 45 13.161 -0.378 -2.860
356 HD13 LEU 45 HD13 LEU 45 11.383 -0.329 -2.840
357 HD21 LEU 45 HD21 LEU 45 11.414 -0.456 -0.357
358 HD22 LEU 45 HD22 LEU 45 13.193 -0.466 -0.340
359 HD23 LEU 45 HD23 LEU 45 12.296 0.750 0.591
360 H LEU 46 HN LEU 46 10.945 3.648 -2.419
361 HA LEU 46 HA LEU 46 11.043 5.717 -0.286
362 HG LEU 46 HG LEU 46 11.464 6.869 -3.116
363 HB2 LEU 46 HB2 LEU 46 9.303 5.733 -2.772
364 HB3 LEU 46 HB3 LEU 46 8.999 6.724 -1.357
365 HD11 LEU 46 HD11 LEU 46 9.485 7.773 -4.209
366 HD12 LEU 46 HD12 LEU 46 9.074 8.745 -2.780
367 HD13 LEU 46 HD13 LEU 46 10.519 9.124 -3.729
368 HD21 LEU 46 HD21 LEU 46 11.958 8.971 -1.824
369 HD22 LEU 46 HD22 LEU 46 10.679 8.496 -0.670
370 HD23 LEU 46 HD23 LEU 46 12.120 7.490 -0.883
371 H SER 47 HN SER 47 10.358 4.633 1.387
372 HA SER 47 HA SER 47 8.253 2.555 1.163
373 HG SER 47 HG SER 47 10.454 1.203 1.904
374 HB2 SER 47 HB2 SER 47 9.899 3.412 3.577
375 HB3 SER 47 HB3 SER 47 8.969 1.917 3.391
376 HA PRO 48 HA PRO 48 5.565 5.932 2.489
377 HB2 PRO 48 HB2 PRO 48 3.205 4.559 2.997
378 HB3 PRO 48 HB3 PRO 48 3.771 5.056 1.384
379 HG2 PRO 48 HG2 PRO 48 3.990 2.360 2.704
380 HG3 PRO 48 HG3 PRO 48 3.629 2.752 0.991
381 HD2 PRO 48 HD2 PRO 48 6.112 1.953 1.896
382 HD3 PRO 48 HD3 PRO 48 5.902 3.046 0.492
383 H LEU 49 HN LEU 49 4.657 6.813 4.308
384 HA LEU 49 HA LEU 49 4.932 5.343 6.910
385 HG LEU 49 HG LEU 49 7.451 6.511 5.933
386 HB2 LEU 49 HB2 LEU 49 5.579 8.221 6.160
387 HB3 LEU 49 HB3 LEU 49 5.380 7.699 7.827
388 HD11 LEU 49 HD11 LEU 49 9.063 7.938 7.187
389 HD12 LEU 49 HD12 LEU 49 7.893 8.883 6.252
390 HD13 LEU 49 HD13 LEU 49 7.700 8.730 8.013
391 HD21 LEU 49 HD21 LEU 49 6.921 5.010 7.803
392 HD22 LEU 49 HD22 LEU 49 8.492 5.751 8.108
393 HD23 LEU 49 HD23 LEU 49 7.059 6.348 8.966
394 H GLN 50 HN GLN 50 3.269 7.904 5.028
395 HA GLN 50 HA GLN 50 0.739 7.039 5.959
396 HB2 GLN 50 HB2 GLN 50 -0.054 9.268 6.850
397 HB3 GLN 50 HB3 GLN 50 0.967 8.311 7.876
398 HG2 GLN 50 HG2 GLN 50 1.665 10.426 8.286
399 HG3 GLN 50 HG3 GLN 50 2.925 9.819 7.227
400 HE21 GLN 50 HE22 GLN 50 1.469 12.595 7.952
401 HE22 GLN 50 HE21 GLN 50 1.373 13.334 6.372
402 H ASN 51 HN ASN 51 -0.642 9.342 5.060
403 HA ASN 51 HA ASN 51 -1.098 8.656 2.509
404 HB2 ASN 51 HB2 ASN 51 -2.562 10.091 3.852
405 HB3 ASN 51 HB3 ASN 51 -1.358 11.378 3.856
406 HD21 ASN 51 HD22 ASN 51 -1.303 12.837 2.062
407 HD22 ASN 51 HD21 ASN 51 -2.366 12.693 0.690
408 H ALA 52 HN ALA 52 1.346 11.100 3.399
409 HA ALA 52 HA ALA 52 2.086 11.391 0.575
410 HB1 ALA 52 HB1 ALA 52 2.521 13.787 1.120
411 HB2 ALA 52 HB2 ALA 52 0.814 13.358 1.305
412 HB3 ALA 52 HB3 ALA 52 1.854 13.519 2.744
413 H LEU 53 HN LEU 53 3.135 11.036 3.968
414 HA LEU 53 HA LEU 53 5.889 11.724 3.328
415 HG LEU 53 HG LEU 53 4.652 13.129 5.388
416 HB2 LEU 53 HB2 LEU 53 4.581 10.564 5.794
417 HB3 LEU 53 HB3 LEU 53 6.335 10.616 5.624
418 HD11 LEU 53 HD11 LEU 53 5.300 13.594 7.730
419 HD12 LEU 53 HD12 LEU 53 4.309 12.133 7.628
420 HD13 LEU 53 HD13 LEU 53 6.064 11.993 7.849
421 HD21 LEU 53 HD21 LEU 53 6.997 13.206 4.453
422 HD22 LEU 53 HD22 LEU 53 6.797 14.252 5.862
423 HD23 LEU 53 HD23 LEU 53 7.616 12.689 6.026
424 H TYR 54 HN TYR 54 7.467 10.421 2.743
425 HA TYR 54 HA TYR 54 7.212 7.484 3.018
426 HD1 TYR 54 HD2 TYR 54 5.653 9.651 0.344
427 HD2 TYR 54 HD1 TYR 54 7.236 5.661 0.131
428 HE1 TYR 54 HE2 TYR 54 3.578 8.894 -0.773
429 HE2 TYR 54 HE1 TYR 54 5.181 4.884 -0.984
430 HH TYR 54 HH TYR 54 2.413 7.050 -1.664
431 HB2 TYR 54 HB2 TYR 54 8.193 9.091 0.613
432 HB3 TYR 54 HB3 TYR 54 8.625 7.417 0.882
433 H CYS 55 HN CYS 55 9.253 6.511 3.492
434 HA CYS 55 HA CYS 55 11.314 8.222 4.649
435 HG CYS 55 HG CYS 55 11.060 4.543 6.329
436 HB2 CYS 55 HB2 CYS 55 11.601 5.286 3.902
437 HB3 CYS 55 HB3 CYS 55 12.469 6.207 5.135
438 H ILE 56 HN ILE 56 13.340 8.641 3.625
439 HA ILE 56 HA ILE 56 13.522 8.179 0.710
440 HB ILE 56 HB ILE 56 15.422 9.481 2.712
441 HG12 ILE 56 HG12 ILE 56 13.809 10.750 0.455
442 HG13 ILE 56 HG13 ILE 56 13.234 10.676 2.119
443 HG21 ILE 56 HG21 ILE 56 16.724 10.256 0.702
444 HG22 ILE 56 HG22 ILE 56 16.787 8.518 0.871
445 HG23 ILE 56 HG23 ILE 56 15.707 9.231 -0.325
446 HD11 ILE 56 HD11 ILE 56 15.728 12.160 1.242
447 HD12 ILE 56 HD12 ILE 56 14.174 12.859 1.696
448 HD13 ILE 56 HD13 ILE 56 15.131 11.998 2.911
449 H ASN 57 HN ASN 57 14.826 6.677 -0.171
450 HA ASN 57 HA ASN 57 16.385 5.171 -0.577
451 HB2 ASN 57 HB2 ASN 57 17.868 6.605 0.860
452 HB3 ASN 57 HB3 ASN 57 17.458 5.587 2.242
453 HD21 ASN 57 HD22 ASN 57 18.864 5.618 -1.016
454 HD22 ASN 57 HD21 ASN 57 19.942 4.248 -0.757
455 H ARG 58 HN ARG 58 14.886 4.710 2.492
456 HA ARG 58 HA ARG 58 13.414 2.745 2.716
457 HE ARG 58 HE ARG 58 18.716 -0.988 1.974
458 HB2 ARG 58 HB2 ARG 58 14.331 0.533 2.909
459 HB3 ARG 58 HB3 ARG 58 14.624 1.187 1.321
460 HG2 ARG 58 HG2 ARG 58 17.015 1.803 2.253
461 HG3 ARG 58 HG3 ARG 58 16.622 0.707 3.575
462 HD2 ARG 58 HD2 ARG 58 16.421 -1.165 2.125
463 HD3 ARG 58 HD3 ARG 58 16.245 -0.165 0.685
464 HH11 ARG 58 HH11 ARG 58 17.324 1.529 -0.135
465 HH12 ARG 58 HH12 ARG 58 18.710 1.615 -1.163
466 HH21 ARG 58 HH21 ARG 58 20.621 -0.710 0.720
467 HH22 ARG 58 HH22 ARG 58 20.664 0.407 -0.589
468 H GLU 59 HN GLU 59 15.172 4.877 4.151
469 HA GLU 59 HA GLU 59 15.959 3.638 6.672
470 HB2 GLU 59 HB2 GLU 59 15.606 6.544 5.775
471 HB3 GLU 59 HB3 GLU 59 16.348 6.041 7.290
472 HG2 GLU 59 HG2 GLU 59 17.458 5.500 4.521
473 HG3 GLU 59 HG3 GLU 59 18.006 6.713 5.672
474 H LYS 60 HN LYS 60 14.915 5.423 8.507
475 HA LYS 60 HA LYS 60 12.021 5.626 8.057
476 HB2 LYS 60 HB2 LYS 60 13.330 4.951 10.733
477 HB3 LYS 60 HB3 LYS 60 11.603 5.169 10.461
478 HG2 LYS 60 HG2 LYS 60 13.310 2.961 9.241
479 HG3 LYS 60 HG3 LYS 60 12.300 2.781 10.665
480 HD2 LYS 60 HD2 LYS 60 10.282 2.996 9.476
481 HD3 LYS 60 HD3 LYS 60 11.031 3.706 8.062
482 HE2 LYS 60 HE2 LYS 60 11.462 0.842 8.985
483 HE3 LYS 60 HE3 LYS 60 10.331 1.359 7.722
484 HZ1 LYS 60 HZ1 LYS 60 12.376 2.316 6.587
485 HZ2 LYS 60 HZ2 LYS 60 13.272 1.436 7.620
486 HZ3 LYS 60 HZ3 LYS 60 12.252 0.675 6.606
487 H LEU 61 HN LEU 61 14.945 6.956 9.609
488 HA LEU 61 HA LEU 61 13.577 9.258 10.563
489 HG LEU 61 HG LEU 61 16.964 8.890 9.219
490 HB2 LEU 61 HB2 LEU 61 15.685 10.121 11.214
491 HB3 LEU 61 HB3 LEU 61 15.471 8.479 11.787
492 HD11 LEU 61 HD11 LEU 61 17.922 10.634 10.670
493 HD12 LEU 61 HD12 LEU 61 18.192 9.434 11.954
494 HD13 LEU 61 HD13 LEU 61 19.083 9.325 10.416
495 HD21 LEU 61 HD21 LEU 61 16.641 6.577 10.059
496 HD22 LEU 61 HD22 LEU 61 18.345 7.024 10.050
497 HD23 LEU 61 HD23 LEU 61 17.441 7.020 11.577
498 H HIS 62 HN HIS 62 15.305 8.604 7.522
499 HA HIS 62 HA HIS 62 15.278 11.466 6.799
500 HD1 HIS 62 HD1 HIS 62 18.761 9.074 4.542
501 HD2 HIS 62 HD2 HIS 62 17.413 11.035 8.013
502 HE1 HIS 62 HE1 HIS 62 20.809 9.432 6.005
503 HB2 HIS 62 HB2 HIS 62 16.002 8.997 5.163
504 HB3 HIS 62 HB3 HIS 62 16.194 10.671 4.655
505 H THR 63 HN THR 63 13.341 12.374 6.030
506 HA THR 63 HA THR 63 11.424 10.583 4.650
507 HB THR 63 HB THR 63 9.729 12.030 5.786
508 HG1 THR 63 HG1 THR 63 10.433 13.306 7.495
509 HG21 THR 63 HG21 THR 63 11.615 10.622 7.722
510 HG22 THR 63 HG22 THR 63 9.863 10.873 7.908
511 HG23 THR 63 HG23 THR 63 10.474 9.780 6.654
512 H VAL 64 HN VAL 64 9.931 11.556 3.243
513 HA VAL 64 HA VAL 64 10.462 14.200 2.118
514 HB VAL 64 HB VAL 64 11.955 12.754 0.873
515 HG11 VAL 64 HG11 VAL 64 11.235 10.823 -0.438
516 HG12 VAL 64 HG12 VAL 64 11.009 10.520 1.284
517 HG13 VAL 64 HG13 VAL 64 9.610 10.919 0.268
518 HG21 VAL 64 HG21 VAL 64 9.517 13.127 -0.870
519 HG22 VAL 64 HG22 VAL 64 10.639 14.438 -0.423
520 HG23 VAL 64 HG23 VAL 64 11.220 13.065 -1.371
521 H LYS 65 HN LYS 65 8.506 15.009 1.135
522 HA LYS 65 HA LYS 65 6.080 13.405 1.817
523 HB2 LYS 65 HB2 LYS 65 6.683 15.272 3.424
524 HB3 LYS 65 HB3 LYS 65 6.444 16.409 2.091
525 HG2 LYS 65 HG2 LYS 65 4.089 15.649 1.868
526 HG3 LYS 65 HG3 LYS 65 4.340 14.479 3.180
527 HD2 LYS 65 HD2 LYS 65 4.815 16.335 4.748
528 HD3 LYS 65 HD3 LYS 65 4.613 17.509 3.427
529 HE2 LYS 65 HE2 LYS 65 2.264 16.736 3.115
530 HE3 LYS 65 HE3 LYS 65 2.463 15.593 4.449
531 HZ1 LYS 65 HZ1 LYS 65 2.639 18.544 4.691
532 HZ2 LYS 65 HZ2 LYS 65 1.387 17.627 5.178
533 HZ3 LYS 65 HZ3 LYS 65 2.826 17.491 5.928
534 H VAL 66 HN VAL 66 4.708 13.150 0.187
535 HA VAL 66 HA VAL 66 5.214 14.199 -2.443
536 HB VAL 66 HB VAL 66 2.891 12.650 -1.210
537 HG11 VAL 66 HG11 VAL 66 2.005 13.820 -3.192
538 HG12 VAL 66 HG12 VAL 66 3.403 13.300 -4.164
539 HG13 VAL 66 HG13 VAL 66 2.225 12.113 -3.565
540 HG21 VAL 66 HG21 VAL 66 5.166 11.793 -3.074
541 HG22 VAL 66 HG22 VAL 66 5.057 11.417 -1.345
542 HG23 VAL 66 HG23 VAL 66 3.868 10.750 -2.464
543 H LEU 67 HN LEU 67 4.249 15.830 -3.565
544 HA LEU 67 HA LEU 67 2.378 17.634 -2.072
545 HG LEU 67 HG LEU 67 5.541 17.803 -2.016
546 HB2 LEU 67 HB2 LEU 67 4.433 18.326 -4.206
547 HB3 LEU 67 HB3 LEU 67 3.372 19.460 -3.380
548 HD11 LEU 67 HD11 LEU 67 5.532 20.729 -2.833
549 HD12 LEU 67 HD12 LEU 67 6.813 19.896 -1.924
550 HD13 LEU 67 HD13 LEU 67 6.482 19.428 -3.579
551 HD21 LEU 67 HD21 LEU 67 5.244 19.330 -0.108
552 HD22 LEU 67 HD22 LEU 67 3.875 20.113 -0.935
553 HD23 LEU 67 HD23 LEU 67 3.771 18.412 -0.424
554 H SER 68 HN SER 68 3.228 16.177 -5.258
555 HA SER 68 HA SER 68 0.466 15.804 -5.940
556 HG SER 68 HG SER 68 0.504 18.272 -5.653
557 HB2 SER 68 HB2 SER 68 2.136 17.831 -7.516
558 HB3 SER 68 HB3 SER 68 0.676 17.059 -8.153
559 H ALA 69 HN ALA 69 0.386 14.343 -7.887
560 HA ALA 69 HA ALA 69 2.877 13.663 -9.185
561 HB1 ALA 69 HB1 ALA 69 3.023 12.255 -7.124
562 HB2 ALA 69 HB2 ALA 69 1.449 11.526 -7.523
563 HB3 ALA 69 HB3 ALA 69 2.853 11.270 -8.587
564 H SER 70 HN SER 70 2.573 12.254 -10.994
565 HA SER 70 HA SER 70 -0.156 11.639 -11.935
566 HG SER 70 HG SER 70 0.104 15.041 -13.184
567 HB2 SER 70 HB2 SER 70 1.750 13.468 -13.474
568 HB3 SER 70 HB3 SER 70 0.162 12.910 -14.016
569 H SER 71 HN SER 71 -0.069 10.159 -13.804
570 HA SER 71 HA SER 71 1.994 8.301 -13.977
571 HG SER 71 HG SER 71 -1.296 7.626 -15.292
572 HB2 SER 71 HB2 SER 71 0.140 9.160 -16.232
573 HB3 SER 71 HB3 SER 71 0.892 7.571 -16.001
574 H TYR 72 HN TYR 72 3.720 7.957 -15.523
575 HA TYR 72 HA TYR 72 5.218 10.343 -15.968
576 HD1 TYR 72 HD1 TYR 72 7.998 10.314 -16.171
577 HD2 TYR 72 HD2 TYR 72 6.593 7.283 -18.904
578 HE1 TYR 72 HE1 TYR 72 9.804 10.904 -17.749
579 HE2 TYR 72 HE2 TYR 72 8.415 7.849 -20.474
580 HH TYR 72 HH TYR 72 10.295 9.178 -20.858
581 HB2 TYR 72 HB2 TYR 72 6.412 8.352 -15.465
582 HB3 TYR 72 HB3 TYR 72 5.618 7.449 -16.753
583 H SER 73 HN SER 73 5.651 11.522 -17.735
584 HA SER 73 HA SER 73 5.118 10.582 -20.407
585 HG SER 73 HG SER 73 1.968 12.289 -20.103
586 HB2 SER 73 HB2 SER 73 3.939 13.193 -19.349
587 HB3 SER 73 HB3 SER 73 4.002 12.730 -21.058
588 HA PRO 74 HA PRO 74 9.142 12.255 -20.298
589 HB2 PRO 74 HB2 PRO 74 9.624 12.943 -22.978
590 HB3 PRO 74 HB3 PRO 74 9.740 11.301 -22.279
591 HG2 PRO 74 HG2 PRO 74 7.459 12.555 -23.805
592 HG3 PRO 74 HG3 PRO 74 8.093 10.883 -23.919
593 HD2 PRO 74 HD2 PRO 74 5.842 11.469 -22.513
594 HD3 PRO 74 HD3 PRO 74 7.001 10.237 -21.926
595 H ASP 75 HN ASP 75 7.113 14.321 -22.448
596 HA ASP 75 HA ASP 75 8.573 16.708 -22.046
597 HB2 ASP 75 HB2 ASP 75 6.979 16.421 -23.865
598 HB3 ASP 75 HB3 ASP 75 5.643 16.262 -22.721
599 H GLU 76 HN GLU 76 5.861 15.297 -20.197
600 HA GLU 76 HA GLU 76 5.480 17.590 -18.528
601 HB2 GLU 76 HB2 GLU 76 3.890 15.542 -19.080
602 HB3 GLU 76 HB3 GLU 76 4.712 14.785 -17.713
603 HG2 GLU 76 HG2 GLU 76 2.826 15.765 -16.743
604 HG3 GLU 76 HG3 GLU 76 4.079 16.952 -16.398
605 H TRP 77 HN TRP 77 7.540 14.684 -18.307
606 HA TRP 77 HA TRP 77 8.473 15.098 -15.625
607 HD1 TRP 77 HD1 TRP 77 10.913 14.223 -14.583
608 HE1 TRP 77 HE1 TRP 77 13.442 13.932 -14.731
609 HE3 TRP 77 HE3 TRP 77 11.257 12.810 -19.487
610 HZ2 TRP 77 HZ2 TRP 77 15.407 13.333 -16.789
611 HZ3 TRP 77 HZ3 TRP 77 13.469 12.404 -20.523
612 HH2 TRP 77 HH2 TRP 77 15.552 12.680 -19.191
613 HB2 TRP 77 HB2 TRP 77 8.924 12.978 -16.484
614 HB3 TRP 77 HB3 TRP 77 9.368 13.575 -18.062
615 H GLU 78 HN GLU 78 9.843 16.073 -18.850
616 HA GLU 78 HA GLU 78 11.987 17.457 -17.639
617 HB2 GLU 78 HB2 GLU 78 10.777 17.706 -20.422
618 HB3 GLU 78 HB3 GLU 78 12.255 18.541 -19.915
619 HG2 GLU 78 HG2 GLU 78 13.265 16.330 -19.297
620 HG3 GLU 78 HG3 GLU 78 11.847 15.523 -19.955
621 H ARG 79 HN ARG 79 8.786 18.668 -18.549
622 HA ARG 79 HA ARG 79 9.149 21.411 -17.923
623 HE ARG 79 HE ARG 79 5.428 21.963 -21.060
624 HB2 ARG 79 HB2 ARG 79 6.924 19.388 -17.692
625 HB3 ARG 79 HB3 ARG 79 6.684 20.999 -17.004
626 HG2 ARG 79 HG2 ARG 79 6.973 22.073 -19.144
627 HG3 ARG 79 HG3 ARG 79 7.437 20.540 -19.923
628 HD2 ARG 79 HD2 ARG 79 5.259 19.585 -19.524
629 HD3 ARG 79 HD3 ARG 79 4.767 20.959 -18.514
630 HH11 ARG 79 HH11 ARG 79 3.021 19.781 -19.593
631 HH12 ARG 79 HH12 ARG 79 1.772 20.179 -20.731
632 HH21 ARG 79 HH21 ARG 79 3.763 22.466 -22.588
633 HH22 ARG 79 HH22 ARG 79 2.214 21.723 -22.477
634 H GLN 80 HN GLN 80 8.270 18.657 -15.725
635 HA GLN 80 HA GLN 80 8.209 20.357 -13.447
636 HB2 GLN 80 HB2 GLN 80 8.316 17.337 -13.709
637 HB3 GLN 80 HB3 GLN 80 8.149 18.207 -12.168
638 HG2 GLN 80 HG2 GLN 80 6.085 19.213 -12.797
639 HG3 GLN 80 HG3 GLN 80 6.224 18.656 -14.462
640 HE21 GLN 80 HE22 GLN 80 5.723 16.537 -15.004
641 HE22 GLN 80 HE21 GLN 80 4.846 15.474 -13.904
642 H CYS 81 HN CYS 81 10.953 18.612 -14.965
643 HA CYS 81 HA CYS 81 12.788 18.951 -12.829
644 HG CYS 81 HG CYS 81 13.512 16.695 -13.764
645 HB2 CYS 81 HB2 CYS 81 13.357 19.286 -15.817
646 HB3 CYS 81 HB3 CYS 81 14.545 18.981 -14.548
647 H LYS 82 HN LYS 82 11.651 21.323 -15.311
648 HA LYS 82 HA LYS 82 13.516 23.361 -14.514
649 HB2 LYS 82 HB2 LYS 82 10.888 23.543 -16.060
650 HB3 LYS 82 HB3 LYS 82 12.000 24.884 -15.789
651 HG2 LYS 82 HG2 LYS 82 13.796 23.702 -16.979
652 HG3 LYS 82 HG3 LYS 82 12.732 22.310 -17.251
653 HD2 LYS 82 HD2 LYS 82 11.197 23.701 -18.581
654 HD3 LYS 82 HD3 LYS 82 12.209 25.134 -18.280
655 HE2 LYS 82 HE2 LYS 82 14.124 24.015 -19.388
656 HE3 LYS 82 HE3 LYS 82 13.129 22.586 -19.688
657 HZ1 LYS 82 HZ1 LYS 82 13.237 24.009 -21.631
658 HZ2 LYS 82 HZ2 LYS 82 11.700 23.960 -21.095
659 HZ3 LYS 82 HZ3 LYS 82 12.626 25.280 -20.820
660 H VAL 83 HN VAL 83 10.135 22.482 -13.641
661 HA VAL 83 HA VAL 83 9.726 24.683 -11.957
662 HB VAL 83 HB VAL 83 8.581 21.874 -11.717
663 HG11 VAL 83 HG11 VAL 83 8.243 23.060 -9.597
664 HG12 VAL 83 HG12 VAL 83 7.604 24.474 -10.467
665 HG13 VAL 83 HG13 VAL 83 6.719 22.929 -10.477
666 HG21 VAL 83 HG21 VAL 83 7.446 24.397 -13.012
667 HG22 VAL 83 HG22 VAL 83 8.056 22.988 -13.890
668 HG23 VAL 83 HG23 VAL 83 6.621 22.830 -12.881
669 H ALA 84 HN ALA 84 11.203 21.481 -11.172
670 HA ALA 84 HA ALA 84 11.695 21.957 -8.438
671 HB1 ALA 84 HB1 ALA 84 13.533 20.432 -10.342
672 HB2 ALA 84 HB2 ALA 84 13.366 20.212 -8.592
673 HB3 ALA 84 HB3 ALA 84 12.034 19.767 -9.679
674 H GLY 85 HN GLY 85 13.744 22.731 -11.287
675 HA2 GLY 85 HA2 GLY 85 15.791 24.040 -9.696
676 HA3 GLY 85 HA3 GLY 85 15.678 23.955 -11.460
677 H LYS 86 HN LYS 86 12.727 25.143 -10.251
678 HA LYS 86 HA LYS 86 11.674 27.071 -10.650
679 HB2 LYS 86 HB2 LYS 86 14.063 28.237 -9.168
680 HB3 LYS 86 HB3 LYS 86 12.524 29.061 -9.396
681 HG2 LYS 86 HG2 LYS 86 12.790 26.388 -7.945
682 HG3 LYS 86 HG3 LYS 86 12.876 27.939 -7.142
683 HD2 LYS 86 HD2 LYS 86 10.439 27.236 -8.826
684 HD3 LYS 86 HD3 LYS 86 10.629 26.647 -7.182
685 HE2 LYS 86 HE2 LYS 86 11.099 29.080 -6.487
686 HE3 LYS 86 HE3 LYS 86 10.536 29.557 -8.093
687 HZ1 LYS 86 HZ1 LYS 86 8.399 28.545 -7.560
688 HZ2 LYS 86 HZ2 LYS 86 8.956 28.033 -6.087
689 HZ3 LYS 86 HZ3 LYS 86 8.783 29.631 -6.409
690 H THR 87 HN THR 87 13.209 26.172 -12.819
691 HA THR 87 HA THR 87 14.159 26.692 -14.763
692 HB THR 87 HB THR 87 12.466 29.209 -14.741
693 HG1 THR 87 HG1 THR 87 11.205 27.561 -13.871
694 HG21 THR 87 HG21 THR 87 13.702 28.745 -16.846
695 HG22 THR 87 HG22 THR 87 13.048 27.096 -16.880
696 HG23 THR 87 HG23 THR 87 11.968 28.496 -17.074
697 H GLN 88 HN GLN 88 15.781 27.435 -12.566
698 HA GLN 88 HA GLN 88 16.939 30.014 -12.877
699 HB2 GLN 88 HB2 GLN 88 17.173 28.608 -10.854
700 HB3 GLN 88 HB3 GLN 88 18.149 27.444 -11.765
701 HG2 GLN 88 HG2 GLN 88 19.898 29.151 -12.100
702 HG3 GLN 88 HG3 GLN 88 18.874 30.371 -11.337
703 HE21 GLN 88 HE22 GLN 88 20.529 30.796 -9.729
704 HE22 GLN 88 HE21 GLN 88 20.810 29.678 -8.418
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