Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
521734 | 2l70 RC | 17330 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 TYR 1 H1 TYR 1 3.751 -25.304 -1.722
2 HA TYR 1 HA TYR 1 6.562 -24.669 -0.954
3 HB2 TYR 1 HB2 TYR 1 4.051 -22.922 -0.563
4 HB3 TYR 1 HB3 TYR 1 5.708 -22.488 -0.074
5 HD1 TYR 1 HD2 TYR 1 7.516 -22.255 -1.848
6 HD2 TYR 1 HD1 TYR 1 3.369 -22.687 -2.917
7 HE1 TYR 1 HE2 TYR 1 8.017 -21.408 -4.104
8 HE2 TYR 1 HE1 TYR 1 3.871 -21.823 -5.180
9 HH TYR 1 HH TYR 1 7.113 -20.753 -6.221
10 H ALA 2 H ALA 2 5.794 -27.031 -0.059
11 HA ALA 2 HA ALA 2 5.533 -28.271 1.843
12 HB1 ALA 2 HB1 ALA 2 7.118 -26.652 2.893
13 HB2 ALA 2 HB2 ALA 2 5.745 -25.647 3.440
14 HB3 ALA 2 HB3 ALA 2 5.930 -27.306 4.057
15 H GLU 3 H GLU 3 3.906 -28.894 3.565
16 HA GLU 3 HA GLU 3 1.273 -28.026 2.578
17 HB2 GLU 3 HB2 GLU 3 1.748 -30.419 3.042
18 HB3 GLU 3 HB3 GLU 3 1.987 -30.050 4.773
19 HG2 GLU 3 HG2 GLU 3 -0.390 -29.288 4.963
20 HG3 GLU 3 HG3 GLU 3 -0.633 -29.531 3.210
21 H GLY 4 H GLY 4 -0.334 -26.901 3.994
22 HA2 GLY 4 HA2 GLY 4 -0.195 -26.246 6.610
23 HA3 GLY 4 HA3 GLY 4 1.032 -25.142 5.949
24 H THR 5 H THR 5 -2.500 -25.799 6.048
25 HA THR 5 HA THR 5 -3.235 -23.985 4.008
26 HB THR 5 HB THR 5 -4.713 -24.542 6.649
27 HG1 THR 5 HG1 THR 5 -4.836 -25.983 4.173
28 HG21 THR 5 HG21 THR 5 -5.819 -23.638 3.910
29 HG22 THR 5 HG22 THR 5 -6.776 -23.989 5.378
30 HG23 THR 5 HG23 THR 5 -5.676 -22.582 5.348
31 H PHE 6 H PHE 6 -2.569 -23.377 7.582
32 HA PHE 6 HA PHE 6 -3.227 -20.605 7.457
33 HB2 PHE 6 HB2 PHE 6 -2.819 -21.728 9.643
34 HB3 PHE 6 HB3 PHE 6 -1.119 -22.016 9.210
35 HD1 PHE 6 HD2 PHE 6 0.503 -20.120 9.060
36 HD2 PHE 6 HD1 PHE 6 -3.568 -19.443 10.284
37 HE1 PHE 6 HE2 PHE 6 1.097 -17.829 9.766
38 HE2 PHE 6 HE1 PHE 6 -2.937 -17.196 11.110
39 HZ PHE 6 HZ PHE 6 -0.616 -16.362 10.808
40 H ILE 7 H ILE 7 -0.120 -22.395 6.773
41 HA ILE 7 HA ILE 7 1.425 -19.997 6.481
42 HB ILE 7 HB ILE 7 1.864 -22.751 5.202
43 HG12 ILE 7 HG12 ILE 7 3.180 -21.406 7.664
44 HG13 ILE 7 HG13 ILE 7 1.955 -22.687 7.748
45 HG21 ILE 7 HG21 ILE 7 3.005 -20.880 3.899
46 HG22 ILE 7 HG22 ILE 7 3.839 -20.395 5.401
47 HG23 ILE 7 HG23 ILE 7 4.158 -21.986 4.644
48 HD11 ILE 7 HD11 ILE 7 3.524 -24.266 6.530
49 HD12 ILE 7 HD12 ILE 7 4.803 -23.016 6.635
50 HD13 ILE 7 HD13 ILE 7 4.119 -23.707 8.120
51 H SER 8 H SER 8 -0.380 -22.076 4.056
52 HA SER 8 HA SER 8 0.259 -20.500 1.819
53 HB2 SER 8 HB2 SER 8 -2.405 -21.955 2.352
54 HB3 SER 8 HB3 SER 8 -1.768 -21.474 0.759
55 HG SER 8 HG SER 8 0.023 -23.010 1.256
56 H ASP 9 H ASP 9 -2.575 -20.201 4.137
57 HA ASP 9 HA ASP 9 -3.862 -18.128 2.740
58 HB2 ASP 9 HB2 ASP 9 -4.951 -19.283 4.664
59 HB3 ASP 9 HB3 ASP 9 -3.765 -18.598 5.794
60 H TYR 10 H TYR 10 -1.446 -17.939 5.475
61 HA TYR 10 HA TYR 10 -1.416 -15.086 5.504
62 HB2 TYR 10 HB2 TYR 10 -0.575 -16.398 7.422
63 HB3 TYR 10 HB3 TYR 10 0.692 -17.140 6.424
64 HD1 TYR 10 HD2 TYR 10 -0.553 -13.795 7.659
65 HD2 TYR 10 HD1 TYR 10 2.791 -15.961 6.046
66 HE1 TYR 10 HE2 TYR 10 0.974 -11.985 8.377
67 HE2 TYR 10 HE1 TYR 10 4.320 -14.188 6.808
68 HH TYR 10 HH TYR 10 4.515 -12.082 7.935
69 H SER 11 H SER 11 0.626 -17.535 3.738
70 HA SER 11 HA SER 11 2.504 -15.703 2.717
71 HB2 SER 11 HB2 SER 11 2.756 -18.177 2.475
72 HB3 SER 11 HB3 SER 11 1.382 -18.211 1.323
73 HG SER 11 HG SER 11 3.480 -18.015 0.210
74 H ILE 12 H ILE 12 -0.805 -16.603 1.451
75 HA ILE 12 HA ILE 12 -0.474 -14.968 -0.922
76 HB ILE 12 HB ILE 12 -3.025 -15.868 0.524
77 HG12 ILE 12 HG12 ILE 12 -1.772 -17.815 -0.370
78 HG13 ILE 12 HG13 ILE 12 -3.279 -17.548 -1.257
79 HG21 ILE 12 HG21 ILE 12 -2.709 -14.437 -2.180
80 HG22 ILE 12 HG22 ILE 12 -4.196 -15.289 -1.667
81 HG23 ILE 12 HG23 ILE 12 -3.613 -13.883 -0.749
82 HD11 ILE 12 HD11 ILE 12 -1.910 -16.485 -3.140
83 HD12 ILE 12 HD12 ILE 12 -0.419 -16.885 -2.234
84 HD13 ILE 12 HD13 ILE 12 -1.490 -18.181 -2.802
85 H ALA 13 H ALA 13 -1.822 -14.346 2.418
86 HA ALA 13 HA ALA 13 -2.648 -11.718 1.862
87 HB1 ALA 13 HB1 ALA 13 -1.322 -12.619 4.500
88 HB2 ALA 13 HB2 ALA 13 -2.410 -11.227 4.261
89 HB3 ALA 13 HB3 ALA 13 -3.040 -12.884 4.079
90 H MET 14 H MET 14 0.674 -12.969 2.755
91 HA MET 14 HA MET 14 1.865 -10.360 2.821
92 HB2 MET 14 HB2 MET 14 3.166 -13.051 2.132
93 HB3 MET 14 HB3 MET 14 4.050 -11.535 2.436
94 HG2 MET 14 HG2 MET 14 2.275 -12.938 4.559
95 HG3 MET 14 HG3 MET 14 4.042 -13.049 4.424
96 HE1 MET 14 HE1 MET 14 1.626 -9.288 5.014
97 HE2 MET 14 HE2 MET 14 0.968 -10.959 5.125
98 HE3 MET 14 HE3 MET 14 1.592 -10.137 6.585
99 H ASP 15 H ASP 15 1.404 -12.739 0.079
100 HA ASP 15 HA ASP 15 2.890 -11.299 -1.800
101 HB2 ASP 15 HB2 ASP 15 1.873 -13.516 -2.309
102 HB3 ASP 15 HB3 ASP 15 0.243 -12.795 -2.313
103 H LYS 16 H LYS 16 -0.623 -10.792 -0.877
104 HA LYS 16 HA LYS 16 -0.850 -8.634 -2.851
105 HB2 LYS 16 HB2 LYS 16 -2.727 -9.238 -0.495
106 HB3 LYS 16 HB3 LYS 16 -3.071 -8.215 -1.911
107 HG2 LYS 16 HG2 LYS 16 -2.741 -11.293 -1.878
108 HG3 LYS 16 HG3 LYS 16 -4.211 -10.339 -2.150
109 HD2 LYS 16 HD2 LYS 16 -3.133 -9.391 -4.275
110 HD3 LYS 16 HD3 LYS 16 -1.763 -10.504 -4.012
111 HE2 LYS 16 HE2 LYS 16 -3.320 -11.468 -5.654
112 HE3 LYS 16 HE3 LYS 16 -3.271 -12.479 -4.188
113 HZ1 LYS 16 HZ1 LYS 16 -5.506 -11.769 -3.594
114 HZ2 LYS 16 HZ2 LYS 16 -5.444 -10.405 -4.737
115 H ILE 17 H ILE 17 -0.496 -8.819 0.760
116 HA ILE 17 HA ILE 17 -0.753 -6.010 1.156
117 HB ILE 17 HB ILE 17 0.708 -8.126 2.805
118 HG12 ILE 17 HG12 ILE 17 -1.905 -6.603 3.433
119 HG13 ILE 17 HG13 ILE 17 -1.924 -8.122 2.525
120 HG21 ILE 17 HG21 ILE 17 1.800 -5.970 3.320
121 HG22 ILE 17 HG22 ILE 17 0.208 -5.168 3.496
122 HG23 ILE 17 HG23 ILE 17 0.756 -6.382 4.679
123 HD11 ILE 17 HD11 ILE 17 -2.402 -8.597 4.877
124 HD12 ILE 17 HD12 ILE 17 -0.841 -9.329 4.421
125 HD13 ILE 17 HD13 ILE 17 -0.883 -7.848 5.414
126 H HIS 18 H HIS 18 2.122 -8.009 0.121
127 HA HIS 18 HA HIS 18 4.065 -6.099 0.728
128 HB2 HIS 18 HB2 HIS 18 4.747 -8.261 -0.166
129 HB3 HIS 18 HB3 HIS 18 3.918 -7.963 -1.715
130 HD1 HIS 18 HD1 HIS 18 4.969 -6.147 -3.276
131 HD2 HIS 18 HD2 HIS 18 7.196 -7.086 0.162
132 HE1 HIS 18 HE1 HIS 18 7.273 -5.194 -3.678
133 H GLN 19 H GLN 19 2.067 -6.301 -2.357
134 HA GLN 19 HA GLN 19 3.352 -3.890 -3.369
135 HB2 GLN 19 HB2 GLN 19 0.766 -5.283 -4.295
136 HB3 GLN 19 HB3 GLN 19 1.562 -3.914 -5.114
137 HG2 GLN 19 HG2 GLN 19 3.628 -5.320 -5.469
138 HG3 GLN 19 HG3 GLN 19 2.841 -6.693 -4.659
139 HE21 GLN 19 HE21 GLN 19 2.328 -4.359 -7.461
140 HE22 GLN 19 HE22 GLN 19 1.561 -5.537 -8.458
141 H GLN 20 H GLN 20 0.141 -4.625 -1.779
142 HA GLN 20 HA GLN 20 -0.789 -1.952 -2.163
143 HB2 GLN 20 HB2 GLN 20 -2.277 -3.944 -1.704
144 HB3 GLN 20 HB3 GLN 20 -1.630 -4.022 -0.046
145 HG2 GLN 20 HG2 GLN 20 -3.848 -2.874 -0.101
146 HG3 GLN 20 HG3 GLN 20 -2.560 -1.796 0.478
147 HE21 GLN 20 HE21 GLN 20 -4.016 0.076 -0.142
148 HE22 GLN 20 HE22 GLN 20 -4.157 0.507 -1.803
149 H ASP 21 H ASP 21 1.232 -3.415 0.427
150 HA ASP 21 HA ASP 21 0.945 -1.280 2.286
151 HB2 ASP 21 HB2 ASP 21 2.056 -3.377 2.952
152 HB3 ASP 21 HB3 ASP 21 3.361 -3.110 1.760
153 H PHE 22 H PHE 22 3.241 -1.740 -0.585
154 HA PHE 22 HA PHE 22 4.663 0.677 -0.089
155 HB2 PHE 22 HB2 PHE 22 5.428 -0.873 -1.899
156 HB3 PHE 22 HB3 PHE 22 3.952 -0.537 -2.833
157 HD1 PHE 22 HD1 PHE 22 7.101 0.986 -1.499
158 HD2 PHE 22 HD2 PHE 22 3.685 1.593 -4.049
159 HE1 PHE 22 HE1 PHE 22 8.117 3.068 -2.369
160 HE2 PHE 22 HE2 PHE 22 4.673 3.710 -4.865
161 HZ PHE 22 HZ PHE 22 6.888 4.455 -4.025
162 H VAL 23 H VAL 23 1.490 0.027 -1.762
163 HA VAL 23 HA VAL 23 1.156 2.766 -2.583
164 HB VAL 23 HB VAL 23 -0.949 0.590 -2.047
165 HG11 VAL 23 HG11 VAL 23 -2.040 2.787 -1.764
166 HG12 VAL 23 HG12 VAL 23 -1.340 3.366 -3.305
167 HG13 VAL 23 HG13 VAL 23 -2.546 2.051 -3.301
168 HG21 VAL 23 HG21 VAL 23 0.255 1.696 -4.670
169 HG22 VAL 23 HG22 VAL 23 0.591 0.087 -3.976
170 HG23 VAL 23 HG23 VAL 23 -1.046 0.476 -4.557
171 H ASN 24 H ASN 24 0.481 1.017 0.557
172 HA ASN 24 HA ASN 24 -1.043 3.138 1.625
173 HB2 ASN 24 HB2 ASN 24 0.643 1.041 3.063
174 HB3 ASN 24 HB3 ASN 24 0.009 2.443 3.934
175 HD21 ASN 24 HD21 ASN 24 -1.599 0.310 1.360
176 HD22 ASN 24 HD22 ASN 24 -2.964 0.024 2.368
177 H TRP 25 H TRP 25 2.571 2.786 1.249
178 HA TRP 25 HA TRP 25 3.208 5.012 2.860
179 HB2 TRP 25 HB2 TRP 25 4.950 3.552 1.795
180 HB3 TRP 25 HB3 TRP 25 4.582 4.265 0.200
181 HD1 TRP 25 HD1 TRP 25 6.119 5.213 3.612
182 HE1 TRP 25 HE1 TRP 25 7.415 7.365 3.347
183 HE3 TRP 25 HE3 TRP 25 4.725 6.449 -1.215
184 HZ2 TRP 25 HZ2 TRP 25 7.862 9.314 1.473
185 HZ3 TRP 25 HZ3 TRP 25 5.731 8.532 -2.207
186 HH2 TRP 25 HH2 TRP 25 7.268 9.933 -0.878
187 H LEU 26 H LEU 26 1.993 4.885 -0.600
188 HA LEU 26 HA LEU 26 2.189 7.715 -0.966
189 HB2 LEU 26 HB2 LEU 26 0.124 5.811 -2.204
190 HB3 LEU 26 HB3 LEU 26 0.392 7.480 -2.726
191 HG LEU 26 HG LEU 26 2.590 5.315 -2.842
192 HD11 LEU 26 HD11 LEU 26 0.725 6.258 -5.104
193 HD12 LEU 26 HD12 LEU 26 2.071 5.090 -5.256
194 HD13 LEU 26 HD13 LEU 26 0.634 4.670 -4.296
195 HD21 LEU 26 HD21 LEU 26 3.696 6.855 -4.445
196 HD22 LEU 26 HD22 LEU 26 2.367 8.038 -4.287
197 HD23 LEU 26 HD23 LEU 26 3.450 7.719 -2.915
198 H LEU 27 H LEU 27 -0.651 5.674 0.255
199 HA LEU 27 HA LEU 27 -2.324 7.907 0.287
200 HB2 LEU 27 HB2 LEU 27 -3.979 6.779 1.494
201 HB3 LEU 27 HB3 LEU 27 -3.131 5.594 0.481
202 HG LEU 27 HG LEU 27 -1.813 5.031 2.710
203 HD11 LEU 27 HD11 LEU 27 -3.108 5.341 4.824
204 HD12 LEU 27 HD12 LEU 27 -2.556 6.896 4.193
205 HD13 LEU 27 HD13 LEU 27 -4.251 6.406 3.969
206 HD21 LEU 27 HD21 LEU 27 -4.802 4.330 2.479
207 HD22 LEU 27 HD22 LEU 27 -3.499 3.494 1.596
208 HD23 LEU 27 HD23 LEU 27 -3.577 3.381 3.366
209 H ALA 28 H ALA 28 0.068 6.906 2.810
210 HA ALA 28 HA ALA 28 -0.858 8.630 4.831
211 HB1 ALA 28 HB1 ALA 28 1.001 7.062 5.234
212 HB2 ALA 28 HB2 ALA 28 2.040 7.941 4.077
213 HB3 ALA 28 HB3 ALA 28 1.548 8.725 5.606
214 H GLN 29 H GLN 29 1.409 9.457 2.045
215 HA GLN 29 HA GLN 29 1.713 12.156 3.110
216 HB2 GLN 29 HB2 GLN 29 2.584 10.888 0.457
217 HB3 GLN 29 HB3 GLN 29 2.725 12.635 0.760
218 HG2 GLN 29 HG2 GLN 29 4.852 11.417 1.320
219 HG3 GLN 29 HG3 GLN 29 4.170 12.312 2.697
220 HE21 GLN 29 HE21 GLN 29 4.200 8.969 1.205
221 HE22 GLN 29 HE22 GLN 29 4.126 8.148 2.718
222 H LYS 30 H LYS 30 0.153 10.993 -0.019
223 HA LYS 30 HA LYS 30 -0.956 13.559 -0.451
224 HB2 LYS 30 HB2 LYS 30 -2.362 12.621 -2.180
225 HB3 LYS 30 HB3 LYS 30 -0.751 11.855 -2.236
226 HG2 LYS 30 HG2 LYS 30 -1.731 9.875 -0.952
227 HG3 LYS 30 HG3 LYS 30 -3.342 10.628 -1.069
228 HD2 LYS 30 HD2 LYS 30 -3.165 10.551 -3.593
229 HD3 LYS 30 HD3 LYS 30 -1.540 9.823 -3.458
230 HE2 LYS 30 HE2 LYS 30 -2.489 7.831 -2.289
231 HE3 LYS 30 HE3 LYS 30 -4.136 8.520 -2.413
232 HZ1 LYS 30 HZ1 LYS 30 -3.526 6.862 -4.250
233 HZ2 LYS 30 HZ2 LYS 30 -3.949 8.445 -4.882
234 H GLY 31 H GLY 31 -2.158 10.812 1.587
235 HA2 GLY 31 HA2 GLY 31 -4.779 11.838 1.999
236 HA3 GLY 31 HA3 GLY 31 -3.868 10.875 3.191
237 H LYS 32 H LYS 32 -1.590 12.530 3.690
238 HA LYS 32 HA LYS 32 -2.738 14.380 5.541
239 HB2 LYS 32 HB2 LYS 32 -0.436 13.486 5.843
240 HB3 LYS 32 HB3 LYS 32 0.107 14.338 4.370
241 HG2 LYS 32 HG2 LYS 32 -0.308 16.539 5.396
242 HG3 LYS 32 HG3 LYS 32 -1.085 15.787 6.812
243 HD2 LYS 32 HD2 LYS 32 1.234 16.572 7.295
244 HD3 LYS 32 HD3 LYS 32 1.053 14.820 7.569
245 HE2 LYS 32 HE2 LYS 32 2.262 14.292 5.492
246 HE3 LYS 32 HE3 LYS 32 2.220 15.997 4.966
247 HZ1 LYS 32 HZ1 LYS 32 3.779 16.606 6.729
248 HZ2 LYS 32 HZ2 LYS 32 3.703 14.990 7.434
249 H LYS 33 H LYS 33 -1.346 14.797 2.160
250 HA LYS 33 HA LYS 33 -1.386 17.577 2.143
251 HB2 LYS 33 HB2 LYS 33 -0.530 16.162 0.238
252 HB3 LYS 33 HB3 LYS 33 -2.212 15.835 -0.271
253 HG2 LYS 33 HG2 LYS 33 -2.590 18.339 -0.516
254 HG3 LYS 33 HG3 LYS 33 -0.875 18.610 -0.117
255 HD2 LYS 33 HD2 LYS 33 -2.005 17.125 -2.584
256 HD3 LYS 33 HD3 LYS 33 -1.264 18.745 -2.541
257 HE2 LYS 33 HE2 LYS 33 0.937 17.665 -1.803
258 HE3 LYS 33 HE3 LYS 33 0.166 16.064 -2.039
259 HZ1 LYS 33 HZ1 LYS 33 0.523 18.162 -4.211
260 HZ2 LYS 33 HZ2 LYS 33 1.362 16.625 -4.073
261 H ASN 34 H ASN 34 -4.086 15.235 1.398
262 HA ASN 34 HA ASN 34 -5.995 17.555 1.536
263 HB2 ASN 34 HB2 ASN 34 -7.564 16.056 0.310
264 HB3 ASN 34 HB3 ASN 34 -6.071 16.399 -0.588
265 HD21 ASN 34 HD21 ASN 34 -5.256 14.455 -1.637
266 HD22 ASN 34 HD22 ASN 34 -5.406 12.890 -0.938
267 H ASP 35 H ASP 35 -4.885 16.805 3.997
268 HA ASP 35 HA ASP 35 -6.445 14.941 5.416
269 HB2 ASP 35 HB2 ASP 35 -6.104 16.375 7.437
270 HB3 ASP 35 HB3 ASP 35 -4.587 16.130 6.534
271 H TRP 36 H TRP 36 -7.184 18.423 4.473
272 HA TRP 36 HA TRP 36 -9.986 17.585 4.255
273 HB2 TRP 36 HB2 TRP 36 -9.833 18.204 6.677
274 HB3 TRP 36 HB3 TRP 36 -9.159 19.794 6.239
275 HD1 TRP 36 HD1 TRP 36 -12.379 17.678 5.530
276 HE1 TRP 36 HE1 TRP 36 -14.358 19.233 5.396
277 HE3 TRP 36 HE3 TRP 36 -9.935 22.239 5.955
278 HZ2 TRP 36 HZ2 TRP 36 -14.928 21.903 5.489
279 HZ3 TRP 36 HZ3 TRP 36 -11.359 24.298 5.976
280 HH2 TRP 36 HH2 TRP 36 -13.816 24.132 5.751
281 H LYS 37 H LYS 37 -8.637 17.996 2.084
282 HA LYS 37 HA LYS 37 -9.235 20.846 1.312
283 HB2 LYS 37 HB2 LYS 37 -6.808 19.961 1.157
284 HB3 LYS 37 HB3 LYS 37 -7.407 18.804 -0.060
285 HG2 LYS 37 HG2 LYS 37 -6.311 20.651 -1.164
286 HG3 LYS 37 HG3 LYS 37 -8.034 20.755 -1.571
287 HD2 LYS 37 HD2 LYS 37 -8.321 22.617 0.116
288 HD3 LYS 37 HD3 LYS 37 -6.609 22.436 0.589
289 HE2 LYS 37 HE2 LYS 37 -7.694 23.288 -2.169
290 HE3 LYS 37 HE3 LYS 37 -6.885 24.346 -0.976
291 HZ1 LYS 37 HZ1 LYS 37 -5.336 23.608 -2.797
292 HZ2 LYS 37 HZ2 LYS 37 -4.819 22.931 -1.254
293 H HIS 38 H HIS 38 -11.303 18.837 1.706
294 HA HIS 38 HA HIS 38 -12.595 19.067 -0.831
295 HB2 HIS 38 HB2 HIS 38 -11.153 17.180 -1.608
296 HB3 HIS 38 HB3 HIS 38 -11.541 16.273 -0.124
297 HD1 HIS 38 HD1 HIS 38 -13.410 17.846 -3.057
298 HD2 HIS 38 HD2 HIS 38 -13.628 14.630 -0.356
299 HE1 HIS 38 HE1 HIS 38 -15.411 16.472 -3.784
300 H ASN 39 H ASN 39 -14.937 18.681 -0.402
301 HA ASN 39 HA ASN 39 -15.620 16.972 1.880
302 HB2 ASN 39 HB2 ASN 39 -14.792 19.236 2.873
303 HB3 ASN 39 HB3 ASN 39 -16.214 19.987 2.139
304 HD21 ASN 39 HD21 ASN 39 -18.450 19.012 2.841
305 HD22 ASN 39 HD22 ASN 39 -18.542 18.354 4.433
306 H ILE 40 H ILE 40 -16.367 16.353 -0.561
307 HA ILE 40 HA ILE 40 -18.186 16.088 -1.979
308 HB ILE 40 HB ILE 40 -19.781 16.792 0.552
309 HG12 ILE 40 HG12 ILE 40 -18.639 14.081 -0.360
310 HG13 ILE 40 HG13 ILE 40 -18.111 15.038 1.048
311 HG21 ILE 40 HG21 ILE 40 -21.090 16.756 -1.639
312 HG22 ILE 40 HG22 ILE 40 -20.555 15.071 -1.887
313 HG23 ILE 40 HG23 ILE 40 -21.607 15.499 -0.506
314 HD11 ILE 40 HD11 ILE 40 -19.560 13.293 1.902
315 HD12 ILE 40 HD12 ILE 40 -20.482 14.819 2.013
316 HD13 ILE 40 HD13 ILE 40 -20.835 13.636 0.712
317 H THR 41 H THR 41 -17.476 18.034 -3.260
318 HA THR 41 HA THR 41 -17.821 20.130 -4.168
319 HB THR 41 HB THR 41 -20.487 20.245 -2.654
320 HG1 THR 41 HG1 THR 41 -21.243 19.265 -4.667
321 HG21 THR 41 HG21 THR 41 -21.118 21.850 -4.386
322 HG22 THR 41 HG22 THR 41 -19.593 22.426 -3.654
323 HG23 THR 41 HG23 THR 41 -19.575 21.620 -5.253
324 H GLN 42 H GLN 42 -15.877 20.430 -2.747
325 HA GLN 42 HA GLN 42 -16.008 21.089 -0.071
326 HB2 GLN 42 HB2 GLN 42 -13.870 20.878 -1.692
327 HB3 GLN 42 HB3 GLN 42 -14.006 22.640 -1.793
328 HG2 GLN 42 HG2 GLN 42 -13.659 20.900 0.738
329 HG3 GLN 42 HG3 GLN 42 -12.408 21.921 -0.007
330 HE21 GLN 42 HE21 GLN 42 -13.875 21.994 2.807
331 HE22 GLN 42 HE22 GLN 42 -14.313 23.656 2.921
Start of MODEL 2
1 H1 TYR 1 H1 TYR 1 2.459 -23.040 -3.747
2 HA TYR 1 HA TYR 1 0.261 -23.977 -5.531
3 HB2 TYR 1 HB2 TYR 1 2.749 -25.557 -4.631
4 HB3 TYR 1 HB3 TYR 1 1.402 -26.224 -5.583
5 HD1 TYR 1 HD2 TYR 1 4.285 -23.857 -5.645
6 HD2 TYR 1 HD1 TYR 1 1.029 -25.502 -7.928
7 HE1 TYR 1 HE2 TYR 1 5.293 -22.974 -7.709
8 HE2 TYR 1 HE1 TYR 1 2.078 -24.678 -10.009
9 HH TYR 1 HH TYR 1 5.203 -22.966 -10.101
10 H ALA 2 H ALA 2 -0.635 -22.861 -3.343
11 HA ALA 2 HA ALA 2 -1.654 -23.182 -1.292
12 HB1 ALA 2 HB1 ALA 2 -3.076 -24.524 -2.831
13 HB2 ALA 2 HB2 ALA 2 -2.075 -25.972 -2.518
14 HB3 ALA 2 HB3 ALA 2 -3.035 -25.246 -1.195
15 H GLU 3 H GLU 3 0.984 -23.101 -0.757
16 HA GLU 3 HA GLU 3 2.063 -25.531 0.253
17 HB2 GLU 3 HB2 GLU 3 3.513 -23.559 -0.150
18 HB3 GLU 3 HB3 GLU 3 2.680 -22.645 1.128
19 HG2 GLU 3 HG2 GLU 3 4.844 -23.601 1.967
20 HG3 GLU 3 HG3 GLU 3 3.469 -24.303 2.854
21 H GLY 4 H GLY 4 0.773 -26.746 1.833
22 HA2 GLY 4 HA2 GLY 4 -0.284 -27.102 3.890
23 HA3 GLY 4 HA3 GLY 4 0.522 -25.614 4.451
24 H THR 5 H THR 5 -1.691 -25.398 5.606
25 HA THR 5 HA THR 5 -3.664 -24.064 3.753
26 HB THR 5 HB THR 5 -4.165 -25.391 6.473
27 HG1 THR 5 HG1 THR 5 -4.965 -26.210 3.851
28 HG21 THR 5 HG21 THR 5 -6.103 -23.973 4.528
29 HG22 THR 5 HG22 THR 5 -6.569 -24.869 6.002
30 HG23 THR 5 HG23 THR 5 -5.620 -23.364 6.138
31 H PHE 6 H PHE 6 -2.482 -23.866 7.278
32 HA PHE 6 HA PHE 6 -3.101 -21.093 7.431
33 HB2 PHE 6 HB2 PHE 6 -2.521 -22.358 9.495
34 HB3 PHE 6 HB3 PHE 6 -0.886 -22.676 8.877
35 HD1 PHE 6 HD1 PHE 6 -3.168 -20.000 10.144
36 HD2 PHE 6 HD2 PHE 6 0.821 -20.904 8.805
37 HE1 PHE 6 HE1 PHE 6 -2.398 -17.784 10.932
38 HE2 PHE 6 HE2 PHE 6 1.569 -18.660 9.519
39 HZ PHE 6 HZ PHE 6 -0.029 -17.106 10.618
40 H ILE 7 H ILE 7 -0.079 -22.905 6.406
41 HA ILE 7 HA ILE 7 1.442 -20.491 6.145
42 HB ILE 7 HB ILE 7 1.871 -23.210 4.808
43 HG12 ILE 7 HG12 ILE 7 3.360 -21.887 7.165
44 HG13 ILE 7 HG13 ILE 7 2.081 -23.107 7.342
45 HG21 ILE 7 HG21 ILE 7 3.694 -20.718 4.836
46 HG22 ILE 7 HG22 ILE 7 4.193 -22.316 4.231
47 HG23 ILE 7 HG23 ILE 7 2.914 -21.432 3.398
48 HD11 ILE 7 HD11 ILE 7 3.501 -24.725 5.933
49 HD12 ILE 7 HD12 ILE 7 4.852 -23.559 6.084
50 HD13 ILE 7 HD13 ILE 7 4.157 -24.300 7.539
51 H SER 8 H SER 8 -0.625 -22.397 3.767
52 HA SER 8 HA SER 8 0.068 -20.770 1.558
53 HB2 SER 8 HB2 SER 8 -1.256 -22.803 1.216
54 HB3 SER 8 HB3 SER 8 -2.649 -22.129 2.098
55 HG SER 8 HG SER 8 -2.730 -20.479 0.362
56 H ASP 9 H ASP 9 -2.757 -20.421 3.905
57 HA ASP 9 HA ASP 9 -3.822 -18.120 2.741
58 HB2 ASP 9 HB2 ASP 9 -4.981 -19.236 4.624
59 HB3 ASP 9 HB3 ASP 9 -3.650 -18.838 5.739
60 H TYR 10 H TYR 10 -1.185 -18.361 5.274
61 HA TYR 10 HA TYR 10 -0.914 -15.539 5.513
62 HB2 TYR 10 HB2 TYR 10 0.094 -17.110 7.187
63 HB3 TYR 10 HB3 TYR 10 1.218 -17.728 5.953
64 HD1 TYR 10 HD2 TYR 10 0.095 -14.571 7.670
65 HD2 TYR 10 HD1 TYR 10 3.309 -16.499 5.547
66 HE1 TYR 10 HE2 TYR 10 1.533 -12.620 8.087
67 HE2 TYR 10 HE1 TYR 10 4.798 -14.606 6.107
68 HH TYR 10 HH TYR 10 3.715 -11.682 7.843
69 H SER 11 H SER 11 0.785 -17.979 3.403
70 HA SER 11 HA SER 11 2.690 -16.270 2.306
71 HB2 SER 11 HB2 SER 11 2.615 -18.731 1.815
72 HB3 SER 11 HB3 SER 11 1.157 -18.480 0.805
73 HG SER 11 HG SER 11 3.157 -18.382 -0.492
74 H ILE 12 H ILE 12 -0.787 -16.778 1.355
75 HA ILE 12 HA ILE 12 -0.566 -15.002 -0.930
76 HB ILE 12 HB ILE 12 -3.009 -15.931 0.676
77 HG12 ILE 12 HG12 ILE 12 -1.825 -17.803 -0.520
78 HG13 ILE 12 HG13 ILE 12 -3.476 -17.515 -1.091
79 HG21 ILE 12 HG21 ILE 12 -2.888 -14.290 -1.919
80 HG22 ILE 12 HG22 ILE 12 -4.351 -15.159 -1.360
81 HG23 ILE 12 HG23 ILE 12 -3.655 -13.853 -0.370
82 HD11 ILE 12 HD11 ILE 12 -0.905 -16.632 -2.568
83 HD12 ILE 12 HD12 ILE 12 -1.947 -18.016 -2.964
84 HD13 ILE 12 HD13 ILE 12 -2.581 -16.363 -3.139
85 H ALA 13 H ALA 13 -1.682 -14.583 2.531
86 HA ALA 13 HA ALA 13 -2.606 -11.960 2.156
87 HB1 ALA 13 HB1 ALA 13 -3.013 -13.269 4.252
88 HB2 ALA 13 HB2 ALA 13 -1.300 -13.079 4.719
89 HB3 ALA 13 HB3 ALA 13 -2.357 -11.643 4.599
90 H MET 14 H MET 14 0.734 -12.955 3.380
91 HA MET 14 HA MET 14 1.644 -10.314 3.540
92 HB2 MET 14 HB2 MET 14 3.919 -11.133 3.582
93 HB3 MET 14 HB3 MET 14 2.890 -12.282 4.475
94 HG2 MET 14 HG2 MET 14 2.876 -13.797 2.444
95 HG3 MET 14 HG3 MET 14 3.915 -12.622 1.573
96 HE1 MET 14 HE1 MET 14 5.870 -14.035 0.982
97 HE2 MET 14 HE2 MET 14 6.635 -15.238 2.067
98 HE3 MET 14 HE3 MET 14 4.937 -15.464 1.535
99 H ASP 15 H ASP 15 1.520 -12.516 0.633
100 HA ASP 15 HA ASP 15 3.249 -10.914 -0.961
101 HB2 ASP 15 HB2 ASP 15 2.627 -13.225 -1.611
102 HB3 ASP 15 HB3 ASP 15 0.932 -12.745 -1.844
103 H LYS 16 H LYS 16 -0.406 -10.966 -0.721
104 HA LYS 16 HA LYS 16 -0.679 -8.839 -2.666
105 HB2 LYS 16 HB2 LYS 16 -2.622 -9.809 -0.475
106 HB3 LYS 16 HB3 LYS 16 -3.001 -8.600 -1.734
107 HG2 LYS 16 HG2 LYS 16 -2.628 -10.273 -3.535
108 HG3 LYS 16 HG3 LYS 16 -2.070 -11.483 -2.368
109 HD2 LYS 16 HD2 LYS 16 -4.396 -11.946 -3.071
110 HD3 LYS 16 HD3 LYS 16 -4.269 -11.652 -1.317
111 HE2 LYS 16 HE2 LYS 16 -6.301 -10.623 -2.259
112 HE3 LYS 16 HE3 LYS 16 -5.242 -9.371 -1.582
113 HZ1 LYS 16 HZ1 LYS 16 -6.258 -8.848 -3.861
114 HZ2 LYS 16 HZ2 LYS 16 -4.522 -8.764 -3.858
115 H ILE 17 H ILE 17 -0.529 -8.975 0.965
116 HA ILE 17 HA ILE 17 -1.211 -6.265 1.373
117 HB ILE 17 HB ILE 17 0.562 -8.149 3.002
118 HG12 ILE 17 HG12 ILE 17 -2.194 -6.937 3.687
119 HG13 ILE 17 HG13 ILE 17 -2.043 -8.457 2.789
120 HG21 ILE 17 HG21 ILE 17 -0.225 -5.250 3.681
121 HG22 ILE 17 HG22 ILE 17 0.463 -6.389 4.866
122 HG23 ILE 17 HG23 ILE 17 1.432 -5.895 3.478
123 HD11 ILE 17 HD11 ILE 17 -0.779 -9.504 4.692
124 HD12 ILE 17 HD12 ILE 17 -1.000 -8.018 5.655
125 HD13 ILE 17 HD13 ILE 17 -2.417 -8.963 5.156
126 H HIS 18 H HIS 18 2.031 -7.780 0.574
127 HA HIS 18 HA HIS 18 3.578 -5.583 1.174
128 HB2 HIS 18 HB2 HIS 18 4.606 -7.666 0.451
129 HB3 HIS 18 HB3 HIS 18 3.964 -7.493 -1.204
130 HD1 HIS 18 HD1 HIS 18 5.061 -5.675 -2.691
131 HD2 HIS 18 HD2 HIS 18 6.682 -6.019 1.175
132 HE1 HIS 18 HE1 HIS 18 7.215 -4.347 -2.734
133 H GLN 19 H GLN 19 1.952 -6.055 -2.122
134 HA GLN 19 HA GLN 19 2.930 -3.531 -3.062
135 HB2 GLN 19 HB2 GLN 19 2.020 -5.051 -4.711
136 HB3 GLN 19 HB3 GLN 19 0.429 -5.119 -3.906
137 HG2 GLN 19 HG2 GLN 19 -0.071 -2.779 -4.471
138 HG3 GLN 19 HG3 GLN 19 1.595 -2.487 -5.015
139 HE21 GLN 19 HE21 GLN 19 2.279 -3.356 -7.149
140 HE22 GLN 19 HE22 GLN 19 1.093 -3.945 -8.254
141 H GLN 20 H GLN 20 -0.236 -4.466 -1.471
142 HA GLN 20 HA GLN 20 -1.355 -1.908 -1.607
143 HB2 GLN 20 HB2 GLN 20 -2.593 -3.954 -0.833
144 HB3 GLN 20 HB3 GLN 20 -1.688 -3.925 0.707
145 HG2 GLN 20 HG2 GLN 20 -2.683 -1.750 1.316
146 HG3 GLN 20 HG3 GLN 20 -3.441 -1.598 -0.298
147 HE21 GLN 20 HE21 GLN 20 -5.397 -1.229 1.269
148 HE22 GLN 20 HE22 GLN 20 -6.267 -2.655 1.701
149 H ASP 21 H ASP 21 1.074 -3.214 0.747
150 HA ASP 21 HA ASP 21 0.724 -1.061 2.594
151 HB2 ASP 21 HB2 ASP 21 1.746 -3.180 3.328
152 HB3 ASP 21 HB3 ASP 21 3.111 -2.955 2.201
153 H PHE 22 H PHE 22 3.212 -1.715 -0.068
154 HA PHE 22 HA PHE 22 4.652 0.684 0.343
155 HB2 PHE 22 HB2 PHE 22 5.465 -0.982 -1.311
156 HB3 PHE 22 HB3 PHE 22 4.026 -0.737 -2.323
157 HD1 PHE 22 HD1 PHE 22 7.141 0.913 -1.052
158 HD2 PHE 22 HD2 PHE 22 3.813 1.257 -3.759
159 HE1 PHE 22 HE1 PHE 22 8.230 2.843 -2.149
160 HE2 PHE 22 HE2 PHE 22 4.911 3.179 -4.860
161 HZ PHE 22 HZ PHE 22 7.100 4.009 -4.028
162 H VAL 23 H VAL 23 1.644 0.026 -1.604
163 HA VAL 23 HA VAL 23 1.476 2.713 -2.598
164 HB VAL 23 HB VAL 23 -0.667 0.549 -2.211
165 HG11 VAL 23 HG11 VAL 23 -2.136 1.987 -3.691
166 HG12 VAL 23 HG12 VAL 23 -1.838 2.720 -2.098
167 HG13 VAL 23 HG13 VAL 23 -0.953 3.317 -3.534
168 HG21 VAL 23 HG21 VAL 23 -0.509 0.354 -4.704
169 HG22 VAL 23 HG22 VAL 23 0.712 1.655 -4.752
170 HG23 VAL 23 HG23 VAL 23 1.100 0.093 -3.986
171 H ASN 24 H ASN 24 0.333 1.167 0.520
172 HA ASN 24 HA ASN 24 -1.209 3.408 1.246
173 HB2 ASN 24 HB2 ASN 24 0.066 1.246 2.953
174 HB3 ASN 24 HB3 ASN 24 -0.478 2.736 3.733
175 HD21 ASN 24 HD21 ASN 24 -2.051 0.803 0.992
176 HD22 ASN 24 HD22 ASN 24 -3.538 0.674 1.851
177 H TRP 25 H TRP 25 2.425 3.022 1.323
178 HA TRP 25 HA TRP 25 2.744 5.375 2.933
179 HB2 TRP 25 HB2 TRP 25 4.722 3.974 2.482
180 HB3 TRP 25 HB3 TRP 25 4.620 4.333 0.732
181 HD1 TRP 25 HD1 TRP 25 5.177 6.213 4.108
182 HE1 TRP 25 HE1 TRP 25 6.357 8.393 3.634
183 HE3 TRP 25 HE3 TRP 25 5.205 6.063 -1.072
184 HZ2 TRP 25 HZ2 TRP 25 7.211 9.887 1.502
185 HZ3 TRP 25 HZ3 TRP 25 6.384 7.934 -2.265
186 HH2 TRP 25 HH2 TRP 25 7.326 9.832 -0.996
187 H LEU 26 H LEU 26 2.076 4.905 -0.644
188 HA LEU 26 HA LEU 26 2.464 7.670 -1.245
189 HB2 LEU 26 HB2 LEU 26 0.483 5.740 -2.571
190 HB3 LEU 26 HB3 LEU 26 0.894 7.349 -3.187
191 HG LEU 26 HG LEU 26 2.961 5.081 -2.867
192 HD11 LEU 26 HD11 LEU 26 2.743 4.778 -5.340
193 HD12 LEU 26 HD12 LEU 26 1.184 4.461 -4.539
194 HD13 LEU 26 HD13 LEU 26 1.450 6.010 -5.388
195 HD21 LEU 26 HD21 LEU 26 4.003 7.394 -2.937
196 HD22 LEU 26 HD22 LEU 26 4.360 6.468 -4.404
197 HD23 LEU 26 HD23 LEU 26 3.108 7.740 -4.437
198 H LEU 27 H LEU 27 -0.587 5.870 -0.144
199 HA LEU 27 HA LEU 27 -2.073 8.269 -0.405
200 HB2 LEU 27 HB2 LEU 27 -3.940 7.304 0.674
201 HB3 LEU 27 HB3 LEU 27 -3.118 6.045 -0.272
202 HG LEU 27 HG LEU 27 -1.998 5.418 2.041
203 HD11 LEU 27 HD11 LEU 27 -4.452 6.901 3.122
204 HD12 LEU 27 HD12 LEU 27 -3.377 5.831 4.064
205 HD13 LEU 27 HD13 LEU 27 -2.760 7.365 3.434
206 HD21 LEU 27 HD21 LEU 27 -4.980 4.876 1.534
207 HD22 LEU 27 HD22 LEU 27 -3.626 3.933 0.850
208 HD23 LEU 27 HD23 LEU 27 -3.932 3.900 2.604
209 H ALA 28 H ALA 28 0.105 7.133 2.246
210 HA ALA 28 HA ALA 28 -0.735 9.004 4.190
211 HB1 ALA 28 HB1 ALA 28 1.573 8.937 5.092
212 HB2 ALA 28 HB2 ALA 28 1.045 7.287 4.646
213 HB3 ALA 28 HB3 ALA 28 2.185 8.182 3.604
214 H GLN 29 H GLN 29 1.540 9.391 1.345
215 HA GLN 29 HA GLN 29 2.158 12.127 1.920
216 HB2 GLN 29 HB2 GLN 29 1.956 10.846 -0.886
217 HB3 GLN 29 HB3 GLN 29 2.736 12.390 -0.472
218 HG2 GLN 29 HG2 GLN 29 3.693 9.574 0.373
219 HG3 GLN 29 HG3 GLN 29 4.438 10.665 -0.801
220 HE21 GLN 29 HE21 GLN 29 3.897 10.113 2.740
221 HE22 GLN 29 HE22 GLN 29 5.076 11.270 3.233
222 H LYS 30 H LYS 30 -0.523 10.564 -0.037
223 HA LYS 30 HA LYS 30 -1.516 13.063 -0.965
224 HB2 LYS 30 HB2 LYS 30 -3.120 10.481 -0.536
225 HB3 LYS 30 HB3 LYS 30 -3.694 11.948 -1.365
226 HG2 LYS 30 HG2 LYS 30 -1.888 11.748 -3.084
227 HG3 LYS 30 HG3 LYS 30 -1.251 10.294 -2.278
228 HD2 LYS 30 HD2 LYS 30 -2.562 9.657 -4.239
229 HD3 LYS 30 HD3 LYS 30 -3.353 9.040 -2.765
230 HE2 LYS 30 HE2 LYS 30 -5.103 10.786 -2.921
231 HE3 LYS 30 HE3 LYS 30 -4.182 11.648 -4.194
232 HZ1 LYS 30 HZ1 LYS 30 -5.332 8.856 -4.521
233 HZ2 LYS 30 HZ2 LYS 30 -5.989 10.340 -5.207
234 H GLY 31 H GLY 31 -2.051 11.257 2.161
235 HA2 GLY 31 HA2 GLY 31 -4.265 12.791 3.034
236 HA3 GLY 31 HA3 GLY 31 -3.052 12.057 4.115
237 H LYS 32 H LYS 32 -0.645 13.386 3.429
238 HA LYS 32 HA LYS 32 -0.972 15.839 4.818
239 HB2 LYS 32 HB2 LYS 32 1.263 14.800 4.633
240 HB3 LYS 32 HB3 LYS 32 1.281 15.045 2.867
241 HG2 LYS 32 HG2 LYS 32 1.180 17.533 3.187
242 HG3 LYS 32 HG3 LYS 32 1.125 17.310 4.957
243 HD2 LYS 32 HD2 LYS 32 3.416 16.276 4.893
244 HD3 LYS 32 HD3 LYS 32 3.450 16.448 3.114
245 HE2 LYS 32 HE2 LYS 32 3.225 18.951 3.359
246 HE3 LYS 32 HE3 LYS 32 3.270 18.775 5.139
247 HZ1 LYS 32 HZ1 LYS 32 5.492 19.352 4.161
248 HZ2 LYS 32 HZ2 LYS 32 5.551 17.758 4.900
249 H LYS 33 H LYS 33 -0.677 15.150 1.230
250 HA LYS 33 HA LYS 33 -0.796 17.794 0.357
251 HB2 LYS 33 HB2 LYS 33 -0.474 15.788 -1.124
252 HB3 LYS 33 HB3 LYS 33 -2.213 15.399 -0.959
253 HG2 LYS 33 HG2 LYS 33 -2.768 17.675 -1.948
254 HG3 LYS 33 HG3 LYS 33 -1.029 17.918 -2.264
255 HD2 LYS 33 HD2 LYS 33 -2.829 15.675 -3.420
256 HD3 LYS 33 HD3 LYS 33 -2.255 17.127 -4.281
257 HE2 LYS 33 HE2 LYS 33 0.152 16.309 -3.935
258 HE3 LYS 33 HE3 LYS 33 -0.505 14.780 -3.285
259 HZ1 LYS 33 HZ1 LYS 33 -1.671 14.376 -5.417
260 HZ2 LYS 33 HZ2 LYS 33 -0.995 15.869 -6.073
261 H ASN 34 H ASN 34 -3.564 15.565 1.247
262 HA ASN 34 HA ASN 34 -5.425 17.889 0.968
263 HB2 ASN 34 HB2 ASN 34 -5.943 15.778 -0.262
264 HB3 ASN 34 HB3 ASN 34 -6.033 14.901 1.290
265 HD21 ASN 34 HD21 ASN 34 -8.288 14.831 -0.361
266 HD22 ASN 34 HD22 ASN 34 -9.519 15.839 0.306
267 H ASP 35 H ASP 35 -3.824 18.469 3.016
268 HA ASP 35 HA ASP 35 -4.738 17.337 5.512
269 HB2 ASP 35 HB2 ASP 35 -3.817 19.397 6.577
270 HB3 ASP 35 HB3 ASP 35 -2.647 18.636 5.470
271 H TRP 36 H TRP 36 -5.794 20.155 3.418
272 HA TRP 36 HA TRP 36 -8.502 19.801 4.513
273 HB2 TRP 36 HB2 TRP 36 -7.470 21.319 6.210
274 HB3 TRP 36 HB3 TRP 36 -6.993 22.452 4.917
275 HD1 TRP 36 HD1 TRP 36 -10.226 20.855 6.426
276 HE1 TRP 36 HE1 TRP 36 -12.167 22.422 6.062
277 HE3 TRP 36 HE3 TRP 36 -7.836 24.580 3.715
278 HZ2 TRP 36 HZ2 TRP 36 -12.740 24.781 4.796
279 HZ3 TRP 36 HZ3 TRP 36 -9.224 26.525 2.976
280 HH2 TRP 36 HH2 TRP 36 -11.651 26.591 3.451
281 H LYS 37 H LYS 37 -7.876 19.024 2.095
282 HA LYS 37 HA LYS 37 -8.748 21.288 0.294
283 HB2 LYS 37 HB2 LYS 37 -6.436 20.313 -0.043
284 HB3 LYS 37 HB3 LYS 37 -7.195 18.739 -0.426
285 HG2 LYS 37 HG2 LYS 37 -8.503 19.914 -2.298
286 HG3 LYS 37 HG3 LYS 37 -7.540 21.379 -1.978
287 HD2 LYS 37 HD2 LYS 37 -6.454 18.621 -2.885
288 HD3 LYS 37 HD3 LYS 37 -6.629 20.081 -3.891
289 HE2 LYS 37 HE2 LYS 37 -4.947 21.266 -2.357
290 HE3 LYS 37 HE3 LYS 37 -4.694 19.701 -1.520
291 HZ1 LYS 37 HZ1 LYS 37 -4.187 20.149 -4.476
292 HZ2 LYS 37 HZ2 LYS 37 -2.980 19.986 -3.220
293 H HIS 38 H HIS 38 -10.799 20.502 1.677
294 HA HIS 38 HA HIS 38 -12.866 19.484 1.557
295 HB2 HIS 38 HB2 HIS 38 -12.698 20.517 -0.735
296 HB3 HIS 38 HB3 HIS 38 -12.100 18.973 -1.384
297 HD1 HIS 38 HD1 HIS 38 -15.109 20.522 0.234
298 HD2 HIS 38 HD2 HIS 38 -13.954 16.996 -1.744
299 HE1 HIS 38 HE1 HIS 38 -17.253 19.278 -0.236
300 H ASN 39 H ASN 39 -12.176 17.749 3.095
301 HA ASN 39 HA ASN 39 -11.457 15.150 1.785
302 HB2 ASN 39 HB2 ASN 39 -11.617 15.916 4.746
303 HB3 ASN 39 HB3 ASN 39 -11.227 14.310 4.096
304 HD21 ASN 39 HD21 ASN 39 -9.997 17.731 4.337
305 HD22 ASN 39 HD22 ASN 39 -8.376 17.294 3.937
306 H ILE 40 H ILE 40 -13.612 15.018 0.644
307 HA ILE 40 HA ILE 40 -15.738 14.124 0.520
308 HB ILE 40 HB ILE 40 -15.091 12.900 3.252
309 HG12 ILE 40 HG12 ILE 40 -14.564 11.830 0.407
310 HG13 ILE 40 HG13 ILE 40 -13.325 12.441 1.533
311 HG21 ILE 40 HG21 ILE 40 -17.555 12.851 2.536
312 HG22 ILE 40 HG22 ILE 40 -17.058 11.977 1.064
313 HG23 ILE 40 HG23 ILE 40 -16.834 11.246 2.678
314 HD11 ILE 40 HD11 ILE 40 -13.975 10.611 3.191
315 HD12 ILE 40 HD12 ILE 40 -15.041 9.911 1.930
316 HD13 ILE 40 HD13 ILE 40 -13.288 10.013 1.650
317 H THR 41 H THR 41 -16.820 16.242 0.563
318 HA THR 41 HA THR 41 -18.204 17.849 1.526
319 HB THR 41 HB THR 41 -20.044 16.954 2.818
320 HG1 THR 41 HG1 THR 41 -19.858 14.757 3.698
321 HG21 THR 41 HG21 THR 41 -20.741 15.051 1.331
322 HG22 THR 41 HG22 THR 41 -19.912 16.305 0.363
323 HG23 THR 41 HG23 THR 41 -19.050 14.802 0.818
324 H GLN 42 H GLN 42 -15.578 18.049 2.416
325 HA GLN 42 HA GLN 42 -14.294 18.797 4.199
326 HB2 GLN 42 HB2 GLN 42 -17.011 20.031 4.987
327 HB3 GLN 42 HB3 GLN 42 -15.402 20.558 5.554
328 HG2 GLN 42 HG2 GLN 42 -14.768 21.094 3.142
329 HG3 GLN 42 HG3 GLN 42 -16.395 20.583 2.622
330 HE21 GLN 42 HE21 GLN 42 -14.727 22.908 4.929
331 HE22 GLN 42 HE22 GLN 42 -15.938 24.128 4.777
Start of MODEL 3
1 H1 TYR 1 H1 TYR 1 6.066 -23.001 0.970
2 HA TYR 1 HA TYR 1 8.318 -23.373 2.891
3 HB2 TYR 1 HB2 TYR 1 5.671 -21.873 3.313
4 HB3 TYR 1 HB3 TYR 1 6.972 -22.016 4.524
5 HD1 TYR 1 HD2 TYR 1 9.382 -21.175 3.694
6 HD2 TYR 1 HD1 TYR 1 5.667 -19.939 1.907
7 HE1 TYR 1 HE2 TYR 1 10.450 -19.096 2.881
8 HE2 TYR 1 HE1 TYR 1 6.711 -17.847 1.161
9 HH TYR 1 HH TYR 1 8.714 -16.538 1.097
10 H ALA 2 H ALA 2 7.464 -25.709 1.912
11 HA ALA 2 HA ALA 2 6.566 -27.739 2.521
12 HB1 ALA 2 HB1 ALA 2 6.283 -28.213 4.921
13 HB2 ALA 2 HB2 ALA 2 7.717 -27.178 4.687
14 HB3 ALA 2 HB3 ALA 2 6.198 -26.482 5.315
15 H GLU 3 H GLU 3 4.470 -28.881 3.426
16 HA GLU 3 HA GLU 3 2.219 -27.492 2.227
17 HB2 GLU 3 HB2 GLU 3 2.375 -29.984 2.223
18 HB3 GLU 3 HB3 GLU 3 2.279 -30.004 4.005
19 HG2 GLU 3 HG2 GLU 3 -0.038 -29.061 3.926
20 HG3 GLU 3 HG3 GLU 3 0.069 -28.898 2.151
21 H GLY 4 H GLY 4 0.369 -26.539 3.465
22 HA2 GLY 4 HA2 GLY 4 -0.027 -26.822 6.197
23 HA3 GLY 4 HA3 GLY 4 1.109 -25.454 6.070
24 H THR 5 H THR 5 -2.330 -26.293 5.743
25 HA THR 5 HA THR 5 -3.036 -24.396 3.795
26 HB THR 5 HB THR 5 -4.649 -25.185 6.289
27 HG1 THR 5 HG1 THR 5 -5.445 -26.826 4.773
28 HG21 THR 5 HG21 THR 5 -5.639 -23.173 5.101
29 HG22 THR 5 HG22 THR 5 -5.573 -24.070 3.553
30 HG23 THR 5 HG23 THR 5 -6.658 -24.617 4.860
31 H PHE 6 H PHE 6 -2.584 -23.963 7.416
32 HA PHE 6 HA PHE 6 -3.463 -21.258 7.412
33 HB2 PHE 6 HB2 PHE 6 -3.051 -22.499 9.545
34 HB3 PHE 6 HB3 PHE 6 -1.307 -22.552 9.200
35 HD1 PHE 6 HD2 PHE 6 0.059 -20.445 9.220
36 HD2 PHE 6 HD1 PHE 6 -4.121 -20.382 10.259
37 HE1 PHE 6 HE2 PHE 6 0.309 -18.147 10.094
38 HE2 PHE 6 HE1 PHE 6 -3.842 -18.116 11.218
39 HZ PHE 6 HZ PHE 6 -1.625 -16.994 11.147
40 H ILE 7 H ILE 7 -0.183 -22.756 6.782
41 HA ILE 7 HA ILE 7 1.134 -20.203 6.778
42 HB ILE 7 HB ILE 7 2.006 -22.763 5.332
43 HG12 ILE 7 HG12 ILE 7 3.010 -21.590 8.008
44 HG13 ILE 7 HG13 ILE 7 1.835 -22.917 7.889
45 HG21 ILE 7 HG21 ILE 7 3.062 -20.709 4.322
46 HG22 ILE 7 HG22 ILE 7 3.577 -20.166 5.943
47 HG23 ILE 7 HG23 ILE 7 4.266 -21.640 5.218
48 HD11 ILE 7 HD11 ILE 7 3.967 -23.949 8.285
49 HD12 ILE 7 HD12 ILE 7 3.549 -24.290 6.583
50 HD13 ILE 7 HD13 ILE 7 4.771 -23.048 6.985
51 H SER 8 H SER 8 -0.259 -22.316 4.105
52 HA SER 8 HA SER 8 0.419 -20.602 2.017
53 HB2 SER 8 HB2 SER 8 -2.212 -22.185 2.224
54 HB3 SER 8 HB3 SER 8 -1.419 -21.588 0.730
55 HG SER 8 HG SER 8 -0.812 -23.846 1.238
56 H ASP 9 H ASP 9 -2.580 -20.503 4.159
57 HA ASP 9 HA ASP 9 -3.823 -18.395 2.778
58 HB2 ASP 9 HB2 ASP 9 -5.032 -19.549 4.570
59 HB3 ASP 9 HB3 ASP 9 -3.848 -19.031 5.794
60 H TYR 10 H TYR 10 -1.421 -18.192 5.569
61 HA TYR 10 HA TYR 10 -1.482 -15.338 5.498
62 HB2 TYR 10 HB2 TYR 10 -0.575 -16.480 7.502
63 HB3 TYR 10 HB3 TYR 10 0.730 -17.216 6.541
64 HD1 TYR 10 HD2 TYR 10 -0.806 -13.837 7.295
65 HD2 TYR 10 HD1 TYR 10 2.815 -15.977 6.361
66 HE1 TYR 10 HE2 TYR 10 0.478 -11.756 7.535
67 HE2 TYR 10 HE1 TYR 10 4.108 -13.895 6.657
68 HH TYR 10 HH TYR 10 2.635 -10.726 7.244
69 H SER 11 H SER 11 0.854 -17.725 4.017
70 HA SER 11 HA SER 11 2.653 -15.976 2.911
71 HB2 SER 11 HB2 SER 11 2.807 -18.466 2.690
72 HB3 SER 11 HB3 SER 11 1.503 -18.418 1.457
73 HG SER 11 HG SER 11 3.681 -18.291 0.479
74 H ILE 12 H ILE 12 -0.653 -16.854 1.628
75 HA ILE 12 HA ILE 12 -0.316 -15.263 -0.759
76 HB ILE 12 HB ILE 12 -2.844 -16.201 0.705
77 HG12 ILE 12 HG12 ILE 12 -1.452 -18.025 -0.364
78 HG13 ILE 12 HG13 ILE 12 -3.099 -17.871 -1.008
79 HG21 ILE 12 HG21 ILE 12 -4.060 -15.541 -1.437
80 HG22 ILE 12 HG22 ILE 12 -3.495 -14.164 -0.457
81 HG23 ILE 12 HG23 ILE 12 -2.589 -14.634 -1.918
82 HD11 ILE 12 HD11 ILE 12 -2.192 -16.729 -3.059
83 HD12 ILE 12 HD12 ILE 12 -0.532 -16.858 -2.408
84 HD13 ILE 12 HD13 ILE 12 -1.453 -18.323 -2.801
85 H ALA 13 H ALA 13 -1.929 -14.565 2.472
86 HA ALA 13 HA ALA 13 -2.802 -12.023 1.743
87 HB1 ALA 13 HB1 ALA 13 -3.449 -13.034 3.905
88 HB2 ALA 13 HB2 ALA 13 -1.790 -12.857 4.539
89 HB3 ALA 13 HB3 ALA 13 -2.758 -11.402 4.159
90 H MET 14 H MET 14 0.375 -12.721 3.485
91 HA MET 14 HA MET 14 1.207 -10.053 3.310
92 HB2 MET 14 HB2 MET 14 3.463 -10.764 3.836
93 HB3 MET 14 HB3 MET 14 2.275 -11.735 4.733
94 HG2 MET 14 HG2 MET 14 3.990 -13.275 4.004
95 HG3 MET 14 HG3 MET 14 2.594 -13.578 2.937
96 HE1 MET 14 HE1 MET 14 4.209 -14.805 1.035
97 HE2 MET 14 HE2 MET 14 5.785 -14.104 0.564
98 HE3 MET 14 HE3 MET 14 5.519 -14.650 2.251
99 H ASP 15 H ASP 15 1.411 -12.679 0.810
100 HA ASP 15 HA ASP 15 3.333 -11.269 -0.762
101 HB2 ASP 15 HB2 ASP 15 2.976 -13.686 -1.074
102 HB3 ASP 15 HB3 ASP 15 1.315 -13.407 -1.652
103 H LYS 16 H LYS 16 -0.364 -11.504 -1.219
104 HA LYS 16 HA LYS 16 -0.319 -9.661 -3.385
105 HB2 LYS 16 HB2 LYS 16 -2.560 -9.919 -1.271
106 HB3 LYS 16 HB3 LYS 16 -2.641 -9.006 -2.799
107 HG2 LYS 16 HG2 LYS 16 -2.090 -11.279 -4.000
108 HG3 LYS 16 HG3 LYS 16 -2.495 -12.050 -2.441
109 HD2 LYS 16 HD2 LYS 16 -4.764 -10.841 -2.519
110 HD3 LYS 16 HD3 LYS 16 -4.319 -10.217 -4.130
111 HE2 LYS 16 HE2 LYS 16 -5.701 -12.186 -4.518
112 HE3 LYS 16 HE3 LYS 16 -4.023 -12.653 -4.905
113 HZ1 LYS 16 HZ1 LYS 16 -5.508 -13.241 -2.316
114 HZ2 LYS 16 HZ2 LYS 16 -5.023 -14.401 -3.537
115 H ILE 17 H ILE 17 -0.494 -9.164 0.196
116 HA ILE 17 HA ILE 17 -1.120 -6.420 0.064
117 HB ILE 17 HB ILE 17 0.291 -8.091 2.194
118 HG12 ILE 17 HG12 ILE 17 -2.487 -6.731 2.178
119 HG13 ILE 17 HG13 ILE 17 -2.219 -8.411 1.682
120 HG21 ILE 17 HG21 ILE 17 -0.422 -5.114 2.400
121 HG22 ILE 17 HG22 ILE 17 0.058 -6.136 3.786
122 HG23 ILE 17 HG23 ILE 17 1.216 -5.849 2.495
123 HD11 ILE 17 HD11 ILE 17 -1.303 -8.931 4.007
124 HD12 ILE 17 HD12 ILE 17 -1.807 -7.293 4.519
125 HD13 ILE 17 HD13 ILE 17 -3.024 -8.457 3.963
126 H HIS 18 H HIS 18 2.188 -7.956 -0.290
127 HA HIS 18 HA HIS 18 3.502 -5.720 0.629
128 HB2 HIS 18 HB2 HIS 18 5.550 -6.429 -0.378
129 HB3 HIS 18 HB3 HIS 18 4.676 -7.835 0.274
130 HD1 HIS 18 HD1 HIS 18 6.823 -8.458 -1.489
131 HD2 HIS 18 HD2 HIS 18 3.000 -7.573 -3.001
132 HE1 HIS 18 HE1 HIS 18 6.717 -9.523 -3.776
133 H GLN 19 H GLN 19 1.768 -5.677 -2.460
134 HA GLN 19 HA GLN 19 3.353 -3.295 -3.286
135 HB2 GLN 19 HB2 GLN 19 0.845 -4.515 -4.586
136 HB3 GLN 19 HB3 GLN 19 1.778 -3.106 -5.158
137 HG2 GLN 19 HG2 GLN 19 3.820 -4.628 -5.407
138 HG3 GLN 19 HG3 GLN 19 2.808 -6.004 -4.904
139 HE21 GLN 19 HE21 GLN 19 2.923 -3.299 -7.400
140 HE22 GLN 19 HE22 GLN 19 2.165 -4.241 -8.632
141 H GLN 20 H GLN 20 -0.105 -4.174 -2.327
142 HA GLN 20 HA GLN 20 -1.053 -1.576 -2.260
143 HB2 GLN 20 HB2 GLN 20 -2.471 -3.650 -1.873
144 HB3 GLN 20 HB3 GLN 20 -1.738 -3.820 -0.255
145 HG2 GLN 20 HG2 GLN 20 -3.993 -2.764 -0.127
146 HG3 GLN 20 HG3 GLN 20 -2.718 -1.668 0.452
147 HE21 GLN 20 HE21 GLN 20 -4.393 0.102 0.064
148 HE22 GLN 20 HE22 GLN 20 -4.601 0.679 -1.547
149 H ASP 21 H ASP 21 0.960 -3.273 0.242
150 HA ASP 21 HA ASP 21 0.641 -1.244 2.227
151 HB2 ASP 21 HB2 ASP 21 1.581 -3.432 2.820
152 HB3 ASP 21 HB3 ASP 21 2.981 -3.182 1.739
153 H PHE 22 H PHE 22 3.159 -1.617 -0.468
154 HA PHE 22 HA PHE 22 4.600 0.711 0.382
155 HB2 PHE 22 HB2 PHE 22 5.607 -0.718 -1.335
156 HB3 PHE 22 HB3 PHE 22 4.233 -0.461 -2.432
157 HD1 PHE 22 HD2 PHE 22 7.016 1.373 -0.643
158 HD2 PHE 22 HD1 PHE 22 4.169 1.479 -3.871
159 HE1 PHE 22 HE2 PHE 22 8.077 3.432 -1.515
160 HE2 PHE 22 HE1 PHE 22 5.270 3.499 -4.772
161 HZ PHE 22 HZ PHE 22 7.204 4.502 -3.580
162 H VAL 23 H VAL 23 1.628 0.281 -1.676
163 HA VAL 23 HA VAL 23 1.472 3.069 -2.362
164 HB VAL 23 HB VAL 23 -0.719 0.932 -2.247
165 HG11 VAL 23 HG11 VAL 23 -0.832 3.775 -3.430
166 HG12 VAL 23 HG12 VAL 23 -2.053 2.503 -3.710
167 HG13 VAL 23 HG13 VAL 23 -1.813 3.148 -2.073
168 HG21 VAL 23 HG21 VAL 23 1.170 0.563 -3.974
169 HG22 VAL 23 HG22 VAL 23 -0.432 0.813 -4.700
170 HG23 VAL 23 HG23 VAL 23 0.757 2.144 -4.678
171 H ASN 24 H ASN 24 0.464 1.257 0.635
172 HA ASN 24 HA ASN 24 -1.259 3.255 1.658
173 HB2 ASN 24 HB2 ASN 24 0.659 1.396 3.174
174 HB3 ASN 24 HB3 ASN 24 -0.226 2.693 3.976
175 HD21 ASN 24 HD21 ASN 24 -1.513 0.332 1.403
176 HD22 ASN 24 HD22 ASN 24 -2.731 -0.229 2.479
177 H TRP 25 H TRP 25 2.396 3.196 1.382
178 HA TRP 25 HA TRP 25 2.672 5.563 2.968
179 HB2 TRP 25 HB2 TRP 25 4.641 4.148 2.472
180 HB3 TRP 25 HB3 TRP 25 4.550 4.565 0.736
181 HD1 TRP 25 HD1 TRP 25 5.170 6.232 4.182
182 HE1 TRP 25 HE1 TRP 25 6.366 8.429 3.836
183 HE3 TRP 25 HE3 TRP 25 5.045 6.475 -0.993
184 HZ2 TRP 25 HZ2 TRP 25 7.209 10.047 1.801
185 HZ3 TRP 25 HZ3 TRP 25 6.191 8.438 -2.076
186 HH2 TRP 25 HH2 TRP 25 7.241 10.193 -0.695
187 H LEU 26 H LEU 26 2.107 5.086 -0.640
188 HA LEU 26 HA LEU 26 2.404 7.884 -1.214
189 HB2 LEU 26 HB2 LEU 26 0.522 5.862 -2.571
190 HB3 LEU 26 HB3 LEU 26 0.852 7.498 -3.186
191 HG LEU 26 HG LEU 26 3.008 5.316 -2.870
192 HD11 LEU 26 HD11 LEU 26 1.295 4.675 -4.603
193 HD12 LEU 26 HD12 LEU 26 1.532 6.251 -5.410
194 HD13 LEU 26 HD13 LEU 26 2.864 5.058 -5.351
195 HD21 LEU 26 HD21 LEU 26 3.977 7.656 -2.875
196 HD22 LEU 26 HD22 LEU 26 4.378 6.790 -4.367
197 HD23 LEU 26 HD23 LEU 26 3.082 8.019 -4.368
198 H LEU 27 H LEU 27 -0.482 5.890 -0.191
199 HA LEU 27 HA LEU 27 -2.314 7.997 -0.282
200 HB2 LEU 27 HB2 LEU 27 -3.041 5.692 0.277
201 HB3 LEU 27 HB3 LEU 27 -2.062 5.701 1.757
202 HG LEU 27 HG LEU 27 -3.518 7.528 2.736
203 HD11 LEU 27 HD11 LEU 27 -5.772 7.924 1.545
204 HD12 LEU 27 HD12 LEU 27 -4.380 8.622 0.694
205 HD13 LEU 27 HD13 LEU 27 -5.099 7.089 0.120
206 HD21 LEU 27 HD21 LEU 27 -5.462 6.074 3.221
207 HD22 LEU 27 HD22 LEU 27 -4.990 4.975 1.890
208 HD23 LEU 27 HD23 LEU 27 -3.929 5.170 3.316
209 H ALA 28 H ALA 28 0.042 7.056 2.338
210 HA ALA 28 HA ALA 28 -0.902 8.872 4.252
211 HB1 ALA 28 HB1 ALA 28 1.319 8.666 5.352
212 HB2 ALA 28 HB2 ALA 28 0.754 7.069 4.767
213 HB3 ALA 28 HB3 ALA 28 2.022 7.956 3.873
214 H GLN 29 H GLN 29 1.412 9.430 1.488
215 HA GLN 29 HA GLN 29 2.104 12.096 2.311
216 HB2 GLN 29 HB2 GLN 29 1.841 11.053 -0.587
217 HB3 GLN 29 HB3 GLN 29 2.631 12.560 -0.063
218 HG2 GLN 29 HG2 GLN 29 3.566 9.673 0.519
219 HG3 GLN 29 HG3 GLN 29 4.347 10.875 -0.512
220 HE21 GLN 29 HE21 GLN 29 3.782 9.879 2.909
221 HE22 GLN 29 HE22 GLN 29 4.908 11.001 3.573
222 H LYS 30 H LYS 30 -0.568 10.786 0.161
223 HA LYS 30 HA LYS 30 -1.646 13.364 -0.329
224 HB2 LYS 30 HB2 LYS 30 -2.905 10.577 -0.472
225 HB3 LYS 30 HB3 LYS 30 -3.892 12.037 -0.679
226 HG2 LYS 30 HG2 LYS 30 -3.197 11.184 -2.878
227 HG3 LYS 30 HG3 LYS 30 -2.587 12.826 -2.573
228 HD2 LYS 30 HD2 LYS 30 -0.300 11.871 -2.046
229 HD3 LYS 30 HD3 LYS 30 -0.934 10.226 -2.358
230 HE2 LYS 30 HE2 LYS 30 -1.362 10.850 -4.739
231 HE3 LYS 30 HE3 LYS 30 -0.898 12.543 -4.396
232 HZ1 LYS 30 HZ1 LYS 30 0.974 10.168 -4.130
233 HZ2 LYS 30 HZ2 LYS 30 1.012 11.412 -5.381
234 H GLY 31 H GLY 31 -1.900 11.388 2.667
235 HA2 GLY 31 HA2 GLY 31 -4.139 12.645 3.803
236 HA3 GLY 31 HA3 GLY 31 -2.659 12.232 4.717
237 H LYS 32 H LYS 32 -0.666 13.785 3.669
238 HA LYS 32 HA LYS 32 -1.478 16.497 4.581
239 HB2 LYS 32 HB2 LYS 32 1.225 15.205 3.906
240 HB3 LYS 32 HB3 LYS 32 1.025 16.963 4.006
241 HG2 LYS 32 HG2 LYS 32 1.872 16.006 6.117
242 HG3 LYS 32 HG3 LYS 32 0.334 16.876 6.340
243 HD2 LYS 32 HD2 LYS 32 -0.926 14.759 6.474
244 HD3 LYS 32 HD3 LYS 32 0.518 13.804 6.031
245 HE2 LYS 32 HE2 LYS 32 1.653 14.468 8.138
246 HE3 LYS 32 HE3 LYS 32 0.278 15.519 8.589
247 HZ1 LYS 32 HZ1 LYS 32 0.219 13.240 9.676
248 HZ2 LYS 32 HZ2 LYS 32 -1.188 13.526 8.667
249 H LYS 33 H LYS 33 0.344 15.226 1.651
250 HA LYS 33 HA LYS 33 0.383 16.007 -0.489
251 HB2 LYS 33 HB2 LYS 33 -2.263 15.704 0.073
252 HB3 LYS 33 HB3 LYS 33 -2.311 17.415 -0.294
253 HG2 LYS 33 HG2 LYS 33 -1.279 15.104 -2.044
254 HG3 LYS 33 HG3 LYS 33 -2.797 15.995 -2.295
255 HD2 LYS 33 HD2 LYS 33 0.034 17.222 -2.622
256 HD3 LYS 33 HD3 LYS 33 -0.931 16.483 -3.916
257 HE2 LYS 33 HE2 LYS 33 -1.278 18.793 -4.207
258 HE3 LYS 33 HE3 LYS 33 -2.789 18.222 -3.462
259 HZ1 LYS 33 HZ1 LYS 33 -2.189 19.456 -1.430
260 HZ2 LYS 33 HZ2 LYS 33 -0.488 19.530 -1.960
261 H ASN 34 H ASN 34 2.156 17.286 0.634
262 HA ASN 34 HA ASN 34 2.939 19.508 -0.253
263 HB2 ASN 34 HB2 ASN 34 0.694 20.588 1.552
264 HB3 ASN 34 HB3 ASN 34 2.144 21.508 1.116
265 HD21 ASN 34 HD21 ASN 34 -0.846 21.933 0.340
266 HD22 ASN 34 HD22 ASN 34 -0.701 22.207 -1.354
267 H ASP 35 H ASP 35 1.640 19.109 3.157
268 HA ASP 35 HA ASP 35 2.804 18.979 5.145
269 HB2 ASP 35 HB2 ASP 35 3.578 16.846 4.078
270 HB3 ASP 35 HB3 ASP 35 5.000 17.687 3.421
271 H TRP 36 H TRP 36 2.680 21.496 4.501
272 HA TRP 36 HA TRP 36 3.774 23.556 4.674
273 HB2 TRP 36 HB2 TRP 36 4.043 22.519 6.920
274 HB3 TRP 36 HB3 TRP 36 5.603 21.817 6.435
275 HD1 TRP 36 HD1 TRP 36 3.965 25.267 7.131
276 HE1 TRP 36 HE1 TRP 36 5.779 26.925 7.680
277 HE3 TRP 36 HE3 TRP 36 8.143 22.319 6.228
278 HZ2 TRP 36 HZ2 TRP 36 8.512 27.118 7.661
279 HZ3 TRP 36 HZ3 TRP 36 10.382 23.401 6.485
280 HH2 TRP 36 HH2 TRP 36 10.561 25.772 7.168
281 H LYS 37 H LYS 37 4.205 22.949 2.226
282 HA LYS 37 HA LYS 37 7.169 23.312 1.772
283 HB2 LYS 37 HB2 LYS 37 6.572 20.882 1.568
284 HB3 LYS 37 HB3 LYS 37 5.248 21.313 0.446
285 HG2 LYS 37 HG2 LYS 37 6.996 22.298 -1.137
286 HG3 LYS 37 HG3 LYS 37 8.274 21.690 -0.055
287 HD2 LYS 37 HD2 LYS 37 7.431 19.341 -0.393
288 HD3 LYS 37 HD3 LYS 37 6.116 19.953 -1.433
289 HE2 LYS 37 HE2 LYS 37 9.133 20.154 -2.054
290 HE3 LYS 37 HE3 LYS 37 7.962 19.049 -2.818
291 HZ1 LYS 37 HZ1 LYS 37 6.693 21.136 -3.607
292 HZ2 LYS 37 HZ2 LYS 37 8.180 22.033 -3.235
293 H HIS 38 H HIS 38 6.562 25.631 1.403
294 HA HIS 38 HA HIS 38 5.418 27.358 0.284
295 HB2 HIS 38 HB2 HIS 38 7.383 26.959 -1.123
296 HB3 HIS 38 HB3 HIS 38 6.579 25.585 -1.925
297 HD1 HIS 38 HD1 HIS 38 5.938 29.317 -1.431
298 HD2 HIS 38 HD2 HIS 38 5.330 26.200 -4.187
299 HE1 HIS 38 HE1 HIS 38 4.855 30.391 -3.451
300 H ASN 39 H ASN 39 3.501 25.772 1.347
301 HA ASN 39 HA ASN 39 1.679 24.857 -0.759
302 HB2 ASN 39 HB2 ASN 39 1.575 23.857 1.504
303 HB3 ASN 39 HB3 ASN 39 1.146 25.431 2.212
304 HD21 ASN 39 HD21 ASN 39 -0.705 23.646 2.843
305 HD22 ASN 39 HD22 ASN 39 -2.093 23.745 1.820
306 H ILE 40 H ILE 40 1.857 26.945 -2.098
307 HA ILE 40 HA ILE 40 1.029 29.019 -2.721
308 HB ILE 40 HB ILE 40 -1.318 28.178 -0.920
309 HG12 ILE 40 HG12 ILE 40 -0.616 27.376 -3.811
310 HG13 ILE 40 HG13 ILE 40 -0.696 26.305 -2.388
311 HG21 ILE 40 HG21 ILE 40 -1.236 29.950 -3.437
312 HG22 ILE 40 HG22 ILE 40 -2.679 29.582 -2.445
313 HG23 ILE 40 HG23 ILE 40 -1.378 30.570 -1.768
314 HD11 ILE 40 HD11 ILE 40 -2.740 25.932 -3.592
315 HD12 ILE 40 HD12 ILE 40 -3.191 26.918 -2.170
316 HD13 ILE 40 HD13 ILE 40 -3.062 27.670 -3.793
317 H THR 41 H THR 41 2.956 29.824 -1.398
318 HA THR 41 HA THR 41 3.788 31.434 -0.024
319 HB THR 41 HB THR 41 1.250 32.426 -0.613
320 HG1 THR 41 HG1 THR 41 3.238 33.682 -0.593
321 HG21 THR 41 HG21 THR 41 0.234 33.418 1.308
322 HG22 THR 41 HG22 THR 41 0.462 31.727 1.816
323 HG23 THR 41 HG23 THR 41 1.573 32.999 2.388
324 H GLN 42 H GLN 42 2.879 28.546 0.929
325 HA GLN 42 HA GLN 42 2.741 27.445 2.955
326 HB2 GLN 42 HB2 GLN 42 5.210 28.125 2.595
327 HB3 GLN 42 HB3 GLN 42 4.914 29.490 3.703
328 HG2 GLN 42 HG2 GLN 42 4.218 27.805 5.496
329 HG3 GLN 42 HG3 GLN 42 4.582 26.481 4.365
330 HE21 GLN 42 HE21 GLN 42 6.898 26.067 3.791
331 HE22 GLN 42 HE22 GLN 42 8.168 26.838 4.666
Start of MODEL 4
1 H1 TYR 1 H1 TYR 1 1.787 -28.879 2.242
2 HA TYR 1 HA TYR 1 0.896 -29.828 4.374
3 HB2 TYR 1 HB2 TYR 1 3.317 -31.714 4.014
4 HB3 TYR 1 HB3 TYR 1 2.196 -31.708 5.391
5 HD1 TYR 1 HD2 TYR 1 -0.251 -32.304 5.007
6 HD2 TYR 1 HD1 TYR 1 2.674 -32.756 1.883
7 HE1 TYR 1 HE2 TYR 1 -1.797 -33.773 3.777
8 HE2 TYR 1 HE1 TYR 1 1.127 -34.240 0.657
9 HH TYR 1 HH TYR 1 -2.119 -35.140 1.843
10 H ALA 2 H ALA 2 4.427 -29.500 3.388
11 HA ALA 2 HA ALA 2 5.289 -28.394 5.845
12 HB1 ALA 2 HB1 ALA 2 6.283 -27.711 3.003
13 HB2 ALA 2 HB2 ALA 2 7.104 -27.247 4.523
14 HB3 ALA 2 HB3 ALA 2 6.936 -28.973 4.087
15 H GLU 3 H GLU 3 3.995 -26.717 2.833
16 HA GLU 3 HA GLU 3 3.501 -24.283 4.477
17 HB2 GLU 3 HB2 GLU 3 4.292 -24.039 2.102
18 HB3 GLU 3 HB3 GLU 3 2.811 -24.853 1.538
19 HG2 GLU 3 HG2 GLU 3 1.444 -23.034 2.728
20 HG3 GLU 3 HG3 GLU 3 2.963 -22.212 3.135
21 H GLY 4 H GLY 4 1.978 -25.433 6.050
22 HA2 GLY 4 HA2 GLY 4 -0.216 -26.986 5.137
23 HA3 GLY 4 HA3 GLY 4 -0.172 -26.089 6.684
24 H THR 5 H THR 5 -2.653 -26.118 5.624
25 HA THR 5 HA THR 5 -3.114 -24.164 3.592
26 HB THR 5 HB THR 5 -5.009 -25.150 5.795
27 HG1 THR 5 HG1 THR 5 -4.444 -26.695 4.050
28 HG21 THR 5 HG21 THR 5 -5.752 -22.880 5.071
29 HG22 THR 5 HG22 THR 5 -5.561 -23.348 3.354
30 HG23 THR 5 HG23 THR 5 -6.818 -24.121 4.362
31 H PHE 6 H PHE 6 -3.259 -23.885 7.273
32 HA PHE 6 HA PHE 6 -3.815 -21.161 7.400
33 HB2 PHE 6 HB2 PHE 6 -3.533 -22.321 9.532
34 HB3 PHE 6 HB3 PHE 6 -1.891 -22.844 9.095
35 HD1 PHE 6 HD1 PHE 6 -3.944 -19.739 9.782
36 HD2 PHE 6 HD2 PHE 6 -0.009 -21.465 9.631
37 HE1 PHE 6 HE1 PHE 6 -2.982 -17.659 10.731
38 HE2 PHE 6 HE2 PHE 6 0.967 -19.334 10.404
39 HZ PHE 6 HZ PHE 6 -0.522 -17.435 11.008
40 H ILE 7 H ILE 7 -0.555 -22.727 6.784
41 HA ILE 7 HA ILE 7 0.731 -20.136 6.892
42 HB ILE 7 HB ILE 7 1.840 -22.675 5.602
43 HG12 ILE 7 HG12 ILE 7 2.127 -21.522 8.460
44 HG13 ILE 7 HG13 ILE 7 1.367 -23.072 8.009
45 HG21 ILE 7 HG21 ILE 7 3.277 -20.116 6.575
46 HG22 ILE 7 HG22 ILE 7 4.033 -21.510 5.744
47 HG23 ILE 7 HG23 ILE 7 2.923 -20.457 4.864
48 HD11 ILE 7 HD11 ILE 7 4.356 -22.393 7.909
49 HD12 ILE 7 HD12 ILE 7 3.523 -23.585 8.930
50 HD13 ILE 7 HD13 ILE 7 3.646 -23.861 7.166
51 H SER 8 H SER 8 -0.611 -22.235 4.192
52 HA SER 8 HA SER 8 0.363 -20.636 2.107
53 HB2 SER 8 HB2 SER 8 -0.846 -22.806 1.703
54 HB3 SER 8 HB3 SER 8 -2.392 -22.011 2.135
55 HG SER 8 HG SER 8 -1.935 -21.903 -0.208
56 H ASP 9 H ASP 9 -2.746 -20.299 4.048
57 HA ASP 9 HA ASP 9 -3.728 -18.053 2.755
58 HB2 ASP 9 HB2 ASP 9 -4.953 -19.134 4.645
59 HB3 ASP 9 HB3 ASP 9 -3.756 -18.517 5.808
60 H TYR 10 H TYR 10 -1.136 -18.113 5.395
61 HA TYR 10 HA TYR 10 -0.989 -15.254 5.356
62 HB2 TYR 10 HB2 TYR 10 -0.050 -16.436 7.302
63 HB3 TYR 10 HB3 TYR 10 1.139 -17.273 6.270
64 HD1 TYR 10 HD1 TYR 10 -0.098 -13.787 7.106
65 HD2 TYR 10 HD2 TYR 10 3.293 -16.195 5.984
66 HE1 TYR 10 HE1 TYR 10 1.335 -11.774 7.088
67 HE2 TYR 10 HE2 TYR 10 4.748 -14.217 6.149
68 HH TYR 10 HH TYR 10 4.810 -11.824 6.357
69 H SER 11 H SER 11 1.030 -17.828 3.701
70 HA SER 11 HA SER 11 2.885 -16.202 2.466
71 HB2 SER 11 HB2 SER 11 2.828 -18.692 2.210
72 HB3 SER 11 HB3 SER 11 1.411 -18.537 1.118
73 HG SER 11 HG SER 11 3.466 -18.570 -0.086
74 H ILE 12 H ILE 12 -0.602 -16.697 1.520
75 HA ILE 12 HA ILE 12 -0.296 -15.041 -0.870
76 HB ILE 12 HB ILE 12 -2.830 -15.841 0.662
77 HG12 ILE 12 HG12 ILE 12 -1.793 -17.876 -0.208
78 HG13 ILE 12 HG13 ILE 12 -3.234 -17.477 -1.154
79 HG21 ILE 12 HG21 ILE 12 -2.485 -14.466 -2.064
80 HG22 ILE 12 HG22 ILE 12 -4.021 -15.166 -1.476
81 HG23 ILE 12 HG23 ILE 12 -3.271 -13.806 -0.607
82 HD11 ILE 12 HD11 ILE 12 -0.296 -17.074 -2.035
83 HD12 ILE 12 HD12 ILE 12 -1.447 -18.290 -2.627
84 HD13 ILE 12 HD13 ILE 12 -1.720 -16.568 -2.998
85 H ALA 13 H ALA 13 -1.615 -14.504 2.527
86 HA ALA 13 HA ALA 13 -2.439 -11.893 2.058
87 HB1 ALA 13 HB1 ALA 13 -2.186 -11.440 4.478
88 HB2 ALA 13 HB2 ALA 13 -2.867 -13.072 4.225
89 HB3 ALA 13 HB3 ALA 13 -1.151 -12.877 4.683
90 H MET 14 H MET 14 0.919 -12.872 3.306
91 HA MET 14 HA MET 14 1.852 -10.246 3.287
92 HB2 MET 14 HB2 MET 14 4.129 -11.009 3.208
93 HB3 MET 14 HB3 MET 14 3.187 -12.110 4.239
94 HG2 MET 14 HG2 MET 14 3.056 -13.772 2.387
95 HG3 MET 14 HG3 MET 14 4.066 -12.734 1.336
96 HE1 MET 14 HE1 MET 14 6.446 -11.616 3.574
97 HE2 MET 14 HE2 MET 14 7.581 -12.854 2.965
98 HE3 MET 14 HE3 MET 14 6.486 -12.011 1.822
99 H ASP 15 H ASP 15 1.628 -12.580 0.474
100 HA ASP 15 HA ASP 15 3.334 -10.975 -1.173
101 HB2 ASP 15 HB2 ASP 15 2.884 -13.337 -1.718
102 HB3 ASP 15 HB3 ASP 15 1.169 -12.987 -2.035
103 H LYS 16 H LYS 16 -0.320 -11.276 -1.065
104 HA LYS 16 HA LYS 16 -0.772 -9.188 -2.944
105 HB2 LYS 16 HB2 LYS 16 -2.488 -10.166 -0.563
106 HB3 LYS 16 HB3 LYS 16 -3.029 -8.924 -1.721
107 HG2 LYS 16 HG2 LYS 16 -2.709 -10.530 -3.621
108 HG3 LYS 16 HG3 LYS 16 -2.268 -11.823 -2.474
109 HD2 LYS 16 HD2 LYS 16 -4.516 -11.655 -1.393
110 HD3 LYS 16 HD3 LYS 16 -4.956 -10.301 -2.465
111 HE2 LYS 16 HE2 LYS 16 -4.392 -13.198 -3.374
112 HE3 LYS 16 HE3 LYS 16 -5.981 -12.403 -3.272
113 HZ1 LYS 16 HZ1 LYS 16 -5.119 -10.718 -4.993
114 HZ2 LYS 16 HZ2 LYS 16 -3.822 -11.889 -5.318
115 H ILE 17 H ILE 17 -0.248 -9.104 0.638
116 HA ILE 17 HA ILE 17 -0.917 -6.315 0.831
117 HB ILE 17 HB ILE 17 0.671 -8.163 2.666
118 HG12 ILE 17 HG12 ILE 17 -2.103 -6.831 3.018
119 HG13 ILE 17 HG13 ILE 17 -1.889 -8.455 2.344
120 HG21 ILE 17 HG21 ILE 17 0.599 -6.328 4.400
121 HG22 ILE 17 HG22 ILE 17 1.590 -5.899 3.012
122 HG23 ILE 17 HG23 ILE 17 -0.060 -5.220 3.164
123 HD11 ILE 17 HD11 ILE 17 -0.721 -9.166 4.509
124 HD12 ILE 17 HD12 ILE 17 -1.194 -7.592 5.213
125 HD13 ILE 17 HD13 ILE 17 -2.445 -8.735 4.686
126 H HIS 18 H HIS 18 2.251 -8.056 0.211
127 HA HIS 18 HA HIS 18 3.980 -6.054 0.837
128 HB2 HIS 18 HB2 HIS 18 4.702 -8.226 -0.197
129 HB3 HIS 18 HB3 HIS 18 4.209 -7.634 -1.804
130 HD1 HIS 18 HD1 HIS 18 5.470 -5.274 -2.486
131 HD2 HIS 18 HD2 HIS 18 7.182 -7.615 0.564
132 HE1 HIS 18 HE1 HIS 18 7.846 -4.455 -2.242
133 H GLN 19 H GLN 19 2.084 -6.230 -2.278
134 HA GLN 19 HA GLN 19 3.232 -3.716 -3.208
135 HB2 GLN 19 HB2 GLN 19 0.720 -5.224 -4.161
136 HB3 GLN 19 HB3 GLN 19 1.438 -3.792 -4.950
137 HG2 GLN 19 HG2 GLN 19 3.595 -5.068 -5.285
138 HG3 GLN 19 HG3 GLN 19 2.850 -6.514 -4.551
139 HE21 GLN 19 HE21 GLN 19 3.742 -7.193 -6.899
140 HE22 GLN 19 HE22 GLN 19 2.537 -7.142 -8.132
141 H GLN 20 H GLN 20 0.005 -4.659 -1.725
142 HA GLN 20 HA GLN 20 -1.077 -2.083 -1.937
143 HB2 GLN 20 HB2 GLN 20 -2.340 -4.183 -1.234
144 HB3 GLN 20 HB3 GLN 20 -1.587 -4.032 0.375
145 HG2 GLN 20 HG2 GLN 20 -3.883 -3.087 0.380
146 HG3 GLN 20 HG3 GLN 20 -2.683 -1.823 0.708
147 HE21 GLN 20 HE21 GLN 20 -3.260 0.153 -0.500
148 HE22 GLN 20 HE22 GLN 20 -4.052 0.104 -2.024
149 H ASP 21 H ASP 21 1.095 -3.413 0.668
150 HA ASP 21 HA ASP 21 0.823 -1.188 2.404
151 HB2 ASP 21 HB2 ASP 21 1.890 -3.286 3.165
152 HB3 ASP 21 HB3 ASP 21 3.212 -3.081 1.982
153 H PHE 22 H PHE 22 3.138 -1.777 -0.419
154 HA PHE 22 HA PHE 22 4.523 0.686 0.052
155 HB2 PHE 22 HB2 PHE 22 5.464 -0.986 -1.504
156 HB3 PHE 22 HB3 PHE 22 4.079 -0.798 -2.601
157 HD1 PHE 22 HD2 PHE 22 6.893 1.132 -0.973
158 HD2 PHE 22 HD1 PHE 22 4.098 0.998 -4.243
159 HE1 PHE 22 HE2 PHE 22 8.051 3.036 -2.046
160 HE2 PHE 22 HE1 PHE 22 5.349 2.801 -5.380
161 HZ PHE 22 HZ PHE 22 7.323 3.834 -4.283
162 H VAL 23 H VAL 23 1.450 -0.085 -1.761
163 HA VAL 23 HA VAL 23 1.091 2.581 -2.745
164 HB VAL 23 HB VAL 23 -1.025 0.477 -2.038
165 HG11 VAL 23 HG11 VAL 23 -2.593 1.900 -3.429
166 HG12 VAL 23 HG12 VAL 23 -2.115 2.679 -1.908
167 HG13 VAL 23 HG13 VAL 23 -1.356 3.189 -3.447
168 HG21 VAL 23 HG21 VAL 23 0.494 -0.158 -3.961
169 HG22 VAL 23 HG22 VAL 23 -1.167 0.162 -4.507
170 HG23 VAL 23 HG23 VAL 23 0.104 1.391 -4.756
171 H ASN 24 H ASN 24 0.435 1.094 0.533
172 HA ASN 24 HA ASN 24 -1.192 3.230 1.411
173 HB2 ASN 24 HB2 ASN 24 0.550 1.327 3.043
174 HB3 ASN 24 HB3 ASN 24 -0.184 2.761 3.775
175 HD21 ASN 24 HD21 ASN 24 -1.628 0.391 1.335
176 HD22 ASN 24 HD22 ASN 24 -2.986 0.084 2.343
177 H TRP 25 H TRP 25 2.466 3.008 1.173
178 HA TRP 25 HA TRP 25 2.833 5.393 2.690
179 HB2 TRP 25 HB2 TRP 25 4.708 3.822 2.051
180 HB3 TRP 25 HB3 TRP 25 4.676 4.494 0.397
181 HD1 TRP 25 HD1 TRP 25 5.768 5.264 3.961
182 HE1 TRP 25 HE1 TRP 25 6.986 7.464 4.075
183 HE3 TRP 25 HE3 TRP 25 4.800 7.048 -0.815
184 HZ2 TRP 25 HZ2 TRP 25 7.557 9.619 2.498
185 HZ3 TRP 25 HZ3 TRP 25 5.736 9.295 -1.406
186 HH2 TRP 25 HH2 TRP 25 7.121 10.545 0.217
187 H LEU 26 H LEU 26 2.148 4.820 -0.860
188 HA LEU 26 HA LEU 26 2.551 7.527 -1.669
189 HB2 LEU 26 HB2 LEU 26 0.688 5.360 -2.785
190 HB3 LEU 26 HB3 LEU 26 0.630 7.040 -3.359
191 HG LEU 26 HG LEU 26 2.957 6.979 -4.107
192 HD11 LEU 26 HD11 LEU 26 4.284 4.896 -4.186
193 HD12 LEU 26 HD12 LEU 26 3.958 5.321 -2.497
194 HD13 LEU 26 HD13 LEU 26 3.030 4.008 -3.278
195 HD21 LEU 26 HD21 LEU 26 2.594 5.403 -6.034
196 HD22 LEU 26 HD22 LEU 26 1.280 4.595 -5.130
197 HD23 LEU 26 HD23 LEU 26 1.101 6.293 -5.654
198 H LEU 27 H LEU 27 -0.635 5.896 -0.707
199 HA LEU 27 HA LEU 27 -1.929 8.422 -0.847
200 HB2 LEU 27 HB2 LEU 27 -3.902 7.444 0.096
201 HB3 LEU 27 HB3 LEU 27 -3.126 6.241 -0.946
202 HG LEU 27 HG LEU 27 -2.024 5.453 1.398
203 HD11 LEU 27 HD11 LEU 27 -4.697 6.629 2.383
204 HD12 LEU 27 HD12 LEU 27 -3.520 5.692 3.342
205 HD13 LEU 27 HD13 LEU 27 -3.115 7.330 2.793
206 HD21 LEU 27 HD21 LEU 27 -4.913 4.806 0.585
207 HD22 LEU 27 HD22 LEU 27 -3.436 3.978 0.003
208 HD23 LEU 27 HD23 LEU 27 -3.924 3.824 1.708
209 H ALA 28 H ALA 28 -0.055 6.878 1.851
210 HA ALA 28 HA ALA 28 -1.088 8.389 3.958
211 HB1 ALA 28 HB1 ALA 28 0.673 6.652 4.309
212 HB2 ALA 28 HB2 ALA 28 1.874 7.689 3.485
213 HB3 ALA 28 HB3 ALA 28 1.166 8.209 5.037
214 H GLN 29 H GLN 29 1.104 9.439 1.274
215 HA GLN 29 HA GLN 29 1.876 11.896 2.474
216 HB2 GLN 29 HB2 GLN 29 1.363 11.397 -0.531
217 HB3 GLN 29 HB3 GLN 29 2.247 12.770 0.183
218 HG2 GLN 29 HG2 GLN 29 3.143 9.814 0.160
219 HG3 GLN 29 HG3 GLN 29 3.876 11.186 -0.676
220 HE21 GLN 29 HE21 GLN 29 3.580 9.545 2.519
221 HE22 GLN 29 HE22 GLN 29 4.743 10.548 3.300
222 H LYS 30 H LYS 30 -1.065 11.076 0.409
223 HA LYS 30 HA LYS 30 -1.717 13.727 -0.010
224 HB2 LYS 30 HB2 LYS 30 -3.853 13.099 -0.820
225 HB3 LYS 30 HB3 LYS 30 -2.821 11.682 -1.105
226 HG2 LYS 30 HG2 LYS 30 -3.765 10.886 1.280
227 HG3 LYS 30 HG3 LYS 30 -4.996 12.138 1.043
228 HD2 LYS 30 HD2 LYS 30 -5.674 11.011 -1.124
229 HD3 LYS 30 HD3 LYS 30 -4.408 9.779 -0.866
230 HE2 LYS 30 HE2 LYS 30 -5.498 9.158 1.352
231 HE3 LYS 30 HE3 LYS 30 -6.847 10.262 0.957
232 HZ1 LYS 30 HZ1 LYS 30 -7.293 7.869 0.345
233 HZ2 LYS 30 HZ2 LYS 30 -7.243 8.872 -1.114
234 H GLY 31 H GLY 31 -2.255 11.877 3.055
235 HA2 GLY 31 HA2 GLY 31 -4.265 13.445 4.200
236 HA3 GLY 31 HA3 GLY 31 -2.860 12.827 5.119
237 H LYS 32 H LYS 32 -0.732 14.120 3.783
238 HA LYS 32 HA LYS 32 -1.048 16.926 4.697
239 HB2 LYS 32 HB2 LYS 32 1.338 15.325 3.557
240 HB3 LYS 32 HB3 LYS 32 1.366 17.063 3.891
241 HG2 LYS 32 HG2 LYS 32 2.368 15.874 5.746
242 HG3 LYS 32 HG3 LYS 32 0.888 16.706 6.281
243 HD2 LYS 32 HD2 LYS 32 -0.351 14.555 6.350
244 HD3 LYS 32 HD3 LYS 32 1.024 13.690 5.595
245 HE2 LYS 32 HE2 LYS 32 0.909 13.361 8.103
246 HE3 LYS 32 HE3 LYS 32 2.435 14.129 7.580
247 HZ1 LYS 32 HZ1 LYS 32 0.051 15.657 8.682
248 HZ2 LYS 32 HZ2 LYS 32 1.551 15.310 9.537
249 H LYS 33 H LYS 33 -0.204 15.164 1.572
250 HA LYS 33 HA LYS 33 -0.287 15.903 -0.599
251 HB2 LYS 33 HB2 LYS 33 -2.744 16.000 -0.065
252 HB3 LYS 33 HB3 LYS 33 -2.558 17.718 0.351
253 HG2 LYS 33 HG2 LYS 33 -1.827 18.172 -2.033
254 HG3 LYS 33 HG3 LYS 33 -1.855 16.423 -2.371
255 HD2 LYS 33 HD2 LYS 33 -3.867 17.399 -3.321
256 HD3 LYS 33 HD3 LYS 33 -4.348 16.377 -1.945
257 HE2 LYS 33 HE2 LYS 33 -4.567 18.484 -0.516
258 HE3 LYS 33 HE3 LYS 33 -4.040 19.452 -1.926
259 HZ1 LYS 33 HZ1 LYS 33 -6.547 17.743 -1.752
260 HZ2 LYS 33 HZ2 LYS 33 -6.460 19.496 -1.781
261 H ASN 34 H ASN 34 1.895 16.730 0.396
262 HA ASN 34 HA ASN 34 3.480 18.406 0.406
263 HB2 ASN 34 HB2 ASN 34 2.891 18.240 -2.044
264 HB3 ASN 34 HB3 ASN 34 1.697 19.544 -1.835
265 HD21 ASN 34 HD21 ASN 34 5.246 18.761 -1.287
266 HD22 ASN 34 HD22 ASN 34 5.787 20.379 -1.531
267 H ASP 35 H ASP 35 2.332 18.816 2.623
268 HA ASP 35 HA ASP 35 1.569 21.737 2.680
269 HB2 ASP 35 HB2 ASP 35 -0.218 20.210 3.533
270 HB3 ASP 35 HB3 ASP 35 0.935 19.496 4.688
271 H TRP 36 H TRP 36 4.076 21.680 2.196
272 HA TRP 36 HA TRP 36 6.245 21.877 2.979
273 HB2 TRP 36 HB2 TRP 36 5.151 23.781 4.167
274 HB3 TRP 36 HB3 TRP 36 4.903 22.770 5.613
275 HD1 TRP 36 HD1 TRP 36 7.616 24.496 3.526
276 HE1 TRP 36 HE1 TRP 36 9.836 24.440 4.706
277 HE3 TRP 36 HE3 TRP 36 6.344 21.699 7.724
278 HZ2 TRP 36 HZ2 TRP 36 11.060 23.123 6.762
279 HZ3 TRP 36 HZ3 TRP 36 8.225 20.947 9.193
280 HH2 TRP 36 HH2 TRP 36 10.555 21.612 8.692
281 H LYS 37 H LYS 37 6.125 19.333 2.702
282 HA LYS 37 HA LYS 37 7.269 18.406 5.297
283 HB2 LYS 37 HB2 LYS 37 4.751 17.554 4.372
284 HB3 LYS 37 HB3 LYS 37 5.808 16.264 3.779
285 HG2 LYS 37 HG2 LYS 37 5.516 17.275 6.683
286 HG3 LYS 37 HG3 LYS 37 4.822 15.766 6.038
287 HD2 LYS 37 HD2 LYS 37 7.114 14.852 5.622
288 HD3 LYS 37 HD3 LYS 37 7.836 16.313 6.343
289 HE2 LYS 37 HE2 LYS 37 6.053 14.242 7.782
290 HE3 LYS 37 HE3 LYS 37 7.786 14.547 8.046
291 HZ1 LYS 37 HZ1 LYS 37 7.130 16.900 8.823
292 HZ2 LYS 37 HZ2 LYS 37 5.477 16.251 8.980
293 H HIS 38 H HIS 38 8.508 19.455 2.727
294 HA HIS 38 HA HIS 38 10.584 17.394 2.780
295 HB2 HIS 38 HB2 HIS 38 9.097 16.395 1.060
296 HB3 HIS 38 HB3 HIS 38 8.965 17.967 0.226
297 HD1 HIS 38 HD1 HIS 38 11.643 15.463 1.243
298 HD2 HIS 38 HD2 HIS 38 10.855 18.432 -1.625
299 HE1 HIS 38 HE1 HIS 38 13.568 15.357 -0.393
300 H ASN 39 H ASN 39 12.169 19.007 3.361
301 HA ASN 39 HA ASN 39 12.331 21.430 1.556
302 HB2 ASN 39 HB2 ASN 39 12.698 21.221 4.606
303 HB3 ASN 39 HB3 ASN 39 12.837 22.706 3.627
304 HD21 ASN 39 HD21 ASN 39 10.490 20.281 4.953
305 HD22 ASN 39 HD22 ASN 39 9.084 21.114 4.412
306 H ILE 40 H ILE 40 13.629 19.382 0.612
307 HA ILE 40 HA ILE 40 15.712 18.723 -0.031
308 HB ILE 40 HB ILE 40 16.908 20.879 1.787
309 HG12 ILE 40 HG12 ILE 40 16.297 20.894 -1.239
310 HG13 ILE 40 HG13 ILE 40 15.315 21.724 -0.004
311 HG21 ILE 40 HG21 ILE 40 18.467 19.000 1.280
312 HG22 ILE 40 HG22 ILE 40 18.153 19.208 -0.468
313 HG23 ILE 40 HG23 ILE 40 18.967 20.494 0.471
314 HD11 ILE 40 HD11 ILE 40 16.780 23.369 -1.040
315 HD12 ILE 40 HD12 ILE 40 17.319 23.123 0.649
316 HD13 ILE 40 HD13 ILE 40 18.236 22.401 -0.713
317 H THR 41 H THR 41 16.267 16.624 0.737
318 HA THR 41 HA THR 41 16.502 14.926 2.278
319 HB THR 41 HB THR 41 18.118 17.073 3.766
320 HG1 THR 41 HG1 THR 41 19.793 16.359 2.248
321 HG21 THR 41 HG21 THR 41 18.459 14.000 3.538
322 HG22 THR 41 HG22 THR 41 19.543 15.105 4.431
323 HG23 THR 41 HG23 THR 41 17.872 14.848 4.999
324 H GLN 42 H GLN 42 14.010 15.501 2.529
325 HA GLN 42 HA GLN 42 12.208 15.637 3.991
326 HB2 GLN 42 HB2 GLN 42 14.307 14.838 6.110
327 HB3 GLN 42 HB3 GLN 42 12.538 14.730 6.256
328 HG2 GLN 42 HG2 GLN 42 12.498 13.101 4.308
329 HG3 GLN 42 HG3 GLN 42 14.272 13.224 4.183
330 HE21 GLN 42 HE21 GLN 42 11.624 12.409 6.610
331 HE22 GLN 42 HE22 GLN 42 12.561 11.206 7.413
Start of MODEL 5
1 H1 TYR 1 H1 TYR 1 3.368 -26.338 7.171
2 HA TYR 1 HA TYR 1 5.663 -28.226 7.025
3 HB2 TYR 1 HB2 TYR 1 4.060 -28.748 8.862
4 HB3 TYR 1 HB3 TYR 1 2.708 -28.774 7.709
5 HD1 TYR 1 HD2 TYR 1 6.059 -30.352 8.430
6 HD2 TYR 1 HD1 TYR 1 2.220 -30.878 6.555
7 HE1 TYR 1 HE2 TYR 1 6.646 -32.682 7.898
8 HE2 TYR 1 HE1 TYR 1 2.811 -33.219 6.026
9 HH TYR 1 HH TYR 1 5.968 -34.690 6.789
10 H ALA 2 H ALA 2 6.027 -27.534 4.726
11 HA ALA 2 HA ALA 2 5.687 -27.745 2.451
12 HB1 ALA 2 HB1 ALA 2 4.393 -30.355 3.420
13 HB2 ALA 2 HB2 ALA 2 4.772 -29.957 1.717
14 HB3 ALA 2 HB3 ALA 2 6.077 -30.062 2.936
15 H GLU 3 H GLU 3 2.364 -29.181 3.075
16 HA GLU 3 HA GLU 3 1.294 -27.147 1.340
17 HB2 GLU 3 HB2 GLU 3 0.072 -29.266 1.575
18 HB3 GLU 3 HB3 GLU 3 -0.145 -29.016 3.323
19 HG2 GLU 3 HG2 GLU 3 -2.229 -28.440 2.099
20 HG3 GLU 3 HG3 GLU 3 -1.570 -27.002 2.903
21 H GLY 4 H GLY 4 1.052 -27.710 4.984
22 HA2 GLY 4 HA2 GLY 4 0.406 -26.181 6.641
23 HA3 GLY 4 HA3 GLY 4 1.524 -25.103 5.769
24 H THR 5 H THR 5 -1.933 -26.407 5.516
25 HA THR 5 HA THR 5 -2.790 -24.550 3.641
26 HB THR 5 HB THR 5 -4.433 -25.500 6.059
27 HG1 THR 5 HG1 THR 5 -4.905 -27.279 4.542
28 HG21 THR 5 HG21 THR 5 -5.553 -23.657 4.731
29 HG22 THR 5 HG22 THR 5 -5.305 -24.593 3.226
30 HG23 THR 5 HG23 THR 5 -6.395 -25.212 4.498
31 H PHE 6 H PHE 6 -2.531 -24.069 7.270
32 HA PHE 6 HA PHE 6 -3.566 -21.404 7.207
33 HB2 PHE 6 HB2 PHE 6 -3.226 -22.519 9.381
34 HB3 PHE 6 HB3 PHE 6 -1.477 -22.660 9.092
35 HD1 PHE 6 HD1 PHE 6 0.003 -20.664 9.172
36 HD2 PHE 6 HD2 PHE 6 -4.226 -20.282 9.898
37 HE1 PHE 6 HE1 PHE 6 0.354 -18.370 10.019
38 HE2 PHE 6 HE2 PHE 6 -3.865 -17.992 10.766
39 HZ PHE 6 HZ PHE 6 -1.576 -17.031 10.833
40 H ILE 7 H ILE 7 -0.166 -22.704 6.723
41 HA ILE 7 HA ILE 7 1.016 -20.114 6.637
42 HB ILE 7 HB ILE 7 1.941 -22.610 5.106
43 HG12 ILE 7 HG12 ILE 7 2.948 -21.375 7.754
44 HG13 ILE 7 HG13 ILE 7 1.967 -22.851 7.621
45 HG21 ILE 7 HG21 ILE 7 2.764 -20.493 4.029
46 HG22 ILE 7 HG22 ILE 7 3.405 -19.946 5.605
47 HG23 ILE 7 HG23 ILE 7 4.098 -21.371 4.773
48 HD11 ILE 7 HD11 ILE 7 4.865 -22.526 6.646
49 HD12 ILE 7 HD12 ILE 7 4.248 -23.562 7.946
50 HD13 ILE 7 HD13 ILE 7 3.830 -23.930 6.249
51 H SER 8 H SER 8 -0.309 -22.234 3.927
52 HA SER 8 HA SER 8 0.108 -20.476 1.862
53 HB2 SER 8 HB2 SER 8 -2.485 -22.091 2.266
54 HB3 SER 8 HB3 SER 8 -1.835 -21.509 0.712
55 HG SER 8 HG SER 8 0.015 -22.971 1.172
56 H ASP 9 H ASP 9 -2.742 -20.378 4.208
57 HA ASP 9 HA ASP 9 -4.034 -18.231 2.919
58 HB2 ASP 9 HB2 ASP 9 -5.104 -19.475 4.791
59 HB3 ASP 9 HB3 ASP 9 -3.930 -18.813 5.949
60 H TYR 10 H TYR 10 -1.514 -18.131 5.575
61 HA TYR 10 HA TYR 10 -1.576 -15.252 5.674
62 HB2 TYR 10 HB2 TYR 10 -0.752 -16.551 7.609
63 HB3 TYR 10 HB3 TYR 10 0.550 -17.263 6.638
64 HD1 TYR 10 HD2 TYR 10 -0.816 -13.922 7.760
65 HD2 TYR 10 HD1 TYR 10 2.640 -16.069 6.362
66 HE1 TYR 10 HE2 TYR 10 0.633 -12.022 8.397
67 HE2 TYR 10 HE1 TYR 10 4.093 -14.225 7.093
68 HH TYR 10 HH TYR 10 4.195 -12.098 8.181
69 H SER 11 H SER 11 0.916 -17.555 4.262
70 HA SER 11 HA SER 11 2.584 -15.648 3.150
71 HB2 SER 11 HB2 SER 11 3.074 -18.092 3.053
72 HB3 SER 11 HB3 SER 11 1.711 -18.340 1.927
73 HG SER 11 HG SER 11 4.042 -16.773 1.314
74 H ILE 12 H ILE 12 -0.571 -16.886 1.783
75 HA ILE 12 HA ILE 12 -0.323 -15.443 -0.689
76 HB ILE 12 HB ILE 12 -2.754 -16.412 0.895
77 HG12 ILE 12 HG12 ILE 12 -1.749 -17.282 -1.893
78 HG13 ILE 12 HG13 ILE 12 -1.088 -17.996 -0.414
79 HG21 ILE 12 HG21 ILE 12 -3.495 -14.356 -0.295
80 HG22 ILE 12 HG22 ILE 12 -2.826 -14.991 -1.827
81 HG23 ILE 12 HG23 ILE 12 -4.214 -15.789 -1.039
82 HD11 ILE 12 HD11 ILE 12 -4.035 -18.156 -1.295
83 HD12 ILE 12 HD12 ILE 12 -2.833 -19.472 -1.255
84 HD13 ILE 12 HD13 ILE 12 -3.414 -18.750 0.271
85 H ALA 13 H ALA 13 -1.869 -14.497 2.523
86 HA ALA 13 HA ALA 13 -2.621 -11.931 1.700
87 HB1 ALA 13 HB1 ALA 13 -1.437 -12.608 4.477
88 HB2 ALA 13 HB2 ALA 13 -2.439 -11.194 4.058
89 HB3 ALA 13 HB3 ALA 13 -3.146 -12.829 3.998
90 H MET 14 H MET 14 0.651 -13.087 2.838
91 HA MET 14 HA MET 14 1.833 -10.468 2.796
92 HB2 MET 14 HB2 MET 14 3.173 -13.184 2.295
93 HB3 MET 14 HB3 MET 14 4.032 -11.655 2.583
94 HG2 MET 14 HG2 MET 14 2.171 -13.011 4.672
95 HG3 MET 14 HG3 MET 14 3.941 -13.125 4.606
96 HE1 MET 14 HE1 MET 14 0.866 -10.983 5.042
97 HE2 MET 14 HE2 MET 14 1.378 -10.266 6.596
98 HE3 MET 14 HE3 MET 14 1.545 -9.317 5.090
99 H ASP 15 H ASP 15 1.615 -13.079 0.251
100 HA ASP 15 HA ASP 15 3.172 -11.801 -1.665
101 HB2 ASP 15 HB2 ASP 15 2.279 -14.104 -1.991
102 HB3 ASP 15 HB3 ASP 15 0.622 -13.467 -2.145
103 H LYS 16 H LYS 16 -0.335 -11.195 -0.879
104 HA LYS 16 HA LYS 16 -0.553 -9.285 -3.128
105 HB2 LYS 16 HB2 LYS 16 -2.436 -10.083 -0.831
106 HB3 LYS 16 HB3 LYS 16 -2.758 -8.675 -1.866
107 HG2 LYS 16 HG2 LYS 16 -3.987 -10.656 -2.677
108 HG3 LYS 16 HG3 LYS 16 -2.854 -10.017 -3.895
109 HD2 LYS 16 HD2 LYS 16 -1.215 -11.844 -3.325
110 HD3 LYS 16 HD3 LYS 16 -2.359 -12.483 -2.109
111 HE2 LYS 16 HE2 LYS 16 -4.030 -12.899 -3.944
112 HE3 LYS 16 HE3 LYS 16 -2.875 -12.253 -5.149
113 HZ1 LYS 16 HZ1 LYS 16 -2.846 -14.770 -4.966
114 HZ2 LYS 16 HZ2 LYS 16 -1.285 -14.077 -4.542
115 H ILE 17 H ILE 17 -0.213 -9.118 0.498
116 HA ILE 17 HA ILE 17 -0.749 -6.364 0.623
117 HB ILE 17 HB ILE 17 0.816 -8.198 2.489
118 HG12 ILE 17 HG12 ILE 17 -1.840 -6.697 2.955
119 HG13 ILE 17 HG13 ILE 17 -1.816 -8.269 2.137
120 HG21 ILE 17 HG21 ILE 17 0.228 -5.212 2.925
121 HG22 ILE 17 HG22 ILE 17 0.782 -6.323 4.205
122 HG23 ILE 17 HG23 ILE 17 1.842 -5.988 2.834
123 HD11 ILE 17 HD11 ILE 17 -0.772 -9.348 4.119
124 HD12 ILE 17 HD12 ILE 17 -0.815 -7.810 5.022
125 HD13 ILE 17 HD13 ILE 17 -2.334 -8.586 4.520
126 H HIS 18 H HIS 18 2.407 -7.954 -0.277
127 HA HIS 18 HA HIS 18 3.949 -5.747 0.369
128 HB2 HIS 18 HB2 HIS 18 5.666 -6.437 -1.139
129 HB3 HIS 18 HB3 HIS 18 4.968 -7.876 -0.355
130 HD1 HIS 18 HD1 HIS 18 6.630 -8.205 -2.746
131 HD2 HIS 18 HD2 HIS 18 2.467 -7.656 -2.981
132 HE1 HIS 18 HE1 HIS 18 5.921 -9.177 -4.965
133 H GLN 19 H GLN 19 1.534 -5.713 -2.244
134 HA GLN 19 HA GLN 19 2.828 -3.274 -3.370
135 HB2 GLN 19 HB2 GLN 19 0.283 -4.789 -4.201
136 HB3 GLN 19 HB3 GLN 19 0.863 -3.260 -4.918
137 HG2 GLN 19 HG2 GLN 19 3.038 -4.370 -5.548
138 HG3 GLN 19 HG3 GLN 19 2.408 -5.926 -4.940
139 HE21 GLN 19 HE21 GLN 19 3.264 -5.667 -7.656
140 HE22 GLN 19 HE22 GLN 19 1.867 -5.746 -8.665
141 H GLN 20 H GLN 20 -0.309 -4.311 -1.701
142 HA GLN 20 HA GLN 20 -1.355 -1.739 -1.530
143 HB2 GLN 20 HB2 GLN 20 -2.612 -3.752 -0.802
144 HB3 GLN 20 HB3 GLN 20 -1.510 -3.976 0.584
145 HG2 GLN 20 HG2 GLN 20 -3.689 -2.920 1.249
146 HG3 GLN 20 HG3 GLN 20 -2.302 -1.882 1.625
147 HE21 GLN 20 HE21 GLN 20 -2.113 0.211 0.445
148 HE22 GLN 20 HE22 GLN 20 -3.351 0.730 -0.633
149 H ASP 21 H ASP 21 1.038 -3.351 0.738
150 HA ASP 21 HA ASP 21 1.122 -1.252 2.600
151 HB2 ASP 21 HB2 ASP 21 2.251 -3.393 3.062
152 HB3 ASP 21 HB3 ASP 21 3.413 -3.113 1.737
153 H PHE 22 H PHE 22 3.173 -1.664 -0.455
154 HA PHE 22 HA PHE 22 4.668 0.708 0.031
155 HB2 PHE 22 HB2 PHE 22 5.378 -0.756 -1.809
156 HB3 PHE 22 HB3 PHE 22 3.830 -0.537 -2.657
157 HD1 PHE 22 HD2 PHE 22 7.010 1.181 -1.681
158 HD2 PHE 22 HD1 PHE 22 3.296 1.568 -3.822
159 HE1 PHE 22 HE2 PHE 22 7.849 3.239 -2.770
160 HE2 PHE 22 HE1 PHE 22 4.126 3.644 -4.875
161 HZ PHE 22 HZ PHE 22 6.393 4.499 -4.339
162 H VAL 23 H VAL 23 1.419 0.194 -1.553
163 HA VAL 23 HA VAL 23 1.197 2.976 -2.270
164 HB VAL 23 HB VAL 23 -0.968 0.837 -1.907
165 HG11 VAL 23 HG11 VAL 23 -2.045 3.042 -1.601
166 HG12 VAL 23 HG12 VAL 23 -1.205 3.698 -3.035
167 HG13 VAL 23 HG13 VAL 23 -2.447 2.432 -3.222
168 HG21 VAL 23 HG21 VAL 23 -0.955 0.813 -4.419
169 HG22 VAL 23 HG22 VAL 23 0.353 2.027 -4.438
170 HG23 VAL 23 HG23 VAL 23 0.656 0.395 -3.796
171 H ASN 24 H ASN 24 0.468 1.178 0.824
172 HA ASN 24 HA ASN 24 -1.037 3.228 2.010
173 HB2 ASN 24 HB2 ASN 24 1.131 1.594 3.453
174 HB3 ASN 24 HB3 ASN 24 -0.188 2.517 4.211
175 HD21 ASN 24 HD21 ASN 24 -0.072 -0.077 4.995
176 HD22 ASN 24 HD22 ASN 24 -1.302 -1.007 4.221
177 H TRP 25 H TRP 25 2.581 2.957 1.480
178 HA TRP 25 HA TRP 25 3.224 5.259 2.986
179 HB2 TRP 25 HB2 TRP 25 4.974 3.749 2.032
180 HB3 TRP 25 HB3 TRP 25 4.611 4.339 0.388
181 HD1 TRP 25 HD1 TRP 25 6.092 5.576 3.732
182 HE1 TRP 25 HE1 TRP 25 7.409 7.686 3.303
183 HE3 TRP 25 HE3 TRP 25 4.864 6.354 -1.245
184 HZ2 TRP 25 HZ2 TRP 25 7.882 9.478 1.287
185 HZ3 TRP 25 HZ3 TRP 25 5.917 8.330 -2.386
186 HH2 TRP 25 HH2 TRP 25 7.360 9.887 -1.125
187 H LEU 26 H LEU 26 2.214 4.954 -0.554
188 HA LEU 26 HA LEU 26 2.432 7.703 -1.098
189 HB2 LEU 26 HB2 LEU 26 0.324 5.752 -2.186
190 HB3 LEU 26 HB3 LEU 26 0.518 7.407 -2.782
191 HG LEU 26 HG LEU 26 2.778 5.322 -2.907
192 HD11 LEU 26 HD11 LEU 26 0.807 4.568 -4.279
193 HD12 LEU 26 HD12 LEU 26 0.778 6.150 -5.106
194 HD13 LEU 26 HD13 LEU 26 2.164 5.048 -5.321
195 HD21 LEU 26 HD21 LEU 26 3.712 6.892 -4.656
196 HD22 LEU 26 HD22 LEU 26 2.375 8.033 -4.343
197 HD23 LEU 26 HD23 LEU 26 3.597 7.710 -3.088
198 H LEU 27 H LEU 27 -0.559 5.946 0.183
199 HA LEU 27 HA LEU 27 -2.034 8.295 -0.011
200 HB2 LEU 27 HB2 LEU 27 -3.836 7.349 1.202
201 HB3 LEU 27 HB3 LEU 27 -3.042 6.072 0.265
202 HG LEU 27 HG LEU 27 -1.783 5.518 2.523
203 HD11 LEU 27 HD11 LEU 27 -4.163 7.120 3.654
204 HD12 LEU 27 HD12 LEU 27 -3.155 6.002 4.602
205 HD13 LEU 27 HD13 LEU 27 -2.440 7.474 3.939
206 HD21 LEU 27 HD21 LEU 27 -4.792 4.960 2.222
207 HD22 LEU 27 HD22 LEU 27 -3.471 4.008 1.484
208 HD23 LEU 27 HD23 LEU 27 -3.669 4.023 3.250
209 H ALA 28 H ALA 28 0.329 7.492 2.568
210 HA ALA 28 HA ALA 28 -0.649 9.324 4.500
211 HB1 ALA 28 HB1 ALA 28 1.741 9.530 5.263
212 HB2 ALA 28 HB2 ALA 28 1.267 7.826 4.994
213 HB3 ALA 28 HB3 ALA 28 2.281 8.675 3.790
214 H GLN 29 H GLN 29 1.433 9.903 1.559
215 HA GLN 29 HA GLN 29 1.778 12.725 2.220
216 HB2 GLN 29 HB2 GLN 29 2.247 11.136 -0.369
217 HB3 GLN 29 HB3 GLN 29 2.455 12.901 -0.276
218 HG2 GLN 29 HG2 GLN 29 4.636 11.712 0.062
219 HG3 GLN 29 HG3 GLN 29 4.180 12.716 1.457
220 HE21 GLN 29 HE21 GLN 29 3.911 9.267 0.227
221 HE22 GLN 29 HE22 GLN 29 4.035 8.562 1.796
222 H LYS 30 H LYS 30 -0.531 10.842 0.072
223 HA LYS 30 HA LYS 30 -1.687 13.278 -0.969
224 HB2 LYS 30 HB2 LYS 30 -2.853 10.453 -0.797
225 HB3 LYS 30 HB3 LYS 30 -3.758 11.856 -1.396
226 HG2 LYS 30 HG2 LYS 30 -2.925 10.626 -3.265
227 HG3 LYS 30 HG3 LYS 30 -2.187 12.242 -3.256
228 HD2 LYS 30 HD2 LYS 30 -0.694 9.803 -2.120
229 HD3 LYS 30 HD3 LYS 30 -0.749 10.084 -3.866
230 HE2 LYS 30 HE2 LYS 30 0.412 12.158 -1.924
231 HE3 LYS 30 HE3 LYS 30 1.343 11.004 -2.909
232 HZ1 LYS 30 HZ1 LYS 30 1.122 13.289 -3.925
233 HZ2 LYS 30 HZ2 LYS 30 0.381 12.068 -4.946
234 H GLY 31 H GLY 31 -2.192 11.310 2.052
235 HA2 GLY 31 HA2 GLY 31 -4.649 12.622 2.772
236 HA3 GLY 31 HA3 GLY 31 -3.565 11.741 3.875
237 H LYS 32 H LYS 32 -1.112 13.177 3.586
238 HA LYS 32 HA LYS 32 -1.635 15.311 5.402
239 HB2 LYS 32 HB2 LYS 32 0.558 14.094 5.141
240 HB3 LYS 32 HB3 LYS 32 0.873 14.976 3.633
241 HG2 LYS 32 HG2 LYS 32 0.537 16.200 6.453
242 HG3 LYS 32 HG3 LYS 32 2.070 15.907 5.592
243 HD2 LYS 32 HD2 LYS 32 1.311 17.548 3.779
244 HD3 LYS 32 HD3 LYS 32 -0.105 17.924 4.800
245 HE2 LYS 32 HE2 LYS 32 1.541 19.652 5.186
246 HE3 LYS 32 HE3 LYS 32 1.388 18.672 6.665
247 HZ1 LYS 32 HZ1 LYS 32 3.582 17.659 6.220
248 HZ2 LYS 32 HZ2 LYS 32 3.618 18.401 4.598
249 H LYS 33 H LYS 33 -0.681 15.347 1.862
250 HA LYS 33 HA LYS 33 -1.015 18.024 1.281
251 HB2 LYS 33 HB2 LYS 33 -0.363 16.321 -0.388
252 HB3 LYS 33 HB3 LYS 33 -1.994 15.599 -0.342
253 HG2 LYS 33 HG2 LYS 33 -2.944 17.804 -1.224
254 HG3 LYS 33 HG3 LYS 33 -1.269 18.371 -1.437
255 HD2 LYS 33 HD2 LYS 33 -2.624 15.933 -2.790
256 HD3 LYS 33 HD3 LYS 33 -2.199 17.479 -3.566
257 HE2 LYS 33 HE2 LYS 33 -0.238 15.324 -2.537
258 HE3 LYS 33 HE3 LYS 33 -0.533 15.806 -4.220
259 HZ1 LYS 33 HZ1 LYS 33 1.539 16.851 -3.299
260 HZ2 LYS 33 HZ2 LYS 33 0.347 18.093 -3.661
261 H ASN 34 H ASN 34 -3.656 15.493 1.508
262 HA ASN 34 HA ASN 34 -5.702 17.622 1.195
263 HB2 ASN 34 HB2 ASN 34 -5.977 14.607 1.661
264 HB3 ASN 34 HB3 ASN 34 -7.276 15.726 1.180
265 HD21 ASN 34 HD21 ASN 34 -7.033 13.618 -0.500
266 HD22 ASN 34 HD22 ASN 34 -6.188 14.054 -1.940
267 H ASP 35 H ASP 35 -4.189 18.267 3.520
268 HA ASP 35 HA ASP 35 -5.522 17.073 5.833
269 HB2 ASP 35 HB2 ASP 35 -3.262 17.985 6.164
270 HB3 ASP 35 HB3 ASP 35 -3.774 19.601 5.634
271 H TRP 36 H TRP 36 -5.544 20.371 4.180
272 HA TRP 36 HA TRP 36 -8.492 20.423 4.540
273 HB2 TRP 36 HB2 TRP 36 -7.400 21.380 6.642
274 HB3 TRP 36 HB3 TRP 36 -6.650 22.650 5.649
275 HD1 TRP 36 HD1 TRP 36 -10.071 21.321 6.840
276 HE1 TRP 36 HE1 TRP 36 -11.807 23.141 6.695
277 HE3 TRP 36 HE3 TRP 36 -7.277 25.028 4.491
278 HZ2 TRP 36 HZ2 TRP 36 -12.108 25.662 5.707
279 HZ3 TRP 36 HZ3 TRP 36 -8.445 27.178 3.985
280 HH2 TRP 36 HH2 TRP 36 -10.815 27.503 4.616
281 H LYS 37 H LYS 37 -7.531 19.901 2.132
282 HA LYS 37 HA LYS 37 -7.495 22.593 0.773
283 HB2 LYS 37 HB2 LYS 37 -6.046 20.039 -0.110
284 HB3 LYS 37 HB3 LYS 37 -6.064 21.613 -0.957
285 HG2 LYS 37 HG2 LYS 37 -5.001 22.659 1.151
286 HG3 LYS 37 HG3 LYS 37 -4.835 21.005 1.801
287 HD2 LYS 37 HD2 LYS 37 -3.451 20.412 -0.293
288 HD3 LYS 37 HD3 LYS 37 -3.549 22.122 -0.775
289 HE2 LYS 37 HE2 LYS 37 -2.417 22.791 1.389
290 HE3 LYS 37 HE3 LYS 37 -2.284 21.074 1.847
291 HZ1 LYS 37 HZ1 LYS 37 -0.859 20.670 -0.136
292 HZ2 LYS 37 HZ2 LYS 37 -0.972 22.384 -0.563
293 H HIS 38 H HIS 38 -9.873 21.617 1.493
294 HA HIS 38 HA HIS 38 -11.446 21.734 -0.678
295 HB2 HIS 38 HB2 HIS 38 -12.143 19.343 -1.245
296 HB3 HIS 38 HB3 HIS 38 -10.594 19.830 -1.920
297 HD1 HIS 38 HD1 HIS 38 -10.501 17.150 -2.015
298 HD2 HIS 38 HD2 HIS 38 -10.030 18.928 1.776
299 HE1 HIS 38 HE1 HIS 38 -9.427 15.395 -0.546
300 H ASN 39 H ASN 39 -12.101 22.681 1.578
301 HA ASN 39 HA ASN 39 -14.194 20.942 2.739
302 HB2 ASN 39 HB2 ASN 39 -12.141 20.065 3.846
303 HB3 ASN 39 HB3 ASN 39 -11.642 21.708 4.277
304 HD21 ASN 39 HD21 ASN 39 -14.284 19.222 4.781
305 HD22 ASN 39 HD22 ASN 39 -14.789 19.854 6.303
306 H ILE 40 H ILE 40 -15.481 22.801 1.923
307 HA ILE 40 HA ILE 40 -16.508 24.848 2.205
308 HB ILE 40 HB ILE 40 -15.386 24.735 5.055
309 HG12 ILE 40 HG12 ILE 40 -17.965 23.546 3.854
310 HG13 ILE 40 HG13 ILE 40 -16.559 22.626 4.451
311 HG21 ILE 40 HG21 ILE 40 -17.285 26.243 5.587
312 HG22 ILE 40 HG22 ILE 40 -16.293 26.979 4.318
313 HG23 ILE 40 HG23 ILE 40 -17.837 26.193 3.890
314 HD11 ILE 40 HD11 ILE 40 -18.229 22.527 6.184
315 HD12 ILE 40 HD12 ILE 40 -16.953 23.631 6.773
316 HD13 ILE 40 HD13 ILE 40 -18.506 24.285 6.160
317 H THR 41 H THR 41 -14.927 25.520 0.517
318 HA THR 41 HA THR 41 -13.408 27.040 -0.303
319 HB THR 41 HB THR 41 -13.623 28.450 2.411
320 HG1 THR 41 HG1 THR 41 -15.439 29.493 1.309
321 HG21 THR 41 HG21 THR 41 -13.088 30.477 1.064
322 HG22 THR 41 HG22 THR 41 -11.777 29.281 0.874
323 HG23 THR 41 HG23 THR 41 -12.987 29.498 -0.427
324 H GLN 42 H GLN 42 -12.034 24.988 -0.205
325 HA GLN 42 HA GLN 42 -9.947 24.073 0.185
326 HB2 GLN 42 HB2 GLN 42 -9.352 26.451 -0.515
327 HB3 GLN 42 HB3 GLN 42 -9.182 26.871 1.211
328 HG2 GLN 42 HG2 GLN 42 -7.431 25.074 1.474
329 HG3 GLN 42 HG3 GLN 42 -7.558 24.720 -0.274
330 HE21 GLN 42 HE21 GLN 42 -7.101 26.603 -1.847
331 HE22 GLN 42 HE22 GLN 42 -5.911 27.745 -1.344
Start of MODEL 6
1 H1 TYR 1 H1 TYR 1 3.377 -24.328 3.032
2 HA TYR 1 HA TYR 1 5.330 -25.664 2.254
3 HB2 TYR 1 HB2 TYR 1 6.338 -24.909 5.073
4 HB3 TYR 1 HB3 TYR 1 7.211 -25.957 3.930
5 HD1 TYR 1 HD2 TYR 1 7.757 -24.976 1.569
6 HD2 TYR 1 HD1 TYR 1 6.773 -22.518 4.962
7 HE1 TYR 1 HE2 TYR 1 8.783 -23.037 0.455
8 HE2 TYR 1 HE1 TYR 1 7.790 -20.570 3.838
9 HH TYR 1 HH TYR 1 9.287 -20.705 0.598
10 H ALA 2 H ALA 2 5.850 -27.984 3.210
11 HA ALA 2 HA ALA 2 4.768 -29.937 3.890
12 HB1 ALA 2 HB1 ALA 2 4.526 -29.987 6.403
13 HB2 ALA 2 HB2 ALA 2 6.097 -29.360 5.821
14 HB3 ALA 2 HB3 ALA 2 4.873 -28.224 6.432
15 H GLU 3 H GLU 3 2.528 -28.333 6.218
16 HA GLU 3 HA GLU 3 0.320 -29.256 4.513
17 HB2 GLU 3 HB2 GLU 3 0.133 -29.412 6.991
18 HB3 GLU 3 HB3 GLU 3 0.267 -27.638 7.123
19 HG2 GLU 3 HG2 GLU 3 -1.809 -27.450 5.609
20 HG3 GLU 3 HG3 GLU 3 -1.964 -29.221 5.678
21 H GLY 4 H GLY 4 0.094 -27.876 2.595
22 HA2 GLY 4 HA2 GLY 4 0.685 -24.982 2.884
23 HA3 GLY 4 HA3 GLY 4 0.241 -25.841 1.404
24 H THR 5 H THR 5 -1.157 -24.888 4.657
25 HA THR 5 HA THR 5 -3.580 -23.992 3.183
26 HB THR 5 HB THR 5 -3.762 -25.955 5.522
27 HG1 THR 5 HG1 THR 5 -4.326 -26.377 2.748
28 HG21 THR 5 HG21 THR 5 -5.626 -24.258 5.492
29 HG22 THR 5 HG22 THR 5 -5.961 -24.667 3.782
30 HG23 THR 5 HG23 THR 5 -6.206 -25.894 5.059
31 H PHE 6 H PHE 6 -2.422 -24.352 6.709
32 HA PHE 6 HA PHE 6 -3.402 -21.674 7.253
33 HB2 PHE 6 HB2 PHE 6 -3.064 -23.230 9.154
34 HB3 PHE 6 HB3 PHE 6 -1.331 -23.364 8.783
35 HD1 PHE 6 HD1 PHE 6 0.214 -21.458 9.207
36 HD2 PHE 6 HD2 PHE 6 -3.981 -21.105 10.109
37 HE1 PHE 6 HE1 PHE 6 0.651 -19.353 10.426
38 HE2 PHE 6 HE2 PHE 6 -3.535 -19.005 11.340
39 HZ PHE 6 HZ PHE 6 -1.223 -18.112 11.485
40 H ILE 7 H ILE 7 -0.113 -23.150 6.524
41 HA ILE 7 HA ILE 7 1.207 -20.598 6.657
42 HB ILE 7 HB ILE 7 2.029 -23.157 5.160
43 HG12 ILE 7 HG12 ILE 7 3.055 -21.872 7.780
44 HG13 ILE 7 HG13 ILE 7 1.965 -23.276 7.689
45 HG21 ILE 7 HG21 ILE 7 3.622 -20.549 5.597
46 HG22 ILE 7 HG22 ILE 7 4.280 -22.041 4.871
47 HG23 ILE 7 HG23 ILE 7 3.026 -21.147 4.022
48 HD11 ILE 7 HD11 ILE 7 4.199 -24.104 8.128
49 HD12 ILE 7 HD12 ILE 7 3.773 -24.569 6.458
50 HD13 ILE 7 HD13 ILE 7 4.904 -23.215 6.763
51 H SER 8 H SER 8 -0.137 -22.578 3.870
52 HA SER 8 HA SER 8 0.560 -20.774 1.870
53 HB2 SER 8 HB2 SER 8 -0.462 -22.959 1.356
54 HB3 SER 8 HB3 SER 8 -2.029 -22.435 2.030
55 HG SER 8 HG SER 8 -2.045 -20.822 0.267
56 H ASP 9 H ASP 9 -2.507 -20.737 3.911
57 HA ASP 9 HA ASP 9 -3.644 -18.488 2.706
58 HB2 ASP 9 HB2 ASP 9 -4.870 -19.737 4.441
59 HB3 ASP 9 HB3 ASP 9 -3.689 -19.260 5.687
60 H TYR 10 H TYR 10 -1.253 -18.535 5.523
61 HA TYR 10 HA TYR 10 -1.164 -15.718 5.711
62 HB2 TYR 10 HB2 TYR 10 -0.077 -17.138 7.462
63 HB3 TYR 10 HB3 TYR 10 1.135 -17.692 6.283
64 HD1 TYR 10 HD1 TYR 10 -0.307 -14.527 7.788
65 HD2 TYR 10 HD2 TYR 10 3.152 -16.367 6.004
66 HE1 TYR 10 HE1 TYR 10 0.978 -12.440 8.107
67 HE2 TYR 10 HE2 TYR 10 4.466 -14.338 6.457
68 HH TYR 10 HH TYR 10 4.390 -12.044 7.139
69 H SER 11 H SER 11 0.834 -18.005 3.645
70 HA SER 11 HA SER 11 2.653 -16.063 2.772
71 HB2 SER 11 HB2 SER 11 2.935 -18.474 2.232
72 HB3 SER 11 HB3 SER 11 1.543 -18.391 1.103
73 HG SER 11 HG SER 11 3.612 -17.990 -0.014
74 H ILE 12 H ILE 12 -0.681 -16.916 1.537
75 HA ILE 12 HA ILE 12 -0.493 -15.116 -0.703
76 HB ILE 12 HB ILE 12 -2.961 -16.159 0.801
77 HG12 ILE 12 HG12 ILE 12 -1.596 -17.924 -0.435
78 HG13 ILE 12 HG13 ILE 12 -3.280 -17.757 -0.967
79 HG21 ILE 12 HG21 ILE 12 -2.770 -14.474 -1.756
80 HG22 ILE 12 HG22 ILE 12 -4.243 -15.377 -1.283
81 HG23 ILE 12 HG23 ILE 12 -3.627 -14.070 -0.245
82 HD11 ILE 12 HD11 ILE 12 -2.561 -16.538 -3.022
83 HD12 ILE 12 HD12 ILE 12 -0.855 -16.573 -2.483
84 HD13 ILE 12 HD13 ILE 12 -1.701 -18.086 -2.873
85 H ALA 13 H ALA 13 -1.797 -14.739 2.707
86 HA ALA 13 HA ALA 13 -2.844 -12.188 2.241
87 HB1 ALA 13 HB1 ALA 13 -2.647 -11.744 4.678
88 HB2 ALA 13 HB2 ALA 13 -3.263 -13.397 4.373
89 HB3 ALA 13 HB3 ALA 13 -1.569 -13.155 4.883
90 H MET 14 H MET 14 0.497 -12.943 3.613
91 HA MET 14 HA MET 14 1.223 -10.207 3.578
92 HB2 MET 14 HB2 MET 14 3.517 -10.845 3.973
93 HB3 MET 14 HB3 MET 14 2.435 -11.917 4.891
94 HG2 MET 14 HG2 MET 14 4.162 -13.337 3.975
95 HG3 MET 14 HG3 MET 14 2.725 -13.646 2.969
96 HE1 MET 14 HE1 MET 14 5.728 -13.983 0.412
97 HE2 MET 14 HE2 MET 14 5.550 -14.595 2.089
98 HE3 MET 14 HE3 MET 14 4.173 -14.695 0.943
99 H ASP 15 H ASP 15 1.385 -12.715 0.951
100 HA ASP 15 HA ASP 15 3.137 -11.175 -0.691
101 HB2 ASP 15 HB2 ASP 15 2.697 -13.547 -1.227
102 HB3 ASP 15 HB3 ASP 15 0.991 -13.196 -1.578
103 H LYS 16 H LYS 16 -0.529 -11.487 -0.791
104 HA LYS 16 HA LYS 16 -0.961 -9.537 -2.746
105 HB2 LYS 16 HB2 LYS 16 -2.581 -10.261 -0.221
106 HB3 LYS 16 HB3 LYS 16 -3.156 -9.037 -1.382
107 HG2 LYS 16 HG2 LYS 16 -3.111 -10.675 -3.235
108 HG3 LYS 16 HG3 LYS 16 -2.532 -11.960 -2.143
109 HD2 LYS 16 HD2 LYS 16 -4.598 -11.784 -0.771
110 HD3 LYS 16 HD3 LYS 16 -5.193 -10.435 -1.771
111 HE2 LYS 16 HE2 LYS 16 -4.691 -13.286 -2.850
112 HE3 LYS 16 HE3 LYS 16 -6.271 -12.639 -2.349
113 HZ1 LYS 16 HZ1 LYS 16 -6.024 -10.851 -4.113
114 HZ2 LYS 16 HZ2 LYS 16 -4.645 -11.774 -4.749
115 H ILE 17 H ILE 17 -0.377 -9.054 0.802
116 HA ILE 17 HA ILE 17 -1.078 -6.295 0.724
117 HB ILE 17 HB ILE 17 0.663 -7.903 2.647
118 HG12 ILE 17 HG12 ILE 17 -2.084 -6.584 3.118
119 HG13 ILE 17 HG13 ILE 17 -1.953 -8.213 2.433
120 HG21 ILE 17 HG21 ILE 17 -0.102 -4.931 2.849
121 HG22 ILE 17 HG22 ILE 17 0.548 -5.883 4.208
122 HG23 ILE 17 HG23 ILE 17 1.544 -5.631 2.773
123 HD11 ILE 17 HD11 ILE 17 -0.728 -9.022 4.464
124 HD12 ILE 17 HD12 ILE 17 -0.901 -7.414 5.216
125 HD13 ILE 17 HD13 ILE 17 -2.345 -8.384 4.848
126 H HIS 18 H HIS 18 2.094 -7.907 -0.149
127 HA HIS 18 HA HIS 18 3.632 -5.706 0.389
128 HB2 HIS 18 HB2 HIS 18 5.353 -6.459 -1.161
129 HB3 HIS 18 HB3 HIS 18 4.682 -7.788 -0.186
130 HD1 HIS 18 HD1 HIS 18 6.121 -8.927 -2.150
131 HD2 HIS 18 HD2 HIS 18 2.323 -7.433 -3.149
132 HE1 HIS 18 HE1 HIS 18 5.428 -10.126 -4.265
133 H GLN 19 H GLN 19 1.242 -5.647 -2.230
134 HA GLN 19 HA GLN 19 2.590 -3.240 -3.359
135 HB2 GLN 19 HB2 GLN 19 -0.050 -4.631 -4.094
136 HB3 GLN 19 HB3 GLN 19 0.542 -3.113 -4.817
137 HG2 GLN 19 HG2 GLN 19 2.629 -4.262 -5.608
138 HG3 GLN 19 HG3 GLN 19 2.066 -5.791 -4.904
139 HE21 GLN 19 HE21 GLN 19 -0.165 -6.643 -5.753
140 HE22 GLN 19 HE22 GLN 19 -0.502 -6.336 -7.416
141 H GLN 20 H GLN 20 -0.491 -4.168 -1.551
142 HA GLN 20 HA GLN 20 -1.474 -1.602 -1.202
143 HB2 GLN 20 HB2 GLN 20 -2.634 -3.647 -0.367
144 HB3 GLN 20 HB3 GLN 20 -1.393 -3.845 0.904
145 HG2 GLN 20 HG2 GLN 20 -2.074 -1.689 1.950
146 HG3 GLN 20 HG3 GLN 20 -3.275 -1.424 0.650
147 HE21 GLN 20 HE21 GLN 20 -4.502 -1.259 2.959
148 HE22 GLN 20 HE22 GLN 20 -5.268 -2.731 3.433
149 H ASP 21 H ASP 21 1.133 -3.276 0.776
150 HA ASP 21 HA ASP 21 1.400 -1.247 2.685
151 HB2 ASP 21 HB2 ASP 21 2.596 -3.410 2.903
152 HB3 ASP 21 HB3 ASP 21 3.637 -3.014 1.512
153 H PHE 22 H PHE 22 3.140 -1.550 -0.562
154 HA PHE 22 HA PHE 22 4.652 0.820 -0.200
155 HB2 PHE 22 HB2 PHE 22 5.097 -0.645 -2.161
156 HB3 PHE 22 HB3 PHE 22 3.484 -0.301 -2.826
157 HD1 PHE 22 HD1 PHE 22 6.810 1.210 -2.016
158 HD2 PHE 22 HD2 PHE 22 3.012 1.848 -3.941
159 HE1 PHE 22 HE1 PHE 22 7.629 3.365 -2.923
160 HE2 PHE 22 HE2 PHE 22 3.907 3.904 -4.991
161 HZ PHE 22 HZ PHE 22 6.147 4.755 -4.355
162 H VAL 23 H VAL 23 1.277 0.311 -1.492
163 HA VAL 23 HA VAL 23 0.981 3.063 -2.248
164 HB VAL 23 HB VAL 23 -1.150 0.975 -1.538
165 HG11 VAL 23 HG11 VAL 23 -1.504 3.761 -2.815
166 HG12 VAL 23 HG12 VAL 23 -2.772 2.511 -2.712
167 HG13 VAL 23 HG13 VAL 23 -2.132 3.241 -1.226
168 HG21 VAL 23 HG21 VAL 23 0.274 0.462 -3.615
169 HG22 VAL 23 HG22 VAL 23 -1.435 0.761 -3.998
170 HG23 VAL 23 HG23 VAL 23 -0.216 2.030 -4.294
171 H ASN 24 H ASN 24 0.501 1.303 0.921
172 HA ASN 24 HA ASN 24 -0.879 3.351 2.207
173 HB2 ASN 24 HB2 ASN 24 1.350 1.694 3.504
174 HB3 ASN 24 HB3 ASN 24 0.095 2.631 4.347
175 HD21 ASN 24 HD21 ASN 24 0.265 -0.022 5.036
176 HD22 ASN 24 HD22 ASN 24 -1.061 -0.894 4.360
177 H TRP 25 H TRP 25 2.666 3.132 1.368
178 HA TRP 25 HA TRP 25 3.350 5.480 2.836
179 HB2 TRP 25 HB2 TRP 25 5.070 3.920 1.905
180 HB3 TRP 25 HB3 TRP 25 4.685 4.464 0.250
181 HD1 TRP 25 HD1 TRP 25 6.265 5.750 3.524
182 HE1 TRP 25 HE1 TRP 25 7.498 7.903 3.047
183 HE3 TRP 25 HE3 TRP 25 4.791 6.497 -1.379
184 HZ2 TRP 25 HZ2 TRP 25 7.825 9.714 1.014
185 HZ3 TRP 25 HZ3 TRP 25 5.695 8.529 -2.557
186 HH2 TRP 25 HH2 TRP 25 7.171 10.111 -1.370
187 H LEU 26 H LEU 26 2.275 5.038 -0.677
188 HA LEU 26 HA LEU 26 2.418 7.769 -1.327
189 HB2 LEU 26 HB2 LEU 26 0.236 5.793 -2.235
190 HB3 LEU 26 HB3 LEU 26 0.475 7.407 -2.931
191 HG LEU 26 HG LEU 26 2.563 5.155 -3.084
192 HD11 LEU 26 HD11 LEU 26 0.470 4.555 -4.337
193 HD12 LEU 26 HD12 LEU 26 0.498 6.138 -5.161
194 HD13 LEU 26 HD13 LEU 26 1.772 4.937 -5.484
195 HD21 LEU 26 HD21 LEU 26 3.556 6.599 -4.907
196 HD22 LEU 26 HD22 LEU 26 2.354 7.869 -4.551
197 HD23 LEU 26 HD23 LEU 26 3.592 7.438 -3.344
198 H LEU 27 H LEU 27 -0.472 5.983 0.100
199 HA LEU 27 HA LEU 27 -2.091 8.239 -0.225
200 HB2 LEU 27 HB2 LEU 27 -3.832 7.190 1.018
201 HB3 LEU 27 HB3 LEU 27 -2.946 5.961 0.097
202 HG LEU 27 HG LEU 27 -1.646 5.580 2.389
203 HD11 LEU 27 HD11 LEU 27 -2.619 7.516 3.697
204 HD12 LEU 27 HD12 LEU 27 -4.248 6.845 3.453
205 HD13 LEU 27 HD13 LEU 27 -3.050 5.965 4.437
206 HD21 LEU 27 HD21 LEU 27 -3.199 3.890 1.308
207 HD22 LEU 27 HD22 LEU 27 -3.318 3.864 3.084
208 HD23 LEU 27 HD23 LEU 27 -4.582 4.676 2.118
209 H ALA 28 H ALA 28 0.150 7.438 2.482
210 HA ALA 28 HA ALA 28 -0.895 9.292 4.350
211 HB1 ALA 28 HB1 ALA 28 0.903 7.678 4.938
212 HB2 ALA 28 HB2 ALA 28 2.055 8.532 3.875
213 HB3 ALA 28 HB3 ALA 28 1.406 9.351 5.324
214 H GLN 29 H GLN 29 1.599 9.774 1.707
215 HA GLN 29 HA GLN 29 1.803 12.605 2.325
216 HB2 GLN 29 HB2 GLN 29 2.734 10.980 -0.105
217 HB3 GLN 29 HB3 GLN 29 2.896 12.750 -0.017
218 HG2 GLN 29 HG2 GLN 29 5.004 11.624 0.731
219 HG3 GLN 29 HG3 GLN 29 4.287 12.666 1.985
220 HE21 GLN 29 HE21 GLN 29 4.207 9.167 0.883
221 HE22 GLN 29 HE22 GLN 29 4.194 8.531 2.486
222 H LYS 30 H LYS 30 -0.365 10.629 0.182
223 HA LYS 30 HA LYS 30 -1.231 12.842 -1.375
224 HB2 LYS 30 HB2 LYS 30 -1.797 10.365 -1.732
225 HB3 LYS 30 HB3 LYS 30 -3.078 10.534 -0.512
226 HG2 LYS 30 HG2 LYS 30 -2.788 12.049 -3.196
227 HG3 LYS 30 HG3 LYS 30 -3.894 10.696 -2.869
228 HD2 LYS 30 HD2 LYS 30 -4.125 13.555 -1.750
229 HD3 LYS 30 HD3 LYS 30 -5.150 12.766 -2.952
230 HE2 LYS 30 HE2 LYS 30 -5.900 11.078 -1.217
231 HE3 LYS 30 HE3 LYS 30 -4.973 11.964 0.021
232 HZ1 LYS 30 HZ1 LYS 30 -6.333 13.985 -0.433
233 HZ2 LYS 30 HZ2 LYS 30 -7.301 13.061 -1.586
234 H GLY 31 H GLY 31 -2.446 11.496 1.851
235 HA2 GLY 31 HA2 GLY 31 -4.488 13.400 2.194
236 HA3 GLY 31 HA3 GLY 31 -3.599 12.641 3.540
237 H LYS 32 H LYS 32 -0.994 13.576 3.262
238 HA LYS 32 HA LYS 32 -1.152 16.189 4.364
239 HB2 LYS 32 HB2 LYS 32 0.776 14.635 4.626
240 HB3 LYS 32 HB3 LYS 32 1.209 14.856 2.903
241 HG2 LYS 32 HG2 LYS 32 1.632 17.253 3.273
242 HG3 LYS 32 HG3 LYS 32 1.174 17.118 4.991
243 HD2 LYS 32 HD2 LYS 32 3.575 15.781 3.560
244 HD3 LYS 32 HD3 LYS 32 3.638 17.189 4.661
245 HE2 LYS 32 HE2 LYS 32 2.989 14.277 5.406
246 HE3 LYS 32 HE3 LYS 32 4.372 15.262 5.933
247 HZ1 LYS 32 HZ1 LYS 32 2.563 15.111 7.672
248 HZ2 LYS 32 HZ2 LYS 32 2.798 16.773 7.139
249 H LYS 33 H LYS 33 -0.784 15.064 0.940
250 HA LYS 33 HA LYS 33 -0.754 16.231 -1.027
251 HB2 LYS 33 HB2 LYS 33 -3.125 16.541 -0.048
252 HB3 LYS 33 HB3 LYS 33 -2.626 18.170 0.451
253 HG2 LYS 33 HG2 LYS 33 -2.297 18.833 -1.925
254 HG3 LYS 33 HG3 LYS 33 -2.412 17.139 -2.461
255 HD2 LYS 33 HD2 LYS 33 -4.479 18.291 -3.030
256 HD3 LYS 33 HD3 LYS 33 -4.810 17.036 -1.808
257 HE2 LYS 33 HE2 LYS 33 -4.930 18.806 -0.019
258 HE3 LYS 33 HE3 LYS 33 -4.475 20.051 -1.225
259 HZ1 LYS 33 HZ1 LYS 33 -6.993 18.348 -1.291
260 HZ2 LYS 33 HZ2 LYS 33 -6.897 20.079 -0.980
261 H ASN 34 H ASN 34 1.525 16.661 0.437
262 HA ASN 34 HA ASN 34 3.127 18.234 0.988
263 HB2 ASN 34 HB2 ASN 34 2.451 19.269 -1.818
264 HB3 ASN 34 HB3 ASN 34 4.041 19.219 -1.000
265 HD21 ASN 34 HD21 ASN 34 4.571 18.205 -3.233
266 HD22 ASN 34 HD22 ASN 34 4.383 16.494 -3.340
267 H ASP 35 H ASP 35 0.853 19.185 2.324
268 HA ASP 35 HA ASP 35 0.249 21.882 1.706
269 HB2 ASP 35 HB2 ASP 35 -0.983 20.672 3.473
270 HB3 ASP 35 HB3 ASP 35 0.491 20.503 4.456
271 H TRP 36 H TRP 36 2.919 20.434 3.786
272 HA TRP 36 HA TRP 36 4.590 22.811 3.086
273 HB2 TRP 36 HB2 TRP 36 3.254 23.308 5.175
274 HB3 TRP 36 HB3 TRP 36 3.949 21.870 5.958
275 HD1 TRP 36 HD1 TRP 36 4.886 25.405 4.736
276 HE1 TRP 36 HE1 TRP 36 7.045 26.134 5.815
277 HE3 TRP 36 HE3 TRP 36 6.153 21.012 7.187
278 HZ2 TRP 36 HZ2 TRP 36 9.011 25.137 7.431
279 HZ3 TRP 36 HZ3 TRP 36 8.212 21.052 8.605
280 HH2 TRP 36 HH2 TRP 36 9.630 23.077 8.712
281 H LYS 37 H LYS 37 4.750 20.126 2.028
282 HA LYS 37 HA LYS 37 7.048 18.940 3.548
283 HB2 LYS 37 HB2 LYS 37 5.202 17.469 2.726
284 HB3 LYS 37 HB3 LYS 37 5.556 17.974 1.053
285 HG2 LYS 37 HG2 LYS 37 7.820 16.937 1.176
286 HG3 LYS 37 HG3 LYS 37 7.617 16.618 2.911
287 HD2 LYS 37 HD2 LYS 37 7.299 14.559 1.552
288 HD3 LYS 37 HD3 LYS 37 5.852 14.966 2.510
289 HE2 LYS 37 HE2 LYS 37 5.287 14.180 0.221
290 HE3 LYS 37 HE3 LYS 37 4.705 15.837 0.466
291 HZ1 LYS 37 HZ1 LYS 37 6.035 15.208 -1.748
292 HZ2 LYS 37 HZ2 LYS 37 6.474 16.702 -0.949
293 H HIS 38 H HIS 38 8.193 21.117 3.059
294 HA HIS 38 HA HIS 38 9.388 22.526 1.668
295 HB2 HIS 38 HB2 HIS 38 10.843 20.443 1.920
296 HB3 HIS 38 HB3 HIS 38 10.201 19.856 0.367
297 HD1 HIS 38 HD1 HIS 38 12.918 20.006 0.099
298 HD2 HIS 38 HD2 HIS 38 10.724 23.598 -0.077
299 HE1 HIS 38 HE1 HIS 38 14.404 21.676 -1.085
300 H ASN 39 H ASN 39 6.767 22.618 0.987
301 HA ASN 39 HA ASN 39 6.598 22.146 -1.949
302 HB2 ASN 39 HB2 ASN 39 4.711 21.541 -0.399
303 HB3 ASN 39 HB3 ASN 39 4.506 23.250 0.027
304 HD21 ASN 39 HD21 ASN 39 4.584 20.987 -2.872
305 HD22 ASN 39 HD22 ASN 39 3.482 21.929 -3.802
306 H ILE 40 H ILE 40 8.632 23.787 -1.854
307 HA ILE 40 HA ILE 40 9.446 25.924 -2.113
308 HB ILE 40 HB ILE 40 6.730 26.539 -3.389
309 HG12 ILE 40 HG12 ILE 40 9.104 24.967 -4.578
310 HG13 ILE 40 HG13 ILE 40 7.472 24.336 -4.241
311 HG21 ILE 40 HG21 ILE 40 9.572 27.493 -4.136
312 HG22 ILE 40 HG22 ILE 40 8.032 28.086 -4.822
313 HG23 ILE 40 HG23 ILE 40 8.449 28.457 -3.147
314 HD11 ILE 40 HD11 ILE 40 8.222 26.372 -6.425
315 HD12 ILE 40 HD12 ILE 40 7.585 24.727 -6.621
316 HD13 ILE 40 HD13 ILE 40 6.535 26.005 -5.946
317 H THR 41 H THR 41 8.653 25.389 0.491
318 HA THR 41 HA THR 41 8.150 28.149 1.345
319 HB THR 41 HB THR 41 5.819 27.402 0.914
320 HG1 THR 41 HG1 THR 41 6.334 27.557 3.714
321 HG21 THR 41 HG21 THR 41 4.818 25.504 2.211
322 HG22 THR 41 HG22 THR 41 6.077 24.962 1.076
323 HG23 THR 41 HG23 THR 41 6.444 25.044 2.809
324 H GLN 42 H GLN 42 10.461 26.435 1.731
325 HA GLN 42 HA GLN 42 10.566 26.613 4.649
326 HB2 GLN 42 HB2 GLN 42 9.343 24.487 4.461
327 HB3 GLN 42 HB3 GLN 42 10.451 23.903 3.201
328 HG2 GLN 42 HG2 GLN 42 11.425 24.550 6.046
329 HG3 GLN 42 HG3 GLN 42 10.763 22.953 5.608
330 HE21 GLN 42 HE21 GLN 42 13.293 22.827 6.589
331 HE22 GLN 42 HE22 GLN 42 14.406 22.533 5.303
Start of MODEL 7
1 H1 TYR 1 H1 TYR 1 1.420 -27.979 12.953
2 HA TYR 1 HA TYR 1 0.057 -26.077 12.130
3 HB2 TYR 1 HB2 TYR 1 2.738 -25.285 10.824
4 HB3 TYR 1 HB3 TYR 1 1.206 -24.401 10.643
5 HD1 TYR 1 HD1 TYR 1 0.153 -23.261 12.626
6 HD2 TYR 1 HD2 TYR 1 4.058 -25.055 12.904
7 HE1 TYR 1 HE1 TYR 1 0.534 -22.119 14.786
8 HE2 TYR 1 HE2 TYR 1 4.452 -23.878 15.029
9 HH TYR 1 HH TYR 1 3.465 -22.564 16.769
10 H ALA 2 H ALA 2 -0.686 -25.867 9.731
11 HA ALA 2 HA ALA 2 -0.555 -28.548 8.623
12 HB1 ALA 2 HB1 ALA 2 -2.005 -27.606 6.785
13 HB2 ALA 2 HB2 ALA 2 -2.633 -27.186 8.409
14 HB3 ALA 2 HB3 ALA 2 -1.734 -25.970 7.451
15 H GLU 3 H GLU 3 0.141 -29.005 6.302
16 HA GLU 3 HA GLU 3 2.769 -28.010 5.821
17 HB2 GLU 3 HB2 GLU 3 1.996 -30.177 4.883
18 HB3 GLU 3 HB3 GLU 3 0.790 -29.344 3.865
19 HG2 GLU 3 HG2 GLU 3 2.814 -29.989 2.548
20 HG3 GLU 3 HG3 GLU 3 2.573 -28.226 2.555
21 H GLY 4 H GLY 4 -0.493 -27.176 4.323
22 HA2 GLY 4 HA2 GLY 4 0.567 -24.460 3.782
23 HA3 GLY 4 HA3 GLY 4 0.202 -25.484 2.369
24 H THR 5 H THR 5 -1.277 -24.350 5.515
25 HA THR 5 HA THR 5 -3.678 -23.568 3.927
26 HB THR 5 HB THR 5 -3.875 -25.255 6.477
27 HG1 THR 5 HG1 THR 5 -4.667 -26.819 4.889
28 HG21 THR 5 HG21 THR 5 -5.714 -23.525 6.217
29 HG22 THR 5 HG22 THR 5 -6.055 -24.167 4.579
30 HG23 THR 5 HG23 THR 5 -6.329 -25.192 6.015
31 H PHE 6 H PHE 6 -2.558 -23.539 7.476
32 HA PHE 6 HA PHE 6 -3.353 -20.770 7.737
33 HB2 PHE 6 HB2 PHE 6 -2.927 -22.110 9.786
34 HB3 PHE 6 HB3 PHE 6 -1.244 -22.400 9.305
35 HD1 PHE 6 HD2 PHE 6 -3.615 -19.829 10.571
36 HD2 PHE 6 HD1 PHE 6 0.458 -20.607 9.417
37 HE1 PHE 6 HE2 PHE 6 -2.936 -17.620 11.456
38 HE2 PHE 6 HE1 PHE 6 1.127 -18.390 10.284
39 HZ PHE 6 HZ PHE 6 -0.578 -16.864 11.250
40 H ILE 7 H ILE 7 -0.222 -22.515 6.982
41 HA ILE 7 HA ILE 7 1.298 -20.102 6.813
42 HB ILE 7 HB ILE 7 1.790 -22.832 5.503
43 HG12 ILE 7 HG12 ILE 7 3.150 -21.541 7.961
44 HG13 ILE 7 HG13 ILE 7 1.830 -22.718 8.076
45 HG21 ILE 7 HG21 ILE 7 2.953 -21.009 4.208
46 HG22 ILE 7 HG22 ILE 7 3.695 -20.414 5.720
47 HG23 ILE 7 HG23 ILE 7 4.125 -22.017 5.055
48 HD11 ILE 7 HD11 ILE 7 3.247 -24.433 6.860
49 HD12 ILE 7 HD12 ILE 7 4.632 -23.302 6.943
50 HD13 ILE 7 HD13 ILE 7 3.895 -23.913 8.441
51 H SER 8 H SER 8 -0.430 -22.103 4.244
52 HA SER 8 HA SER 8 0.435 -20.447 2.114
53 HB2 SER 8 HB2 SER 8 -2.190 -22.037 2.342
54 HB3 SER 8 HB3 SER 8 -1.556 -21.324 0.835
55 HG SER 8 HG SER 8 0.315 -22.767 1.127
56 H ASP 9 H ASP 9 -2.661 -20.275 4.089
57 HA ASP 9 HA ASP 9 -3.770 -18.090 2.737
58 HB2 ASP 9 HB2 ASP 9 -5.034 -19.248 4.514
59 HB3 ASP 9 HB3 ASP 9 -3.869 -18.742 5.755
60 H TYR 10 H TYR 10 -1.478 -18.033 5.592
61 HA TYR 10 HA TYR 10 -1.342 -15.207 5.718
62 HB2 TYR 10 HB2 TYR 10 -0.432 -16.593 7.535
63 HB3 TYR 10 HB3 TYR 10 0.766 -17.329 6.452
64 HD1 TYR 10 HD2 TYR 10 -0.267 -14.070 8.011
65 HD2 TYR 10 HD1 TYR 10 2.813 -16.149 5.844
66 HE1 TYR 10 HE2 TYR 10 1.328 -12.281 8.575
67 HE2 TYR 10 HE1 TYR 10 4.415 -14.355 6.407
68 HH TYR 10 HH TYR 10 3.538 -11.426 8.247
69 H SER 11 H SER 11 0.712 -17.578 3.817
70 HA SER 11 HA SER 11 2.494 -15.622 2.825
71 HB2 SER 11 HB2 SER 11 2.887 -18.083 2.543
72 HB3 SER 11 HB3 SER 11 1.521 -18.171 1.382
73 HG SER 11 HG SER 11 3.598 -17.818 0.272
74 H ILE 12 H ILE 12 -0.802 -16.616 1.644
75 HA ILE 12 HA ILE 12 -0.539 -15.110 -0.813
76 HB ILE 12 HB ILE 12 -3.022 -15.992 0.765
77 HG12 ILE 12 HG12 ILE 12 -1.698 -17.887 -0.222
78 HG13 ILE 12 HG13 ILE 12 -3.334 -17.730 -0.888
79 HG21 ILE 12 HG21 ILE 12 -4.311 -15.443 -1.373
80 HG22 ILE 12 HG22 ILE 12 -3.714 -14.029 -0.468
81 HG23 ILE 12 HG23 ILE 12 -2.864 -14.552 -1.942
82 HD11 ILE 12 HD11 ILE 12 -1.728 -18.290 -2.665
83 HD12 ILE 12 HD12 ILE 12 -2.360 -16.656 -2.971
84 HD13 ILE 12 HD13 ILE 12 -0.715 -16.877 -2.302
85 H ALA 13 H ALA 13 -1.945 -14.343 2.477
86 HA ALA 13 HA ALA 13 -2.775 -11.749 1.811
87 HB1 ALA 13 HB1 ALA 13 -2.482 -11.159 4.216
88 HB2 ALA 13 HB2 ALA 13 -3.202 -12.787 4.069
89 HB3 ALA 13 HB3 ALA 13 -1.469 -12.608 4.478
90 H MET 14 H MET 14 0.552 -12.958 2.736
91 HA MET 14 HA MET 14 1.691 -10.298 2.684
92 HB2 MET 14 HB2 MET 14 3.057 -13.025 2.284
93 HB3 MET 14 HB3 MET 14 3.907 -11.470 2.461
94 HG2 MET 14 HG2 MET 14 2.122 -12.755 4.644
95 HG3 MET 14 HG3 MET 14 3.903 -12.689 4.593
96 HE1 MET 14 HE1 MET 14 0.586 -10.621 4.767
97 HE2 MET 14 HE2 MET 14 1.042 -10.848 6.478
98 HE3 MET 14 HE3 MET 14 1.100 -9.213 5.749
99 H ASP 15 H ASP 15 1.360 -12.880 0.107
100 HA ASP 15 HA ASP 15 2.971 -11.584 -1.773
101 HB2 ASP 15 HB2 ASP 15 1.990 -13.795 -2.280
102 HB3 ASP 15 HB3 ASP 15 0.348 -13.103 -2.307
103 H LYS 16 H LYS 16 -0.614 -10.998 -1.106
104 HA LYS 16 HA LYS 16 -0.623 -8.887 -3.106
105 HB2 LYS 16 HB2 LYS 16 -2.690 -9.406 -0.886
106 HB3 LYS 16 HB3 LYS 16 -2.834 -8.236 -2.224
107 HG2 LYS 16 HG2 LYS 16 -2.567 -10.171 -3.881
108 HG3 LYS 16 HG3 LYS 16 -2.626 -11.300 -2.501
109 HD2 LYS 16 HD2 LYS 16 -4.928 -10.392 -1.903
110 HD3 LYS 16 HD3 LYS 16 -4.850 -9.313 -3.322
111 HE2 LYS 16 HE2 LYS 16 -6.154 -11.358 -3.898
112 HE3 LYS 16 HE3 LYS 16 -4.632 -11.317 -4.836
113 HZ1 LYS 16 HZ1 LYS 16 -5.171 -12.949 -2.332
114 HZ2 LYS 16 HZ2 LYS 16 -4.853 -13.556 -3.951
115 H ILE 17 H ILE 17 -0.476 -8.938 0.548
116 HA ILE 17 HA ILE 17 -0.720 -6.121 0.729
117 HB ILE 17 HB ILE 17 0.459 -8.124 2.696
118 HG12 ILE 17 HG12 ILE 17 -2.128 -6.431 2.824
119 HG13 ILE 17 HG13 ILE 17 -2.085 -8.065 2.134
120 HG21 ILE 17 HG21 ILE 17 0.075 -5.099 3.099
121 HG22 ILE 17 HG22 ILE 17 0.432 -6.249 4.417
122 HG23 ILE 17 HG23 ILE 17 1.625 -6.000 3.144
123 HD11 ILE 17 HD11 ILE 17 -2.884 -8.262 4.416
124 HD12 ILE 17 HD12 ILE 17 -1.245 -8.965 4.357
125 HD13 ILE 17 HD13 ILE 17 -1.509 -7.352 5.076
126 H HIS 18 H HIS 18 2.166 -8.101 -0.112
127 HA HIS 18 HA HIS 18 4.135 -6.238 0.513
128 HB2 HIS 18 HB2 HIS 18 4.762 -8.373 -0.460
129 HB3 HIS 18 HB3 HIS 18 3.892 -8.030 -1.977
130 HD1 HIS 18 HD1 HIS 18 4.870 -6.196 -3.518
131 HD2 HIS 18 HD2 HIS 18 7.247 -7.197 -0.198
132 HE1 HIS 18 HE1 HIS 18 7.144 -5.215 -3.995
133 H GLN 19 H GLN 19 2.030 -6.216 -2.515
134 HA GLN 19 HA GLN 19 3.324 -3.743 -3.389
135 HB2 GLN 19 HB2 GLN 19 0.703 -5.022 -4.358
136 HB3 GLN 19 HB3 GLN 19 1.507 -3.607 -5.090
137 HG2 GLN 19 HG2 GLN 19 3.535 -5.012 -5.599
138 HG3 GLN 19 HG3 GLN 19 2.745 -6.427 -4.863
139 HE21 GLN 19 HE21 GLN 19 2.300 -3.954 -7.536
140 HE22 GLN 19 HE22 GLN 19 1.418 -5.032 -8.555
141 H GLN 20 H GLN 20 0.065 -4.572 -1.902
142 HA GLN 20 HA GLN 20 -0.944 -1.963 -2.042
143 HB2 GLN 20 HB2 GLN 20 -2.260 -4.012 -1.340
144 HB3 GLN 20 HB3 GLN 20 -1.437 -3.953 0.245
145 HG2 GLN 20 HG2 GLN 20 -2.395 -1.663 0.643
146 HG3 GLN 20 HG3 GLN 20 -3.263 -1.752 -0.910
147 HE21 GLN 20 HE21 GLN 20 -4.796 -3.788 -1.156
148 HE22 GLN 20 HE22 GLN 20 -5.616 -4.273 0.282
149 H ASP 21 H ASP 21 1.236 -3.452 0.439
150 HA ASP 21 HA ASP 21 1.176 -1.359 2.308
151 HB2 ASP 21 HB2 ASP 21 2.304 -3.508 2.780
152 HB3 ASP 21 HB3 ASP 21 3.514 -3.195 1.503
153 H PHE 22 H PHE 22 3.381 -1.707 -0.658
154 HA PHE 22 HA PHE 22 4.788 0.706 -0.159
155 HB2 PHE 22 HB2 PHE 22 5.447 -0.751 -2.067
156 HB3 PHE 22 HB3 PHE 22 3.901 -0.439 -2.884
157 HD1 PHE 22 HD1 PHE 22 7.149 1.089 -1.881
158 HD2 PHE 22 HD2 PHE 22 3.417 1.763 -3.917
159 HE1 PHE 22 HE1 PHE 22 8.067 3.157 -2.883
160 HE2 PHE 22 HE2 PHE 22 4.333 3.839 -4.900
161 HZ PHE 22 HZ PHE 22 6.654 4.548 -4.381
162 H VAL 23 H VAL 23 1.558 0.098 -1.736
163 HA VAL 23 HA VAL 23 1.241 2.849 -2.478
164 HB VAL 23 HB VAL 23 -0.869 0.654 -2.097
165 HG11 VAL 23 HG11 VAL 23 -1.181 3.510 -3.199
166 HG12 VAL 23 HG12 VAL 23 -2.378 2.208 -3.437
167 HG13 VAL 23 HG13 VAL 23 -2.031 2.797 -1.797
168 HG21 VAL 23 HG21 VAL 23 0.825 0.302 -3.978
169 HG22 VAL 23 HG22 VAL 23 -0.823 0.577 -4.591
170 HG23 VAL 23 HG23 VAL 23 0.379 1.897 -4.635
171 H ASN 24 H ASN 24 0.671 1.145 0.676
172 HA ASN 24 HA ASN 24 -1.007 3.123 1.796
173 HB2 ASN 24 HB2 ASN 24 1.224 1.535 3.189
174 HB3 ASN 24 HB3 ASN 24 0.139 2.670 4.006
175 HD21 ASN 24 HD21 ASN 24 -1.524 0.656 1.497
176 HD22 ASN 24 HD22 ASN 24 -2.248 -0.334 2.699
177 H TRP 25 H TRP 25 2.621 3.047 1.279
178 HA TRP 25 HA TRP 25 3.145 5.369 2.794
179 HB2 TRP 25 HB2 TRP 25 4.958 3.918 1.896
180 HB3 TRP 25 HB3 TRP 25 4.626 4.476 0.232
181 HD1 TRP 25 HD1 TRP 25 6.257 5.583 3.493
182 HE1 TRP 25 HE1 TRP 25 7.380 7.818 3.183
183 HE3 TRP 25 HE3 TRP 25 4.522 6.770 -1.247
184 HZ2 TRP 25 HZ2 TRP 25 7.558 9.829 1.338
185 HZ3 TRP 25 HZ3 TRP 25 5.126 9.052 -2.138
186 HH2 TRP 25 HH2 TRP 25 6.635 10.527 -0.882
187 H LEU 26 H LEU 26 2.205 5.031 -0.745
188 HA LEU 26 HA LEU 26 2.212 7.855 -1.229
189 HB2 LEU 26 HB2 LEU 26 0.355 5.704 -2.421
190 HB3 LEU 26 HB3 LEU 26 0.465 7.368 -3.027
191 HG LEU 26 HG LEU 26 2.857 5.428 -3.025
192 HD11 LEU 26 HD11 LEU 26 0.788 6.031 -5.231
193 HD12 LEU 26 HD12 LEU 26 2.334 5.192 -5.524
194 HD13 LEU 26 HD13 LEU 26 1.105 4.451 -4.466
195 HD21 LEU 26 HD21 LEU 26 2.385 7.979 -4.702
196 HD22 LEU 26 HD22 LEU 26 3.366 7.961 -3.221
197 HD23 LEU 26 HD23 LEU 26 3.876 6.998 -4.616
198 H LEU 27 H LEU 27 -0.414 5.620 -0.066
199 HA LEU 27 HA LEU 27 -2.436 7.517 -0.162
200 HB2 LEU 27 HB2 LEU 27 -2.852 5.102 0.228
201 HB3 LEU 27 HB3 LEU 27 -2.083 5.219 1.834
202 HG LEU 27 HG LEU 27 -3.869 6.614 2.718
203 HD11 LEU 27 HD11 LEU 27 -5.947 7.123 1.328
204 HD12 LEU 27 HD12 LEU 27 -4.525 8.024 0.785
205 HD13 LEU 27 HD13 LEU 27 -5.062 6.584 -0.129
206 HD21 LEU 27 HD21 LEU 27 -5.049 4.235 1.153
207 HD22 LEU 27 HD22 LEU 27 -4.211 4.126 2.731
208 HD23 LEU 27 HD23 LEU 27 -5.761 4.997 2.604
209 H ALA 28 H ALA 28 -0.015 6.881 2.493
210 HA ALA 28 HA ALA 28 -1.439 8.447 4.421
211 HB1 ALA 28 HB1 ALA 28 0.685 8.476 5.719
212 HB2 ALA 28 HB2 ALA 28 0.319 6.830 5.116
213 HB3 ALA 28 HB3 ALA 28 1.574 7.818 4.310
214 H GLN 29 H GLN 29 1.360 9.265 2.171
215 HA GLN 29 HA GLN 29 1.656 11.872 3.290
216 HB2 GLN 29 HB2 GLN 29 2.544 10.708 0.614
217 HB3 GLN 29 HB3 GLN 29 2.605 12.464 0.874
218 HG2 GLN 29 HG2 GLN 29 4.784 11.273 1.439
219 HG3 GLN 29 HG3 GLN 29 4.130 12.341 2.698
220 HE21 GLN 29 HE21 GLN 29 3.847 8.808 1.725
221 HE22 GLN 29 HE22 GLN 29 4.009 8.226 3.342
222 H LYS 30 H LYS 30 -0.012 11.003 0.087
223 HA LYS 30 HA LYS 30 -1.009 13.564 -0.268
224 HB2 LYS 30 HB2 LYS 30 -2.797 12.683 -1.676
225 HB3 LYS 30 HB3 LYS 30 -1.301 11.750 -1.933
226 HG2 LYS 30 HG2 LYS 30 -2.250 9.977 -0.319
227 HG3 LYS 30 HG3 LYS 30 -3.750 10.932 -0.219
228 HD2 LYS 30 HD2 LYS 30 -4.154 9.148 -1.785
229 HD3 LYS 30 HD3 LYS 30 -4.051 10.656 -2.733
230 HE2 LYS 30 HE2 LYS 30 -1.730 10.029 -3.473
231 HE3 LYS 30 HE3 LYS 30 -1.747 8.628 -2.361
232 HZ1 LYS 30 HZ1 LYS 30 -3.607 9.003 -4.727
233 HZ2 LYS 30 HZ2 LYS 30 -2.269 7.869 -4.606
234 H GLY 31 H GLY 31 -2.298 11.080 2.066
235 HA2 GLY 31 HA2 GLY 31 -4.699 12.428 2.703
236 HA3 GLY 31 HA3 GLY 31 -3.741 11.471 3.860
237 H LYS 32 H LYS 32 -1.335 12.838 4.124
238 HA LYS 32 HA LYS 32 -2.192 15.136 5.720
239 HB2 LYS 32 HB2 LYS 32 0.587 14.004 5.050
240 HB3 LYS 32 HB3 LYS 32 0.357 15.569 5.852
241 HG2 LYS 32 HG2 LYS 32 0.782 13.824 7.499
242 HG3 LYS 32 HG3 LYS 32 -0.814 14.571 7.748
243 HD2 LYS 32 HD2 LYS 32 -1.927 12.591 6.700
244 HD3 LYS 32 HD3 LYS 32 -0.329 11.866 6.334
245 HE2 LYS 32 HE2 LYS 32 0.183 11.727 8.777
246 HE3 LYS 32 HE3 LYS 32 -1.396 12.478 9.164
247 HZ1 LYS 32 HZ1 LYS 32 -1.476 10.018 9.366
248 HZ2 LYS 32 HZ2 LYS 32 -2.503 10.521 8.040
249 H LYS 33 H LYS 33 -0.012 14.812 2.808
250 HA LYS 33 HA LYS 33 0.174 16.110 0.942
251 HB2 LYS 33 HB2 LYS 33 -2.357 16.245 1.035
252 HB3 LYS 33 HB3 LYS 33 -2.205 17.844 1.807
253 HG2 LYS 33 HG2 LYS 33 -0.764 18.586 -0.167
254 HG3 LYS 33 HG3 LYS 33 -1.080 17.017 -0.947
255 HD2 LYS 33 HD2 LYS 33 -3.194 19.144 -0.209
256 HD3 LYS 33 HD3 LYS 33 -2.569 18.790 -1.840
257 HE2 LYS 33 HE2 LYS 33 -4.329 16.960 -0.101
258 HE3 LYS 33 HE3 LYS 33 -4.743 17.719 -1.653
259 HZ1 LYS 33 HZ1 LYS 33 -4.127 15.303 -1.894
260 HZ2 LYS 33 HZ2 LYS 33 -2.991 16.323 -2.760
261 H ASN 34 H ASN 34 2.094 16.393 2.544
262 HA ASN 34 HA ASN 34 3.618 17.830 3.545
263 HB2 ASN 34 HB2 ASN 34 2.446 19.778 1.468
264 HB3 ASN 34 HB3 ASN 34 4.083 19.825 2.173
265 HD21 ASN 34 HD21 ASN 34 5.477 17.728 1.786
266 HD22 ASN 34 HD22 ASN 34 5.257 16.944 0.265
267 H ASP 35 H ASP 35 1.483 17.579 5.215
268 HA ASP 35 HA ASP 35 0.798 20.377 6.059
269 HB2 ASP 35 HB2 ASP 35 -1.058 18.710 5.918
270 HB3 ASP 35 HB3 ASP 35 -0.227 17.677 7.110
271 H TRP 36 H TRP 36 3.398 20.304 6.248
272 HA TRP 36 HA TRP 36 5.274 20.051 7.561
273 HB2 TRP 36 HB2 TRP 36 3.826 21.807 8.708
274 HB3 TRP 36 HB3 TRP 36 3.307 20.573 9.884
275 HD1 TRP 36 HD1 TRP 36 6.356 22.576 8.682
276 HE1 TRP 36 HE1 TRP 36 8.259 22.388 10.319
277 HE3 TRP 36 HE3 TRP 36 4.294 19.202 12.063
278 HZ2 TRP 36 HZ2 TRP 36 8.980 20.947 12.518
279 HZ3 TRP 36 HZ3 TRP 36 5.770 18.414 13.917
280 HH2 TRP 36 HH2 TRP 36 8.076 19.277 14.149
281 H LYS 37 H LYS 37 4.654 17.572 6.723
282 HA LYS 37 HA LYS 37 5.331 16.036 9.212
283 HB2 LYS 37 HB2 LYS 37 2.905 15.746 8.259
284 HB3 LYS 37 HB3 LYS 37 3.661 14.796 6.969
285 HG2 LYS 37 HG2 LYS 37 3.775 14.254 10.032
286 HG3 LYS 37 HG3 LYS 37 2.779 13.410 8.835
287 HD2 LYS 37 HD2 LYS 37 4.463 11.852 9.143
288 HD3 LYS 37 HD3 LYS 37 5.062 12.693 7.705
289 HE2 LYS 37 HE2 LYS 37 6.630 14.023 9.301
290 HE3 LYS 37 HE3 LYS 37 5.940 13.102 10.655
291 HZ1 LYS 37 HZ1 LYS 37 8.112 12.194 9.782
292 HZ2 LYS 37 HZ2 LYS 37 6.816 11.022 9.595
293 H HIS 38 H HIS 38 7.336 17.143 8.127
294 HA HIS 38 HA HIS 38 9.068 15.189 7.292
295 HB2 HIS 38 HB2 HIS 38 8.016 14.809 5.069
296 HB3 HIS 38 HB3 HIS 38 7.868 16.570 4.816
297 HD1 HIS 38 HD1 HIS 38 10.618 14.028 5.537
298 HD2 HIS 38 HD2 HIS 38 9.892 17.554 3.364
299 HE1 HIS 38 HE1 HIS 38 12.742 14.482 4.245
300 H ASN 39 H ASN 39 11.002 16.369 8.001
301 HA ASN 39 HA ASN 39 11.232 19.211 7.078
302 HB2 ASN 39 HB2 ASN 39 11.529 18.338 10.007
303 HB3 ASN 39 HB3 ASN 39 11.474 19.998 9.376
304 HD21 ASN 39 HD21 ASN 39 9.196 20.285 7.903
305 HD22 ASN 39 HD22 ASN 39 7.807 19.700 8.737
306 H ILE 40 H ILE 40 12.694 17.592 5.706
307 HA ILE 40 HA ILE 40 14.877 17.046 5.184
308 HB ILE 40 HB ILE 40 15.595 19.212 7.242
309 HG12 ILE 40 HG12 ILE 40 14.954 19.427 4.235
310 HG13 ILE 40 HG13 ILE 40 13.919 19.991 5.575
311 HG21 ILE 40 HG21 ILE 40 17.535 17.794 6.602
312 HG22 ILE 40 HG22 ILE 40 17.151 17.992 4.871
313 HG23 ILE 40 HG23 ILE 40 17.703 19.381 5.844
314 HD11 ILE 40 HD11 ILE 40 15.026 21.949 4.744
315 HD12 ILE 40 HD12 ILE 40 15.825 21.563 6.294
316 HD13 ILE 40 HD13 ILE 40 16.628 21.176 4.738
317 H THR 41 H THR 41 14.608 14.838 6.027
318 HA THR 41 HA THR 41 14.682 13.186 7.667
319 HB THR 41 HB THR 41 16.898 13.007 6.811
320 HG1 THR 41 HG1 THR 41 17.034 12.956 9.669
321 HG21 THR 41 HG21 THR 41 17.752 15.294 6.877
322 HG22 THR 41 HG22 THR 41 17.726 15.314 8.672
323 HG23 THR 41 HG23 THR 41 18.854 14.241 7.805
324 H GLN 42 H GLN 42 13.024 15.006 8.556
325 HA GLN 42 HA GLN 42 12.171 16.033 10.441
326 HB2 GLN 42 HB2 GLN 42 13.539 13.691 11.864
327 HB3 GLN 42 HB3 GLN 42 12.156 14.666 12.439
328 HG2 GLN 42 HG2 GLN 42 10.817 13.869 10.399
329 HG3 GLN 42 HG3 GLN 42 12.207 12.856 9.928
330 HE21 GLN 42 HE21 GLN 42 9.900 13.465 12.722
331 HE22 GLN 42 HE22 GLN 42 9.941 11.833 13.278
Start of MODEL 8
1 H1 TYR 1 H1 TYR 1 2.939 -25.959 2.840
2 HA TYR 1 HA TYR 1 4.612 -27.744 2.879
3 HB2 TYR 1 HB2 TYR 1 5.760 -26.061 5.192
4 HB3 TYR 1 HB3 TYR 1 6.443 -27.596 4.611
5 HD1 TYR 1 HD1 TYR 1 7.459 -27.735 2.308
6 HD2 TYR 1 HD2 TYR 1 6.023 -23.987 3.862
7 HE1 TYR 1 HE1 TYR 1 8.652 -26.542 0.516
8 HE2 TYR 1 HE2 TYR 1 7.224 -22.791 2.063
9 HH TYR 1 HH TYR 1 9.195 -24.413 -0.434
10 H ALA 2 H ALA 2 4.660 -29.600 4.531
11 HA ALA 2 HA ALA 2 3.223 -30.969 5.756
12 HB1 ALA 2 HB1 ALA 2 4.880 -30.189 7.352
13 HB2 ALA 2 HB2 ALA 2 3.951 -28.714 7.702
14 HB3 ALA 2 HB3 ALA 2 3.295 -30.321 8.168
15 H GLU 3 H GLU 3 1.641 -28.417 7.701
16 HA GLU 3 HA GLU 3 -0.863 -29.073 6.256
17 HB2 GLU 3 HB2 GLU 3 -0.966 -29.009 8.701
18 HB3 GLU 3 HB3 GLU 3 -0.315 -27.352 8.741
19 HG2 GLU 3 HG2 GLU 3 -2.801 -27.351 9.017
20 HG3 GLU 3 HG3 GLU 3 -2.322 -26.485 7.546
21 H GLY 4 H GLY 4 -0.237 -28.076 4.137
22 HA2 GLY 4 HA2 GLY 4 0.584 -25.234 4.166
23 HA3 GLY 4 HA3 GLY 4 0.302 -26.255 2.747
24 H THR 5 H THR 5 -1.582 -24.889 5.590
25 HA THR 5 HA THR 5 -3.648 -24.015 3.613
26 HB THR 5 HB THR 5 -4.287 -25.536 6.203
27 HG1 THR 5 HG1 THR 5 -3.851 -26.876 4.304
28 HG21 THR 5 HG21 THR 5 -6.670 -25.155 5.511
29 HG22 THR 5 HG22 THR 5 -5.859 -23.618 5.917
30 HG23 THR 5 HG23 THR 5 -6.125 -24.066 4.205
31 H PHE 6 H PHE 6 -2.987 -23.796 7.281
32 HA PHE 6 HA PHE 6 -3.707 -21.013 7.228
33 HB2 PHE 6 HB2 PHE 6 -3.597 -22.186 9.412
34 HB3 PHE 6 HB3 PHE 6 -1.851 -22.466 9.208
35 HD1 PHE 6 HD2 PHE 6 -4.460 -19.833 9.732
36 HD2 PHE 6 HD1 PHE 6 -0.236 -20.594 9.373
37 HE1 PHE 6 HE2 PHE 6 -3.974 -17.566 10.600
38 HE2 PHE 6 HE1 PHE 6 0.243 -18.315 10.203
39 HZ PHE 6 HZ PHE 6 -1.622 -16.797 10.831
40 H ILE 7 H ILE 7 -0.534 -22.831 6.922
41 HA ILE 7 HA ILE 7 1.060 -20.458 6.824
42 HB ILE 7 HB ILE 7 1.540 -23.203 5.541
43 HG12 ILE 7 HG12 ILE 7 2.814 -21.930 8.053
44 HG13 ILE 7 HG13 ILE 7 1.459 -23.075 8.102
45 HG21 ILE 7 HG21 ILE 7 3.532 -20.863 5.823
46 HG22 ILE 7 HG22 ILE 7 3.921 -22.487 5.185
47 HG23 ILE 7 HG23 ILE 7 2.832 -21.435 4.284
48 HD11 ILE 7 HD11 ILE 7 2.910 -24.814 6.927
49 HD12 ILE 7 HD12 ILE 7 4.309 -23.718 7.140
50 HD13 ILE 7 HD13 ILE 7 3.454 -24.346 8.563
51 H SER 8 H SER 8 -0.630 -22.403 4.211
52 HA SER 8 HA SER 8 0.384 -20.824 2.092
53 HB2 SER 8 HB2 SER 8 -2.348 -22.237 2.229
54 HB3 SER 8 HB3 SER 8 -1.526 -21.650 0.749
55 HG SER 8 HG SER 8 -1.026 -23.941 1.218
56 H ASP 9 H ASP 9 -2.759 -20.496 3.963
57 HA ASP 9 HA ASP 9 -3.679 -18.244 2.528
58 HB2 ASP 9 HB2 ASP 9 -5.163 -19.468 4.061
59 HB3 ASP 9 HB3 ASP 9 -4.150 -19.050 5.465
60 H TYR 10 H TYR 10 -1.765 -18.377 5.634
61 HA TYR 10 HA TYR 10 -1.615 -15.575 5.984
62 HB2 TYR 10 HB2 TYR 10 -0.933 -17.140 7.760
63 HB3 TYR 10 HB3 TYR 10 0.373 -17.812 6.759
64 HD1 TYR 10 HD1 TYR 10 -0.750 -14.757 8.606
65 HD2 TYR 10 HD2 TYR 10 2.443 -16.543 6.336
66 HE1 TYR 10 HE1 TYR 10 0.841 -13.093 9.519
67 HE2 TYR 10 HE2 TYR 10 4.013 -14.860 7.207
68 HH TYR 10 HH TYR 10 4.348 -13.165 8.862
69 H SER 11 H SER 11 0.642 -17.836 4.213
70 HA SER 11 HA SER 11 2.487 -15.788 3.490
71 HB2 SER 11 HB2 SER 11 3.050 -18.190 3.310
72 HB3 SER 11 HB3 SER 11 1.817 -18.415 2.023
73 HG SER 11 HG SER 11 3.998 -17.959 1.133
74 H ILE 12 H ILE 12 -0.537 -16.994 1.853
75 HA ILE 12 HA ILE 12 -0.165 -15.458 -0.540
76 HB ILE 12 HB ILE 12 -2.676 -16.525 0.850
77 HG12 ILE 12 HG12 ILE 12 -1.476 -17.323 -1.874
78 HG13 ILE 12 HG13 ILE 12 -0.898 -18.057 -0.370
79 HG21 ILE 12 HG21 ILE 12 -3.382 -14.464 -0.356
80 HG22 ILE 12 HG22 ILE 12 -2.585 -15.046 -1.846
81 HG23 ILE 12 HG23 ILE 12 -4.002 -15.900 -1.177
82 HD11 ILE 12 HD11 ILE 12 -2.557 -19.537 -1.376
83 HD12 ILE 12 HD12 ILE 12 -3.213 -18.895 0.152
84 HD13 ILE 12 HD13 ILE 12 -3.789 -18.252 -1.413
85 H ALA 13 H ALA 13 -1.840 -14.676 2.639
86 HA ALA 13 HA ALA 13 -2.690 -12.122 1.850
87 HB1 ALA 13 HB1 ALA 13 -2.616 -11.452 4.245
88 HB2 ALA 13 HB2 ALA 13 -3.319 -13.087 4.066
89 HB3 ALA 13 HB3 ALA 13 -1.645 -12.893 4.655
90 H MET 14 H MET 14 0.505 -13.080 3.395
91 HA MET 14 HA MET 14 1.573 -10.439 3.185
92 HB2 MET 14 HB2 MET 14 2.998 -13.160 3.243
93 HB3 MET 14 HB3 MET 14 3.856 -11.599 3.299
94 HG2 MET 14 HG2 MET 14 1.764 -12.468 5.405
95 HG3 MET 14 HG3 MET 14 3.537 -12.560 5.599
96 HE1 MET 14 HE1 MET 14 2.719 -9.403 7.876
97 HE2 MET 14 HE2 MET 14 2.045 -11.063 7.799
98 HE3 MET 14 HE3 MET 14 3.828 -10.802 7.734
99 H ASP 15 H ASP 15 1.418 -13.099 0.707
100 HA ASP 15 HA ASP 15 3.381 -11.945 -0.958
101 HB2 ASP 15 HB2 ASP 15 2.487 -14.235 -1.366
102 HB3 ASP 15 HB3 ASP 15 0.928 -13.557 -1.885
103 H LYS 16 H LYS 16 -0.290 -11.576 -1.234
104 HA LYS 16 HA LYS 16 0.014 -9.648 -3.307
105 HB2 LYS 16 HB2 LYS 16 -2.346 -9.161 -3.099
106 HB3 LYS 16 HB3 LYS 16 -2.108 -10.915 -2.883
107 HG2 LYS 16 HG2 LYS 16 -2.279 -10.557 -0.348
108 HG3 LYS 16 HG3 LYS 16 -2.601 -8.825 -0.660
109 HD2 LYS 16 HD2 LYS 16 -4.649 -9.422 -1.954
110 HD3 LYS 16 HD3 LYS 16 -4.316 -11.159 -1.711
111 HE2 LYS 16 HE2 LYS 16 -6.059 -10.332 -0.127
112 HE3 LYS 16 HE3 LYS 16 -4.629 -10.944 0.736
113 HZ1 LYS 16 HZ1 LYS 16 -4.011 -8.707 1.380
114 HZ2 LYS 16 HZ2 LYS 16 -5.116 -7.984 0.185
115 H ILE 17 H ILE 17 -0.025 -9.262 0.288
116 HA ILE 17 HA ILE 17 -0.756 -6.530 0.290
117 HB ILE 17 HB ILE 17 0.964 -8.158 2.220
118 HG12 ILE 17 HG12 ILE 17 -1.807 -6.868 2.657
119 HG13 ILE 17 HG13 ILE 17 -1.629 -8.484 1.962
120 HG21 ILE 17 HG21 ILE 17 0.792 -6.173 3.836
121 HG22 ILE 17 HG22 ILE 17 1.819 -5.869 2.437
122 HG23 ILE 17 HG23 ILE 17 0.156 -5.201 2.482
123 HD11 ILE 17 HD11 ILE 17 -2.085 -8.693 4.364
124 HD12 ILE 17 HD12 ILE 17 -0.434 -9.279 4.040
125 HD13 ILE 17 HD13 ILE 17 -0.689 -7.682 4.790
126 H HIS 18 H HIS 18 2.481 -8.023 -0.466
127 HA HIS 18 HA HIS 18 3.981 -5.846 0.179
128 HB2 HIS 18 HB2 HIS 18 5.707 -6.505 -1.372
129 HB3 HIS 18 HB3 HIS 18 5.029 -7.922 -0.536
130 HD1 HIS 18 HD1 HIS 18 6.677 -8.432 -2.812
131 HD2 HIS 18 HD2 HIS 18 2.545 -7.762 -3.254
132 HE1 HIS 18 HE1 HIS 18 6.019 -9.512 -4.996
133 H GLN 19 H GLN 19 1.695 -5.764 -2.575
134 HA GLN 19 HA GLN 19 3.034 -3.328 -3.604
135 HB2 GLN 19 HB2 GLN 19 0.367 -4.631 -4.418
136 HB3 GLN 19 HB3 GLN 19 1.105 -3.180 -5.148
137 HG2 GLN 19 HG2 GLN 19 3.122 -4.560 -5.821
138 HG3 GLN 19 HG3 GLN 19 2.369 -6.000 -5.094
139 HE21 GLN 19 HE21 GLN 19 1.735 -3.386 -7.605
140 HE22 GLN 19 HE22 GLN 19 0.785 -4.412 -8.615
141 H GLN 20 H GLN 20 -0.100 -4.297 -1.912
142 HA GLN 20 HA GLN 20 -1.086 -1.685 -1.786
143 HB2 GLN 20 HB2 GLN 20 -2.432 -3.722 -1.206
144 HB3 GLN 20 HB3 GLN 20 -1.433 -3.961 0.252
145 HG2 GLN 20 HG2 GLN 20 -3.565 -2.957 0.891
146 HG3 GLN 20 HG3 GLN 20 -2.248 -1.800 1.174
147 HE21 GLN 20 HE21 GLN 20 -4.533 -0.523 1.272
148 HE22 GLN 20 HE22 GLN 20 -4.981 0.219 -0.217
149 H ASP 21 H ASP 21 1.134 -3.400 0.562
150 HA ASP 21 HA ASP 21 1.225 -1.319 2.459
151 HB2 ASP 21 HB2 ASP 21 2.306 -3.453 2.963
152 HB3 ASP 21 HB3 ASP 21 3.438 -3.275 1.594
153 H PHE 22 H PHE 22 3.314 -1.748 -0.567
154 HA PHE 22 HA PHE 22 4.864 0.582 0.015
155 HB2 PHE 22 HB2 PHE 22 5.650 -0.886 -1.781
156 HB3 PHE 22 HB3 PHE 22 4.137 -0.686 -2.692
157 HD1 PHE 22 HD2 PHE 22 7.106 1.242 -1.373
158 HD2 PHE 22 HD1 PHE 22 3.824 1.213 -4.159
159 HE1 PHE 22 HE2 PHE 22 8.003 3.278 -2.458
160 HE2 PHE 22 HE1 PHE 22 4.752 3.217 -5.270
161 HZ PHE 22 HZ PHE 22 6.861 4.236 -4.446
162 H VAL 23 H VAL 23 1.772 0.138 -1.841
163 HA VAL 23 HA VAL 23 1.558 2.868 -2.625
164 HB VAL 23 HB VAL 23 -0.593 0.732 -2.143
165 HG11 VAL 23 HG11 VAL 23 -2.153 2.200 -3.484
166 HG12 VAL 23 HG12 VAL 23 -1.744 2.901 -1.906
167 HG13 VAL 23 HG13 VAL 23 -0.957 3.523 -3.389
168 HG21 VAL 23 HG21 VAL 23 1.070 0.347 -4.089
169 HG22 VAL 23 HG22 VAL 23 -0.623 0.515 -4.603
170 HG23 VAL 23 HG23 VAL 23 0.508 1.881 -4.791
171 H ASN 24 H ASN 24 0.820 1.298 0.576
172 HA ASN 24 HA ASN 24 -0.873 3.319 1.513
173 HB2 ASN 24 HB2 ASN 24 1.073 1.571 3.065
174 HB3 ASN 24 HB3 ASN 24 0.327 2.978 3.834
175 HD21 ASN 24 HD21 ASN 24 -1.036 0.316 1.640
176 HD22 ASN 24 HD22 ASN 24 -2.360 0.043 2.713
177 H TRP 25 H TRP 25 2.784 3.408 1.163
178 HA TRP 25 HA TRP 25 2.956 5.862 2.617
179 HB2 TRP 25 HB2 TRP 25 4.981 4.514 2.083
180 HB3 TRP 25 HB3 TRP 25 4.837 4.959 0.358
181 HD1 TRP 25 HD1 TRP 25 5.882 6.398 3.756
182 HE1 TRP 25 HE1 TRP 25 6.797 8.729 3.464
183 HE3 TRP 25 HE3 TRP 25 4.725 7.151 -1.234
184 HZ2 TRP 25 HZ2 TRP 25 6.997 10.671 1.537
185 HZ3 TRP 25 HZ3 TRP 25 5.224 9.417 -2.199
186 HH2 TRP 25 HH2 TRP 25 6.395 11.122 -0.847
187 H LEU 26 H LEU 26 2.397 5.162 -0.948
188 HA LEU 26 HA LEU 26 2.404 7.888 -1.750
189 HB2 LEU 26 HB2 LEU 26 0.614 5.614 -2.788
190 HB3 LEU 26 HB3 LEU 26 0.706 7.219 -3.535
191 HG LEU 26 HG LEU 26 3.125 5.325 -3.304
192 HD11 LEU 26 HD11 LEU 26 1.236 5.821 -5.691
193 HD12 LEU 26 HD12 LEU 26 2.715 4.819 -5.723
194 HD13 LEU 26 HD13 LEU 26 1.323 4.316 -4.735
195 HD21 LEU 26 HD21 LEU 26 2.650 7.912 -4.932
196 HD22 LEU 26 HD22 LEU 26 3.841 7.701 -3.617
197 HD23 LEU 26 HD23 LEU 26 4.052 6.828 -5.146
198 H LEU 27 H LEU 27 -0.432 5.847 -0.539
199 HA LEU 27 HA LEU 27 -2.140 8.108 -0.883
200 HB2 LEU 27 HB2 LEU 27 -3.936 6.874 -0.016
201 HB3 LEU 27 HB3 LEU 27 -2.867 5.682 -0.766
202 HG LEU 27 HG LEU 27 -1.915 5.452 1.744
203 HD11 LEU 27 HD11 LEU 27 -4.772 6.450 2.323
204 HD12 LEU 27 HD12 LEU 27 -3.625 5.788 3.513
205 HD13 LEU 27 HD13 LEU 27 -3.301 7.353 2.751
206 HD21 LEU 27 HD21 LEU 27 -3.525 3.617 2.208
207 HD22 LEU 27 HD22 LEU 27 -4.649 4.269 0.982
208 HD23 LEU 27 HD23 LEU 27 -3.072 3.602 0.485
209 H ALA 28 H ALA 28 0.002 7.070 1.851
210 HA ALA 28 HA ALA 28 -1.215 8.582 3.868
211 HB1 ALA 28 HB1 ALA 28 1.818 8.209 3.434
212 HB2 ALA 28 HB2 ALA 28 1.033 8.723 4.951
213 HB3 ALA 28 HB3 ALA 28 0.749 7.076 4.313
214 H GLN 29 H GLN 29 0.936 9.692 1.142
215 HA GLN 29 HA GLN 29 1.529 12.227 2.175
216 HB2 GLN 29 HB2 GLN 29 0.785 11.673 -0.771
217 HB3 GLN 29 HB3 GLN 29 1.617 13.117 -0.138
218 HG2 GLN 29 HG2 GLN 29 2.749 10.254 -0.283
219 HG3 GLN 29 HG3 GLN 29 3.304 11.697 -1.139
220 HE21 GLN 29 HE21 GLN 29 3.366 9.990 2.044
221 HE22 GLN 29 HE22 GLN 29 4.534 11.045 2.738
222 H LYS 30 H LYS 30 -1.567 11.019 0.711
223 HA LYS 30 HA LYS 30 -2.821 13.351 0.216
224 HB2 LYS 30 HB2 LYS 30 -4.936 12.347 0.476
225 HB3 LYS 30 HB3 LYS 30 -3.857 11.006 0.041
226 HG2 LYS 30 HG2 LYS 30 -3.720 10.570 2.663
227 HG3 LYS 30 HG3 LYS 30 -5.082 11.688 2.793
228 HD2 LYS 30 HD2 LYS 30 -5.018 9.042 1.209
229 HD3 LYS 30 HD3 LYS 30 -5.864 9.332 2.747
230 HE2 LYS 30 HE2 LYS 30 -6.571 10.603 0.020
231 HE3 LYS 30 HE3 LYS 30 -7.465 9.325 0.866
232 HZ1 LYS 30 HZ1 LYS 30 -7.943 10.928 2.724
233 HZ2 LYS 30 HZ2 LYS 30 -7.271 12.230 1.718
234 H GLY 31 H GLY 31 -2.047 12.203 3.579
235 HA2 GLY 31 HA2 GLY 31 -3.896 13.875 4.921
236 HA3 GLY 31 HA3 GLY 31 -2.352 13.315 5.600
237 H LYS 32 H LYS 32 -0.297 14.511 4.390
238 HA LYS 32 HA LYS 32 -0.778 17.364 5.033
239 HB2 LYS 32 HB2 LYS 32 1.812 15.986 4.092
240 HB3 LYS 32 HB3 LYS 32 1.612 17.733 4.363
241 HG2 LYS 32 HG2 LYS 32 2.697 16.676 6.279
242 HG3 LYS 32 HG3 LYS 32 1.130 17.374 6.758
243 HD2 LYS 32 HD2 LYS 32 0.077 15.170 6.863
244 HD3 LYS 32 HD3 LYS 32 1.473 14.382 6.062
245 HE2 LYS 32 HE2 LYS 32 2.906 14.709 7.981
246 HE3 LYS 32 HE3 LYS 32 1.751 15.821 8.762
247 HZ1 LYS 32 HZ1 LYS 32 0.208 14.015 9.184
248 HZ2 LYS 32 HZ2 LYS 32 1.174 12.881 8.237
249 H LYS 33 H LYS 33 0.538 15.444 2.196
250 HA LYS 33 HA LYS 33 0.651 16.013 -0.016
251 HB2 LYS 33 HB2 LYS 33 -1.852 15.522 0.700
252 HB3 LYS 33 HB3 LYS 33 -2.146 17.218 0.366
253 HG2 LYS 33 HG2 LYS 33 -1.038 15.031 -1.542
254 HG3 LYS 33 HG3 LYS 33 -2.695 15.675 -1.578
255 HD2 LYS 33 HD2 LYS 33 -0.182 17.326 -2.235
256 HD3 LYS 33 HD3 LYS 33 -1.213 16.544 -3.434
257 HE2 LYS 33 HE2 LYS 33 -3.136 17.942 -2.929
258 HE3 LYS 33 HE3 LYS 33 -2.377 18.620 -1.474
259 HZ1 LYS 33 HZ1 LYS 33 -1.404 19.095 -4.301
260 HZ2 LYS 33 HZ2 LYS 33 -2.094 20.271 -3.182
261 H ASN 34 H ASN 34 2.070 17.875 1.597
262 HA ASN 34 HA ASN 34 2.087 20.024 -0.349
263 HB2 ASN 34 HB2 ASN 34 1.156 20.752 2.489
264 HB3 ASN 34 HB3 ASN 34 1.874 21.916 1.356
265 HD21 ASN 34 HD21 ASN 34 -1.093 19.991 2.010
266 HD22 ASN 34 HD22 ASN 34 -2.025 20.772 0.787
267 H ASP 35 H ASP 35 3.143 19.467 3.133
268 HA ASP 35 HA ASP 35 5.401 20.785 3.356
269 HB2 ASP 35 HB2 ASP 35 5.215 17.750 3.840
270 HB3 ASP 35 HB3 ASP 35 6.511 18.801 4.484
271 H TRP 36 H TRP 36 5.319 17.759 1.268
272 HA TRP 36 HA TRP 36 7.237 19.156 -0.481
273 HB2 TRP 36 HB2 TRP 36 8.765 18.006 1.125
274 HB3 TRP 36 HB3 TRP 36 7.966 16.444 0.794
275 HD1 TRP 36 HD1 TRP 36 9.844 19.278 -1.132
276 HE1 TRP 36 HE1 TRP 36 10.991 18.301 -3.153
277 HE3 TRP 36 HE3 TRP 36 8.262 14.353 -0.722
278 HZ2 TRP 36 HZ2 TRP 36 11.216 15.915 -4.475
279 HZ3 TRP 36 HZ3 TRP 36 9.006 12.762 -2.504
280 HH2 TRP 36 HH2 TRP 36 10.465 13.531 -4.349
281 H LYS 37 H LYS 37 4.901 19.104 -1.407
282 HA LYS 37 HA LYS 37 4.912 16.888 -3.366
283 HB2 LYS 37 HB2 LYS 37 3.717 16.046 -1.261
284 HB3 LYS 37 HB3 LYS 37 2.566 17.385 -1.441
285 HG2 LYS 37 HG2 LYS 37 1.579 15.320 -2.300
286 HG3 LYS 37 HG3 LYS 37 1.843 16.416 -3.681
287 HD2 LYS 37 HD2 LYS 37 3.768 15.085 -4.442
288 HD3 LYS 37 HD3 LYS 37 3.835 14.186 -2.899
289 HE2 LYS 37 HE2 LYS 37 2.864 12.767 -4.665
290 HE3 LYS 37 HE3 LYS 37 1.646 13.086 -3.412
291 HZ1 LYS 37 HZ1 LYS 37 0.534 14.709 -4.898
292 HZ2 LYS 37 HZ2 LYS 37 1.825 14.505 -6.103
293 H HIS 38 H HIS 38 5.592 19.038 -4.417
294 HA HIS 38 HA HIS 38 5.056 20.732 -5.887
295 HB2 HIS 38 HB2 HIS 38 3.832 18.974 -7.021
296 HB3 HIS 38 HB3 HIS 38 2.370 19.265 -6.055
297 HD1 HIS 38 HD1 HIS 38 0.951 21.257 -6.700
298 HD2 HIS 38 HD2 HIS 38 4.623 21.067 -8.738
299 HE1 HIS 38 HE1 HIS 38 0.808 23.006 -8.519
300 H ASN 39 H ASN 39 5.392 22.094 -3.842
301 HA ASN 39 HA ASN 39 2.914 23.273 -2.760
302 HB2 ASN 39 HB2 ASN 39 5.835 24.165 -2.433
303 HB3 ASN 39 HB3 ASN 39 4.428 24.895 -1.636
304 HD21 ASN 39 HD21 ASN 39 6.660 22.093 -1.570
305 HD22 ASN 39 HD22 ASN 39 5.971 21.408 -0.148
306 H ILE 40 H ILE 40 1.994 23.887 -4.995
307 HA ILE 40 HA ILE 40 1.563 25.578 -6.532
308 HB ILE 40 HB ILE 40 2.958 27.389 -4.478
309 HG12 ILE 40 HG12 ILE 40 0.091 26.279 -4.318
310 HG13 ILE 40 HG13 ILE 40 1.439 25.811 -3.251
311 HG21 ILE 40 HG21 ILE 40 2.149 28.410 -6.700
312 HG22 ILE 40 HG22 ILE 40 0.496 27.907 -6.264
313 HG23 ILE 40 HG23 ILE 40 1.371 29.109 -5.273
314 HD11 ILE 40 HD11 ILE 40 0.150 28.600 -3.348
315 HD12 ILE 40 HD12 ILE 40 0.100 27.406 -2.032
316 HD13 ILE 40 HD13 ILE 40 1.647 28.199 -2.449
317 H THR 41 H THR 41 3.517 24.102 -7.505
318 HA THR 41 HA THR 41 5.530 24.027 -8.638
319 HB THR 41 HB THR 41 5.022 27.012 -9.154
320 HG1 THR 41 HG1 THR 41 3.735 24.791 -10.421
321 HG21 THR 41 HG21 THR 41 5.986 26.478 -11.407
322 HG22 THR 41 HG22 THR 41 7.180 26.110 -10.133
323 HG23 THR 41 HG23 THR 41 6.266 24.787 -10.908
324 H GLN 42 H GLN 42 5.928 23.974 -5.973
325 HA GLN 42 HA GLN 42 7.438 24.531 -4.295
326 HB2 GLN 42 HB2 GLN 42 9.237 25.198 -6.703
327 HB3 GLN 42 HB3 GLN 42 9.757 24.759 -5.058
328 HG2 GLN 42 HG2 GLN 42 8.275 22.981 -7.106
329 HG3 GLN 42 HG3 GLN 42 9.936 22.755 -6.502
330 HE21 GLN 42 HE21 GLN 42 10.058 22.490 -3.910
331 HE22 GLN 42 HE22 GLN 42 8.813 21.501 -3.239
Start of MODEL 9
1 H1 TYR 1 H1 TYR 1 2.601 -31.569 10.260
2 HA TYR 1 HA TYR 1 1.103 -33.174 9.064
3 HB2 TYR 1 HB2 TYR 1 -0.178 -33.810 11.105
4 HB3 TYR 1 HB3 TYR 1 -0.849 -32.170 11.233
5 HD1 TYR 1 HD2 TYR 1 -0.849 -35.306 9.192
6 HD2 TYR 1 HD1 TYR 1 -2.614 -31.408 9.659
7 HE1 TYR 1 HE2 TYR 1 -2.625 -35.907 7.578
8 HE2 TYR 1 HE1 TYR 1 -4.369 -32.001 8.043
9 HH TYR 1 HH TYR 1 -5.216 -33.673 6.556
10 H ALA 2 H ALA 2 0.184 -29.905 10.491
11 HA ALA 2 HA ALA 2 -1.433 -29.104 8.344
12 HB1 ALA 2 HB1 ALA 2 -1.280 -27.729 10.399
13 HB2 ALA 2 HB2 ALA 2 0.421 -27.316 10.033
14 HB3 ALA 2 HB3 ALA 2 -0.890 -26.734 8.963
15 H GLU 3 H GLU 3 -0.800 -28.996 6.096
16 HA GLU 3 HA GLU 3 2.129 -28.694 5.568
17 HB2 GLU 3 HB2 GLU 3 0.743 -30.686 4.795
18 HB3 GLU 3 HB3 GLU 3 -0.088 -29.608 3.656
19 HG2 GLU 3 HG2 GLU 3 2.220 -29.130 2.582
20 HG3 GLU 3 HG3 GLU 3 2.967 -30.175 3.810
21 H GLY 4 H GLY 4 0.532 -27.523 2.746
22 HA2 GLY 4 HA2 GLY 4 1.100 -24.762 3.683
23 HA3 GLY 4 HA3 GLY 4 0.779 -25.303 2.029
24 H THR 5 H THR 5 -0.826 -24.681 5.248
25 HA THR 5 HA THR 5 -3.345 -24.185 3.694
26 HB THR 5 HB THR 5 -3.121 -25.854 6.258
27 HG1 THR 5 HG1 THR 5 -3.771 -26.667 3.603
28 HG21 THR 5 HG21 THR 5 -5.225 -24.462 6.209
29 HG22 THR 5 HG22 THR 5 -5.580 -25.063 4.561
30 HG23 THR 5 HG23 THR 5 -5.578 -26.196 5.944
31 H PHE 6 H PHE 6 -2.323 -23.898 7.251
32 HA PHE 6 HA PHE 6 -3.487 -21.240 7.329
33 HB2 PHE 6 HB2 PHE 6 -3.173 -22.470 9.458
34 HB3 PHE 6 HB3 PHE 6 -1.420 -22.574 9.187
35 HD1 PHE 6 HD1 PHE 6 -4.203 -20.243 10.044
36 HD2 PHE 6 HD2 PHE 6 0.034 -20.582 9.369
37 HE1 PHE 6 HE1 PHE 6 -3.862 -17.997 11.024
38 HE2 PHE 6 HE2 PHE 6 0.362 -18.313 10.291
39 HZ PHE 6 HZ PHE 6 -1.582 -17.016 11.135
40 H ILE 7 H ILE 7 -0.135 -22.643 6.900
41 HA ILE 7 HA ILE 7 1.157 -20.096 6.836
42 HB ILE 7 HB ILE 7 1.963 -22.757 5.530
43 HG12 ILE 7 HG12 ILE 7 3.058 -21.306 8.034
44 HG13 ILE 7 HG13 ILE 7 1.873 -22.625 8.093
45 HG21 ILE 7 HG21 ILE 7 3.611 -20.160 5.785
46 HG22 ILE 7 HG22 ILE 7 4.232 -21.721 5.172
47 HG23 ILE 7 HG23 ILE 7 2.998 -20.852 4.256
48 HD11 ILE 7 HD11 ILE 7 3.547 -24.168 6.961
49 HD12 ILE 7 HD12 ILE 7 4.784 -22.881 7.134
50 HD13 ILE 7 HD13 ILE 7 4.030 -23.585 8.580
51 H SER 8 H SER 8 -0.212 -22.229 4.154
52 HA SER 8 HA SER 8 0.478 -20.479 2.082
53 HB2 SER 8 HB2 SER 8 -2.056 -22.212 2.326
54 HB3 SER 8 HB3 SER 8 -1.549 -21.376 0.833
55 HG SER 8 HG SER 8 0.430 -22.694 0.953
56 H ASP 9 H ASP 9 -2.621 -20.447 4.084
57 HA ASP 9 HA ASP 9 -3.786 -18.303 2.722
58 HB2 ASP 9 HB2 ASP 9 -5.055 -19.504 4.449
59 HB3 ASP 9 HB3 ASP 9 -3.925 -18.982 5.722
60 H TYR 10 H TYR 10 -1.590 -18.122 5.647
61 HA TYR 10 HA TYR 10 -1.554 -15.275 5.680
62 HB2 TYR 10 HB2 TYR 10 -0.783 -16.579 7.633
63 HB3 TYR 10 HB3 TYR 10 0.499 -17.345 6.668
64 HD1 TYR 10 HD1 TYR 10 -0.736 -13.857 7.541
65 HD2 TYR 10 HD2 TYR 10 2.684 -16.362 6.799
66 HE1 TYR 10 HE1 TYR 10 0.752 -12.016 8.210
67 HE2 TYR 10 HE2 TYR 10 4.168 -14.556 7.599
68 HH TYR 10 HH TYR 10 2.993 -11.402 8.783
69 H SER 11 H SER 11 0.516 -17.654 3.848
70 HA SER 11 HA SER 11 2.450 -15.674 3.094
71 HB2 SER 11 HB2 SER 11 2.878 -18.139 2.942
72 HB3 SER 11 HB3 SER 11 1.721 -18.263 1.585
73 HG SER 11 HG SER 11 3.196 -16.768 0.434
74 H ILE 12 H ILE 12 -0.658 -16.839 1.583
75 HA ILE 12 HA ILE 12 -0.281 -15.282 -0.822
76 HB ILE 12 HB ILE 12 -2.816 -16.345 0.541
77 HG12 ILE 12 HG12 ILE 12 -1.290 -18.131 -0.362
78 HG13 ILE 12 HG13 ILE 12 -2.878 -18.079 -1.149
79 HG21 ILE 12 HG21 ILE 12 -2.577 -14.880 -2.144
80 HG22 ILE 12 HG22 ILE 12 -3.995 -15.861 -1.660
81 HG23 ILE 12 HG23 ILE 12 -3.548 -14.413 -0.726
82 HD11 ILE 12 HD11 ILE 12 -1.101 -18.510 -2.796
83 HD12 ILE 12 HD12 ILE 12 -1.827 -16.926 -3.149
84 HD13 ILE 12 HD13 ILE 12 -0.228 -17.028 -2.352
85 H ALA 13 H ALA 13 -1.962 -14.631 2.364
86 HA ALA 13 HA ALA 13 -2.885 -12.071 1.642
87 HB1 ALA 13 HB1 ALA 13 -3.496 -13.162 3.808
88 HB2 ALA 13 HB2 ALA 13 -1.825 -12.952 4.407
89 HB3 ALA 13 HB3 ALA 13 -2.843 -11.520 4.081
90 H MET 14 H MET 14 0.352 -13.044 3.078
91 HA MET 14 HA MET 14 1.373 -10.405 3.150
92 HB2 MET 14 HB2 MET 14 2.810 -13.068 2.695
93 HB3 MET 14 HB3 MET 14 3.700 -11.548 2.915
94 HG2 MET 14 HG2 MET 14 1.674 -12.334 5.090
95 HG3 MET 14 HG3 MET 14 3.229 -13.196 4.987
96 HE1 MET 14 HE1 MET 14 2.826 -8.806 6.336
97 HE2 MET 14 HE2 MET 14 2.687 -9.000 4.564
98 HE3 MET 14 HE3 MET 14 1.485 -9.784 5.659
99 H ASP 15 H ASP 15 1.492 -12.905 0.482
100 HA ASP 15 HA ASP 15 3.198 -11.436 -1.180
101 HB2 ASP 15 HB2 ASP 15 2.561 -13.788 -1.691
102 HB3 ASP 15 HB3 ASP 15 0.887 -13.288 -2.042
103 H LYS 16 H LYS 16 -0.475 -11.360 -1.086
104 HA LYS 16 HA LYS 16 -0.607 -9.435 -3.220
105 HB2 LYS 16 HB2 LYS 16 -2.506 -10.923 -2.382
106 HB3 LYS 16 HB3 LYS 16 -2.700 -9.841 -0.988
107 HG2 LYS 16 HG2 LYS 16 -3.047 -9.123 -3.977
108 HG3 LYS 16 HG3 LYS 16 -4.338 -9.383 -2.780
109 HD2 LYS 16 HD2 LYS 16 -3.436 -7.360 -1.463
110 HD3 LYS 16 HD3 LYS 16 -2.341 -7.051 -2.845
111 HE2 LYS 16 HE2 LYS 16 -4.257 -6.823 -4.397
112 HE3 LYS 16 HE3 LYS 16 -5.394 -7.132 -3.050
113 HZ1 LYS 16 HZ1 LYS 16 -3.431 -4.813 -3.146
114 HZ2 LYS 16 HZ2 LYS 16 -5.155 -4.717 -3.428
115 H ILE 17 H ILE 17 -0.865 -9.160 0.403
116 HA ILE 17 HA ILE 17 -1.252 -6.428 0.538
117 HB ILE 17 HB ILE 17 0.269 -8.288 2.422
118 HG12 ILE 17 HG12 ILE 17 -2.438 -6.849 2.824
119 HG13 ILE 17 HG13 ILE 17 -2.339 -8.436 2.049
120 HG21 ILE 17 HG21 ILE 17 -0.356 -5.318 2.896
121 HG22 ILE 17 HG22 ILE 17 0.175 -6.441 4.176
122 HG23 ILE 17 HG23 ILE 17 1.264 -6.076 2.840
123 HD11 ILE 17 HD11 ILE 17 -2.888 -8.816 4.372
124 HD12 ILE 17 HD12 ILE 17 -1.210 -9.379 4.130
125 HD13 ILE 17 HD13 ILE 17 -1.532 -7.826 4.953
126 H HIS 18 H HIS 18 1.922 -8.148 0.044
127 HA HIS 18 HA HIS 18 3.693 -6.220 0.655
128 HB2 HIS 18 HB2 HIS 18 4.441 -8.295 -0.422
129 HB3 HIS 18 HB3 HIS 18 3.681 -7.835 -1.968
130 HD1 HIS 18 HD1 HIS 18 4.784 -5.930 -3.309
131 HD2 HIS 18 HD2 HIS 18 6.807 -7.009 0.217
132 HE1 HIS 18 HE1 HIS 18 7.056 -4.837 -3.466
133 H GLN 19 H GLN 19 1.765 -6.116 -2.485
134 HA GLN 19 HA GLN 19 3.112 -3.651 -3.238
135 HB2 GLN 19 HB2 GLN 19 0.461 -4.789 -4.316
136 HB3 GLN 19 HB3 GLN 19 1.378 -3.407 -4.985
137 HG2 GLN 19 HG2 GLN 19 3.363 -4.951 -5.371
138 HG3 GLN 19 HG3 GLN 19 2.365 -6.330 -4.829
139 HE21 GLN 19 HE21 GLN 19 3.284 -6.842 -7.229
140 HE22 GLN 19 HE22 GLN 19 2.151 -6.474 -8.478
141 H GLN 20 H GLN 20 -0.139 -4.457 -1.755
142 HA GLN 20 HA GLN 20 -1.142 -1.859 -1.671
143 HB2 GLN 20 HB2 GLN 20 -2.414 -3.885 -0.911
144 HB3 GLN 20 HB3 GLN 20 -1.377 -3.987 0.540
145 HG2 GLN 20 HG2 GLN 20 -2.187 -1.770 1.315
146 HG3 GLN 20 HG3 GLN 20 -3.212 -1.616 -0.145
147 HE21 GLN 20 HE21 GLN 20 -4.728 -1.326 1.987
148 HE22 GLN 20 HE22 GLN 20 -5.520 -2.783 2.463
149 H ASP 21 H ASP 21 1.175 -3.479 0.654
150 HA ASP 21 HA ASP 21 1.216 -1.375 2.518
151 HB2 ASP 21 HB2 ASP 21 2.217 -3.568 3.041
152 HB3 ASP 21 HB3 ASP 21 3.465 -3.349 1.786
153 H PHE 22 H PHE 22 3.444 -1.928 -0.396
154 HA PHE 22 HA PHE 22 4.945 0.439 0.096
155 HB2 PHE 22 HB2 PHE 22 5.761 -1.103 -1.628
156 HB3 PHE 22 HB3 PHE 22 4.276 -0.921 -2.586
157 HD1 PHE 22 HD1 PHE 22 7.402 0.826 -1.511
158 HD2 PHE 22 HD2 PHE 22 3.822 1.124 -3.880
159 HE1 PHE 22 HE1 PHE 22 8.294 2.855 -2.615
160 HE2 PHE 22 HE2 PHE 22 4.687 3.185 -4.931
161 HZ PHE 22 HZ PHE 22 6.931 4.053 -4.310
162 H VAL 23 H VAL 23 1.892 -0.099 -1.828
163 HA VAL 23 HA VAL 23 1.720 2.604 -2.714
164 HB VAL 23 HB VAL 23 -0.450 0.476 -2.291
165 HG11 VAL 23 HG11 VAL 23 -1.944 1.971 -3.715
166 HG12 VAL 23 HG12 VAL 23 -1.635 2.623 -2.089
167 HG13 VAL 23 HG13 VAL 23 -0.759 3.287 -3.498
168 HG21 VAL 23 HG21 VAL 23 1.275 0.097 -4.164
169 HG22 VAL 23 HG22 VAL 23 -0.385 0.309 -4.775
170 HG23 VAL 23 HG23 VAL 23 0.779 1.656 -4.871
171 H ASN 24 H ASN 24 0.763 1.117 0.474
172 HA ASN 24 HA ASN 24 -0.821 3.349 1.229
173 HB2 ASN 24 HB2 ASN 24 0.615 1.239 2.903
174 HB3 ASN 24 HB3 ASN 24 -0.003 2.715 3.666
175 HD21 ASN 24 HD21 ASN 24 -1.619 0.841 0.917
176 HD22 ASN 24 HD22 ASN 24 -3.042 0.595 1.847
177 H TRP 25 H TRP 25 2.794 3.006 1.084
178 HA TRP 25 HA TRP 25 3.298 5.285 2.689
179 HB2 TRP 25 HB2 TRP 25 5.156 3.858 1.810
180 HB3 TRP 25 HB3 TRP 25 4.848 4.458 0.155
181 HD1 TRP 25 HD1 TRP 25 6.210 5.652 3.570
182 HE1 TRP 25 HE1 TRP 25 7.347 7.884 3.279
183 HE3 TRP 25 HE3 TRP 25 4.991 6.585 -1.371
184 HZ2 TRP 25 HZ2 TRP 25 7.642 9.848 1.384
185 HZ3 TRP 25 HZ3 TRP 25 5.830 8.740 -2.374
186 HH2 TRP 25 HH2 TRP 25 7.078 10.358 -0.999
187 H LEU 26 H LEU 26 2.256 4.987 -0.811
188 HA LEU 26 HA LEU 26 2.516 7.779 -1.332
189 HB2 LEU 26 HB2 LEU 26 0.502 5.795 -2.538
190 HB3 LEU 26 HB3 LEU 26 0.759 7.435 -3.143
191 HG LEU 26 HG LEU 26 3.026 5.344 -3.051
192 HD11 LEU 26 HD11 LEU 26 1.193 4.476 -4.511
193 HD12 LEU 26 HD12 LEU 26 1.157 6.024 -5.401
194 HD13 LEU 26 HD13 LEU 26 2.598 4.968 -5.482
195 HD21 LEU 26 HD21 LEU 26 2.701 7.984 -4.633
196 HD22 LEU 26 HD22 LEU 26 3.808 7.737 -3.262
197 HD23 LEU 26 HD23 LEU 26 4.075 6.851 -4.775
198 H LEU 27 H LEU 27 -0.437 5.875 -0.155
199 HA LEU 27 HA LEU 27 -1.966 8.274 -0.181
200 HB2 LEU 27 HB2 LEU 27 -3.776 7.179 0.874
201 HB3 LEU 27 HB3 LEU 27 -2.975 6.006 -0.189
202 HG LEU 27 HG LEU 27 -1.755 5.304 2.116
203 HD11 LEU 27 HD11 LEU 27 -2.729 7.134 3.575
204 HD12 LEU 27 HD12 LEU 27 -4.360 6.513 3.221
205 HD13 LEU 27 HD13 LEU 27 -3.190 5.515 4.123
206 HD21 LEU 27 HD21 LEU 27 -3.607 3.630 2.532
207 HD22 LEU 27 HD22 LEU 27 -4.701 4.606 1.511
208 HD23 LEU 27 HD23 LEU 27 -3.282 3.798 0.791
209 H ALA 28 H ALA 28 0.353 7.020 2.275
210 HA ALA 28 HA ALA 28 -0.585 8.377 4.503
211 HB1 ALA 28 HB1 ALA 28 1.513 7.004 4.532
212 HB2 ALA 28 HB2 ALA 28 2.355 8.271 3.591
213 HB3 ALA 28 HB3 ALA 28 1.782 8.624 5.244
214 H GLN 29 H GLN 29 1.201 9.792 1.641
215 HA GLN 29 HA GLN 29 1.269 12.427 2.930
216 HB2 GLN 29 HB2 GLN 29 1.970 11.508 0.084
217 HB3 GLN 29 HB3 GLN 29 1.971 13.220 0.566
218 HG2 GLN 29 HG2 GLN 29 4.263 12.268 0.732
219 HG3 GLN 29 HG3 GLN 29 3.660 12.879 2.290
220 HE21 GLN 29 HE21 GLN 29 3.880 9.777 0.332
221 HE22 GLN 29 HE22 GLN 29 4.064 8.771 1.719
222 H LYS 30 H LYS 30 -1.141 10.759 0.749
223 HA LYS 30 HA LYS 30 -1.942 13.007 -0.562
224 HB2 LYS 30 HB2 LYS 30 -4.023 12.088 -1.116
225 HB3 LYS 30 HB3 LYS 30 -2.924 10.696 -0.947
226 HG2 LYS 30 HG2 LYS 30 -3.875 10.415 1.444
227 HG3 LYS 30 HG3 LYS 30 -5.078 11.662 1.064
228 HD2 LYS 30 HD2 LYS 30 -4.733 8.992 -0.459
229 HD3 LYS 30 HD3 LYS 30 -5.952 9.319 0.804
230 HE2 LYS 30 HE2 LYS 30 -6.941 11.137 -0.670
231 HE3 LYS 30 HE3 LYS 30 -5.765 10.695 -1.949
232 HZ1 LYS 30 HZ1 LYS 30 -7.858 8.830 -0.790
233 HZ2 LYS 30 HZ2 LYS 30 -7.811 9.500 -2.411
234 H GLY 31 H GLY 31 -2.741 12.261 2.893
235 HA2 GLY 31 HA2 GLY 31 -4.684 14.322 3.209
236 HA3 GLY 31 HA3 GLY 31 -3.612 13.726 4.500
237 H LYS 32 H LYS 32 -1.038 14.359 3.666
238 HA LYS 32 HA LYS 32 -1.077 17.239 4.184
239 HB2 LYS 32 HB2 LYS 32 1.234 15.266 3.716
240 HB3 LYS 32 HB3 LYS 32 1.459 17.026 3.812
241 HG2 LYS 32 HG2 LYS 32 1.924 15.966 5.973
242 HG3 LYS 32 HG3 LYS 32 0.559 17.106 6.098
243 HD2 LYS 32 HD2 LYS 32 -1.060 15.183 6.092
244 HD3 LYS 32 HD3 LYS 32 0.295 14.033 5.878
245 HE2 LYS 32 HE2 LYS 32 1.226 14.784 8.118
246 HE3 LYS 32 HE3 LYS 32 -0.140 15.929 8.276
247 HZ1 LYS 32 HZ1 LYS 32 -0.352 12.904 8.136
248 HZ2 LYS 32 HZ2 LYS 32 -0.727 13.932 9.508
249 H LYS 33 H LYS 33 0.450 15.279 1.465
250 HA LYS 33 HA LYS 33 0.989 15.984 -0.662
251 HB2 LYS 33 HB2 LYS 33 -1.469 15.421 -0.667
252 HB3 LYS 33 HB3 LYS 33 -1.860 17.153 -0.529
253 HG2 LYS 33 HG2 LYS 33 -0.617 17.565 -2.711
254 HG3 LYS 33 HG3 LYS 33 -0.253 15.838 -2.825
255 HD2 LYS 33 HD2 LYS 33 -3.072 17.084 -2.842
256 HD3 LYS 33 HD3 LYS 33 -2.168 16.543 -4.277
257 HE2 LYS 33 HE2 LYS 33 -3.259 14.722 -2.033
258 HE3 LYS 33 HE3 LYS 33 -3.832 14.845 -3.700
259 HZ1 LYS 33 HZ1 LYS 33 -1.624 13.998 -4.508
260 HZ2 LYS 33 HZ2 LYS 33 -1.190 13.631 -2.830
261 H ASN 34 H ASN 34 2.333 17.529 1.065
262 HA ASN 34 HA ASN 34 2.484 20.033 -0.341
263 HB2 ASN 34 HB2 ASN 34 0.394 20.480 1.071
264 HB3 ASN 34 HB3 ASN 34 1.343 20.192 2.530
265 HD21 ASN 34 HD21 ASN 34 1.107 22.281 -0.461
266 HD22 ASN 34 HD22 ASN 34 1.863 23.650 0.258
267 H ASP 35 H ASP 35 3.145 18.684 3.044
268 HA ASP 35 HA ASP 35 5.333 20.133 3.695
269 HB2 ASP 35 HB2 ASP 35 4.509 18.264 5.122
270 HB3 ASP 35 HB3 ASP 35 5.115 17.065 3.954
271 H TRP 36 H TRP 36 5.444 17.221 1.461
272 HA TRP 36 HA TRP 36 7.640 18.572 0.013
273 HB2 TRP 36 HB2 TRP 36 8.858 17.384 1.833
274 HB3 TRP 36 HB3 TRP 36 8.039 15.855 1.421
275 HD1 TRP 36 HD1 TRP 36 10.396 18.488 -0.242
276 HE1 TRP 36 HE1 TRP 36 11.829 17.335 -1.970
277 HE3 TRP 36 HE3 TRP 36 8.442 13.688 0.074
278 HZ2 TRP 36 HZ2 TRP 36 12.124 14.876 -3.132
279 HZ3 TRP 36 HZ3 TRP 36 9.409 11.959 -1.454
280 HH2 TRP 36 HH2 TRP 36 11.201 12.551 -3.052
281 H LYS 37 H LYS 37 5.303 18.521 -1.076
282 HA LYS 37 HA LYS 37 5.505 16.245 -3.035
283 HB2 LYS 37 HB2 LYS 37 3.683 16.032 -1.215
284 HB3 LYS 37 HB3 LYS 37 2.866 17.412 -1.980
285 HG2 LYS 37 HG2 LYS 37 3.643 14.769 -3.433
286 HG3 LYS 37 HG3 LYS 37 2.069 15.062 -2.682
287 HD2 LYS 37 HD2 LYS 37 1.714 17.055 -4.210
288 HD3 LYS 37 HD3 LYS 37 3.242 16.651 -5.047
289 HE2 LYS 37 HE2 LYS 37 2.358 14.487 -5.796
290 HE3 LYS 37 HE3 LYS 37 0.882 14.681 -4.820
291 HZ1 LYS 37 HZ1 LYS 37 0.167 16.561 -6.197
292 HZ2 LYS 37 HZ2 LYS 37 1.644 16.458 -7.163
293 H HIS 38 H HIS 38 6.994 18.023 -3.833
294 HA HIS 38 HA HIS 38 7.397 19.786 -5.242
295 HB2 HIS 38 HB2 HIS 38 4.653 19.158 -6.448
296 HB3 HIS 38 HB3 HIS 38 6.106 19.771 -7.281
297 HD1 HIS 38 HD1 HIS 38 8.221 17.790 -6.408
298 HD2 HIS 38 HD2 HIS 38 4.275 16.705 -7.370
299 HE1 HIS 38 HE1 HIS 38 8.315 15.347 -7.036
300 H ASN 39 H ASN 39 6.134 20.541 -2.663
301 HA ASN 39 HA ASN 39 4.445 22.860 -3.407
302 HB2 ASN 39 HB2 ASN 39 4.052 21.758 -1.244
303 HB3 ASN 39 HB3 ASN 39 5.761 22.005 -0.773
304 HD21 ASN 39 HD21 ASN 39 4.678 23.081 1.189
305 HD22 ASN 39 HD22 ASN 39 4.268 24.749 1.018
306 H ILE 40 H ILE 40 6.265 23.486 -5.091
307 HA ILE 40 HA ILE 40 8.118 24.763 -5.630
308 HB ILE 40 HB ILE 40 7.352 26.312 -3.097
309 HG12 ILE 40 HG12 ILE 40 6.006 26.335 -5.873
310 HG13 ILE 40 HG13 ILE 40 5.279 25.798 -4.337
311 HG21 ILE 40 HG21 ILE 40 8.214 28.282 -4.328
312 HG22 ILE 40 HG22 ILE 40 9.471 27.039 -4.364
313 HG23 ILE 40 HG23 ILE 40 8.458 27.306 -5.805
314 HD11 ILE 40 HD11 ILE 40 5.543 28.172 -3.429
315 HD12 ILE 40 HD12 ILE 40 6.005 28.691 -5.083
316 HD13 ILE 40 HD13 ILE 40 4.397 27.994 -4.789
317 H THR 41 H THR 41 9.000 22.444 -4.749
318 HA THR 41 HA THR 41 11.527 23.236 -3.461
319 HB THR 41 HB THR 41 10.182 22.838 -1.454
320 HG1 THR 41 HG1 THR 41 11.511 21.021 -0.659
321 HG21 THR 41 HG21 THR 41 8.356 21.452 -2.480
322 HG22 THR 41 HG22 THR 41 9.462 20.055 -2.596
323 HG23 THR 41 HG23 THR 41 9.002 20.711 -0.998
324 H GLN 42 H GLN 42 11.202 22.579 -6.091
325 HA GLN 42 HA GLN 42 12.691 20.060 -6.222
326 HB2 GLN 42 HB2 GLN 42 11.097 18.725 -7.416
327 HB3 GLN 42 HB3 GLN 42 10.183 19.393 -6.045
328 HG2 GLN 42 HG2 GLN 42 10.140 20.329 -8.985
329 HG3 GLN 42 HG3 GLN 42 8.814 19.551 -8.109
330 HE21 GLN 42 HE21 GLN 42 9.550 22.594 -9.285
331 HE22 GLN 42 HE22 GLN 42 8.803 23.527 -8.046
Start of MODEL 10
1 H1 TYR 1 H1 TYR 1 3.033 -23.536 -4.120
2 HA TYR 1 HA TYR 1 5.088 -24.671 -3.269
3 HB2 TYR 1 HB2 TYR 1 7.007 -23.281 -2.661
4 HB3 TYR 1 HB3 TYR 1 6.511 -22.753 -4.282
5 HD1 TYR 1 HD1 TYR 1 4.900 -20.696 -4.454
6 HD2 TYR 1 HD2 TYR 1 7.065 -21.672 -0.866
7 HE1 TYR 1 HE1 TYR 1 4.459 -18.430 -3.560
8 HE2 TYR 1 HE2 TYR 1 6.551 -19.453 0.058
9 HH TYR 1 HH TYR 1 5.620 -17.299 -0.383
10 H ALA 2 H ALA 2 5.836 -24.416 -0.759
11 HA ALA 2 HA ALA 2 4.988 -24.432 1.410
12 HB1 ALA 2 HB1 ALA 2 4.266 -22.199 2.234
13 HB2 ALA 2 HB2 ALA 2 5.697 -22.051 1.179
14 HB3 ALA 2 HB3 ALA 2 4.081 -21.608 0.555
15 H GLU 3 H GLU 3 3.422 -26.089 0.026
16 HA GLU 3 HA GLU 3 0.688 -25.215 -0.144
17 HB2 GLU 3 HB2 GLU 3 1.509 -27.223 -1.357
18 HB3 GLU 3 HB3 GLU 3 1.789 -28.064 0.194
19 HG2 GLU 3 HG2 GLU 3 -0.667 -27.967 0.711
20 HG3 GLU 3 HG3 GLU 3 -0.961 -27.074 -0.806
21 H GLY 4 H GLY 4 -1.068 -25.513 1.486
22 HA2 GLY 4 HA2 GLY 4 -0.906 -26.838 3.902
23 HA3 GLY 4 HA3 GLY 4 -0.017 -25.313 4.197
24 H THR 5 H THR 5 -1.637 -24.379 5.650
25 HA THR 5 HA THR 5 -4.080 -23.443 4.204
26 HB THR 5 HB THR 5 -4.067 -25.012 6.841
27 HG1 THR 5 HG1 THR 5 -5.401 -26.414 5.474
28 HG21 THR 5 HG21 THR 5 -6.384 -23.535 5.412
29 HG22 THR 5 HG22 THR 5 -6.552 -24.600 6.840
30 HG23 THR 5 HG23 THR 5 -5.667 -23.059 6.984
31 H PHE 6 H PHE 6 -2.658 -23.281 7.636
32 HA PHE 6 HA PHE 6 -3.380 -20.480 7.755
33 HB2 PHE 6 HB2 PHE 6 -3.041 -21.756 9.859
34 HB3 PHE 6 HB3 PHE 6 -1.341 -22.065 9.446
35 HD1 PHE 6 HD1 PHE 6 -3.799 -19.409 10.363
36 HD2 PHE 6 HD2 PHE 6 0.348 -20.265 9.587
37 HE1 PHE 6 HE1 PHE 6 -3.181 -17.148 11.157
38 HE2 PHE 6 HE2 PHE 6 0.958 -17.996 10.359
39 HZ PHE 6 HZ PHE 6 -0.806 -16.421 11.122
40 H ILE 7 H ILE 7 -0.281 -22.330 7.109
41 HA ILE 7 HA ILE 7 1.242 -19.895 6.832
42 HB ILE 7 HB ILE 7 1.837 -22.712 5.782
43 HG12 ILE 7 HG12 ILE 7 2.957 -21.168 8.221
44 HG13 ILE 7 HG13 ILE 7 1.728 -22.445 8.313
45 HG21 ILE 7 HG21 ILE 7 3.025 -20.931 4.419
46 HG22 ILE 7 HG22 ILE 7 3.721 -20.272 5.926
47 HG23 ILE 7 HG23 ILE 7 4.159 -21.908 5.349
48 HD11 ILE 7 HD11 ILE 7 4.655 -22.827 7.457
49 HD12 ILE 7 HD12 ILE 7 3.837 -23.461 8.899
50 HD13 ILE 7 HD13 ILE 7 3.390 -24.084 7.285
51 H SER 8 H SER 8 -0.377 -22.160 4.402
52 HA SER 8 HA SER 8 0.454 -20.696 2.158
53 HB2 SER 8 HB2 SER 8 -2.235 -22.159 2.538
54 HB3 SER 8 HB3 SER 8 -1.573 -21.608 0.974
55 HG SER 8 HG SER 8 0.256 -23.067 1.440
56 H ASP 9 H ASP 9 -2.680 -20.282 4.049
57 HA ASP 9 HA ASP 9 -3.670 -18.189 2.482
58 HB2 ASP 9 HB2 ASP 9 -5.051 -19.211 4.244
59 HB3 ASP 9 HB3 ASP 9 -3.957 -18.637 5.524
60 H TYR 10 H TYR 10 -1.569 -17.921 5.481
61 HA TYR 10 HA TYR 10 -1.474 -15.083 5.326
62 HB2 TYR 10 HB2 TYR 10 -0.848 -16.291 7.401
63 HB3 TYR 10 HB3 TYR 10 0.518 -17.068 6.564
64 HD1 TYR 10 HD1 TYR 10 -0.885 -13.578 7.175
65 HD2 TYR 10 HD2 TYR 10 2.656 -15.994 6.786
66 HE1 TYR 10 HE1 TYR 10 0.497 -11.650 7.828
67 HE2 TYR 10 HE2 TYR 10 4.030 -14.086 7.536
68 HH TYR 10 HH TYR 10 2.688 -10.900 8.425
69 H SER 11 H SER 11 0.594 -17.634 3.745
70 HA SER 11 HA SER 11 2.599 -15.812 2.850
71 HB2 SER 11 HB2 SER 11 2.849 -18.305 2.721
72 HB3 SER 11 HB3 SER 11 1.633 -18.370 1.415
73 HG SER 11 HG SER 11 3.147 -17.006 0.176
74 H ILE 12 H ILE 12 -0.654 -16.745 1.484
75 HA ILE 12 HA ILE 12 -0.178 -15.256 -0.973
76 HB ILE 12 HB ILE 12 -2.807 -16.167 0.322
77 HG12 ILE 12 HG12 ILE 12 -1.425 -18.125 -0.304
78 HG13 ILE 12 HG13 ILE 12 -2.848 -17.976 -1.343
79 HG21 ILE 12 HG21 ILE 12 -3.277 -14.269 -1.146
80 HG22 ILE 12 HG22 ILE 12 -2.272 -14.957 -2.445
81 HG23 ILE 12 HG23 ILE 12 -3.805 -15.753 -1.974
82 HD11 ILE 12 HD11 ILE 12 -1.343 -17.028 -3.178
83 HD12 ILE 12 HD12 ILE 12 0.069 -17.278 -2.106
84 HD13 ILE 12 HD13 ILE 12 -0.890 -18.665 -2.656
85 H ALA 13 H ALA 13 -1.930 -14.533 2.164
86 HA ALA 13 HA ALA 13 -2.701 -11.928 1.424
87 HB1 ALA 13 HB1 ALA 13 -2.700 -11.391 3.870
88 HB2 ALA 13 HB2 ALA 13 -3.420 -13.003 3.575
89 HB3 ALA 13 HB3 ALA 13 -1.750 -12.867 4.207
90 H MET 14 H MET 14 0.497 -13.140 2.743
91 HA MET 14 HA MET 14 1.639 -10.538 2.942
92 HB2 MET 14 HB2 MET 14 2.936 -13.261 2.484
93 HB3 MET 14 HB3 MET 14 3.907 -11.782 2.622
94 HG2 MET 14 HG2 MET 14 1.914 -12.470 4.867
95 HG3 MET 14 HG3 MET 14 3.513 -13.252 4.774
96 HE1 MET 14 HE1 MET 14 1.550 -10.044 5.542
97 HE2 MET 14 HE2 MET 14 2.812 -8.996 6.253
98 HE3 MET 14 HE3 MET 14 2.588 -9.017 4.484
99 H ASP 15 H ASP 15 1.641 -12.950 0.175
100 HA ASP 15 HA ASP 15 3.277 -11.425 -1.513
101 HB2 ASP 15 HB2 ASP 15 2.517 -13.706 -2.138
102 HB3 ASP 15 HB3 ASP 15 0.838 -13.137 -2.318
103 H LYS 16 H LYS 16 -0.344 -11.199 -1.056
104 HA LYS 16 HA LYS 16 -0.579 -9.125 -3.070
105 HB2 LYS 16 HB2 LYS 16 -2.459 -9.973 -0.789
106 HB3 LYS 16 HB3 LYS 16 -2.863 -8.737 -2.009
107 HG2 LYS 16 HG2 LYS 16 -2.666 -10.367 -3.847
108 HG3 LYS 16 HG3 LYS 16 -2.092 -11.635 -2.732
109 HD2 LYS 16 HD2 LYS 16 -4.262 -11.669 -1.550
110 HD3 LYS 16 HD3 LYS 16 -4.841 -10.265 -2.489
111 HE2 LYS 16 HE2 LYS 16 -5.843 -12.348 -3.338
112 HE3 LYS 16 HE3 LYS 16 -4.812 -11.618 -4.596
113 HZ1 LYS 16 HZ1 LYS 16 -4.587 -14.176 -4.192
114 HZ2 LYS 16 HZ2 LYS 16 -3.095 -13.278 -4.213
115 H ILE 17 H ILE 17 -0.398 -9.090 0.558
116 HA ILE 17 HA ILE 17 -0.744 -6.284 0.818
117 HB ILE 17 HB ILE 17 0.707 -8.318 2.578
118 HG12 ILE 17 HG12 ILE 17 -1.882 -6.735 3.138
119 HG13 ILE 17 HG13 ILE 17 -1.921 -8.263 2.242
120 HG21 ILE 17 HG21 ILE 17 0.778 -6.540 4.394
121 HG22 ILE 17 HG22 ILE 17 1.845 -6.188 3.034
122 HG23 ILE 17 HG23 ILE 17 0.276 -5.339 3.174
123 HD11 ILE 17 HD11 ILE 17 -2.430 -8.747 4.574
124 HD12 ILE 17 HD12 ILE 17 -0.833 -9.454 4.199
125 HD13 ILE 17 HD13 ILE 17 -0.950 -7.947 5.148
126 H HIS 18 H HIS 18 2.274 -8.227 0.096
127 HA HIS 18 HA HIS 18 4.139 -6.295 0.688
128 HB2 HIS 18 HB2 HIS 18 4.857 -8.449 -0.225
129 HB3 HIS 18 HB3 HIS 18 4.094 -8.111 -1.803
130 HD1 HIS 18 HD1 HIS 18 5.226 -6.337 -3.300
131 HD2 HIS 18 HD2 HIS 18 7.221 -7.124 0.317
132 HE1 HIS 18 HE1 HIS 18 7.516 -5.279 -3.534
133 H GLN 19 H GLN 19 2.078 -6.389 -2.344
134 HA GLN 19 HA GLN 19 3.425 -3.993 -3.349
135 HB2 GLN 19 HB2 GLN 19 0.818 -5.330 -4.280
136 HB3 GLN 19 HB3 GLN 19 1.633 -3.958 -5.074
137 HG2 GLN 19 HG2 GLN 19 3.699 -5.398 -5.415
138 HG3 GLN 19 HG3 GLN 19 2.869 -6.768 -4.644
139 HE21 GLN 19 HE21 GLN 19 2.428 -4.336 -7.370
140 HE22 GLN 19 HE22 GLN 19 1.609 -5.449 -8.403
141 H GLN 20 H GLN 20 0.122 -4.644 -1.828
142 HA GLN 20 HA GLN 20 -0.665 -1.953 -2.119
143 HB2 GLN 20 HB2 GLN 20 -2.283 -3.750 -1.510
144 HB3 GLN 20 HB3 GLN 20 -1.502 -3.931 0.082
145 HG2 GLN 20 HG2 GLN 20 -3.584 -2.540 0.239
146 HG3 GLN 20 HG3 GLN 20 -2.139 -1.623 0.720
147 HE21 GLN 20 HE21 GLN 20 -3.247 0.474 0.235
148 HE22 GLN 20 HE22 GLN 20 -3.549 0.925 -1.395
149 H ASP 21 H ASP 21 1.129 -3.563 0.604
150 HA ASP 21 HA ASP 21 1.309 -1.571 2.454
151 HB2 ASP 21 HB2 ASP 21 2.527 -3.653 2.782
152 HB3 ASP 21 HB3 ASP 21 3.606 -3.299 1.408
153 H PHE 22 H PHE 22 3.389 -1.710 -0.586
154 HA PHE 22 HA PHE 22 4.728 0.734 0.052
155 HB2 PHE 22 HB2 PHE 22 5.600 -0.769 -1.714
156 HB3 PHE 22 HB3 PHE 22 4.145 -0.516 -2.702
157 HD1 PHE 22 HD2 PHE 22 7.266 1.095 -1.443
158 HD2 PHE 22 HD1 PHE 22 3.748 1.621 -3.870
159 HE1 PHE 22 HE2 PHE 22 8.193 3.212 -2.331
160 HE2 PHE 22 HE1 PHE 22 4.763 3.637 -4.878
161 HZ PHE 22 HZ PHE 22 6.929 4.502 -4.039
162 H VAL 23 H VAL 23 1.648 0.062 -1.774
163 HA VAL 23 HA VAL 23 1.333 2.800 -2.584
164 HB VAL 23 HB VAL 23 -0.790 0.613 -2.243
165 HG11 VAL 23 HG11 VAL 23 -1.016 3.347 -3.652
166 HG12 VAL 23 HG12 VAL 23 -2.244 2.052 -3.690
167 HG13 VAL 23 HG13 VAL 23 -1.865 2.864 -2.158
168 HG21 VAL 23 HG21 VAL 23 0.933 0.057 -4.010
169 HG22 VAL 23 HG22 VAL 23 -0.629 0.460 -4.759
170 HG23 VAL 23 HG23 VAL 23 0.693 1.660 -4.749
171 H ASN 24 H ASN 24 0.314 0.992 0.447
172 HA ASN 24 HA ASN 24 -1.352 2.931 1.479
173 HB2 ASN 24 HB2 ASN 24 0.749 1.346 3.045
174 HB3 ASN 24 HB3 ASN 24 -0.533 2.325 3.788
175 HD21 ASN 24 HD21 ASN 24 -2.925 1.807 2.938
176 HD22 ASN 24 HD22 ASN 24 -3.246 0.123 2.755
177 H TRP 25 H TRP 25 2.328 2.923 1.469
178 HA TRP 25 HA TRP 25 2.466 5.381 2.906
179 HB2 TRP 25 HB2 TRP 25 4.450 3.921 2.633
180 HB3 TRP 25 HB3 TRP 25 4.526 4.313 0.892
181 HD1 TRP 25 HD1 TRP 25 5.198 5.848 4.352
182 HE1 TRP 25 HE1 TRP 25 6.312 8.095 4.088
183 HE3 TRP 25 HE3 TRP 25 4.841 6.375 -0.783
184 HZ2 TRP 25 HZ2 TRP 25 6.939 9.899 2.119
185 HZ3 TRP 25 HZ3 TRP 25 5.661 8.534 -1.779
186 HH2 TRP 25 HH2 TRP 25 6.692 10.262 -0.343
187 H LEU 26 H LEU 26 2.335 4.721 -0.744
188 HA LEU 26 HA LEU 26 2.592 7.395 -1.516
189 HB2 LEU 26 HB2 LEU 26 0.603 5.380 -2.734
190 HB3 LEU 26 HB3 LEU 26 0.965 6.978 -3.414
191 HG LEU 26 HG LEU 26 3.000 4.688 -3.157
192 HD11 LEU 26 HD11 LEU 26 2.682 4.518 -5.671
193 HD12 LEU 26 HD12 LEU 26 1.161 4.209 -4.809
194 HD13 LEU 26 HD13 LEU 26 1.439 5.787 -5.592
195 HD21 LEU 26 HD21 LEU 26 4.177 6.896 -3.155
196 HD22 LEU 26 HD22 LEU 26 4.375 6.138 -4.741
197 HD23 LEU 26 HD23 LEU 26 3.185 7.453 -4.533
198 H LEU 27 H LEU 27 -0.595 5.739 -0.727
199 HA LEU 27 HA LEU 27 -1.937 8.257 -0.936
200 HB2 LEU 27 HB2 LEU 27 -3.963 7.191 -0.174
201 HB3 LEU 27 HB3 LEU 27 -3.081 6.152 -1.312
202 HG LEU 27 HG LEU 27 -2.141 4.967 0.840
203 HD11 LEU 27 HD11 LEU 27 -3.723 4.947 2.804
204 HD12 LEU 27 HD12 LEU 27 -2.961 6.532 2.617
205 HD13 LEU 27 HD13 LEU 27 -4.638 6.287 2.064
206 HD21 LEU 27 HD21 LEU 27 -4.081 3.393 0.900
207 HD22 LEU 27 HD22 LEU 27 -5.104 4.622 0.097
208 HD23 LEU 27 HD23 LEU 27 -3.731 3.877 -0.771
209 H ALA 28 H ALA 28 -0.163 6.791 1.845
210 HA ALA 28 HA ALA 28 -1.485 8.258 3.868
211 HB1 ALA 28 HB1 ALA 28 0.296 6.565 4.405
212 HB2 ALA 28 HB2 ALA 28 1.539 7.658 3.730
213 HB3 ALA 28 HB3 ALA 28 0.626 8.142 5.183
214 H GLN 29 H GLN 29 0.996 9.287 1.431
215 HA GLN 29 HA GLN 29 1.692 11.715 2.680
216 HB2 GLN 29 HB2 GLN 29 1.368 11.266 -0.360
217 HB3 GLN 29 HB3 GLN 29 2.243 12.606 0.426
218 HG2 GLN 29 HG2 GLN 29 3.080 9.633 0.413
219 HG3 GLN 29 HG3 GLN 29 3.894 11.007 -0.337
220 HE21 GLN 29 HE21 GLN 29 3.341 9.308 2.793
221 HE22 GLN 29 HE22 GLN 29 4.460 10.276 3.675
222 H LYS 30 H LYS 30 -1.320 10.888 0.790
223 HA LYS 30 HA LYS 30 -1.951 13.535 0.200
224 HB2 LYS 30 HB2 LYS 30 -4.171 12.908 -0.326
225 HB3 LYS 30 HB3 LYS 30 -3.162 11.500 -0.695
226 HG2 LYS 30 HG2 LYS 30 -4.865 10.380 0.441
227 HG3 LYS 30 HG3 LYS 30 -3.937 10.833 1.888
228 HD2 LYS 30 HD2 LYS 30 -5.436 12.886 2.142
229 HD3 LYS 30 HD3 LYS 30 -6.337 12.369 0.694
230 HE2 LYS 30 HE2 LYS 30 -6.943 10.213 1.865
231 HE3 LYS 30 HE3 LYS 30 -6.147 10.819 3.349
232 HZ1 LYS 30 HZ1 LYS 30 -8.627 11.244 3.311
233 HZ2 LYS 30 HZ2 LYS 30 -7.753 12.771 3.291
234 H GLY 31 H GLY 31 -2.188 11.928 3.417
235 HA2 GLY 31 HA2 GLY 31 -4.022 13.636 4.655
236 HA3 GLY 31 HA3 GLY 31 -2.535 13.037 5.446
237 H LYS 32 H LYS 32 -0.486 14.161 3.922
238 HA LYS 32 HA LYS 32 -0.625 16.946 4.892
239 HB2 LYS 32 HB2 LYS 32 1.620 15.346 3.520
240 HB3 LYS 32 HB3 LYS 32 1.731 17.073 3.912
241 HG2 LYS 32 HG2 LYS 32 2.826 15.756 5.653
242 HG3 LYS 32 HG3 LYS 32 1.433 16.645 6.322
243 HD2 LYS 32 HD2 LYS 32 0.071 14.570 6.385
244 HD3 LYS 32 HD3 LYS 32 1.350 13.662 5.513
245 HE2 LYS 32 HE2 LYS 32 2.881 13.921 7.444
246 HE3 LYS 32 HE3 LYS 32 1.701 14.981 8.275
247 HZ1 LYS 32 HZ1 LYS 32 1.117 12.088 7.535
248 HZ2 LYS 32 HZ2 LYS 32 1.556 12.676 9.136
249 H LYS 33 H LYS 33 -0.105 15.256 1.657
250 HA LYS 33 HA LYS 33 -0.318 16.093 -0.477
251 HB2 LYS 33 HB2 LYS 33 -2.717 16.133 0.307
252 HB3 LYS 33 HB3 LYS 33 -2.519 17.848 0.746
253 HG2 LYS 33 HG2 LYS 33 -2.058 18.395 -1.673
254 HG3 LYS 33 HG3 LYS 33 -2.087 16.660 -2.076
255 HD2 LYS 33 HD2 LYS 33 -4.197 17.696 -2.747
256 HD3 LYS 33 HD3 LYS 33 -4.503 16.516 -1.447
257 HE2 LYS 33 HE2 LYS 33 -4.759 18.367 0.217
258 HE3 LYS 33 HE3 LYS 33 -4.264 19.569 -1.007
259 HZ1 LYS 33 HZ1 LYS 33 -6.304 19.034 -2.302
260 HZ2 LYS 33 HZ2 LYS 33 -6.766 17.841 -1.085
261 H ASN 34 H ASN 34 1.917 16.940 0.527
262 HA ASN 34 HA ASN 34 3.424 18.700 0.714
263 HB2 ASN 34 HB2 ASN 34 1.787 19.654 -1.693
264 HB3 ASN 34 HB3 ASN 34 3.476 20.108 -1.317
265 HD21 ASN 34 HD21 ASN 34 3.085 19.029 -3.819
266 HD22 ASN 34 HD22 ASN 34 3.680 17.409 -3.860
267 H ASP 35 H ASP 35 1.213 19.016 2.563
268 HA ASP 35 HA ASP 35 0.607 21.850 2.624
269 HB2 ASP 35 HB2 ASP 35 -0.693 20.300 4.043
270 HB3 ASP 35 HB3 ASP 35 0.779 19.768 4.897
271 H TRP 36 H TRP 36 3.266 19.673 3.932
272 HA TRP 36 HA TRP 36 5.061 22.035 3.968
273 HB2 TRP 36 HB2 TRP 36 3.625 21.910 6.128
274 HB3 TRP 36 HB3 TRP 36 4.465 20.400 6.534
275 HD1 TRP 36 HD1 TRP 36 4.941 24.185 6.127
276 HE1 TRP 36 HE1 TRP 36 7.068 24.926 7.256
277 HE3 TRP 36 HE3 TRP 36 6.888 19.555 7.457
278 HZ2 TRP 36 HZ2 TRP 36 9.345 23.849 8.322
279 HZ3 TRP 36 HZ3 TRP 36 9.146 19.534 8.525
280 HH2 TRP 36 HH2 TRP 36 10.364 21.646 8.939
281 H LYS 37 H LYS 37 5.611 20.332 2.092
282 HA LYS 37 HA LYS 37 7.712 18.538 3.225
283 HB2 LYS 37 HB2 LYS 37 5.480 17.316 3.130
284 HB3 LYS 37 HB3 LYS 37 5.453 17.584 1.377
285 HG2 LYS 37 HG2 LYS 37 6.209 15.322 1.864
286 HG3 LYS 37 HG3 LYS 37 7.566 16.214 1.130
287 HD2 LYS 37 HD2 LYS 37 8.743 16.361 3.253
288 HD3 LYS 37 HD3 LYS 37 7.268 15.989 4.188
289 HE2 LYS 37 HE2 LYS 37 8.799 14.058 4.211
290 HE3 LYS 37 HE3 LYS 37 7.290 13.634 3.366
291 HZ1 LYS 37 HZ1 LYS 37 8.468 13.829 1.195
292 HZ2 LYS 37 HZ2 LYS 37 9.946 14.317 2.060
293 H HIS 38 H HIS 38 9.032 20.271 2.273
294 HA HIS 38 HA HIS 38 10.711 20.226 0.581
295 HB2 HIS 38 HB2 HIS 38 8.594 19.967 -1.602
296 HB3 HIS 38 HB3 HIS 38 10.352 20.130 -1.781
297 HD1 HIS 38 HD1 HIS 38 10.853 17.894 0.620
298 HD2 HIS 38 HD2 HIS 38 8.695 17.629 -2.982
299 HE1 HIS 38 HE1 HIS 38 10.823 15.453 0.026
300 H ASN 39 H ASN 39 10.451 22.235 1.950
301 HA ASN 39 HA ASN 39 9.069 24.486 0.673
302 HB2 ASN 39 HB2 ASN 39 11.240 24.430 2.852
303 HB3 ASN 39 HB3 ASN 39 10.281 25.851 2.353
304 HD21 ASN 39 HD21 ASN 39 10.101 25.394 4.977
305 HD22 ASN 39 HD22 ASN 39 8.658 24.548 5.391
306 H ILE 40 H ILE 40 10.010 24.257 -1.580
307 HA ILE 40 HA ILE 40 11.605 24.723 -3.192
308 HB ILE 40 HB ILE 40 12.830 26.582 -1.075
309 HG12 ILE 40 HG12 ILE 40 10.500 27.075 -3.030
310 HG13 ILE 40 HG13 ILE 40 10.377 26.958 -1.254
311 HG21 ILE 40 HG21 ILE 40 12.845 26.696 -4.156
312 HG22 ILE 40 HG22 ILE 40 13.679 27.829 -3.051
313 HG23 ILE 40 HG23 ILE 40 14.218 26.147 -3.161
314 HD11 ILE 40 HD11 ILE 40 11.784 29.205 -2.817
315 HD12 ILE 40 HD12 ILE 40 10.321 29.308 -1.813
316 HD13 ILE 40 HD13 ILE 40 11.901 28.985 -1.042
317 H THR 41 H THR 41 12.127 22.345 -2.763
318 HA THR 41 HA THR 41 13.670 20.676 -2.336
319 HB THR 41 HB THR 41 15.785 22.863 -2.717
320 HG1 THR 41 HG1 THR 41 14.151 21.740 -4.781
321 HG21 THR 41 HG21 THR 41 16.666 20.502 -2.377
322 HG22 THR 41 HG22 THR 41 15.647 19.944 -3.735
323 HG23 THR 41 HG23 THR 41 16.968 21.107 -4.028
324 H GLN 42 H GLN 42 12.506 21.884 -0.020
325 HA GLN 42 HA GLN 42 12.894 22.101 2.254
326 HB2 GLN 42 HB2 GLN 42 13.081 19.631 1.560
327 HB3 GLN 42 HB3 GLN 42 14.855 19.805 1.620
328 HG2 GLN 42 HG2 GLN 42 14.670 20.448 4.068
329 HG3 GLN 42 HG3 GLN 42 12.892 20.297 3.959
330 HE21 GLN 42 HE21 GLN 42 13.583 18.763 5.902
331 HE22 GLN 42 HE22 GLN 42 13.843 17.117 5.448
Start of MODEL 11
1 H1 TYR 1 H1 TYR 1 5.001 -20.032 -0.170
2 HA TYR 1 HA TYR 1 7.696 -21.295 -0.177
3 HB2 TYR 1 HB2 TYR 1 7.618 -19.335 1.332
4 HB3 TYR 1 HB3 TYR 1 6.181 -19.975 2.156
5 HD1 TYR 1 HD1 TYR 1 9.777 -20.800 1.312
6 HD2 TYR 1 HD2 TYR 1 6.508 -21.519 4.010
7 HE1 TYR 1 HE1 TYR 1 11.269 -22.110 2.782
8 HE2 TYR 1 HE2 TYR 1 7.982 -22.849 5.460
9 HH TYR 1 HH TYR 1 10.153 -23.841 5.694
10 H ALA 2 H ALA 2 6.900 -23.417 -0.851
11 HA ALA 2 HA ALA 2 6.121 -25.524 -0.459
12 HB1 ALA 2 HB1 ALA 2 5.694 -24.695 2.479
13 HB2 ALA 2 HB2 ALA 2 5.828 -26.345 1.830
14 HB3 ALA 2 HB3 ALA 2 7.240 -25.253 1.776
15 H GLU 3 H GLU 3 4.103 -26.845 0.090
16 HA GLU 3 HA GLU 3 1.729 -25.110 -0.462
17 HB2 GLU 3 HB2 GLU 3 2.299 -26.921 -2.078
18 HB3 GLU 3 HB3 GLU 3 2.106 -28.142 -0.789
19 HG2 GLU 3 HG2 GLU 3 -0.304 -27.534 -0.538
20 HG3 GLU 3 HG3 GLU 3 -0.121 -26.209 -1.724
21 H GLY 4 H GLY 4 -0.237 -25.419 0.938
22 HA2 GLY 4 HA2 GLY 4 -0.250 -27.223 3.141
23 HA3 GLY 4 HA3 GLY 4 0.524 -25.696 3.655
24 H THR 5 H THR 5 -1.165 -24.774 4.983
25 HA THR 5 HA THR 5 -3.637 -23.993 3.524
26 HB THR 5 HB THR 5 -3.586 -25.742 6.052
27 HG1 THR 5 HG1 THR 5 -4.740 -26.224 3.486
28 HG21 THR 5 HG21 THR 5 -5.309 -23.949 6.369
29 HG22 THR 5 HG22 THR 5 -5.990 -24.307 4.751
30 HG23 THR 5 HG23 THR 5 -6.076 -25.529 6.054
31 H PHE 6 H PHE 6 -2.352 -23.983 7.005
32 HA PHE 6 HA PHE 6 -3.228 -21.243 7.281
33 HB2 PHE 6 HB2 PHE 6 -2.888 -22.660 9.312
34 HB3 PHE 6 HB3 PHE 6 -1.155 -22.811 8.943
35 HD1 PHE 6 HD2 PHE 6 -3.839 -20.398 9.927
36 HD2 PHE 6 HD1 PHE 6 0.386 -20.929 9.303
37 HE1 PHE 6 HE2 PHE 6 -3.414 -18.147 10.867
38 HE2 PHE 6 HE1 PHE 6 0.808 -18.682 10.244
39 HZ PHE 6 HZ PHE 6 -1.091 -17.277 11.015
40 H ILE 7 H ILE 7 0.003 -22.874 6.670
41 HA ILE 7 HA ILE 7 1.426 -20.379 6.678
42 HB ILE 7 HB ILE 7 2.129 -23.072 5.396
43 HG12 ILE 7 HG12 ILE 7 3.180 -21.680 7.960
44 HG13 ILE 7 HG13 ILE 7 1.982 -22.991 7.942
45 HG21 ILE 7 HG21 ILE 7 3.982 -20.634 5.763
46 HG22 ILE 7 HG22 ILE 7 4.426 -22.227 5.079
47 HG23 ILE 7 HG23 ILE 7 3.320 -21.173 4.193
48 HD11 ILE 7 HD11 ILE 7 4.091 -24.006 8.492
49 HD12 ILE 7 HD12 ILE 7 3.726 -24.502 6.816
50 HD13 ILE 7 HD13 ILE 7 4.943 -23.228 7.141
51 H SER 8 H SER 8 0.014 -22.418 3.953
52 HA SER 8 HA SER 8 0.857 -20.657 1.920
53 HB2 SER 8 HB2 SER 8 -1.701 -22.372 2.018
54 HB3 SER 8 HB3 SER 8 -1.004 -21.644 0.542
55 HG SER 8 HG SER 8 0.916 -22.990 1.007
56 H ASP 9 H ASP 9 -2.349 -20.685 3.733
57 HA ASP 9 HA ASP 9 -3.450 -18.484 2.380
58 HB2 ASP 9 HB2 ASP 9 -4.777 -19.841 3.993
59 HB3 ASP 9 HB3 ASP 9 -3.789 -19.257 5.350
60 H TYR 10 H TYR 10 -1.434 -18.501 5.419
61 HA TYR 10 HA TYR 10 -1.463 -15.691 5.794
62 HB2 TYR 10 HB2 TYR 10 -0.677 -17.321 7.517
63 HB3 TYR 10 HB3 TYR 10 0.718 -17.747 6.507
64 HD1 TYR 10 HD2 TYR 10 -0.804 -15.047 8.604
65 HD2 TYR 10 HD1 TYR 10 2.604 -16.152 6.228
66 HE1 TYR 10 HE2 TYR 10 0.557 -13.333 9.751
67 HE2 TYR 10 HE1 TYR 10 3.965 -14.447 7.375
68 HH TYR 10 HH TYR 10 4.054 -12.893 9.198
69 H SER 11 H SER 11 0.737 -17.823 3.809
70 HA SER 11 HA SER 11 2.503 -15.722 3.053
71 HB2 SER 11 HB2 SER 11 2.992 -18.158 2.714
72 HB3 SER 11 HB3 SER 11 1.793 -18.222 1.394
73 HG SER 11 HG SER 11 3.172 -16.594 0.305
74 H ILE 12 H ILE 12 -0.641 -16.871 1.570
75 HA ILE 12 HA ILE 12 -0.307 -15.199 -0.770
76 HB ILE 12 HB ILE 12 -2.844 -16.360 0.511
77 HG12 ILE 12 HG12 ILE 12 -1.325 -18.125 -0.382
78 HG13 ILE 12 HG13 ILE 12 -2.853 -18.025 -1.273
79 HG21 ILE 12 HG21 ILE 12 -3.996 -15.835 -1.681
80 HG22 ILE 12 HG22 ILE 12 -3.565 -14.398 -0.731
81 HG23 ILE 12 HG23 ILE 12 -2.583 -14.841 -2.148
82 HD11 ILE 12 HD11 ILE 12 -0.964 -18.410 -2.810
83 HD12 ILE 12 HD12 ILE 12 -1.661 -16.809 -3.152
84 HD13 ILE 12 HD13 ILE 12 -0.118 -16.954 -2.253
85 H ALA 13 H ALA 13 -2.010 -14.739 2.425
86 HA ALA 13 HA ALA 13 -3.044 -12.194 1.880
87 HB1 ALA 13 HB1 ALA 13 -1.738 -13.149 4.511
88 HB2 ALA 13 HB2 ALA 13 -2.798 -11.721 4.344
89 HB3 ALA 13 HB3 ALA 13 -3.449 -13.360 4.048
90 H MET 14 H MET 14 0.337 -13.112 2.958
91 HA MET 14 HA MET 14 1.193 -10.377 2.966
92 HB2 MET 14 HB2 MET 14 2.824 -12.967 2.747
93 HB3 MET 14 HB3 MET 14 3.552 -11.345 2.873
94 HG2 MET 14 HG2 MET 14 1.664 -12.551 5.005
95 HG3 MET 14 HG3 MET 14 3.448 -12.487 5.104
96 HE1 MET 14 HE1 MET 14 1.628 -11.291 7.401
97 HE2 MET 14 HE2 MET 14 3.426 -11.170 7.382
98 HE3 MET 14 HE3 MET 14 2.433 -9.714 7.700
99 H ASP 15 H ASP 15 1.231 -12.926 0.384
100 HA ASP 15 HA ASP 15 2.909 -11.605 -1.387
101 HB2 ASP 15 HB2 ASP 15 1.915 -13.892 -1.821
102 HB3 ASP 15 HB3 ASP 15 0.339 -13.126 -2.160
103 H LYS 16 H LYS 16 -0.597 -10.920 -0.708
104 HA LYS 16 HA LYS 16 -0.672 -8.899 -2.856
105 HB2 LYS 16 HB2 LYS 16 -2.596 -9.518 -0.540
106 HB3 LYS 16 HB3 LYS 16 -2.927 -8.336 -1.825
107 HG2 LYS 16 HG2 LYS 16 -2.429 -11.344 -2.366
108 HG3 LYS 16 HG3 LYS 16 -4.035 -10.617 -2.126
109 HD2 LYS 16 HD2 LYS 16 -3.639 -9.078 -4.098
110 HD3 LYS 16 HD3 LYS 16 -2.086 -9.895 -4.412
111 HE2 LYS 16 HE2 LYS 16 -4.859 -11.223 -4.474
112 HE3 LYS 16 HE3 LYS 16 -3.851 -10.804 -5.888
113 HZ1 LYS 16 HZ1 LYS 16 -3.662 -13.222 -5.189
114 HZ2 LYS 16 HZ2 LYS 16 -2.117 -12.384 -5.100
115 H ILE 17 H ILE 17 -0.319 -8.922 0.772
116 HA ILE 17 HA ILE 17 -0.730 -6.151 1.068
117 HB ILE 17 HB ILE 17 0.986 -8.060 2.720
118 HG12 ILE 17 HG12 ILE 17 -1.697 -6.706 3.442
119 HG13 ILE 17 HG13 ILE 17 -1.648 -8.266 2.615
120 HG21 ILE 17 HG21 ILE 17 0.305 -5.131 3.309
121 HG22 ILE 17 HG22 ILE 17 1.014 -6.242 4.511
122 HG23 ILE 17 HG23 ILE 17 1.942 -5.826 3.071
123 HD11 ILE 17 HD11 ILE 17 -0.518 -7.733 5.432
124 HD12 ILE 17 HD12 ILE 17 -1.972 -8.658 5.001
125 HD13 ILE 17 HD13 ILE 17 -0.365 -9.276 4.544
126 H HIS 18 H HIS 18 2.390 -7.893 0.150
127 HA HIS 18 HA HIS 18 3.932 -5.643 0.700
128 HB2 HIS 18 HB2 HIS 18 5.738 -6.481 -0.613
129 HB3 HIS 18 HB3 HIS 18 4.972 -7.817 0.279
130 HD1 HIS 18 HD1 HIS 18 6.698 -8.702 -1.760
131 HD2 HIS 18 HD2 HIS 18 2.762 -7.566 -2.692
132 HE1 HIS 18 HE1 HIS 18 6.153 -9.836 -3.948
133 H GLN 19 H GLN 19 1.568 -5.734 -1.907
134 HA GLN 19 HA GLN 19 2.881 -3.306 -3.069
135 HB2 GLN 19 HB2 GLN 19 0.468 -4.962 -4.005
136 HB3 GLN 19 HB3 GLN 19 0.951 -3.390 -4.693
137 HG2 GLN 19 HG2 GLN 19 3.239 -4.306 -5.226
138 HG3 GLN 19 HG3 GLN 19 2.718 -5.913 -4.643
139 HE21 GLN 19 HE21 GLN 19 3.704 -5.667 -7.266
140 HE22 GLN 19 HE22 GLN 19 2.394 -5.820 -8.376
141 H GLN 20 H GLN 20 -0.334 -4.344 -1.540
142 HA GLN 20 HA GLN 20 -1.368 -1.745 -1.546
143 HB2 GLN 20 HB2 GLN 20 -2.634 -3.837 -0.842
144 HB3 GLN 20 HB3 GLN 20 -1.800 -3.765 0.733
145 HG2 GLN 20 HG2 GLN 20 -2.737 -1.394 1.046
146 HG3 GLN 20 HG3 GLN 20 -3.667 -1.610 -0.457
147 HE21 GLN 20 HE21 GLN 20 -5.065 -3.815 -0.486
148 HE22 GLN 20 HE22 GLN 20 -5.863 -4.159 1.002
149 H ASP 21 H ASP 21 0.648 -3.369 1.067
150 HA ASP 21 HA ASP 21 0.782 -1.284 2.878
151 HB2 ASP 21 HB2 ASP 21 2.009 -3.371 3.317
152 HB3 ASP 21 HB3 ASP 21 3.093 -3.087 1.932
153 H PHE 22 H PHE 22 2.731 -1.690 -0.195
154 HA PHE 22 HA PHE 22 4.339 0.583 0.272
155 HB2 PHE 22 HB2 PHE 22 4.547 -1.240 -1.643
156 HB3 PHE 22 HB3 PHE 22 3.472 -0.185 -2.575
157 HD1 PHE 22 HD1 PHE 22 4.234 2.243 -2.979
158 HD2 PHE 22 HD2 PHE 22 6.870 -0.702 -1.285
159 HE1 PHE 22 HE1 PHE 22 6.180 3.721 -3.420
160 HE2 PHE 22 HE2 PHE 22 8.813 0.717 -1.836
161 HZ PHE 22 HZ PHE 22 8.476 2.932 -2.908
162 H VAL 23 H VAL 23 1.059 0.224 -1.270
163 HA VAL 23 HA VAL 23 0.897 2.967 -2.074
164 HB VAL 23 HB VAL 23 -1.381 1.022 -1.437
165 HG11 VAL 23 HG11 VAL 23 -2.830 2.640 -2.717
166 HG12 VAL 23 HG12 VAL 23 -2.193 3.375 -1.233
167 HG13 VAL 23 HG13 VAL 23 -1.465 3.788 -2.808
168 HG21 VAL 23 HG21 VAL 23 -0.190 1.951 -4.140
169 HG22 VAL 23 HG22 VAL 23 0.065 0.338 -3.425
170 HG23 VAL 23 HG23 VAL 23 -1.567 0.833 -3.932
171 H ASN 24 H ASN 24 0.046 1.250 1.060
172 HA ASN 24 HA ASN 24 -1.340 3.248 2.299
173 HB2 ASN 24 HB2 ASN 24 0.972 1.803 3.715
174 HB3 ASN 24 HB3 ASN 24 -0.395 2.641 4.480
175 HD21 ASN 24 HD21 ASN 24 -0.187 0.137 5.379
176 HD22 ASN 24 HD22 ASN 24 -1.316 -0.922 4.614
177 H TRP 25 H TRP 25 2.251 3.204 1.633
178 HA TRP 25 HA TRP 25 2.632 5.638 3.129
179 HB2 TRP 25 HB2 TRP 25 4.455 3.970 2.720
180 HB3 TRP 25 HB3 TRP 25 4.512 4.465 1.003
181 HD1 TRP 25 HD1 TRP 25 5.146 5.801 4.579
182 HE1 TRP 25 HE1 TRP 25 6.540 7.903 4.465
183 HE3 TRP 25 HE3 TRP 25 5.189 6.523 -0.554
184 HZ2 TRP 25 HZ2 TRP 25 7.563 9.629 2.606
185 HZ3 TRP 25 HZ3 TRP 25 6.561 8.434 -1.429
186 HH2 TRP 25 HH2 TRP 25 7.717 9.967 0.129
187 H LEU 26 H LEU 26 2.168 4.930 -0.492
188 HA LEU 26 HA LEU 26 2.518 7.621 -1.306
189 HB2 LEU 26 HB2 LEU 26 0.615 5.494 -2.437
190 HB3 LEU 26 HB3 LEU 26 0.528 7.186 -2.967
191 HG LEU 26 HG LEU 26 2.876 7.158 -3.749
192 HD11 LEU 26 HD11 LEU 26 4.045 4.971 -4.071
193 HD12 LEU 26 HD12 LEU 26 3.820 5.310 -2.336
194 HD13 LEU 26 HD13 LEU 26 2.749 4.141 -3.166
195 HD21 LEU 26 HD21 LEU 26 0.974 6.733 -5.326
196 HD22 LEU 26 HD22 LEU 26 2.393 5.765 -5.799
197 HD23 LEU 26 HD23 LEU 26 1.029 4.988 -4.945
198 H LEU 27 H LEU 27 -0.646 5.955 -0.292
199 HA LEU 27 HA LEU 27 -2.012 8.381 -0.564
200 HB2 LEU 27 HB2 LEU 27 -3.945 7.467 0.500
201 HB3 LEU 27 HB3 LEU 27 -3.162 6.223 -0.499
202 HG LEU 27 HG LEU 27 -2.046 5.464 1.774
203 HD11 LEU 27 HD11 LEU 27 -3.447 5.873 3.822
204 HD12 LEU 27 HD12 LEU 27 -2.836 7.421 3.230
205 HD13 LEU 27 HD13 LEU 27 -4.516 6.954 2.882
206 HD21 LEU 27 HD21 LEU 27 -5.054 5.002 1.287
207 HD22 LEU 27 HD22 LEU 27 -3.722 4.060 0.564
208 HD23 LEU 27 HD23 LEU 27 -4.005 3.982 2.316
209 H ALA 28 H ALA 28 -0.004 7.275 2.222
210 HA ALA 28 HA ALA 28 -0.997 9.262 4.028
211 HB1 ALA 28 HB1 ALA 28 0.543 7.432 4.771
212 HB2 ALA 28 HB2 ALA 28 1.884 8.176 3.849
213 HB3 ALA 28 HB3 ALA 28 1.155 9.050 5.222
214 H GLN 29 H GLN 29 1.504 9.351 1.366
215 HA GLN 29 HA GLN 29 2.323 12.041 1.913
216 HB2 GLN 29 HB2 GLN 29 2.213 10.721 -0.880
217 HB3 GLN 29 HB3 GLN 29 3.079 12.201 -0.430
218 HG2 GLN 29 HG2 GLN 29 3.744 9.357 0.549
219 HG3 GLN 29 HG3 GLN 29 4.657 10.345 -0.597
220 HE21 GLN 29 HE21 GLN 29 3.810 9.967 2.907
221 HE22 GLN 29 HE22 GLN 29 4.999 11.086 3.457
222 H LYS 30 H LYS 30 -0.304 10.633 -0.234
223 HA LYS 30 HA LYS 30 -1.190 13.114 -1.222
224 HB2 LYS 30 HB2 LYS 30 -2.082 10.940 -2.060
225 HB3 LYS 30 HB3 LYS 30 -2.935 10.681 -0.510
226 HG2 LYS 30 HG2 LYS 30 -4.333 12.695 -0.875
227 HG3 LYS 30 HG3 LYS 30 -3.447 13.076 -2.381
228 HD2 LYS 30 HD2 LYS 30 -4.248 10.941 -3.409
229 HD3 LYS 30 HD3 LYS 30 -5.082 10.500 -1.890
230 HE2 LYS 30 HE2 LYS 30 -6.566 12.528 -2.107
231 HE3 LYS 30 HE3 LYS 30 -5.724 12.983 -3.613
232 HZ1 LYS 30 HZ1 LYS 30 -6.484 10.861 -4.648
233 HZ2 LYS 30 HZ2 LYS 30 -7.362 10.458 -3.174
234 H GLY 31 H GLY 31 -1.962 11.427 1.954
235 HA2 GLY 31 HA2 GLY 31 -3.885 13.213 2.894
236 HA3 GLY 31 HA3 GLY 31 -2.665 12.443 3.946
237 H LYS 32 H LYS 32 -0.259 13.497 3.349
238 HA LYS 32 HA LYS 32 -0.328 16.107 4.416
239 HB2 LYS 32 HB2 LYS 32 1.827 14.421 3.158
240 HB3 LYS 32 HB3 LYS 32 1.981 16.103 2.679
241 HG2 LYS 32 HG2 LYS 32 3.312 15.776 4.672
242 HG3 LYS 32 HG3 LYS 32 1.931 16.822 5.083
243 HD2 LYS 32 HD2 LYS 32 0.740 14.732 6.048
244 HD3 LYS 32 HD3 LYS 32 2.212 13.800 5.681
245 HE2 LYS 32 HE2 LYS 32 3.528 15.327 7.216
246 HE3 LYS 32 HE3 LYS 32 2.036 16.261 7.541
247 HZ1 LYS 32 HZ1 LYS 32 2.370 13.312 8.184
248 HZ2 LYS 32 HZ2 LYS 32 2.411 14.637 9.339
249 H LYS 33 H LYS 33 -0.359 15.101 0.930
250 HA LYS 33 HA LYS 33 -0.760 16.371 -0.955
251 HB2 LYS 33 HB2 LYS 33 -2.997 16.575 0.345
252 HB3 LYS 33 HB3 LYS 33 -2.454 18.173 0.885
253 HG2 LYS 33 HG2 LYS 33 -2.287 18.911 -1.533
254 HG3 LYS 33 HG3 LYS 33 -2.759 17.270 -2.052
255 HD2 LYS 33 HD2 LYS 33 -4.974 17.509 -0.951
256 HD3 LYS 33 HD3 LYS 33 -4.510 19.101 -0.293
257 HE2 LYS 33 HE2 LYS 33 -5.972 19.369 -2.278
258 HE3 LYS 33 HE3 LYS 33 -4.358 20.046 -2.605
259 HZ1 LYS 33 HZ1 LYS 33 -3.834 18.153 -4.049
260 HZ2 LYS 33 HZ2 LYS 33 -5.275 17.276 -3.500
261 H ASN 34 H ASN 34 1.720 16.753 0.027
262 HA ASN 34 HA ASN 34 3.403 18.299 0.544
263 HB2 ASN 34 HB2 ASN 34 1.902 19.726 -1.731
264 HB3 ASN 34 HB3 ASN 34 3.595 20.021 -1.230
265 HD21 ASN 34 HD21 ASN 34 3.634 19.451 -3.781
266 HD22 ASN 34 HD22 ASN 34 3.992 17.794 -4.100
267 H ASP 35 H ASP 35 1.877 18.531 2.681
268 HA ASP 35 HA ASP 35 0.530 20.991 3.018
269 HB2 ASP 35 HB2 ASP 35 0.383 19.272 4.771
270 HB3 ASP 35 HB3 ASP 35 2.122 19.399 5.123
271 H TRP 36 H TRP 36 4.032 20.153 3.818
272 HA TRP 36 HA TRP 36 4.924 22.585 2.596
273 HB2 TRP 36 HB2 TRP 36 3.957 23.686 4.648
274 HB3 TRP 36 HB3 TRP 36 4.932 22.613 5.679
275 HD1 TRP 36 HD1 TRP 36 5.494 25.164 2.754
276 HE1 TRP 36 HE1 TRP 36 7.691 26.344 3.098
277 HE3 TRP 36 HE3 TRP 36 7.075 22.804 7.103
278 HZ2 TRP 36 HZ2 TRP 36 9.851 26.285 4.769
279 HZ3 TRP 36 HZ3 TRP 36 9.282 23.514 8.044
280 HH2 TRP 36 HH2 TRP 36 10.673 25.190 6.867
281 H LYS 37 H LYS 37 5.867 20.317 1.818
282 HA LYS 37 HA LYS 37 8.617 20.444 3.002
283 HB2 LYS 37 HB2 LYS 37 8.932 18.003 2.585
284 HB3 LYS 37 HB3 LYS 37 7.854 18.431 3.935
285 HG2 LYS 37 HG2 LYS 37 6.942 16.523 2.794
286 HG3 LYS 37 HG3 LYS 37 5.833 17.900 2.596
287 HD2 LYS 37 HD2 LYS 37 6.532 18.200 0.259
288 HD3 LYS 37 HD3 LYS 37 7.878 17.033 0.433
289 HE2 LYS 37 HE2 LYS 37 6.269 15.164 0.828
290 HE3 LYS 37 HE3 LYS 37 4.896 16.290 0.724
291 HZ1 LYS 37 HZ1 LYS 37 5.485 16.731 -1.644
292 HZ2 LYS 37 HZ2 LYS 37 6.787 15.535 -1.533
293 H HIS 38 H HIS 38 7.494 22.095 1.003
294 HA HIS 38 HA HIS 38 9.800 21.836 -0.661
295 HB2 HIS 38 HB2 HIS 38 7.045 21.231 -1.911
296 HB3 HIS 38 HB3 HIS 38 8.364 21.945 -2.879
297 HD1 HIS 38 HD1 HIS 38 7.137 18.705 -2.072
298 HD2 HIS 38 HD2 HIS 38 10.896 20.511 -2.604
299 HE1 HIS 38 HE1 HIS 38 8.748 16.808 -2.530
300 H ASN 39 H ASN 39 10.149 23.834 -1.936
301 HA ASN 39 HA ASN 39 8.295 26.040 -1.727
302 HB2 ASN 39 HB2 ASN 39 8.780 25.898 0.723
303 HB3 ASN 39 HB3 ASN 39 10.517 25.721 0.379
304 HD21 ASN 39 HD21 ASN 39 7.812 28.118 -0.431
305 HD22 ASN 39 HD22 ASN 39 8.783 29.499 -0.072
306 H ILE 40 H ILE 40 9.343 25.571 -4.037
307 HA ILE 40 HA ILE 40 10.795 26.339 -5.679
308 HB ILE 40 HB ILE 40 11.412 28.614 -3.708
309 HG12 ILE 40 HG12 ILE 40 9.071 28.262 -5.682
310 HG13 ILE 40 HG13 ILE 40 8.959 28.286 -3.906
311 HG21 ILE 40 HG21 ILE 40 12.913 28.397 -5.742
312 HG22 ILE 40 HG22 ILE 40 11.469 28.522 -6.785
313 HG23 ILE 40 HG23 ILE 40 11.958 29.891 -5.744
314 HD11 ILE 40 HD11 ILE 40 9.862 30.675 -3.920
315 HD12 ILE 40 HD12 ILE 40 9.694 30.667 -5.705
316 HD13 ILE 40 HD13 ILE 40 8.257 30.458 -4.675
317 H THR 41 H THR 41 11.995 24.281 -5.247
318 HA THR 41 HA THR 41 13.915 23.103 -4.750
319 HB THR 41 HB THR 41 15.314 25.830 -4.796
320 HG1 THR 41 HG1 THR 41 15.262 25.448 -7.138
321 HG21 THR 41 HG21 THR 41 17.211 24.523 -5.751
322 HG22 THR 41 HG22 THR 41 16.765 23.821 -4.174
323 HG23 THR 41 HG23 THR 41 16.254 23.017 -5.685
324 H GLN 42 H GLN 42 12.354 23.172 -2.655
325 HA GLN 42 HA GLN 42 12.169 23.438 -0.333
326 HB2 GLN 42 HB2 GLN 42 13.637 21.461 -0.739
327 HB3 GLN 42 HB3 GLN 42 15.087 22.505 -0.700
328 HG2 GLN 42 HG2 GLN 42 14.642 23.100 1.679
329 HG3 GLN 42 HG3 GLN 42 13.107 22.186 1.649
330 HE21 GLN 42 HE21 GLN 42 14.451 21.277 3.670
331 HE22 GLN 42 HE22 GLN 42 15.370 19.860 3.311
Start of MODEL 12
1 H1 TYR 1 H1 TYR 1 6.205 -28.373 6.772
2 HA TYR 1 HA TYR 1 6.435 -25.459 7.249
3 HB2 TYR 1 HB2 TYR 1 8.798 -25.469 6.442
4 HB3 TYR 1 HB3 TYR 1 8.606 -26.481 7.891
5 HD1 TYR 1 HD2 TYR 1 8.740 -28.955 7.731
6 HD2 TYR 1 HD1 TYR 1 9.201 -26.520 4.215
7 HE1 TYR 1 HE2 TYR 1 9.590 -30.907 6.500
8 HE2 TYR 1 HE1 TYR 1 10.038 -28.486 2.969
9 HH TYR 1 HH TYR 1 10.468 -31.715 4.427
10 H ALA 2 H ALA 2 6.893 -24.220 5.132
11 HA ALA 2 HA ALA 2 6.180 -23.722 3.009
12 HB1 ALA 2 HB1 ALA 2 6.774 -25.331 1.217
13 HB2 ALA 2 HB2 ALA 2 8.103 -25.043 2.374
14 HB3 ALA 2 HB3 ALA 2 7.187 -26.566 2.441
15 H GLU 3 H GLU 3 4.975 -27.224 2.897
16 HA GLU 3 HA GLU 3 2.527 -26.169 1.786
17 HB2 GLU 3 HB2 GLU 3 3.256 -28.438 1.172
18 HB3 GLU 3 HB3 GLU 3 3.158 -28.967 2.874
19 HG2 GLU 3 HG2 GLU 3 1.157 -29.709 1.566
20 HG3 GLU 3 HG3 GLU 3 0.686 -28.624 2.892
21 H GLY 4 H GLY 4 0.514 -25.775 2.948
22 HA2 GLY 4 HA2 GLY 4 -0.146 -26.850 5.439
23 HA3 GLY 4 HA3 GLY 4 0.729 -25.333 5.802
24 H THR 5 H THR 5 -2.317 -25.966 6.087
25 HA THR 5 HA THR 5 -3.518 -24.411 3.953
26 HB THR 5 HB THR 5 -4.667 -25.077 6.722
27 HG1 THR 5 HG1 THR 5 -5.544 -26.902 5.476
28 HG21 THR 5 HG21 THR 5 -6.872 -24.720 5.562
29 HG22 THR 5 HG22 THR 5 -5.894 -23.228 5.528
30 HG23 THR 5 HG23 THR 5 -6.021 -24.251 4.063
31 H PHE 6 H PHE 6 -2.740 -23.738 7.482
32 HA PHE 6 HA PHE 6 -3.379 -20.956 7.178
33 HB2 PHE 6 HB2 PHE 6 -3.414 -21.853 9.424
34 HB3 PHE 6 HB3 PHE 6 -1.747 -22.460 9.280
35 HD1 PHE 6 HD1 PHE 6 -3.580 -19.157 8.742
36 HD2 PHE 6 HD2 PHE 6 -0.152 -21.123 10.462
37 HE1 PHE 6 HE1 PHE 6 -2.692 -16.974 9.479
38 HE2 PHE 6 HE2 PHE 6 0.685 -18.947 11.268
39 HZ PHE 6 HZ PHE 6 -0.554 -16.858 10.741
40 H ILE 7 H ILE 7 -0.307 -22.864 6.627
41 HA ILE 7 HA ILE 7 1.343 -20.525 6.506
42 HB ILE 7 HB ILE 7 1.699 -23.137 4.924
43 HG12 ILE 7 HG12 ILE 7 3.048 -22.134 7.523
44 HG13 ILE 7 HG13 ILE 7 1.865 -23.454 7.394
45 HG21 ILE 7 HG21 ILE 7 3.644 -20.776 5.300
46 HG22 ILE 7 HG22 ILE 7 4.024 -22.294 4.442
47 HG23 ILE 7 HG23 ILE 7 2.816 -21.204 3.774
48 HD11 ILE 7 HD11 ILE 7 3.536 -24.674 5.838
49 HD12 ILE 7 HD12 ILE 7 4.745 -23.447 6.323
50 HD13 ILE 7 HD13 ILE 7 4.024 -24.508 7.550
51 H SER 8 H SER 8 -0.527 -22.356 3.925
52 HA SER 8 HA SER 8 0.166 -20.589 1.855
53 HB2 SER 8 HB2 SER 8 -2.461 -22.149 2.175
54 HB3 SER 8 HB3 SER 8 -1.851 -21.408 0.659
55 HG SER 8 HG SER 8 -1.165 -23.688 0.873
56 H ASP 9 H ASP 9 -2.632 -20.378 4.229
57 HA ASP 9 HA ASP 9 -3.871 -18.175 2.983
58 HB2 ASP 9 HB2 ASP 9 -4.959 -19.346 4.860
59 HB3 ASP 9 HB3 ASP 9 -3.706 -18.789 5.994
60 H TYR 10 H TYR 10 -1.338 -18.061 5.685
61 HA TYR 10 HA TYR 10 -1.236 -15.210 5.572
62 HB2 TYR 10 HB2 TYR 10 -0.272 -16.409 7.516
63 HB3 TYR 10 HB3 TYR 10 0.941 -17.190 6.470
64 HD1 TYR 10 HD1 TYR 10 -0.283 -13.846 7.703
65 HD2 TYR 10 HD2 TYR 10 2.972 -15.983 5.872
66 HE1 TYR 10 HE1 TYR 10 1.077 -11.778 7.694
67 HE2 TYR 10 HE2 TYR 10 4.384 -13.976 6.039
68 HH TYR 10 HH TYR 10 4.450 -11.641 6.528
69 H SER 11 H SER 11 0.686 -17.775 3.812
70 HA SER 11 HA SER 11 2.577 -16.051 2.673
71 HB2 SER 11 HB2 SER 11 2.643 -18.552 2.435
72 HB3 SER 11 HB3 SER 11 1.272 -18.459 1.279
73 HG SER 11 HG SER 11 3.378 -18.406 0.170
74 H ILE 12 H ILE 12 -0.832 -16.787 1.639
75 HA ILE 12 HA ILE 12 -0.605 -15.304 -0.835
76 HB ILE 12 HB ILE 12 -3.027 -16.143 0.847
77 HG12 ILE 12 HG12 ILE 12 -2.248 -17.141 -1.951
78 HG13 ILE 12 HG13 ILE 12 -1.493 -17.857 -0.515
79 HG21 ILE 12 HG21 ILE 12 -4.427 -15.445 -1.177
80 HG22 ILE 12 HG22 ILE 12 -3.675 -14.081 -0.331
81 HG23 ILE 12 HG23 ILE 12 -2.971 -14.676 -1.862
82 HD11 ILE 12 HD11 ILE 12 -4.538 -17.821 -0.998
83 HD12 ILE 12 HD12 ILE 12 -3.441 -19.208 -1.233
84 HD13 ILE 12 HD13 ILE 12 -3.695 -18.544 0.402
85 H ALA 13 H ALA 13 -1.787 -14.475 2.552
86 HA ALA 13 HA ALA 13 -2.632 -11.883 1.879
87 HB1 ALA 13 HB1 ALA 13 -3.056 -12.849 4.147
88 HB2 ALA 13 HB2 ALA 13 -1.319 -12.721 4.550
89 HB3 ALA 13 HB3 ALA 13 -2.278 -11.245 4.254
90 H MET 14 H MET 14 0.705 -12.953 3.055
91 HA MET 14 HA MET 14 1.629 -10.288 3.062
92 HB2 MET 14 HB2 MET 14 3.815 -11.040 3.457
93 HB3 MET 14 HB3 MET 14 2.786 -12.295 4.173
94 HG2 MET 14 HG2 MET 14 3.188 -13.753 2.158
95 HG3 MET 14 HG3 MET 14 4.203 -12.472 1.416
96 HE1 MET 14 HE1 MET 14 5.976 -14.433 1.122
97 HE2 MET 14 HE2 MET 14 6.819 -15.218 2.499
98 HE3 MET 14 HE3 MET 14 5.113 -15.637 2.138
99 H ASP 15 H ASP 15 1.644 -12.836 0.469
100 HA ASP 15 HA ASP 15 3.313 -11.616 -1.365
101 HB2 ASP 15 HB2 ASP 15 2.321 -13.837 -1.797
102 HB3 ASP 15 HB3 ASP 15 0.697 -13.138 -1.947
103 H LYS 16 H LYS 16 -0.335 -11.117 -1.128
104 HA LYS 16 HA LYS 16 -0.286 -9.052 -3.110
105 HB2 LYS 16 HB2 LYS 16 -2.419 -10.166 -2.519
106 HB3 LYS 16 HB3 LYS 16 -2.311 -9.567 -0.845
107 HG2 LYS 16 HG2 LYS 16 -2.437 -7.189 -1.657
108 HG3 LYS 16 HG3 LYS 16 -2.521 -7.771 -3.344
109 HD2 LYS 16 HD2 LYS 16 -4.706 -8.867 -2.851
110 HD3 LYS 16 HD3 LYS 16 -4.563 -8.447 -1.120
111 HE2 LYS 16 HE2 LYS 16 -6.093 -6.845 -2.285
112 HE3 LYS 16 HE3 LYS 16 -4.638 -6.011 -1.672
113 HZ1 LYS 16 HZ1 LYS 16 -4.982 -6.926 -4.553
114 HZ2 LYS 16 HZ2 LYS 16 -5.087 -5.270 -3.958
115 H ILE 17 H ILE 17 -0.331 -8.969 0.545
116 HA ILE 17 HA ILE 17 -0.838 -6.259 0.744
117 HB ILE 17 HB ILE 17 0.748 -8.052 2.628
118 HG12 ILE 17 HG12 ILE 17 -2.049 -6.747 2.924
119 HG13 ILE 17 HG13 ILE 17 -1.806 -8.375 2.276
120 HG21 ILE 17 HG21 ILE 17 1.618 -5.744 3.005
121 HG22 ILE 17 HG22 ILE 17 -0.054 -5.124 3.126
122 HG23 ILE 17 HG23 ILE 17 0.610 -6.215 4.369
123 HD11 ILE 17 HD11 ILE 17 -0.675 -9.051 4.467
124 HD12 ILE 17 HD12 ILE 17 -1.181 -7.477 5.149
125 HD13 ILE 17 HD13 ILE 17 -2.407 -8.633 4.602
126 H HIS 18 H HIS 18 2.464 -7.790 0.340
127 HA HIS 18 HA HIS 18 4.022 -5.623 0.865
128 HB2 HIS 18 HB2 HIS 18 4.353 -7.243 -1.724
129 HB3 HIS 18 HB3 HIS 18 5.629 -6.334 -0.876
130 HD1 HIS 18 HD1 HIS 18 5.323 -7.378 1.981
131 HD2 HIS 18 HD2 HIS 18 5.016 -9.753 -1.470
132 HE1 HIS 18 HE1 HIS 18 5.818 -9.739 2.730
133 H GLN 19 H GLN 19 2.087 -6.023 -2.208
134 HA GLN 19 HA GLN 19 3.113 -3.535 -3.318
135 HB2 GLN 19 HB2 GLN 19 0.653 -5.243 -4.035
136 HB3 GLN 19 HB3 GLN 19 1.119 -3.763 -4.908
137 HG2 GLN 19 HG2 GLN 19 3.307 -4.752 -5.543
138 HG3 GLN 19 HG3 GLN 19 2.981 -6.197 -4.555
139 HE21 GLN 19 HE21 GLN 19 1.557 -4.269 -7.355
140 HE22 GLN 19 HE22 GLN 19 0.936 -5.668 -8.152
141 H GLN 20 H GLN 20 -0.022 -4.464 -1.670
142 HA GLN 20 HA GLN 20 -1.165 -1.888 -2.012
143 HB2 GLN 20 HB2 GLN 20 -2.431 -3.988 -1.343
144 HB3 GLN 20 HB3 GLN 20 -1.689 -3.886 0.274
145 HG2 GLN 20 HG2 GLN 20 -4.004 -2.937 0.254
146 HG3 GLN 20 HG3 GLN 20 -2.811 -1.690 0.673
147 HE21 GLN 20 HE21 GLN 20 -3.128 0.310 -0.556
148 HE22 GLN 20 HE22 GLN 20 -3.900 0.346 -2.094
149 H ASP 21 H ASP 21 1.006 -3.204 0.586
150 HA ASP 21 HA ASP 21 0.708 -0.941 2.288
151 HB2 ASP 21 HB2 ASP 21 1.683 -3.064 3.122
152 HB3 ASP 21 HB3 ASP 21 3.090 -2.865 2.040
153 H PHE 22 H PHE 22 2.961 -1.593 -0.582
154 HA PHE 22 HA PHE 22 4.498 0.773 -0.093
155 HB2 PHE 22 HB2 PHE 22 5.239 -0.773 -1.885
156 HB3 PHE 22 HB3 PHE 22 3.759 -0.450 -2.817
157 HD1 PHE 22 HD2 PHE 22 6.905 1.119 -1.496
158 HD2 PHE 22 HD1 PHE 22 3.435 1.710 -3.976
159 HE1 PHE 22 HE2 PHE 22 7.941 3.146 -2.466
160 HE2 PHE 22 HE1 PHE 22 4.496 3.713 -4.965
161 HZ PHE 22 HZ PHE 22 6.736 4.450 -4.203
162 H VAL 23 H VAL 23 1.296 0.194 -1.756
163 HA VAL 23 HA VAL 23 1.031 2.940 -2.564
164 HB VAL 23 HB VAL 23 -1.140 0.843 -2.056
165 HG11 VAL 23 HG11 VAL 23 -1.365 3.626 -3.369
166 HG12 VAL 23 HG12 VAL 23 -2.646 2.383 -3.393
167 HG13 VAL 23 HG13 VAL 23 -2.151 3.106 -1.850
168 HG21 VAL 23 HG21 VAL 23 -1.225 0.658 -4.541
169 HG22 VAL 23 HG22 VAL 23 0.091 1.854 -4.698
170 HG23 VAL 23 HG23 VAL 23 0.410 0.262 -3.964
171 H ASN 24 H ASN 24 0.349 1.208 0.575
172 HA ASN 24 HA ASN 24 -1.182 3.272 1.743
173 HB2 ASN 24 HB2 ASN 24 0.791 1.360 3.099
174 HB3 ASN 24 HB3 ASN 24 0.095 2.732 3.952
175 HD21 ASN 24 HD21 ASN 24 -1.562 0.395 1.593
176 HD22 ASN 24 HD22 ASN 24 -2.731 -0.047 2.770
177 H TRP 25 H TRP 25 2.473 2.840 1.524
178 HA TRP 25 HA TRP 25 3.015 5.247 2.872
179 HB2 TRP 25 HB2 TRP 25 4.794 3.619 2.389
180 HB3 TRP 25 HB3 TRP 25 4.712 3.968 0.639
181 HD1 TRP 25 HD1 TRP 25 5.929 5.481 3.953
182 HE1 TRP 25 HE1 TRP 25 7.249 7.585 3.500
183 HE3 TRP 25 HE3 TRP 25 5.108 5.929 -1.144
184 HZ2 TRP 25 HZ2 TRP 25 7.775 9.316 1.445
185 HZ3 TRP 25 HZ3 TRP 25 6.185 7.886 -2.306
186 HH2 TRP 25 HH2 TRP 25 7.405 9.593 -1.014
187 H LEU 26 H LEU 26 2.144 4.769 -0.675
188 HA LEU 26 HA LEU 26 2.678 7.498 -1.326
189 HB2 LEU 26 HB2 LEU 26 0.481 5.700 -2.511
190 HB3 LEU 26 HB3 LEU 26 0.925 7.299 -3.141
191 HG LEU 26 HG LEU 26 2.841 4.894 -3.061
192 HD11 LEU 26 HD11 LEU 26 1.162 6.044 -5.389
193 HD12 LEU 26 HD12 LEU 26 2.369 4.743 -5.547
194 HD13 LEU 26 HD13 LEU 26 0.891 4.468 -4.598
195 HD21 LEU 26 HD21 LEU 26 4.195 6.257 -4.696
196 HD22 LEU 26 HD22 LEU 26 3.046 7.611 -4.520
197 HD23 LEU 26 HD23 LEU 26 4.055 7.099 -3.145
198 H LEU 27 H LEU 27 -0.510 5.946 -0.294
199 HA LEU 27 HA LEU 27 -1.777 8.491 -0.481
200 HB2 LEU 27 HB2 LEU 27 -3.764 7.512 0.400
201 HB3 LEU 27 HB3 LEU 27 -2.961 6.314 -0.628
202 HG LEU 27 HG LEU 27 -1.954 5.519 1.768
203 HD11 LEU 27 HD11 LEU 27 -3.583 5.759 3.634
204 HD12 LEU 27 HD12 LEU 27 -3.020 7.367 3.145
205 HD13 LEU 27 HD13 LEU 27 -4.623 6.792 2.620
206 HD21 LEU 27 HD21 LEU 27 -3.882 3.900 1.995
207 HD22 LEU 27 HD22 LEU 27 -4.818 4.895 0.841
208 HD23 LEU 27 HD23 LEU 27 -3.333 4.054 0.309
209 H ALA 28 H ALA 28 0.220 7.073 2.122
210 HA ALA 28 HA ALA 28 -0.792 8.473 4.306
211 HB1 ALA 28 HB1 ALA 28 2.206 8.146 3.639
212 HB2 ALA 28 HB2 ALA 28 1.497 8.434 5.252
213 HB3 ALA 28 HB3 ALA 28 1.193 6.891 4.404
214 H GLN 29 H GLN 29 1.455 9.621 1.668
215 HA GLN 29 HA GLN 29 1.679 12.268 2.811
216 HB2 GLN 29 HB2 GLN 29 2.311 11.164 0.019
217 HB3 GLN 29 HB3 GLN 29 2.416 12.903 0.383
218 HG2 GLN 29 HG2 GLN 29 4.641 11.769 0.646
219 HG3 GLN 29 HG3 GLN 29 4.081 12.595 2.117
220 HE21 GLN 29 HE21 GLN 29 4.169 9.285 0.538
221 HE22 GLN 29 HE22 GLN 29 4.218 8.440 2.040
222 H LYS 30 H LYS 30 -0.568 10.838 0.237
223 HA LYS 30 HA LYS 30 -1.486 13.395 -0.486
224 HB2 LYS 30 HB2 LYS 30 -3.202 12.485 -1.727
225 HB3 LYS 30 HB3 LYS 30 -2.065 11.119 -1.655
226 HG2 LYS 30 HG2 LYS 30 -3.551 10.191 0.272
227 HG3 LYS 30 HG3 LYS 30 -4.659 11.553 -0.015
228 HD2 LYS 30 HD2 LYS 30 -4.858 10.759 -2.462
229 HD3 LYS 30 HD3 LYS 30 -3.890 9.331 -2.010
230 HE2 LYS 30 HE2 LYS 30 -6.293 8.750 -1.986
231 HE3 LYS 30 HE3 LYS 30 -5.685 8.717 -0.306
232 HZ1 LYS 30 HZ1 LYS 30 -7.242 10.998 -1.558
233 HZ2 LYS 30 HZ2 LYS 30 -7.802 9.893 -0.320
234 H GLY 31 H GLY 31 -2.415 11.298 2.311
235 HA2 GLY 31 HA2 GLY 31 -4.646 12.941 3.104
236 HA3 GLY 31 HA3 GLY 31 -3.741 11.823 4.152
237 H LYS 32 H LYS 32 -1.058 12.955 3.888
238 HA LYS 32 HA LYS 32 -1.319 14.981 5.901
239 HB2 LYS 32 HB2 LYS 32 0.678 13.461 5.537
240 HB3 LYS 32 HB3 LYS 32 1.141 14.437 4.126
241 HG2 LYS 32 HG2 LYS 32 0.955 15.430 7.052
242 HG3 LYS 32 HG3 LYS 32 2.434 14.980 6.168
243 HD2 LYS 32 HD2 LYS 32 1.807 16.855 4.446
244 HD3 LYS 32 HD3 LYS 32 0.637 17.413 5.679
245 HE2 LYS 32 HE2 LYS 32 2.518 17.639 7.349
246 HE3 LYS 32 HE3 LYS 32 3.668 17.130 6.076
247 HZ1 LYS 32 HZ1 LYS 32 1.911 19.607 5.992
248 HZ2 LYS 32 HZ2 LYS 32 3.662 19.545 6.130
249 H LYS 33 H LYS 33 -0.392 15.178 2.359
250 HA LYS 33 HA LYS 33 -0.263 17.973 2.156
251 HB2 LYS 33 HB2 LYS 33 -1.409 15.944 0.137
252 HB3 LYS 33 HB3 LYS 33 -1.120 17.671 -0.223
253 HG2 LYS 33 HG2 LYS 33 1.293 17.432 0.042
254 HG3 LYS 33 HG3 LYS 33 1.143 15.780 0.684
255 HD2 LYS 33 HD2 LYS 33 1.887 15.727 -1.666
256 HD3 LYS 33 HD3 LYS 33 0.307 14.927 -1.485
257 HE2 LYS 33 HE2 LYS 33 -0.867 16.885 -2.465
258 HE3 LYS 33 HE3 LYS 33 0.646 17.837 -2.457
259 HZ1 LYS 33 HZ1 LYS 33 1.594 16.299 -4.129
260 HZ2 LYS 33 HZ2 LYS 33 0.123 15.322 -4.084
261 H ASN 34 H ASN 34 -3.162 15.741 2.045
262 HA ASN 34 HA ASN 34 -4.944 18.154 2.036
263 HB2 ASN 34 HB2 ASN 34 -5.635 15.175 1.790
264 HB3 ASN 34 HB3 ASN 34 -6.722 16.564 1.546
265 HD21 ASN 34 HD21 ASN 34 -6.395 14.584 -0.495
266 HD22 ASN 34 HD22 ASN 34 -5.576 15.322 -1.817
267 H ASP 35 H ASP 35 -3.489 18.128 4.384
268 HA ASP 35 HA ASP 35 -4.507 16.410 6.409
269 HB2 ASP 35 HB2 ASP 35 -2.523 17.854 6.834
270 HB3 ASP 35 HB3 ASP 35 -3.519 19.323 6.668
271 H TRP 36 H TRP 36 -5.562 19.717 5.232
272 HA TRP 36 HA TRP 36 -8.327 18.954 5.825
273 HB2 TRP 36 HB2 TRP 36 -7.589 19.692 8.079
274 HB3 TRP 36 HB3 TRP 36 -6.966 21.221 7.404
275 HD1 TRP 36 HD1 TRP 36 -10.340 19.255 7.569
276 HE1 TRP 36 HE1 TRP 36 -12.255 20.889 7.612
277 HE3 TRP 36 HE3 TRP 36 -7.686 23.707 7.269
278 HZ2 TRP 36 HZ2 TRP 36 -12.704 23.580 7.469
279 HZ3 TRP 36 HZ3 TRP 36 -9.014 25.828 7.294
280 HH2 TRP 36 HH2 TRP 36 -11.485 25.765 7.363
281 H LYS 37 H LYS 37 -7.942 19.197 3.336
282 HA LYS 37 HA LYS 37 -8.516 22.049 2.630
283 HB2 LYS 37 HB2 LYS 37 -6.013 21.539 2.572
284 HB3 LYS 37 HB3 LYS 37 -6.339 20.337 1.299
285 HG2 LYS 37 HG2 LYS 37 -7.527 22.307 0.001
286 HG3 LYS 37 HG3 LYS 37 -6.818 23.388 1.223
287 HD2 LYS 37 HD2 LYS 37 -5.326 21.574 -0.788
288 HD3 LYS 37 HD3 LYS 37 -5.419 23.355 -0.801
289 HE2 LYS 37 HE2 LYS 37 -4.175 23.391 1.418
290 HE3 LYS 37 HE3 LYS 37 -3.938 21.619 1.277
291 HZ1 LYS 37 HZ1 LYS 37 -1.998 22.909 0.391
292 HZ2 LYS 37 HZ2 LYS 37 -2.777 22.010 -0.902
293 H HIS 38 H HIS 38 -10.738 21.050 2.373
294 HA HIS 38 HA HIS 38 -12.391 20.393 0.842
295 HB2 HIS 38 HB2 HIS 38 -10.236 21.384 -1.120
296 HB3 HIS 38 HB3 HIS 38 -11.988 21.312 -1.436
297 HD1 HIS 38 HD1 HIS 38 -10.399 23.860 -1.720
298 HD2 HIS 38 HD2 HIS 38 -12.458 22.752 1.782
299 HE1 HIS 38 HE1 HIS 38 -10.860 26.011 -0.477
300 H ASN 39 H ASN 39 -11.447 18.051 1.660
301 HA ASN 39 HA ASN 39 -11.450 16.475 -0.841
302 HB2 ASN 39 HB2 ASN 39 -9.073 17.014 -0.727
303 HB3 ASN 39 HB3 ASN 39 -9.036 16.723 1.016
304 HD21 ASN 39 HD21 ASN 39 -9.944 14.901 -2.063
305 HD22 ASN 39 HD22 ASN 39 -9.188 13.436 -1.562
306 H ILE 40 H ILE 40 -13.573 16.290 0.445
307 HA ILE 40 HA ILE 40 -14.966 14.820 1.530
308 HB ILE 40 HB ILE 40 -12.635 12.844 1.406
309 HG12 ILE 40 HG12 ILE 40 -14.797 13.510 -0.692
310 HG13 ILE 40 HG13 ILE 40 -13.063 13.903 -0.820
311 HG21 ILE 40 HG21 ILE 40 -14.436 11.136 1.517
312 HG22 ILE 40 HG22 ILE 40 -14.585 12.222 2.906
313 HG23 ILE 40 HG23 ILE 40 -15.686 12.411 1.514
314 HD11 ILE 40 HD11 ILE 40 -13.464 11.935 -2.168
315 HD12 ILE 40 HD12 ILE 40 -12.498 11.440 -0.747
316 HD13 ILE 40 HD13 ILE 40 -14.249 11.068 -0.830
317 H THR 41 H THR 41 -15.070 16.207 3.417
318 HA THR 41 HA THR 41 -14.737 16.808 5.568
319 HB THR 41 HB THR 41 -15.589 14.255 5.557
320 HG1 THR 41 HG1 THR 41 -16.214 15.851 7.168
321 HG21 THR 41 HG21 THR 41 -14.427 12.806 7.083
322 HG22 THR 41 HG22 THR 41 -13.183 13.290 5.911
323 HG23 THR 41 HG23 THR 41 -13.234 14.032 7.532
324 H GLN 42 H GLN 42 -12.370 17.038 3.776
325 HA GLN 42 HA GLN 42 -10.401 17.380 6.027
326 HB2 GLN 42 HB2 GLN 42 -9.905 16.453 3.166
327 HB3 GLN 42 HB3 GLN 42 -8.609 16.964 4.272
328 HG2 GLN 42 HG2 GLN 42 -10.473 14.559 4.773
329 HG3 GLN 42 HG3 GLN 42 -8.837 14.467 4.085
330 HE21 GLN 42 HE21 GLN 42 -10.658 15.052 7.157
331 HE22 GLN 42 HE22 GLN 42 -9.250 15.036 8.150
Start of MODEL 13
1 H1 TYR 1 H1 TYR 1 -5.641 -30.012 5.352
2 HA TYR 1 HA TYR 1 -4.192 -31.271 3.839
3 HB2 TYR 1 HB2 TYR 1 -3.274 -28.459 2.967
4 HB3 TYR 1 HB3 TYR 1 -2.739 -30.005 2.263
5 HD1 TYR 1 HD1 TYR 1 -4.347 -31.379 0.897
6 HD2 TYR 1 HD2 TYR 1 -5.517 -27.551 2.477
7 HE1 TYR 1 HE1 TYR 1 -6.316 -31.351 -0.600
8 HE2 TYR 1 HE2 TYR 1 -7.495 -27.544 1.022
9 HH TYR 1 HH TYR 1 -8.700 -28.694 -0.693
10 H ALA 2 H ALA 2 -3.831 -31.320 6.450
11 HA ALA 2 HA ALA 2 -2.329 -31.255 8.214
12 HB1 ALA 2 HB1 ALA 2 -1.067 -32.588 6.427
13 HB2 ALA 2 HB2 ALA 2 -0.192 -31.092 5.994
14 HB3 ALA 2 HB3 ALA 2 -0.006 -31.798 7.618
15 H GLU 3 H GLU 3 -0.126 -29.868 9.013
16 HA GLU 3 HA GLU 3 -0.947 -27.127 9.015
17 HB2 GLU 3 HB2 GLU 3 0.621 -27.987 10.740
18 HB3 GLU 3 HB3 GLU 3 1.849 -28.330 9.488
19 HG2 GLU 3 HG2 GLU 3 2.363 -26.207 10.712
20 HG3 GLU 3 HG3 GLU 3 2.084 -25.905 8.983
21 H GLY 4 H GLY 4 -0.161 -25.348 7.565
22 HA2 GLY 4 HA2 GLY 4 1.509 -25.044 5.624
23 HA3 GLY 4 HA3 GLY 4 0.727 -26.477 4.910
24 H THR 5 H THR 5 -2.035 -26.014 5.821
25 HA THR 5 HA THR 5 -2.872 -24.350 3.686
26 HB THR 5 HB THR 5 -4.401 -25.021 6.269
27 HG1 THR 5 HG1 THR 5 -5.105 -26.828 4.921
28 HG21 THR 5 HG21 THR 5 -5.389 -24.171 3.461
29 HG22 THR 5 HG22 THR 5 -6.440 -24.658 4.821
30 HG23 THR 5 HG23 THR 5 -5.479 -23.159 4.935
31 H PHE 6 H PHE 6 -2.555 -23.647 7.293
32 HA PHE 6 HA PHE 6 -3.331 -20.917 7.057
33 HB2 PHE 6 HB2 PHE 6 -3.115 -21.823 9.317
34 HB3 PHE 6 HB3 PHE 6 -1.429 -22.302 9.033
35 HD1 PHE 6 HD1 PHE 6 -3.670 -19.319 9.440
36 HD2 PHE 6 HD2 PHE 6 0.398 -20.711 9.214
37 HE1 PHE 6 HE1 PHE 6 -2.859 -17.095 10.172
38 HE2 PHE 6 HE2 PHE 6 1.202 -18.474 9.883
39 HZ PHE 6 HZ PHE 6 -0.422 -16.656 10.363
40 H ILE 7 H ILE 7 -0.025 -22.498 6.778
41 HA ILE 7 HA ILE 7 1.340 -20.014 6.574
42 HB ILE 7 HB ILE 7 2.049 -22.690 5.267
43 HG12 ILE 7 HG12 ILE 7 2.062 -22.712 7.816
44 HG13 ILE 7 HG13 ILE 7 3.617 -23.088 7.054
45 HG21 ILE 7 HG21 ILE 7 3.669 -20.086 5.401
46 HG22 ILE 7 HG22 ILE 7 4.410 -21.681 5.062
47 HG23 ILE 7 HG23 ILE 7 3.194 -21.007 3.952
48 HD11 ILE 7 HD11 ILE 7 2.913 -20.353 8.302
49 HD12 ILE 7 HD12 ILE 7 3.911 -21.634 9.032
50 HD13 ILE 7 HD13 ILE 7 4.482 -20.801 7.568
51 H SER 8 H SER 8 -0.158 -22.119 4.004
52 HA SER 8 HA SER 8 0.599 -20.488 1.836
53 HB2 SER 8 HB2 SER 8 -0.351 -22.726 1.489
54 HB3 SER 8 HB3 SER 8 -1.930 -22.230 2.144
55 HG SER 8 HG SER 8 -2.053 -20.745 0.285
56 H ASP 9 H ASP 9 -2.547 -20.375 3.783
57 HA ASP 9 HA ASP 9 -3.631 -18.216 2.356
58 HB2 ASP 9 HB2 ASP 9 -4.971 -19.412 4.049
59 HB3 ASP 9 HB3 ASP 9 -3.906 -18.868 5.359
60 H TYR 10 H TYR 10 -1.568 -18.084 5.374
61 HA TYR 10 HA TYR 10 -1.438 -15.261 5.434
62 HB2 TYR 10 HB2 TYR 10 -0.733 -16.642 7.361
63 HB3 TYR 10 HB3 TYR 10 0.580 -17.373 6.409
64 HD1 TYR 10 HD1 TYR 10 -0.726 -13.962 7.435
65 HD2 TYR 10 HD2 TYR 10 2.761 -16.346 6.605
66 HE1 TYR 10 HE1 TYR 10 0.709 -12.101 8.154
67 HE2 TYR 10 HE2 TYR 10 4.197 -14.511 7.419
68 HH TYR 10 HH TYR 10 2.943 -11.394 8.633
69 H SER 11 H SER 11 0.584 -17.644 3.547
70 HA SER 11 HA SER 11 2.542 -15.682 2.802
71 HB2 SER 11 HB2 SER 11 2.920 -18.145 2.552
72 HB3 SER 11 HB3 SER 11 1.722 -18.203 1.229
73 HG SER 11 HG SER 11 3.190 -16.703 0.082
74 H ILE 12 H ILE 12 -0.654 -16.711 1.370
75 HA ILE 12 HA ILE 12 -0.297 -15.036 -0.975
76 HB ILE 12 HB ILE 12 -2.844 -16.133 0.329
77 HG12 ILE 12 HG12 ILE 12 -1.345 -17.930 -0.575
78 HG13 ILE 12 HG13 ILE 12 -2.901 -17.823 -1.417
79 HG21 ILE 12 HG21 ILE 12 -3.492 -14.146 -0.921
80 HG22 ILE 12 HG22 ILE 12 -2.513 -14.627 -2.329
81 HG23 ILE 12 HG23 ILE 12 -3.969 -15.568 -1.877
82 HD11 ILE 12 HD11 ILE 12 -1.044 -18.260 -2.987
83 HD12 ILE 12 HD12 ILE 12 -1.779 -16.684 -3.362
84 HD13 ILE 12 HD13 ILE 12 -0.206 -16.768 -2.513
85 H ALA 13 H ALA 13 -1.903 -14.567 2.291
86 HA ALA 13 HA ALA 13 -2.815 -11.963 1.718
87 HB1 ALA 13 HB1 ALA 13 -2.771 -11.525 4.167
88 HB2 ALA 13 HB2 ALA 13 -3.425 -13.156 3.842
89 HB3 ALA 13 HB3 ALA 13 -1.748 -12.966 4.434
90 H MET 14 H MET 14 0.447 -13.115 2.933
91 HA MET 14 HA MET 14 1.530 -10.511 3.236
92 HB2 MET 14 HB2 MET 14 2.875 -13.156 2.490
93 HB3 MET 14 HB3 MET 14 3.814 -11.677 2.751
94 HG2 MET 14 HG2 MET 14 1.912 -12.559 4.997
95 HG3 MET 14 HG3 MET 14 3.440 -13.437 4.735
96 HE1 MET 14 HE1 MET 14 2.858 -9.208 4.719
97 HE2 MET 14 HE2 MET 14 1.796 -10.109 5.865
98 HE3 MET 14 HE3 MET 14 3.204 -9.181 6.472
99 H ASP 15 H ASP 15 1.580 -12.766 0.341
100 HA ASP 15 HA ASP 15 3.138 -11.077 -1.273
101 HB2 ASP 15 HB2 ASP 15 2.545 -13.392 -1.953
102 HB3 ASP 15 HB3 ASP 15 0.838 -12.929 -2.156
103 H LYS 16 H LYS 16 -0.494 -11.163 -0.891
104 HA LYS 16 HA LYS 16 -0.882 -9.042 -2.790
105 HB2 LYS 16 HB2 LYS 16 -2.608 -9.983 -0.435
106 HB3 LYS 16 HB3 LYS 16 -3.207 -8.813 -1.619
107 HG2 LYS 16 HG2 LYS 16 -2.229 -11.589 -2.544
108 HG3 LYS 16 HG3 LYS 16 -3.835 -11.364 -1.826
109 HD2 LYS 16 HD2 LYS 16 -4.043 -11.396 -4.197
110 HD3 LYS 16 HD3 LYS 16 -4.517 -9.783 -3.619
111 HE2 LYS 16 HE2 LYS 16 -1.677 -10.267 -4.694
112 HE3 LYS 16 HE3 LYS 16 -3.047 -10.052 -5.808
113 HZ1 LYS 16 HZ1 LYS 16 -2.706 -7.860 -3.776
114 HZ2 LYS 16 HZ2 LYS 16 -1.893 -7.895 -5.356
115 H ILE 17 H ILE 17 -0.571 -9.084 0.826
116 HA ILE 17 HA ILE 17 -1.193 -6.365 1.164
117 HB ILE 17 HB ILE 17 0.525 -8.240 2.841
118 HG12 ILE 17 HG12 ILE 17 -2.169 -6.908 3.541
119 HG13 ILE 17 HG13 ILE 17 -2.120 -8.416 2.617
120 HG21 ILE 17 HG21 ILE 17 0.471 -6.442 4.659
121 HG22 ILE 17 HG22 ILE 17 1.469 -6.007 3.267
122 HG23 ILE 17 HG23 ILE 17 -0.169 -5.305 3.442
123 HD11 ILE 17 HD11 ILE 17 -0.851 -9.541 4.497
124 HD12 ILE 17 HD12 ILE 17 -1.023 -8.055 5.473
125 HD13 ILE 17 HD13 ILE 17 -2.470 -8.958 4.977
126 H HIS 18 H HIS 18 2.055 -7.938 0.493
127 HA HIS 18 HA HIS 18 3.717 -5.850 0.961
128 HB2 HIS 18 HB2 HIS 18 4.590 -7.925 0.042
129 HB3 HIS 18 HB3 HIS 18 3.735 -7.691 -1.503
130 HD1 HIS 18 HD1 HIS 18 4.651 -5.885 -3.103
131 HD2 HIS 18 HD2 HIS 18 6.909 -6.483 0.396
132 HE1 HIS 18 HE1 HIS 18 6.868 -4.744 -3.520
133 H GLN 19 H GLN 19 1.752 -6.084 -2.143
134 HA GLN 19 HA GLN 19 2.838 -3.577 -3.089
135 HB2 GLN 19 HB2 GLN 19 0.182 -4.935 -3.848
136 HB3 GLN 19 HB3 GLN 19 0.887 -3.501 -4.649
137 HG2 GLN 19 HG2 GLN 19 2.910 -4.837 -5.297
138 HG3 GLN 19 HG3 GLN 19 2.222 -6.282 -4.512
139 HE21 GLN 19 HE21 GLN 19 2.763 -6.875 -7.018
140 HE22 GLN 19 HE22 GLN 19 1.389 -6.747 -8.053
141 H GLN 20 H GLN 20 -0.306 -4.446 -1.404
142 HA GLN 20 HA GLN 20 -1.352 -1.864 -1.294
143 HB2 GLN 20 HB2 GLN 20 -2.613 -3.840 -0.524
144 HB3 GLN 20 HB3 GLN 20 -1.479 -4.062 0.836
145 HG2 GLN 20 HG2 GLN 20 -2.220 -1.971 1.905
146 HG3 GLN 20 HG3 GLN 20 -3.225 -1.568 0.481
147 HE21 GLN 20 HE21 GLN 20 -2.764 -4.323 2.909
148 HE22 GLN 20 HE22 GLN 20 -4.450 -4.655 3.024
149 H ASP 21 H ASP 21 1.119 -3.373 0.941
150 HA ASP 21 HA ASP 21 1.131 -1.273 2.815
151 HB2 ASP 21 HB2 ASP 21 2.275 -3.414 3.293
152 HB3 ASP 21 HB3 ASP 21 3.429 -3.139 1.964
153 H PHE 22 H PHE 22 3.246 -1.768 -0.168
154 HA PHE 22 HA PHE 22 4.658 0.674 0.218
155 HB2 PHE 22 HB2 PHE 22 5.475 -0.986 -1.416
156 HB3 PHE 22 HB3 PHE 22 4.003 -0.820 -2.399
157 HD1 PHE 22 HD2 PHE 22 6.937 1.111 -1.041
158 HD2 PHE 22 HD1 PHE 22 3.812 1.009 -4.000
159 HE1 PHE 22 HE2 PHE 22 7.977 3.032 -2.206
160 HE2 PHE 22 HE1 PHE 22 4.876 2.902 -5.186
161 HZ PHE 22 HZ PHE 22 6.951 3.929 -4.282
162 H VAL 23 H VAL 23 1.562 -0.042 -1.575
163 HA VAL 23 HA VAL 23 1.276 2.629 -2.575
164 HB VAL 23 HB VAL 23 -0.830 0.487 -1.981
165 HG11 VAL 23 HG11 VAL 23 -2.389 1.874 -3.420
166 HG12 VAL 23 HG12 VAL 23 -1.998 2.666 -1.877
167 HG13 VAL 23 HG13 VAL 23 -1.199 3.205 -3.384
168 HG21 VAL 23 HG21 VAL 23 -0.827 0.189 -4.467
169 HG22 VAL 23 HG22 VAL 23 0.362 1.508 -4.647
170 HG23 VAL 23 HG23 VAL 23 0.833 -0.020 -3.860
171 H ASN 24 H ASN 24 0.444 1.140 0.640
172 HA ASN 24 HA ASN 24 -1.139 3.330 1.461
173 HB2 ASN 24 HB2 ASN 24 0.331 1.199 3.053
174 HB3 ASN 24 HB3 ASN 24 -0.158 2.683 3.882
175 HD21 ASN 24 HD21 ASN 24 -1.831 0.578 1.336
176 HD22 ASN 24 HD22 ASN 24 -3.290 0.503 2.248
177 H TRP 25 H TRP 25 2.497 3.027 1.327
178 HA TRP 25 HA TRP 25 2.884 5.341 2.931
179 HB2 TRP 25 HB2 TRP 25 4.804 3.882 2.169
180 HB3 TRP 25 HB3 TRP 25 4.648 4.560 0.524
181 HD1 TRP 25 HD1 TRP 25 5.350 5.657 4.181
182 HE1 TRP 25 HE1 TRP 25 6.659 7.814 4.188
183 HE3 TRP 25 HE3 TRP 25 5.299 6.718 -0.894
184 HZ2 TRP 25 HZ2 TRP 25 7.630 9.671 2.431
185 HZ3 TRP 25 HZ3 TRP 25 6.517 8.767 -1.650
186 HH2 TRP 25 HH2 TRP 25 7.680 10.213 -0.015
187 H LEU 26 H LEU 26 2.061 4.916 -0.609
188 HA LEU 26 HA LEU 26 2.405 7.701 -1.193
189 HB2 LEU 26 HB2 LEU 26 0.729 5.569 -2.642
190 HB3 LEU 26 HB3 LEU 26 0.668 7.295 -3.052
191 HG LEU 26 HG LEU 26 3.124 7.340 -3.489
192 HD11 LEU 26 HD11 LEU 26 4.390 5.244 -3.819
193 HD12 LEU 26 HD12 LEU 26 3.845 5.314 -2.135
194 HD13 LEU 26 HD13 LEU 26 2.994 4.261 -3.294
195 HD21 LEU 26 HD21 LEU 26 1.514 5.309 -5.157
196 HD22 LEU 26 HD22 LEU 26 1.468 7.084 -5.348
197 HD23 LEU 26 HD23 LEU 26 2.968 6.194 -5.708
198 H LEU 27 H LEU 27 -0.628 5.774 -0.232
199 HA LEU 27 HA LEU 27 -2.183 8.105 -0.522
200 HB2 LEU 27 HB2 LEU 27 -4.051 7.069 0.465
201 HB3 LEU 27 HB3 LEU 27 -3.129 5.820 -0.393
202 HG LEU 27 HG LEU 27 -2.084 5.374 2.040
203 HD11 LEU 27 HD11 LEU 27 -3.180 7.323 3.242
204 HD12 LEU 27 HD12 LEU 27 -4.771 6.635 2.844
205 HD13 LEU 27 HD13 LEU 27 -3.655 5.757 3.921
206 HD21 LEU 27 HD21 LEU 27 -3.877 3.690 2.505
207 HD22 LEU 27 HD22 LEU 27 -4.978 4.536 1.381
208 HD23 LEU 27 HD23 LEU 27 -3.516 3.723 0.764
209 H ALA 28 H ALA 28 -0.115 6.987 2.222
210 HA ALA 28 HA ALA 28 -1.147 8.857 4.116
211 HB1 ALA 28 HB1 ALA 28 1.029 8.603 5.290
212 HB2 ALA 28 HB2 ALA 28 0.432 7.007 4.743
213 HB3 ALA 28 HB3 ALA 28 1.749 7.824 3.853
214 H GLN 29 H GLN 29 1.379 9.144 1.470
215 HA GLN 29 HA GLN 29 2.238 11.733 2.221
216 HB2 GLN 29 HB2 GLN 29 2.012 10.673 -0.676
217 HB3 GLN 29 HB3 GLN 29 2.813 12.158 -0.141
218 HG2 GLN 29 HG2 GLN 29 3.672 9.277 0.509
219 HG3 GLN 29 HG3 GLN 29 4.492 10.440 -0.537
220 HE21 GLN 29 HE21 GLN 29 3.816 9.565 2.907
221 HE22 GLN 29 HE22 GLN 29 4.969 10.667 3.561
222 H LYS 30 H LYS 30 -0.380 10.883 -0.275
223 HA LYS 30 HA LYS 30 -0.992 13.640 -0.557
224 HB2 LYS 30 HB2 LYS 30 -2.931 13.073 -1.813
225 HB3 LYS 30 HB3 LYS 30 -1.662 11.879 -2.209
226 HG2 LYS 30 HG2 LYS 30 -2.812 10.380 -0.394
227 HG3 LYS 30 HG3 LYS 30 -4.187 11.498 -0.469
228 HD2 LYS 30 HD2 LYS 30 -3.026 9.796 -2.785
229 HD3 LYS 30 HD3 LYS 30 -4.537 9.488 -1.901
230 HE2 LYS 30 HE2 LYS 30 -5.121 10.515 -4.044
231 HE3 LYS 30 HE3 LYS 30 -5.452 11.699 -2.747
232 HZ1 LYS 30 HZ1 LYS 30 -2.987 11.666 -4.548
233 HZ2 LYS 30 HZ2 LYS 30 -4.300 12.839 -4.581
234 H GLY 31 H GLY 31 -1.966 11.300 2.001
235 HA2 GLY 31 HA2 GLY 31 -4.163 12.694 3.054
236 HA3 GLY 31 HA3 GLY 31 -2.954 11.835 4.042
237 H LYS 32 H LYS 32 -0.573 13.195 3.724
238 HA LYS 32 HA LYS 32 -1.174 15.749 5.069
239 HB2 LYS 32 HB2 LYS 32 1.458 14.324 4.412
240 HB3 LYS 32 HB3 LYS 32 1.413 16.048 4.836
241 HG2 LYS 32 HG2 LYS 32 1.879 14.728 6.822
242 HG3 LYS 32 HG3 LYS 32 0.323 15.566 7.006
243 HD2 LYS 32 HD2 LYS 32 -0.893 13.427 6.447
244 HD3 LYS 32 HD3 LYS 32 0.673 12.591 6.235
245 HE2 LYS 32 HE2 LYS 32 1.243 13.071 8.638
246 HE3 LYS 32 HE3 LYS 32 -0.335 13.889 8.856
247 HZ1 LYS 32 HZ1 LYS 32 -0.288 11.456 9.599
248 HZ2 LYS 32 HZ2 LYS 32 -1.484 11.756 8.347
249 H LYS 33 H LYS 33 0.938 15.029 2.163
250 HA LYS 33 HA LYS 33 0.961 16.000 0.123
251 HB2 LYS 33 HB2 LYS 33 -1.562 16.239 0.252
252 HB3 LYS 33 HB3 LYS 33 -1.308 17.927 0.784
253 HG2 LYS 33 HG2 LYS 33 -0.061 18.451 -1.302
254 HG3 LYS 33 HG3 LYS 33 -0.134 16.745 -1.804
255 HD2 LYS 33 HD2 LYS 33 -1.768 17.890 -3.103
256 HD3 LYS 33 HD3 LYS 33 -2.662 16.895 -1.928
257 HE2 LYS 33 HE2 LYS 33 -2.074 19.915 -1.620
258 HE3 LYS 33 HE3 LYS 33 -3.590 19.256 -2.293
259 HZ1 LYS 33 HZ1 LYS 33 -3.770 19.851 0.128
260 HZ2 LYS 33 HZ2 LYS 33 -4.062 18.140 -0.145
261 H ASN 34 H ASN 34 0.625 18.400 2.878
262 HA ASN 34 HA ASN 34 3.006 19.772 1.855
263 HB2 ASN 34 HB2 ASN 34 1.688 21.966 1.513
264 HB3 ASN 34 HB3 ASN 34 1.494 20.711 0.263
265 HD21 ASN 34 HD21 ASN 34 -0.513 22.131 -0.212
266 HD22 ASN 34 HD22 ASN 34 -1.947 21.686 0.634
267 H ASP 35 H ASP 35 0.130 20.253 4.173
268 HA ASP 35 HA ASP 35 1.371 22.030 5.868
269 HB2 ASP 35 HB2 ASP 35 -0.210 19.528 6.738
270 HB3 ASP 35 HB3 ASP 35 0.189 20.907 7.794
271 H TRP 36 H TRP 36 1.979 18.412 5.684
272 HA TRP 36 HA TRP 36 4.674 18.988 6.750
273 HB2 TRP 36 HB2 TRP 36 3.183 18.649 8.769
274 HB3 TRP 36 HB3 TRP 36 2.789 17.013 8.190
275 HD1 TRP 36 HD1 TRP 36 5.784 19.190 9.343
276 HE1 TRP 36 HE1 TRP 36 7.612 17.721 10.267
277 HE3 TRP 36 HE3 TRP 36 3.770 14.515 8.304
278 HZ2 TRP 36 HZ2 TRP 36 8.214 15.074 10.563
279 HZ3 TRP 36 HZ3 TRP 36 5.171 12.523 8.854
280 HH2 TRP 36 HH2 TRP 36 7.352 12.796 9.991
281 H LYS 37 H LYS 37 4.477 18.455 4.203
282 HA LYS 37 HA LYS 37 5.333 15.555 4.069
283 HB2 LYS 37 HB2 LYS 37 3.327 16.150 2.651
284 HB3 LYS 37 HB3 LYS 37 4.314 17.383 1.829
285 HG2 LYS 37 HG2 LYS 37 5.846 15.574 0.940
286 HG3 LYS 37 HG3 LYS 37 4.950 14.348 1.863
287 HD2 LYS 37 HD2 LYS 37 2.965 14.678 0.494
288 HD3 LYS 37 HD3 LYS 37 3.627 16.160 -0.253
289 HE2 LYS 37 HE2 LYS 37 5.398 14.870 -1.405
290 HE3 LYS 37 HE3 LYS 37 4.777 13.352 -0.711
291 HZ1 LYS 37 HZ1 LYS 37 2.528 13.986 -1.893
292 HZ2 LYS 37 HZ2 LYS 37 3.868 13.715 -3.006
293 H HIS 38 H HIS 38 7.057 17.311 5.351
294 HA HIS 38 HA HIS 38 9.305 17.215 3.607
295 HB2 HIS 38 HB2 HIS 38 8.209 19.265 2.507
296 HB3 HIS 38 HB3 HIS 38 8.151 20.027 4.107
297 HD1 HIS 38 HD1 HIS 38 9.843 21.838 3.850
298 HD2 HIS 38 HD2 HIS 38 11.199 18.174 2.291
299 HE1 HIS 38 HE1 HIS 38 12.232 22.239 3.121
300 H ASN 39 H ASN 39 11.285 17.578 4.889
301 HA ASN 39 HA ASN 39 11.011 19.088 7.418
302 HB2 ASN 39 HB2 ASN 39 11.891 16.143 7.395
303 HB3 ASN 39 HB3 ASN 39 11.942 17.234 8.798
304 HD21 ASN 39 HD21 ASN 39 9.707 15.450 6.549
305 HD22 ASN 39 HD22 ASN 39 8.331 15.607 7.569
306 H ILE 40 H ILE 40 12.239 20.084 5.301
307 HA ILE 40 HA ILE 40 14.277 20.797 4.456
308 HB ILE 40 HB ILE 40 15.323 20.050 7.242
309 HG12 ILE 40 HG12 ILE 40 13.838 22.572 6.279
310 HG13 ILE 40 HG13 ILE 40 13.257 21.375 7.469
311 HG21 ILE 40 HG21 ILE 40 16.243 22.202 5.236
312 HG22 ILE 40 HG22 ILE 40 17.019 21.807 6.799
313 HG23 ILE 40 HG23 ILE 40 17.069 20.640 5.471
314 HD11 ILE 40 HD11 ILE 40 14.028 23.288 8.724
315 HD12 ILE 40 HD12 ILE 40 15.244 22.001 8.968
316 HD13 ILE 40 HD13 ILE 40 15.575 23.364 7.852
317 H THR 41 H THR 41 13.974 18.825 3.029
318 HA THR 41 HA THR 41 15.355 17.428 1.811
319 HB THR 41 HB THR 41 17.367 17.747 3.480
320 HG1 THR 41 HG1 THR 41 18.349 16.066 2.165
321 HG21 THR 41 HG21 THR 41 18.059 15.634 4.595
322 HG22 THR 41 HG22 THR 41 16.499 16.032 5.321
323 HG23 THR 41 HG23 THR 41 16.592 14.789 4.051
324 H GLN 42 H GLN 42 14.196 16.430 5.103
325 HA GLN 42 HA GLN 42 13.350 13.796 3.945
326 HB2 GLN 42 HB2 GLN 42 14.748 13.587 5.920
327 HB3 GLN 42 HB3 GLN 42 13.832 14.825 6.799
328 HG2 GLN 42 HG2 GLN 42 11.801 13.345 6.843
329 HG3 GLN 42 HG3 GLN 42 12.673 12.115 5.892
330 HE21 GLN 42 HE21 GLN 42 13.018 14.098 8.987
331 HE22 GLN 42 HE22 GLN 42 13.765 12.823 9.874
Start of MODEL 14
1 H1 TYR 1 H1 TYR 1 3.085 -33.098 6.934
2 HA TYR 1 HA TYR 1 1.603 -34.928 6.079
3 HB2 TYR 1 HB2 TYR 1 -0.043 -34.006 8.515
4 HB3 TYR 1 HB3 TYR 1 -0.550 -35.251 7.334
5 HD1 TYR 1 HD1 TYR 1 2.878 -36.035 7.687
6 HD2 TYR 1 HD2 TYR 1 -0.775 -36.010 9.978
7 HE1 TYR 1 HE1 TYR 1 3.739 -37.842 9.095
8 HE2 TYR 1 HE2 TYR 1 0.119 -37.795 11.411
9 HH TYR 1 HH TYR 1 1.978 -39.230 11.869
10 H ALA 2 H ALA 2 2.039 -32.993 4.560
11 HA ALA 2 HA ALA 2 1.224 -31.252 3.257
12 HB1 ALA 2 HB1 ALA 2 -1.454 -32.645 3.874
13 HB2 ALA 2 HB2 ALA 2 -1.099 -31.574 2.486
14 HB3 ALA 2 HB3 ALA 2 -0.283 -33.160 2.625
15 H GLU 3 H GLU 3 1.898 -30.264 5.701
16 HA GLU 3 HA GLU 3 -0.213 -29.075 7.158
17 HB2 GLU 3 HB2 GLU 3 2.013 -29.007 8.106
18 HB3 GLU 3 HB3 GLU 3 2.688 -28.137 6.708
19 HG2 GLU 3 HG2 GLU 3 2.319 -26.639 8.717
20 HG3 GLU 3 HG3 GLU 3 1.479 -26.082 7.253
21 H GLY 4 H GLY 4 1.768 -27.697 4.406
22 HA2 GLY 4 HA2 GLY 4 1.157 -25.224 4.149
23 HA3 GLY 4 HA3 GLY 4 0.939 -26.250 2.721
24 H THR 5 H THR 5 -0.803 -24.608 5.412
25 HA THR 5 HA THR 5 -3.112 -24.292 3.600
26 HB THR 5 HB THR 5 -3.337 -25.855 6.235
27 HG1 THR 5 HG1 THR 5 -4.140 -27.451 4.693
28 HG21 THR 5 HG21 THR 5 -5.244 -24.223 6.068
29 HG22 THR 5 HG22 THR 5 -5.556 -24.751 4.385
30 HG23 THR 5 HG23 THR 5 -5.821 -25.879 5.747
31 H PHE 6 H PHE 6 -2.414 -23.922 7.222
32 HA PHE 6 HA PHE 6 -3.530 -21.255 7.188
33 HB2 PHE 6 HB2 PHE 6 -3.358 -22.451 9.352
34 HB3 PHE 6 HB3 PHE 6 -1.599 -22.601 9.182
35 HD1 PHE 6 HD1 PHE 6 -4.372 -20.163 9.766
36 HD2 PHE 6 HD2 PHE 6 -0.105 -20.678 9.494
37 HE1 PHE 6 HE1 PHE 6 -4.031 -17.906 10.726
38 HE2 PHE 6 HE2 PHE 6 0.227 -18.386 10.352
39 HZ PHE 6 HZ PHE 6 -1.733 -16.994 10.980
40 H ILE 7 H ILE 7 -0.145 -22.637 7.029
41 HA ILE 7 HA ILE 7 1.104 -20.049 7.022
42 HB ILE 7 HB ILE 7 2.099 -22.729 5.901
43 HG12 ILE 7 HG12 ILE 7 2.855 -21.224 8.496
44 HG13 ILE 7 HG13 ILE 7 1.715 -22.584 8.428
45 HG21 ILE 7 HG21 ILE 7 3.251 -20.822 4.730
46 HG22 ILE 7 HG22 ILE 7 3.661 -20.094 6.309
47 HG23 ILE 7 HG23 ILE 7 4.377 -21.652 5.802
48 HD11 ILE 7 HD11 ILE 7 4.725 -22.760 7.823
49 HD12 ILE 7 HD12 ILE 7 3.831 -23.455 9.189
50 HD13 ILE 7 HD13 ILE 7 3.552 -24.084 7.541
51 H SER 8 H SER 8 0.035 -22.309 4.338
52 HA SER 8 HA SER 8 0.940 -20.652 2.247
53 HB2 SER 8 HB2 SER 8 -1.513 -22.511 2.295
54 HB3 SER 8 HB3 SER 8 -0.920 -21.656 0.844
55 HG SER 8 HG SER 8 0.673 -23.526 2.329
56 H ASP 9 H ASP 9 -2.372 -20.665 3.875
57 HA ASP 9 HA ASP 9 -3.476 -18.579 2.407
58 HB2 ASP 9 HB2 ASP 9 -4.817 -19.744 4.109
59 HB3 ASP 9 HB3 ASP 9 -3.787 -19.141 5.425
60 H TYR 10 H TYR 10 -1.431 -18.250 5.440
61 HA TYR 10 HA TYR 10 -1.521 -15.415 5.457
62 HB2 TYR 10 HB2 TYR 10 -0.637 -16.656 7.402
63 HB3 TYR 10 HB3 TYR 10 0.677 -17.339 6.420
64 HD1 TYR 10 HD2 TYR 10 -0.750 -13.978 7.468
65 HD2 TYR 10 HD1 TYR 10 2.749 -16.145 6.213
66 HE1 TYR 10 HE2 TYR 10 0.681 -12.064 8.115
67 HE2 TYR 10 HE1 TYR 10 4.178 -14.298 6.977
68 HH TYR 10 HH TYR 10 4.248 -12.140 7.997
69 H SER 11 H SER 11 0.842 -17.694 3.813
70 HA SER 11 HA SER 11 2.508 -15.657 2.832
71 HB2 SER 11 HB2 SER 11 3.120 -18.075 2.660
72 HB3 SER 11 HB3 SER 11 1.810 -18.331 1.474
73 HG SER 11 HG SER 11 4.057 -16.608 1.030
74 H ILE 12 H ILE 12 -0.664 -16.877 1.481
75 HA ILE 12 HA ILE 12 -0.398 -15.332 -0.951
76 HB ILE 12 HB ILE 12 -2.927 -16.263 0.516
77 HG12 ILE 12 HG12 ILE 12 -1.580 -18.183 -0.293
78 HG13 ILE 12 HG13 ILE 12 -3.119 -18.030 -1.157
79 HG21 ILE 12 HG21 ILE 12 -4.111 -15.785 -1.689
80 HG22 ILE 12 HG22 ILE 12 -3.555 -14.332 -0.828
81 HG23 ILE 12 HG23 ILE 12 -2.637 -14.924 -2.233
82 HD11 ILE 12 HD11 ILE 12 -0.345 -17.234 -2.270
83 HD12 ILE 12 HD12 ILE 12 -1.312 -18.653 -2.713
84 HD13 ILE 12 HD13 ILE 12 -1.897 -17.027 -3.137
85 H ALA 13 H ALA 13 -1.901 -14.588 2.305
86 HA ALA 13 HA ALA 13 -2.751 -12.001 1.557
87 HB1 ALA 13 HB1 ALA 13 -1.614 -12.820 4.309
88 HB2 ALA 13 HB2 ALA 13 -2.643 -11.403 3.952
89 HB3 ALA 13 HB3 ALA 13 -3.309 -13.048 3.778
90 H MET 14 H MET 14 0.560 -13.160 2.617
91 HA MET 14 HA MET 14 1.602 -10.523 2.869
92 HB2 MET 14 HB2 MET 14 3.063 -13.129 2.211
93 HB3 MET 14 HB3 MET 14 3.888 -11.583 2.510
94 HG2 MET 14 HG2 MET 14 2.046 -13.000 4.548
95 HG3 MET 14 HG3 MET 14 3.827 -13.022 4.577
96 HE1 MET 14 HE1 MET 14 5.265 -11.182 5.764
97 HE2 MET 14 HE2 MET 14 5.028 -10.235 4.255
98 HE3 MET 14 HE3 MET 14 4.759 -9.465 5.850
99 H ASP 15 H ASP 15 1.354 -12.724 -0.039
100 HA ASP 15 HA ASP 15 2.914 -11.197 -1.776
101 HB2 ASP 15 HB2 ASP 15 1.843 -13.312 -2.519
102 HB3 ASP 15 HB3 ASP 15 0.227 -12.570 -2.429
103 H LYS 16 H LYS 16 -0.567 -10.644 -0.833
104 HA LYS 16 HA LYS 16 -0.684 -8.282 -2.606
105 HB2 LYS 16 HB2 LYS 16 -2.695 -9.252 -0.489
106 HB3 LYS 16 HB3 LYS 16 -2.990 -8.026 -1.750
107 HG2 LYS 16 HG2 LYS 16 -2.518 -11.051 -2.211
108 HG3 LYS 16 HG3 LYS 16 -4.051 -10.160 -2.338
109 HD2 LYS 16 HD2 LYS 16 -3.141 -8.826 -4.261
110 HD3 LYS 16 HD3 LYS 16 -1.594 -9.706 -4.143
111 HE2 LYS 16 HE2 LYS 16 -2.894 -10.676 -5.958
112 HE3 LYS 16 HE3 LYS 16 -2.707 -11.870 -4.650
113 HZ1 LYS 16 HZ1 LYS 16 -5.040 -11.598 -4.030
114 HZ2 LYS 16 HZ2 LYS 16 -5.202 -10.166 -5.077
115 H ILE 17 H ILE 17 -0.420 -8.899 0.964
116 HA ILE 17 HA ILE 17 -0.942 -6.187 1.674
117 HB ILE 17 HB ILE 17 0.713 -8.345 3.080
118 HG12 ILE 17 HG12 ILE 17 -1.983 -7.115 3.913
119 HG13 ILE 17 HG13 ILE 17 -1.911 -8.515 2.833
120 HG21 ILE 17 HG21 ILE 17 0.019 -5.523 4.081
121 HG22 ILE 17 HG22 ILE 17 0.694 -6.808 5.117
122 HG23 ILE 17 HG23 ILE 17 1.657 -6.171 3.786
123 HD11 ILE 17 HD11 ILE 17 -0.781 -8.505 5.704
124 HD12 ILE 17 HD12 ILE 17 -2.293 -9.250 5.157
125 HD13 ILE 17 HD13 ILE 17 -0.725 -9.872 4.560
126 H HIS 18 H HIS 18 2.159 -7.904 0.726
127 HA HIS 18 HA HIS 18 3.829 -5.726 1.335
128 HB2 HIS 18 HB2 HIS 18 4.807 -7.856 0.697
129 HB3 HIS 18 HB3 HIS 18 4.090 -7.796 -0.934
130 HD1 HIS 18 HD1 HIS 18 5.047 -5.995 -2.560
131 HD2 HIS 18 HD2 HIS 18 7.046 -6.325 1.126
132 HE1 HIS 18 HE1 HIS 18 7.227 -4.753 -2.853
133 H GLN 19 H GLN 19 2.058 -6.364 -1.836
134 HA GLN 19 HA GLN 19 3.159 -3.935 -2.962
135 HB2 GLN 19 HB2 GLN 19 0.697 -5.548 -3.862
136 HB3 GLN 19 HB3 GLN 19 1.417 -4.170 -4.742
137 HG2 GLN 19 HG2 GLN 19 3.608 -5.427 -4.899
138 HG3 GLN 19 HG3 GLN 19 2.831 -6.846 -4.139
139 HE21 GLN 19 HE21 GLN 19 3.877 -7.508 -6.490
140 HE22 GLN 19 HE22 GLN 19 2.707 -7.517 -7.759
141 H GLN 20 H GLN 20 -0.115 -4.727 -1.499
142 HA GLN 20 HA GLN 20 -1.116 -2.134 -2.023
143 HB2 GLN 20 HB2 GLN 20 -2.601 -4.040 -1.406
144 HB3 GLN 20 HB3 GLN 20 -1.926 -4.065 0.242
145 HG2 GLN 20 HG2 GLN 20 -4.144 -2.842 0.106
146 HG3 GLN 20 HG3 GLN 20 -2.818 -1.831 0.724
147 HE21 GLN 20 HE21 GLN 20 -3.394 0.321 -0.085
148 HE22 GLN 20 HE22 GLN 20 -3.759 0.613 -1.740
149 H ASP 21 H ASP 21 0.629 -3.431 0.905
150 HA ASP 21 HA ASP 21 0.391 -1.123 2.484
151 HB2 ASP 21 HB2 ASP 21 1.421 -3.210 3.378
152 HB3 ASP 21 HB3 ASP 21 2.824 -2.999 2.287
153 H PHE 22 H PHE 22 2.701 -1.849 -0.222
154 HA PHE 22 HA PHE 22 4.344 0.434 0.226
155 HB2 PHE 22 HB2 PHE 22 4.633 -1.564 -1.460
156 HB3 PHE 22 HB3 PHE 22 3.726 -0.563 -2.617
157 HD1 PHE 22 HD2 PHE 22 5.131 2.173 -1.520
158 HD2 PHE 22 HD1 PHE 22 6.574 -1.649 -2.876
159 HE1 PHE 22 HE2 PHE 22 7.331 3.160 -1.954
160 HE2 PHE 22 HE1 PHE 22 8.759 -0.631 -3.380
161 HZ PHE 22 HZ PHE 22 9.166 1.770 -2.884
162 H VAL 23 H VAL 23 1.347 -0.086 -1.827
163 HA VAL 23 HA VAL 23 1.196 2.621 -2.678
164 HB VAL 23 HB VAL 23 -1.042 0.555 -2.320
165 HG11 VAL 23 HG11 VAL 23 -1.165 3.306 -3.710
166 HG12 VAL 23 HG12 VAL 23 -2.433 2.050 -3.787
167 HG13 VAL 23 HG13 VAL 23 -2.058 2.828 -2.237
168 HG21 VAL 23 HG21 VAL 23 0.455 1.576 -4.832
169 HG22 VAL 23 HG22 VAL 23 0.671 -0.035 -4.098
170 HG23 VAL 23 HG23 VAL 23 -0.889 0.403 -4.833
171 H ASN 24 H ASN 24 -0.036 1.048 0.403
172 HA ASN 24 HA ASN 24 -1.610 3.169 1.247
173 HB2 ASN 24 HB2 ASN 24 0.278 1.621 3.110
174 HB3 ASN 24 HB3 ASN 24 -1.146 2.575 3.587
175 HD21 ASN 24 HD21 ASN 24 -1.161 -0.002 4.495
176 HD22 ASN 24 HD22 ASN 24 -2.259 -0.956 3.569
177 H TRP 25 H TRP 25 2.010 2.807 1.386
178 HA TRP 25 HA TRP 25 2.417 5.186 2.904
179 HB2 TRP 25 HB2 TRP 25 4.123 3.400 2.602
180 HB3 TRP 25 HB3 TRP 25 4.334 3.863 0.891
181 HD1 TRP 25 HD1 TRP 25 5.296 4.966 4.420
182 HE1 TRP 25 HE1 TRP 25 6.927 6.887 4.263
183 HE3 TRP 25 HE3 TRP 25 4.925 5.975 -0.642
184 HZ2 TRP 25 HZ2 TRP 25 7.970 8.593 2.385
185 HZ3 TRP 25 HZ3 TRP 25 6.306 7.872 -1.543
186 HH2 TRP 25 HH2 TRP 25 7.814 9.142 -0.053
187 H LEU 26 H LEU 26 2.118 4.646 -0.732
188 HA LEU 26 HA LEU 26 2.763 7.338 -1.384
189 HB2 LEU 26 HB2 LEU 26 0.725 5.516 -2.799
190 HB3 LEU 26 HB3 LEU 26 1.277 7.077 -3.432
191 HG LEU 26 HG LEU 26 3.131 4.665 -2.943
192 HD11 LEU 26 HD11 LEU 26 1.431 4.168 -4.730
193 HD12 LEU 26 HD12 LEU 26 1.863 5.683 -5.565
194 HD13 LEU 26 HD13 LEU 26 3.056 4.361 -5.431
195 HD21 LEU 26 HD21 LEU 26 4.386 6.867 -2.962
196 HD22 LEU 26 HD22 LEU 26 4.733 5.922 -4.418
197 HD23 LEU 26 HD23 LEU 26 3.596 7.295 -4.502
198 H LEU 27 H LEU 27 -0.568 5.896 -0.755
199 HA LEU 27 HA LEU 27 -1.707 8.506 -1.089
200 HB2 LEU 27 HB2 LEU 27 -3.851 7.612 -0.506
201 HB3 LEU 27 HB3 LEU 27 -2.958 6.430 -1.484
202 HG LEU 27 HG LEU 27 -2.287 5.409 0.897
203 HD11 LEU 27 HD11 LEU 27 -4.896 6.856 1.650
204 HD12 LEU 27 HD12 LEU 27 -4.101 5.588 2.616
205 HD13 LEU 27 HD13 LEU 27 -3.307 7.153 2.398
206 HD21 LEU 27 HD21 LEU 27 -5.103 5.072 -0.291
207 HD22 LEU 27 HD22 LEU 27 -3.633 4.193 -0.803
208 HD23 LEU 27 HD23 LEU 27 -4.310 3.913 0.816
209 H ALA 28 H ALA 28 -0.015 7.145 1.708
210 HA ALA 28 HA ALA 28 -1.380 8.850 3.618
211 HB1 ALA 28 HB1 ALA 28 0.659 8.452 5.049
212 HB2 ALA 28 HB2 ALA 28 -0.037 6.934 4.412
213 HB3 ALA 28 HB3 ALA 28 1.436 7.618 3.676
214 H GLN 29 H GLN 29 1.623 9.140 1.533
215 HA GLN 29 HA GLN 29 2.234 11.814 2.519
216 HB2 GLN 29 HB2 GLN 29 3.256 10.173 0.159
217 HB3 GLN 29 HB3 GLN 29 3.589 11.913 0.250
218 HG2 GLN 29 HG2 GLN 29 5.428 10.464 1.244
219 HG3 GLN 29 HG3 GLN 29 4.831 11.802 2.250
220 HE21 GLN 29 HE21 GLN 29 3.968 8.270 1.695
221 HE22 GLN 29 HE22 GLN 29 3.855 7.917 3.379
222 H LYS 30 H LYS 30 0.196 12.955 2.358
223 HA LYS 30 HA LYS 30 -0.134 14.676 0.386
224 HB2 LYS 30 HB2 LYS 30 -2.102 13.935 -1.051
225 HB3 LYS 30 HB3 LYS 30 -0.543 13.312 -1.510
226 HG2 LYS 30 HG2 LYS 30 -1.205 11.136 -1.267
227 HG3 LYS 30 HG3 LYS 30 -1.723 11.413 0.391
228 HD2 LYS 30 HD2 LYS 30 -3.436 11.948 -2.111
229 HD3 LYS 30 HD3 LYS 30 -3.510 10.492 -1.085
230 HE2 LYS 30 HE2 LYS 30 -5.368 11.881 -0.427
231 HE3 LYS 30 HE3 LYS 30 -4.174 11.935 0.894
232 HZ1 LYS 30 HZ1 LYS 30 -4.608 14.079 -1.228
233 HZ2 LYS 30 HZ2 LYS 30 -5.029 14.194 0.466
234 H GLY 31 H GLY 31 -2.139 12.379 2.446
235 HA2 GLY 31 HA2 GLY 31 -3.161 14.809 3.748
236 HA3 GLY 31 HA3 GLY 31 -4.376 13.846 2.866
237 H LYS 32 H LYS 32 -1.477 12.594 4.777
238 HA LYS 32 HA LYS 32 -3.369 11.032 6.404
239 HB2 LYS 32 HB2 LYS 32 -1.034 10.240 5.698
240 HB3 LYS 32 HB3 LYS 32 -0.376 11.290 6.967
241 HG2 LYS 32 HG2 LYS 32 -2.319 8.901 7.281
242 HG3 LYS 32 HG3 LYS 32 -0.612 8.986 7.781
243 HD2 LYS 32 HD2 LYS 32 -1.309 10.867 9.436
244 HD3 LYS 32 HD3 LYS 32 -3.006 10.467 9.031
245 HE2 LYS 32 HE2 LYS 32 -2.624 8.087 9.764
246 HE3 LYS 32 HE3 LYS 32 -0.966 8.523 10.255
247 HZ1 LYS 32 HZ1 LYS 32 -1.890 10.115 11.906
248 HZ2 LYS 32 HZ2 LYS 32 -3.529 9.675 11.423
249 H LYS 33 H LYS 33 -0.848 13.682 6.936
250 HA LYS 33 HA LYS 33 -1.836 14.270 9.522
251 HB2 LYS 33 HB2 LYS 33 -0.709 16.482 9.383
252 HB3 LYS 33 HB3 LYS 33 0.334 15.070 9.094
253 HG2 LYS 33 HG2 LYS 33 0.928 16.971 7.672
254 HG3 LYS 33 HG3 LYS 33 0.492 15.568 6.685
255 HD2 LYS 33 HD2 LYS 33 -1.703 16.570 6.141
256 HD3 LYS 33 HD3 LYS 33 -1.433 17.910 7.291
257 HE2 LYS 33 HE2 LYS 33 0.236 17.290 4.764
258 HE3 LYS 33 HE3 LYS 33 -0.999 18.577 4.889
259 HZ1 LYS 33 HZ1 LYS 33 1.347 19.416 5.225
260 HZ2 LYS 33 HZ2 LYS 33 0.383 19.640 6.687
261 H ASN 34 H ASN 34 -3.409 14.971 6.415
262 HA ASN 34 HA ASN 34 -5.369 16.573 8.040
263 HB2 ASN 34 HB2 ASN 34 -4.090 17.715 6.022
264 HB3 ASN 34 HB3 ASN 34 -5.152 16.735 4.993
265 HD21 ASN 34 HD21 ASN 34 -7.686 16.819 6.018
266 HD22 ASN 34 HD22 ASN 34 -8.190 18.433 6.328
267 H ASP 35 H ASP 35 -5.339 13.843 8.413
268 HA ASP 35 HA ASP 35 -7.265 12.686 6.475
269 HB2 ASP 35 HB2 ASP 35 -5.581 11.185 7.458
270 HB3 ASP 35 HB3 ASP 35 -6.145 11.547 9.107
271 H TRP 36 H TRP 36 -7.162 13.659 10.026
272 HA TRP 36 HA TRP 36 -10.015 14.490 9.764
273 HB2 TRP 36 HB2 TRP 36 -9.884 12.030 10.436
274 HB3 TRP 36 HB3 TRP 36 -8.968 12.494 11.889
275 HD1 TRP 36 HD1 TRP 36 -12.464 12.726 10.284
276 HE1 TRP 36 HE1 TRP 36 -14.174 13.322 12.033
277 HE3 TRP 36 HE3 TRP 36 -9.325 13.526 14.351
278 HZ2 TRP 36 HZ2 TRP 36 -14.299 14.160 14.630
279 HZ3 TRP 36 HZ3 TRP 36 -10.382 14.367 16.452
280 HH2 TRP 36 HH2 TRP 36 -12.833 14.667 16.597
281 H LYS 37 H LYS 37 -7.908 16.287 9.738
282 HA LYS 37 HA LYS 37 -7.820 17.264 12.600
283 HB2 LYS 37 HB2 LYS 37 -5.752 16.052 11.694
284 HB3 LYS 37 HB3 LYS 37 -5.589 17.364 10.494
285 HG2 LYS 37 HG2 LYS 37 -5.389 19.023 12.439
286 HG3 LYS 37 HG3 LYS 37 -5.475 17.659 13.574
287 HD2 LYS 37 HD2 LYS 37 -3.296 18.087 11.417
288 HD3 LYS 37 HD3 LYS 37 -3.141 18.494 13.143
289 HE2 LYS 37 HE2 LYS 37 -3.477 16.032 13.725
290 HE3 LYS 37 HE3 LYS 37 -3.430 15.647 11.984
291 HZ1 LYS 37 HZ1 LYS 37 -1.165 16.663 11.855
292 HZ2 LYS 37 HZ2 LYS 37 -1.186 16.874 13.602
293 H HIS 38 H HIS 38 -9.894 18.002 10.834
294 HA HIS 38 HA HIS 38 -9.545 20.857 10.894
295 HB2 HIS 38 HB2 HIS 38 -8.115 20.430 8.839
296 HB3 HIS 38 HB3 HIS 38 -9.471 19.542 8.111
297 HD1 HIS 38 HD1 HIS 38 -8.728 21.537 6.365
298 HD2 HIS 38 HD2 HIS 38 -10.995 22.604 9.751
299 HE1 HIS 38 HE1 HIS 38 -9.786 23.772 5.824
300 H ASN 39 H ASN 39 -11.552 20.035 12.159
301 HA ASN 39 HA ASN 39 -13.926 19.889 10.337
302 HB2 ASN 39 HB2 ASN 39 -13.129 17.546 10.629
303 HB3 ASN 39 HB3 ASN 39 -13.048 17.779 12.396
304 HD21 ASN 39 HD21 ASN 39 -14.557 15.822 12.424
305 HD22 ASN 39 HD22 ASN 39 -16.244 16.103 12.198
306 H ILE 40 H ILE 40 -14.150 22.126 11.349
307 HA ILE 40 HA ILE 40 -15.183 23.483 12.922
308 HB ILE 40 HB ILE 40 -16.680 20.902 13.637
309 HG12 ILE 40 HG12 ILE 40 -17.190 22.929 11.370
310 HG13 ILE 40 HG13 ILE 40 -16.660 21.239 11.177
311 HG21 ILE 40 HG21 ILE 40 -18.473 22.425 14.384
312 HG22 ILE 40 HG22 ILE 40 -16.981 22.929 15.190
313 HG23 ILE 40 HG23 ILE 40 -17.574 23.850 13.784
314 HD11 ILE 40 HD11 ILE 40 -19.405 22.178 12.193
315 HD12 ILE 40 HD12 ILE 40 -19.024 21.270 10.709
316 HD13 ILE 40 HD13 ILE 40 -18.834 20.481 12.302
317 H THR 41 H THR 41 -12.983 23.635 13.956
318 HA THR 41 HA THR 41 -11.633 23.580 15.821
319 HB THR 41 HB THR 41 -14.119 22.711 17.386
320 HG1 THR 41 HG1 THR 41 -14.383 25.072 17.519
321 HG21 THR 41 HG21 THR 41 -11.600 24.299 18.224
322 HG22 THR 41 HG22 THR 41 -12.975 23.865 19.276
323 HG23 THR 41 HG23 THR 41 -11.902 22.589 18.644
324 H GLN 42 H GLN 42 -10.790 21.724 14.366
325 HA GLN 42 HA GLN 42 -10.143 19.472 14.157
326 HB2 GLN 42 HB2 GLN 42 -8.652 18.897 16.051
327 HB3 GLN 42 HB3 GLN 42 -8.439 20.581 15.492
328 HG2 GLN 42 HG2 GLN 42 -9.773 21.432 17.418
329 HG3 GLN 42 HG3 GLN 42 -10.065 19.753 17.977
330 HE21 GLN 42 HE21 GLN 42 -9.065 21.168 19.945
331 HE22 GLN 42 HE22 GLN 42 -7.356 20.988 20.113
Start of MODEL 15
1 H1 TYR 1 H1 TYR 1 6.682 -24.853 0.320
2 HA TYR 1 HA TYR 1 6.677 -27.800 0.345
3 HB2 TYR 1 HB2 TYR 1 8.684 -27.992 1.711
4 HB3 TYR 1 HB3 TYR 1 9.114 -26.945 0.338
5 HD1 TYR 1 HD1 TYR 1 9.200 -24.416 0.686
6 HD2 TYR 1 HD2 TYR 1 8.755 -27.139 3.986
7 HE1 TYR 1 HE1 TYR 1 9.652 -22.578 2.257
8 HE2 TYR 1 HE2 TYR 1 9.270 -25.307 5.563
9 HH TYR 1 HH TYR 1 10.065 -21.978 4.532
10 H ALA 2 H ALA 2 6.275 -28.643 2.727
11 HA ALA 2 HA ALA 2 4.666 -28.549 4.442
12 HB1 ALA 2 HB1 ALA 2 6.310 -25.986 4.935
13 HB2 ALA 2 HB2 ALA 2 5.268 -26.804 6.140
14 HB3 ALA 2 HB3 ALA 2 6.716 -27.636 5.498
15 H GLU 3 H GLU 3 3.058 -28.162 2.508
16 HA GLU 3 HA GLU 3 2.190 -25.714 1.694
17 HB2 GLU 3 HB2 GLU 3 1.185 -27.777 0.815
18 HB3 GLU 3 HB3 GLU 3 0.387 -28.115 2.370
19 HG2 GLU 3 HG2 GLU 3 -0.974 -25.980 2.120
20 HG3 GLU 3 HG3 GLU 3 -0.168 -25.679 0.556
21 H GLY 4 H GLY 4 0.757 -27.405 4.655
22 HA2 GLY 4 HA2 GLY 4 -0.206 -26.438 6.554
23 HA3 GLY 4 HA3 GLY 4 0.961 -25.133 6.273
24 H THR 5 H THR 5 -2.479 -26.177 5.616
25 HA THR 5 HA THR 5 -3.220 -24.242 3.841
26 HB THR 5 HB THR 5 -4.829 -24.934 6.373
27 HG1 THR 5 HG1 THR 5 -4.720 -26.317 3.861
28 HG21 THR 5 HG21 THR 5 -5.853 -23.024 5.118
29 HG22 THR 5 HG22 THR 5 -5.713 -23.929 3.581
30 HG23 THR 5 HG23 THR 5 -6.822 -24.502 4.859
31 H PHE 6 H PHE 6 -2.702 -23.690 7.430
32 HA PHE 6 HA PHE 6 -3.486 -20.940 7.314
33 HB2 PHE 6 HB2 PHE 6 -3.184 -22.041 9.509
34 HB3 PHE 6 HB3 PHE 6 -1.454 -22.292 9.186
35 HD1 PHE 6 HD1 PHE 6 -4.054 -19.719 9.933
36 HD2 PHE 6 HD2 PHE 6 0.134 -20.374 9.172
37 HE1 PHE 6 HE1 PHE 6 -3.533 -17.472 10.832
38 HE2 PHE 6 HE2 PHE 6 0.639 -18.105 10.007
39 HZ PHE 6 HZ PHE 6 -1.180 -16.681 10.926
40 H ILE 7 H ILE 7 -0.207 -22.577 6.908
41 HA ILE 7 HA ILE 7 1.202 -20.124 6.635
42 HB ILE 7 HB ILE 7 1.852 -22.823 5.337
43 HG12 ILE 7 HG12 ILE 7 3.138 -21.426 7.764
44 HG13 ILE 7 HG13 ILE 7 1.932 -22.727 7.873
45 HG21 ILE 7 HG21 ILE 7 3.629 -20.314 5.493
46 HG22 ILE 7 HG22 ILE 7 4.100 -21.890 4.792
47 HG23 ILE 7 HG23 ILE 7 2.863 -20.920 3.999
48 HD11 ILE 7 HD11 ILE 7 4.108 -23.738 8.188
49 HD12 ILE 7 HD12 ILE 7 3.507 -24.270 6.592
50 HD13 ILE 7 HD13 ILE 7 4.774 -23.014 6.715
51 H SER 8 H SER 8 -0.204 -22.316 4.012
52 HA SER 8 HA SER 8 0.343 -20.642 1.887
53 HB2 SER 8 HB2 SER 8 -2.240 -22.266 2.317
54 HB3 SER 8 HB3 SER 8 -1.646 -21.668 0.744
55 HG SER 8 HG SER 8 0.247 -23.078 1.123
56 H ASP 9 H ASP 9 -2.525 -20.429 4.168
57 HA ASP 9 HA ASP 9 -3.803 -18.311 2.794
58 HB2 ASP 9 HB2 ASP 9 -4.922 -19.508 4.657
59 HB3 ASP 9 HB3 ASP 9 -3.767 -18.838 5.830
60 H TYR 10 H TYR 10 -1.324 -18.143 5.522
61 HA TYR 10 HA TYR 10 -1.293 -15.296 5.481
62 HB2 TYR 10 HB2 TYR 10 -0.309 -16.551 7.399
63 HB3 TYR 10 HB3 TYR 10 0.945 -17.231 6.335
64 HD1 TYR 10 HD1 TYR 10 -0.538 -13.937 7.462
65 HD2 TYR 10 HD2 TYR 10 2.993 -15.948 6.028
66 HE1 TYR 10 HE1 TYR 10 0.750 -11.834 7.647
67 HE2 TYR 10 HE2 TYR 10 4.313 -13.914 6.431
68 HH TYR 10 HH TYR 10 4.219 -11.565 6.928
69 H SER 11 H SER 11 0.801 -17.751 3.738
70 HA SER 11 HA SER 11 2.632 -16.015 2.612
71 HB2 SER 11 HB2 SER 11 2.739 -18.483 2.214
72 HB3 SER 11 HB3 SER 11 1.289 -18.389 1.181
73 HG SER 11 HG SER 11 3.746 -17.028 0.578
74 H ILE 12 H ILE 12 -0.711 -16.869 1.449
75 HA ILE 12 HA ILE 12 -0.567 -15.224 -0.901
76 HB ILE 12 HB ILE 12 -2.955 -16.239 0.734
77 HG12 ILE 12 HG12 ILE 12 -2.073 -17.119 -2.080
78 HG13 ILE 12 HG13 ILE 12 -1.363 -17.866 -0.640
79 HG21 ILE 12 HG21 ILE 12 -2.965 -14.713 -1.944
80 HG22 ILE 12 HG22 ILE 12 -4.386 -15.542 -1.254
81 HG23 ILE 12 HG23 ILE 12 -3.677 -14.166 -0.397
82 HD11 ILE 12 HD11 ILE 12 -3.248 -19.239 -1.471
83 HD12 ILE 12 HD12 ILE 12 -3.582 -18.623 0.172
84 HD13 ILE 12 HD13 ILE 12 -4.386 -17.890 -1.244
85 H ALA 13 H ALA 13 -1.836 -14.607 2.507
86 HA ALA 13 HA ALA 13 -2.754 -12.029 1.933
87 HB1 ALA 13 HB1 ALA 13 -2.565 -11.469 4.321
88 HB2 ALA 13 HB2 ALA 13 -3.217 -13.122 4.140
89 HB3 ALA 13 HB3 ALA 13 -1.519 -12.879 4.631
90 H MET 14 H MET 14 0.562 -12.853 3.400
91 HA MET 14 HA MET 14 1.318 -10.155 3.354
92 HB2 MET 14 HB2 MET 14 3.620 -10.774 3.639
93 HB3 MET 14 HB3 MET 14 2.601 -11.854 4.624
94 HG2 MET 14 HG2 MET 14 2.907 -13.697 2.982
95 HG3 MET 14 HG3 MET 14 3.788 -12.599 1.866
96 HE1 MET 14 HE1 MET 14 5.338 -15.434 2.953
97 HE2 MET 14 HE2 MET 14 5.574 -14.268 1.610
98 HE3 MET 14 HE3 MET 14 6.884 -14.537 2.801
99 H ASP 15 H ASP 15 1.493 -12.680 0.736
100 HA ASP 15 HA ASP 15 3.308 -11.216 -0.881
101 HB2 ASP 15 HB2 ASP 15 2.872 -13.572 -1.365
102 HB3 ASP 15 HB3 ASP 15 1.158 -13.260 -1.718
103 H LYS 16 H LYS 16 -0.353 -11.448 -1.187
104 HA LYS 16 HA LYS 16 -0.622 -9.431 -3.119
105 HB2 LYS 16 HB2 LYS 16 -2.542 -10.825 -2.262
106 HB3 LYS 16 HB3 LYS 16 -2.421 -9.998 -0.690
107 HG2 LYS 16 HG2 LYS 16 -2.948 -7.774 -1.934
108 HG3 LYS 16 HG3 LYS 16 -3.149 -8.744 -3.410
109 HD2 LYS 16 HD2 LYS 16 -5.348 -8.277 -2.470
110 HD3 LYS 16 HD3 LYS 16 -5.033 -10.018 -2.249
111 HE2 LYS 16 HE2 LYS 16 -6.100 -8.891 -0.235
112 HE3 LYS 16 HE3 LYS 16 -4.549 -9.654 0.172
113 HZ1 LYS 16 HZ1 LYS 16 -4.902 -6.686 -0.414
114 HZ2 LYS 16 HZ2 LYS 16 -4.667 -7.425 1.166
115 H ILE 17 H ILE 17 -0.414 -9.166 0.512
116 HA ILE 17 HA ILE 17 -1.100 -6.406 0.510
117 HB ILE 17 HB ILE 17 0.268 -8.158 2.598
118 HG12 ILE 17 HG12 ILE 17 -2.519 -6.823 2.541
119 HG13 ILE 17 HG13 ILE 17 -2.224 -8.474 1.960
120 HG21 ILE 17 HG21 ILE 17 1.137 -5.897 3.011
121 HG22 ILE 17 HG22 ILE 17 -0.512 -5.204 2.913
122 HG23 ILE 17 HG23 ILE 17 -0.046 -6.280 4.260
123 HD11 ILE 17 HD11 ILE 17 -3.101 -8.685 4.193
124 HD12 ILE 17 HD12 ILE 17 -1.363 -9.086 4.304
125 HD13 ILE 17 HD13 ILE 17 -1.966 -7.497 4.867
126 H HIS 18 H HIS 18 2.157 -8.019 0.191
127 HA HIS 18 HA HIS 18 3.719 -5.891 0.965
128 HB2 HIS 18 HB2 HIS 18 4.585 -8.105 0.068
129 HB3 HIS 18 HB3 HIS 18 4.317 -7.517 -1.588
130 HD1 HIS 18 HD1 HIS 18 5.595 -4.879 -1.766
131 HD2 HIS 18 HD2 HIS 18 7.063 -7.861 0.815
132 HE1 HIS 18 HE1 HIS 18 7.995 -4.262 -1.300
133 H GLN 19 H GLN 19 2.203 -6.332 -2.350
134 HA GLN 19 HA GLN 19 3.348 -3.902 -3.346
135 HB2 GLN 19 HB2 GLN 19 0.795 -5.364 -4.264
136 HB3 GLN 19 HB3 GLN 19 1.553 -3.981 -5.105
137 HG2 GLN 19 HG2 GLN 19 3.683 -5.323 -5.371
138 HG3 GLN 19 HG3 GLN 19 2.866 -6.741 -4.656
139 HE21 GLN 19 HE21 GLN 19 3.812 -7.354 -7.056
140 HE22 GLN 19 HE22 GLN 19 2.616 -7.246 -8.294
141 H GLN 20 H GLN 20 0.074 -4.598 -1.831
142 HA GLN 20 HA GLN 20 -0.796 -1.919 -2.114
143 HB2 GLN 20 HB2 GLN 20 -2.354 -3.732 -1.506
144 HB3 GLN 20 HB3 GLN 20 -1.537 -3.967 0.059
145 HG2 GLN 20 HG2 GLN 20 -3.709 -2.591 0.177
146 HG3 GLN 20 HG3 GLN 20 -2.281 -1.845 0.923
147 HE21 GLN 20 HE21 GLN 20 -3.766 -1.943 -2.471
148 HE22 GLN 20 HE22 GLN 20 -3.586 -0.245 -2.704
149 H ASP 21 H ASP 21 1.325 -3.435 0.434
150 HA ASP 21 HA ASP 21 1.035 -1.294 2.273
151 HB2 ASP 21 HB2 ASP 21 2.030 -3.485 2.911
152 HB3 ASP 21 HB3 ASP 21 3.465 -3.151 1.907
153 H PHE 22 H PHE 22 3.426 -1.846 -0.471
154 HA PHE 22 HA PHE 22 4.884 0.548 0.035
155 HB2 PHE 22 HB2 PHE 22 5.750 -1.027 -1.632
156 HB3 PHE 22 HB3 PHE 22 4.268 -0.900 -2.604
157 HD1 PHE 22 HD2 PHE 22 7.075 1.239 -1.222
158 HD2 PHE 22 HD1 PHE 22 4.168 0.733 -4.361
159 HE1 PHE 22 HE2 PHE 22 8.000 3.205 -2.403
160 HE2 PHE 22 HE1 PHE 22 5.117 2.679 -5.549
161 HZ PHE 22 HZ PHE 22 7.032 3.925 -4.574
162 H VAL 23 H VAL 23 1.755 -0.014 -1.759
163 HA VAL 23 HA VAL 23 1.613 2.721 -2.656
164 HB VAL 23 HB VAL 23 -0.610 0.647 -2.286
165 HG11 VAL 23 HG11 VAL 23 -1.628 2.906 -2.166
166 HG12 VAL 23 HG12 VAL 23 -0.726 3.429 -3.617
167 HG13 VAL 23 HG13 VAL 23 -1.998 2.178 -3.741
168 HG21 VAL 23 HG21 VAL 23 -0.472 0.444 -4.766
169 HG22 VAL 23 HG22 VAL 23 0.804 1.693 -4.829
170 HG23 VAL 23 HG23 VAL 23 1.134 0.111 -4.076
171 H ASN 24 H ASN 24 0.599 1.090 0.459
172 HA ASN 24 HA ASN 24 -1.027 3.087 1.443
173 HB2 ASN 24 HB2 ASN 24 1.153 1.688 3.095
174 HB3 ASN 24 HB3 ASN 24 -0.236 2.597 3.736
175 HD21 ASN 24 HD21 ASN 24 -0.137 0.130 4.737
176 HD22 ASN 24 HD22 ASN 24 -1.270 -0.915 3.966
177 H TRP 25 H TRP 25 2.625 3.176 1.137
178 HA TRP 25 HA TRP 25 2.846 5.510 2.782
179 HB2 TRP 25 HB2 TRP 25 4.820 4.098 2.261
180 HB3 TRP 25 HB3 TRP 25 4.777 4.616 0.551
181 HD1 TRP 25 HD1 TRP 25 5.681 5.839 4.053
182 HE1 TRP 25 HE1 TRP 25 6.735 8.130 3.965
183 HE3 TRP 25 HE3 TRP 25 4.953 6.949 -0.945
184 HZ2 TRP 25 HZ2 TRP 25 7.182 10.162 2.170
185 HZ3 TRP 25 HZ3 TRP 25 5.646 9.203 -1.754
186 HH2 TRP 25 HH2 TRP 25 6.760 10.788 -0.215
187 H LEU 26 H LEU 26 2.388 5.032 -0.818
188 HA LEU 26 HA LEU 26 2.722 7.821 -1.435
189 HB2 LEU 26 HB2 LEU 26 1.142 5.620 -2.900
190 HB3 LEU 26 HB3 LEU 26 1.104 7.330 -3.386
191 HG LEU 26 HG LEU 26 3.578 7.339 -3.706
192 HD11 LEU 26 HD11 LEU 26 3.402 4.262 -3.404
193 HD12 LEU 26 HD12 LEU 26 4.831 5.205 -3.915
194 HD13 LEU 26 HD13 LEU 26 4.248 5.303 -2.252
195 HD21 LEU 26 HD21 LEU 26 1.995 6.932 -5.638
196 HD22 LEU 26 HD22 LEU 26 3.535 6.060 -5.854
197 HD23 LEU 26 HD23 LEU 26 2.076 5.176 -5.316
198 H LEU 27 H LEU 27 -0.361 5.866 -0.907
199 HA LEU 27 HA LEU 27 -1.894 8.218 -1.167
200 HB2 LEU 27 HB2 LEU 27 -3.830 7.021 -0.465
201 HB3 LEU 27 HB3 LEU 27 -2.786 5.893 -1.337
202 HG LEU 27 HG LEU 27 -1.908 5.270 1.111
203 HD11 LEU 27 HD11 LEU 27 -3.267 7.116 2.325
204 HD12 LEU 27 HD12 LEU 27 -4.745 6.295 1.783
205 HD13 LEU 27 HD13 LEU 27 -3.618 5.477 2.903
206 HD21 LEU 27 HD21 LEU 27 -4.671 4.360 0.121
207 HD22 LEU 27 HD22 LEU 27 -3.096 3.649 -0.343
208 HD23 LEU 27 HD23 LEU 27 -3.673 3.503 1.333
209 H ALA 28 H ALA 28 -0.171 6.867 1.752
210 HA ALA 28 HA ALA 28 -1.487 8.401 3.677
211 HB1 ALA 28 HB1 ALA 28 0.620 8.356 5.014
212 HB2 ALA 28 HB2 ALA 28 0.288 6.756 4.290
213 HB3 ALA 28 HB3 ALA 28 1.536 7.822 3.575
214 H GLN 29 H GLN 29 1.020 9.482 1.270
215 HA GLN 29 HA GLN 29 1.637 11.954 2.429
216 HB2 GLN 29 HB2 GLN 29 1.170 11.465 -0.579
217 HB3 GLN 29 HB3 GLN 29 1.996 12.872 0.131
218 HG2 GLN 29 HG2 GLN 29 3.035 9.962 0.167
219 HG3 GLN 29 HG3 GLN 29 3.669 11.327 -0.750
220 HE21 GLN 29 HE21 GLN 29 3.437 9.889 2.565
221 HE22 GLN 29 HE22 GLN 29 4.630 10.933 3.244
222 H LYS 30 H LYS 30 -1.414 11.021 0.682
223 HA LYS 30 HA LYS 30 -2.297 13.585 0.155
224 HB2 LYS 30 HB2 LYS 30 -4.525 12.767 -0.077
225 HB3 LYS 30 HB3 LYS 30 -3.457 11.418 -0.528
226 HG2 LYS 30 HG2 LYS 30 -3.763 10.748 2.083
227 HG3 LYS 30 HG3 LYS 30 -5.176 11.811 1.997
228 HD2 LYS 30 HD2 LYS 30 -4.620 9.312 0.268
229 HD3 LYS 30 HD3 LYS 30 -5.773 9.422 1.621
230 HE2 LYS 30 HE2 LYS 30 -7.144 11.100 0.315
231 HE3 LYS 30 HE3 LYS 30 -6.010 10.950 -1.055
232 HZ1 LYS 30 HZ1 LYS 30 -6.555 8.549 -1.237
233 HZ2 LYS 30 HZ2 LYS 30 -7.713 8.709 0.084
234 H GLY 31 H GLY 31 -2.101 12.046 3.414
235 HA2 GLY 31 HA2 GLY 31 -4.090 13.482 4.740
236 HA3 GLY 31 HA3 GLY 31 -2.541 13.017 5.488
237 H LYS 32 H LYS 32 -0.545 14.468 4.586
238 HA LYS 32 HA LYS 32 -1.317 17.251 5.214
239 HB2 LYS 32 HB2 LYS 32 1.389 15.990 4.491
240 HB3 LYS 32 HB3 LYS 32 1.123 17.747 4.470
241 HG2 LYS 32 HG2 LYS 32 2.125 17.104 6.576
242 HG3 LYS 32 HG3 LYS 32 0.500 17.777 6.855
243 HD2 LYS 32 HD2 LYS 32 -0.434 15.463 7.111
244 HD3 LYS 32 HD3 LYS 32 1.181 14.762 6.808
245 HE2 LYS 32 HE2 LYS 32 0.446 16.598 9.190
246 HE3 LYS 32 HE3 LYS 32 0.520 14.815 9.231
247 HZ1 LYS 32 HZ1 LYS 32 2.906 16.650 8.769
248 HZ2 LYS 32 HZ2 LYS 32 2.587 15.615 10.125
249 H LYS 33 H LYS 33 0.224 15.523 2.364
250 HA LYS 33 HA LYS 33 0.357 16.182 0.181
251 HB2 LYS 33 HB2 LYS 33 -2.228 15.954 0.521
252 HB3 LYS 33 HB3 LYS 33 -2.286 17.726 0.524
253 HG2 LYS 33 HG2 LYS 33 -1.125 17.719 -1.746
254 HG3 LYS 33 HG3 LYS 33 -1.125 15.933 -1.710
255 HD2 LYS 33 HD2 LYS 33 -3.624 15.901 -1.616
256 HD3 LYS 33 HD3 LYS 33 -3.652 17.687 -1.659
257 HE2 LYS 33 HE2 LYS 33 -2.443 17.634 -3.882
258 HE3 LYS 33 HE3 LYS 33 -2.539 15.845 -3.874
259 HZ1 LYS 33 HZ1 LYS 33 -4.407 17.015 -5.146
260 HZ2 LYS 33 HZ2 LYS 33 -4.985 15.973 -3.846
261 H ASN 34 H ASN 34 1.994 17.570 1.860
262 HA ASN 34 HA ASN 34 2.175 20.063 0.374
263 HB2 ASN 34 HB2 ASN 34 1.801 20.304 3.423
264 HB3 ASN 34 HB3 ASN 34 2.291 21.606 2.320
265 HD21 ASN 34 HD21 ASN 34 -0.501 19.733 3.509
266 HD22 ASN 34 HD22 ASN 34 -1.673 20.619 2.615
267 H ASP 35 H ASP 35 3.473 18.563 3.506
268 HA ASP 35 HA ASP 35 5.733 19.852 3.839
269 HB2 ASP 35 HB2 ASP 35 5.252 17.787 5.117
270 HB3 ASP 35 HB3 ASP 35 5.591 16.777 3.691
271 H TRP 36 H TRP 36 5.478 17.313 1.240
272 HA TRP 36 HA TRP 36 7.221 19.002 -0.440
273 HB2 TRP 36 HB2 TRP 36 8.899 17.755 0.879
274 HB3 TRP 36 HB3 TRP 36 8.072 16.207 0.564
275 HD1 TRP 36 HD1 TRP 36 9.929 19.025 -1.344
276 HE1 TRP 36 HE1 TRP 36 10.964 18.056 -3.452
277 HE3 TRP 36 HE3 TRP 36 8.092 14.204 -1.038
278 HZ2 TRP 36 HZ2 TRP 36 11.049 15.668 -4.828
279 HZ3 TRP 36 HZ3 TRP 36 8.756 12.592 -2.835
280 HH2 TRP 36 HH2 TRP 36 10.159 13.337 -4.733
281 H LYS 37 H LYS 37 4.691 18.879 -0.936
282 HA LYS 37 HA LYS 37 4.454 16.820 -3.109
283 HB2 LYS 37 HB2 LYS 37 3.212 16.311 -0.829
284 HB3 LYS 37 HB3 LYS 37 2.097 17.604 -1.312
285 HG2 LYS 37 HG2 LYS 37 2.762 15.009 -2.873
286 HG3 LYS 37 HG3 LYS 37 1.256 15.363 -2.008
287 HD2 LYS 37 HD2 LYS 37 0.821 17.294 -3.618
288 HD3 LYS 37 HD3 LYS 37 2.274 16.801 -4.546
289 HE2 LYS 37 HE2 LYS 37 1.239 14.525 -4.919
290 HE3 LYS 37 HE3 LYS 37 -0.221 15.068 -4.059
291 HZ1 LYS 37 HZ1 LYS 37 -0.481 16.883 -5.786
292 HZ2 LYS 37 HZ2 LYS 37 0.864 16.163 -6.673
293 H HIS 38 H HIS 38 5.399 18.800 -4.224
294 HA HIS 38 HA HIS 38 5.101 20.774 -5.442
295 HB2 HIS 38 HB2 HIS 38 2.220 19.723 -5.571
296 HB3 HIS 38 HB3 HIS 38 2.941 20.930 -6.666
297 HD1 HIS 38 HD1 HIS 38 1.761 18.341 -7.707
298 HD2 HIS 38 HD2 HIS 38 5.829 18.903 -6.806
299 HE1 HIS 38 HE1 HIS 38 3.018 16.634 -9.088
300 H ASN 39 H ASN 39 5.397 21.300 -2.834
301 HA ASN 39 HA ASN 39 3.373 23.499 -2.384
302 HB2 ASN 39 HB2 ASN 39 4.213 23.606 -0.093
303 HB3 ASN 39 HB3 ASN 39 3.632 21.959 -0.452
304 HD21 ASN 39 HD21 ASN 39 5.507 22.530 1.724
305 HD22 ASN 39 HD22 ASN 39 7.006 21.784 1.304
306 H ILE 40 H ILE 40 4.970 23.865 -4.587
307 HA ILE 40 HA ILE 40 6.740 25.057 -5.455
308 HB ILE 40 HB ILE 40 6.368 26.864 -3.009
309 HG12 ILE 40 HG12 ILE 40 4.549 26.606 -5.484
310 HG13 ILE 40 HG13 ILE 40 4.112 26.253 -3.793
311 HG21 ILE 40 HG21 ILE 40 6.964 27.548 -5.962
312 HG22 ILE 40 HG22 ILE 40 6.981 28.682 -4.581
313 HG23 ILE 40 HG23 ILE 40 8.224 27.435 -4.712
314 HD11 ILE 40 HD11 ILE 40 4.485 28.696 -3.207
315 HD12 ILE 40 HD12 ILE 40 4.668 29.038 -4.958
316 HD13 ILE 40 HD13 ILE 40 3.138 28.385 -4.339
317 H THR 41 H THR 41 7.603 22.737 -4.153
318 HA THR 41 HA THR 41 10.326 23.642 -3.574
319 HB THR 41 HB THR 41 8.944 21.932 -1.418
320 HG1 THR 41 HG1 THR 41 8.090 24.112 -1.219
321 HG21 THR 41 HG21 THR 41 11.468 21.722 -1.614
322 HG22 THR 41 HG22 THR 41 11.604 23.491 -1.399
323 HG23 THR 41 HG23 THR 41 10.948 22.480 -0.083
324 H GLN 42 H GLN 42 9.985 22.397 -5.849
325 HA GLN 42 HA GLN 42 11.014 19.700 -5.334
326 HB2 GLN 42 HB2 GLN 42 8.474 19.465 -5.098
327 HB3 GLN 42 HB3 GLN 42 8.298 20.023 -6.777
328 HG2 GLN 42 HG2 GLN 42 9.596 18.062 -7.598
329 HG3 GLN 42 HG3 GLN 42 9.934 17.543 -5.931
330 HE21 GLN 42 HE21 GLN 42 7.766 17.202 -4.489
331 HE22 GLN 42 HE22 GLN 42 6.526 16.352 -5.333