NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
24534 |
2k37   |
15742 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 MET 1 HT1 MET 1 -34.987 8.151 2.379
2 H2 MET 1 HT2 MET 1 -33.939 9.369 2.905
3 H3 MET 1 HT3 MET 1 -34.006 7.897 3.735
4 HA MET 1 HA MET 1 -32.029 8.024 2.373
5 HB2 MET 1 HB2 MET 1 -34.079 6.062 1.322
6 HB3 MET 1 HB1 MET 1 -32.336 5.906 1.162
7 HG2 MET 1 HG2 MET 1 -32.102 5.708 3.562
8 HG3 MET 1 HG1 MET 1 -33.835 5.955 3.771
9 HE1 MET 1 HE1 MET 1 -31.970 2.247 1.748
10 HE2 MET 1 HE2 MET 1 -31.034 3.584 2.417
11 HE3 MET 1 HE3 MET 1 -32.018 3.831 0.975
12 H SER 2 HN SER 2 -33.520 10.207 1.348
13 HA SER 2 HA SER 2 -33.181 9.795 -1.550
14 HB2 SER 2 HB2 SER 2 -35.102 11.676 -0.157
15 HB3 SER 2 HB1 SER 2 -34.893 11.534 -1.902
16 HG SER 2 HG SER 2 -35.545 9.317 -1.673
17 H GLY 3 HN GLY 3 -31.269 10.654 -2.068
18 HA2 GLY 3 HA2 GLY 3 -30.371 12.930 -2.638
19 HA3 GLY 3 HA1 GLY 3 -30.596 13.300 -0.935
20 H GLY 4 HN GLY 4 -29.269 12.175 0.622
21 HA2 GLY 4 HA2 GLY 4 -26.770 11.198 -0.556
22 HA3 GLY 4 HA1 GLY 4 -26.812 12.196 0.880
23 H GLY 5 HN GLY 5 -29.384 10.389 1.401
24 HA2 GLY 5 HA2 GLY 5 -28.192 8.770 3.359
25 HA3 GLY 5 HA1 GLY 5 -29.816 8.554 2.718
26 H VAL 6 HN VAL 6 -29.718 7.703 0.332
27 HA VAL 6 HA VAL 6 -28.688 5.086 0.434
28 HB VAL 6 HB VAL 6 -30.628 5.591 -0.900
29 HG11 VAL 6 HG11 VAL 6 -29.944 7.875 -1.541
30 HG12 VAL 6 HG12 VAL 6 -30.573 6.923 -2.886
31 HG13 VAL 6 HG13 VAL 6 -28.836 7.171 -2.717
32 HG21 VAL 6 HG21 VAL 6 -29.987 4.475 -3.004
33 HG22 VAL 6 HG22 VAL 6 -29.319 3.677 -1.581
34 HG23 VAL 6 HG23 VAL 6 -28.291 4.708 -2.578
35 H PHE 7 HN PHE 7 -27.645 7.974 -1.274
36 HA PHE 7 HA PHE 7 -25.575 6.891 -2.788
37 HB2 PHE 7 HB2 PHE 7 -26.540 9.212 -2.960
38 HB3 PHE 7 HB1 PHE 7 -25.561 9.652 -1.566
39 HD1 PHE 7 HD1 PHE 7 -23.069 9.513 -1.747
40 HD2 PHE 7 HD2 PHE 7 -25.633 9.149 -5.120
41 HE1 PHE 7 HE1 PHE 7 -21.173 10.018 -3.235
42 HE2 PHE 7 HE2 PHE 7 -23.744 9.649 -6.617
43 HZ PHE 7 HZ PHE 7 -21.511 10.084 -5.675
44 H THR 8 HN THR 8 -25.476 8.184 0.533
45 HA THR 8 HA THR 8 -22.682 7.823 0.852
46 HB THR 8 HB THR 8 -24.773 7.804 3.025
47 HG1 THR 8 HG1 THR 8 -24.188 9.751 1.415
48 HG21 THR 8 HG21 THR 8 -21.813 8.371 3.142
49 HG22 THR 8 HG22 THR 8 -22.610 6.921 3.755
50 HG23 THR 8 HG23 THR 8 -22.940 8.490 4.493
51 H ASP 9 HN ASP 9 -25.428 5.693 1.190
52 HA ASP 9 HA ASP 9 -24.104 3.580 2.566
53 HB2 ASP 9 HB2 ASP 9 -26.713 4.091 1.572
54 HB3 ASP 9 HB1 ASP 9 -26.164 2.594 0.826
55 H ILE 10 HN ILE 10 -24.633 4.509 -0.739
56 HA ILE 10 HA ILE 10 -23.474 2.299 -2.038
57 HB ILE 10 HB ILE 10 -23.798 5.204 -2.782
58 HG12 ILE 10 HG12 ILE 10 -25.241 2.723 -3.703
59 HG13 ILE 10 HG11 ILE 10 -25.842 3.864 -2.512
60 HG21 ILE 10 HG21 ILE 10 -21.916 4.420 -4.038
61 HG22 ILE 10 HG22 ILE 10 -23.309 4.522 -5.113
62 HG23 ILE 10 HG23 ILE 10 -22.779 2.953 -4.503
63 HD11 ILE 10 HD11 ILE 10 -26.866 4.226 -4.682
64 HD12 ILE 10 HD12 ILE 10 -25.275 4.483 -5.399
65 HD13 ILE 10 HD13 ILE 10 -25.894 5.614 -4.195
66 H LEU 11 HN LEU 11 -22.301 5.314 -0.771
67 HA LEU 11 HA LEU 11 -19.599 5.104 -1.560
68 HB2 LEU 11 HB2 LEU 11 -21.080 6.684 0.522
69 HB3 LEU 11 HB1 LEU 11 -19.337 6.768 0.415
70 HG LEU 11 HG LEU 11 -21.232 7.474 -1.828
71 HD11 LEU 11 HD11 LEU 11 -19.697 9.251 0.066
72 HD12 LEU 11 HD12 LEU 11 -21.448 9.045 0.012
73 HD13 LEU 11 HD13 LEU 11 -20.605 9.797 -1.343
74 HD21 LEU 11 HD21 LEU 11 -19.053 6.712 -2.615
75 HD22 LEU 11 HD22 LEU 11 -18.252 7.861 -1.542
76 HD23 LEU 11 HD23 LEU 11 -19.245 8.446 -2.877
77 H ALA 12 HN ALA 12 -21.432 4.134 1.225
78 HA ALA 12 HA ALA 12 -19.248 3.302 2.836
79 HB1 ALA 12 HB1 ALA 12 -22.202 2.724 2.885
80 HB2 ALA 12 HB2 ALA 12 -21.262 3.733 3.984
81 HB3 ALA 12 HB3 ALA 12 -21.085 1.977 4.031
82 H ALA 13 HN ALA 13 -21.374 1.746 0.536
83 HA ALA 13 HA ALA 13 -20.459 -0.897 0.906
84 HB1 ALA 13 HB1 ALA 13 -21.601 0.219 -1.648
85 HB2 ALA 13 HB2 ALA 13 -22.595 -0.134 -0.234
86 HB3 ALA 13 HB3 ALA 13 -21.704 -1.432 -1.034
87 H ALA 14 HN ALA 14 -19.757 1.439 -1.713
88 HA ALA 14 HA ALA 14 -17.744 -0.004 -2.968
89 HB1 ALA 14 HB1 ALA 14 -18.714 1.980 -3.981
90 HB2 ALA 14 HB2 ALA 14 -16.958 2.138 -3.868
91 HB3 ALA 14 HB3 ALA 14 -17.995 2.989 -2.723
92 H GLY 15 HN GLY 15 -17.512 2.378 -0.348
93 HA2 GLY 15 HA2 GLY 15 -14.730 2.408 -0.099
94 HA3 GLY 15 HA1 GLY 15 -15.866 2.739 1.207
95 H ARG 16 HN ARG 16 -17.182 0.341 1.343
96 HA ARG 16 HA ARG 16 -15.407 -1.250 2.867
97 HB2 ARG 16 HB2 ARG 16 -18.271 -1.328 2.082
98 HB3 ARG 16 HB1 ARG 16 -17.541 -2.828 2.627
99 HG2 ARG 16 HG2 ARG 16 -17.136 -0.390 4.264
100 HG3 ARG 16 HG1 ARG 16 -18.722 -1.165 4.286
101 HD2 ARG 16 HD2 ARG 16 -17.931 -3.066 5.258
102 HD3 ARG 16 HD1 ARG 16 -16.303 -2.862 4.613
103 HE ARG 16 HE ARG 16 -16.775 -0.788 6.399
104 HH11 ARG 16 HH11 ARG 16 -16.462 -4.256 6.449
105 HH12 ARG 16 HH12 ARG 16 -15.845 -4.307 8.066
106 HH21 ARG 16 HH21 ARG 16 -15.959 -0.845 8.533
107 HH22 ARG 16 HH22 ARG 16 -15.557 -2.369 9.249
108 H ILE 17 HN ILE 17 -16.632 -1.345 -0.404
109 HA ILE 17 HA ILE 17 -15.963 -4.051 -0.996
110 HB ILE 17 HB ILE 17 -16.415 -1.599 -2.703
111 HG12 ILE 17 HG12 ILE 17 -18.005 -3.989 -1.898
112 HG13 ILE 17 HG11 ILE 17 -18.474 -2.305 -1.976
113 HG21 ILE 17 HG21 ILE 17 -14.738 -3.023 -3.788
114 HG22 ILE 17 HG22 ILE 17 -16.252 -2.962 -4.687
115 HG23 ILE 17 HG23 ILE 17 -15.861 -4.381 -3.716
116 HD11 ILE 17 HD11 ILE 17 -18.504 -2.462 -4.439
117 HD12 ILE 17 HD12 ILE 17 -19.666 -3.525 -3.648
118 HD13 ILE 17 HD13 ILE 17 -18.165 -4.187 -4.294
119 H PHE 18 HN PHE 18 -14.625 -1.010 -1.928
120 HA PHE 18 HA PHE 18 -12.187 -1.750 -2.938
121 HB2 PHE 18 HB2 PHE 18 -13.099 0.443 -3.195
122 HB3 PHE 18 HB1 PHE 18 -13.119 0.713 -1.469
123 HD1 PHE 18 HD1 PHE 18 -11.139 1.201 -0.269
124 HD2 PHE 18 HD2 PHE 18 -11.046 0.698 -4.479
125 HE1 PHE 18 HE1 PHE 18 -8.926 2.299 -0.341
126 HE2 PHE 18 HE2 PHE 18 -8.834 1.779 -4.574
127 HZ PHE 18 HZ PHE 18 -7.772 2.584 -2.500
128 H GLU 19 HN GLU 19 -13.176 -1.112 0.387
129 HA GLU 19 HA GLU 19 -10.604 -1.152 1.526
130 HB2 GLU 19 HB2 GLU 19 -13.291 -0.973 2.481
131 HB3 GLU 19 HB1 GLU 19 -12.444 -2.188 3.424
132 HG2 GLU 19 HG2 GLU 19 -10.692 -0.565 3.938
133 HG3 GLU 19 HG1 GLU 19 -11.552 0.655 2.998
134 H VAL 20 HN VAL 20 -13.070 -3.710 1.345
135 HA VAL 20 HA VAL 20 -11.383 -5.695 2.471
136 HB VAL 20 HB VAL 20 -12.974 -7.346 1.674
137 HG11 VAL 20 HG11 VAL 20 -13.537 -5.827 3.616
138 HG12 VAL 20 HG12 VAL 20 -14.900 -6.639 2.850
139 HG13 VAL 20 HG13 VAL 20 -14.584 -4.939 2.508
140 HG21 VAL 20 HG21 VAL 20 -14.341 -5.141 0.144
141 HG22 VAL 20 HG22 VAL 20 -14.792 -6.845 0.195
142 HG23 VAL 20 HG23 VAL 20 -13.289 -6.354 -0.585
143 H MET 21 HN MET 21 -11.755 -4.282 -0.611
144 HA MET 21 HA MET 21 -10.396 -6.243 -2.176
145 HB2 MET 21 HB2 MET 21 -11.121 -3.340 -2.585
146 HB3 MET 21 HB1 MET 21 -10.219 -4.258 -3.789
147 HG2 MET 21 HG2 MET 21 -12.712 -5.502 -2.839
148 HG3 MET 21 HG1 MET 21 -12.905 -4.019 -3.773
149 HE1 MET 21 HE1 MET 21 -14.159 -6.725 -4.663
150 HE2 MET 21 HE2 MET 21 -13.720 -6.848 -6.367
151 HE3 MET 21 HE3 MET 21 -14.257 -5.304 -5.704
152 H VAL 22 HN VAL 22 -9.608 -3.498 -0.231
153 HA VAL 22 HA VAL 22 -6.945 -3.180 -1.171
154 HB VAL 22 HB VAL 22 -8.520 -1.987 1.068
155 HG11 VAL 22 HG11 VAL 22 -6.384 -2.398 2.118
156 HG12 VAL 22 HG12 VAL 22 -6.514 -0.683 1.730
157 HG13 VAL 22 HG13 VAL 22 -5.531 -1.744 0.721
158 HG21 VAL 22 HG21 VAL 22 -7.687 0.097 -0.117
159 HG22 VAL 22 HG22 VAL 22 -8.814 -0.920 -1.013
160 HG23 VAL 22 HG23 VAL 22 -7.090 -0.985 -1.375
161 H GLU 23 HN GLU 23 -8.463 -4.757 1.606
162 HA GLU 23 HA GLU 23 -6.175 -5.426 3.038
163 HB2 GLU 23 HB2 GLU 23 -8.649 -7.132 2.765
164 HB3 GLU 23 HB1 GLU 23 -7.523 -7.099 4.112
165 HG2 GLU 23 HG2 GLU 23 -9.214 -4.776 3.270
166 HG3 GLU 23 HG1 GLU 23 -9.663 -5.920 4.536
167 H GLY 24 HN GLY 24 -7.812 -7.050 0.387
168 HA2 GLY 24 HA2 GLY 24 -6.116 -9.325 0.316
169 HA3 GLY 24 HA1 GLY 24 -7.151 -8.768 -0.992
170 H HIS 25 HN HIS 25 -5.910 -6.083 -0.973
171 HA HIS 25 HA HIS 25 -3.934 -6.530 -2.932
172 HB2 HIS 25 HB2 HIS 25 -5.197 -4.367 -2.604
173 HB3 HIS 25 HB1 HIS 25 -4.172 -4.068 -1.199
174 HD1 HIS 25 HD1 HIS 25 -3.318 -5.162 -4.747
175 HD2 HIS 25 HD2 HIS 25 -2.313 -2.274 -1.934
176 HE1 HIS 25 HE1 HIS 25 -1.465 -3.822 -5.791
177 HE2 HIS 25 HE2 HIS 25 -0.813 -2.138 -4.036
178 H TRP 26 HN TRP 26 -3.720 -5.675 0.492
179 HA TRP 26 HA TRP 26 -0.870 -5.829 0.501
180 HB2 TRP 26 HB2 TRP 26 -2.746 -5.689 2.822
181 HB3 TRP 26 HB1 TRP 26 -1.023 -5.480 2.896
182 HD1 TRP 26 HD1 TRP 26 -4.202 -3.601 2.159
183 HE1 TRP 26 HE1 TRP 26 -3.625 -1.135 1.668
184 HE3 TRP 26 HE3 TRP 26 0.817 -4.066 1.798
185 HZ2 TRP 26 HZ2 TRP 26 -1.289 0.408 1.186
186 HZ3 TRP 26 HZ3 TRP 26 2.181 -2.078 1.325
187 HH2 TRP 26 HH2 TRP 26 1.151 0.121 1.020
188 H GLU 27 HN GLU 27 -3.243 -8.157 0.507
189 HA GLU 27 HA GLU 27 -1.995 -10.001 2.258
190 HB2 GLU 27 HB2 GLU 27 -4.020 -10.248 0.060
191 HB3 GLU 27 HB1 GLU 27 -3.311 -11.694 0.755
192 HG2 GLU 27 HG2 GLU 27 -4.650 -9.589 2.421
193 HG3 GLU 27 HG1 GLU 27 -5.525 -10.941 1.705
194 H THR 28 HN THR 28 -1.744 -9.263 -1.138
195 HA THR 28 HA THR 28 0.144 -11.380 -1.640
196 HB THR 28 HB THR 28 -1.514 -10.221 -3.333
197 HG1 THR 28 HG1 THR 28 1.122 -11.147 -3.835
198 HG21 THR 28 HG21 THR 28 1.005 -8.614 -3.764
199 HG22 THR 28 HG22 THR 28 -0.465 -7.973 -3.029
200 HG23 THR 28 HG23 THR 28 -0.487 -8.528 -4.702
201 H VAL 29 HN VAL 29 0.252 -8.103 -0.540
202 HA VAL 29 HA VAL 29 2.787 -7.428 -1.475
203 HB VAL 29 HB VAL 29 2.910 -5.709 0.171
204 HG11 VAL 29 HG11 VAL 29 1.573 -5.254 -1.731
205 HG12 VAL 29 HG12 VAL 29 0.789 -4.543 -0.318
206 HG13 VAL 29 HG13 VAL 29 0.179 -6.048 -1.002
207 HG21 VAL 29 HG21 VAL 29 1.318 -7.468 1.718
208 HG22 VAL 29 HG22 VAL 29 0.538 -5.893 1.612
209 HG23 VAL 29 HG23 VAL 29 2.187 -6.019 2.213
210 H GLY 30 HN GLY 30 1.805 -9.278 1.297
211 HA2 GLY 30 HA2 GLY 30 4.167 -9.379 2.728
212 HA3 GLY 30 HA1 GLY 30 3.074 -10.755 2.565
213 H MET 31 HN MET 31 3.732 -10.132 -0.469
214 HA MET 31 HA MET 31 6.033 -11.934 -0.644
215 HB2 MET 31 HB2 MET 31 4.011 -11.123 -2.737
216 HB3 MET 31 HB1 MET 31 5.266 -12.326 -2.935
217 HG2 MET 31 HG2 MET 31 2.792 -12.457 -1.257
218 HG3 MET 31 HG1 MET 31 3.305 -13.528 -2.554
219 HE1 MET 31 HE1 MET 31 3.307 -15.750 0.732
220 HE2 MET 31 HE2 MET 31 2.622 -15.575 -0.884
221 HE3 MET 31 HE3 MET 31 2.226 -14.404 0.373
222 H LEU 32 HN LEU 32 4.680 -9.322 -2.665
223 HA LEU 32 HA LEU 32 7.114 -8.584 -3.822
224 HB2 LEU 32 HB2 LEU 32 5.988 -6.671 -4.701
225 HB3 LEU 32 HB1 LEU 32 4.890 -8.033 -4.749
226 HG LEU 32 HG LEU 32 4.131 -6.986 -2.413
227 HD11 LEU 32 HD11 LEU 32 5.113 -4.636 -4.023
228 HD12 LEU 32 HD12 LEU 32 5.715 -5.154 -2.448
229 HD13 LEU 32 HD13 LEU 32 4.071 -4.536 -2.604
230 HD21 LEU 32 HD21 LEU 32 2.650 -7.477 -4.253
231 HD22 LEU 32 HD22 LEU 32 3.252 -6.081 -5.148
232 HD23 LEU 32 HD23 LEU 32 2.334 -5.847 -3.659
233 H PHE 33 HN PHE 33 5.438 -7.396 -1.003
234 HA PHE 33 HA PHE 33 7.143 -5.199 -0.463
235 HB2 PHE 33 HB2 PHE 33 4.835 -5.517 0.495
236 HB3 PHE 33 HB1 PHE 33 5.490 -6.782 1.529
237 HD1 PHE 33 HD1 PHE 33 7.752 -4.042 0.984
238 HD2 PHE 33 HD2 PHE 33 4.470 -5.365 3.349
239 HE1 PHE 33 HE1 PHE 33 8.298 -2.348 2.682
240 HE2 PHE 33 HE2 PHE 33 5.013 -3.677 5.052
241 HZ PHE 33 HZ PHE 33 6.927 -2.165 4.720
242 H ASP 34 HN ASP 34 7.095 -8.572 0.472
243 HA ASP 34 HA ASP 34 9.127 -8.520 2.401
244 HB2 ASP 34 HB2 ASP 34 7.423 -10.395 1.433
245 HB3 ASP 34 HB1 ASP 34 8.934 -10.926 0.700
246 H SER 35 HN SER 35 9.200 -8.731 -1.092
247 HA SER 35 HA SER 35 11.842 -9.559 -1.458
248 HB2 SER 35 HB2 SER 35 10.164 -7.738 -3.200
249 HB3 SER 35 HB1 SER 35 11.655 -8.533 -3.704
250 HG SER 35 HG SER 35 10.598 -10.542 -3.274
251 H LEU 36 HN LEU 36 10.543 -6.515 -0.454
252 HA LEU 36 HA LEU 36 13.250 -5.514 -0.112
253 HB2 LEU 36 HB2 LEU 36 12.575 -3.289 -1.095
254 HB3 LEU 36 HB1 LEU 36 12.804 -4.593 -2.242
255 HG LEU 36 HG LEU 36 10.045 -4.065 -1.245
256 HD11 LEU 36 HD11 LEU 36 9.696 -2.368 -2.947
257 HD12 LEU 36 HD12 LEU 36 11.401 -2.435 -3.391
258 HD13 LEU 36 HD13 LEU 36 10.926 -1.843 -1.799
259 HD21 LEU 36 HD21 LEU 36 11.229 -4.948 -3.875
260 HD22 LEU 36 HD22 LEU 36 9.506 -4.733 -3.563
261 HD23 LEU 36 HD23 LEU 36 10.414 -5.965 -2.686
262 H GLY 37 HN GLY 37 11.213 -6.405 1.691
263 HA2 GLY 37 HA2 GLY 37 10.963 -3.929 3.288
264 HA3 GLY 37 HA1 GLY 37 9.648 -5.104 3.206
265 H LYS 38 HN LYS 38 11.192 -7.375 3.134
266 HA LYS 38 HA LYS 38 11.792 -7.728 5.931
267 HB2 LYS 38 HB2 LYS 38 10.916 -9.381 3.822
268 HB3 LYS 38 HB1 LYS 38 12.519 -9.964 4.249
269 HG2 LYS 38 HG2 LYS 38 10.804 -11.156 5.482
270 HG3 LYS 38 HG1 LYS 38 11.811 -10.208 6.577
271 HD2 LYS 38 HD2 LYS 38 10.091 -8.453 6.616
272 HD3 LYS 38 HD1 LYS 38 9.082 -9.429 5.545
273 HE2 LYS 38 HE2 LYS 38 8.943 -11.174 7.225
274 HE3 LYS 38 HE1 LYS 38 10.029 -10.275 8.283
275 HZ1 LYS 38 HZ1 LYS 38 7.342 -9.368 7.401
276 HZ2 LYS 38 HZ2 LYS 38 8.380 -8.521 8.433
277 HZ3 LYS 38 HZ3 LYS 38 7.716 -9.995 8.927
278 H GLY 39 HN GLY 39 13.404 -8.021 2.819
279 HA2 GLY 39 HA2 GLY 39 16.007 -8.351 3.954
280 HA3 GLY 39 HA1 GLY 39 15.632 -8.096 2.260
281 H THR 40 HN THR 40 14.042 -5.685 2.887
282 HA THR 40 HA THR 40 16.117 -3.837 2.604
283 HB THR 40 HB THR 40 13.614 -3.626 1.887
284 HG1 THR 40 HG1 THR 40 14.611 -1.181 2.764
285 HG21 THR 40 HG21 THR 40 12.298 -2.205 3.322
286 HG22 THR 40 HG22 THR 40 13.620 -2.094 4.485
287 HG23 THR 40 HG23 THR 40 12.788 -3.629 4.240
288 H MET 41 HN MET 41 14.150 -4.759 5.338
289 HA MET 41 HA MET 41 14.755 -2.875 7.204
290 HB2 MET 41 HB2 MET 41 14.108 -5.750 7.294
291 HB3 MET 41 HB1 MET 41 14.903 -5.122 8.727
292 HG2 MET 41 HG2 MET 41 13.167 -3.374 8.882
293 HG3 MET 41 HG1 MET 41 12.349 -4.111 7.506
294 HE1 MET 41 HE1 MET 41 12.586 -7.170 7.929
295 HE2 MET 41 HE2 MET 41 11.055 -6.373 7.574
296 HE3 MET 41 HE3 MET 41 11.159 -7.524 8.903
297 H ARG 42 HN ARG 42 16.799 -5.492 6.057
298 HA ARG 42 HA ARG 42 18.892 -5.085 7.917
299 HB2 ARG 42 HB2 ARG 42 18.966 -7.168 6.953
300 HB3 ARG 42 HB1 ARG 42 18.625 -6.527 5.369
301 HG2 ARG 42 HG2 ARG 42 20.865 -5.666 5.165
302 HG3 ARG 42 HG1 ARG 42 21.224 -6.155 6.822
303 HD2 ARG 42 HD2 ARG 42 20.466 -8.048 4.600
304 HD3 ARG 42 HD1 ARG 42 22.121 -7.706 5.102
305 HE ARG 42 HE ARG 42 20.842 -8.484 7.391
306 HH11 ARG 42 HH11 ARG 42 21.350 -9.889 4.242
307 HH12 ARG 42 HH12 ARG 42 21.351 -11.518 4.828
308 HH21 ARG 42 HH21 ARG 42 20.844 -10.625 8.172
309 HH22 ARG 42 HH22 ARG 42 21.066 -11.937 7.063
310 H ILE 43 HN ILE 43 18.249 -3.975 4.650
311 HA ILE 43 HA ILE 43 20.625 -2.596 4.146
312 HB ILE 43 HB ILE 43 17.888 -1.732 3.228
313 HG12 ILE 43 HG12 ILE 43 19.672 -3.853 2.015
314 HG13 ILE 43 HG11 ILE 43 18.162 -4.146 2.875
315 HG21 ILE 43 HG21 ILE 43 20.620 -1.468 1.985
316 HG22 ILE 43 HG22 ILE 43 19.666 -0.174 2.713
317 HG23 ILE 43 HG23 ILE 43 19.107 -0.959 1.236
318 HD11 ILE 43 HD11 ILE 43 16.905 -3.039 1.159
319 HD12 ILE 43 HD12 ILE 43 17.947 -4.255 0.416
320 HD13 ILE 43 HD13 ILE 43 18.386 -2.548 0.336
321 H ASN 44 HN ASN 44 17.552 -1.457 5.458
322 HA ASN 44 HA ASN 44 18.284 1.198 5.946
323 HB2 ASN 44 HB2 ASN 44 16.208 -0.630 7.116
324 HB3 ASN 44 HB1 ASN 44 16.358 1.046 7.639
325 HD21 ASN 44 HD21 ASN 44 15.447 -1.091 5.073
326 HD22 ASN 44 HD22 ASN 44 14.680 0.092 4.077
327 H ARG 45 HN ARG 45 18.198 -1.595 8.162
328 HA ARG 45 HA ARG 45 19.073 -0.317 10.456
329 HB2 ARG 45 HB2 ARG 45 19.423 -3.123 9.451
330 HB3 ARG 45 HB1 ARG 45 20.160 -2.623 10.965
331 HG2 ARG 45 HG2 ARG 45 17.231 -2.441 10.336
332 HG3 ARG 45 HG1 ARG 45 17.994 -3.743 11.247
333 HD2 ARG 45 HD2 ARG 45 17.918 -0.825 12.007
334 HD3 ARG 45 HD1 ARG 45 16.993 -2.124 12.758
335 HE ARG 45 HE ARG 45 19.920 -2.244 12.809
336 HH11 ARG 45 HH11 ARG 45 16.891 -1.872 14.492
337 HH12 ARG 45 HH12 ARG 45 17.592 -2.085 16.061
338 HH21 ARG 45 HH21 ARG 45 20.849 -2.525 14.869
339 HH22 ARG 45 HH22 ARG 45 19.841 -2.458 16.276
340 H ASN 46 HN ASN 46 20.998 -1.854 7.894
341 HA ASN 46 HA ASN 46 23.472 -1.190 9.081
342 HB2 ASN 46 HB2 ASN 46 22.664 -1.995 6.288
343 HB3 ASN 46 HB1 ASN 46 24.323 -1.520 6.649
344 HD21 ASN 46 HD21 ASN 46 22.159 -4.048 6.538
345 HD22 ASN 46 HD22 ASN 46 23.057 -5.211 7.446
346 H ALA 47 HN ALA 47 21.374 0.307 6.709
347 HA ALA 47 HA ALA 47 23.022 2.549 6.140
348 HB1 ALA 47 HB1 ALA 47 20.028 2.288 5.848
349 HB2 ALA 47 HB2 ALA 47 21.217 1.805 4.638
350 HB3 ALA 47 HB3 ALA 47 21.052 3.503 5.084
351 H TYR 48 HN TYR 48 21.476 1.642 8.915
352 HA TYR 48 HA TYR 48 21.341 4.420 9.857
353 HB2 TYR 48 HB2 TYR 48 19.473 2.249 9.996
354 HB3 TYR 48 HB1 TYR 48 19.872 2.814 11.611
355 HD1 TYR 48 HD1 TYR 48 18.756 3.999 8.279
356 HD2 TYR 48 HD2 TYR 48 18.836 4.737 12.464
357 HE1 TYR 48 HE1 TYR 48 17.206 5.887 7.970
358 HE2 TYR 48 HE2 TYR 48 17.291 6.626 12.172
359 HH TYR 48 HH TYR 48 15.579 7.167 9.289
360 H GLY 49 HN GLY 49 22.922 1.451 10.203
361 HA2 GLY 49 HA2 GLY 49 23.472 1.332 12.948
362 HA3 GLY 49 HA1 GLY 49 24.503 0.678 11.682
363 H SER 50 HN SER 50 24.441 3.635 10.690
364 HA SER 50 HA SER 50 25.966 5.111 12.589
365 HB2 SER 50 HB2 SER 50 27.445 3.854 10.260
366 HB3 SER 50 HB1 SER 50 28.090 5.154 11.267
367 HG SER 50 HG SER 50 27.821 2.463 11.802
368 H MET 51 HN MET 51 24.886 4.556 9.331
369 HA MET 51 HA MET 51 25.366 7.156 8.305
370 HB2 MET 51 HB2 MET 51 23.503 4.939 7.459
371 HB3 MET 51 HB1 MET 51 23.759 6.405 6.520
372 HG2 MET 51 HG2 MET 51 25.802 4.305 7.204
373 HG3 MET 51 HG1 MET 51 25.086 4.612 5.623
374 HE1 MET 51 HE1 MET 51 27.518 4.679 4.565
375 HE2 MET 51 HE2 MET 51 28.252 4.414 6.146
376 HE3 MET 51 HE3 MET 51 28.807 5.743 5.129
377 H GLY 52 HN GLY 52 22.791 5.702 10.144
378 HA2 GLY 52 HA2 GLY 52 21.195 8.168 9.845
379 HA3 GLY 52 HA1 GLY 52 20.517 6.590 10.212
380 H GLY 53 HN GLY 53 23.390 8.034 11.664
381 HA2 GLY 53 HA2 GLY 53 22.012 8.848 14.050
382 HA3 GLY 53 HA1 GLY 53 22.902 7.348 14.260
383 H GLY 54 HN GLY 54 24.595 8.933 11.989
384 HA2 GLY 54 HA2 GLY 54 26.082 10.644 13.851
385 HA3 GLY 54 HA1 GLY 54 26.942 9.324 13.072
386 H SER 55 HN SER 55 25.979 9.382 10.526
387 HA SER 55 HA SER 55 27.389 11.599 9.420
388 HB2 SER 55 HB2 SER 55 26.806 9.124 8.499
389 HB3 SER 55 HB1 SER 55 25.572 10.057 7.662
390 HG SER 55 HG SER 55 28.367 10.550 7.612
391 H LEU 56 HN LEU 56 23.975 10.605 9.268
392 HA LEU 56 HA LEU 56 23.294 13.368 8.557
393 HB2 LEU 56 HB2 LEU 56 21.453 11.048 8.176
394 HB3 LEU 56 HB1 LEU 56 21.465 12.596 7.346
395 HG LEU 56 HG LEU 56 23.584 10.491 7.039
396 HD11 LEU 56 HD11 LEU 56 21.475 9.676 6.153
397 HD12 LEU 56 HD12 LEU 56 22.585 10.061 4.837
398 HD13 LEU 56 HD13 LEU 56 21.270 11.166 5.232
399 HD21 LEU 56 HD21 LEU 56 23.086 13.112 5.671
400 HD22 LEU 56 HD22 LEU 56 24.122 11.856 4.992
401 HD23 LEU 56 HD23 LEU 56 24.525 12.587 6.546
402 H ARG 57 HN ARG 57 22.936 10.897 10.884
403 HA ARG 57 HA ARG 57 21.712 10.619 12.764
404 HB2 ARG 57 HB2 ARG 57 21.561 13.514 13.270
405 HB3 ARG 57 HB1 ARG 57 22.187 12.211 14.264
406 HG2 ARG 57 HG2 ARG 57 24.108 12.203 12.486
407 HG3 ARG 57 HG1 ARG 57 23.550 13.856 12.220
408 HD2 ARG 57 HD2 ARG 57 24.551 12.643 14.787
409 HD3 ARG 57 HD1 ARG 57 25.296 13.934 13.845
410 HE ARG 57 HE ARG 57 22.662 14.607 14.715
411 HH11 ARG 57 HH11 ARG 57 25.995 14.432 15.713
412 HH12 ARG 57 HH12 ARG 57 25.830 15.655 16.930
413 HH21 ARG 57 HH21 ARG 57 22.434 16.220 16.315
414 HH22 ARG 57 HH22 ARG 57 23.806 16.671 17.271
415 H GLY 58 HN GLY 58 20.164 11.212 10.258
416 HA2 GLY 58 HA2 GLY 58 17.972 11.514 9.645
417 HA3 GLY 58 HA1 GLY 58 17.589 11.059 11.296
418 H SER 59 HN SER 59 19.485 13.893 10.516
419 HA SER 59 HA SER 59 17.333 15.745 10.498
420 HB2 SER 59 HB2 SER 59 17.198 15.164 12.873
421 HB3 SER 59 HB1 SER 59 18.913 15.528 13.074
422 HG SER 59 HG SER 59 16.943 17.393 12.237
Start of MODEL 2
1 H1 MET 1 HT1 MET 1 -33.612 15.901 2.521
2 H2 MET 1 HT2 MET 1 -33.965 16.397 0.944
3 H3 MET 1 HT3 MET 1 -32.415 15.838 1.328
4 HA MET 1 HA MET 1 -33.287 13.644 1.797
5 HB2 MET 1 HB2 MET 1 -35.900 14.715 0.715
6 HB3 MET 1 HB1 MET 1 -35.588 13.095 1.319
7 HG2 MET 1 HG2 MET 1 -36.742 14.129 3.045
8 HG3 MET 1 HG1 MET 1 -35.056 14.223 3.548
9 HE1 MET 1 HE1 MET 1 -37.477 15.963 4.750
10 HE2 MET 1 HE2 MET 1 -36.719 17.549 4.894
11 HE3 MET 1 HE3 MET 1 -35.824 16.099 5.349
12 H SER 2 HN SER 2 -31.641 14.597 -0.048
13 HA SER 2 HA SER 2 -32.197 13.001 -2.332
14 HB2 SER 2 HB2 SER 2 -32.194 14.806 -4.025
15 HB3 SER 2 HB1 SER 2 -33.597 14.903 -2.961
16 HG SER 2 HG SER 2 -32.068 16.852 -3.472
17 H GLY 3 HN GLY 3 -30.266 12.093 -2.516
18 HA2 GLY 3 HA2 GLY 3 -28.047 12.704 -3.606
19 HA3 GLY 3 HA1 GLY 3 -27.871 13.792 -2.236
20 H GLY 4 HN GLY 4 -27.316 12.976 -0.229
21 HA2 GLY 4 HA2 GLY 4 -25.981 10.433 -0.270
22 HA3 GLY 4 HA1 GLY 4 -26.095 11.517 1.103
23 H GLY 5 HN GLY 5 -29.154 11.026 -0.115
24 HA2 GLY 5 HA2 GLY 5 -29.991 9.497 2.130
25 HA3 GLY 5 HA1 GLY 5 -30.975 9.903 0.730
26 H VAL 6 HN VAL 6 -28.226 8.548 -0.336
27 HA VAL 6 HA VAL 6 -28.639 5.781 0.063
28 HB VAL 6 HB VAL 6 -30.486 6.676 -1.547
29 HG11 VAL 6 HG11 VAL 6 -28.193 6.316 -3.454
30 HG12 VAL 6 HG12 VAL 6 -28.977 7.844 -3.049
31 HG13 VAL 6 HG13 VAL 6 -29.879 6.587 -3.897
32 HG21 VAL 6 HG21 VAL 6 -30.551 4.504 -2.660
33 HG22 VAL 6 HG22 VAL 6 -30.122 4.328 -0.959
34 HG23 VAL 6 HG23 VAL 6 -28.874 4.215 -2.200
35 H PHE 7 HN PHE 7 -27.257 8.441 -1.718
36 HA PHE 7 HA PHE 7 -25.236 7.078 -3.112
37 HB2 PHE 7 HB2 PHE 7 -25.906 9.435 -3.529
38 HB3 PHE 7 HB1 PHE 7 -25.166 9.893 -2.000
39 HD1 PHE 7 HD1 PHE 7 -22.697 9.565 -1.718
40 HD2 PHE 7 HD2 PHE 7 -24.635 9.275 -5.490
41 HE1 PHE 7 HE1 PHE 7 -20.536 9.916 -2.850
42 HE2 PHE 7 HE2 PHE 7 -22.481 9.615 -6.632
43 HZ PHE 7 HZ PHE 7 -20.428 9.936 -5.310
44 H THR 8 HN THR 8 -25.562 8.025 0.210
45 HA THR 8 HA THR 8 -22.800 7.850 0.919
46 HB THR 8 HB THR 8 -25.240 7.588 2.645
47 HG1 THR 8 HG1 THR 8 -24.614 9.654 1.353
48 HG21 THR 8 HG21 THR 8 -22.374 8.160 3.382
49 HG22 THR 8 HG22 THR 8 -23.271 6.688 3.751
50 HG23 THR 8 HG23 THR 8 -23.738 8.216 4.497
51 H ASP 9 HN ASP 9 -25.526 5.639 0.870
52 HA ASP 9 HA ASP 9 -24.276 3.502 2.215
53 HB2 ASP 9 HB2 ASP 9 -26.133 2.355 1.757
54 HB3 ASP 9 HB1 ASP 9 -26.799 3.917 1.354
55 H ILE 10 HN ILE 10 -24.652 4.429 -1.102
56 HA ILE 10 HA ILE 10 -23.265 2.403 -2.388
57 HB ILE 10 HB ILE 10 -23.544 5.357 -2.940
58 HG12 ILE 10 HG12 ILE 10 -24.896 2.925 -4.105
59 HG13 ILE 10 HG11 ILE 10 -25.602 4.046 -2.955
60 HG21 ILE 10 HG21 ILE 10 -21.552 4.652 -4.090
61 HG22 ILE 10 HG22 ILE 10 -22.846 4.826 -5.276
62 HG23 ILE 10 HG23 ILE 10 -22.366 3.221 -4.724
63 HD11 ILE 10 HD11 ILE 10 -24.796 4.668 -5.783
64 HD12 ILE 10 HD12 ILE 10 -25.422 5.838 -4.620
65 HD13 ILE 10 HD13 ILE 10 -26.439 4.502 -5.161
66 H LEU 11 HN LEU 11 -22.315 5.151 -0.566
67 HA LEU 11 HA LEU 11 -19.516 5.079 -1.244
68 HB2 LEU 11 HB2 LEU 11 -21.209 6.631 0.666
69 HB3 LEU 11 HB1 LEU 11 -19.473 6.643 0.852
70 HG LEU 11 HG LEU 11 -20.977 7.525 -1.612
71 HD11 LEU 11 HD11 LEU 11 -20.252 9.776 -0.971
72 HD12 LEU 11 HD12 LEU 11 -19.554 9.126 0.512
73 HD13 LEU 11 HD13 LEU 11 -21.297 9.054 0.252
74 HD21 LEU 11 HD21 LEU 11 -18.795 8.373 -2.354
75 HD22 LEU 11 HD22 LEU 11 -18.796 6.620 -2.169
76 HD23 LEU 11 HD23 LEU 11 -18.037 7.635 -0.943
77 H ALA 12 HN ALA 12 -21.582 3.991 1.311
78 HA ALA 12 HA ALA 12 -19.560 3.183 3.129
79 HB1 ALA 12 HB1 ALA 12 -21.447 1.860 4.163
80 HB2 ALA 12 HB2 ALA 12 -22.475 2.465 2.855
81 HB3 ALA 12 HB3 ALA 12 -21.737 3.595 3.990
82 H ALA 13 HN ALA 13 -21.612 1.405 0.878
83 HA ALA 13 HA ALA 13 -20.486 -1.119 1.267
84 HB1 ALA 13 HB1 ALA 13 -21.694 -0.147 -1.317
85 HB2 ALA 13 HB2 ALA 13 -22.667 -0.529 0.105
86 HB3 ALA 13 HB3 ALA 13 -21.689 -1.785 -0.661
87 H ALA 14 HN ALA 14 -19.862 1.284 -1.311
88 HA ALA 14 HA ALA 14 -17.808 -0.074 -2.605
89 HB1 ALA 14 HB1 ALA 14 -18.203 2.895 -2.294
90 HB2 ALA 14 HB2 ALA 14 -18.793 1.876 -3.610
91 HB3 ALA 14 HB3 ALA 14 -17.059 2.140 -3.405
92 H GLY 15 HN GLY 15 -17.615 2.286 0.047
93 HA2 GLY 15 HA2 GLY 15 -14.836 2.374 0.272
94 HA3 GLY 15 HA1 GLY 15 -15.964 2.658 1.597
95 H ARG 16 HN ARG 16 -17.232 0.222 1.644
96 HA ARG 16 HA ARG 16 -15.438 -1.369 3.153
97 HB2 ARG 16 HB2 ARG 16 -18.287 -1.567 2.266
98 HB3 ARG 16 HB1 ARG 16 -17.500 -2.973 2.959
99 HG2 ARG 16 HG2 ARG 16 -17.360 -0.376 4.401
100 HG3 ARG 16 HG1 ARG 16 -18.855 -1.313 4.449
101 HD2 ARG 16 HD2 ARG 16 -17.960 -2.920 5.731
102 HD3 ARG 16 HD1 ARG 16 -16.389 -2.838 4.937
103 HE ARG 16 HE ARG 16 -16.474 -0.542 6.335
104 HH11 ARG 16 HH11 ARG 16 -17.044 -3.864 7.217
105 HH12 ARG 16 HH12 ARG 16 -16.508 -3.658 8.850
106 HH21 ARG 16 HH21 ARG 16 -15.765 -0.261 8.486
107 HH22 ARG 16 HH22 ARG 16 -15.781 -1.610 9.573
108 H ILE 17 HN ILE 17 -16.689 -1.441 -0.117
109 HA ILE 17 HA ILE 17 -15.948 -4.125 -0.738
110 HB ILE 17 HB ILE 17 -16.558 -1.694 -2.426
111 HG12 ILE 17 HG12 ILE 17 -18.029 -4.115 -1.517
112 HG13 ILE 17 HG11 ILE 17 -18.573 -2.456 -1.639
113 HG21 ILE 17 HG21 ILE 17 -16.452 -3.092 -4.408
114 HG22 ILE 17 HG22 ILE 17 -15.915 -4.460 -3.433
115 HG23 ILE 17 HG23 ILE 17 -14.888 -3.035 -3.596
116 HD11 ILE 17 HD11 ILE 17 -19.769 -3.778 -3.225
117 HD12 ILE 17 HD12 ILE 17 -18.267 -4.416 -3.895
118 HD13 ILE 17 HD13 ILE 17 -18.669 -2.710 -4.098
119 H PHE 18 HN PHE 18 -14.745 -1.036 -1.713
120 HA PHE 18 HA PHE 18 -12.331 -1.691 -2.821
121 HB2 PHE 18 HB2 PHE 18 -13.305 0.485 -3.013
122 HB3 PHE 18 HB1 PHE 18 -13.271 0.726 -1.283
123 HD1 PHE 18 HD1 PHE 18 -11.215 1.124 -0.132
124 HD2 PHE 18 HD2 PHE 18 -11.361 0.945 -4.367
125 HE1 PHE 18 HE1 PHE 18 -9.034 2.284 -0.245
126 HE2 PHE 18 HE2 PHE 18 -9.184 2.089 -4.505
127 HZ PHE 18 HZ PHE 18 -8.017 2.762 -2.440
128 H GLU 19 HN GLU 19 -13.168 -1.075 0.556
129 HA GLU 19 HA GLU 19 -10.564 -1.076 1.614
130 HB2 GLU 19 HB2 GLU 19 -13.264 -1.141 2.644
131 HB3 GLU 19 HB1 GLU 19 -12.212 -2.184 3.586
132 HG2 GLU 19 HG2 GLU 19 -11.711 0.725 2.989
133 HG3 GLU 19 HG1 GLU 19 -12.349 0.082 4.501
134 H VAL 20 HN VAL 20 -12.944 -3.700 1.440
135 HA VAL 20 HA VAL 20 -11.131 -5.658 2.445
136 HB VAL 20 HB VAL 20 -12.783 -7.315 1.822
137 HG11 VAL 20 HG11 VAL 20 -13.204 -5.441 3.669
138 HG12 VAL 20 HG12 VAL 20 -14.383 -6.702 3.325
139 HG13 VAL 20 HG13 VAL 20 -14.591 -5.093 2.632
140 HG21 VAL 20 HG21 VAL 20 -14.713 -6.837 0.475
141 HG22 VAL 20 HG22 VAL 20 -13.267 -6.373 -0.424
142 HG23 VAL 20 HG23 VAL 20 -14.257 -5.137 0.354
143 H MET 21 HN MET 21 -11.778 -4.236 -0.598
144 HA MET 21 HA MET 21 -10.550 -6.213 -2.257
145 HB2 MET 21 HB2 MET 21 -11.372 -3.335 -2.640
146 HB3 MET 21 HB1 MET 21 -10.497 -4.215 -3.890
147 HG2 MET 21 HG2 MET 21 -12.913 -5.515 -2.792
148 HG3 MET 21 HG1 MET 21 -13.162 -4.081 -3.787
149 HE1 MET 21 HE1 MET 21 -11.611 -5.105 -7.197
150 HE2 MET 21 HE2 MET 21 -10.819 -4.212 -5.898
151 HE3 MET 21 HE3 MET 21 -12.504 -3.879 -6.296
152 H VAL 22 HN VAL 22 -9.602 -3.503 -0.357
153 HA VAL 22 HA VAL 22 -7.036 -3.171 -1.556
154 HB VAL 22 HB VAL 22 -8.403 -1.939 0.793
155 HG11 VAL 22 HG11 VAL 22 -6.195 -2.337 1.665
156 HG12 VAL 22 HG12 VAL 22 -6.323 -0.632 1.230
157 HG13 VAL 22 HG13 VAL 22 -5.454 -1.748 0.176
158 HG21 VAL 22 HG21 VAL 22 -7.680 0.124 -0.496
159 HG22 VAL 22 HG22 VAL 22 -8.877 -0.907 -1.277
160 HG23 VAL 22 HG23 VAL 22 -7.189 -0.978 -1.784
161 H GLU 23 HN GLU 23 -8.289 -4.656 1.413
162 HA GLU 23 HA GLU 23 -5.847 -5.246 2.596
163 HB2 GLU 23 HB2 GLU 23 -7.001 -6.656 4.033
164 HB3 GLU 23 HB1 GLU 23 -8.211 -5.478 3.559
165 HG2 GLU 23 HG2 GLU 23 -9.176 -7.040 2.007
166 HG3 GLU 23 HG1 GLU 23 -7.902 -8.208 2.343
167 H GLY 24 HN GLY 24 -7.712 -6.981 0.195
168 HA2 GLY 24 HA2 GLY 24 -5.988 -9.251 0.072
169 HA3 GLY 24 HA1 GLY 24 -7.188 -8.790 -1.132
170 H HIS 25 HN HIS 25 -5.998 -6.084 -1.414
171 HA HIS 25 HA HIS 25 -4.284 -6.593 -3.573
172 HB2 HIS 25 HB2 HIS 25 -5.495 -4.427 -3.181
173 HB3 HIS 25 HB1 HIS 25 -4.341 -4.078 -1.896
174 HD1 HIS 25 HD1 HIS 25 -4.036 -5.081 -5.564
175 HD2 HIS 25 HD2 HIS 25 -2.392 -2.461 -2.789
176 HE1 HIS 25 HE1 HIS 25 -2.272 -3.797 -6.813
177 HE2 HIS 25 HE2 HIS 25 -1.235 -2.276 -5.094
178 H TRP 26 HN TRP 26 -3.629 -5.718 -0.211
179 HA TRP 26 HA TRP 26 -0.793 -5.833 -0.582
180 HB2 TRP 26 HB2 TRP 26 -2.339 -5.699 1.970
181 HB3 TRP 26 HB1 TRP 26 -0.627 -5.455 1.799
182 HD1 TRP 26 HD1 TRP 26 -3.907 -3.644 1.537
183 HE1 TRP 26 HE1 TRP 26 -3.463 -1.176 0.936
184 HE3 TRP 26 HE3 TRP 26 0.998 -4.031 0.394
185 HZ2 TRP 26 HZ2 TRP 26 -1.261 0.401 0.074
186 HZ3 TRP 26 HZ3 TRP 26 2.233 -2.023 -0.309
187 HH2 TRP 26 HH2 TRP 26 1.126 0.153 -0.471
188 H GLU 27 HN GLU 27 -3.125 -8.165 -0.245
189 HA GLU 27 HA GLU 27 -1.611 -9.988 1.312
190 HB2 GLU 27 HB2 GLU 27 -3.926 -10.318 -0.579
191 HB3 GLU 27 HB1 GLU 27 -3.156 -11.703 0.164
192 HG2 GLU 27 HG2 GLU 27 -4.382 -9.420 1.683
193 HG3 GLU 27 HG1 GLU 27 -5.193 -10.944 1.335
194 H THR 28 HN THR 28 -1.924 -9.281 -2.086
195 HA THR 28 HA THR 28 -0.122 -11.398 -2.861
196 HB THR 28 HB THR 28 -2.054 -10.352 -4.280
197 HG1 THR 28 HG1 THR 28 -1.065 -11.806 -5.469
198 HG21 THR 28 HG21 THR 28 -1.345 -8.626 -5.820
199 HG22 THR 28 HG22 THR 28 0.257 -8.584 -5.081
200 HG23 THR 28 HG23 THR 28 -1.153 -8.043 -4.167
201 H VAL 29 HN VAL 29 0.117 -8.116 -1.833
202 HA VAL 29 HA VAL 29 2.413 -7.377 -3.212
203 HB VAL 29 HB VAL 29 2.850 -5.708 -1.538
204 HG11 VAL 29 HG11 VAL 29 1.221 -5.198 -3.184
205 HG12 VAL 29 HG12 VAL 29 0.707 -4.516 -1.641
206 HG13 VAL 29 HG13 VAL 29 -0.038 -5.994 -2.243
207 HG21 VAL 29 HG21 VAL 29 0.793 -5.874 0.280
208 HG22 VAL 29 HG22 VAL 29 2.503 -6.161 0.574
209 HG23 VAL 29 HG23 VAL 29 1.442 -7.507 0.170
210 H GLY 30 HN GLY 30 2.025 -9.290 -0.327
211 HA2 GLY 30 HA2 GLY 30 4.629 -9.349 0.603
212 HA3 GLY 30 HA1 GLY 30 3.561 -10.755 0.636
213 H MET 31 HN MET 31 3.541 -10.156 -2.446
214 HA MET 31 HA MET 31 5.826 -11.858 -3.115
215 HB2 MET 31 HB2 MET 31 3.415 -11.075 -4.762
216 HB3 MET 31 HB1 MET 31 4.641 -12.238 -5.217
217 HG2 MET 31 HG2 MET 31 2.631 -12.477 -2.996
218 HG3 MET 31 HG1 MET 31 2.690 -13.401 -4.493
219 HE1 MET 31 HE1 MET 31 4.403 -15.261 -5.042
220 HE2 MET 31 HE2 MET 31 5.774 -15.696 -4.021
221 HE3 MET 31 HE3 MET 31 5.739 -14.130 -4.833
222 H LEU 32 HN LEU 32 4.015 -9.311 -4.807
223 HA LEU 32 HA LEU 32 6.127 -8.454 -6.422
224 HB2 LEU 32 HB2 LEU 32 4.733 -6.679 -7.097
225 HB3 LEU 32 HB1 LEU 32 3.671 -8.033 -6.766
226 HG LEU 32 HG LEU 32 3.617 -6.776 -4.366
227 HD11 LEU 32 HD11 LEU 32 3.366 -4.377 -4.784
228 HD12 LEU 32 HD12 LEU 32 3.890 -4.618 -6.452
229 HD13 LEU 32 HD13 LEU 32 5.004 -4.935 -5.122
230 HD21 LEU 32 HD21 LEU 32 1.871 -6.159 -6.749
231 HD22 LEU 32 HD22 LEU 32 1.445 -5.915 -5.055
232 HD23 LEU 32 HD23 LEU 32 1.696 -7.547 -5.674
233 H PHE 33 HN PHE 33 4.943 -7.287 -3.351
234 HA PHE 33 HA PHE 33 6.642 -5.034 -3.157
235 HB2 PHE 33 HB2 PHE 33 4.527 -5.367 -1.847
236 HB3 PHE 33 HB1 PHE 33 5.362 -6.592 -0.891
237 HD1 PHE 33 HD2 PHE 33 7.318 -5.897 0.521
238 HD2 PHE 33 HD1 PHE 33 4.758 -3.119 -1.407
239 HE1 PHE 33 HE2 PHE 33 8.124 -4.126 2.030
240 HE2 PHE 33 HE1 PHE 33 5.555 -1.326 0.093
241 HZ PHE 33 HZ PHE 33 7.280 -1.900 1.872
242 H ASP 34 HN ASP 34 6.931 -8.413 -2.336
243 HA ASP 34 HA ASP 34 9.188 -8.331 -0.662
244 HB2 ASP 34 HB2 ASP 34 7.541 -10.284 -1.681
245 HB3 ASP 34 HB1 ASP 34 9.055 -10.612 -2.515
246 H SER 35 HN SER 35 8.876 -8.222 -4.161
247 HA SER 35 HA SER 35 11.522 -8.701 -4.888
248 HB2 SER 35 HB2 SER 35 9.555 -6.773 -6.156
249 HB3 SER 35 HB1 SER 35 11.028 -7.373 -6.916
250 HG SER 35 HG SER 35 9.160 -8.560 -7.540
251 H LEU 36 HN LEU 36 10.133 -6.161 -3.135
252 HA LEU 36 HA LEU 36 12.698 -4.825 -2.905
253 HB2 LEU 36 HB2 LEU 36 11.672 -2.595 -3.252
254 HB3 LEU 36 HB1 LEU 36 11.679 -3.580 -4.702
255 HG LEU 36 HG LEU 36 9.243 -3.588 -2.987
256 HD11 LEU 36 HD11 LEU 36 9.769 -1.222 -3.194
257 HD12 LEU 36 HD12 LEU 36 8.374 -1.634 -4.192
258 HD13 LEU 36 HD13 LEU 36 9.955 -1.401 -4.938
259 HD21 LEU 36 HD21 LEU 36 9.371 -5.102 -4.882
260 HD22 LEU 36 HD22 LEU 36 9.723 -3.752 -5.960
261 HD23 LEU 36 HD23 LEU 36 8.150 -3.862 -5.170
262 H GLY 37 HN GLY 37 11.002 -6.474 -1.248
263 HA2 GLY 37 HA2 GLY 37 10.732 -4.665 1.049
264 HA3 GLY 37 HA1 GLY 37 9.372 -5.708 0.628
265 H LYS 38 HN LYS 38 12.086 -7.174 -0.276
266 HA LYS 38 HA LYS 38 12.950 -8.366 2.207
267 HB2 LYS 38 HB2 LYS 38 11.010 -9.547 0.505
268 HB3 LYS 38 HB1 LYS 38 12.512 -10.420 0.259
269 HG2 LYS 38 HG2 LYS 38 11.182 -11.485 1.979
270 HG3 LYS 38 HG1 LYS 38 12.649 -10.802 2.692
271 HD2 LYS 38 HD2 LYS 38 11.385 -8.820 3.365
272 HD3 LYS 38 HD1 LYS 38 9.923 -9.523 2.680
273 HE2 LYS 38 HE2 LYS 38 10.102 -11.406 4.255
274 HE3 LYS 38 HE1 LYS 38 11.543 -10.671 4.956
275 HZ1 LYS 38 HZ1 LYS 38 10.204 -8.764 5.607
276 HZ2 LYS 38 HZ2 LYS 38 9.585 -10.189 6.275
277 HZ3 LYS 38 HZ3 LYS 38 8.822 -9.480 4.943
278 H GLY 39 HN GLY 39 13.029 -8.318 -1.317
279 HA2 GLY 39 HA2 GLY 39 15.707 -9.313 -1.526
280 HA3 GLY 39 HA1 GLY 39 14.748 -8.623 -2.826
281 H THR 40 HN THR 40 14.327 -6.212 -0.978
282 HA THR 40 HA THR 40 16.869 -5.030 -0.580
283 HB THR 40 HB THR 40 16.689 -5.041 -3.036
284 HG1 THR 40 HG1 THR 40 17.070 -2.649 -3.166
285 HG21 THR 40 HG21 THR 40 14.441 -4.743 -3.551
286 HG22 THR 40 HG22 THR 40 15.173 -3.197 -3.980
287 HG23 THR 40 HG23 THR 40 14.282 -3.360 -2.469
288 H MET 41 HN MET 41 14.433 -5.359 0.907
289 HA MET 41 HA MET 41 12.834 -3.126 1.078
290 HB2 MET 41 HB2 MET 41 12.664 -3.801 3.546
291 HB3 MET 41 HB1 MET 41 12.164 -4.974 2.344
292 HG2 MET 41 HG2 MET 41 14.355 -6.057 2.536
293 HG3 MET 41 HG1 MET 41 14.786 -4.918 3.808
294 HE1 MET 41 HE1 MET 41 14.242 -8.338 5.694
295 HE2 MET 41 HE2 MET 41 15.408 -7.100 5.226
296 HE3 MET 41 HE3 MET 41 14.777 -8.218 4.017
297 H ARG 42 HN ARG 42 16.080 -3.649 2.294
298 HA ARG 42 HA ARG 42 16.183 -1.408 4.020
299 HB2 ARG 42 HB2 ARG 42 17.803 -3.239 4.150
300 HB3 ARG 42 HB1 ARG 42 18.441 -2.807 2.572
301 HG2 ARG 42 HG2 ARG 42 19.943 -1.953 4.155
302 HG3 ARG 42 HG1 ARG 42 19.015 -0.566 3.580
303 HD2 ARG 42 HD2 ARG 42 19.275 -0.557 6.025
304 HD3 ARG 42 HD1 ARG 42 17.587 -0.686 5.524
305 HE ARG 42 HE ARG 42 17.791 -3.089 5.996
306 HH11 ARG 42 HH11 ARG 42 20.000 -0.854 7.494
307 HH12 ARG 42 HH12 ARG 42 20.318 -1.877 8.855
308 HH21 ARG 42 HH21 ARG 42 18.201 -4.447 7.787
309 HH22 ARG 42 HH22 ARG 42 19.296 -3.919 9.021
310 H ILE 43 HN ILE 43 17.586 -1.829 0.751
311 HA ILE 43 HA ILE 43 18.416 0.768 0.345
312 HB ILE 43 HB ILE 43 17.213 -1.058 -1.742
313 HG12 ILE 43 HG12 ILE 43 20.074 -0.717 -0.812
314 HG13 ILE 43 HG11 ILE 43 19.057 -2.129 -0.550
315 HG21 ILE 43 HG21 ILE 43 17.363 1.256 -2.498
316 HG22 ILE 43 HG22 ILE 43 18.528 0.241 -3.344
317 HG23 ILE 43 HG23 ILE 43 19.066 1.302 -2.042
318 HD11 ILE 43 HD11 ILE 43 20.696 -2.454 -2.344
319 HD12 ILE 43 HD12 ILE 43 19.955 -1.129 -3.242
320 HD13 ILE 43 HD13 ILE 43 19.034 -2.599 -2.917
321 H ASN 44 HN ASN 44 15.209 -0.638 -0.236
322 HA ASN 44 HA ASN 44 14.023 1.701 -1.279
323 HB2 ASN 44 HB2 ASN 44 13.031 -0.865 -0.143
324 HB3 ASN 44 HB1 ASN 44 11.886 0.470 -0.257
325 HD21 ASN 44 HD21 ASN 44 14.070 -1.576 -2.076
326 HD22 ASN 44 HD22 ASN 44 13.291 -1.374 -3.604
327 H ARG 45 HN ARG 45 14.186 0.401 2.007
328 HA ARG 45 HA ARG 45 12.614 2.319 3.290
329 HB2 ARG 45 HB2 ARG 45 13.557 0.090 4.167
330 HB3 ARG 45 HB1 ARG 45 15.009 1.002 4.531
331 HG2 ARG 45 HG2 ARG 45 13.670 0.812 6.507
332 HG3 ARG 45 HG1 ARG 45 13.685 2.493 5.970
333 HD2 ARG 45 HD2 ARG 45 11.504 0.695 5.034
334 HD3 ARG 45 HD1 ARG 45 11.449 1.320 6.680
335 HE ARG 45 HE ARG 45 11.939 3.379 4.778
336 HH11 ARG 45 HH11 ARG 45 9.432 1.392 6.166
337 HH12 ARG 45 HH12 ARG 45 8.174 2.544 5.865
338 HH21 ARG 45 HH21 ARG 45 10.283 4.903 4.383
339 HH22 ARG 45 HH22 ARG 45 8.657 4.537 4.852
340 H ASN 46 HN ASN 46 16.156 2.165 2.956
341 HA ASN 46 HA ASN 46 16.712 4.600 4.222
342 HB2 ASN 46 HB2 ASN 46 18.213 2.953 2.185
343 HB3 ASN 46 HB1 ASN 46 18.861 4.462 2.813
344 HD21 ASN 46 HD21 ASN 46 18.044 1.156 3.563
345 HD22 ASN 46 HD22 ASN 46 18.901 1.096 5.051
346 H ALA 47 HN ALA 47 15.908 3.724 0.937
347 HA ALA 47 HA ALA 47 16.382 6.241 -0.268
348 HB1 ALA 47 HB1 ALA 47 14.484 4.031 -1.069
349 HB2 ALA 47 HB2 ALA 47 16.151 4.229 -1.610
350 HB3 ALA 47 HB3 ALA 47 14.926 5.406 -2.081
351 H TYR 48 HN TYR 48 13.559 4.755 1.214
352 HA TYR 48 HA TYR 48 11.707 6.813 0.670
353 HB2 TYR 48 HB2 TYR 48 11.645 4.282 1.826
354 HB3 TYR 48 HB1 TYR 48 11.191 5.364 3.138
355 HD1 TYR 48 HD1 TYR 48 10.291 4.293 -0.289
356 HD2 TYR 48 HD2 TYR 48 9.058 6.403 3.196
357 HE1 TYR 48 HE1 TYR 48 8.004 4.420 -1.182
358 HE2 TYR 48 HE2 TYR 48 6.769 6.537 2.312
359 HH TYR 48 HH TYR 48 5.620 6.441 0.151
360 H GLY 49 HN GLY 49 14.226 6.458 2.961
361 HA2 GLY 49 HA2 GLY 49 13.392 8.027 5.091
362 HA3 GLY 49 HA1 GLY 49 15.060 7.878 4.565
363 H SER 50 HN SER 50 13.530 9.072 1.941
364 HA SER 50 HA SER 50 13.125 11.788 2.694
365 HB2 SER 50 HB2 SER 50 15.595 11.712 2.791
366 HB3 SER 50 HB1 SER 50 15.631 11.158 1.113
367 HG SER 50 HG SER 50 15.179 13.122 0.444
368 H MET 51 HN MET 51 13.749 9.445 0.154
369 HA MET 51 HA MET 51 12.615 10.999 -1.949
370 HB2 MET 51 HB2 MET 51 13.149 8.040 -1.685
371 HB3 MET 51 HB1 MET 51 12.535 8.783 -3.153
372 HG2 MET 51 HG2 MET 51 15.164 9.414 -1.831
373 HG3 MET 51 HG1 MET 51 14.940 8.410 -3.261
374 HE1 MET 51 HE1 MET 51 13.593 11.033 -5.860
375 HE2 MET 51 HE2 MET 51 12.629 10.025 -4.781
376 HE3 MET 51 HE3 MET 51 14.039 9.347 -5.596
377 H GLY 52 HN GLY 52 11.385 8.734 0.406
378 HA2 GLY 52 HA2 GLY 52 8.797 8.501 -0.885
379 HA3 GLY 52 HA1 GLY 52 9.271 7.782 0.645
380 H GLY 53 HN GLY 53 9.427 11.156 -0.359
381 HA2 GLY 53 HA2 GLY 53 7.139 12.207 0.686
382 HA3 GLY 53 HA1 GLY 53 8.194 12.024 2.084
383 H GLY 54 HN GLY 54 9.954 12.456 -0.717
384 HA2 GLY 54 HA2 GLY 54 10.593 15.209 0.040
385 HA3 GLY 54 HA1 GLY 54 11.554 14.151 -0.981
386 H SER 55 HN SER 55 10.877 13.772 -3.147
387 HA SER 55 HA SER 55 9.899 16.164 -4.393
388 HB2 SER 55 HB2 SER 55 10.493 13.492 -5.640
389 HB3 SER 55 HB1 SER 55 10.326 15.025 -6.479
390 HG SER 55 HG SER 55 12.178 15.057 -4.454
391 H LEU 56 HN LEU 56 8.109 14.433 -2.702
392 HA LEU 56 HA LEU 56 5.945 13.773 -2.630
393 HB2 LEU 56 HB2 LEU 56 5.707 15.439 -5.130
394 HB3 LEU 56 HB1 LEU 56 4.386 14.941 -4.091
395 HG LEU 56 HG LEU 56 5.596 16.272 -2.245
396 HD11 LEU 56 HD11 LEU 56 7.717 16.547 -3.414
397 HD12 LEU 56 HD12 LEU 56 6.987 18.113 -3.050
398 HD13 LEU 56 HD13 LEU 56 6.908 17.460 -4.687
399 HD21 LEU 56 HD21 LEU 56 4.339 17.674 -4.602
400 HD22 LEU 56 HD22 LEU 56 4.544 18.364 -2.992
401 HD23 LEU 56 HD23 LEU 56 3.490 16.968 -3.226
402 H ARG 57 HN ARG 57 7.859 12.111 -4.044
403 HA ARG 57 HA ARG 57 6.912 11.134 -6.474
404 HB2 ARG 57 HB2 ARG 57 8.345 9.306 -6.182
405 HB3 ARG 57 HB1 ARG 57 9.105 10.594 -5.262
406 HG2 ARG 57 HG2 ARG 57 9.190 9.205 -3.549
407 HG3 ARG 57 HG1 ARG 57 7.433 9.317 -3.442
408 HD2 ARG 57 HD2 ARG 57 8.934 7.334 -5.147
409 HD3 ARG 57 HD1 ARG 57 8.274 6.985 -3.550
410 HE ARG 57 HE ARG 57 6.057 7.618 -4.620
411 HH11 ARG 57 HH11 ARG 57 8.700 6.188 -6.384
412 HH12 ARG 57 HH12 ARG 57 7.677 5.446 -7.568
413 HH21 ARG 57 HH21 ARG 57 4.703 6.643 -6.174
414 HH22 ARG 57 HH22 ARG 57 5.406 5.708 -7.452
415 H GLY 58 HN GLY 58 5.624 10.772 -3.337
416 HA2 GLY 58 HA2 GLY 58 3.500 9.068 -4.419
417 HA3 GLY 58 HA1 GLY 58 4.354 8.504 -2.992
418 H SER 59 HN SER 59 4.347 11.764 -2.738
419 HA SER 59 HA SER 59 1.898 11.728 -1.108
420 HB2 SER 59 HB2 SER 59 3.952 12.111 0.179
421 HB3 SER 59 HB1 SER 59 4.348 13.488 -0.849
422 HG SER 59 HG SER 59 2.622 14.595 -0.027
Start of MODEL 3
1 H1 MET 1 HT1 MET 1 -34.215 14.006 -4.916
2 H2 MET 1 HT2 MET 1 -34.250 12.339 -4.628
3 H3 MET 1 HT3 MET 1 -34.027 12.921 -6.201
4 HA MET 1 HA MET 1 -31.955 12.123 -5.252
5 HB2 MET 1 HB2 MET 1 -32.092 15.122 -5.630
6 HB3 MET 1 HB1 MET 1 -30.620 14.160 -5.684
7 HG2 MET 1 HG2 MET 1 -32.952 13.864 -7.562
8 HG3 MET 1 HG1 MET 1 -31.467 14.745 -7.913
9 HE1 MET 1 HE1 MET 1 -31.123 11.578 -10.180
10 HE2 MET 1 HE2 MET 1 -31.165 13.340 -10.123
11 HE3 MET 1 HE3 MET 1 -32.626 12.413 -9.789
12 H SER 2 HN SER 2 -31.879 11.417 -3.145
13 HA SER 2 HA SER 2 -32.200 13.089 -0.894
14 HB2 SER 2 HB2 SER 2 -30.812 10.418 -1.133
15 HB3 SER 2 HB1 SER 2 -31.232 11.203 0.389
16 HG SER 2 HG SER 2 -32.734 9.580 -0.914
17 H GLY 3 HN GLY 3 -29.342 11.767 -2.441
18 HA2 GLY 3 HA2 GLY 3 -27.231 12.698 -2.677
19 HA3 GLY 3 HA1 GLY 3 -27.802 14.119 -1.814
20 H GLY 4 HN GLY 4 -28.283 11.035 -0.353
21 HA2 GLY 4 HA2 GLY 4 -25.898 10.572 0.960
22 HA3 GLY 4 HA1 GLY 4 -26.756 11.750 1.941
23 H GLY 5 HN GLY 5 -29.372 10.601 1.074
24 HA2 GLY 5 HA2 GLY 5 -29.585 8.646 3.169
25 HA3 GLY 5 HA1 GLY 5 -30.886 9.201 2.126
26 H VAL 6 HN VAL 6 -28.135 8.240 0.478
27 HA VAL 6 HA VAL 6 -28.513 5.450 0.323
28 HB VAL 6 HB VAL 6 -30.496 6.583 -0.912
29 HG11 VAL 6 HG11 VAL 6 -28.379 6.707 -3.037
30 HG12 VAL 6 HG12 VAL 6 -29.151 8.089 -2.262
31 HG13 VAL 6 HG13 VAL 6 -30.101 7.000 -3.273
32 HG21 VAL 6 HG21 VAL 6 -30.145 4.202 -0.880
33 HG22 VAL 6 HG22 VAL 6 -28.867 4.341 -2.088
34 HG23 VAL 6 HG23 VAL 6 -30.539 4.696 -2.528
35 H PHE 7 HN PHE 7 -27.372 8.392 -1.278
36 HA PHE 7 HA PHE 7 -25.414 7.196 -2.905
37 HB2 PHE 7 HB2 PHE 7 -26.216 9.546 -3.136
38 HB3 PHE 7 HB1 PHE 7 -25.364 9.955 -1.652
39 HD1 PHE 7 HD1 PHE 7 -22.857 9.681 -1.601
40 HD2 PHE 7 HD2 PHE 7 -25.122 9.577 -5.199
41 HE1 PHE 7 HE1 PHE 7 -20.818 10.176 -2.893
42 HE2 PHE 7 HE2 PHE 7 -23.090 10.063 -6.500
43 HZ PHE 7 HZ PHE 7 -20.934 10.364 -5.347
44 H THR 8 HN THR 8 -25.527 8.003 0.462
45 HA THR 8 HA THR 8 -22.706 7.850 0.953
46 HB THR 8 HB THR 8 -24.955 7.505 2.903
47 HG1 THR 8 HG1 THR 8 -25.117 9.647 2.987
48 HG21 THR 8 HG21 THR 8 -22.799 6.784 3.776
49 HG22 THR 8 HG22 THR 8 -23.311 8.275 4.566
50 HG23 THR 8 HG23 THR 8 -22.081 8.324 3.303
51 H ASP 9 HN ASP 9 -25.437 5.652 1.069
52 HA ASP 9 HA ASP 9 -24.130 3.489 2.314
53 HB2 ASP 9 HB2 ASP 9 -26.014 2.348 1.930
54 HB3 ASP 9 HB1 ASP 9 -26.692 3.925 1.604
55 H ILE 10 HN ILE 10 -24.661 4.472 -0.958
56 HA ILE 10 HA ILE 10 -23.376 2.450 -2.354
57 HB ILE 10 HB ILE 10 -23.645 5.419 -2.830
58 HG12 ILE 10 HG12 ILE 10 -25.095 3.038 -3.982
59 HG13 ILE 10 HG11 ILE 10 -25.720 4.126 -2.756
60 HG21 ILE 10 HG21 ILE 10 -21.715 4.642 -4.093
61 HG22 ILE 10 HG22 ILE 10 -23.056 4.980 -5.187
62 HG23 ILE 10 HG23 ILE 10 -22.661 3.313 -4.766
63 HD11 ILE 10 HD11 ILE 10 -25.039 4.874 -5.588
64 HD12 ILE 10 HD12 ILE 10 -25.659 5.966 -4.348
65 HD13 ILE 10 HD13 ILE 10 -26.658 4.633 -4.930
66 H LEU 11 HN LEU 11 -22.300 5.150 -0.535
67 HA LEU 11 HA LEU 11 -19.535 5.035 -1.347
68 HB2 LEU 11 HB2 LEU 11 -21.093 6.617 0.665
69 HB3 LEU 11 HB1 LEU 11 -19.345 6.610 0.716
70 HG LEU 11 HG LEU 11 -21.010 7.493 -1.640
71 HD11 LEU 11 HD11 LEU 11 -19.464 9.102 0.387
72 HD12 LEU 11 HD12 LEU 11 -21.219 9.033 0.227
73 HD13 LEU 11 HD13 LEU 11 -20.244 9.746 -1.058
74 HD21 LEU 11 HD21 LEU 11 -18.852 6.571 -2.304
75 HD22 LEU 11 HD22 LEU 11 -18.035 7.638 -1.162
76 HD23 LEU 11 HD23 LEU 11 -18.894 8.318 -2.544
77 H ALA 12 HN ALA 12 -21.519 3.959 1.276
78 HA ALA 12 HA ALA 12 -19.450 3.119 3.023
79 HB1 ALA 12 HB1 ALA 12 -21.197 2.016 4.268
80 HB2 ALA 12 HB2 ALA 12 -22.293 2.115 2.887
81 HB3 ALA 12 HB3 ALA 12 -21.795 3.587 3.721
82 H ALA 13 HN ALA 13 -21.547 1.412 0.772
83 HA ALA 13 HA ALA 13 -20.462 -1.141 1.101
84 HB1 ALA 13 HB1 ALA 13 -21.660 -0.144 -1.472
85 HB2 ALA 13 HB2 ALA 13 -22.650 -0.431 -0.038
86 HB3 ALA 13 HB3 ALA 13 -21.742 -1.761 -0.769
87 H ALA 14 HN ALA 14 -19.861 1.272 -1.481
88 HA ALA 14 HA ALA 14 -17.825 -0.104 -2.791
89 HB1 ALA 14 HB1 ALA 14 -17.100 2.076 -3.652
90 HB2 ALA 14 HB2 ALA 14 -18.164 2.874 -2.494
91 HB3 ALA 14 HB3 ALA 14 -18.849 1.863 -3.769
92 H GLY 15 HN GLY 15 -17.639 2.216 -0.116
93 HA2 GLY 15 HA2 GLY 15 -14.851 2.332 0.088
94 HA3 GLY 15 HA1 GLY 15 -15.980 2.611 1.414
95 H ARG 16 HN ARG 16 -17.233 0.174 1.486
96 HA ARG 16 HA ARG 16 -15.417 -1.394 2.991
97 HB2 ARG 16 HB2 ARG 16 -18.276 -1.583 2.163
98 HB3 ARG 16 HB1 ARG 16 -17.486 -3.015 2.795
99 HG2 ARG 16 HG2 ARG 16 -17.181 -0.519 4.342
100 HG3 ARG 16 HG1 ARG 16 -18.780 -1.267 4.324
101 HD2 ARG 16 HD2 ARG 16 -18.072 -3.129 5.424
102 HD3 ARG 16 HD1 ARG 16 -16.421 -3.001 4.815
103 HE ARG 16 HE ARG 16 -16.734 -0.839 6.440
104 HH11 ARG 16 HH11 ARG 16 -17.064 -4.284 6.830
105 HH12 ARG 16 HH12 ARG 16 -16.625 -4.269 8.505
106 HH21 ARG 16 HH21 ARG 16 -16.155 -0.807 8.651
107 HH22 ARG 16 HH22 ARG 16 -16.109 -2.294 9.540
108 H ILE 17 HN ILE 17 -16.684 -1.483 -0.268
109 HA ILE 17 HA ILE 17 -15.942 -4.162 -0.894
110 HB ILE 17 HB ILE 17 -16.534 -1.720 -2.576
111 HG12 ILE 17 HG12 ILE 17 -18.025 -4.133 -1.676
112 HG13 ILE 17 HG11 ILE 17 -18.559 -2.473 -1.816
113 HG21 ILE 17 HG21 ILE 17 -15.868 -4.483 -3.578
114 HG22 ILE 17 HG22 ILE 17 -14.873 -3.037 -3.758
115 HG23 ILE 17 HG23 ILE 17 -16.439 -3.134 -4.561
116 HD11 ILE 17 HD11 ILE 17 -19.749 -3.797 -3.402
117 HD12 ILE 17 HD12 ILE 17 -18.246 -4.451 -4.052
118 HD13 ILE 17 HD13 ILE 17 -18.634 -2.745 -4.273
119 H PHE 18 HN PHE 18 -14.730 -1.071 -1.843
120 HA PHE 18 HA PHE 18 -12.307 -1.731 -2.945
121 HB2 PHE 18 HB2 PHE 18 -13.287 0.435 -3.156
122 HB3 PHE 18 HB1 PHE 18 -13.268 0.690 -1.428
123 HD1 PHE 18 HD1 PHE 18 -11.239 1.153 -0.267
124 HD2 PHE 18 HD2 PHE 18 -11.314 0.848 -4.497
125 HE1 PHE 18 HE1 PHE 18 -9.065 2.325 -0.380
126 HE2 PHE 18 HE2 PHE 18 -9.142 2.003 -4.632
127 HZ PHE 18 HZ PHE 18 -8.016 2.746 -2.570
128 H GLU 19 HN GLU 19 -13.181 -1.107 0.415
129 HA GLU 19 HA GLU 19 -10.576 -1.072 1.468
130 HB2 GLU 19 HB2 GLU 19 -13.273 -1.125 2.516
131 HB3 GLU 19 HB1 GLU 19 -12.196 -2.122 3.481
132 HG2 GLU 19 HG2 GLU 19 -10.694 -0.230 3.779
133 HG3 GLU 19 HG1 GLU 19 -11.749 0.772 2.782
134 H VAL 20 HN VAL 20 -12.950 -3.713 1.371
135 HA VAL 20 HA VAL 20 -11.150 -5.627 2.459
136 HB VAL 20 HB VAL 20 -12.741 -7.329 1.748
137 HG11 VAL 20 HG11 VAL 20 -14.542 -6.707 3.091
138 HG12 VAL 20 HG12 VAL 20 -14.456 -5.016 2.603
139 HG13 VAL 20 HG13 VAL 20 -13.231 -5.687 3.682
140 HG21 VAL 20 HG21 VAL 20 -14.643 -6.849 0.359
141 HG22 VAL 20 HG22 VAL 20 -13.175 -6.361 -0.490
142 HG23 VAL 20 HG23 VAL 20 -14.196 -5.145 0.276
143 H MET 21 HN MET 21 -11.734 -4.284 -0.629
144 HA MET 21 HA MET 21 -10.414 -6.235 -2.232
145 HB2 MET 21 HB2 MET 21 -11.240 -3.360 -2.627
146 HB3 MET 21 HB1 MET 21 -10.329 -4.233 -3.858
147 HG2 MET 21 HG2 MET 21 -12.716 -5.624 -2.873
148 HG3 MET 21 HG1 MET 21 -13.037 -4.115 -3.725
149 HE1 MET 21 HE1 MET 21 -10.106 -6.701 -4.268
150 HE2 MET 21 HE2 MET 21 -10.774 -7.704 -5.557
151 HE3 MET 21 HE3 MET 21 -11.506 -7.724 -3.952
152 H VAL 22 HN VAL 22 -9.580 -3.433 -0.385
153 HA VAL 22 HA VAL 22 -6.964 -3.129 -1.457
154 HB VAL 22 HB VAL 22 -8.441 -1.850 0.799
155 HG11 VAL 22 HG11 VAL 22 -5.474 -1.629 0.284
156 HG12 VAL 22 HG12 VAL 22 -6.260 -2.186 1.763
157 HG13 VAL 22 HG13 VAL 22 -6.399 -0.498 1.272
158 HG21 VAL 22 HG21 VAL 22 -8.859 -0.886 -1.309
159 HG22 VAL 22 HG22 VAL 22 -7.159 -0.966 -1.766
160 HG23 VAL 22 HG23 VAL 22 -7.686 0.181 -0.535
161 H GLU 23 HN GLU 23 -8.305 -4.390 1.583
162 HA GLU 23 HA GLU 23 -5.898 -5.063 2.806
163 HB2 GLU 23 HB2 GLU 23 -8.512 -6.557 3.024
164 HB3 GLU 23 HB1 GLU 23 -7.202 -6.542 4.195
165 HG2 GLU 23 HG2 GLU 23 -8.700 -4.080 3.397
166 HG3 GLU 23 HG1 GLU 23 -9.194 -5.110 4.741
167 H GLY 24 HN GLY 24 -8.005 -6.876 0.656
168 HA2 GLY 24 HA2 GLY 24 -6.468 -9.246 0.600
169 HA3 GLY 24 HA1 GLY 24 -7.640 -8.752 -0.615
170 H HIS 25 HN HIS 25 -6.242 -6.183 -1.091
171 HA HIS 25 HA HIS 25 -4.599 -7.004 -3.223
172 HB2 HIS 25 HB2 HIS 25 -5.647 -4.716 -2.982
173 HB3 HIS 25 HB1 HIS 25 -4.405 -4.357 -1.781
174 HD1 HIS 25 HD1 HIS 25 -4.168 -5.905 -5.257
175 HD2 HIS 25 HD2 HIS 25 -2.559 -2.819 -2.988
176 HE1 HIS 25 HE1 HIS 25 -2.410 -4.847 -6.709
177 HE2 HIS 25 HE2 HIS 25 -1.412 -3.017 -5.296
178 H TRP 26 HN TRP 26 -3.829 -5.846 0.033
179 HA TRP 26 HA TRP 26 -1.027 -6.226 -0.364
180 HB2 TRP 26 HB2 TRP 26 -2.482 -5.697 2.196
181 HB3 TRP 26 HB1 TRP 26 -0.762 -5.596 1.957
182 HD1 TRP 26 HD1 TRP 26 -3.961 -3.648 1.389
183 HE1 TRP 26 HE1 TRP 26 -3.354 -1.275 0.584
184 HE3 TRP 26 HE3 TRP 26 0.983 -4.360 0.615
185 HZ2 TRP 26 HZ2 TRP 26 -1.029 0.107 -0.276
186 HZ3 TRP 26 HZ3 TRP 26 2.357 -2.493 -0.195
187 HH2 TRP 26 HH2 TRP 26 1.372 -0.298 -0.637
188 H GLU 27 HN GLU 27 -3.601 -8.272 0.525
189 HA GLU 27 HA GLU 27 -2.182 -10.070 2.169
190 HB2 GLU 27 HB2 GLU 27 -4.484 -10.444 0.249
191 HB3 GLU 27 HB1 GLU 27 -3.825 -11.779 1.174
192 HG2 GLU 27 HG2 GLU 27 -4.996 -9.278 2.364
193 HG3 GLU 27 HG1 GLU 27 -5.836 -10.817 2.204
194 H THR 28 HN THR 28 -2.471 -9.546 -1.197
195 HA THR 28 HA THR 28 -1.042 -11.870 -2.032
196 HB THR 28 HB THR 28 -1.513 -9.361 -3.621
197 HG1 THR 28 HG1 THR 28 -3.269 -11.523 -3.042
198 HG21 THR 28 HG21 THR 28 -1.594 -11.008 -5.480
199 HG22 THR 28 HG22 THR 28 -1.117 -12.251 -4.322
200 HG23 THR 28 HG23 THR 28 -0.031 -10.902 -4.669
201 H VAL 29 HN VAL 29 -0.281 -8.578 -1.186
202 HA VAL 29 HA VAL 29 2.201 -8.462 -2.455
203 HB VAL 29 HB VAL 29 2.667 -6.489 -1.287
204 HG11 VAL 29 HG11 VAL 29 1.069 -6.279 -3.012
205 HG12 VAL 29 HG12 VAL 29 0.563 -5.228 -1.680
206 HG13 VAL 29 HG13 VAL 29 -0.235 -6.781 -1.939
207 HG21 VAL 29 HG21 VAL 29 2.252 -6.208 0.844
208 HG22 VAL 29 HG22 VAL 29 1.324 -7.702 0.860
209 HG23 VAL 29 HG23 VAL 29 0.527 -6.176 0.508
210 H GLY 30 HN GLY 30 1.343 -9.537 0.771
211 HA2 GLY 30 HA2 GLY 30 3.848 -9.717 1.901
212 HA3 GLY 30 HA1 GLY 30 2.581 -10.916 2.179
213 H MET 31 HN MET 31 2.785 -11.148 -0.938
214 HA MET 31 HA MET 31 4.883 -13.195 -0.941
215 HB2 MET 31 HB2 MET 31 2.815 -12.842 -3.082
216 HB3 MET 31 HB1 MET 31 3.681 -14.291 -2.612
217 HG2 MET 31 HG2 MET 31 1.472 -12.930 -1.095
218 HG3 MET 31 HG1 MET 31 1.389 -14.469 -1.947
219 HE1 MET 31 HE1 MET 31 0.470 -14.089 1.148
220 HE2 MET 31 HE2 MET 31 1.089 -15.621 1.764
221 HE3 MET 31 HE3 MET 31 0.325 -15.553 0.176
222 H LEU 32 HN LEU 32 3.394 -11.073 -3.403
223 HA LEU 32 HA LEU 32 5.627 -11.008 -5.073
224 HB2 LEU 32 HB2 LEU 32 4.557 -9.215 -6.260
225 HB3 LEU 32 HB1 LEU 32 3.373 -10.427 -5.825
226 HG LEU 32 HG LEU 32 3.009 -8.809 -3.761
227 HD11 LEU 32 HD11 LEU 32 3.162 -6.464 -4.471
228 HD12 LEU 32 HD12 LEU 32 4.001 -6.977 -5.937
229 HD13 LEU 32 HD13 LEU 32 4.747 -7.230 -4.358
230 HD21 LEU 32 HD21 LEU 32 1.889 -8.347 -6.519
231 HD22 LEU 32 HD22 LEU 32 1.174 -7.776 -5.011
232 HD23 LEU 32 HD23 LEU 32 1.292 -9.506 -5.331
233 H PHE 33 HN PHE 33 4.747 -9.066 -2.359
234 HA PHE 33 HA PHE 33 6.664 -6.986 -2.791
235 HB2 PHE 33 HB2 PHE 33 4.610 -6.724 -1.371
236 HB3 PHE 33 HB1 PHE 33 5.343 -7.793 -0.179
237 HD1 PHE 33 HD1 PHE 33 7.710 -5.633 -1.807
238 HD2 PHE 33 HD2 PHE 33 4.860 -5.842 1.348
239 HE1 PHE 33 HE1 PHE 33 8.763 -3.690 -0.730
240 HE2 PHE 33 HE2 PHE 33 5.912 -3.901 2.430
241 HZ PHE 33 HZ PHE 33 7.865 -2.821 1.392
242 H ASP 34 HN ASP 34 6.550 -9.979 -1.002
243 HA ASP 34 HA ASP 34 8.880 -9.782 0.494
244 HB2 ASP 34 HB2 ASP 34 7.364 -11.529 0.983
245 HB3 ASP 34 HB1 ASP 34 7.377 -12.111 -0.676
246 H SER 35 HN SER 35 8.389 -10.792 -2.843
247 HA SER 35 HA SER 35 10.918 -11.872 -3.340
248 HB2 SER 35 HB2 SER 35 9.026 -12.142 -4.885
249 HB3 SER 35 HB1 SER 35 9.087 -10.421 -5.266
250 HG SER 35 HG SER 35 10.591 -12.462 -6.238
251 H LEU 36 HN LEU 36 9.825 -8.567 -3.183
252 HA LEU 36 HA LEU 36 12.606 -7.703 -3.544
253 HB2 LEU 36 HB2 LEU 36 11.800 -5.688 -4.759
254 HB3 LEU 36 HB1 LEU 36 11.590 -7.188 -5.641
255 HG LEU 36 HG LEU 36 9.294 -6.171 -4.042
256 HD11 LEU 36 HD11 LEU 36 10.109 -4.183 -5.217
257 HD12 LEU 36 HD12 LEU 36 8.573 -4.743 -5.878
258 HD13 LEU 36 HD13 LEU 36 10.077 -5.072 -6.739
259 HD21 LEU 36 HD21 LEU 36 9.539 -7.542 -6.717
260 HD22 LEU 36 HD22 LEU 36 8.032 -7.167 -5.881
261 HD23 LEU 36 HD23 LEU 36 9.163 -8.327 -5.184
262 H GLY 37 HN GLY 37 11.049 -8.164 -1.154
263 HA2 GLY 37 HA2 GLY 37 10.946 -5.405 -0.099
264 HA3 GLY 37 HA1 GLY 37 9.887 -6.698 0.466
265 H LYS 38 HN LYS 38 11.550 -8.778 0.686
266 HA LYS 38 HA LYS 38 12.919 -8.190 3.093
267 HB2 LYS 38 HB2 LYS 38 12.052 -10.486 1.690
268 HB3 LYS 38 HB1 LYS 38 13.800 -10.643 1.813
269 HG2 LYS 38 HG2 LYS 38 12.750 -11.754 3.679
270 HG3 LYS 38 HG1 LYS 38 13.632 -10.339 4.256
271 HD2 LYS 38 HD2 LYS 38 11.557 -9.068 4.365
272 HD3 LYS 38 HD1 LYS 38 10.661 -10.449 3.728
273 HE2 LYS 38 HE2 LYS 38 11.304 -11.763 5.698
274 HE3 LYS 38 HE1 LYS 38 12.182 -10.372 6.333
275 HZ1 LYS 38 HZ1 LYS 38 10.117 -9.149 6.464
276 HZ2 LYS 38 HZ2 LYS 38 9.976 -10.599 7.323
277 HZ3 LYS 38 HZ3 LYS 38 9.261 -10.448 5.798
278 H GLY 39 HN GLY 39 13.871 -8.999 -0.199
279 HA2 GLY 39 HA2 GLY 39 16.644 -8.602 0.158
280 HA3 GLY 39 HA1 GLY 39 15.788 -8.566 -1.382
281 H THR 40 HN THR 40 13.962 -6.444 -0.266
282 HA THR 40 HA THR 40 15.497 -4.223 0.428
283 HB THR 40 HB THR 40 16.245 -4.559 -1.869
284 HG1 THR 40 HG1 THR 40 15.056 -2.233 -0.931
285 HG21 THR 40 HG21 THR 40 13.559 -3.623 -2.806
286 HG22 THR 40 HG22 THR 40 13.950 -5.336 -2.669
287 HG23 THR 40 HG23 THR 40 14.882 -4.304 -3.752
288 H MET 41 HN MET 41 13.641 -4.438 1.926
289 HA MET 41 HA MET 41 11.078 -3.573 1.032
290 HB2 MET 41 HB2 MET 41 12.232 -4.667 3.406
291 HB3 MET 41 HB1 MET 41 11.370 -3.188 3.843
292 HG2 MET 41 HG2 MET 41 9.492 -4.224 2.367
293 HG3 MET 41 HG1 MET 41 10.343 -5.728 2.685
294 HE1 MET 41 HE1 MET 41 8.447 -2.690 4.229
295 HE2 MET 41 HE2 MET 41 9.974 -2.606 5.107
296 HE3 MET 41 HE3 MET 41 8.493 -3.048 5.955
297 H ARG 42 HN ARG 42 13.665 -2.046 2.928
298 HA ARG 42 HA ARG 42 12.492 0.413 3.409
299 HB2 ARG 42 HB2 ARG 42 14.683 -0.344 4.324
300 HB3 ARG 42 HB1 ARG 42 15.408 -0.065 2.750
301 HG2 ARG 42 HG2 ARG 42 15.918 1.933 3.567
302 HG3 ARG 42 HG1 ARG 42 14.230 2.332 3.254
303 HD2 ARG 42 HD2 ARG 42 15.401 1.346 5.850
304 HD3 ARG 42 HD1 ARG 42 14.833 2.979 5.508
305 HE ARG 42 HE ARG 42 12.646 1.468 5.042
306 HH11 ARG 42 HH11 ARG 42 14.861 1.693 7.722
307 HH12 ARG 42 HH12 ARG 42 13.677 1.249 8.905
308 HH21 ARG 42 HH21 ARG 42 11.079 0.881 6.594
309 HH22 ARG 42 HH22 ARG 42 11.527 0.791 8.264
310 H ILE 43 HN ILE 43 14.683 -0.360 0.686
311 HA ILE 43 HA ILE 43 14.429 2.037 -0.680
312 HB ILE 43 HB ILE 43 14.745 -0.698 -1.919
313 HG12 ILE 43 HG12 ILE 43 16.808 1.279 -0.921
314 HG13 ILE 43 HG11 ILE 43 16.451 -0.298 -0.228
315 HG21 ILE 43 HG21 ILE 43 15.444 2.033 -2.983
316 HG22 ILE 43 HG22 ILE 43 14.117 1.010 -3.534
317 HG23 ILE 43 HG23 ILE 43 15.786 0.496 -3.779
318 HD11 ILE 43 HD11 ILE 43 17.258 -1.374 -2.269
319 HD12 ILE 43 HD12 ILE 43 18.494 -0.362 -1.521
320 HD13 ILE 43 HD13 ILE 43 17.630 0.211 -2.948
321 H ASN 44 HN ASN 44 12.389 -0.851 -0.775
322 HA ASN 44 HA ASN 44 10.700 -0.064 -2.866
323 HB2 ASN 44 HB2 ASN 44 10.438 -1.911 -0.544
324 HB3 ASN 44 HB1 ASN 44 8.974 -1.477 -1.417
325 HD21 ASN 44 HD21 ASN 44 12.221 -1.861 -2.708
326 HD22 ASN 44 HD22 ASN 44 11.852 -3.196 -3.740
327 H ARG 45 HN ARG 45 10.615 0.677 0.586
328 HA ARG 45 HA ARG 45 8.139 2.014 0.638
329 HB2 ARG 45 HB2 ARG 45 10.515 2.708 2.355
330 HB3 ARG 45 HB1 ARG 45 8.818 2.907 2.742
331 HG2 ARG 45 HG2 ARG 45 8.724 0.337 2.513
332 HG3 ARG 45 HG1 ARG 45 10.471 0.441 2.736
333 HD2 ARG 45 HD2 ARG 45 8.267 1.075 4.628
334 HD3 ARG 45 HD1 ARG 45 9.785 0.227 4.914
335 HE ARG 45 HE ARG 45 10.492 2.821 4.333
336 HH11 ARG 45 HH11 ARG 45 8.515 1.226 6.722
337 HH12 ARG 45 HH12 ARG 45 8.793 2.427 7.939
338 HH21 ARG 45 HH21 ARG 45 10.860 4.405 5.932
339 HH22 ARG 45 HH22 ARG 45 10.124 4.233 7.491
340 H ASN 46 HN ASN 46 11.451 3.275 0.301
341 HA ASN 46 HA ASN 46 10.723 5.969 0.045
342 HB2 ASN 46 HB2 ASN 46 13.135 4.477 -1.019
343 HB3 ASN 46 HB1 ASN 46 12.974 6.229 -1.041
344 HD21 ASN 46 HD21 ASN 46 13.567 3.434 0.873
345 HD22 ASN 46 HD22 ASN 46 14.012 4.260 2.322
346 H ALA 47 HN ALA 47 11.053 3.342 -2.221
347 HA ALA 47 HA ALA 47 10.712 4.815 -4.612
348 HB1 ALA 47 HB1 ALA 47 11.625 2.569 -4.640
349 HB2 ALA 47 HB2 ALA 47 10.163 2.629 -5.622
350 HB3 ALA 47 HB3 ALA 47 10.112 1.917 -4.008
351 H TYR 48 HN TYR 48 8.490 3.228 -2.400
352 HA TYR 48 HA TYR 48 6.123 3.557 -3.898
353 HB2 TYR 48 HB2 TYR 48 6.816 2.303 -1.547
354 HB3 TYR 48 HB1 TYR 48 5.811 3.632 -0.984
355 HD1 TYR 48 HD1 TYR 48 5.867 0.601 -3.083
356 HD2 TYR 48 HD2 TYR 48 3.453 3.661 -1.374
357 HE1 TYR 48 HE1 TYR 48 3.847 -0.675 -3.664
358 HE2 TYR 48 HE2 TYR 48 1.427 2.394 -1.950
359 HH TYR 48 HH TYR 48 1.502 -0.849 -2.915
360 H GLY 49 HN GLY 49 7.980 5.662 -1.904
361 HA2 GLY 49 HA2 GLY 49 6.086 7.552 -1.122
362 HA3 GLY 49 HA1 GLY 49 7.786 7.890 -1.393
363 H SER 50 HN SER 50 6.574 6.703 -4.243
364 HA SER 50 HA SER 50 5.253 9.043 -5.236
365 HB2 SER 50 HB2 SER 50 8.091 8.481 -6.139
366 HB3 SER 50 HB1 SER 50 6.990 9.615 -6.926
367 HG SER 50 HG SER 50 8.068 10.883 -5.557
368 H MET 51 HN MET 51 6.970 6.047 -5.923
369 HA MET 51 HA MET 51 5.755 5.625 -8.472
370 HB2 MET 51 HB2 MET 51 7.275 3.815 -6.600
371 HB3 MET 51 HB1 MET 51 6.635 3.261 -8.138
372 HG2 MET 51 HG2 MET 51 8.636 5.476 -7.749
373 HG3 MET 51 HG1 MET 51 8.987 3.842 -8.309
374 HE1 MET 51 HE1 MET 51 9.878 6.496 -9.801
375 HE2 MET 51 HE2 MET 51 9.495 6.141 -11.485
376 HE3 MET 51 HE3 MET 51 10.248 4.909 -10.474
377 H GLY 52 HN GLY 52 4.856 4.988 -5.194
378 HA2 GLY 52 HA2 GLY 52 2.736 3.139 -6.017
379 HA3 GLY 52 HA1 GLY 52 3.224 3.482 -4.364
380 H GLY 53 HN GLY 53 3.154 6.436 -5.561
381 HA2 GLY 53 HA2 GLY 53 0.484 6.947 -4.534
382 HA3 GLY 53 HA1 GLY 53 1.692 8.153 -4.949
383 H GLY 54 HN GLY 54 2.117 6.850 -7.602
384 HA2 GLY 54 HA2 GLY 54 0.104 6.508 -9.293
385 HA3 GLY 54 HA1 GLY 54 -0.073 8.222 -8.953
386 H SER 55 HN SER 55 2.712 6.087 -9.543
387 HA SER 55 HA SER 55 4.629 6.476 -10.737
388 HB2 SER 55 HB2 SER 55 4.169 6.638 -13.159
389 HB3 SER 55 HB1 SER 55 3.236 5.411 -12.318
390 HG SER 55 HG SER 55 2.175 7.022 -13.882
391 H LEU 56 HN LEU 56 4.091 8.631 -9.308
392 HA LEU 56 HA LEU 56 4.817 10.757 -8.982
393 HB2 LEU 56 HB2 LEU 56 5.930 10.396 -11.748
394 HB3 LEU 56 HB1 LEU 56 6.235 11.801 -10.748
395 HG LEU 56 HG LEU 56 7.108 10.051 -9.019
396 HD11 LEU 56 HD11 LEU 56 7.392 8.524 -11.604
397 HD12 LEU 56 HD12 LEU 56 6.355 8.077 -10.250
398 HD13 LEU 56 HD13 LEU 56 8.107 8.084 -10.053
399 HD21 LEU 56 HD21 LEU 56 8.468 11.760 -10.070
400 HD22 LEU 56 HD22 LEU 56 8.623 10.771 -11.521
401 HD23 LEU 56 HD23 LEU 56 9.344 10.231 -10.004
402 H ARG 57 HN ARG 57 2.837 10.034 -11.731
403 HA ARG 57 HA ARG 57 2.170 12.802 -12.235
404 HB2 ARG 57 HB2 ARG 57 0.579 11.909 -13.872
405 HB3 ARG 57 HB1 ARG 57 2.179 11.223 -14.105
406 HG2 ARG 57 HG2 ARG 57 1.396 9.220 -12.847
407 HG3 ARG 57 HG1 ARG 57 -0.217 9.933 -12.854
408 HD2 ARG 57 HD2 ARG 57 1.413 9.242 -15.292
409 HD3 ARG 57 HD1 ARG 57 0.058 8.305 -14.663
410 HE ARG 57 HE ARG 57 -0.552 11.060 -15.281
411 HH11 ARG 57 HH11 ARG 57 -0.443 7.780 -16.451
412 HH12 ARG 57 HH12 ARG 57 -1.593 8.056 -17.715
413 HH21 ARG 57 HH21 ARG 57 -2.069 11.432 -16.941
414 HH22 ARG 57 HH22 ARG 57 -2.520 10.131 -17.992
415 H GLY 58 HN GLY 58 1.718 11.575 -9.574
416 HA2 GLY 58 HA2 GLY 58 -1.052 12.472 -9.277
417 HA3 GLY 58 HA1 GLY 58 -0.665 10.853 -8.716
418 H SER 59 HN SER 59 1.782 13.260 -8.460
419 HA SER 59 HA SER 59 1.874 12.991 -5.619
420 HB2 SER 59 HB2 SER 59 3.925 13.306 -6.915
421 HB3 SER 59 HB1 SER 59 3.358 14.884 -7.459
422 HG SER 59 HG SER 59 3.357 14.552 -4.729
Start of MODEL 4
1 H1 MET 1 HT1 MET 1 -34.961 11.227 4.517
2 H2 MET 1 HT2 MET 1 -35.524 10.740 2.999
3 H3 MET 1 HT3 MET 1 -35.329 12.385 3.339
4 HA MET 1 HA MET 1 -32.958 12.120 3.526
5 HB2 MET 1 HB2 MET 1 -31.914 9.981 2.935
6 HB3 MET 1 HB1 MET 1 -32.952 9.814 4.343
7 HG2 MET 1 HG2 MET 1 -34.708 8.861 2.934
8 HG3 MET 1 HG1 MET 1 -33.656 9.017 1.529
9 HE1 MET 1 HE1 MET 1 -35.034 6.282 2.278
10 HE2 MET 1 HE2 MET 1 -33.695 5.152 2.082
11 HE3 MET 1 HE3 MET 1 -33.921 6.460 0.921
12 H SER 2 HN SER 2 -31.823 12.768 1.764
13 HA SER 2 HA SER 2 -32.692 11.996 -0.900
14 HB2 SER 2 HB2 SER 2 -32.670 14.890 -0.006
15 HB3 SER 2 HB1 SER 2 -32.920 14.332 -1.660
16 HG SER 2 HG SER 2 -34.785 13.205 -0.872
17 H GLY 3 HN GLY 3 -30.739 11.125 -1.398
18 HA2 GLY 3 HA2 GLY 3 -28.697 11.642 -2.587
19 HA3 GLY 3 HA1 GLY 3 -28.475 13.009 -1.507
20 H GLY 4 HN GLY 4 -28.007 12.523 0.775
21 HA2 GLY 4 HA2 GLY 4 -25.963 10.573 0.992
22 HA3 GLY 4 HA1 GLY 4 -26.605 11.541 2.307
23 H GLY 5 HN GLY 5 -29.245 10.189 1.023
24 HA2 GLY 5 HA2 GLY 5 -29.231 8.027 3.004
25 HA3 GLY 5 HA1 GLY 5 -30.659 8.731 2.261
26 H VAL 6 HN VAL 6 -27.951 7.954 0.321
27 HA VAL 6 HA VAL 6 -28.730 5.297 -0.441
28 HB VAL 6 HB VAL 6 -29.136 7.561 -2.413
29 HG11 VAL 6 HG11 VAL 6 -29.796 5.789 -4.000
30 HG12 VAL 6 HG12 VAL 6 -29.313 4.577 -2.814
31 HG13 VAL 6 HG13 VAL 6 -28.108 5.666 -3.503
32 HG21 VAL 6 HG21 VAL 6 -31.464 6.667 -2.567
33 HG22 VAL 6 HG22 VAL 6 -31.066 7.412 -1.019
34 HG23 VAL 6 HG23 VAL 6 -31.108 5.655 -1.168
35 H PHE 7 HN PHE 7 -27.157 8.248 -1.637
36 HA PHE 7 HA PHE 7 -25.063 6.999 -3.029
37 HB2 PHE 7 HB2 PHE 7 -25.759 9.388 -3.281
38 HB3 PHE 7 HB1 PHE 7 -25.033 9.727 -1.715
39 HD1 PHE 7 HD1 PHE 7 -22.579 9.400 -1.427
40 HD2 PHE 7 HD2 PHE 7 -24.461 9.329 -5.236
41 HE1 PHE 7 HE1 PHE 7 -20.400 9.809 -2.503
42 HE2 PHE 7 HE2 PHE 7 -22.292 9.734 -6.325
43 HZ PHE 7 HZ PHE 7 -20.256 9.975 -4.957
44 H THR 8 HN THR 8 -25.339 8.082 0.330
45 HA THR 8 HA THR 8 -22.632 7.598 1.013
46 HB THR 8 HB THR 8 -25.057 7.681 2.769
47 HG1 THR 8 HG1 THR 8 -24.262 9.612 1.466
48 HG21 THR 8 HG21 THR 8 -23.063 6.523 3.770
49 HG22 THR 8 HG22 THR 8 -23.633 7.937 4.654
50 HG23 THR 8 HG23 THR 8 -22.206 8.056 3.629
51 H ASP 9 HN ASP 9 -25.488 5.636 0.824
52 HA ASP 9 HA ASP 9 -24.507 3.378 2.254
53 HB2 ASP 9 HB2 ASP 9 -26.779 4.026 0.508
54 HB3 ASP 9 HB1 ASP 9 -26.237 2.360 0.387
55 H ILE 10 HN ILE 10 -24.555 4.472 -1.044
56 HA ILE 10 HA ILE 10 -23.218 2.315 -2.262
57 HB ILE 10 HB ILE 10 -23.460 5.238 -2.974
58 HG12 ILE 10 HG12 ILE 10 -24.862 2.790 -4.025
59 HG13 ILE 10 HG11 ILE 10 -25.549 3.952 -2.907
60 HG21 ILE 10 HG21 ILE 10 -22.412 2.982 -4.680
61 HG22 ILE 10 HG22 ILE 10 -21.467 4.322 -4.026
62 HG23 ILE 10 HG23 ILE 10 -22.722 4.631 -5.226
63 HD11 ILE 10 HD11 ILE 10 -26.351 4.301 -5.177
64 HD12 ILE 10 HD12 ILE 10 -24.692 4.543 -5.727
65 HD13 ILE 10 HD13 ILE 10 -25.422 5.682 -4.596
66 H LEU 11 HN LEU 11 -22.243 5.224 -0.633
67 HA LEU 11 HA LEU 11 -19.491 5.142 -1.314
68 HB2 LEU 11 HB2 LEU 11 -19.583 7.178 -0.411
69 HB3 LEU 11 HB1 LEU 11 -21.280 6.950 -0.242
70 HG LEU 11 HG LEU 11 -20.930 6.221 2.068
71 HD11 LEU 11 HD11 LEU 11 -18.552 7.011 2.934
72 HD12 LEU 11 HD12 LEU 11 -18.085 6.540 1.298
73 HD13 LEU 11 HD13 LEU 11 -18.843 5.366 2.371
74 HD21 LEU 11 HD21 LEU 11 -19.630 8.878 1.501
75 HD22 LEU 11 HD22 LEU 11 -20.489 8.403 2.966
76 HD23 LEU 11 HD23 LEU 11 -21.368 8.592 1.450
77 H ALA 12 HN ALA 12 -21.499 4.151 1.288
78 HA ALA 12 HA ALA 12 -19.532 3.275 3.100
79 HB1 ALA 12 HB1 ALA 12 -22.444 2.724 2.732
80 HB2 ALA 12 HB2 ALA 12 -21.603 3.457 4.100
81 HB3 ALA 12 HB3 ALA 12 -21.514 1.711 3.841
82 H ALA 13 HN ALA 13 -21.534 1.443 0.834
83 HA ALA 13 HA ALA 13 -20.238 -1.023 1.204
84 HB1 ALA 13 HB1 ALA 13 -21.468 -1.768 -0.702
85 HB2 ALA 13 HB2 ALA 13 -21.659 -0.122 -1.306
86 HB3 ALA 13 HB3 ALA 13 -22.505 -0.626 0.158
87 H ALA 14 HN ALA 14 -19.816 1.434 -1.394
88 HA ALA 14 HA ALA 14 -17.782 0.095 -2.754
89 HB1 ALA 14 HB1 ALA 14 -18.051 3.074 -2.411
90 HB2 ALA 14 HB2 ALA 14 -18.861 2.103 -3.646
91 HB3 ALA 14 HB3 ALA 14 -17.101 2.242 -3.641
92 H GLY 15 HN GLY 15 -17.655 2.267 0.013
93 HA2 GLY 15 HA2 GLY 15 -14.877 2.482 0.242
94 HA3 GLY 15 HA1 GLY 15 -16.029 2.647 1.560
95 H ARG 16 HN ARG 16 -17.128 0.253 1.830
96 HA ARG 16 HA ARG 16 -15.085 -1.250 3.080
97 HB2 ARG 16 HB2 ARG 16 -16.940 -2.800 3.617
98 HB3 ARG 16 HB1 ARG 16 -17.254 -1.156 4.100
99 HG2 ARG 16 HG2 ARG 16 -19.232 -1.604 3.183
100 HG3 ARG 16 HG1 ARG 16 -18.380 -1.165 1.702
101 HD2 ARG 16 HD2 ARG 16 -17.703 -3.691 1.733
102 HD3 ARG 16 HD1 ARG 16 -19.159 -3.841 2.725
103 HE ARG 16 HE ARG 16 -19.282 -2.532 0.119
104 HH11 ARG 16 HH11 ARG 16 -20.216 -5.122 2.244
105 HH12 ARG 16 HH12 ARG 16 -21.480 -5.694 1.208
106 HH21 ARG 16 HH21 ARG 16 -20.950 -3.278 -1.262
107 HH22 ARG 16 HH22 ARG 16 -21.897 -4.647 -0.784
108 H ILE 17 HN ILE 17 -16.677 -1.378 -0.006
109 HA ILE 17 HA ILE 17 -16.057 -4.084 -0.667
110 HB ILE 17 HB ILE 17 -16.715 -1.643 -2.343
111 HG12 ILE 17 HG12 ILE 17 -18.161 -4.074 -1.407
112 HG13 ILE 17 HG11 ILE 17 -18.716 -2.424 -1.542
113 HG21 ILE 17 HG21 ILE 17 -16.101 -4.406 -3.397
114 HG22 ILE 17 HG22 ILE 17 -15.063 -2.990 -3.560
115 HG23 ILE 17 HG23 ILE 17 -16.641 -3.018 -4.343
116 HD11 ILE 17 HD11 ILE 17 -19.920 -3.780 -3.094
117 HD12 ILE 17 HD12 ILE 17 -18.419 -4.398 -3.782
118 HD13 ILE 17 HD13 ILE 17 -18.850 -2.701 -3.990
119 H PHE 18 HN PHE 18 -14.824 -1.005 -1.649
120 HA PHE 18 HA PHE 18 -12.461 -1.728 -2.869
121 HB2 PHE 18 HB2 PHE 18 -13.409 0.469 -3.053
122 HB3 PHE 18 HB1 PHE 18 -13.318 0.719 -1.326
123 HD1 PHE 18 HD1 PHE 18 -11.239 1.117 -0.243
124 HD2 PHE 18 HD2 PHE 18 -11.490 0.876 -4.467
125 HE1 PHE 18 HE1 PHE 18 -9.053 2.262 -0.426
126 HE2 PHE 18 HE2 PHE 18 -9.310 2.002 -4.677
127 HZ PHE 18 HZ PHE 18 -8.088 2.700 -2.652
128 H GLU 19 HN GLU 19 -13.246 -1.128 0.507
129 HA GLU 19 HA GLU 19 -10.647 -1.144 1.562
130 HB2 GLU 19 HB2 GLU 19 -13.302 -1.059 2.580
131 HB3 GLU 19 HB1 GLU 19 -12.426 -2.305 3.454
132 HG2 GLU 19 HG2 GLU 19 -10.658 -0.659 3.958
133 HG3 GLU 19 HG1 GLU 19 -11.626 0.581 3.158
134 H VAL 20 HN VAL 20 -13.020 -3.776 1.277
135 HA VAL 20 HA VAL 20 -11.237 -5.747 2.305
136 HB VAL 20 HB VAL 20 -12.847 -7.404 1.570
137 HG11 VAL 20 HG11 VAL 20 -14.946 -6.451 2.595
138 HG12 VAL 20 HG12 VAL 20 -14.095 -4.912 2.714
139 HG13 VAL 20 HG13 VAL 20 -13.490 -6.323 3.582
140 HG21 VAL 20 HG21 VAL 20 -14.668 -6.986 0.135
141 HG22 VAL 20 HG22 VAL 20 -13.263 -6.270 -0.658
142 HG23 VAL 20 HG23 VAL 20 -14.415 -5.242 0.197
143 H MET 21 HN MET 21 -11.852 -4.323 -0.770
144 HA MET 21 HA MET 21 -10.521 -6.255 -2.395
145 HB2 MET 21 HB2 MET 21 -11.257 -3.349 -2.832
146 HB3 MET 21 HB1 MET 21 -10.505 -4.356 -4.067
147 HG2 MET 21 HG2 MET 21 -12.821 -5.663 -2.974
148 HG3 MET 21 HG1 MET 21 -13.232 -4.049 -3.553
149 HE1 MET 21 HE1 MET 21 -14.872 -5.035 -5.384
150 HE2 MET 21 HE2 MET 21 -14.527 -6.653 -4.773
151 HE3 MET 21 HE3 MET 21 -14.423 -6.323 -6.502
152 H VAL 22 HN VAL 22 -9.685 -3.555 -0.446
153 HA VAL 22 HA VAL 22 -7.076 -3.204 -1.573
154 HB VAL 22 HB VAL 22 -8.608 -1.859 0.596
155 HG11 VAL 22 HG11 VAL 22 -6.586 -0.493 1.112
156 HG12 VAL 22 HG12 VAL 22 -5.621 -1.665 0.212
157 HG13 VAL 22 HG13 VAL 22 -6.480 -2.163 1.671
158 HG21 VAL 22 HG21 VAL 22 -7.213 -1.063 -1.937
159 HG22 VAL 22 HG22 VAL 22 -7.775 0.125 -0.760
160 HG23 VAL 22 HG23 VAL 22 -8.929 -0.952 -1.546
161 H GLU 23 HN GLU 23 -8.435 -4.524 1.430
162 HA GLU 23 HA GLU 23 -6.022 -5.010 2.719
163 HB2 GLU 23 HB2 GLU 23 -7.209 -6.382 4.204
164 HB3 GLU 23 HB1 GLU 23 -8.353 -5.151 3.696
165 HG2 GLU 23 HG2 GLU 23 -9.423 -6.683 2.198
166 HG3 GLU 23 HG1 GLU 23 -8.196 -7.908 2.514
167 H GLY 24 HN GLY 24 -7.841 -6.950 0.428
168 HA2 GLY 24 HA2 GLY 24 -6.161 -9.227 0.517
169 HA3 GLY 24 HA1 GLY 24 -7.214 -8.779 -0.826
170 H HIS 25 HN HIS 25 -6.051 -6.184 -1.252
171 HA HIS 25 HA HIS 25 -3.968 -6.868 -3.034
172 HB2 HIS 25 HB2 HIS 25 -5.398 -4.802 -3.219
173 HB3 HIS 25 HB1 HIS 25 -4.524 -4.144 -1.836
174 HD1 HIS 25 HD1 HIS 25 -3.817 -5.318 -5.376
175 HD2 HIS 25 HD2 HIS 25 -2.242 -2.818 -2.453
176 HE1 HIS 25 HE1 HIS 25 -1.888 -4.131 -6.470
177 HE2 HIS 25 HE2 HIS 25 -0.898 -2.691 -4.658
178 H TRP 26 HN TRP 26 -4.071 -5.544 0.212
179 HA TRP 26 HA TRP 26 -1.271 -5.223 0.511
180 HB2 TRP 26 HB2 TRP 26 -3.723 -4.923 2.130
181 HB3 TRP 26 HB1 TRP 26 -2.254 -5.272 3.011
182 HD1 TRP 26 HD1 TRP 26 -4.118 -2.465 1.443
183 HE1 TRP 26 HE1 TRP 26 -2.727 -0.301 1.572
184 HE3 TRP 26 HE3 TRP 26 0.355 -4.480 2.824
185 HZ2 TRP 26 HZ2 TRP 26 -0.069 0.448 2.192
186 HZ3 TRP 26 HZ3 TRP 26 2.264 -2.986 3.178
187 HH2 TRP 26 HH2 TRP 26 2.066 -0.570 2.863
188 H GLU 27 HN GLU 27 -3.392 -7.882 0.672
189 HA GLU 27 HA GLU 27 -1.860 -9.387 2.543
190 HB2 GLU 27 HB2 GLU 27 -4.044 -10.042 0.589
191 HB3 GLU 27 HB1 GLU 27 -3.189 -11.326 1.422
192 HG2 GLU 27 HG2 GLU 27 -4.589 -9.074 2.830
193 HG3 GLU 27 HG1 GLU 27 -5.343 -10.623 2.465
194 H THR 28 HN THR 28 -2.021 -9.121 -0.927
195 HA THR 28 HA THR 28 -0.065 -11.177 -1.364
196 HB THR 28 HB THR 28 -1.956 -10.283 -2.989
197 HG1 THR 28 HG1 THR 28 -0.012 -10.894 -4.651
198 HG21 THR 28 HG21 THR 28 -1.121 -8.806 -4.695
199 HG22 THR 28 HG22 THR 28 0.467 -8.748 -3.927
200 HG23 THR 28 HG23 THR 28 -0.927 -8.012 -3.132
201 H VAL 29 HN VAL 29 0.013 -7.778 -0.703
202 HA VAL 29 HA VAL 29 2.410 -7.167 -1.983
203 HB VAL 29 HB VAL 29 2.702 -5.294 -0.450
204 HG11 VAL 29 HG11 VAL 29 0.933 -4.036 -1.258
205 HG12 VAL 29 HG12 VAL 29 -0.195 -5.389 -1.182
206 HG13 VAL 29 HG13 VAL 29 1.065 -5.357 -2.421
207 HG21 VAL 29 HG21 VAL 29 0.982 -6.900 1.191
208 HG22 VAL 29 HG22 VAL 29 0.396 -5.247 1.041
209 HG23 VAL 29 HG23 VAL 29 2.027 -5.553 1.626
210 H GLY 30 HN GLY 30 1.759 -8.584 1.140
211 HA2 GLY 30 HA2 GLY 30 4.251 -8.516 2.310
212 HA3 GLY 30 HA1 GLY 30 3.176 -9.907 2.435
213 H MET 31 HN MET 31 3.470 -9.810 -0.678
214 HA MET 31 HA MET 31 5.796 -11.577 -0.819
215 HB2 MET 31 HB2 MET 31 3.568 -11.111 -2.803
216 HB3 MET 31 HB1 MET 31 4.810 -12.338 -2.918
217 HG2 MET 31 HG2 MET 31 2.548 -12.165 -0.959
218 HG3 MET 31 HG1 MET 31 2.854 -13.401 -2.172
219 HE1 MET 31 HE1 MET 31 2.488 -15.332 -0.384
220 HE2 MET 31 HE2 MET 31 2.138 -14.100 0.829
221 HE3 MET 31 HE3 MET 31 3.306 -15.375 1.178
222 H LEU 32 HN LEU 32 4.197 -9.309 -3.061
223 HA LEU 32 HA LEU 32 6.457 -8.787 -4.608
224 HB2 LEU 32 HB2 LEU 32 5.224 -6.968 -5.580
225 HB3 LEU 32 HB1 LEU 32 4.156 -8.336 -5.337
226 HG LEU 32 HG LEU 32 3.675 -7.002 -3.064
227 HD11 LEU 32 HD11 LEU 32 3.500 -4.607 -3.572
228 HD12 LEU 32 HD12 LEU 32 4.344 -4.883 -5.097
229 HD13 LEU 32 HD13 LEU 32 5.172 -5.169 -3.565
230 HD21 LEU 32 HD21 LEU 32 1.998 -7.784 -4.632
231 HD22 LEU 32 HD22 LEU 32 2.401 -6.475 -5.744
232 HD23 LEU 32 HD23 LEU 32 1.676 -6.110 -4.177
233 H PHE 33 HN PHE 33 5.210 -7.206 -1.765
234 HA PHE 33 HA PHE 33 6.936 -4.959 -1.796
235 HB2 PHE 33 HB2 PHE 33 4.890 -4.949 -0.458
236 HB3 PHE 33 HB1 PHE 33 5.480 -6.297 0.506
237 HD1 PHE 33 HD1 PHE 33 7.693 -3.541 -0.484
238 HD2 PHE 33 HD2 PHE 33 5.205 -5.126 2.582
239 HE1 PHE 33 HE1 PHE 33 8.665 -1.949 1.121
240 HE2 PHE 33 HE2 PHE 33 6.179 -3.543 4.194
241 HZ PHE 33 HZ PHE 33 7.910 -1.952 3.464
242 H ASP 34 HN ASP 34 7.100 -8.176 -0.428
243 HA ASP 34 HA ASP 34 9.370 -7.871 1.171
244 HB2 ASP 34 HB2 ASP 34 7.608 -9.851 0.732
245 HB3 ASP 34 HB1 ASP 34 8.955 -10.458 -0.224
246 H SER 35 HN SER 35 9.027 -8.637 -2.252
247 HA SER 35 HA SER 35 11.621 -9.406 -2.854
248 HB2 SER 35 HB2 SER 35 9.798 -9.538 -4.483
249 HB3 SER 35 HB1 SER 35 9.714 -7.779 -4.554
250 HG SER 35 HG SER 35 11.976 -9.340 -5.266
251 H LEU 36 HN LEU 36 10.318 -6.269 -2.159
252 HA LEU 36 HA LEU 36 13.025 -5.163 -2.182
253 HB2 LEU 36 HB2 LEU 36 12.134 -3.063 -3.227
254 HB3 LEU 36 HB1 LEU 36 12.218 -4.445 -4.301
255 HG LEU 36 HG LEU 36 9.638 -3.864 -2.919
256 HD11 LEU 36 HD11 LEU 36 10.380 -1.698 -3.811
257 HD12 LEU 36 HD12 LEU 36 8.982 -2.333 -4.681
258 HD13 LEU 36 HD13 LEU 36 10.591 -2.437 -5.399
259 HD21 LEU 36 HD21 LEU 36 8.745 -4.765 -5.032
260 HD22 LEU 36 HD22 LEU 36 9.833 -5.892 -4.224
261 HD23 LEU 36 HD23 LEU 36 10.395 -4.973 -5.619
262 H GLY 37 HN GLY 37 11.410 -6.037 -0.053
263 HA2 GLY 37 HA2 GLY 37 10.998 -3.475 1.366
264 HA3 GLY 37 HA1 GLY 37 9.973 -4.883 1.639
265 H LYS 38 HN LYS 38 12.114 -6.721 1.363
266 HA LYS 38 HA LYS 38 13.073 -6.745 4.075
267 HB2 LYS 38 HB2 LYS 38 12.652 -8.663 2.009
268 HB3 LYS 38 HB1 LYS 38 14.356 -8.713 2.443
269 HG2 LYS 38 HG2 LYS 38 13.134 -10.316 3.759
270 HG3 LYS 38 HG1 LYS 38 13.712 -9.016 4.805
271 HD2 LYS 38 HD2 LYS 38 11.452 -7.949 4.570
272 HD3 LYS 38 HD1 LYS 38 10.919 -9.413 3.740
273 HE2 LYS 38 HE2 LYS 38 10.301 -9.497 6.087
274 HE3 LYS 38 HE1 LYS 38 11.500 -10.737 5.721
275 HZ1 LYS 38 HZ1 LYS 38 12.072 -8.112 6.988
276 HZ2 LYS 38 HZ2 LYS 38 13.211 -9.317 6.653
277 HZ3 LYS 38 HZ3 LYS 38 11.995 -9.598 7.795
278 H GLY 39 HN GLY 39 14.458 -6.723 0.838
279 HA2 GLY 39 HA2 GLY 39 17.097 -6.138 1.701
280 HA3 GLY 39 HA1 GLY 39 16.497 -6.033 0.059
281 H THR 40 HN THR 40 14.324 -4.244 0.752
282 HA THR 40 HA THR 40 15.700 -1.831 0.389
283 HB THR 40 HB THR 40 13.231 -2.498 -0.250
284 HG1 THR 40 HG1 THR 40 13.568 -0.613 -1.131
285 HG21 THR 40 HG21 THR 40 12.507 -2.555 2.140
286 HG22 THR 40 HG22 THR 40 11.580 -1.436 1.144
287 HG23 THR 40 HG23 THR 40 12.830 -0.826 2.226
288 H MET 41 HN MET 41 14.680 -3.489 3.199
289 HA MET 41 HA MET 41 14.175 -1.703 5.107
290 HB2 MET 41 HB2 MET 41 15.109 -3.167 6.716
291 HB3 MET 41 HB1 MET 41 14.469 -4.157 5.420
292 HG2 MET 41 HG2 MET 41 16.781 -4.242 4.491
293 HG3 MET 41 HG1 MET 41 17.336 -3.490 5.979
294 HE1 MET 41 HE1 MET 41 18.489 -7.243 6.334
295 HE2 MET 41 HE2 MET 41 19.017 -5.561 6.295
296 HE3 MET 41 HE3 MET 41 18.391 -6.323 4.833
297 H ARG 42 HN ARG 42 17.459 -2.407 3.968
298 HA ARG 42 HA ARG 42 18.841 -0.664 5.651
299 HB2 ARG 42 HB2 ARG 42 20.039 -2.267 4.299
300 HB3 ARG 42 HB1 ARG 42 19.446 -1.530 2.818
301 HG2 ARG 42 HG2 ARG 42 20.725 0.491 3.300
302 HG3 ARG 42 HG1 ARG 42 21.315 -0.238 4.795
303 HD2 ARG 42 HD2 ARG 42 22.963 -0.411 2.992
304 HD3 ARG 42 HD1 ARG 42 22.413 -1.999 3.525
305 HE ARG 42 HE ARG 42 20.846 -1.148 1.348
306 HH11 ARG 42 HH11 ARG 42 24.073 -2.238 2.083
307 HH12 ARG 42 HH12 ARG 42 24.343 -2.909 0.510
308 HH21 ARG 42 HH21 ARG 42 21.192 -2.030 -0.726
309 HH22 ARG 42 HH22 ARG 42 22.706 -2.790 -1.087
310 H ILE 43 HN ILE 43 17.508 -0.097 2.412
311 HA ILE 43 HA ILE 43 18.260 2.535 2.037
312 HB ILE 43 HB ILE 43 15.607 1.347 1.226
313 HG12 ILE 43 HG12 ILE 43 18.239 1.239 -0.261
314 HG13 ILE 43 HG11 ILE 43 17.531 -0.107 0.625
315 HG21 ILE 43 HG21 ILE 43 15.776 3.757 0.905
316 HG22 ILE 43 HG22 ILE 43 15.748 2.915 -0.645
317 HG23 ILE 43 HG23 ILE 43 17.270 3.539 -0.007
318 HD11 ILE 43 HD11 ILE 43 17.193 -0.145 -1.853
319 HD12 ILE 43 HD12 ILE 43 16.148 1.263 -1.663
320 HD13 ILE 43 HD13 ILE 43 15.720 -0.265 -0.891
321 H ASN 44 HN ASN 44 15.477 1.205 3.748
322 HA ASN 44 HA ASN 44 14.185 3.618 4.341
323 HB2 ASN 44 HB2 ASN 44 14.085 0.834 5.322
324 HB3 ASN 44 HB1 ASN 44 13.527 2.057 6.465
325 HD21 ASN 44 HD21 ASN 44 13.012 0.600 3.347
326 HD22 ASN 44 HD22 ASN 44 11.396 1.167 3.125
327 H ARG 45 HN ARG 45 16.713 1.837 6.060
328 HA ARG 45 HA ARG 45 16.786 3.447 8.371
329 HB2 ARG 45 HB2 ARG 45 19.184 2.084 7.170
330 HB3 ARG 45 HB1 ARG 45 18.872 2.424 8.863
331 HG2 ARG 45 HG2 ARG 45 16.983 0.817 8.773
332 HG3 ARG 45 HG1 ARG 45 17.486 0.403 7.134
333 HD2 ARG 45 HD2 ARG 45 19.010 0.011 9.695
334 HD3 ARG 45 HD1 ARG 45 18.441 -1.223 8.570
335 HE ARG 45 HE ARG 45 20.245 0.596 7.321
336 HH11 ARG 45 HH11 ARG 45 20.083 -2.177 9.428
337 HH12 ARG 45 HH12 ARG 45 21.668 -2.743 9.016
338 HH21 ARG 45 HH21 ARG 45 22.333 -0.143 6.776
339 HH22 ARG 45 HH22 ARG 45 22.947 -1.587 7.510
340 H ASN 46 HN ASN 46 18.802 3.541 5.433
341 HA ASN 46 HA ASN 46 20.303 5.782 6.194
342 HB2 ASN 46 HB2 ASN 46 19.597 4.727 3.443
343 HB3 ASN 46 HB1 ASN 46 20.768 6.010 3.731
344 HD21 ASN 46 HD21 ASN 46 20.128 2.637 3.883
345 HD22 ASN 46 HD22 ASN 46 21.726 2.136 4.299
346 H ALA 47 HN ALA 47 17.246 5.375 4.574
347 HA ALA 47 HA ALA 47 16.818 8.070 3.829
348 HB1 ALA 47 HB1 ALA 47 14.838 5.863 4.408
349 HB2 ALA 47 HB2 ALA 47 15.519 6.285 2.835
350 HB3 ALA 47 HB3 ALA 47 14.436 7.409 3.658
351 H TYR 48 HN TYR 48 15.935 6.187 6.676
352 HA TYR 48 HA TYR 48 14.457 8.170 8.016
353 HB2 TYR 48 HB2 TYR 48 15.199 5.500 8.467
354 HB3 TYR 48 HB1 TYR 48 15.838 6.402 9.837
355 HD1 TYR 48 HD1 TYR 48 12.711 5.819 7.903
356 HD2 TYR 48 HD2 TYR 48 14.437 7.027 11.600
357 HE1 TYR 48 HE1 TYR 48 10.478 5.845 8.931
358 HE2 TYR 48 HE2 TYR 48 12.209 7.056 12.637
359 HH TYR 48 HH TYR 48 9.457 5.706 11.124
360 H GLY 49 HN GLY 49 17.816 7.709 7.543
361 HA2 GLY 49 HA2 GLY 49 18.974 8.886 9.765
362 HA3 GLY 49 HA1 GLY 49 19.637 8.976 8.143
363 H SER 50 HN SER 50 16.747 10.368 7.766
364 HA SER 50 HA SER 50 17.113 12.902 9.028
365 HB2 SER 50 HB2 SER 50 18.844 13.112 7.299
366 HB3 SER 50 HB1 SER 50 17.655 12.724 6.051
367 HG SER 50 HG SER 50 17.492 14.949 7.809
368 H MET 51 HN MET 51 15.581 10.946 6.559
369 HA MET 51 HA MET 51 13.324 12.653 6.181
370 HB2 MET 51 HB2 MET 51 13.678 9.715 5.556
371 HB3 MET 51 HB1 MET 51 12.352 10.720 4.989
372 HG2 MET 51 HG2 MET 51 15.262 11.075 4.313
373 HG3 MET 51 HG1 MET 51 14.017 10.414 3.256
374 HE1 MET 51 HE1 MET 51 11.539 12.291 3.880
375 HE2 MET 51 HE2 MET 51 12.021 11.835 2.245
376 HE3 MET 51 HE3 MET 51 11.731 13.530 2.639
377 H GLY 52 HN GLY 52 14.182 10.205 8.468
378 HA2 GLY 52 HA2 GLY 52 11.410 10.050 9.437
379 HA3 GLY 52 HA1 GLY 52 12.699 8.932 9.851
380 H GLY 53 HN GLY 53 12.412 12.482 9.986
381 HA2 GLY 53 HA2 GLY 53 12.125 12.722 12.744
382 HA3 GLY 53 HA1 GLY 53 13.851 12.682 12.417
383 H GLY 54 HN GLY 54 12.674 13.967 9.711
384 HA2 GLY 54 HA2 GLY 54 12.515 16.712 10.773
385 HA3 GLY 54 HA1 GLY 54 13.631 16.329 9.471
386 H SER 55 HN SER 55 11.564 14.369 8.428
387 HA SER 55 HA SER 55 10.327 16.160 6.588
388 HB2 SER 55 HB2 SER 55 10.953 13.468 6.598
389 HB3 SER 55 HB1 SER 55 9.193 13.467 6.681
390 HG SER 55 HG SER 55 9.334 13.777 4.606
391 H LEU 56 HN LEU 56 8.777 13.715 8.667
392 HA LEU 56 HA LEU 56 6.246 15.011 8.551
393 HB2 LEU 56 HB2 LEU 56 7.359 12.739 10.157
394 HB3 LEU 56 HB1 LEU 56 5.769 13.385 10.510
395 HG LEU 56 HG LEU 56 5.199 12.943 8.070
396 HD11 LEU 56 HD11 LEU 56 7.700 11.273 8.261
397 HD12 LEU 56 HD12 LEU 56 7.478 12.693 7.241
398 HD13 LEU 56 HD13 LEU 56 6.529 11.237 6.943
399 HD21 LEU 56 HD21 LEU 56 4.679 10.619 8.509
400 HD22 LEU 56 HD22 LEU 56 4.397 11.597 9.951
401 HD23 LEU 56 HD23 LEU 56 5.842 10.591 9.837
402 H ARG 57 HN ARG 57 8.957 15.134 10.734
403 HA ARG 57 HA ARG 57 7.482 16.533 12.789
404 HB2 ARG 57 HB2 ARG 57 10.460 16.075 12.485
405 HB3 ARG 57 HB1 ARG 57 9.668 16.748 13.900
406 HG2 ARG 57 HG2 ARG 57 8.496 14.705 14.287
407 HG3 ARG 57 HG1 ARG 57 9.178 13.994 12.824
408 HD2 ARG 57 HD2 ARG 57 10.421 13.185 14.709
409 HD3 ARG 57 HD1 ARG 57 11.441 14.311 13.816
410 HE ARG 57 HE ARG 57 10.041 15.645 15.889
411 HH11 ARG 57 HH11 ARG 57 12.732 13.509 15.310
412 HH12 ARG 57 HH12 ARG 57 13.594 14.003 16.729
413 HH21 ARG 57 HH21 ARG 57 11.166 16.298 17.759
414 HH22 ARG 57 HH22 ARG 57 12.703 15.587 18.122
415 H GLY 58 HN GLY 58 7.681 17.590 10.013
416 HA2 GLY 58 HA2 GLY 58 8.059 20.340 10.714
417 HA3 GLY 58 HA1 GLY 58 9.364 19.744 9.699
418 H SER 59 HN SER 59 6.401 18.192 9.131
419 HA SER 59 HA SER 59 6.133 19.624 6.598
420 HB2 SER 59 HB2 SER 59 4.612 17.743 5.982
421 HB3 SER 59 HB1 SER 59 6.233 17.208 6.423
422 HG SER 59 HG SER 59 4.053 16.293 7.409
Start of MODEL 5
1 H1 MET 1 HT1 MET 1 -33.772 9.840 2.455
2 H2 MET 1 HT2 MET 1 -35.063 9.180 3.325
3 H3 MET 1 HT3 MET 1 -34.229 10.520 3.934
4 HA MET 1 HA MET 1 -35.805 10.500 1.430
5 HB2 MET 1 HB2 MET 1 -37.466 11.818 2.643
6 HB3 MET 1 HB1 MET 1 -37.246 10.248 3.399
7 HG2 MET 1 HG2 MET 1 -35.896 12.751 4.371
8 HG3 MET 1 HG1 MET 1 -37.461 12.196 4.961
9 HE1 MET 1 HE1 MET 1 -36.630 12.141 7.454
10 HE2 MET 1 HE2 MET 1 -35.061 12.759 6.936
11 HE3 MET 1 HE3 MET 1 -35.149 11.341 7.982
12 H SER 2 HN SER 2 -33.047 11.469 2.185
13 HA SER 2 HA SER 2 -33.461 14.269 1.378
14 HB2 SER 2 HB2 SER 2 -32.795 14.234 3.735
15 HB3 SER 2 HB1 SER 2 -31.386 13.252 3.334
16 HG SER 2 HG SER 2 -31.490 15.844 3.390
17 H GLY 3 HN GLY 3 -32.364 11.366 0.424
18 HA2 GLY 3 HA2 GLY 3 -31.311 11.064 -1.688
19 HA3 GLY 3 HA1 GLY 3 -30.479 12.594 -1.460
20 H GLY 4 HN GLY 4 -29.160 12.448 0.812
21 HA2 GLY 4 HA2 GLY 4 -27.040 10.672 0.261
22 HA3 GLY 4 HA1 GLY 4 -27.209 11.640 1.720
23 H GLY 5 HN GLY 5 -29.986 10.020 1.575
24 HA2 GLY 5 HA2 GLY 5 -29.127 8.063 3.525
25 HA3 GLY 5 HA1 GLY 5 -30.783 8.372 3.014
26 H VAL 6 HN VAL 6 -28.244 7.879 0.743
27 HA VAL 6 HA VAL 6 -28.657 5.074 0.317
28 HB VAL 6 HB VAL 6 -29.699 7.051 -1.728
29 HG11 VAL 6 HG11 VAL 6 -29.242 4.080 -1.952
30 HG12 VAL 6 HG12 VAL 6 -28.469 5.356 -2.893
31 HG13 VAL 6 HG13 VAL 6 -30.189 5.028 -3.099
32 HG21 VAL 6 HG21 VAL 6 -31.798 5.720 -1.538
33 HG22 VAL 6 HG22 VAL 6 -31.373 6.611 -0.077
34 HG23 VAL 6 HG23 VAL 6 -31.080 4.874 -0.168
35 H PHE 7 HN PHE 7 -27.542 8.173 -1.074
36 HA PHE 7 HA PHE 7 -25.575 7.014 -2.724
37 HB2 PHE 7 HB2 PHE 7 -24.985 9.144 -3.336
38 HB3 PHE 7 HB1 PHE 7 -26.584 9.446 -2.694
39 HD1 PHE 7 HD1 PHE 7 -23.281 9.179 -0.905
40 HD2 PHE 7 HD2 PHE 7 -26.610 11.588 -1.992
41 HE1 PHE 7 HE1 PHE 7 -22.389 11.012 0.459
42 HE2 PHE 7 HE2 PHE 7 -25.730 13.423 -0.615
43 HZ PHE 7 HZ PHE 7 -23.616 13.139 0.611
44 H THR 8 HN THR 8 -25.570 7.995 0.622
45 HA THR 8 HA THR 8 -22.770 7.741 1.021
46 HB THR 8 HB THR 8 -24.844 7.334 3.137
47 HG1 THR 8 HG1 THR 8 -23.775 9.873 2.528
48 HG21 THR 8 HG21 THR 8 -22.542 6.891 3.791
49 HG22 THR 8 HG22 THR 8 -23.140 8.346 4.588
50 HG23 THR 8 HG23 THR 8 -22.060 8.482 3.201
51 H ASP 9 HN ASP 9 -25.494 5.510 1.219
52 HA ASP 9 HA ASP 9 -24.113 3.366 2.472
53 HB2 ASP 9 HB2 ASP 9 -26.717 3.800 1.747
54 HB3 ASP 9 HB1 ASP 9 -26.193 2.642 0.530
55 H ILE 10 HN ILE 10 -24.573 4.502 -0.755
56 HA ILE 10 HA ILE 10 -23.382 2.396 -2.191
57 HB ILE 10 HB ILE 10 -23.714 5.351 -2.695
58 HG12 ILE 10 HG12 ILE 10 -25.084 2.943 -3.899
59 HG13 ILE 10 HG11 ILE 10 -25.741 3.942 -2.613
60 HG21 ILE 10 HG21 ILE 10 -21.758 4.621 -3.949
61 HG22 ILE 10 HG22 ILE 10 -23.106 4.927 -5.043
62 HG23 ILE 10 HG23 ILE 10 -22.671 3.270 -4.624
63 HD11 ILE 10 HD11 ILE 10 -25.117 4.858 -5.408
64 HD12 ILE 10 HD12 ILE 10 -25.770 5.859 -4.111
65 HD13 ILE 10 HD13 ILE 10 -26.719 4.518 -4.752
66 H LEU 11 HN LEU 11 -22.229 5.360 -0.755
67 HA LEU 11 HA LEU 11 -19.505 5.149 -1.455
68 HB2 LEU 11 HB2 LEU 11 -21.045 6.660 0.637
69 HB3 LEU 11 HB1 LEU 11 -19.300 6.734 0.591
70 HG LEU 11 HG LEU 11 -21.162 7.593 -1.625
71 HD11 LEU 11 HD11 LEU 11 -21.225 9.089 0.294
72 HD12 LEU 11 HD12 LEU 11 -20.418 9.852 -1.076
73 HD13 LEU 11 HD13 LEU 11 -19.466 9.216 0.265
74 HD21 LEU 11 HD21 LEU 11 -18.157 7.774 -1.408
75 HD22 LEU 11 HD22 LEU 11 -19.139 8.500 -2.681
76 HD23 LEU 11 HD23 LEU 11 -19.065 6.745 -2.517
77 H ALA 12 HN ALA 12 -21.445 4.064 1.206
78 HA ALA 12 HA ALA 12 -19.339 3.188 2.894
79 HB1 ALA 12 HB1 ALA 12 -21.147 1.935 4.062
80 HB2 ALA 12 HB2 ALA 12 -22.260 2.421 2.779
81 HB3 ALA 12 HB3 ALA 12 -21.524 3.641 3.820
82 H ALA 13 HN ALA 13 -21.395 1.671 0.499
83 HA ALA 13 HA ALA 13 -20.445 -0.961 0.796
84 HB1 ALA 13 HB1 ALA 13 -22.561 -0.281 -0.357
85 HB2 ALA 13 HB2 ALA 13 -21.571 -1.424 -1.267
86 HB3 ALA 13 HB3 ALA 13 -21.577 0.284 -1.709
87 H ALA 14 HN ALA 14 -19.710 1.466 -1.730
88 HA ALA 14 HA ALA 14 -17.650 0.066 -2.976
89 HB1 ALA 14 HB1 ALA 14 -16.900 2.182 -3.871
90 HB2 ALA 14 HB2 ALA 14 -17.847 3.055 -2.666
91 HB3 ALA 14 HB3 ALA 14 -18.664 2.104 -3.909
92 H GLY 15 HN GLY 15 -17.548 2.321 -0.268
93 HA2 GLY 15 HA2 GLY 15 -14.821 2.553 0.090
94 HA3 GLY 15 HA1 GLY 15 -16.017 2.606 1.391
95 H ARG 16 HN ARG 16 -17.027 0.278 1.626
96 HA ARG 16 HA ARG 16 -15.015 -1.301 2.807
97 HB2 ARG 16 HB2 ARG 16 -17.834 -1.108 2.795
98 HB3 ARG 16 HB1 ARG 16 -17.419 -2.772 2.446
99 HG2 ARG 16 HG2 ARG 16 -15.983 -2.801 4.420
100 HG3 ARG 16 HG1 ARG 16 -16.585 -1.178 4.813
101 HD2 ARG 16 HD2 ARG 16 -17.951 -2.696 5.935
102 HD3 ARG 16 HD1 ARG 16 -18.871 -2.083 4.580
103 HE ARG 16 HE ARG 16 -17.949 -4.301 3.529
104 HH11 ARG 16 HH11 ARG 16 -19.201 -3.796 6.741
105 HH12 ARG 16 HH12 ARG 16 -19.788 -5.417 6.907
106 HH21 ARG 16 HH21 ARG 16 -18.720 -6.437 3.739
107 HH22 ARG 16 HH22 ARG 16 -19.514 -6.917 5.200
108 H ILE 17 HN ILE 17 -16.644 -1.400 -0.299
109 HA ILE 17 HA ILE 17 -15.991 -4.078 -0.974
110 HB ILE 17 HB ILE 17 -16.525 -1.614 -2.650
111 HG12 ILE 17 HG12 ILE 17 -18.057 -4.014 -1.782
112 HG13 ILE 17 HG11 ILE 17 -18.557 -2.342 -1.879
113 HG21 ILE 17 HG21 ILE 17 -15.931 -4.387 -3.678
114 HG22 ILE 17 HG22 ILE 17 -14.883 -2.976 -3.832
115 HG23 ILE 17 HG23 ILE 17 -16.444 -3.008 -4.649
116 HD11 ILE 17 HD11 ILE 17 -18.295 -4.269 -4.165
117 HD12 ILE 17 HD12 ILE 17 -18.653 -2.552 -4.340
118 HD13 ILE 17 HD13 ILE 17 -19.783 -3.605 -3.489
119 H PHE 18 HN PHE 18 -14.703 -1.028 -1.916
120 HA PHE 18 HA PHE 18 -12.293 -1.753 -3.029
121 HB2 PHE 18 HB2 PHE 18 -13.289 0.444 -3.216
122 HB3 PHE 18 HB1 PHE 18 -13.146 0.707 -1.498
123 HD1 PHE 18 HD1 PHE 18 -11.094 1.201 -0.490
124 HD2 PHE 18 HD2 PHE 18 -11.346 0.686 -4.687
125 HE1 PHE 18 HE1 PHE 18 -8.888 2.293 -0.742
126 HE2 PHE 18 HE2 PHE 18 -9.147 1.762 -4.968
127 HZ PHE 18 HZ PHE 18 -7.914 2.570 -2.991
128 H GLU 19 HN GLU 19 -13.169 -1.076 0.321
129 HA GLU 19 HA GLU 19 -10.562 -1.079 1.381
130 HB2 GLU 19 HB2 GLU 19 -13.182 -0.779 2.407
131 HB3 GLU 19 HB1 GLU 19 -12.421 -2.068 3.326
132 HG2 GLU 19 HG2 GLU 19 -11.301 0.697 2.929
133 HG3 GLU 19 HG1 GLU 19 -12.115 0.111 4.378
134 H VAL 20 HN VAL 20 -13.024 -3.633 1.367
135 HA VAL 20 HA VAL 20 -11.321 -5.583 2.520
136 HB VAL 20 HB VAL 20 -12.958 -7.238 1.870
137 HG11 VAL 20 HG11 VAL 20 -14.324 -4.666 2.689
138 HG12 VAL 20 HG12 VAL 20 -13.562 -5.836 3.765
139 HG13 VAL 20 HG13 VAL 20 -15.003 -6.284 2.854
140 HG21 VAL 20 HG21 VAL 20 -14.273 -5.115 0.184
141 HG22 VAL 20 HG22 VAL 20 -14.811 -6.781 0.392
142 HG23 VAL 20 HG23 VAL 20 -13.293 -6.440 -0.441
143 H MET 21 HN MET 21 -11.797 -4.293 -0.610
144 HA MET 21 HA MET 21 -10.504 -6.333 -2.129
145 HB2 MET 21 HB2 MET 21 -11.260 -3.454 -2.638
146 HB3 MET 21 HB1 MET 21 -10.351 -4.394 -3.823
147 HG2 MET 21 HG2 MET 21 -12.777 -5.703 -2.823
148 HG3 MET 21 HG1 MET 21 -13.063 -4.215 -3.726
149 HE1 MET 21 HE1 MET 21 -10.901 -7.938 -5.408
150 HE2 MET 21 HE2 MET 21 -11.668 -7.877 -3.821
151 HE3 MET 21 HE3 MET 21 -10.213 -6.931 -4.134
152 H VAL 22 HN VAL 22 -9.627 -3.499 -0.349
153 HA VAL 22 HA VAL 22 -6.984 -3.304 -1.391
154 HB VAL 22 HB VAL 22 -8.453 -1.893 0.794
155 HG11 VAL 22 HG11 VAL 22 -6.392 -0.557 1.205
156 HG12 VAL 22 HG12 VAL 22 -5.486 -1.741 0.262
157 HG13 VAL 22 HG13 VAL 22 -6.274 -2.226 1.763
158 HG21 VAL 22 HG21 VAL 22 -7.214 -1.187 -1.840
159 HG22 VAL 22 HG22 VAL 22 -7.600 0.056 -0.650
160 HG23 VAL 22 HG23 VAL 22 -8.880 -0.964 -1.306
161 H GLU 23 HN GLU 23 -8.441 -4.489 1.615
162 HA GLU 23 HA GLU 23 -6.099 -5.114 2.983
163 HB2 GLU 23 HB2 GLU 23 -8.715 -6.618 3.084
164 HB3 GLU 23 HB1 GLU 23 -7.480 -6.569 4.332
165 HG2 GLU 23 HG2 GLU 23 -8.900 -4.119 3.382
166 HG3 GLU 23 HG1 GLU 23 -9.524 -5.127 4.688
167 H GLY 24 HN GLY 24 -8.039 -6.960 0.709
168 HA2 GLY 24 HA2 GLY 24 -6.498 -9.331 0.819
169 HA3 GLY 24 HA1 GLY 24 -7.582 -8.869 -0.487
170 H HIS 25 HN HIS 25 -6.173 -6.302 -0.913
171 HA HIS 25 HA HIS 25 -4.362 -7.157 -2.897
172 HB2 HIS 25 HB2 HIS 25 -5.456 -4.881 -2.803
173 HB3 HIS 25 HB1 HIS 25 -4.322 -4.472 -1.515
174 HD1 HIS 25 HD1 HIS 25 -3.793 -6.081 -4.930
175 HD2 HIS 25 HD2 HIS 25 -2.396 -2.943 -2.592
176 HE1 HIS 25 HE1 HIS 25 -1.930 -5.032 -6.254
177 HE2 HIS 25 HE2 HIS 25 -1.161 -3.080 -4.860
178 H TRP 26 HN TRP 26 -3.862 -5.858 0.355
179 HA TRP 26 HA TRP 26 -1.034 -6.230 0.217
180 HB2 TRP 26 HB2 TRP 26 -2.728 -5.609 2.596
181 HB3 TRP 26 HB1 TRP 26 -0.994 -5.530 2.537
182 HD1 TRP 26 HD1 TRP 26 -4.072 -3.525 1.730
183 HE1 TRP 26 HE1 TRP 26 -3.361 -1.213 0.836
184 HE3 TRP 26 HE3 TRP 26 0.858 -4.448 1.113
185 HZ2 TRP 26 HZ2 TRP 26 -0.965 0.047 -0.025
186 HZ3 TRP 26 HZ3 TRP 26 2.319 -2.666 0.258
187 HH2 TRP 26 HH2 TRP 26 1.427 -0.459 -0.306
188 H GLU 27 HN GLU 27 -3.560 -8.342 0.725
189 HA GLU 27 HA GLU 27 -2.292 -9.994 2.648
190 HB2 GLU 27 HB2 GLU 27 -4.500 -10.426 0.662
191 HB3 GLU 27 HB1 GLU 27 -3.836 -11.786 1.549
192 HG2 GLU 27 HG2 GLU 27 -4.922 -9.331 2.889
193 HG3 GLU 27 HG1 GLU 27 -5.904 -10.744 2.515
194 H THR 28 HN THR 28 -2.277 -9.795 -0.832
195 HA THR 28 HA THR 28 -0.583 -12.106 -1.130
196 HB THR 28 HB THR 28 -2.292 -11.098 -2.862
197 HG1 THR 28 HG1 THR 28 0.262 -12.156 -3.556
198 HG21 THR 28 HG21 THR 28 -1.093 -8.908 -2.982
199 HG22 THR 28 HG22 THR 28 -1.284 -9.704 -4.544
200 HG23 THR 28 HG23 THR 28 0.272 -9.754 -3.713
201 H VAL 29 HN VAL 29 -0.166 -8.722 -0.556
202 HA VAL 29 HA VAL 29 2.322 -8.392 -1.756
203 HB VAL 29 HB VAL 29 2.710 -6.482 -0.371
204 HG11 VAL 29 HG11 VAL 29 0.666 -5.209 -0.890
205 HG12 VAL 29 HG12 VAL 29 -0.124 -6.730 -1.298
206 HG13 VAL 29 HG13 VAL 29 1.267 -6.183 -2.232
207 HG21 VAL 29 HG21 VAL 29 1.103 -7.880 1.497
208 HG22 VAL 29 HG22 VAL 29 0.449 -6.267 1.230
209 HG23 VAL 29 HG23 VAL 29 2.121 -6.464 1.735
210 H GLY 30 HN GLY 30 1.450 -9.740 1.327
211 HA2 GLY 30 HA2 GLY 30 3.925 -9.851 2.559
212 HA3 GLY 30 HA1 GLY 30 2.706 -11.117 2.715
213 H MET 31 HN MET 31 3.154 -10.997 -0.437
214 HA MET 31 HA MET 31 5.266 -13.029 -0.503
215 HB2 MET 31 HB2 MET 31 3.099 -12.397 -2.509
216 HB3 MET 31 HB1 MET 31 4.235 -13.724 -2.609
217 HG2 MET 31 HG2 MET 31 2.635 -13.610 -0.150
218 HG3 MET 31 HG1 MET 31 1.742 -13.916 -1.630
219 HE1 MET 31 HE1 MET 31 5.157 -16.595 -0.052
220 HE2 MET 31 HE2 MET 31 4.521 -15.196 0.813
221 HE3 MET 31 HE3 MET 31 5.432 -14.970 -0.680
222 H LEU 32 HN LEU 32 3.890 -10.655 -2.787
223 HA LEU 32 HA LEU 32 6.219 -10.324 -4.294
224 HB2 LEU 32 HB2 LEU 32 5.150 -8.461 -5.331
225 HB3 LEU 32 HB1 LEU 32 3.941 -9.694 -5.038
226 HG LEU 32 HG LEU 32 3.615 -8.230 -2.817
227 HD11 LEU 32 HD11 LEU 32 5.339 -6.610 -3.471
228 HD12 LEU 32 HD12 LEU 32 3.745 -5.868 -3.340
229 HD13 LEU 32 HD13 LEU 32 4.419 -6.238 -4.928
230 HD21 LEU 32 HD21 LEU 32 1.703 -7.213 -3.927
231 HD22 LEU 32 HD22 LEU 32 1.880 -8.900 -4.408
232 HD23 LEU 32 HD23 LEU 32 2.391 -7.613 -5.500
233 H PHE 33 HN PHE 33 4.979 -8.590 -1.536
234 HA PHE 33 HA PHE 33 6.943 -6.546 -1.494
235 HB2 PHE 33 HB2 PHE 33 4.755 -6.375 -0.308
236 HB3 PHE 33 HB1 PHE 33 5.292 -7.617 0.819
237 HD1 PHE 33 HD1 PHE 33 7.788 -5.238 -0.298
238 HD2 PHE 33 HD2 PHE 33 4.785 -5.999 2.618
239 HE1 PHE 33 HE1 PHE 33 8.754 -3.494 1.144
240 HE2 PHE 33 HE2 PHE 33 5.748 -4.259 4.068
241 HZ PHE 33 HZ PHE 33 7.734 -3.004 3.331
242 H ASP 34 HN ASP 34 6.608 -9.698 0.040
243 HA ASP 34 HA ASP 34 8.848 -9.583 1.729
244 HB2 ASP 34 HB2 ASP 34 6.869 -11.422 1.118
245 HB3 ASP 34 HB1 ASP 34 8.341 -12.222 0.581
246 H SER 35 HN SER 35 8.579 -10.231 -1.698
247 HA SER 35 HA SER 35 11.053 -11.457 -2.131
248 HB2 SER 35 HB2 SER 35 9.545 -9.551 -3.943
249 HB3 SER 35 HB1 SER 35 10.869 -10.599 -4.450
250 HG SER 35 HG SER 35 9.594 -12.386 -3.946
251 H LEU 36 HN LEU 36 10.293 -8.339 -1.086
252 HA LEU 36 HA LEU 36 13.056 -7.604 -0.928
253 HB2 LEU 36 HB2 LEU 36 12.674 -5.418 -2.113
254 HB3 LEU 36 HB1 LEU 36 12.705 -6.833 -3.148
255 HG LEU 36 HG LEU 36 10.040 -6.039 -2.190
256 HD11 LEU 36 HD11 LEU 36 11.550 -4.345 -4.179
257 HD12 LEU 36 HD12 LEU 36 11.013 -3.838 -2.577
258 HD13 LEU 36 HD13 LEU 36 9.826 -4.227 -3.824
259 HD21 LEU 36 HD21 LEU 36 10.400 -7.873 -3.766
260 HD22 LEU 36 HD22 LEU 36 11.145 -6.751 -4.904
261 HD23 LEU 36 HD23 LEU 36 9.440 -6.583 -4.487
262 H GLY 37 HN GLY 37 10.898 -8.106 0.871
263 HA2 GLY 37 HA2 GLY 37 10.929 -5.565 2.330
264 HA3 GLY 37 HA1 GLY 37 9.377 -6.355 2.063
265 H LYS 38 HN LYS 38 11.736 -8.574 2.215
266 HA LYS 38 HA LYS 38 12.116 -8.953 5.014
267 HB2 LYS 38 HB2 LYS 38 9.810 -9.974 3.793
268 HB3 LYS 38 HB1 LYS 38 10.920 -11.329 3.888
269 HG2 LYS 38 HG2 LYS 38 9.490 -11.259 5.846
270 HG3 LYS 38 HG1 LYS 38 11.165 -10.923 6.307
271 HD2 LYS 38 HD2 LYS 38 10.551 -8.462 6.004
272 HD3 LYS 38 HD1 LYS 38 8.874 -9.008 6.031
273 HE2 LYS 38 HE2 LYS 38 10.927 -9.406 8.207
274 HE3 LYS 38 HE1 LYS 38 9.545 -8.312 8.256
275 HZ1 LYS 38 HZ1 LYS 38 9.423 -11.276 8.121
276 HZ2 LYS 38 HZ2 LYS 38 8.081 -10.249 8.104
277 HZ3 LYS 38 HZ3 LYS 38 9.070 -10.323 9.474
278 H GLY 39 HN GLY 39 12.098 -10.229 1.759
279 HA2 GLY 39 HA2 GLY 39 14.216 -12.105 2.181
280 HA3 GLY 39 HA1 GLY 39 13.516 -11.650 0.636
281 H THR 40 HN THR 40 14.071 -8.740 1.461
282 HA THR 40 HA THR 40 16.892 -8.511 1.637
283 HB THR 40 HB THR 40 16.542 -9.396 -0.655
284 HG1 THR 40 HG1 THR 40 17.846 -7.490 -1.572
285 HG21 THR 40 HG21 THR 40 15.233 -6.723 -1.051
286 HG22 THR 40 HG22 THR 40 14.562 -8.321 -1.376
287 HG23 THR 40 HG23 THR 40 15.868 -7.691 -2.379
288 H MET 41 HN MET 41 14.330 -7.257 2.658
289 HA MET 41 HA MET 41 13.875 -4.706 1.877
290 HB2 MET 41 HB2 MET 41 13.309 -6.224 4.115
291 HB3 MET 41 HB1 MET 41 14.244 -4.888 4.775
292 HG2 MET 41 HG2 MET 41 12.480 -3.654 3.069
293 HG3 MET 41 HG1 MET 41 11.534 -4.960 3.774
294 HE1 MET 41 HE1 MET 41 9.855 -3.257 4.896
295 HE2 MET 41 HE2 MET 41 10.749 -1.922 4.167
296 HE3 MET 41 HE3 MET 41 10.366 -1.891 5.888
297 H ARG 42 HN ARG 42 16.605 -5.856 3.796
298 HA ARG 42 HA ARG 42 17.715 -3.381 4.478
299 HB2 ARG 42 HB2 ARG 42 18.385 -5.579 5.443
300 HB3 ARG 42 HB1 ARG 42 19.210 -5.952 3.939
301 HG2 ARG 42 HG2 ARG 42 20.875 -5.217 5.409
302 HG3 ARG 42 HG1 ARG 42 20.573 -3.854 4.331
303 HD2 ARG 42 HD2 ARG 42 19.308 -4.161 7.049
304 HD3 ARG 42 HD1 ARG 42 20.795 -3.263 6.759
305 HE ARG 42 HE ARG 42 19.116 -2.095 5.038
306 HH11 ARG 42 HH11 ARG 42 18.748 -2.928 8.402
307 HH12 ARG 42 HH12 ARG 42 17.669 -1.617 8.741
308 HH21 ARG 42 HH21 ARG 42 17.695 -0.366 5.478
309 HH22 ARG 42 HH22 ARG 42 17.068 -0.164 7.080
310 H ILE 43 HN ILE 43 18.599 -5.552 1.788
311 HA ILE 43 HA ILE 43 20.491 -3.864 0.618
312 HB ILE 43 HB ILE 43 18.721 -5.861 -0.796
313 HG12 ILE 43 HG12 ILE 43 21.452 -6.192 0.473
314 HG13 ILE 43 HG11 ILE 43 19.944 -6.858 1.088
315 HG21 ILE 43 HG21 ILE 43 20.522 -5.940 -2.456
316 HG22 ILE 43 HG22 ILE 43 21.375 -4.668 -1.583
317 HG23 ILE 43 HG23 ILE 43 19.815 -4.329 -2.333
318 HD11 ILE 43 HD11 ILE 43 19.754 -8.310 -0.822
319 HD12 ILE 43 HD12 ILE 43 21.340 -8.515 -0.079
320 HD13 ILE 43 HD13 ILE 43 21.176 -7.575 -1.562
321 H ASN 44 HN ASN 44 16.990 -4.112 0.072
322 HA ASN 44 HA ASN 44 16.829 -2.340 -2.091
323 HB2 ASN 44 HB2 ASN 44 14.892 -3.286 -0.024
324 HB3 ASN 44 HB1 ASN 44 14.433 -1.940 -1.064
325 HD21 ASN 44 HD21 ASN 44 16.283 -4.901 -1.636
326 HD22 ASN 44 HD22 ASN 44 15.300 -5.472 -2.937
327 H ARG 45 HN ARG 45 16.496 -1.710 1.389
328 HA ARG 45 HA ARG 45 16.006 1.040 1.213
329 HB2 ARG 45 HB2 ARG 45 16.666 -0.881 3.278
330 HB3 ARG 45 HB1 ARG 45 17.455 0.662 3.567
331 HG2 ARG 45 HG2 ARG 45 14.508 0.292 3.097
332 HG3 ARG 45 HG1 ARG 45 15.276 0.472 4.676
333 HD2 ARG 45 HD2 ARG 45 15.286 2.496 2.441
334 HD3 ARG 45 HD1 ARG 45 14.344 2.588 3.928
335 HE ARG 45 HE ARG 45 17.077 2.331 4.556
336 HH11 ARG 45 HH11 ARG 45 14.809 4.633 3.253
337 HH12 ARG 45 HH12 ARG 45 15.706 6.014 3.791
338 HH21 ARG 45 HH21 ARG 45 18.263 4.140 5.268
339 HH22 ARG 45 HH22 ARG 45 17.669 5.734 4.939
340 H ASN 46 HN ASN 46 19.083 -0.678 1.738
341 HA ASN 46 HA ASN 46 20.677 1.633 1.807
342 HB2 ASN 46 HB2 ASN 46 21.400 -1.190 0.969
343 HB3 ASN 46 HB1 ASN 46 22.563 0.085 1.327
344 HD21 ASN 46 HD21 ASN 46 21.786 -2.596 2.573
345 HD22 ASN 46 HD22 ASN 46 21.648 -2.231 4.256
346 H ALA 47 HN ALA 47 19.448 -0.374 -0.755
347 HA ALA 47 HA ALA 47 20.969 0.722 -2.882
348 HB1 ALA 47 HB1 ALA 47 19.241 -0.280 -4.340
349 HB2 ALA 47 HB2 ALA 47 18.278 -0.648 -2.908
350 HB3 ALA 47 HB3 ALA 47 19.851 -1.413 -3.133
351 H TYR 48 HN TYR 48 17.831 1.479 -1.473
352 HA TYR 48 HA TYR 48 17.033 3.444 -3.325
353 HB2 TYR 48 HB2 TYR 48 15.932 2.230 -1.078
354 HB3 TYR 48 HB1 TYR 48 16.086 3.921 -0.613
355 HD1 TYR 48 HD1 TYR 48 14.626 1.655 -3.155
356 HD2 TYR 48 HD2 TYR 48 14.619 5.564 -1.472
357 HE1 TYR 48 HE1 TYR 48 12.586 2.192 -4.419
358 HE2 TYR 48 HE2 TYR 48 12.581 6.111 -2.732
359 HH TYR 48 HH TYR 48 10.706 3.748 -4.310
360 H GLY 49 HN GLY 49 19.245 3.456 -0.694
361 HA2 GLY 49 HA2 GLY 49 19.298 6.156 0.012
362 HA3 GLY 49 HA1 GLY 49 20.668 5.063 0.121
363 H SER 50 HN SER 50 19.741 5.060 -3.047
364 HA SER 50 HA SER 50 20.846 7.534 -3.942
365 HB2 SER 50 HB2 SER 50 22.936 6.426 -3.283
366 HB3 SER 50 HB1 SER 50 22.524 5.034 -4.291
367 HG SER 50 HG SER 50 22.344 7.017 -5.913
368 H MET 51 HN MET 51 20.011 4.197 -4.671
369 HA MET 51 HA MET 51 19.607 4.608 -7.465
370 HB2 MET 51 HB2 MET 51 18.637 2.409 -5.631
371 HB3 MET 51 HB1 MET 51 18.512 2.377 -7.382
372 HG2 MET 51 HG2 MET 51 21.080 2.500 -5.820
373 HG3 MET 51 HG1 MET 51 20.394 1.053 -6.554
374 HE1 MET 51 HE1 MET 51 23.473 1.746 -8.853
375 HE2 MET 51 HE2 MET 51 22.660 0.585 -7.802
376 HE3 MET 51 HE3 MET 51 23.392 2.036 -7.115
377 H GLY 52 HN GLY 52 17.655 4.957 -4.609
378 HA2 GLY 52 HA2 GLY 52 15.217 5.262 -6.214
379 HA3 GLY 52 HA1 GLY 52 15.287 5.118 -4.465
380 H GLY 53 HN GLY 53 17.456 7.264 -6.118
381 HA2 GLY 53 HA2 GLY 53 15.795 9.587 -5.957
382 HA3 GLY 53 HA1 GLY 53 16.925 9.498 -4.613
383 H GLY 54 HN GLY 54 18.149 8.007 -7.366
384 HA2 GLY 54 HA2 GLY 54 19.390 10.454 -8.375
385 HA3 GLY 54 HA1 GLY 54 20.441 9.178 -7.781
386 H SER 55 HN SER 55 18.946 6.968 -8.730
387 HA SER 55 HA SER 55 19.890 6.875 -11.420
388 HB2 SER 55 HB2 SER 55 18.157 4.925 -9.888
389 HB3 SER 55 HB1 SER 55 18.919 4.603 -11.446
390 HG SER 55 HG SER 55 20.925 4.775 -10.473
391 H LEU 56 HN LEU 56 17.102 8.126 -10.074
392 HA LEU 56 HA LEU 56 15.262 7.432 -12.168
393 HB2 LEU 56 HB2 LEU 56 15.118 9.542 -10.011
394 HB3 LEU 56 HB1 LEU 56 13.804 9.143 -11.101
395 HG LEU 56 HG LEU 56 15.037 7.214 -9.130
396 HD11 LEU 56 HD11 LEU 56 12.441 8.742 -8.984
397 HD12 LEU 56 HD12 LEU 56 13.870 9.028 -7.989
398 HD13 LEU 56 HD13 LEU 56 12.984 7.509 -7.845
399 HD21 LEU 56 HD21 LEU 56 13.067 5.842 -9.647
400 HD22 LEU 56 HD22 LEU 56 14.080 6.104 -11.067
401 HD23 LEU 56 HD23 LEU 56 12.583 7.014 -10.872
402 H ARG 57 HN ARG 57 17.884 8.843 -12.730
403 HA ARG 57 HA ARG 57 17.110 11.415 -13.768
404 HB2 ARG 57 HB2 ARG 57 19.443 11.485 -14.597
405 HB3 ARG 57 HB1 ARG 57 19.343 11.122 -12.883
406 HG2 ARG 57 HG2 ARG 57 19.868 8.875 -13.213
407 HG3 ARG 57 HG1 ARG 57 19.627 8.986 -14.958
408 HD2 ARG 57 HD2 ARG 57 21.773 10.418 -13.398
409 HD3 ARG 57 HD1 ARG 57 22.012 8.930 -14.312
410 HE ARG 57 HE ARG 57 20.911 11.034 -15.905
411 HH11 ARG 57 HH11 ARG 57 23.866 9.736 -14.590
412 HH12 ARG 57 HH12 ARG 57 24.871 10.440 -15.813
413 HH21 ARG 57 HH21 ARG 57 22.228 11.967 -17.519
414 HH22 ARG 57 HH22 ARG 57 23.941 11.708 -17.476
415 H GLY 58 HN GLY 58 15.859 8.868 -14.791
416 HA2 GLY 58 HA2 GLY 58 14.837 8.738 -16.954
417 HA3 GLY 58 HA1 GLY 58 16.285 9.459 -17.641
418 H SER 59 HN SER 59 17.961 7.630 -15.942
419 HA SER 59 HA SER 59 19.079 5.670 -16.208
420 HB2 SER 59 HB2 SER 59 17.026 4.703 -15.288
421 HB3 SER 59 HB1 SER 59 16.318 4.635 -16.901
422 HG SER 59 HG SER 59 18.732 3.421 -16.849
Start of MODEL 6
1 H1 MET 1 HT1 MET 1 -31.264 12.907 3.113
2 H2 MET 1 HT2 MET 1 -29.869 11.951 3.106
3 H3 MET 1 HT3 MET 1 -30.390 12.674 4.543
4 HA MET 1 HA MET 1 -32.382 11.340 4.547
5 HB2 MET 1 HB2 MET 1 -31.160 10.091 2.078
6 HB3 MET 1 HB1 MET 1 -32.587 9.493 2.912
7 HG2 MET 1 HG2 MET 1 -32.332 12.188 1.598
8 HG3 MET 1 HG1 MET 1 -33.148 10.783 0.913
9 HE1 MET 1 HE1 MET 1 -36.080 13.248 1.841
10 HE2 MET 1 HE2 MET 1 -35.377 12.264 0.556
11 HE3 MET 1 HE3 MET 1 -34.481 13.639 1.205
12 H SER 2 HN SER 2 -32.231 8.689 4.692
13 HA SER 2 HA SER 2 -30.415 8.216 6.765
14 HB2 SER 2 HB2 SER 2 -31.899 6.225 5.041
15 HB3 SER 2 HB1 SER 2 -31.085 5.837 6.557
16 HG SER 2 HG SER 2 -33.533 6.580 6.323
17 H GLY 3 HN GLY 3 -30.213 7.653 3.347
18 HA2 GLY 3 HA2 GLY 3 -27.449 6.674 3.711
19 HA3 GLY 3 HA1 GLY 3 -28.506 6.096 2.442
20 H GLY 4 HN GLY 4 -28.351 9.496 3.356
21 HA2 GLY 4 HA2 GLY 4 -27.829 11.337 2.076
22 HA3 GLY 4 HA1 GLY 4 -26.438 10.395 1.556
23 H GLY 5 HN GLY 5 -29.834 9.655 1.103
24 HA2 GLY 5 HA2 GLY 5 -31.112 9.515 -0.829
25 HA3 GLY 5 HA1 GLY 5 -29.801 10.311 -1.709
26 H VAL 6 HN VAL 6 -29.200 7.685 0.375
27 HA VAL 6 HA VAL 6 -28.557 5.552 0.150
28 HB VAL 6 HB VAL 6 -30.343 5.898 -1.935
29 HG11 VAL 6 HG11 VAL 6 -29.508 4.489 -3.736
30 HG12 VAL 6 HG12 VAL 6 -27.959 4.325 -2.911
31 HG13 VAL 6 HG13 VAL 6 -28.466 5.897 -3.531
32 HG21 VAL 6 HG21 VAL 6 -30.075 4.222 0.005
33 HG22 VAL 6 HG22 VAL 6 -29.207 3.242 -1.181
34 HG23 VAL 6 HG23 VAL 6 -30.887 3.698 -1.474
35 H PHE 7 HN PHE 7 -27.395 8.164 -1.387
36 HA PHE 7 HA PHE 7 -25.210 7.238 -2.897
37 HB2 PHE 7 HB2 PHE 7 -26.138 9.552 -2.914
38 HB3 PHE 7 HB1 PHE 7 -25.454 9.804 -1.310
39 HD1 PHE 7 HD1 PHE 7 -22.994 9.743 -1.030
40 HD2 PHE 7 HD2 PHE 7 -24.832 9.794 -4.857
41 HE1 PHE 7 HE1 PHE 7 -20.866 10.487 -2.034
42 HE2 PHE 7 HE2 PHE 7 -22.716 10.531 -5.876
43 HZ PHE 7 HZ PHE 7 -20.729 10.881 -4.463
44 H THR 8 HN THR 8 -25.475 8.149 0.547
45 HA THR 8 HA THR 8 -22.765 7.795 1.194
46 HB THR 8 HB THR 8 -25.060 7.233 3.059
47 HG1 THR 8 HG1 THR 8 -25.039 9.363 1.845
48 HG21 THR 8 HG21 THR 8 -23.500 8.009 4.781
49 HG22 THR 8 HG22 THR 8 -22.264 8.255 3.547
50 HG23 THR 8 HG23 THR 8 -22.847 6.628 3.900
51 H ASP 9 HN ASP 9 -25.405 5.559 0.812
52 HA ASP 9 HA ASP 9 -24.189 3.300 2.009
53 HB2 ASP 9 HB2 ASP 9 -26.193 2.500 1.610
54 HB3 ASP 9 HB1 ASP 9 -26.624 3.885 0.639
55 H ILE 10 HN ILE 10 -24.503 4.496 -1.244
56 HA ILE 10 HA ILE 10 -23.021 2.620 -2.636
57 HB ILE 10 HB ILE 10 -23.358 5.597 -2.972
58 HG12 ILE 10 HG12 ILE 10 -24.590 3.212 -4.322
59 HG13 ILE 10 HG11 ILE 10 -25.371 4.269 -3.165
60 HG21 ILE 10 HG21 ILE 10 -21.287 4.999 -4.070
61 HG22 ILE 10 HG22 ILE 10 -22.535 5.344 -5.268
62 HG23 ILE 10 HG23 ILE 10 -22.088 3.673 -4.916
63 HD11 ILE 10 HD11 ILE 10 -24.437 5.046 -5.913
64 HD12 ILE 10 HD12 ILE 10 -25.184 6.124 -4.734
65 HD13 ILE 10 HD13 ILE 10 -26.105 4.779 -5.404
66 H LEU 11 HN LEU 11 -22.186 5.174 -0.521
67 HA LEU 11 HA LEU 11 -19.362 5.201 -1.117
68 HB2 LEU 11 HB2 LEU 11 -21.115 6.555 0.896
69 HB3 LEU 11 HB1 LEU 11 -19.373 6.596 1.059
70 HG LEU 11 HG LEU 11 -20.929 7.637 -1.309
71 HD11 LEU 11 HD11 LEU 11 -19.572 9.077 0.967
72 HD12 LEU 11 HD12 LEU 11 -21.304 9.015 0.637
73 HD13 LEU 11 HD13 LEU 11 -20.222 9.851 -0.478
74 HD21 LEU 11 HD21 LEU 11 -18.781 8.612 -1.989
75 HD22 LEU 11 HD22 LEU 11 -18.719 6.850 -1.946
76 HD23 LEU 11 HD23 LEU 11 -17.989 7.791 -0.644
77 H ALA 12 HN ALA 12 -21.489 3.971 1.339
78 HA ALA 12 HA ALA 12 -19.478 3.030 3.120
79 HB1 ALA 12 HB1 ALA 12 -22.425 2.510 2.832
80 HB2 ALA 12 HB2 ALA 12 -21.576 3.397 4.101
81 HB3 ALA 12 HB3 ALA 12 -21.445 1.636 4.016
82 H ALA 13 HN ALA 13 -21.543 1.487 0.749
83 HA ALA 13 HA ALA 13 -20.590 -1.111 0.982
84 HB1 ALA 13 HB1 ALA 13 -21.582 0.081 -1.595
85 HB2 ALA 13 HB2 ALA 13 -22.669 -0.237 -0.240
86 HB3 ALA 13 HB3 ALA 13 -21.779 -1.566 -0.994
87 H ALA 14 HN ALA 14 -19.738 1.342 -1.514
88 HA ALA 14 HA ALA 14 -17.653 -0.139 -2.669
89 HB1 ALA 14 HB1 ALA 14 -16.695 2.234 -3.173
90 HB2 ALA 14 HB2 ALA 14 -18.278 2.772 -2.588
91 HB3 ALA 14 HB3 ALA 14 -18.175 1.679 -3.972
92 H GLY 15 HN GLY 15 -17.656 2.215 -0.043
93 HA2 GLY 15 HA2 GLY 15 -14.922 2.467 0.316
94 HA3 GLY 15 HA1 GLY 15 -16.114 2.582 1.616
95 H ARG 16 HN ARG 16 -17.146 0.178 1.813
96 HA ARG 16 HA ARG 16 -15.112 -1.337 3.081
97 HB2 ARG 16 HB2 ARG 16 -17.913 -1.177 3.126
98 HB3 ARG 16 HB1 ARG 16 -17.522 -2.824 2.666
99 HG2 ARG 16 HG2 ARG 16 -16.288 -3.187 4.645
100 HG3 ARG 16 HG1 ARG 16 -16.312 -1.464 5.050
101 HD2 ARG 16 HD2 ARG 16 -18.912 -1.898 4.812
102 HD3 ARG 16 HD1 ARG 16 -18.425 -3.505 5.310
103 HE ARG 16 HE ARG 16 -17.198 -1.810 7.081
104 HH11 ARG 16 HH11 ARG 16 -20.480 -2.453 6.107
105 HH12 ARG 16 HH12 ARG 16 -21.156 -2.018 7.641
106 HH21 ARG 16 HH21 ARG 16 -18.079 -1.235 9.104
107 HH22 ARG 16 HH22 ARG 16 -19.792 -1.328 9.345
108 H ILE 17 HN ILE 17 -16.749 -1.537 -0.035
109 HA ILE 17 HA ILE 17 -16.015 -4.222 -0.640
110 HB ILE 17 HB ILE 17 -16.688 -1.850 -2.395
111 HG12 ILE 17 HG12 ILE 17 -18.167 -4.166 -1.279
112 HG13 ILE 17 HG11 ILE 17 -18.692 -2.524 -1.558
113 HG21 ILE 17 HG21 ILE 17 -16.674 -3.337 -4.318
114 HG22 ILE 17 HG22 ILE 17 -16.120 -4.667 -3.301
115 HG23 ILE 17 HG23 ILE 17 -15.082 -3.266 -3.564
116 HD11 ILE 17 HD11 ILE 17 -18.450 -4.691 -3.618
117 HD12 ILE 17 HD12 ILE 17 -18.854 -3.010 -3.968
118 HD13 ILE 17 HD13 ILE 17 -19.934 -3.990 -2.975
119 H PHE 18 HN PHE 18 -14.921 -1.178 -1.817
120 HA PHE 18 HA PHE 18 -12.559 -1.831 -3.030
121 HB2 PHE 18 HB2 PHE 18 -13.643 0.338 -3.173
122 HB3 PHE 18 HB1 PHE 18 -13.363 0.627 -1.478
123 HD1 PHE 18 HD2 PHE 18 -11.743 0.483 -4.786
124 HD2 PHE 18 HD1 PHE 18 -11.358 1.292 -0.656
125 HE1 PHE 18 HE2 PHE 18 -9.598 1.615 -5.231
126 HE2 PHE 18 HE1 PHE 18 -9.201 2.445 -1.062
127 HZ PHE 18 HZ PHE 18 -8.323 2.601 -3.363
128 H GLU 19 HN GLU 19 -13.216 -1.056 0.357
129 HA GLU 19 HA GLU 19 -10.537 -1.030 1.225
130 HB2 GLU 19 HB2 GLU 19 -13.121 -0.849 2.450
131 HB3 GLU 19 HB1 GLU 19 -12.118 -1.957 3.370
132 HG2 GLU 19 HG2 GLU 19 -11.363 0.857 2.616
133 HG3 GLU 19 HG1 GLU 19 -11.975 0.348 4.190
134 H VAL 20 HN VAL 20 -12.987 -3.585 1.524
135 HA VAL 20 HA VAL 20 -11.207 -5.505 2.578
136 HB VAL 20 HB VAL 20 -12.857 -7.193 2.035
137 HG11 VAL 20 HG11 VAL 20 -14.743 -5.008 2.678
138 HG12 VAL 20 HG12 VAL 20 -13.319 -5.124 3.714
139 HG13 VAL 20 HG13 VAL 20 -14.395 -6.508 3.541
140 HG21 VAL 20 HG21 VAL 20 -14.789 -6.778 0.654
141 HG22 VAL 20 HG22 VAL 20 -13.326 -6.428 -0.266
142 HG23 VAL 20 HG23 VAL 20 -14.287 -5.108 0.399
143 H MET 21 HN MET 21 -11.866 -4.291 -0.548
144 HA MET 21 HA MET 21 -10.590 -6.326 -2.092
145 HB2 MET 21 HB2 MET 21 -11.445 -3.476 -2.631
146 HB3 MET 21 HB1 MET 21 -10.592 -4.438 -3.838
147 HG2 MET 21 HG2 MET 21 -12.991 -5.660 -2.617
148 HG3 MET 21 HG1 MET 21 -13.259 -4.299 -3.706
149 HE1 MET 21 HE1 MET 21 -14.685 -5.837 -5.339
150 HE2 MET 21 HE2 MET 21 -14.459 -7.186 -4.226
151 HE3 MET 21 HE3 MET 21 -14.126 -7.396 -5.946
152 H VAL 22 HN VAL 22 -9.735 -3.413 -0.430
153 HA VAL 22 HA VAL 22 -7.164 -3.116 -1.597
154 HB VAL 22 HB VAL 22 -8.590 -1.783 0.661
155 HG11 VAL 22 HG11 VAL 22 -6.368 -2.048 1.563
156 HG12 VAL 22 HG12 VAL 22 -6.572 -0.378 1.036
157 HG13 VAL 22 HG13 VAL 22 -5.648 -1.508 0.047
158 HG21 VAL 22 HG21 VAL 22 -7.770 0.197 -0.817
159 HG22 VAL 22 HG22 VAL 22 -9.122 -0.796 -1.359
160 HG23 VAL 22 HG23 VAL 22 -7.511 -1.062 -2.026
161 H GLU 23 HN GLU 23 -8.397 -4.470 1.439
162 HA GLU 23 HA GLU 23 -5.946 -4.987 2.656
163 HB2 GLU 23 HB2 GLU 23 -8.371 -6.752 2.902
164 HB3 GLU 23 HB1 GLU 23 -7.116 -6.460 4.096
165 HG2 GLU 23 HG2 GLU 23 -9.098 -4.432 3.126
166 HG3 GLU 23 HG1 GLU 23 -9.207 -5.319 4.646
167 H GLY 24 HN GLY 24 -7.950 -6.964 0.536
168 HA2 GLY 24 HA2 GLY 24 -6.286 -9.220 0.442
169 HA3 GLY 24 HA1 GLY 24 -7.412 -8.737 -0.827
170 H HIS 25 HN HIS 25 -6.215 -6.143 -1.272
171 HA HIS 25 HA HIS 25 -4.258 -6.876 -3.191
172 HB2 HIS 25 HB2 HIS 25 -5.623 -4.792 -3.342
173 HB3 HIS 25 HB1 HIS 25 -4.733 -4.145 -1.966
174 HD1 HIS 25 HD1 HIS 25 -4.128 -5.254 -5.539
175 HD2 HIS 25 HD2 HIS 25 -2.398 -2.886 -2.596
176 HE1 HIS 25 HE1 HIS 25 -2.199 -4.091 -6.658
177 HE2 HIS 25 HE2 HIS 25 -1.109 -2.742 -4.832
178 H TRP 26 HN TRP 26 -4.150 -5.566 0.056
179 HA TRP 26 HA TRP 26 -1.329 -5.313 0.231
180 HB2 TRP 26 HB2 TRP 26 -3.710 -4.997 1.957
181 HB3 TRP 26 HB1 TRP 26 -2.211 -5.378 2.772
182 HD1 TRP 26 HD1 TRP 26 -4.102 -2.524 1.322
183 HE1 TRP 26 HE1 TRP 26 -2.674 -0.381 1.417
184 HE3 TRP 26 HE3 TRP 26 0.391 -4.621 2.486
185 HZ2 TRP 26 HZ2 TRP 26 0.018 0.322 1.932
186 HZ3 TRP 26 HZ3 TRP 26 2.339 -3.160 2.776
187 HH2 TRP 26 HH2 TRP 26 2.164 -0.736 2.500
188 H GLU 27 HN GLU 27 -3.510 -7.919 0.465
189 HA GLU 27 HA GLU 27 -1.946 -9.484 2.249
190 HB2 GLU 27 HB2 GLU 27 -4.184 -10.079 0.337
191 HB3 GLU 27 HB1 GLU 27 -3.330 -11.384 1.137
192 HG2 GLU 27 HG2 GLU 27 -4.679 -9.129 2.594
193 HG3 GLU 27 HG1 GLU 27 -5.453 -10.669 2.234
194 H THR 28 HN THR 28 -2.252 -9.206 -1.212
195 HA THR 28 HA THR 28 -0.272 -11.238 -1.689
196 HB THR 28 HB THR 28 -2.269 -10.354 -3.257
197 HG1 THR 28 HG1 THR 28 -1.133 -12.247 -3.660
198 HG21 THR 28 HG21 THR 28 0.201 -9.077 -4.419
199 HG22 THR 28 HG22 THR 28 -1.086 -8.178 -3.608
200 HG23 THR 28 HG23 THR 28 -1.430 -9.062 -5.095
201 H VAL 29 HN VAL 29 -0.230 -7.833 -1.060
202 HA VAL 29 HA VAL 29 2.000 -7.125 -2.539
203 HB VAL 29 HB VAL 29 2.511 -5.370 -0.927
204 HG11 VAL 29 HG11 VAL 29 -0.449 -5.503 -1.398
205 HG12 VAL 29 HG12 VAL 29 0.730 -5.153 -2.664
206 HG13 VAL 29 HG13 VAL 29 0.569 -4.068 -1.279
207 HG21 VAL 29 HG21 VAL 29 2.040 -5.619 1.200
208 HG22 VAL 29 HG22 VAL 29 1.151 -7.099 0.849
209 HG23 VAL 29 HG23 VAL 29 0.322 -5.546 0.820
210 H GLY 30 HN GLY 30 1.707 -8.813 0.459
211 HA2 GLY 30 HA2 GLY 30 4.282 -8.822 1.405
212 HA3 GLY 30 HA1 GLY 30 3.249 -10.248 1.453
213 H MET 31 HN MET 31 3.340 -9.779 -1.690
214 HA MET 31 HA MET 31 5.785 -11.341 -2.078
215 HB2 MET 31 HB2 MET 31 4.772 -12.498 -3.795
216 HB3 MET 31 HB1 MET 31 3.472 -12.315 -2.644
217 HG2 MET 31 HG2 MET 31 2.386 -11.840 -4.569
218 HG3 MET 31 HG1 MET 31 2.915 -10.222 -4.125
219 HE1 MET 31 HE1 MET 31 1.995 -11.141 -7.090
220 HE2 MET 31 HE2 MET 31 3.188 -10.270 -8.055
221 HE3 MET 31 HE3 MET 31 2.443 -9.490 -6.659
222 H LEU 32 HN LEU 32 3.766 -8.983 -3.890
223 HA LEU 32 HA LEU 32 5.817 -8.316 -5.707
224 HB2 LEU 32 HB2 LEU 32 4.417 -6.484 -6.404
225 HB3 LEU 32 HB1 LEU 32 3.432 -7.910 -6.159
226 HG LEU 32 HG LEU 32 3.099 -6.807 -3.764
227 HD11 LEU 32 HD11 LEU 32 2.850 -4.360 -4.022
228 HD12 LEU 32 HD12 LEU 32 3.656 -4.477 -5.588
229 HD13 LEU 32 HD13 LEU 32 4.525 -4.903 -4.114
230 HD21 LEU 32 HD21 LEU 32 1.632 -5.990 -6.266
231 HD22 LEU 32 HD22 LEU 32 1.022 -5.826 -4.619
232 HD23 LEU 32 HD23 LEU 32 1.319 -7.428 -5.293
233 H PHE 33 HN PHE 33 4.934 -7.230 -2.590
234 HA PHE 33 HA PHE 33 6.512 -4.833 -2.579
235 HB2 PHE 33 HB2 PHE 33 4.543 -5.142 -1.081
236 HB3 PHE 33 HB1 PHE 33 5.413 -6.412 -0.231
237 HD1 PHE 33 HD1 PHE 33 7.349 -3.547 -1.333
238 HD2 PHE 33 HD2 PHE 33 4.998 -5.137 1.839
239 HE1 PHE 33 HE1 PHE 33 8.279 -1.861 0.196
240 HE2 PHE 33 HE2 PHE 33 5.928 -3.456 3.374
241 HZ PHE 33 HZ PHE 33 7.570 -1.814 2.554
242 H ASP 34 HN ASP 34 6.803 -8.071 -1.259
243 HA ASP 34 HA ASP 34 9.241 -7.871 0.016
244 HB2 ASP 34 HB2 ASP 34 7.876 -9.792 0.357
245 HB3 ASP 34 HB1 ASP 34 7.872 -10.175 -1.359
246 H SER 35 HN SER 35 8.553 -8.668 -3.380
247 HA SER 35 HA SER 35 11.114 -9.381 -4.182
248 HB2 SER 35 HB2 SER 35 9.165 -9.632 -5.643
249 HB3 SER 35 HB1 SER 35 9.015 -7.880 -5.770
250 HG SER 35 HG SER 35 10.115 -8.781 -7.563
251 H LEU 36 HN LEU 36 9.898 -6.311 -3.273
252 HA LEU 36 HA LEU 36 12.531 -5.147 -3.511
253 HB2 LEU 36 HB2 LEU 36 11.674 -3.154 -4.767
254 HB3 LEU 36 HB1 LEU 36 11.785 -4.626 -5.710
255 HG LEU 36 HG LEU 36 9.165 -3.953 -4.465
256 HD11 LEU 36 HD11 LEU 36 9.839 -1.835 -5.431
257 HD12 LEU 36 HD12 LEU 36 8.583 -2.579 -6.421
258 HD13 LEU 36 HD13 LEU 36 10.268 -2.635 -6.942
259 HD21 LEU 36 HD21 LEU 36 10.007 -5.204 -7.077
260 HD22 LEU 36 HD22 LEU 36 8.342 -4.993 -6.535
261 HD23 LEU 36 HD23 LEU 36 9.430 -6.057 -5.644
262 H GLY 37 HN GLY 37 11.061 -5.809 -1.327
263 HA2 GLY 37 HA2 GLY 37 10.555 -3.156 -0.134
264 HA3 GLY 37 HA1 GLY 37 9.511 -4.532 0.217
265 H LYS 38 HN LYS 38 11.710 -6.354 0.014
266 HA LYS 38 HA LYS 38 12.577 -6.352 2.752
267 HB2 LYS 38 HB2 LYS 38 12.221 -8.269 0.707
268 HB3 LYS 38 HB1 LYS 38 13.941 -8.262 1.060
269 HG2 LYS 38 HG2 LYS 38 12.864 -9.922 2.414
270 HG3 LYS 38 HG1 LYS 38 13.399 -8.601 3.457
271 HD2 LYS 38 HD2 LYS 38 11.148 -7.686 3.492
272 HD3 LYS 38 HD1 LYS 38 10.599 -8.943 2.382
273 HE2 LYS 38 HE2 LYS 38 9.977 -9.475 4.678
274 HE3 LYS 38 HE1 LYS 38 11.127 -10.651 4.045
275 HZ1 LYS 38 HZ1 LYS 38 11.684 -9.995 6.299
276 HZ2 LYS 38 HZ2 LYS 38 11.793 -8.374 5.832
277 HZ3 LYS 38 HZ3 LYS 38 12.896 -9.504 5.227
278 H GLY 39 HN GLY 39 14.034 -6.230 -0.444
279 HA2 GLY 39 HA2 GLY 39 16.620 -5.511 0.529
280 HA3 GLY 39 HA1 GLY 39 16.106 -5.522 -1.146
281 H THR 40 HN THR 40 13.846 -3.881 -0.840
282 HA THR 40 HA THR 40 15.084 -1.361 -1.048
283 HB THR 40 HB THR 40 12.729 -2.385 -1.984
284 HG1 THR 40 HG1 THR 40 12.470 -0.089 -2.694
285 HG21 THR 40 HG21 THR 40 10.918 -1.063 -1.163
286 HG22 THR 40 HG22 THR 40 11.998 -0.117 -0.140
287 HG23 THR 40 HG23 THR 40 11.685 -1.811 0.239
288 H MET 41 HN MET 41 14.003 -3.066 1.632
289 HA MET 41 HA MET 41 12.818 -1.411 3.377
290 HB2 MET 41 HB2 MET 41 14.619 -3.647 3.580
291 HB3 MET 41 HB1 MET 41 14.926 -2.503 4.880
292 HG2 MET 41 HG2 MET 41 12.208 -3.599 4.216
293 HG3 MET 41 HG1 MET 41 13.291 -4.304 5.412
294 HE1 MET 41 HE1 MET 41 11.467 -4.125 7.288
295 HE2 MET 41 HE2 MET 41 10.321 -3.440 6.135
296 HE3 MET 41 HE3 MET 41 10.595 -2.645 7.685
297 H ARG 42 HN ARG 42 16.284 -1.339 2.634
298 HA ARG 42 HA ARG 42 16.901 0.820 4.370
299 HB2 ARG 42 HB2 ARG 42 18.668 -0.633 3.601
300 HB3 ARG 42 HB1 ARG 42 18.305 -0.269 1.924
301 HG2 ARG 42 HG2 ARG 42 20.184 0.989 2.320
302 HG3 ARG 42 HG1 ARG 42 18.893 2.161 2.570
303 HD2 ARG 42 HD2 ARG 42 20.314 0.616 4.737
304 HD3 ARG 42 HD1 ARG 42 20.626 2.297 4.308
305 HE ARG 42 HE ARG 42 18.010 2.353 4.876
306 HH11 ARG 42 HH11 ARG 42 20.724 0.982 6.581
307 HH12 ARG 42 HH12 ARG 42 20.016 1.202 8.146
308 HH21 ARG 42 HH21 ARG 42 17.074 2.648 6.937
309 HH22 ARG 42 HH22 ARG 42 17.944 2.146 8.349
310 H ILE 43 HN ILE 43 16.054 0.573 0.974
311 HA ILE 43 HA ILE 43 16.446 3.252 0.243
312 HB ILE 43 HB ILE 43 14.475 1.283 -0.922
313 HG12 ILE 43 HG12 ILE 43 17.309 1.852 -1.811
314 HG13 ILE 43 HG11 ILE 43 16.863 0.491 -0.787
315 HG21 ILE 43 HG21 ILE 43 14.035 3.552 -1.635
316 HG22 ILE 43 HG22 ILE 43 14.719 2.623 -2.969
317 HG23 ILE 43 HG23 ILE 43 15.727 3.766 -2.083
318 HD11 ILE 43 HD11 ILE 43 15.843 0.985 -3.574
319 HD12 ILE 43 HD12 ILE 43 15.449 -0.398 -2.550
320 HD13 ILE 43 HD13 ILE 43 17.103 -0.165 -3.122
321 H ASN 44 HN ASN 44 13.724 1.622 1.764
322 HA ASN 44 HA ASN 44 11.736 3.526 1.285
323 HB2 ASN 44 HB2 ASN 44 12.054 1.205 2.954
324 HB3 ASN 44 HB1 ASN 44 11.240 2.491 3.836
325 HD21 ASN 44 HD21 ASN 44 10.979 0.120 1.413
326 HD22 ASN 44 HD22 ASN 44 9.344 0.432 0.951
327 H ARG 45 HN ARG 45 13.641 3.135 4.296
328 HA ARG 45 HA ARG 45 12.758 5.416 5.571
329 HB2 ARG 45 HB2 ARG 45 14.324 3.420 6.284
330 HB3 ARG 45 HB1 ARG 45 15.595 4.551 5.850
331 HG2 ARG 45 HG2 ARG 45 14.845 6.124 7.473
332 HG3 ARG 45 HG1 ARG 45 13.397 5.167 7.800
333 HD2 ARG 45 HD2 ARG 45 14.807 4.610 9.548
334 HD3 ARG 45 HD1 ARG 45 15.035 3.289 8.414
335 HE ARG 45 HE ARG 45 17.062 4.651 7.669
336 HH11 ARG 45 HH11 ARG 45 15.838 4.604 10.931
337 HH12 ARG 45 HH12 ARG 45 17.380 4.924 11.651
338 HH21 ARG 45 HH21 ARG 45 19.095 5.070 8.607
339 HH22 ARG 45 HH22 ARG 45 19.232 5.190 10.330
340 H ASN 46 HN ASN 46 15.581 5.033 3.428
341 HA ASN 46 HA ASN 46 16.448 7.714 3.644
342 HB2 ASN 46 HB2 ASN 46 16.824 5.769 1.348
343 HB3 ASN 46 HB1 ASN 46 17.758 7.239 1.612
344 HD21 ASN 46 HD21 ASN 46 18.441 4.305 1.534
345 HD22 ASN 46 HD22 ASN 46 19.341 4.038 2.983
346 H ALA 47 HN ALA 47 14.127 6.058 1.652
347 HA ALA 47 HA ALA 47 13.609 8.148 -0.191
348 HB1 ALA 47 HB1 ALA 47 11.916 5.811 0.705
349 HB2 ALA 47 HB2 ALA 47 12.937 5.905 -0.731
350 HB3 ALA 47 HB3 ALA 47 11.485 6.900 -0.616
351 H TYR 48 HN TYR 48 12.036 7.106 2.792
352 HA TYR 48 HA TYR 48 9.983 9.003 2.846
353 HB2 TYR 48 HB2 TYR 48 10.942 6.898 4.483
354 HB3 TYR 48 HB1 TYR 48 10.770 8.319 5.506
355 HD1 TYR 48 HD1 TYR 48 8.937 6.205 3.062
356 HD2 TYR 48 HD2 TYR 48 8.653 8.973 6.280
357 HE1 TYR 48 HE1 TYR 48 6.513 5.811 3.179
358 HE2 TYR 48 HE2 TYR 48 6.227 8.588 6.405
359 HH TYR 48 HH TYR 48 4.691 6.014 4.843
360 H GLY 49 HN GLY 49 13.328 9.298 3.451
361 HA2 GLY 49 HA2 GLY 49 13.487 11.335 5.323
362 HA3 GLY 49 HA1 GLY 49 14.620 11.121 3.998
363 H SER 50 HN SER 50 11.913 11.486 2.355
364 HA SER 50 HA SER 50 11.291 14.249 2.680
365 HB2 SER 50 HB2 SER 50 13.501 14.517 1.645
366 HB3 SER 50 HB1 SER 50 13.001 13.489 0.298
367 HG SER 50 HG SER 50 11.816 15.077 -0.497
368 H MET 51 HN MET 51 11.190 11.328 0.768
369 HA MET 51 HA MET 51 9.082 12.128 -0.972
370 HB2 MET 51 HB2 MET 51 10.011 9.360 -0.181
371 HB3 MET 51 HB1 MET 51 8.920 9.723 -1.513
372 HG2 MET 51 HG2 MET 51 11.758 10.700 -1.298
373 HG3 MET 51 HG1 MET 51 11.237 9.297 -2.230
374 HE1 MET 51 HE1 MET 51 9.029 10.889 -5.012
375 HE2 MET 51 HE2 MET 51 8.432 10.336 -3.448
376 HE3 MET 51 HE3 MET 51 9.661 9.404 -4.301
377 H GLY 52 HN GLY 52 9.229 10.690 2.206
378 HA2 GLY 52 HA2 GLY 52 6.332 10.218 2.186
379 HA3 GLY 52 HA1 GLY 52 7.463 9.605 3.382
380 H GLY 53 HN GLY 53 6.743 12.856 2.117
381 HA2 GLY 53 HA2 GLY 53 5.277 13.995 4.042
382 HA3 GLY 53 HA1 GLY 53 6.845 13.906 4.828
383 H GLY 54 HN GLY 54 6.940 14.313 1.435
384 HA2 GLY 54 HA2 GLY 54 6.989 17.215 1.600
385 HA3 GLY 54 HA1 GLY 54 8.505 16.434 1.179
386 H SER 55 HN SER 55 7.485 14.357 -0.423
387 HA SER 55 HA SER 55 7.095 15.778 -2.878
388 HB2 SER 55 HB2 SER 55 6.966 12.825 -2.310
389 HB3 SER 55 HB1 SER 55 7.037 13.559 -3.903
390 HG SER 55 HG SER 55 9.096 14.246 -3.499
391 H LEU 56 HN LEU 56 4.992 15.898 -0.777
392 HA LEU 56 HA LEU 56 2.739 16.044 -0.645
393 HB2 LEU 56 HB2 LEU 56 2.859 15.628 -3.627
394 HB3 LEU 56 HB1 LEU 56 1.480 16.234 -2.734
395 HG LEU 56 HG LEU 56 3.028 18.161 -2.016
396 HD11 LEU 56 HD11 LEU 56 5.140 17.193 -2.693
397 HD12 LEU 56 HD12 LEU 56 4.828 18.657 -3.629
398 HD13 LEU 56 HD13 LEU 56 4.581 17.071 -4.360
399 HD21 LEU 56 HD21 LEU 56 2.542 19.397 -4.073
400 HD22 LEU 56 HD22 LEU 56 1.163 18.426 -3.558
401 HD23 LEU 56 HD23 LEU 56 2.175 17.881 -4.896
402 H ARG 57 HN ARG 57 4.118 13.495 -0.428
403 HA ARG 57 HA ARG 57 3.810 11.223 -0.529
404 HB2 ARG 57 HB2 ARG 57 1.654 10.585 0.587
405 HB3 ARG 57 HB1 ARG 57 2.632 11.751 1.459
406 HG2 ARG 57 HG2 ARG 57 1.183 13.537 0.686
407 HG3 ARG 57 HG1 ARG 57 0.243 12.365 -0.233
408 HD2 ARG 57 HD2 ARG 57 0.577 12.403 2.761
409 HD3 ARG 57 HD1 ARG 57 -0.857 12.926 1.877
410 HE ARG 57 HE ARG 57 -0.250 10.276 1.165
411 HH11 ARG 57 HH11 ARG 57 -1.433 12.128 3.870
412 HH12 ARG 57 HH12 ARG 57 -2.355 10.817 4.529
413 HH21 ARG 57 HH21 ARG 57 -1.460 8.547 2.023
414 HH22 ARG 57 HH22 ARG 57 -2.370 8.782 3.478
415 H GLY 58 HN GLY 58 3.437 12.260 -3.081
416 HA2 GLY 58 HA2 GLY 58 2.530 10.281 -4.610
417 HA3 GLY 58 HA1 GLY 58 1.015 11.044 -4.155
418 H SER 59 HN SER 59 2.214 13.730 -4.122
419 HA SER 59 HA SER 59 2.407 15.512 -5.518
420 HB2 SER 59 HB2 SER 59 4.599 14.537 -6.000
421 HB3 SER 59 HB1 SER 59 3.885 13.509 -7.242
422 HG SER 59 HG SER 59 3.548 16.291 -7.387
Start of MODEL 7
1 H1 MET 1 HT1 MET 1 -31.490 8.755 0.031
2 H2 MET 1 HT2 MET 1 -32.018 8.162 -1.463
3 H3 MET 1 HT3 MET 1 -32.517 7.410 -0.032
4 HA MET 1 HA MET 1 -34.294 8.735 -0.919
5 HB2 MET 1 HB2 MET 1 -33.042 9.958 1.550
6 HB3 MET 1 HB1 MET 1 -34.719 10.153 1.059
7 HG2 MET 1 HG2 MET 1 -34.778 8.514 2.707
8 HG3 MET 1 HG1 MET 1 -34.882 7.617 1.194
9 HE1 MET 1 HE1 MET 1 -34.195 5.323 2.374
10 HE2 MET 1 HE2 MET 1 -34.221 6.208 3.899
11 HE3 MET 1 HE3 MET 1 -32.838 5.193 3.491
12 H SER 2 HN SER 2 -31.906 9.639 -2.354
13 HA SER 2 HA SER 2 -31.202 11.398 -3.607
14 HB2 SER 2 HB2 SER 2 -33.584 11.473 -4.250
15 HB3 SER 2 HB1 SER 2 -33.906 12.558 -2.898
16 HG SER 2 HG SER 2 -33.405 14.087 -4.237
17 H GLY 3 HN GLY 3 -31.024 11.407 -0.539
18 HA2 GLY 3 HA2 GLY 3 -30.185 14.231 -0.333
19 HA3 GLY 3 HA1 GLY 3 -31.048 13.442 0.979
20 H GLY 4 HN GLY 4 -28.607 11.885 -0.998
21 HA2 GLY 4 HA2 GLY 4 -26.416 11.303 -0.525
22 HA3 GLY 4 HA1 GLY 4 -26.500 12.268 0.937
23 H GLY 5 HN GLY 5 -29.133 10.563 1.365
24 HA2 GLY 5 HA2 GLY 5 -28.046 8.837 3.292
25 HA3 GLY 5 HA1 GLY 5 -29.670 8.717 2.625
26 H VAL 6 HN VAL 6 -29.587 7.926 0.224
27 HA VAL 6 HA VAL 6 -28.699 5.261 0.260
28 HB VAL 6 HB VAL 6 -30.582 5.943 -1.091
29 HG11 VAL 6 HG11 VAL 6 -29.674 8.178 -1.679
30 HG12 VAL 6 HG12 VAL 6 -30.406 7.313 -3.029
31 HG13 VAL 6 HG13 VAL 6 -28.651 7.387 -2.876
32 HG21 VAL 6 HG21 VAL 6 -29.985 4.807 -3.197
33 HG22 VAL 6 HG22 VAL 6 -29.402 3.943 -1.773
34 HG23 VAL 6 HG23 VAL 6 -28.285 4.908 -2.738
35 H PHE 7 HN PHE 7 -27.460 8.133 -1.347
36 HA PHE 7 HA PHE 7 -25.405 6.955 -2.825
37 HB2 PHE 7 HB2 PHE 7 -26.262 9.322 -3.014
38 HB3 PHE 7 HB1 PHE 7 -25.293 9.710 -1.597
39 HD1 PHE 7 HD1 PHE 7 -22.819 9.492 -1.715
40 HD2 PHE 7 HD2 PHE 7 -25.295 9.165 -5.157
41 HE1 PHE 7 HE1 PHE 7 -20.865 9.904 -3.153
42 HE2 PHE 7 HE2 PHE 7 -23.347 9.571 -6.604
43 HZ PHE 7 HZ PHE 7 -21.128 9.944 -5.603
44 H THR 8 HN THR 8 -25.368 8.191 0.513
45 HA THR 8 HA THR 8 -22.596 7.751 0.911
46 HB THR 8 HB THR 8 -24.775 7.778 2.994
47 HG1 THR 8 HG1 THR 8 -23.749 9.987 3.252
48 HG21 THR 8 HG21 THR 8 -21.791 8.113 3.271
49 HG22 THR 8 HG22 THR 8 -22.739 6.736 3.831
50 HG23 THR 8 HG23 THR 8 -22.968 8.322 4.567
51 H ASP 9 HN ASP 9 -25.402 5.679 1.122
52 HA ASP 9 HA ASP 9 -24.173 3.506 2.487
53 HB2 ASP 9 HB2 ASP 9 -26.726 4.084 1.322
54 HB3 ASP 9 HB1 ASP 9 -26.161 2.540 0.698
55 H ILE 10 HN ILE 10 -24.583 4.517 -0.808
56 HA ILE 10 HA ILE 10 -23.413 2.317 -2.115
57 HB ILE 10 HB ILE 10 -23.686 5.238 -2.818
58 HG12 ILE 10 HG12 ILE 10 -25.133 2.793 -3.822
59 HG13 ILE 10 HG11 ILE 10 -25.749 3.908 -2.615
60 HG21 ILE 10 HG21 ILE 10 -22.639 3.002 -4.541
61 HG22 ILE 10 HG22 ILE 10 -21.788 4.467 -4.047
62 HG23 ILE 10 HG23 ILE 10 -23.157 4.573 -5.153
63 HD11 ILE 10 HD11 ILE 10 -25.728 5.703 -4.263
64 HD12 ILE 10 HD12 ILE 10 -26.734 4.348 -4.777
65 HD13 ILE 10 HD13 ILE 10 -25.132 4.574 -5.480
66 H LEU 11 HN LEU 11 -22.244 5.288 -0.748
67 HA LEU 11 HA LEU 11 -19.526 5.066 -1.493
68 HB2 LEU 11 HB2 LEU 11 -21.046 6.643 0.558
69 HB3 LEU 11 HB1 LEU 11 -19.298 6.686 0.528
70 HG LEU 11 HG LEU 11 -21.093 7.486 -1.765
71 HD11 LEU 11 HD11 LEU 11 -20.370 9.771 -1.241
72 HD12 LEU 11 HD12 LEU 11 -19.515 9.170 0.180
73 HD13 LEU 11 HD13 LEU 11 -21.273 9.046 0.090
74 HD21 LEU 11 HD21 LEU 11 -18.988 8.436 -2.690
75 HD22 LEU 11 HD22 LEU 11 -18.992 6.676 -2.595
76 HD23 LEU 11 HD23 LEU 11 -18.102 7.622 -1.401
77 H ALA 12 HN ALA 12 -21.430 4.068 1.231
78 HA ALA 12 HA ALA 12 -19.297 3.229 2.903
79 HB1 ALA 12 HB1 ALA 12 -21.372 3.668 3.953
80 HB2 ALA 12 HB2 ALA 12 -21.142 1.920 4.057
81 HB3 ALA 12 HB3 ALA 12 -22.243 2.598 2.852
82 H ALA 13 HN ALA 13 -21.425 1.615 0.622
83 HA ALA 13 HA ALA 13 -20.435 -0.998 0.984
84 HB1 ALA 13 HB1 ALA 13 -21.671 0.132 -1.527
85 HB2 ALA 13 HB2 ALA 13 -22.602 -0.360 -0.111
86 HB3 ALA 13 HB3 ALA 13 -21.648 -1.552 -1.000
87 H ALA 14 HN ALA 14 -19.798 1.356 -1.637
88 HA ALA 14 HA ALA 14 -17.775 -0.062 -2.914
89 HB1 ALA 14 HB1 ALA 14 -18.017 2.930 -2.675
90 HB2 ALA 14 HB2 ALA 14 -18.829 1.928 -3.881
91 HB3 ALA 14 HB3 ALA 14 -17.067 2.052 -3.873
92 H GLY 15 HN GLY 15 -17.600 2.260 -0.255
93 HA2 GLY 15 HA2 GLY 15 -14.807 2.353 -0.031
94 HA3 GLY 15 HA1 GLY 15 -15.948 2.686 1.271
95 H ARG 16 HN ARG 16 -17.249 0.238 1.338
96 HA ARG 16 HA ARG 16 -15.476 -1.312 2.922
97 HB2 ARG 16 HB2 ARG 16 -18.311 -1.569 2.003
98 HB3 ARG 16 HB1 ARG 16 -17.502 -2.956 2.695
99 HG2 ARG 16 HG2 ARG 16 -17.856 -0.302 4.042
100 HG3 ARG 16 HG1 ARG 16 -18.825 -1.749 4.339
101 HD2 ARG 16 HD2 ARG 16 -16.545 -2.875 4.800
102 HD3 ARG 16 HD1 ARG 16 -15.966 -1.226 4.980
103 HE ARG 16 HE ARG 16 -18.263 -2.134 6.546
104 HH11 ARG 16 HH11 ARG 16 -14.966 -1.011 6.406
105 HH12 ARG 16 HH12 ARG 16 -14.861 -0.709 8.108
106 HH21 ARG 16 HH21 ARG 16 -18.131 -1.737 8.788
107 HH22 ARG 16 HH22 ARG 16 -16.660 -1.122 9.462
108 H ILE 17 HN ILE 17 -16.662 -1.431 -0.356
109 HA ILE 17 HA ILE 17 -15.913 -4.110 -0.956
110 HB ILE 17 HB ILE 17 -16.458 -1.669 -2.656
111 HG12 ILE 17 HG12 ILE 17 -17.988 -4.058 -1.767
112 HG13 ILE 17 HG11 ILE 17 -18.506 -2.396 -1.950
113 HG21 ILE 17 HG21 ILE 17 -16.318 -3.063 -4.637
114 HG22 ILE 17 HG22 ILE 17 -15.815 -4.439 -3.653
115 HG23 ILE 17 HG23 ILE 17 -14.774 -3.020 -3.787
116 HD11 ILE 17 HD11 ILE 17 -19.667 -3.733 -3.542
117 HD12 ILE 17 HD12 ILE 17 -18.157 -4.425 -4.137
118 HD13 ILE 17 HD13 ILE 17 -18.513 -2.718 -4.407
119 H PHE 18 HN PHE 18 -14.651 -1.007 -1.813
120 HA PHE 18 HA PHE 18 -12.208 -1.711 -2.877
121 HB2 PHE 18 HB2 PHE 18 -13.155 0.464 -3.158
122 HB3 PHE 18 HB1 PHE 18 -13.199 0.740 -1.432
123 HD1 PHE 18 HD1 PHE 18 -11.177 1.107 -0.194
124 HD2 PHE 18 HD2 PHE 18 -11.171 0.935 -4.428
125 HE1 PHE 18 HE1 PHE 18 -8.991 2.264 -0.226
126 HE2 PHE 18 HE2 PHE 18 -8.986 2.072 -4.488
127 HZ PHE 18 HZ PHE 18 -7.893 2.742 -2.383
128 H GLU 19 HN GLU 19 -13.194 -1.078 0.449
129 HA GLU 19 HA GLU 19 -10.635 -1.067 1.626
130 HB2 GLU 19 HB2 GLU 19 -13.365 -1.073 2.542
131 HB3 GLU 19 HB1 GLU 19 -12.402 -2.175 3.512
132 HG2 GLU 19 HG2 GLU 19 -11.779 0.725 3.006
133 HG3 GLU 19 HG1 GLU 19 -12.476 0.060 4.482
134 H VAL 20 HN VAL 20 -13.005 -3.692 1.295
135 HA VAL 20 HA VAL 20 -11.258 -5.650 2.407
136 HB VAL 20 HB VAL 20 -12.854 -7.317 1.647
137 HG11 VAL 20 HG11 VAL 20 -13.373 -5.830 3.626
138 HG12 VAL 20 HG12 VAL 20 -14.755 -6.634 2.886
139 HG13 VAL 20 HG13 VAL 20 -14.453 -4.929 2.562
140 HG21 VAL 20 HG21 VAL 20 -14.260 -5.098 0.175
141 HG22 VAL 20 HG22 VAL 20 -14.736 -6.794 0.242
142 HG23 VAL 20 HG23 VAL 20 -13.251 -6.326 -0.586
143 H MET 21 HN MET 21 -11.748 -4.253 -0.696
144 HA MET 21 HA MET 21 -10.405 -6.237 -2.253
145 HB2 MET 21 HB2 MET 21 -11.163 -3.353 -2.747
146 HB3 MET 21 HB1 MET 21 -10.276 -4.308 -3.931
147 HG2 MET 21 HG2 MET 21 -12.705 -5.596 -2.931
148 HG3 MET 21 HG1 MET 21 -12.988 -4.090 -3.801
149 HE1 MET 21 HE1 MET 21 -10.884 -7.801 -5.571
150 HE2 MET 21 HE2 MET 21 -11.568 -7.721 -3.947
151 HE3 MET 21 HE3 MET 21 -10.125 -6.788 -4.343
152 H VAL 22 HN VAL 22 -9.593 -3.474 -0.361
153 HA VAL 22 HA VAL 22 -6.941 -3.202 -1.384
154 HB VAL 22 HB VAL 22 -8.475 -1.852 0.788
155 HG11 VAL 22 HG11 VAL 22 -6.448 -0.544 1.360
156 HG12 VAL 22 HG12 VAL 22 -5.487 -1.674 0.405
157 HG13 VAL 22 HG13 VAL 22 -6.337 -2.236 1.845
158 HG21 VAL 22 HG21 VAL 22 -8.749 -0.961 -1.395
159 HG22 VAL 22 HG22 VAL 22 -7.013 -1.005 -1.696
160 HG23 VAL 22 HG23 VAL 22 -7.676 0.139 -0.528
161 H GLU 23 HN GLU 23 -8.422 -4.461 1.590
162 HA GLU 23 HA GLU 23 -6.040 -5.146 2.874
163 HB2 GLU 23 HB2 GLU 23 -7.340 -6.381 4.376
164 HB3 GLU 23 HB1 GLU 23 -8.405 -5.091 3.843
165 HG2 GLU 23 HG2 GLU 23 -9.539 -6.595 2.346
166 HG3 GLU 23 HG1 GLU 23 -8.410 -7.887 2.744
167 H GLY 24 HN GLY 24 -8.067 -6.861 0.587
168 HA2 GLY 24 HA2 GLY 24 -6.659 -9.307 0.591
169 HA3 GLY 24 HA1 GLY 24 -7.640 -8.691 -0.743
170 H HIS 25 HN HIS 25 -6.171 -6.245 -1.093
171 HA HIS 25 HA HIS 25 -4.155 -7.125 -2.864
172 HB2 HIS 25 HB2 HIS 25 -5.333 -4.887 -2.973
173 HB3 HIS 25 HB1 HIS 25 -4.351 -4.386 -1.596
174 HD1 HIS 25 HD1 HIS 25 -3.715 -5.789 -5.083
175 HD2 HIS 25 HD2 HIS 25 -2.095 -3.129 -2.333
176 HE1 HIS 25 HE1 HIS 25 -1.712 -4.779 -6.221
177 HE2 HIS 25 HE2 HIS 25 -0.791 -3.120 -4.566
178 H TRP 26 HN TRP 26 -4.173 -6.001 0.456
179 HA TRP 26 HA TRP 26 -1.354 -6.006 0.768
180 HB2 TRP 26 HB2 TRP 26 -3.752 -5.528 2.438
181 HB3 TRP 26 HB1 TRP 26 -2.285 -6.004 3.262
182 HD1 TRP 26 HD1 TRP 26 -3.951 -3.053 1.734
183 HE1 TRP 26 HE1 TRP 26 -2.397 -1.005 1.854
184 HE3 TRP 26 HE3 TRP 26 0.360 -5.423 3.042
185 HZ2 TRP 26 HZ2 TRP 26 0.324 -0.473 2.436
186 HZ3 TRP 26 HZ3 TRP 26 2.391 -4.089 3.369
187 HH2 TRP 26 HH2 TRP 26 2.382 -1.662 3.065
188 H GLU 27 HN GLU 27 -3.815 -8.366 0.834
189 HA GLU 27 HA GLU 27 -2.488 -10.225 2.544
190 HB2 GLU 27 HB2 GLU 27 -4.635 -10.508 0.438
191 HB3 GLU 27 HB1 GLU 27 -4.026 -11.877 1.343
192 HG2 GLU 27 HG2 GLU 27 -5.356 -9.462 2.544
193 HG3 GLU 27 HG1 GLU 27 -6.128 -11.018 2.256
194 H THR 28 HN THR 28 -2.705 -9.557 -0.826
195 HA THR 28 HA THR 28 -1.159 -11.736 -1.745
196 HB THR 28 HB THR 28 -1.565 -9.104 -3.138
197 HG1 THR 28 HG1 THR 28 -3.623 -9.742 -2.753
198 HG21 THR 28 HG21 THR 28 0.031 -10.478 -4.225
199 HG22 THR 28 HG22 THR 28 -1.476 -10.594 -5.138
200 HG23 THR 28 HG23 THR 28 -0.999 -11.901 -4.053
201 H VAL 29 HN VAL 29 -0.417 -8.508 -0.617
202 HA VAL 29 HA VAL 29 2.119 -8.331 -1.744
203 HB VAL 29 HB VAL 29 2.637 -6.576 -0.176
204 HG11 VAL 29 HG11 VAL 29 0.855 -6.511 -2.139
205 HG12 VAL 29 HG12 VAL 29 1.249 -5.093 -1.159
206 HG13 VAL 29 HG13 VAL 29 -0.199 -6.038 -0.799
207 HG21 VAL 29 HG21 VAL 29 1.889 -6.696 1.885
208 HG22 VAL 29 HG22 VAL 29 0.732 -7.946 1.441
209 HG23 VAL 29 HG23 VAL 29 0.299 -6.248 1.278
210 H GLY 30 HN GLY 30 1.050 -9.745 1.257
211 HA2 GLY 30 HA2 GLY 30 3.454 -10.220 2.504
212 HA3 GLY 30 HA1 GLY 30 2.103 -11.347 2.552
213 H MET 31 HN MET 31 2.610 -11.210 -0.596
214 HA MET 31 HA MET 31 4.641 -13.326 -0.583
215 HB2 MET 31 HB2 MET 31 3.409 -14.554 -1.998
216 HB3 MET 31 HB1 MET 31 2.088 -13.636 -1.310
217 HG2 MET 31 HG2 MET 31 1.655 -13.590 -3.568
218 HG3 MET 31 HG1 MET 31 2.447 -12.043 -3.289
219 HE1 MET 31 HE1 MET 31 3.691 -12.976 -6.875
220 HE2 MET 31 HE2 MET 31 2.914 -11.751 -5.872
221 HE3 MET 31 HE3 MET 31 2.095 -13.280 -6.188
222 H LEU 32 HN LEU 32 3.301 -10.798 -2.749
223 HA LEU 32 HA LEU 32 5.524 -10.824 -4.486
224 HB2 LEU 32 HB2 LEU 32 4.647 -8.782 -5.432
225 HB3 LEU 32 HB1 LEU 32 3.351 -9.932 -5.170
226 HG LEU 32 HG LEU 32 3.088 -8.598 -2.912
227 HD11 LEU 32 HD11 LEU 32 3.453 -6.165 -3.359
228 HD12 LEU 32 HD12 LEU 32 4.423 -6.632 -4.756
229 HD13 LEU 32 HD13 LEU 32 4.928 -7.104 -3.134
230 HD21 LEU 32 HD21 LEU 32 1.415 -7.182 -4.035
231 HD22 LEU 32 HD22 LEU 32 1.344 -8.862 -4.564
232 HD23 LEU 32 HD23 LEU 32 2.098 -7.646 -5.593
233 H PHE 33 HN PHE 33 4.884 -9.394 -1.470
234 HA PHE 33 HA PHE 33 6.900 -7.350 -1.587
235 HB2 PHE 33 HB2 PHE 33 5.003 -7.083 -0.057
236 HB3 PHE 33 HB1 PHE 33 5.442 -8.562 0.787
237 HD1 PHE 33 HD1 PHE 33 7.928 -6.111 -0.342
238 HD2 PHE 33 HD2 PHE 33 5.630 -7.536 2.939
239 HE1 PHE 33 HE1 PHE 33 9.328 -4.797 1.201
240 HE2 PHE 33 HE2 PHE 33 7.025 -6.231 4.491
241 HZ PHE 33 HZ PHE 33 8.877 -4.860 3.622
242 H ASP 34 HN ASP 34 6.560 -10.527 -0.153
243 HA ASP 34 HA ASP 34 9.066 -10.716 1.058
244 HB2 ASP 34 HB2 ASP 34 6.881 -12.227 1.117
245 HB3 ASP 34 HB1 ASP 34 7.771 -13.145 -0.094
246 H SER 35 HN SER 35 7.952 -11.554 -2.181
247 HA SER 35 HA SER 35 10.099 -12.928 -3.194
248 HB2 SER 35 HB2 SER 35 8.478 -10.799 -4.615
249 HB3 SER 35 HB1 SER 35 9.482 -12.014 -5.407
250 HG SER 35 HG SER 35 6.987 -12.251 -4.260
251 H LEU 36 HN LEU 36 9.837 -9.526 -2.487
252 HA LEU 36 HA LEU 36 12.718 -9.249 -2.894
253 HB2 LEU 36 HB2 LEU 36 12.312 -6.984 -3.931
254 HB3 LEU 36 HB1 LEU 36 11.945 -8.368 -4.940
255 HG LEU 36 HG LEU 36 9.718 -7.160 -3.382
256 HD11 LEU 36 HD11 LEU 36 10.823 -5.201 -4.289
257 HD12 LEU 36 HD12 LEU 36 9.328 -5.518 -5.171
258 HD13 LEU 36 HD13 LEU 36 10.883 -5.948 -5.886
259 HD21 LEU 36 HD21 LEU 36 9.948 -8.318 -6.158
260 HD22 LEU 36 HD22 LEU 36 8.455 -7.804 -5.372
261 HD23 LEU 36 HD23 LEU 36 9.367 -9.169 -4.728
262 H GLY 37 HN GLY 37 11.254 -9.573 -0.537
263 HA2 GLY 37 HA2 GLY 37 11.754 -6.961 0.759
264 HA3 GLY 37 HA1 GLY 37 10.423 -8.011 1.239
265 H LYS 38 HN LYS 38 11.968 -10.381 0.790
266 HA LYS 38 HA LYS 38 13.205 -10.613 3.378
267 HB2 LYS 38 HB2 LYS 38 11.980 -12.375 1.546
268 HB3 LYS 38 HB1 LYS 38 13.667 -12.865 1.628
269 HG2 LYS 38 HG2 LYS 38 12.333 -14.097 3.233
270 HG3 LYS 38 HG1 LYS 38 13.492 -13.056 4.061
271 HD2 LYS 38 HD2 LYS 38 11.710 -11.390 4.414
272 HD3 LYS 38 HD1 LYS 38 10.559 -12.477 3.632
273 HE2 LYS 38 HE2 LYS 38 10.904 -14.137 5.361
274 HE3 LYS 38 HE1 LYS 38 12.145 -13.137 6.112
275 HZ1 LYS 38 HZ1 LYS 38 10.477 -11.466 6.583
276 HZ2 LYS 38 HZ2 LYS 38 10.018 -12.950 7.253
277 HZ3 LYS 38 HZ3 LYS 38 9.282 -12.400 5.833
278 H GLY 39 HN GLY 39 14.091 -10.935 -0.003
279 HA2 GLY 39 HA2 GLY 39 16.895 -11.089 0.484
280 HA3 GLY 39 HA1 GLY 39 16.119 -10.867 -1.072
281 H THR 40 HN THR 40 14.588 -8.546 -0.148
282 HA THR 40 HA THR 40 16.423 -6.569 -0.877
283 HB THR 40 HB THR 40 13.781 -6.553 -0.918
284 HG1 THR 40 HG1 THR 40 14.876 -4.973 -1.990
285 HG21 THR 40 HG21 THR 40 12.828 -5.109 0.764
286 HG22 THR 40 HG22 THR 40 14.406 -4.887 1.520
287 HG23 THR 40 HG23 THR 40 13.618 -6.465 1.568
288 H MET 41 HN MET 41 15.439 -7.838 2.165
289 HA MET 41 HA MET 41 16.154 -5.908 3.967
290 HB2 MET 41 HB2 MET 41 16.083 -8.858 3.983
291 HB3 MET 41 HB1 MET 41 17.075 -8.122 5.231
292 HG2 MET 41 HG2 MET 41 15.152 -6.782 5.949
293 HG3 MET 41 HG1 MET 41 14.163 -7.569 4.720
294 HE1 MET 41 HE1 MET 41 12.411 -8.183 6.622
295 HE2 MET 41 HE2 MET 41 13.432 -7.458 7.864
296 HE3 MET 41 HE3 MET 41 12.816 -9.096 8.074
297 H ARG 42 HN ARG 42 18.228 -7.960 2.041
298 HA ARG 42 HA ARG 42 20.669 -7.436 3.355
299 HB2 ARG 42 HB2 ARG 42 20.496 -9.257 1.760
300 HB3 ARG 42 HB1 ARG 42 20.073 -8.144 0.473
301 HG2 ARG 42 HG2 ARG 42 22.243 -8.427 -0.031
302 HG3 ARG 42 HG1 ARG 42 22.432 -7.120 1.136
303 HD2 ARG 42 HD2 ARG 42 22.656 -10.062 1.760
304 HD3 ARG 42 HD1 ARG 42 24.019 -8.975 1.505
305 HE ARG 42 HE ARG 42 22.562 -7.812 3.506
306 HH11 ARG 42 HH11 ARG 42 24.085 -10.904 3.009
307 HH12 ARG 42 HH12 ARG 42 24.383 -11.175 4.695
308 HH21 ARG 42 HH21 ARG 42 22.944 -8.159 5.728
309 HH22 ARG 42 HH22 ARG 42 23.732 -9.614 6.240
310 H ILE 43 HN ILE 43 18.937 -5.854 0.741
311 HA ILE 43 HA ILE 43 20.860 -3.898 0.090
312 HB ILE 43 HB ILE 43 17.871 -3.583 -0.139
313 HG12 ILE 43 HG12 ILE 43 19.677 -4.917 -2.158
314 HG13 ILE 43 HG11 ILE 43 18.691 -5.805 -1.001
315 HG21 ILE 43 HG21 ILE 43 18.463 -2.267 -2.139
316 HG22 ILE 43 HG22 ILE 43 20.169 -2.498 -1.757
317 HG23 ILE 43 HG23 ILE 43 19.132 -1.591 -0.654
318 HD11 ILE 43 HD11 ILE 43 16.690 -5.094 -1.997
319 HD12 ILE 43 HD12 ILE 43 17.755 -5.536 -3.333
320 HD13 ILE 43 HD13 ILE 43 17.507 -3.837 -2.928
321 H ASN 44 HN ASN 44 17.988 -3.803 2.159
322 HA ASN 44 HA ASN 44 18.220 -1.156 3.017
323 HB2 ASN 44 HB2 ASN 44 16.863 -3.603 4.064
324 HB3 ASN 44 HB1 ASN 44 16.924 -2.163 5.080
325 HD21 ASN 44 HD21 ASN 44 15.698 -3.565 2.150
326 HD22 ASN 44 HD22 ASN 44 14.517 -2.348 1.820
327 H ARG 45 HN ARG 45 19.509 -4.146 4.419
328 HA ARG 45 HA ARG 45 20.602 -2.993 6.740
329 HB2 ARG 45 HB2 ARG 45 20.280 -5.362 6.641
330 HB3 ARG 45 HB1 ARG 45 21.273 -5.495 5.203
331 HG2 ARG 45 HG2 ARG 45 22.686 -4.329 7.462
332 HG3 ARG 45 HG1 ARG 45 22.095 -5.966 7.764
333 HD2 ARG 45 HD2 ARG 45 23.816 -6.741 6.605
334 HD3 ARG 45 HD1 ARG 45 23.116 -5.998 5.171
335 HE ARG 45 HE ARG 45 24.430 -3.936 6.067
336 HH11 ARG 45 HH11 ARG 45 25.453 -7.268 6.111
337 HH12 ARG 45 HH12 ARG 45 27.140 -6.886 6.015
338 HH21 ARG 45 HH21 ARG 45 26.654 -3.426 5.943
339 HH22 ARG 45 HH22 ARG 45 27.822 -4.706 5.919
340 H ASN 46 HN ASN 46 22.082 -3.769 3.589
341 HA ASN 46 HA ASN 46 24.653 -2.808 4.233
342 HB2 ASN 46 HB2 ASN 46 23.248 -3.067 1.562
343 HB3 ASN 46 HB1 ASN 46 24.955 -2.678 1.742
344 HD21 ASN 46 HD21 ASN 46 23.509 -4.999 0.540
345 HD22 ASN 46 HD22 ASN 46 24.210 -6.388 1.289
346 H ALA 47 HN ALA 47 21.758 -1.336 2.956
347 HA ALA 47 HA ALA 47 22.840 1.205 2.340
348 HB1 ALA 47 HB1 ALA 47 20.020 0.388 3.052
349 HB2 ALA 47 HB2 ALA 47 20.706 0.520 1.432
350 HB3 ALA 47 HB3 ALA 47 20.479 1.967 2.413
351 H TYR 48 HN TYR 48 21.320 -0.148 5.211
352 HA TYR 48 HA TYR 48 21.305 2.211 6.768
353 HB2 TYR 48 HB2 TYR 48 20.459 -0.483 7.050
354 HB3 TYR 48 HB1 TYR 48 21.511 -0.128 8.415
355 HD1 TYR 48 HD1 TYR 48 18.504 1.113 6.613
356 HD2 TYR 48 HD2 TYR 48 20.722 1.101 10.243
357 HE1 TYR 48 HE1 TYR 48 16.655 2.279 7.739
358 HE2 TYR 48 HE2 TYR 48 18.879 2.266 11.380
359 HH TYR 48 HH TYR 48 15.794 2.552 10.064
360 H GLY 49 HN GLY 49 23.766 0.008 5.894
361 HA2 GLY 49 HA2 GLY 49 25.498 0.147 8.086
362 HA3 GLY 49 HA1 GLY 49 25.994 -0.130 6.426
363 H SER 50 HN SER 50 24.398 2.765 6.446
364 HA SER 50 HA SER 50 26.397 4.482 7.534
365 HB2 SER 50 HB2 SER 50 27.626 3.768 5.539
366 HB3 SER 50 HB1 SER 50 26.261 4.229 4.516
367 HG SER 50 HG SER 50 28.235 5.773 5.570
368 H MET 51 HN MET 51 23.634 4.011 5.430
369 HA MET 51 HA MET 51 22.831 6.752 5.394
370 HB2 MET 51 HB2 MET 51 21.354 4.205 4.725
371 HB3 MET 51 HB1 MET 51 20.663 5.808 4.524
372 HG2 MET 51 HG2 MET 51 23.111 4.736 3.140
373 HG3 MET 51 HG1 MET 51 21.518 4.967 2.423
374 HE1 MET 51 HE1 MET 51 22.524 6.402 0.425
375 HE2 MET 51 HE2 MET 51 24.131 6.105 1.091
376 HE3 MET 51 HE3 MET 51 23.640 7.746 0.667
377 H GLY 52 HN GLY 52 22.445 4.145 7.610
378 HA2 GLY 52 HA2 GLY 52 20.609 5.824 9.202
379 HA3 GLY 52 HA1 GLY 52 20.368 4.089 9.057
380 H GLY 53 HN GLY 53 23.629 5.131 9.186
381 HA2 GLY 53 HA2 GLY 53 23.747 4.678 12.091
382 HA3 GLY 53 HA1 GLY 53 24.747 3.698 11.029
383 H GLY 54 HN GLY 54 25.034 6.130 9.229
384 HA2 GLY 54 HA2 GLY 54 27.017 7.553 10.897
385 HA3 GLY 54 HA1 GLY 54 27.326 7.107 9.225
386 H SER 55 HN SER 55 24.386 7.809 8.701
387 HA SER 55 HA SER 55 24.882 10.480 7.829
388 HB2 SER 55 HB2 SER 55 22.435 8.723 7.793
389 HB3 SER 55 HB1 SER 55 22.419 10.383 7.200
390 HG SER 55 HG SER 55 23.764 8.136 6.184
391 H LEU 56 HN LEU 56 22.824 9.050 10.341
392 HA LEU 56 HA LEU 56 21.735 11.538 11.198
393 HB2 LEU 56 HB2 LEU 56 21.891 8.868 12.593
394 HB3 LEU 56 HB1 LEU 56 20.972 10.241 13.178
395 HG LEU 56 HG LEU 56 20.474 8.808 10.568
396 HD11 LEU 56 HD11 LEU 56 18.991 8.727 13.190
397 HD12 LEU 56 HD12 LEU 56 19.908 7.408 12.459
398 HD13 LEU 56 HD13 LEU 56 18.438 7.997 11.682
399 HD21 LEU 56 HD21 LEU 56 19.860 11.172 10.490
400 HD22 LEU 56 HD22 LEU 56 18.907 10.978 11.961
401 HD23 LEU 56 HD23 LEU 56 18.431 10.141 10.484
402 H ARG 57 HN ARG 57 24.769 11.019 11.141
403 HA ARG 57 HA ARG 57 25.502 11.433 13.914
404 HB2 ARG 57 HB2 ARG 57 27.076 11.223 11.357
405 HB3 ARG 57 HB1 ARG 57 27.830 11.620 12.891
406 HG2 ARG 57 HG2 ARG 57 26.842 9.473 13.771
407 HG3 ARG 57 HG1 ARG 57 26.440 9.100 12.093
408 HD2 ARG 57 HD2 ARG 57 28.541 8.058 12.672
409 HD3 ARG 57 HD1 ARG 57 28.811 9.340 11.492
410 HE ARG 57 HE ARG 57 29.137 10.265 14.168
411 HH11 ARG 57 HH11 ARG 57 30.711 8.524 11.592
412 HH12 ARG 57 HH12 ARG 57 32.310 8.911 12.132
413 HH21 ARG 57 HH21 ARG 57 31.241 10.782 14.885
414 HH22 ARG 57 HH22 ARG 57 32.611 10.196 14.002
415 H GLY 58 HN GLY 58 23.816 13.419 12.621
416 HA2 GLY 58 HA2 GLY 58 25.652 15.737 12.637
417 HA3 GLY 58 HA1 GLY 58 24.145 15.683 11.735
418 H SER 59 HN SER 59 22.596 14.479 13.852
419 HA SER 59 HA SER 59 22.118 16.887 15.408
420 HB2 SER 59 HB2 SER 59 20.198 15.796 14.364
421 HB3 SER 59 HB1 SER 59 20.556 14.299 15.224
422 HG SER 59 HG SER 59 18.920 15.932 16.096
Start of MODEL 8
1 H1 MET 1 HT1 MET 1 -31.575 7.182 1.630
2 H2 MET 1 HT2 MET 1 -31.647 8.713 2.343
3 H3 MET 1 HT3 MET 1 -31.474 8.570 0.667
4 HA MET 1 HA MET 1 -33.649 7.582 0.476
5 HB2 MET 1 HB2 MET 1 -35.128 7.536 2.454
6 HB3 MET 1 HB1 MET 1 -33.737 6.477 2.638
7 HG2 MET 1 HG2 MET 1 -32.653 8.062 4.079
8 HG3 MET 1 HG1 MET 1 -33.930 9.244 3.800
9 HE1 MET 1 HE1 MET 1 -36.559 7.545 3.892
10 HE2 MET 1 HE2 MET 1 -36.370 9.063 4.770
11 HE3 MET 1 HE3 MET 1 -36.987 7.635 5.601
12 H SER 2 HN SER 2 -32.066 10.302 1.161
13 HA SER 2 HA SER 2 -34.343 11.966 0.431
14 HB2 SER 2 HB2 SER 2 -32.594 12.577 2.825
15 HB3 SER 2 HB1 SER 2 -33.837 13.641 2.167
16 HG SER 2 HG SER 2 -34.312 11.021 3.149
17 H GLY 3 HN GLY 3 -31.611 10.951 -0.565
18 HA2 GLY 3 HA2 GLY 3 -30.811 12.428 -2.485
19 HA3 GLY 3 HA1 GLY 3 -30.442 13.581 -1.211
20 H GLY 4 HN GLY 4 -29.055 12.546 0.618
21 HA2 GLY 4 HA2 GLY 4 -26.815 11.234 -0.720
22 HA3 GLY 4 HA1 GLY 4 -26.691 12.205 0.731
23 H GLY 5 HN GLY 5 -29.350 10.422 1.264
24 HA2 GLY 5 HA2 GLY 5 -28.167 8.793 3.218
25 HA3 GLY 5 HA1 GLY 5 -29.785 8.574 2.562
26 H VAL 6 HN VAL 6 -29.680 7.725 0.185
27 HA VAL 6 HA VAL 6 -28.655 5.113 0.276
28 HB VAL 6 HB VAL 6 -30.577 5.658 -1.077
29 HG11 VAL 6 HG11 VAL 6 -30.461 6.978 -3.074
30 HG12 VAL 6 HG12 VAL 6 -28.724 7.198 -2.868
31 HG13 VAL 6 HG13 VAL 6 -29.846 7.924 -1.719
32 HG21 VAL 6 HG21 VAL 6 -29.952 4.499 -3.147
33 HG22 VAL 6 HG22 VAL 6 -29.258 3.722 -1.723
34 HG23 VAL 6 HG23 VAL 6 -28.249 4.741 -2.750
35 H PHE 7 HN PHE 7 -27.563 8.011 -1.389
36 HA PHE 7 HA PHE 7 -25.467 6.921 -2.870
37 HB2 PHE 7 HB2 PHE 7 -26.399 9.259 -3.046
38 HB3 PHE 7 HB1 PHE 7 -25.448 9.672 -1.624
39 HD1 PHE 7 HD1 PHE 7 -22.967 9.536 -1.737
40 HD2 PHE 7 HD2 PHE 7 -25.426 9.147 -5.183
41 HE1 PHE 7 HE1 PHE 7 -21.023 10.013 -3.171
42 HE2 PHE 7 HE2 PHE 7 -23.490 9.618 -6.626
43 HZ PHE 7 HZ PHE 7 -21.284 10.053 -5.620
44 H THR 8 HN THR 8 -25.454 8.172 0.463
45 HA THR 8 HA THR 8 -22.670 7.799 0.855
46 HB THR 8 HB THR 8 -24.828 7.775 2.960
47 HG1 THR 8 HG1 THR 8 -23.600 10.052 3.034
48 HG21 THR 8 HG21 THR 8 -23.020 8.457 4.486
49 HG22 THR 8 HG22 THR 8 -21.861 8.267 3.170
50 HG23 THR 8 HG23 THR 8 -22.731 6.864 3.787
51 H ASP 9 HN ASP 9 -25.438 5.686 1.070
52 HA ASP 9 HA ASP 9 -24.177 3.544 2.458
53 HB2 ASP 9 HB2 ASP 9 -26.750 4.080 1.391
54 HB3 ASP 9 HB1 ASP 9 -26.181 2.598 0.631
55 H ILE 10 HN ILE 10 -24.598 4.517 -0.853
56 HA ILE 10 HA ILE 10 -23.407 2.320 -2.138
57 HB ILE 10 HB ILE 10 -23.687 5.236 -2.854
58 HG12 ILE 10 HG12 ILE 10 -25.103 2.773 -3.861
59 HG13 ILE 10 HG11 ILE 10 -25.743 3.896 -2.673
60 HG21 ILE 10 HG21 ILE 10 -21.756 4.428 -4.045
61 HG22 ILE 10 HG22 ILE 10 -23.105 4.613 -5.165
62 HG23 ILE 10 HG23 ILE 10 -22.647 3.008 -4.594
63 HD11 ILE 10 HD11 ILE 10 -25.083 4.551 -5.532
64 HD12 ILE 10 HD12 ILE 10 -25.723 5.674 -4.333
65 HD13 ILE 10 HD13 ILE 10 -26.696 4.302 -4.863
66 H LEU 11 HN LEU 11 -22.248 5.309 -0.792
67 HA LEU 11 HA LEU 11 -19.518 5.076 -1.486
68 HB2 LEU 11 HB2 LEU 11 -21.063 6.655 0.549
69 HB3 LEU 11 HB1 LEU 11 -19.316 6.720 0.512
70 HG LEU 11 HG LEU 11 -21.118 7.469 -1.791
71 HD11 LEU 11 HD11 LEU 11 -21.367 9.024 0.061
72 HD12 LEU 11 HD12 LEU 11 -20.488 9.776 -1.270
73 HD13 LEU 11 HD13 LEU 11 -19.618 9.214 0.158
74 HD21 LEU 11 HD21 LEU 11 -18.918 6.676 -2.499
75 HD22 LEU 11 HD22 LEU 11 -18.145 7.820 -1.402
76 HD23 LEU 11 HD23 LEU 11 -19.087 8.411 -2.771
77 H ALA 12 HN ALA 12 -21.466 4.094 1.214
78 HA ALA 12 HA ALA 12 -19.371 3.274 2.937
79 HB1 ALA 12 HB1 ALA 12 -22.274 2.446 2.836
80 HB2 ALA 12 HB2 ALA 12 -21.585 3.749 3.805
81 HB3 ALA 12 HB3 ALA 12 -21.160 2.071 4.153
82 H ALA 13 HN ALA 13 -21.449 1.594 0.650
83 HA ALA 13 HA ALA 13 -20.411 -0.989 1.055
84 HB1 ALA 13 HB1 ALA 13 -21.587 -0.004 -1.532
85 HB2 ALA 13 HB2 ALA 13 -22.581 -0.301 -0.106
86 HB3 ALA 13 HB3 ALA 13 -21.663 -1.623 -0.834
87 H ALA 14 HN ALA 14 -19.782 1.369 -1.560
88 HA ALA 14 HA ALA 14 -17.747 -0.012 -2.844
89 HB1 ALA 14 HB1 ALA 14 -17.031 2.126 -3.750
90 HB2 ALA 14 HB2 ALA 14 -17.989 2.976 -2.538
91 HB3 ALA 14 HB3 ALA 14 -18.792 2.002 -3.772
92 H GLY 15 HN GLY 15 -17.551 2.321 -0.179
93 HA2 GLY 15 HA2 GLY 15 -14.768 2.383 0.066
94 HA3 GLY 15 HA1 GLY 15 -15.906 2.682 1.379
95 H ARG 16 HN ARG 16 -17.204 0.251 1.422
96 HA ARG 16 HA ARG 16 -15.432 -1.348 2.951
97 HB2 ARG 16 HB2 ARG 16 -18.269 -1.567 2.020
98 HB3 ARG 16 HB1 ARG 16 -17.486 -2.949 2.756
99 HG2 ARG 16 HG2 ARG 16 -17.444 -0.309 4.135
100 HG3 ARG 16 HG1 ARG 16 -18.893 -1.314 4.196
101 HD2 ARG 16 HD2 ARG 16 -17.918 -2.879 5.501
102 HD3 ARG 16 HD1 ARG 16 -16.324 -2.653 4.779
103 HE ARG 16 HE ARG 16 -16.470 -0.425 6.104
104 HH11 ARG 16 HH11 ARG 16 -17.608 -3.552 7.136
105 HH12 ARG 16 HH12 ARG 16 -17.375 -3.225 8.820
106 HH21 ARG 16 HH21 ARG 16 -16.160 0.014 8.324
107 HH22 ARG 16 HH22 ARG 16 -16.551 -1.201 9.494
108 H ILE 17 HN ILE 17 -16.609 -1.377 -0.342
109 HA ILE 17 HA ILE 17 -15.885 -4.062 -0.984
110 HB ILE 17 HB ILE 17 -16.414 -1.595 -2.649
111 HG12 ILE 17 HG12 ILE 17 -17.948 -4.013 -1.830
112 HG13 ILE 17 HG11 ILE 17 -18.456 -2.340 -1.916
113 HG21 ILE 17 HG21 ILE 17 -16.277 -2.962 -4.648
114 HG22 ILE 17 HG22 ILE 17 -15.794 -4.356 -3.682
115 HG23 ILE 17 HG23 ILE 17 -14.735 -2.949 -3.791
116 HD11 ILE 17 HD11 ILE 17 -18.508 -2.516 -4.377
117 HD12 ILE 17 HD12 ILE 17 -19.635 -3.603 -3.566
118 HD13 ILE 17 HD13 ILE 17 -18.126 -4.231 -4.224
119 H PHE 18 HN PHE 18 -14.636 -0.975 -1.907
120 HA PHE 18 HA PHE 18 -12.195 -1.626 -2.951
121 HB2 PHE 18 HB2 PHE 18 -13.147 0.557 -3.131
122 HB3 PHE 18 HB1 PHE 18 -13.165 0.769 -1.398
123 HD1 PHE 18 HD1 PHE 18 -11.158 1.189 -0.182
124 HD2 PHE 18 HD2 PHE 18 -11.140 0.979 -4.419
125 HE1 PHE 18 HE1 PHE 18 -8.969 2.336 -0.219
126 HE2 PHE 18 HE2 PHE 18 -8.953 2.112 -4.479
127 HZ PHE 18 HZ PHE 18 -7.866 2.794 -2.375
128 H GLU 19 HN GLU 19 -13.131 -1.044 0.400
129 HA GLU 19 HA GLU 19 -10.549 -1.087 1.505
130 HB2 GLU 19 HB2 GLU 19 -13.280 -1.126 2.497
131 HB3 GLU 19 HB1 GLU 19 -12.211 -2.107 3.482
132 HG2 GLU 19 HG2 GLU 19 -10.718 -0.191 3.766
133 HG3 GLU 19 HG1 GLU 19 -11.800 0.791 2.779
134 H VAL 20 HN VAL 20 -12.997 -3.660 1.364
135 HA VAL 20 HA VAL 20 -11.275 -5.642 2.443
136 HB VAL 20 HB VAL 20 -12.884 -7.290 1.652
137 HG11 VAL 20 HG11 VAL 20 -14.252 -4.808 2.704
138 HG12 VAL 20 HG12 VAL 20 -13.460 -6.056 3.670
139 HG13 VAL 20 HG13 VAL 20 -14.912 -6.443 2.747
140 HG21 VAL 20 HG21 VAL 20 -14.746 -6.738 0.240
141 HG22 VAL 20 HG22 VAL 20 -13.256 -6.255 -0.572
142 HG23 VAL 20 HG23 VAL 20 -14.268 -5.041 0.208
143 H MET 21 HN MET 21 -11.732 -4.228 -0.632
144 HA MET 21 HA MET 21 -10.415 -6.185 -2.234
145 HB2 MET 21 HB2 MET 21 -11.177 -3.288 -2.602
146 HB3 MET 21 HB1 MET 21 -10.242 -4.153 -3.822
147 HG2 MET 21 HG2 MET 21 -12.715 -5.472 -2.908
148 HG3 MET 21 HG1 MET 21 -12.927 -3.987 -3.834
149 HE1 MET 21 HE1 MET 21 -14.051 -6.847 -4.808
150 HE2 MET 21 HE2 MET 21 -13.655 -6.719 -6.522
151 HE3 MET 21 HE3 MET 21 -14.267 -5.312 -5.650
152 H VAL 22 HN VAL 22 -9.580 -3.434 -0.313
153 HA VAL 22 HA VAL 22 -6.931 -3.148 -1.292
154 HB VAL 22 HB VAL 22 -8.437 -1.939 0.988
155 HG11 VAL 22 HG11 VAL 22 -6.414 -0.638 1.573
156 HG12 VAL 22 HG12 VAL 22 -5.468 -1.677 0.507
157 HG13 VAL 22 HG13 VAL 22 -6.246 -2.355 1.937
158 HG21 VAL 22 HG21 VAL 22 -7.276 -1.086 -1.613
159 HG22 VAL 22 HG22 VAL 22 -7.451 0.109 -0.327
160 HG23 VAL 22 HG23 VAL 22 -8.867 -0.753 -0.931
161 H GLU 23 HN GLU 23 -8.394 -4.571 1.614
162 HA GLU 23 HA GLU 23 -6.024 -5.350 2.864
163 HB2 GLU 23 HB2 GLU 23 -8.629 -6.863 2.973
164 HB3 GLU 23 HB1 GLU 23 -7.368 -6.799 4.195
165 HG2 GLU 23 HG2 GLU 23 -8.989 -4.431 3.336
166 HG3 GLU 23 HG1 GLU 23 -9.391 -5.451 4.718
167 H GLY 24 HN GLY 24 -8.143 -7.013 0.594
168 HA2 GLY 24 HA2 GLY 24 -6.696 -9.414 0.412
169 HA3 GLY 24 HA1 GLY 24 -7.735 -8.755 -0.854
170 H HIS 25 HN HIS 25 -6.309 -6.267 -1.125
171 HA HIS 25 HA HIS 25 -4.350 -7.054 -3.022
172 HB2 HIS 25 HB2 HIS 25 -5.565 -4.850 -3.057
173 HB3 HIS 25 HB1 HIS 25 -4.597 -4.359 -1.668
174 HD1 HIS 25 HD1 HIS 25 -3.983 -5.575 -5.223
175 HD2 HIS 25 HD2 HIS 25 -2.326 -3.078 -2.346
176 HE1 HIS 25 HE1 HIS 25 -1.996 -4.500 -6.328
177 HE2 HIS 25 HE2 HIS 25 -0.963 -3.055 -4.543
178 H TRP 26 HN TRP 26 -4.273 -6.011 0.317
179 HA TRP 26 HA TRP 26 -1.439 -5.959 0.549
180 HB2 TRP 26 HB2 TRP 26 -3.814 -5.554 2.271
181 HB3 TRP 26 HB1 TRP 26 -2.345 -6.067 3.069
182 HD1 TRP 26 HD1 TRP 26 -4.026 -3.041 1.701
183 HE1 TRP 26 HE1 TRP 26 -2.461 -1.004 1.892
184 HE3 TRP 26 HE3 TRP 26 0.299 -5.474 2.846
185 HZ2 TRP 26 HZ2 TRP 26 0.265 -0.502 2.465
186 HZ3 TRP 26 HZ3 TRP 26 2.336 -4.158 3.208
187 HH2 TRP 26 HH2 TRP 26 2.329 -1.721 3.016
188 H GLU 27 HN GLU 27 -3.841 -8.378 0.610
189 HA GLU 27 HA GLU 27 -2.413 -10.192 2.273
190 HB2 GLU 27 HB2 GLU 27 -4.705 -10.477 0.343
191 HB3 GLU 27 HB1 GLU 27 -3.979 -11.882 1.100
192 HG2 GLU 27 HG2 GLU 27 -5.169 -9.559 2.590
193 HG3 GLU 27 HG1 GLU 27 -6.007 -11.070 2.247
194 H THR 28 HN THR 28 -2.670 -9.573 -1.143
195 HA THR 28 HA THR 28 -0.972 -11.766 -1.872
196 HB THR 28 HB THR 28 -2.785 -10.529 -3.327
197 HG1 THR 28 HG1 THR 28 -1.899 -11.614 -5.001
198 HG21 THR 28 HG21 THR 28 -1.602 -8.344 -3.231
199 HG22 THR 28 HG22 THR 28 -1.860 -8.927 -4.875
200 HG23 THR 28 HG23 THR 28 -0.267 -9.071 -4.126
201 H VAL 29 HN VAL 29 -0.486 -8.481 -0.867
202 HA VAL 29 HA VAL 29 1.950 -8.030 -2.152
203 HB VAL 29 HB VAL 29 2.503 -6.372 -0.474
204 HG11 VAL 29 HG11 VAL 29 0.810 -6.004 -2.333
205 HG12 VAL 29 HG12 VAL 29 0.838 -4.840 -1.007
206 HG13 VAL 29 HG13 VAL 29 -0.415 -6.080 -1.063
207 HG21 VAL 29 HG21 VAL 29 0.186 -6.331 1.112
208 HG22 VAL 29 HG22 VAL 29 1.856 -6.577 1.608
209 HG23 VAL 29 HG23 VAL 29 0.852 -7.958 1.171
210 H GLY 30 HN GLY 30 1.154 -9.729 0.774
211 HA2 GLY 30 HA2 GLY 30 3.631 -10.106 1.911
212 HA3 GLY 30 HA1 GLY 30 2.402 -11.370 1.862
213 H MET 31 HN MET 31 2.710 -10.874 -1.212
214 HA MET 31 HA MET 31 4.811 -12.858 -1.642
215 HB2 MET 31 HB2 MET 31 2.643 -11.826 -3.475
216 HB3 MET 31 HB1 MET 31 3.769 -13.110 -3.858
217 HG2 MET 31 HG2 MET 31 1.561 -13.127 -1.828
218 HG3 MET 31 HG1 MET 31 1.729 -14.121 -3.270
219 HE1 MET 31 HE1 MET 31 2.056 -16.751 -0.394
220 HE2 MET 31 HE2 MET 31 1.119 -16.208 -1.786
221 HE3 MET 31 HE3 MET 31 1.083 -15.284 -0.285
222 H LEU 32 HN LEU 32 3.523 -10.101 -3.507
223 HA LEU 32 HA LEU 32 5.865 -9.624 -4.953
224 HB2 LEU 32 HB2 LEU 32 4.869 -7.559 -5.658
225 HB3 LEU 32 HB1 LEU 32 3.645 -8.809 -5.622
226 HG LEU 32 HG LEU 32 3.250 -7.766 -3.190
227 HD11 LEU 32 HD11 LEU 32 3.407 -5.326 -3.314
228 HD12 LEU 32 HD12 LEU 32 4.230 -5.463 -4.867
229 HD13 LEU 32 HD13 LEU 32 4.996 -6.086 -3.407
230 HD21 LEU 32 HD21 LEU 32 1.413 -6.492 -4.179
231 HD22 LEU 32 HD22 LEU 32 1.562 -8.088 -4.916
232 HD23 LEU 32 HD23 LEU 32 2.153 -6.663 -5.770
233 H PHE 33 HN PHE 33 4.692 -8.261 -1.956
234 HA PHE 33 HA PHE 33 6.697 -6.294 -1.632
235 HB2 PHE 33 HB2 PHE 33 4.607 -6.194 -0.360
236 HB3 PHE 33 HB1 PHE 33 4.991 -7.714 0.438
237 HD1 PHE 33 HD1 PHE 33 7.587 -5.191 -0.121
238 HD2 PHE 33 HD2 PHE 33 4.739 -6.746 2.629
239 HE1 PHE 33 HE1 PHE 33 8.674 -3.946 1.701
240 HE2 PHE 33 HE2 PHE 33 5.824 -5.510 4.458
241 HZ PHE 33 HZ PHE 33 7.794 -4.107 3.995
242 H ASP 34 HN ASP 34 6.415 -9.667 -0.772
243 HA ASP 34 HA ASP 34 8.620 -9.895 0.925
244 HB2 ASP 34 HB2 ASP 34 6.680 -11.571 0.021
245 HB3 ASP 34 HB1 ASP 34 8.077 -12.181 -0.860
246 H SER 35 HN SER 35 8.349 -9.878 -2.565
247 HA SER 35 HA SER 35 10.888 -10.858 -3.226
248 HB2 SER 35 HB2 SER 35 9.206 -8.811 -4.698
249 HB3 SER 35 HB1 SER 35 10.573 -9.691 -5.382
250 HG SER 35 HG SER 35 8.848 -10.875 -5.966
251 H LEU 36 HN LEU 36 9.825 -7.783 -2.035
252 HA LEU 36 HA LEU 36 12.618 -6.918 -1.890
253 HB2 LEU 36 HB2 LEU 36 11.967 -4.612 -2.515
254 HB3 LEU 36 HB1 LEU 36 11.778 -5.761 -3.825
255 HG LEU 36 HG LEU 36 9.403 -5.113 -2.138
256 HD11 LEU 36 HD11 LEU 36 10.434 -3.373 -4.375
257 HD12 LEU 36 HD12 LEU 36 10.378 -2.934 -2.668
258 HD13 LEU 36 HD13 LEU 36 8.880 -3.202 -3.559
259 HD21 LEU 36 HD21 LEU 36 9.765 -5.700 -5.074
260 HD22 LEU 36 HD22 LEU 36 8.228 -5.516 -4.229
261 HD23 LEU 36 HD23 LEU 36 9.290 -6.872 -3.846
262 H GLY 37 HN GLY 37 10.882 -8.048 0.064
263 HA2 GLY 37 HA2 GLY 37 10.850 -5.802 1.989
264 HA3 GLY 37 HA1 GLY 37 9.596 -7.042 1.979
265 H LYS 38 HN LYS 38 11.292 -9.169 1.346
266 HA LYS 38 HA LYS 38 12.292 -9.834 3.967
267 HB2 LYS 38 HB2 LYS 38 11.359 -11.265 1.689
268 HB3 LYS 38 HB1 LYS 38 13.025 -11.752 1.963
269 HG2 LYS 38 HG2 LYS 38 11.533 -13.247 3.120
270 HG3 LYS 38 HG1 LYS 38 12.452 -12.304 4.295
271 HD2 LYS 38 HD2 LYS 38 10.568 -10.841 4.663
272 HD3 LYS 38 HD1 LYS 38 9.653 -11.641 3.384
273 HE2 LYS 38 HE2 LYS 38 9.649 -13.713 4.665
274 HE3 LYS 38 HE1 LYS 38 10.608 -12.947 5.931
275 HZ1 LYS 38 HZ1 LYS 38 8.234 -13.033 6.467
276 HZ2 LYS 38 HZ2 LYS 38 7.885 -12.089 5.108
277 HZ3 LYS 38 HZ3 LYS 38 8.798 -11.442 6.376
278 H GLY 39 HN GLY 39 13.509 -9.593 0.676
279 HA2 GLY 39 HA2 GLY 39 16.255 -9.758 1.416
280 HA3 GLY 39 HA1 GLY 39 15.626 -9.315 -0.159
281 H THR 40 HN THR 40 13.941 -7.183 0.958
282 HA THR 40 HA THR 40 15.795 -5.108 0.717
283 HB THR 40 HB THR 40 13.207 -5.067 0.343
284 HG1 THR 40 HG1 THR 40 14.036 -3.206 -0.259
285 HG21 THR 40 HG21 THR 40 11.978 -3.988 2.114
286 HG22 THR 40 HG22 THR 40 13.427 -3.903 3.116
287 HG23 THR 40 HG23 THR 40 12.701 -5.465 2.749
288 H MET 41 HN MET 41 14.431 -6.726 3.453
289 HA MET 41 HA MET 41 14.967 -5.085 5.553
290 HB2 MET 41 HB2 MET 41 14.951 -8.024 5.174
291 HB3 MET 41 HB1 MET 41 15.706 -7.428 6.641
292 HG2 MET 41 HG2 MET 41 13.676 -6.293 7.277
293 HG3 MET 41 HG1 MET 41 12.913 -6.754 5.756
294 HE1 MET 41 HE1 MET 41 14.414 -8.028 9.133
295 HE2 MET 41 HE2 MET 41 15.272 -9.039 7.969
296 HE3 MET 41 HE3 MET 41 14.087 -9.759 9.060
297 H ARG 42 HN ARG 42 17.250 -7.038 3.725
298 HA ARG 42 HA ARG 42 19.496 -6.487 5.392
299 HB2 ARG 42 HB2 ARG 42 19.570 -8.438 3.993
300 HB3 ARG 42 HB1 ARG 42 19.275 -7.481 2.550
301 HG2 ARG 42 HG2 ARG 42 21.433 -6.515 2.641
302 HG3 ARG 42 HG1 ARG 42 21.720 -7.167 4.256
303 HD2 ARG 42 HD2 ARG 42 21.153 -8.995 1.958
304 HD3 ARG 42 HD1 ARG 42 22.776 -8.348 2.204
305 HE ARG 42 HE ARG 42 22.216 -9.331 4.622
306 HH11 ARG 42 HH11 ARG 42 21.861 -10.709 1.440
307 HH12 ARG 42 HH12 ARG 42 22.100 -12.337 1.977
308 HH21 ARG 42 HH21 ARG 42 22.529 -11.474 5.338
309 HH22 ARG 42 HH22 ARG 42 22.479 -12.772 4.193
310 H ILE 43 HN ILE 43 18.091 -5.019 2.530
311 HA ILE 43 HA ILE 43 20.170 -3.197 1.953
312 HB ILE 43 HB ILE 43 17.235 -2.740 1.443
313 HG12 ILE 43 HG12 ILE 43 19.178 -4.326 -0.251
314 HG13 ILE 43 HG11 ILE 43 17.865 -5.008 0.706
315 HG21 ILE 43 HG21 ILE 43 18.704 -0.847 0.997
316 HG22 ILE 43 HG22 ILE 43 18.036 -1.495 -0.500
317 HG23 ILE 43 HG23 ILE 43 19.701 -1.857 -0.049
318 HD11 ILE 43 HD11 ILE 43 17.499 -3.086 -1.581
319 HD12 ILE 43 HD12 ILE 43 16.229 -3.908 -0.672
320 HD13 ILE 43 HD13 ILE 43 17.331 -4.839 -1.686
321 H ASN 44 HN ASN 44 17.130 -2.846 3.732
322 HA ASN 44 HA ASN 44 17.433 -0.186 4.508
323 HB2 ASN 44 HB2 ASN 44 15.829 -2.510 5.503
324 HB3 ASN 44 HB1 ASN 44 15.861 -1.017 6.446
325 HD21 ASN 44 HD21 ASN 44 14.862 -2.531 3.491
326 HD22 ASN 44 HD22 ASN 44 13.808 -1.269 2.959
327 H ARG 45 HN ARG 45 18.251 -3.171 6.277
328 HA ARG 45 HA ARG 45 19.230 -1.924 8.593
329 HB2 ARG 45 HB2 ARG 45 19.526 -4.604 7.349
330 HB3 ARG 45 HB1 ARG 45 20.689 -4.160 8.588
331 HG2 ARG 45 HG2 ARG 45 18.891 -3.770 10.169
332 HG3 ARG 45 HG1 ARG 45 17.697 -4.149 8.925
333 HD2 ARG 45 HD2 ARG 45 18.113 -6.042 10.449
334 HD3 ARG 45 HD1 ARG 45 18.517 -6.417 8.775
335 HE ARG 45 HE ARG 45 20.888 -5.646 9.744
336 HH11 ARG 45 HH11 ARG 45 18.488 -7.837 11.000
337 HH12 ARG 45 HH12 ARG 45 19.641 -8.836 11.819
338 HH21 ARG 45 HH21 ARG 45 22.414 -6.958 10.819
339 HH22 ARG 45 HH22 ARG 45 21.872 -8.337 11.715
340 H ASN 46 HN ASN 46 21.005 -3.106 5.734
341 HA ASN 46 HA ASN 46 23.532 -2.255 6.636
342 HB2 ASN 46 HB2 ASN 46 22.459 -2.774 3.857
343 HB3 ASN 46 HB1 ASN 46 24.144 -2.372 4.174
344 HD21 ASN 46 HD21 ASN 46 22.783 -4.826 3.129
345 HD22 ASN 46 HD22 ASN 46 23.375 -6.109 4.118
346 H ALA 47 HN ALA 47 20.929 -0.707 4.906
347 HA ALA 47 HA ALA 47 22.301 1.670 4.190
348 HB1 ALA 47 HB1 ALA 47 20.039 2.634 3.912
349 HB2 ALA 47 HB2 ALA 47 19.354 1.182 4.644
350 HB3 ALA 47 HB3 ALA 47 20.215 1.074 3.108
351 H TYR 48 HN TYR 48 20.423 0.684 6.989
352 HA TYR 48 HA TYR 48 20.358 3.153 8.337
353 HB2 TYR 48 HB2 TYR 48 19.342 0.597 8.756
354 HB3 TYR 48 HB1 TYR 48 20.453 0.835 10.100
355 HD1 TYR 48 HD1 TYR 48 17.497 2.283 8.396
356 HD2 TYR 48 HD2 TYR 48 19.881 2.222 11.919
357 HE1 TYR 48 HE1 TYR 48 15.795 3.621 9.562
358 HE2 TYR 48 HE2 TYR 48 18.185 3.558 13.096
359 HH TYR 48 HH TYR 48 15.063 4.078 11.851
360 H GLY 49 HN GLY 49 22.782 0.738 7.954
361 HA2 GLY 49 HA2 GLY 49 24.386 1.182 10.199
362 HA3 GLY 49 HA1 GLY 49 24.967 0.607 8.645
363 H SER 50 HN SER 50 23.513 3.539 8.116
364 HA SER 50 HA SER 50 25.588 5.303 8.990
365 HB2 SER 50 HB2 SER 50 25.440 4.570 6.054
366 HB3 SER 50 HB1 SER 50 26.336 5.953 6.691
367 HG SER 50 HG SER 50 27.734 4.591 7.694
368 H MET 51 HN MET 51 22.902 4.719 6.791
369 HA MET 51 HA MET 51 22.178 7.463 6.499
370 HB2 MET 51 HB2 MET 51 20.602 4.932 6.001
371 HB3 MET 51 HB1 MET 51 20.080 6.541 5.527
372 HG2 MET 51 HG2 MET 51 22.068 6.736 4.093
373 HG3 MET 51 HG1 MET 51 22.522 5.091 4.535
374 HE1 MET 51 HE1 MET 51 22.271 6.005 1.548
375 HE2 MET 51 HE2 MET 51 21.355 4.680 0.826
376 HE3 MET 51 HE3 MET 51 22.633 4.337 1.993
377 H GLY 52 HN GLY 52 21.441 4.931 8.759
378 HA2 GLY 52 HA2 GLY 52 19.347 6.565 10.017
379 HA3 GLY 52 HA1 GLY 52 19.663 4.867 10.347
380 H GLY 53 HN GLY 53 22.638 5.791 10.323
381 HA2 GLY 53 HA2 GLY 53 22.916 5.920 13.144
382 HA3 GLY 53 HA1 GLY 53 24.198 6.157 11.964
383 H GLY 54 HN GLY 54 22.820 8.328 10.617
384 HA2 GLY 54 HA2 GLY 54 22.339 10.423 12.510
385 HA3 GLY 54 HA1 GLY 54 23.946 10.530 11.801
386 H SER 55 HN SER 55 20.906 9.477 10.337
387 HA SER 55 HA SER 55 19.925 10.046 8.363
388 HB2 SER 55 HB2 SER 55 19.229 12.353 8.227
389 HB3 SER 55 HB1 SER 55 19.135 11.758 9.873
390 HG SER 55 HG SER 55 21.445 13.083 9.025
391 H LEU 56 HN LEU 56 22.348 9.344 7.919
392 HA LEU 56 HA LEU 56 24.220 9.547 6.636
393 HB2 LEU 56 HB2 LEU 56 23.644 10.099 4.229
394 HB3 LEU 56 HB1 LEU 56 22.858 8.718 4.979
395 HG LEU 56 HG LEU 56 21.539 11.335 5.133
396 HD11 LEU 56 HD11 LEU 56 22.194 11.218 2.786
397 HD12 LEU 56 HD12 LEU 56 20.454 10.984 2.953
398 HD13 LEU 56 HD13 LEU 56 21.506 9.598 2.667
399 HD21 LEU 56 HD21 LEU 56 20.810 9.126 6.197
400 HD22 LEU 56 HD22 LEU 56 20.301 8.674 4.567
401 HD23 LEU 56 HD23 LEU 56 19.592 10.086 5.354
402 H ARG 57 HN ARG 57 23.725 11.960 8.194
403 HA ARG 57 HA ARG 57 24.482 14.161 6.489
404 HB2 ARG 57 HB2 ARG 57 24.009 13.853 9.435
405 HB3 ARG 57 HB1 ARG 57 24.725 15.316 8.791
406 HG2 ARG 57 HG2 ARG 57 22.096 14.211 7.860
407 HG3 ARG 57 HG1 ARG 57 22.255 15.379 9.174
408 HD2 ARG 57 HD2 ARG 57 23.493 15.883 6.505
409 HD3 ARG 57 HD1 ARG 57 21.790 16.242 6.788
410 HE ARG 57 HE ARG 57 23.383 17.394 8.817
411 HH11 ARG 57 HH11 ARG 57 22.559 17.788 5.453
412 HH12 ARG 57 HH12 ARG 57 22.837 19.497 5.454
413 HH21 ARG 57 HH21 ARG 57 23.750 19.642 8.825
414 HH22 ARG 57 HH22 ARG 57 23.519 20.550 7.368
415 H GLY 58 HN GLY 58 26.401 12.638 5.854
416 HA2 GLY 58 HA2 GLY 58 28.750 13.803 7.047
417 HA3 GLY 58 HA1 GLY 58 28.588 12.084 7.373
418 H SER 59 HN SER 59 27.326 11.511 4.809
419 HA SER 59 HA SER 59 29.741 11.642 3.144
420 HB2 SER 59 HB2 SER 59 28.742 9.706 1.927
421 HB3 SER 59 HB1 SER 59 29.029 9.376 3.635
422 HG SER 59 HG SER 59 27.000 8.692 3.341
Start of MODEL 9
1 H1 MET 1 HT1 MET 1 -33.412 10.204 6.543
2 H2 MET 1 HT2 MET 1 -31.914 10.148 7.326
3 H3 MET 1 HT3 MET 1 -32.317 8.964 6.188
4 HA MET 1 HA MET 1 -31.911 11.844 5.632
5 HB2 MET 1 HB2 MET 1 -30.210 9.406 5.117
6 HB3 MET 1 HB1 MET 1 -29.967 10.928 4.270
7 HG2 MET 1 HG2 MET 1 -29.571 12.048 6.407
8 HG3 MET 1 HG1 MET 1 -29.795 10.514 7.247
9 HE1 MET 1 HE1 MET 1 -27.151 12.472 7.447
10 HE2 MET 1 HE2 MET 1 -25.936 11.200 7.560
11 HE3 MET 1 HE3 MET 1 -27.466 11.037 8.422
12 H SER 2 HN SER 2 -32.139 12.471 3.477
13 HA SER 2 HA SER 2 -33.409 10.525 1.675
14 HB2 SER 2 HB2 SER 2 -35.000 12.287 0.947
15 HB3 SER 2 HB1 SER 2 -35.206 11.860 2.646
16 HG SER 2 HG SER 2 -34.739 13.836 3.154
17 H GLY 3 HN GLY 3 -32.277 10.379 -0.136
18 HA2 GLY 3 HA2 GLY 3 -31.501 11.414 -2.172
19 HA3 GLY 3 HA1 GLY 3 -31.033 12.820 -1.226
20 H GLY 4 HN GLY 4 -29.217 12.564 0.272
21 HA2 GLY 4 HA2 GLY 4 -27.091 11.103 -0.970
22 HA3 GLY 4 HA1 GLY 4 -26.952 12.129 0.442
23 H GLY 5 HN GLY 5 -29.426 10.224 1.238
24 HA2 GLY 5 HA2 GLY 5 -27.997 8.706 3.114
25 HA3 GLY 5 HA1 GLY 5 -29.654 8.392 2.610
26 H VAL 6 HN VAL 6 -29.596 7.608 0.136
27 HA VAL 6 HA VAL 6 -28.526 5.003 0.200
28 HB VAL 6 HB VAL 6 -30.499 5.521 -1.100
29 HG11 VAL 6 HG11 VAL 6 -30.480 6.846 -3.074
30 HG12 VAL 6 HG12 VAL 6 -28.729 7.035 -2.990
31 HG13 VAL 6 HG13 VAL 6 -29.756 7.794 -1.776
32 HG21 VAL 6 HG21 VAL 6 -28.196 4.601 -2.809
33 HG22 VAL 6 HG22 VAL 6 -29.904 4.355 -3.182
34 HG23 VAL 6 HG23 VAL 6 -29.191 3.588 -1.763
35 H PHE 7 HN PHE 7 -27.551 7.919 -1.523
36 HA PHE 7 HA PHE 7 -25.448 6.859 -3.020
37 HB2 PHE 7 HB2 PHE 7 -26.425 9.145 -3.283
38 HB3 PHE 7 HB1 PHE 7 -25.558 9.637 -1.832
39 HD1 PHE 7 HD1 PHE 7 -23.051 9.543 -1.841
40 HD2 PHE 7 HD2 PHE 7 -25.377 9.123 -5.375
41 HE1 PHE 7 HE1 PHE 7 -21.073 10.091 -3.201
42 HE2 PHE 7 HE2 PHE 7 -23.407 9.666 -6.745
43 HZ PHE 7 HZ PHE 7 -21.249 10.151 -5.657
44 H THR 8 HN THR 8 -25.452 8.168 0.278
45 HA THR 8 HA THR 8 -22.658 7.845 0.678
46 HB THR 8 HB THR 8 -24.808 7.815 2.775
47 HG1 THR 8 HG1 THR 8 -23.245 10.050 1.997
48 HG21 THR 8 HG21 THR 8 -21.866 8.446 2.969
49 HG22 THR 8 HG22 THR 8 -22.655 6.994 3.585
50 HG23 THR 8 HG23 THR 8 -23.030 8.567 4.288
51 H ASP 9 HN ASP 9 -25.425 5.717 1.006
52 HA ASP 9 HA ASP 9 -24.143 3.637 2.457
53 HB2 ASP 9 HB2 ASP 9 -26.717 4.097 1.594
54 HB3 ASP 9 HB1 ASP 9 -26.187 2.803 0.527
55 H ILE 10 HN ILE 10 -24.485 4.553 -0.857
56 HA ILE 10 HA ILE 10 -23.285 2.324 -2.091
57 HB ILE 10 HB ILE 10 -23.575 5.230 -2.840
58 HG12 ILE 10 HG12 ILE 10 -24.923 2.740 -3.887
59 HG13 ILE 10 HG11 ILE 10 -25.614 3.851 -2.717
60 HG21 ILE 10 HG21 ILE 10 -22.505 3.010 -4.586
61 HG22 ILE 10 HG22 ILE 10 -21.572 4.364 -3.944
62 HG23 ILE 10 HG23 ILE 10 -22.867 4.657 -5.107
63 HD11 ILE 10 HD11 ILE 10 -26.495 4.223 -4.955
64 HD12 ILE 10 HD12 ILE 10 -24.863 4.547 -5.542
65 HD13 ILE 10 HD13 ILE 10 -25.605 5.626 -4.361
66 H LEU 11 HN LEU 11 -22.155 5.370 -0.821
67 HA LEU 11 HA LEU 11 -19.422 5.113 -1.440
68 HB2 LEU 11 HB2 LEU 11 -20.999 6.729 0.548
69 HB3 LEU 11 HB1 LEU 11 -19.247 6.782 0.542
70 HG LEU 11 HG LEU 11 -20.990 7.499 -1.817
71 HD11 LEU 11 HD11 LEU 11 -20.414 9.811 -1.323
72 HD12 LEU 11 HD12 LEU 11 -19.529 9.296 0.113
73 HD13 LEU 11 HD13 LEU 11 -21.277 9.077 0.028
74 HD21 LEU 11 HD21 LEU 11 -18.803 6.713 -2.493
75 HD22 LEU 11 HD22 LEU 11 -18.028 7.799 -1.340
76 HD23 LEU 11 HD23 LEU 11 -18.909 8.460 -2.718
77 H ALA 12 HN ALA 12 -21.424 4.160 1.231
78 HA ALA 12 HA ALA 12 -19.358 3.287 2.971
79 HB1 ALA 12 HB1 ALA 12 -22.310 2.673 2.826
80 HB2 ALA 12 HB2 ALA 12 -21.485 3.773 3.932
81 HB3 ALA 12 HB3 ALA 12 -21.250 2.029 4.085
82 H ALA 13 HN ALA 13 -21.400 1.768 0.564
83 HA ALA 13 HA ALA 13 -20.551 -0.887 0.951
84 HB1 ALA 13 HB1 ALA 13 -21.679 -1.380 -1.072
85 HB2 ALA 13 HB2 ALA 13 -21.512 0.276 -1.657
86 HB3 ALA 13 HB3 ALA 13 -22.598 -0.078 -0.312
87 H ALA 14 HN ALA 14 -19.625 1.453 -1.607
88 HA ALA 14 HA ALA 14 -17.555 -0.043 -2.713
89 HB1 ALA 14 HB1 ALA 14 -17.969 1.804 -4.003
90 HB2 ALA 14 HB2 ALA 14 -16.528 2.346 -3.125
91 HB3 ALA 14 HB3 ALA 14 -18.136 2.872 -2.607
92 H GLY 15 HN GLY 15 -17.486 2.353 -0.108
93 HA2 GLY 15 HA2 GLY 15 -14.743 2.354 0.351
94 HA3 GLY 15 HA1 GLY 15 -15.963 2.651 1.594
95 H ARG 16 HN ARG 16 -17.285 0.239 1.510
96 HA ARG 16 HA ARG 16 -15.625 -1.420 3.105
97 HB2 ARG 16 HB2 ARG 16 -18.423 -1.514 2.063
98 HB3 ARG 16 HB1 ARG 16 -17.720 -2.961 2.757
99 HG2 ARG 16 HG2 ARG 16 -17.705 -0.352 4.221
100 HG3 ARG 16 HG1 ARG 16 -19.100 -1.433 4.266
101 HD2 ARG 16 HD2 ARG 16 -18.066 -2.919 5.579
102 HD3 ARG 16 HD1 ARG 16 -16.514 -2.720 4.771
103 HE ARG 16 HE ARG 16 -16.530 -0.489 6.083
104 HH11 ARG 16 HH11 ARG 16 -17.738 -3.557 7.212
105 HH12 ARG 16 HH12 ARG 16 -17.410 -3.218 8.878
106 HH21 ARG 16 HH21 ARG 16 -16.094 -0.036 8.276
107 HH22 ARG 16 HH22 ARG 16 -16.480 -1.216 9.483
108 H ILE 17 HN ILE 17 -16.754 -1.466 -0.227
109 HA ILE 17 HA ILE 17 -16.025 -4.168 -0.804
110 HB ILE 17 HB ILE 17 -16.539 -1.755 -2.552
111 HG12 ILE 17 HG12 ILE 17 -18.143 -4.068 -1.584
112 HG13 ILE 17 HG11 ILE 17 -18.598 -2.391 -1.775
113 HG21 ILE 17 HG21 ILE 17 -16.485 -3.241 -4.483
114 HG22 ILE 17 HG22 ILE 17 -15.983 -4.577 -3.446
115 HG23 ILE 17 HG23 ILE 17 -14.924 -3.182 -3.664
116 HD11 ILE 17 HD11 ILE 17 -19.838 -3.704 -3.331
117 HD12 ILE 17 HD12 ILE 17 -18.364 -4.448 -3.948
118 HD13 ILE 17 HD13 ILE 17 -18.668 -2.733 -4.226
119 H PHE 18 HN PHE 18 -14.806 -1.123 -1.865
120 HA PHE 18 HA PHE 18 -12.374 -1.790 -2.889
121 HB2 PHE 18 HB2 PHE 18 -13.351 0.381 -3.125
122 HB3 PHE 18 HB1 PHE 18 -13.332 0.646 -1.402
123 HD1 PHE 18 HD2 PHE 18 -11.267 0.618 -4.443
124 HD2 PHE 18 HD1 PHE 18 -11.440 1.253 -0.267
125 HE1 PHE 18 HE2 PHE 18 -9.091 1.773 -4.550
126 HE2 PHE 18 HE1 PHE 18 -9.260 2.428 -0.335
127 HZ PHE 18 HZ PHE 18 -8.084 2.682 -2.490
128 H GLU 19 HN GLU 19 -13.256 -1.155 0.491
129 HA GLU 19 HA GLU 19 -10.651 -1.178 1.561
130 HB2 GLU 19 HB2 GLU 19 -13.316 -1.099 2.587
131 HB3 GLU 19 HB1 GLU 19 -12.404 -2.298 3.482
132 HG2 GLU 19 HG2 GLU 19 -11.582 0.566 3.067
133 HG3 GLU 19 HG1 GLU 19 -12.325 -0.085 4.527
134 H VAL 20 HN VAL 20 -13.077 -3.770 1.396
135 HA VAL 20 HA VAL 20 -11.323 -5.749 2.436
136 HB VAL 20 HB VAL 20 -12.939 -7.396 1.749
137 HG11 VAL 20 HG11 VAL 20 -14.851 -5.219 2.367
138 HG12 VAL 20 HG12 VAL 20 -13.505 -5.424 3.489
139 HG13 VAL 20 HG13 VAL 20 -14.593 -6.772 3.165
140 HG21 VAL 20 HG21 VAL 20 -14.357 -5.276 0.153
141 HG22 VAL 20 HG22 VAL 20 -14.736 -6.997 0.236
142 HG23 VAL 20 HG23 VAL 20 -13.251 -6.457 -0.549
143 H MET 21 HN MET 21 -11.852 -4.294 -0.604
144 HA MET 21 HA MET 21 -10.477 -6.205 -2.231
145 HB2 MET 21 HB2 MET 21 -11.363 -3.341 -2.627
146 HB3 MET 21 HB1 MET 21 -10.456 -4.221 -3.855
147 HG2 MET 21 HG2 MET 21 -12.871 -5.551 -2.798
148 HG3 MET 21 HG1 MET 21 -13.131 -4.117 -3.792
149 HE1 MET 21 HE1 MET 21 -14.148 -7.173 -4.560
150 HE2 MET 21 HE2 MET 21 -13.888 -7.017 -6.297
151 HE3 MET 21 HE3 MET 21 -14.533 -5.658 -5.377
152 H VAL 22 HN VAL 22 -9.742 -3.516 -0.228
153 HA VAL 22 HA VAL 22 -7.144 -3.008 -1.285
154 HB VAL 22 HB VAL 22 -8.739 -1.923 0.980
155 HG11 VAL 22 HG11 VAL 22 -5.747 -1.606 0.724
156 HG12 VAL 22 HG12 VAL 22 -6.627 -2.309 2.082
157 HG13 VAL 22 HG13 VAL 22 -6.781 -0.589 1.727
158 HG21 VAL 22 HG21 VAL 22 -8.946 -0.883 -1.174
159 HG22 VAL 22 HG22 VAL 22 -7.195 -0.741 -1.319
160 HG23 VAL 22 HG23 VAL 22 -8.059 0.206 -0.108
161 H GLU 23 HN GLU 23 -8.468 -4.850 1.430
162 HA GLU 23 HA GLU 23 -6.071 -5.331 2.765
163 HB2 GLU 23 HB2 GLU 23 -7.204 -6.882 4.023
164 HB3 GLU 23 HB1 GLU 23 -8.526 -5.890 3.436
165 HG2 GLU 23 HG2 GLU 23 -8.984 -7.536 1.695
166 HG3 GLU 23 HG1 GLU 23 -7.653 -8.526 2.285
167 H GLY 24 HN GLY 24 -7.647 -7.110 0.157
168 HA2 GLY 24 HA2 GLY 24 -5.672 -9.134 -0.082
169 HA3 GLY 24 HA1 GLY 24 -6.786 -8.629 -1.358
170 H HIS 25 HN HIS 25 -5.945 -5.854 -1.315
171 HA HIS 25 HA HIS 25 -3.815 -5.967 -3.162
172 HB2 HIS 25 HB2 HIS 25 -5.435 -4.087 -3.070
173 HB3 HIS 25 HB1 HIS 25 -4.755 -3.596 -1.522
174 HD1 HIS 25 HD1 HIS 25 -3.802 -3.854 -5.173
175 HD2 HIS 25 HD2 HIS 25 -2.550 -1.982 -1.681
176 HE1 HIS 25 HE1 HIS 25 -2.009 -2.239 -5.881
177 HE2 HIS 25 HE2 HIS 25 -1.346 -1.040 -3.767
178 H TRP 26 HN TRP 26 -4.035 -5.431 0.287
179 HA TRP 26 HA TRP 26 -1.294 -4.797 0.714
180 HB2 TRP 26 HB2 TRP 26 -3.746 -5.256 2.303
181 HB3 TRP 26 HB1 TRP 26 -2.238 -5.632 3.102
182 HD1 TRP 26 HD1 TRP 26 -4.479 -2.782 2.323
183 HE1 TRP 26 HE1 TRP 26 -3.372 -0.567 3.036
184 HE3 TRP 26 HE3 TRP 26 0.253 -4.489 3.137
185 HZ2 TRP 26 HZ2 TRP 26 -0.811 0.330 3.846
186 HZ3 TRP 26 HZ3 TRP 26 1.968 -2.909 3.885
187 HH2 TRP 26 HH2 TRP 26 1.455 -0.542 4.229
188 H GLU 27 HN GLU 27 -3.059 -7.649 0.182
189 HA GLU 27 HA GLU 27 -1.257 -9.372 1.561
190 HB2 GLU 27 HB2 GLU 27 -3.413 -9.809 -0.493
191 HB3 GLU 27 HB1 GLU 27 -2.422 -11.128 0.080
192 HG2 GLU 27 HG2 GLU 27 -4.117 -9.379 1.837
193 HG3 GLU 27 HG1 GLU 27 -4.600 -10.958 1.220
194 H THR 28 HN THR 28 -1.692 -8.234 -1.698
195 HA THR 28 HA THR 28 0.516 -9.755 -2.732
196 HB THR 28 HB THR 28 -1.614 -8.851 -3.994
197 HG1 THR 28 HG1 THR 28 -0.200 -8.880 -5.947
198 HG21 THR 28 HG21 THR 28 0.398 -6.669 -4.530
199 HG22 THR 28 HG22 THR 28 -1.070 -6.471 -3.574
200 HG23 THR 28 HG23 THR 28 -1.184 -6.856 -5.290
201 H VAL 29 HN VAL 29 0.143 -6.721 -1.130
202 HA VAL 29 HA VAL 29 2.212 -5.299 -2.310
203 HB VAL 29 HB VAL 29 2.524 -4.048 -0.226
204 HG11 VAL 29 HG11 VAL 29 0.434 -2.945 -0.251
205 HG12 VAL 29 HG12 VAL 29 -0.392 -4.387 -0.831
206 HG13 VAL 29 HG13 VAL 29 0.735 -3.534 -1.887
207 HG21 VAL 29 HG21 VAL 29 1.404 -6.376 0.915
208 HG22 VAL 29 HG22 VAL 29 0.369 -5.005 1.304
209 HG23 VAL 29 HG23 VAL 29 2.080 -4.960 1.717
210 H GLY 30 HN GLY 30 2.248 -7.799 0.083
211 HA2 GLY 30 HA2 GLY 30 4.830 -7.698 1.024
212 HA3 GLY 30 HA1 GLY 30 4.026 -9.218 0.640
213 H MET 31 HN MET 31 3.914 -7.915 -2.208
214 HA MET 31 HA MET 31 6.511 -8.942 -3.098
215 HB2 MET 31 HB2 MET 31 3.997 -8.387 -4.678
216 HB3 MET 31 HB1 MET 31 5.451 -9.157 -5.287
217 HG2 MET 31 HG2 MET 31 3.446 -10.226 -3.336
218 HG3 MET 31 HG1 MET 31 3.932 -10.883 -4.895
219 HE1 MET 31 HE1 MET 31 3.700 -12.730 -2.377
220 HE2 MET 31 HE2 MET 31 5.196 -13.661 -2.467
221 HE3 MET 31 HE3 MET 31 4.281 -13.317 -3.936
222 H LEU 32 HN LEU 32 4.201 -6.448 -4.215
223 HA LEU 32 HA LEU 32 6.093 -4.925 -5.597
224 HB2 LEU 32 HB2 LEU 32 4.429 -3.177 -5.685
225 HB3 LEU 32 HB1 LEU 32 3.684 -4.736 -5.973
226 HG LEU 32 HG LEU 32 3.261 -4.539 -3.337
227 HD11 LEU 32 HD11 LEU 32 3.221 -1.700 -4.341
228 HD12 LEU 32 HD12 LEU 32 4.319 -2.362 -3.130
229 HD13 LEU 32 HD13 LEU 32 2.592 -2.252 -2.788
230 HD21 LEU 32 HD21 LEU 32 1.002 -3.805 -3.881
231 HD22 LEU 32 HD22 LEU 32 1.583 -4.985 -5.057
232 HD23 LEU 32 HD23 LEU 32 1.551 -3.271 -5.471
233 H PHE 33 HN PHE 33 5.101 -4.898 -2.276
234 HA PHE 33 HA PHE 33 6.287 -2.425 -1.534
235 HB2 PHE 33 HB2 PHE 33 4.514 -3.578 -0.195
236 HB3 PHE 33 HB1 PHE 33 5.685 -4.819 0.230
237 HD1 PHE 33 HD1 PHE 33 7.057 -1.493 0.035
238 HD2 PHE 33 HD2 PHE 33 5.016 -4.228 2.581
239 HE1 PHE 33 HE1 PHE 33 7.727 -0.166 1.991
240 HE2 PHE 33 HE2 PHE 33 5.689 -2.905 4.543
241 HZ PHE 33 HZ PHE 33 7.046 -0.871 4.249
242 H ASP 34 HN ASP 34 7.347 -5.744 -1.730
243 HA ASP 34 HA ASP 34 9.786 -5.543 -0.368
244 HB2 ASP 34 HB2 ASP 34 9.007 -7.697 -0.929
245 HB3 ASP 34 HB1 ASP 34 8.800 -7.275 -2.621
246 H SER 35 HN SER 35 8.866 -4.653 -3.630
247 HA SER 35 HA SER 35 11.542 -4.156 -4.530
248 HB2 SER 35 HB2 SER 35 9.717 -4.653 -6.119
249 HB3 SER 35 HB1 SER 35 8.903 -3.163 -5.646
250 HG SER 35 HG SER 35 11.091 -3.545 -7.286
251 H LEU 36 HN LEU 36 9.598 -2.691 -2.339
252 HA LEU 36 HA LEU 36 10.969 -0.101 -2.627
253 HB2 LEU 36 HB2 LEU 36 8.304 -0.244 -1.302
254 HB3 LEU 36 HB1 LEU 36 9.042 1.079 -2.188
255 HG LEU 36 HG LEU 36 8.037 -1.421 -3.527
256 HD11 LEU 36 HD11 LEU 36 6.055 -0.120 -4.157
257 HD12 LEU 36 HD12 LEU 36 6.596 1.192 -3.109
258 HD13 LEU 36 HD13 LEU 36 6.160 -0.370 -2.416
259 HD21 LEU 36 HD21 LEU 36 9.643 -0.211 -4.834
260 HD22 LEU 36 HD22 LEU 36 8.787 1.307 -4.554
261 HD23 LEU 36 HD23 LEU 36 8.038 0.036 -5.521
262 H GLY 37 HN GLY 37 10.977 -2.805 -0.976
263 HA2 GLY 37 HA2 GLY 37 11.285 -1.550 1.695
264 HA3 GLY 37 HA1 GLY 37 10.973 -3.273 1.417
265 H LYS 38 HN LYS 38 12.494 -4.119 -0.329
266 HA LYS 38 HA LYS 38 15.141 -4.221 0.612
267 HB2 LYS 38 HB2 LYS 38 13.564 -5.520 -1.261
268 HB3 LYS 38 HB1 LYS 38 14.766 -4.681 -2.234
269 HG2 LYS 38 HG2 LYS 38 15.555 -6.904 -1.765
270 HG3 LYS 38 HG1 LYS 38 16.544 -5.752 -0.863
271 HD2 LYS 38 HD2 LYS 38 15.073 -6.169 1.121
272 HD3 LYS 38 HD1 LYS 38 14.295 -7.456 0.199
273 HE2 LYS 38 HE2 LYS 38 17.221 -7.311 0.921
274 HE3 LYS 38 HE1 LYS 38 16.017 -8.348 1.684
275 HZ1 LYS 38 HZ1 LYS 38 17.309 -9.560 0.049
276 HZ2 LYS 38 HZ2 LYS 38 16.855 -8.472 -1.163
277 HZ3 LYS 38 HZ3 LYS 38 15.692 -9.464 -0.440
278 H GLY 39 HN GLY 39 13.394 -2.334 -1.660
279 HA2 GLY 39 HA2 GLY 39 13.860 -0.266 -2.599
280 HA3 GLY 39 HA1 GLY 39 15.356 -0.260 -1.685
281 H THR 40 HN THR 40 13.994 -2.515 -3.853
282 HA THR 40 HA THR 40 15.012 -3.854 -5.401
283 HB THR 40 HB THR 40 14.137 -2.231 -6.868
284 HG1 THR 40 HG1 THR 40 15.634 -3.497 -7.940
285 HG21 THR 40 HG21 THR 40 16.442 -0.473 -6.064
286 HG22 THR 40 HG22 THR 40 14.725 -0.189 -5.794
287 HG23 THR 40 HG23 THR 40 15.383 -0.135 -7.430
288 H MET 41 HN MET 41 16.594 -3.369 -3.105
289 HA MET 41 HA MET 41 19.192 -2.609 -3.450
290 HB2 MET 41 HB2 MET 41 17.746 -4.397 -1.687
291 HB3 MET 41 HB1 MET 41 19.380 -4.985 -1.984
292 HG2 MET 41 HG2 MET 41 20.206 -2.704 -1.370
293 HG3 MET 41 HG1 MET 41 18.566 -2.319 -0.866
294 HE1 MET 41 HE1 MET 41 19.446 -1.672 1.558
295 HE2 MET 41 HE2 MET 41 21.094 -2.050 1.057
296 HE3 MET 41 HE3 MET 41 20.447 -2.735 2.548
297 H ARG 42 HN ARG 42 17.634 -5.390 -4.828
298 HA ARG 42 HA ARG 42 19.942 -6.882 -5.492
299 HB2 ARG 42 HB2 ARG 42 17.580 -7.741 -5.525
300 HB3 ARG 42 HB1 ARG 42 17.321 -6.811 -6.995
301 HG2 ARG 42 HG2 ARG 42 19.138 -8.098 -8.077
302 HG3 ARG 42 HG1 ARG 42 19.249 -9.091 -6.622
303 HD2 ARG 42 HD2 ARG 42 17.890 -10.219 -8.267
304 HD3 ARG 42 HD1 ARG 42 16.881 -9.720 -6.910
305 HE ARG 42 HE ARG 42 16.994 -7.976 -9.250
306 HH11 ARG 42 HH11 ARG 42 15.237 -10.296 -7.334
307 HH12 ARG 42 HH12 ARG 42 13.708 -9.932 -8.062
308 HH21 ARG 42 HH21 ARG 42 14.987 -7.491 -10.215
309 HH22 ARG 42 HH22 ARG 42 13.565 -8.336 -9.699
310 H ILE 43 HN ILE 43 17.848 -4.999 -7.684
311 HA ILE 43 HA ILE 43 19.566 -4.912 -9.852
312 HB ILE 43 HB ILE 43 17.640 -2.737 -9.024
313 HG12 ILE 43 HG12 ILE 43 17.179 -5.198 -10.727
314 HG13 ILE 43 HG11 ILE 43 16.556 -4.939 -9.101
315 HG21 ILE 43 HG21 ILE 43 19.189 -2.044 -10.769
316 HG22 ILE 43 HG22 ILE 43 17.555 -2.209 -11.410
317 HG23 ILE 43 HG23 ILE 43 18.758 -3.458 -11.729
318 HD11 ILE 43 HD11 ILE 43 15.846 -3.329 -11.541
319 HD12 ILE 43 HD12 ILE 43 15.228 -3.057 -9.912
320 HD13 ILE 43 HD13 ILE 43 14.840 -4.552 -10.764
321 H ASN 44 HN ASN 44 19.344 -2.759 -7.053
322 HA ASN 44 HA ASN 44 21.154 -0.802 -7.909
323 HB2 ASN 44 HB2 ASN 44 20.094 -1.701 -5.294
324 HB3 ASN 44 HB1 ASN 44 21.584 -0.763 -5.251
325 HD21 ASN 44 HD21 ASN 44 18.227 -0.764 -6.169
326 HD22 ASN 44 HD22 ASN 44 18.046 0.951 -6.270
327 H ARG 45 HN ARG 45 21.698 -3.865 -6.230
328 HA ARG 45 HA ARG 45 24.463 -3.568 -5.802
329 HB2 ARG 45 HB2 ARG 45 22.569 -5.862 -5.911
330 HB3 ARG 45 HB1 ARG 45 24.286 -6.219 -6.022
331 HG2 ARG 45 HG2 ARG 45 23.001 -4.652 -3.805
332 HG3 ARG 45 HG1 ARG 45 23.398 -6.369 -3.738
333 HD2 ARG 45 HD2 ARG 45 25.341 -4.091 -4.103
334 HD3 ARG 45 HD1 ARG 45 25.128 -5.060 -2.646
335 HE ARG 45 HE ARG 45 25.738 -6.737 -4.829
336 HH11 ARG 45 HH11 ARG 45 27.216 -4.384 -2.725
337 HH12 ARG 45 HH12 ARG 45 28.804 -5.061 -2.873
338 HH21 ARG 45 HH21 ARG 45 27.822 -7.633 -5.030
339 HH22 ARG 45 HH22 ARG 45 29.149 -6.907 -4.185
340 H ASN 46 HN ASN 46 22.699 -5.207 -8.419
341 HA ASN 46 HA ASN 46 24.980 -5.961 -9.856
342 HB2 ASN 46 HB2 ASN 46 22.177 -5.381 -10.861
343 HB3 ASN 46 HB1 ASN 46 23.425 -6.216 -11.783
344 HD21 ASN 46 HD21 ASN 46 21.060 -6.447 -9.316
345 HD22 ASN 46 HD22 ASN 46 21.212 -8.140 -9.021
346 H ALA 47 HN ALA 47 23.031 -3.080 -9.785
347 HA ALA 47 HA ALA 47 24.210 -1.751 -11.994
348 HB1 ALA 47 HB1 ALA 47 22.055 -1.060 -11.095
349 HB2 ALA 47 HB2 ALA 47 23.200 0.281 -11.038
350 HB3 ALA 47 HB3 ALA 47 22.815 -0.615 -9.567
351 H TYR 48 HN TYR 48 24.887 -1.843 -8.547
352 HA TYR 48 HA TYR 48 26.865 0.149 -8.450
353 HB2 TYR 48 HB2 TYR 48 25.595 -1.476 -6.622
354 HB3 TYR 48 HB1 TYR 48 27.252 -2.065 -6.578
355 HD1 TYR 48 HD1 TYR 48 25.186 0.997 -6.215
356 HD2 TYR 48 HD2 TYR 48 28.931 -0.869 -5.438
357 HE1 TYR 48 HE1 TYR 48 25.809 2.870 -4.750
358 HE2 TYR 48 HE2 TYR 48 29.563 1.000 -3.971
359 HH TYR 48 HH TYR 48 27.345 3.299 -2.862
360 H GLY 49 HN GLY 49 26.871 -3.102 -9.540
361 HA2 GLY 49 HA2 GLY 49 29.487 -3.923 -9.280
362 HA3 GLY 49 HA1 GLY 49 28.468 -4.335 -10.647
363 H SER 50 HN SER 50 28.506 -1.138 -10.885
364 HA SER 50 HA SER 50 31.166 -0.620 -11.814
365 HB2 SER 50 HB2 SER 50 30.358 -1.978 -13.695
366 HB3 SER 50 HB1 SER 50 28.967 -0.906 -13.879
367 HG SER 50 HG SER 50 30.330 0.733 -14.501
368 H MET 51 HN MET 51 27.782 0.302 -11.709
369 HA MET 51 HA MET 51 28.198 3.063 -12.300
370 HB2 MET 51 HB2 MET 51 25.907 1.679 -10.902
371 HB3 MET 51 HB1 MET 51 25.883 3.341 -11.464
372 HG2 MET 51 HG2 MET 51 26.266 0.952 -13.251
373 HG3 MET 51 HG1 MET 51 24.718 1.744 -12.959
374 HE1 MET 51 HE1 MET 51 24.293 2.104 -15.464
375 HE2 MET 51 HE2 MET 51 25.817 1.357 -15.944
376 HE3 MET 51 HE3 MET 51 25.376 2.945 -16.573
377 H GLY 52 HN GLY 52 28.238 1.108 -9.419
378 HA2 GLY 52 HA2 GLY 52 28.107 3.322 -7.584
379 HA3 GLY 52 HA1 GLY 52 28.469 1.651 -7.181
380 H GLY 53 HN GLY 53 30.386 2.617 -9.711
381 HA2 GLY 53 HA2 GLY 53 32.639 3.076 -7.875
382 HA3 GLY 53 HA1 GLY 53 32.770 2.418 -9.500
383 H GLY 54 HN GLY 54 31.599 4.011 -11.132
384 HA2 GLY 54 HA2 GLY 54 33.224 6.362 -11.162
385 HA3 GLY 54 HA1 GLY 54 31.962 5.940 -12.318
386 H SER 55 HN SER 55 30.605 5.682 -9.355
387 HA SER 55 HA SER 55 28.967 6.856 -8.310
388 HB2 SER 55 HB2 SER 55 31.182 8.732 -8.791
389 HB3 SER 55 HB1 SER 55 29.659 9.445 -8.261
390 HG SER 55 HG SER 55 29.853 7.615 -6.597
391 H LEU 56 HN LEU 56 29.322 6.725 -11.388
392 HA LEU 56 HA LEU 56 27.800 8.999 -12.308
393 HB2 LEU 56 HB2 LEU 56 28.528 6.446 -13.741
394 HB3 LEU 56 HB1 LEU 56 27.854 7.884 -14.486
395 HG LEU 56 HG LEU 56 30.547 7.683 -13.154
396 HD11 LEU 56 HD11 LEU 56 29.747 7.905 -16.049
397 HD12 LEU 56 HD12 LEU 56 30.521 6.527 -15.267
398 HD13 LEU 56 HD13 LEU 56 31.398 8.048 -15.445
399 HD21 LEU 56 HD21 LEU 56 30.878 9.957 -14.136
400 HD22 LEU 56 HD22 LEU 56 29.712 9.886 -12.814
401 HD23 LEU 56 HD23 LEU 56 29.149 9.992 -14.484
402 H ARG 57 HN ARG 57 27.079 6.468 -10.508
403 HA ARG 57 HA ARG 57 24.795 5.303 -11.652
404 HB2 ARG 57 HB2 ARG 57 24.277 4.504 -9.452
405 HB3 ARG 57 HB1 ARG 57 26.020 4.462 -9.644
406 HG2 ARG 57 HG2 ARG 57 26.368 6.191 -8.186
407 HG3 ARG 57 HG1 ARG 57 24.731 6.823 -8.364
408 HD2 ARG 57 HD2 ARG 57 25.466 4.230 -7.006
409 HD3 ARG 57 HD1 ARG 57 25.111 5.744 -6.174
410 HE ARG 57 HE ARG 57 23.053 4.683 -7.946
411 HH11 ARG 57 HH11 ARG 57 24.227 5.133 -4.694
412 HH12 ARG 57 HH12 ARG 57 22.691 4.817 -3.959
413 HH21 ARG 57 HH21 ARG 57 21.030 4.267 -6.987
414 HH22 ARG 57 HH22 ARG 57 20.873 4.326 -5.263
415 H GLY 58 HN GLY 58 25.244 8.484 -10.910
416 HA2 GLY 58 HA2 GLY 58 22.357 8.895 -10.418
417 HA3 GLY 58 HA1 GLY 58 23.602 9.943 -9.756
418 H SER 59 HN SER 59 25.011 9.544 -12.481
419 HA SER 59 HA SER 59 23.440 11.593 -13.897
420 HB2 SER 59 HB2 SER 59 25.607 12.344 -14.870
421 HB3 SER 59 HB1 SER 59 25.550 12.501 -13.115
422 HG SER 59 HG SER 59 27.136 11.136 -12.969
Contact the webmaster for help, if required. Sunday, May 19, 2024 7:50:33 PM GMT (wattos1)