NMR Restraints Grid
| |
NMR Restraints Grid |
|
Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
623967 |
5uzl   |
30256 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ASN 1 H ASN 1 1.808 0.001 0.855
2 HA ASN 1 HA ASN 1 1.688 0.769 -1.881
3 HB2 ASN 1 HB2 ASN 1 3.625 1.089 -0.215
4 HB3 ASN 1 HB3 ASN 1 4.049 -0.580 -0.585
5 HD21 ASN 1 HD21 ASN 1 4.851 2.448 -1.276
6 HD22 ASN 1 HD22 ASN 1 5.399 2.276 -2.905
7 H VAL 2 H VAL 2 1.690 -2.278 -0.207
8 HA VAL 2 HA VAL 2 2.247 -3.806 -2.612
9 HB VAL 2 HB VAL 2 1.409 -4.822 0.106
10 HG11 VAL 2 HG11 VAL 2 2.853 -6.803 -0.948
11 HG12 VAL 2 HG12 VAL 2 1.111 -6.660 -1.192
12 HG13 VAL 2 HG13 VAL 2 2.227 -6.098 -2.437
13 HG21 VAL 2 HG21 VAL 2 3.405 -4.080 0.789
14 HG22 VAL 2 HG22 VAL 2 4.082 -5.384 -0.186
15 HG23 VAL 2 HG23 VAL 2 3.948 -3.760 -0.859
16 H ASP 3 H ASP 3 0.376 -2.907 -3.769
17 HA ASP 3 HA ASP 3 -2.189 -4.076 -2.940
18 HB2 ASP 3 HB2 ASP 3 -1.605 -1.898 -4.958
19 HB3 ASP 3 HB3 ASP 3 -3.209 -2.498 -4.546
20 H VAL 4 H VAL 4 -1.488 -6.194 -3.661
21 HA VAL 4 HA VAL 4 -1.537 -6.485 -6.594
22 HB VAL 4 HB VAL 4 -0.448 -8.714 -6.191
23 HG11 VAL 4 HG11 VAL 4 1.808 -7.721 -5.708
24 HG12 VAL 4 HG12 VAL 4 0.902 -6.926 -6.997
25 HG13 VAL 4 HG13 VAL 4 0.990 -6.189 -5.397
26 HG21 VAL 4 HG21 VAL 4 0.099 -7.616 -3.438
27 HG22 VAL 4 HG22 VAL 4 -1.119 -8.843 -3.786
28 HG23 VAL 4 HG23 VAL 4 0.585 -9.183 -4.084
29 H ARG 5 H ARG 5 -3.882 -6.249 -4.932
30 HA ARG 5 HA ARG 5 -4.984 -8.972 -5.064
31 HB2 ARG 5 HB2 ARG 5 -5.895 -6.534 -3.532
32 HB3 ARG 5 HB3 ARG 5 -6.819 -8.027 -3.629
33 HG2 ARG 5 HG2 ARG 5 -5.739 -8.396 -1.671
34 HG3 ARG 5 HG3 ARG 5 -4.537 -9.062 -2.778
35 HD2 ARG 5 HD2 ARG 5 -3.434 -7.637 -1.183
36 HD3 ARG 5 HD3 ARG 5 -3.383 -6.872 -2.770
37 HE ARG 5 HE ARG 5 -4.628 -5.150 -1.932
38 HH11 ARG 5 HH11 ARG 5 -4.902 -7.884 0.205
39 HH12 ARG 5 HH12 ARG 5 -5.773 -7.011 1.422
40 HH21 ARG 5 HH21 ARG 5 -5.775 -3.990 -0.338
41 HH22 ARG 5 HH22 ARG 5 -6.270 -4.797 1.112
42 H TYR 6 H TYR 6 -5.990 -9.360 -6.922
43 HA TYR 6 HA TYR 6 -8.050 -7.525 -7.831
44 HB2 TYR 6 HB2 TYR 6 -7.207 -7.511 -10.156
45 HB3 TYR 6 HB3 TYR 6 -6.102 -6.713 -9.042
46 HD1 TYR 6 HD1 TYR 6 -3.945 -7.708 -8.499
47 HD2 TYR 6 HD2 TYR 6 -6.603 -9.597 -11.232
48 HE1 TYR 6 HE1 TYR 6 -2.111 -9.151 -9.276
49 HE2 TYR 6 HE2 TYR 6 -4.777 -11.046 -12.015
50 HH TYR 6 HH TYR 6 -1.567 -10.451 -11.401
51 H THR 7 H THR 7 -7.933 -10.212 -6.687
52 HA THR 7 HA THR 7 -9.210 -11.687 -8.897
53 HB THR 7 HB THR 7 -8.441 -13.646 -7.108
54 HG1 THR 7 HG1 THR 7 -6.559 -13.119 -6.262
55 HG21 THR 7 HG21 THR 7 -6.610 -14.066 -8.859
56 HG22 THR 7 HG22 THR 7 -7.254 -12.645 -9.681
57 HG23 THR 7 HG23 THR 7 -8.284 -14.052 -9.413
58 H TYR 8 H TYR 8 -10.070 -9.940 -6.469
59 HA TYR 8 HA TYR 8 -12.523 -11.240 -5.999
60 HB2 TYR 8 HB2 TYR 8 -12.306 -11.866 -3.670
61 HB3 TYR 8 HB3 TYR 8 -11.083 -12.713 -4.610
62 HD1 TYR 8 HD1 TYR 8 -11.670 -10.792 -1.722
63 HD2 TYR 8 HD2 TYR 8 -8.740 -11.515 -4.721
64 HE1 TYR 8 HE1 TYR 8 -9.926 -9.928 -0.218
65 HE2 TYR 8 HE2 TYR 8 -6.988 -10.653 -3.226
66 HH TYR 8 HH TYR 8 -7.392 -10.241 0.035
67 H ARG 9 H ARG 9 -13.328 -10.207 -3.618
68 HA ARG 9 HA ARG 9 -12.991 -7.313 -4.041
69 HB2 ARG 9 HB2 ARG 9 -15.275 -8.231 -4.414
70 HB3 ARG 9 HB3 ARG 9 -15.305 -8.755 -2.736
71 HG2 ARG 9 HG2 ARG 9 -14.865 -6.287 -2.173
72 HG3 ARG 9 HG3 ARG 9 -15.360 -5.974 -3.838
73 HD2 ARG 9 HD2 ARG 9 -17.528 -6.646 -3.463
74 HD3 ARG 9 HD3 ARG 9 -17.082 -7.690 -2.114
75 HE ARG 9 HE ARG 9 -16.536 -5.223 -1.170
76 HH11 ARG 9 HH11 ARG 9 -19.341 -6.617 -2.689
77 HH12 ARG 9 HH12 ARG 9 -20.463 -5.596 -1.853
78 HH21 ARG 9 HH21 ARG 9 -18.004 -3.872 -0.063
79 HH22 ARG 9 HH22 ARG 9 -19.701 -4.034 -0.360
80 HA PRO 10 HA PRO 10 -10.988 -8.097 0.026
81 HB2 PRO 10 HB2 PRO 10 -9.108 -6.164 -0.292
82 HB3 PRO 10 HB3 PRO 10 -8.920 -7.802 -0.930
83 HG2 PRO 10 HG2 PRO 10 -9.783 -5.306 -2.341
84 HG3 PRO 10 HG3 PRO 10 -8.668 -6.572 -2.888
85 HD2 PRO 10 HD2 PRO 10 -11.243 -6.442 -3.714
86 HD3 PRO 10 HD3 PRO 10 -10.379 -7.981 -3.521
87 H SER 11 H SER 11 -11.940 -7.215 1.742
88 HA SER 11 HA SER 11 -13.517 -4.915 1.700
89 HB2 SER 11 HB2 SER 11 -12.383 -6.655 3.835
90 HB3 SER 11 HB3 SER 11 -13.014 -5.081 4.318
91 HG SER 11 HG SER 11 -14.437 -7.155 4.062
92 H VAL 12 H VAL 12 -10.561 -5.209 3.661
93 HA VAL 12 HA VAL 12 -9.664 -2.598 2.703
94 HB VAL 12 HB VAL 12 -9.162 -1.929 5.098
95 HG11 VAL 12 HG11 VAL 12 -11.073 -1.109 3.603
96 HG12 VAL 12 HG12 VAL 12 -12.112 -2.143 4.587
97 HG13 VAL 12 HG13 VAL 12 -11.210 -0.826 5.338
98 HG21 VAL 12 HG21 VAL 12 -11.139 -4.138 5.654
99 HG22 VAL 12 HG22 VAL 12 -9.452 -4.081 6.166
100 HG23 VAL 12 HG23 VAL 12 -10.614 -2.931 6.827
101 HA PRO 13 HA PRO 13 -5.663 -4.394 2.922
102 HB2 PRO 13 HB2 PRO 13 -4.134 -2.205 3.413
103 HB3 PRO 13 HB3 PRO 13 -4.893 -2.514 1.848
104 HG2 PRO 13 HG2 PRO 13 -5.792 -0.718 4.067
105 HG3 PRO 13 HG3 PRO 13 -5.777 -0.416 2.320
106 HD2 PRO 13 HD2 PRO 13 -8.023 -1.125 3.657
107 HD3 PRO 13 HD3 PRO 13 -7.725 -1.598 1.972
108 H ALA 14 H ALA 14 -4.761 -5.571 4.481
109 HA ALA 14 HA ALA 14 -5.248 -5.232 7.210
110 HB1 ALA 14 HB1 ALA 14 -4.629 -7.379 6.291
111 HB2 ALA 14 HB2 ALA 14 -3.036 -6.763 5.848
112 HB3 ALA 14 HB3 ALA 14 -3.481 -6.918 7.548
113 H HIS 15 H HIS 15 -2.714 -3.974 5.163
114 HA HIS 15 HA HIS 15 -1.975 -1.992 7.039
115 HB2 HIS 15 HB2 HIS 15 0.424 -2.790 7.318
116 HB3 HIS 15 HB3 HIS 15 -0.795 -3.659 8.246
117 HD1 HIS 15 HD1 HIS 15 -1.386 -6.084 7.432
118 HD2 HIS 15 HD2 HIS 15 1.808 -4.303 5.461
119 HE1 HIS 15 HE1 HIS 15 -0.220 -7.952 6.218
120 H ARG 16 H ARG 16 -0.944 -0.339 6.038
121 HA ARG 16 HA ARG 16 0.253 -0.845 3.403
122 HB2 ARG 16 HB2 ARG 16 -0.810 1.221 2.547
123 HB3 ARG 16 HB3 ARG 16 -1.981 -0.022 2.966
124 HG2 ARG 16 HG2 ARG 16 -2.563 1.114 4.988
125 HG3 ARG 16 HG3 ARG 16 -1.256 2.278 4.764
126 HD2 ARG 16 HD2 ARG 16 -2.345 3.357 3.023
127 HD3 ARG 16 HD3 ARG 16 -3.370 1.966 2.672
128 HE ARG 16 HE ARG 16 -3.924 2.974 5.256
129 HH11 ARG 16 HH11 ARG 16 -4.397 3.681 1.881
130 HH12 ARG 16 HH12 ARG 16 -5.858 4.577 2.139
131 HH21 ARG 16 HH21 ARG 16 -5.846 4.151 5.609
132 HH22 ARG 16 HH22 ARG 16 -6.680 4.845 4.260
133 H ARG 17 H ARG 17 1.635 -0.539 5.820
134 HA ARG 17 HA ARG 17 3.243 1.784 5.173
135 HB2 ARG 17 HB2 ARG 17 1.532 1.615 7.584
136 HB3 ARG 17 HB3 ARG 17 3.179 2.175 7.843
137 HG2 ARG 17 HG2 ARG 17 1.294 3.376 5.828
138 HG3 ARG 17 HG3 ARG 17 1.511 3.983 7.471
139 HD2 ARG 17 HD2 ARG 17 3.910 4.312 7.000
140 HD3 ARG 17 HD3 ARG 17 3.638 3.773 5.343
141 HE ARG 17 HE ARG 17 1.965 5.973 6.115
142 HH11 ARG 17 HH11 ARG 17 5.089 5.062 4.879
143 HH12 ARG 17 HH12 ARG 17 5.368 6.582 4.097
144 HH21 ARG 17 HH21 ARG 17 2.321 7.980 5.091
145 HH22 ARG 17 HH22 ARG 17 3.793 8.242 4.219
146 H VAL 18 H VAL 18 5.140 1.884 6.862
147 HA VAL 18 HA VAL 18 6.330 -0.759 6.847
148 HB VAL 18 HB VAL 18 7.704 1.093 6.102
149 HG11 VAL 18 HG11 VAL 18 8.446 2.821 7.745
150 HG12 VAL 18 HG12 VAL 18 6.740 2.925 7.303
151 HG13 VAL 18 HG13 VAL 18 7.210 2.223 8.852
152 HG21 VAL 18 HG21 VAL 18 8.494 -0.863 7.799
153 HG22 VAL 18 HG22 VAL 18 9.592 0.274 7.016
154 HG23 VAL 18 HG23 VAL 18 9.044 0.571 8.666
155 H ARG 19 H ARG 19 4.925 1.449 9.120
156 HA ARG 19 HA ARG 19 5.448 -0.486 11.266
157 HB2 ARG 19 HB2 ARG 19 5.667 1.480 12.839
158 HB3 ARG 19 HB3 ARG 19 7.010 1.244 11.729
159 HG2 ARG 19 HG2 ARG 19 5.979 2.981 10.251
160 HG3 ARG 19 HG3 ARG 19 4.824 3.298 11.547
161 HD2 ARG 19 HD2 ARG 19 6.423 4.874 12.011
162 HD3 ARG 19 HD3 ARG 19 6.994 3.531 13.000
163 HE ARG 19 HE ARG 19 8.138 3.489 10.390
164 HH11 ARG 19 HH11 ARG 19 8.356 5.006 13.517
165 HH12 ARG 19 HH12 ARG 19 10.036 5.394 13.356
166 HH21 ARG 19 HH21 ARG 19 10.351 3.995 10.167
167 HH22 ARG 19 HH22 ARG 19 11.170 4.820 11.450
168 H GLU 20 H GLU 20 3.232 -1.073 10.479
169 HA GLU 20 HA GLU 20 1.226 0.560 11.886
170 HB2 GLU 20 HB2 GLU 20 1.179 0.604 9.299
171 HB3 GLU 20 HB3 GLU 20 0.561 -1.037 9.429
172 HG2 GLU 20 HG2 GLU 20 -1.349 0.266 9.253
173 HG3 GLU 20 HG3 GLU 20 -1.212 -0.046 10.983
174 H SER 21 H SER 21 -0.584 -0.601 12.744
175 HA SER 21 HA SER 21 -0.623 -3.468 12.730
176 HB2 SER 21 HB2 SER 21 0.452 -1.979 15.111
177 HB3 SER 21 HB3 SER 21 -0.381 -3.520 15.317
178 HG SER 21 HG SER 21 2.129 -3.012 14.391
179 HA PRO 22 HA PRO 22 -4.639 -1.288 13.561
180 HB2 PRO 22 HB2 PRO 22 -6.017 -2.597 11.623
181 HB3 PRO 22 HB3 PRO 22 -5.097 -1.120 11.316
182 HG2 PRO 22 HG2 PRO 22 -4.329 -3.969 10.812
183 HG3 PRO 22 HG3 PRO 22 -4.096 -2.548 9.777
184 HD2 PRO 22 HD2 PRO 22 -2.110 -3.585 11.297
185 HD3 PRO 22 HD3 PRO 22 -2.233 -1.850 10.941
186 H LEU 23 H LEU 23 -6.793 -2.341 14.007
187 HA LEU 23 HA LEU 23 -6.333 -4.812 15.491
188 HB2 LEU 23 HB2 LEU 23 -8.498 -2.735 15.528
189 HB3 LEU 23 HB3 LEU 23 -8.693 -4.288 16.338
190 HG LEU 23 HG LEU 23 -8.043 -2.662 17.964
191 HD11 LEU 23 HD11 LEU 23 -6.777 -5.027 17.615
192 HD12 LEU 23 HD12 LEU 23 -6.536 -3.964 19.001
193 HD13 LEU 23 HD13 LEU 23 -5.406 -3.918 17.648
194 HD21 LEU 23 HD21 LEU 23 -6.693 -1.441 15.899
195 HD22 LEU 23 HD22 LEU 23 -5.394 -2.045 16.929
196 HD23 LEU 23 HD23 LEU 23 -6.628 -0.976 17.599
197 H SER 24 H SER 24 -8.570 -3.484 13.075
198 HA SER 24 HA SER 24 -10.234 -5.654 12.718
199 HB2 SER 24 HB2 SER 24 -9.209 -3.663 10.686
200 HB3 SER 24 HB3 SER 24 -10.503 -4.815 10.355
201 HG SER 24 HG SER 24 -10.542 -2.493 11.826
202 H SER 25 H SER 25 -6.948 -5.203 11.642
203 HA SER 25 HA SER 25 -6.799 -7.171 9.665
204 HB2 SER 25 HB2 SER 25 -4.838 -5.817 11.450
205 HB3 SER 25 HB3 SER 25 -4.311 -7.290 10.637
206 HG SER 25 HG SER 25 -3.859 -5.704 9.216
207 H ASP 26 H ASP 26 -6.634 -7.402 13.163
208 HA ASP 26 HA ASP 26 -5.999 -10.238 13.065
209 HB2 ASP 26 HB2 ASP 26 -6.440 -8.306 15.344
210 HB3 ASP 26 HB3 ASP 26 -6.179 -10.031 15.588
211 H ALA 27 H ALA 27 -8.749 -8.162 13.440
212 HA ALA 27 HA ALA 27 -10.549 -9.819 14.752
213 HB1 ALA 27 HB1 ALA 27 -10.800 -7.577 12.823
214 HB2 ALA 27 HB2 ALA 27 -12.230 -8.562 13.132
215 HB3 ALA 27 HB3 ALA 27 -11.424 -7.736 14.465
216 H ILE 28 H ILE 28 -9.298 -10.011 11.524
217 HA ILE 28 HA ILE 28 -11.238 -11.453 10.192
218 HB ILE 28 HB ILE 28 -8.249 -11.849 10.000
219 HG12 ILE 28 HG12 ILE 28 -10.028 -10.140 8.258
220 HG13 ILE 28 HG13 ILE 28 -9.153 -9.504 9.647
221 HG21 ILE 28 HG21 ILE 28 -10.440 -12.545 8.048
222 HG22 ILE 28 HG22 ILE 28 -8.709 -12.706 7.756
223 HG23 ILE 28 HG23 ILE 28 -9.489 -13.690 8.994
224 HD11 ILE 28 HD11 ILE 28 -8.024 -9.118 7.484
225 HD12 ILE 28 HD12 ILE 28 -7.051 -10.037 8.633
226 HD13 ILE 28 HD13 ILE 28 -7.856 -10.864 7.299
227 H PHE 29 H PHE 29 -8.926 -12.550 12.594
228 HA PHE 29 HA PHE 29 -9.733 -15.326 12.254
229 HB2 PHE 29 HB2 PHE 29 -7.330 -14.428 12.774
230 HB3 PHE 29 HB3 PHE 29 -7.911 -14.372 14.435
231 HD1 PHE 29 HD1 PHE 29 -6.700 -16.456 11.767
232 HD2 PHE 29 HD2 PHE 29 -8.706 -16.478 15.521
233 HE1 PHE 29 HE1 PHE 29 -6.199 -18.852 12.016
234 HE2 PHE 29 HE2 PHE 29 -8.207 -18.874 15.777
235 HZ PHE 29 HZ PHE 29 -6.952 -20.064 14.024
236 H LYS 30 H LYS 30 -10.344 -12.616 14.320
237 HA LYS 30 HA LYS 30 -11.252 -13.866 16.634
238 HB2 LYS 30 HB2 LYS 30 -11.846 -11.258 15.303
239 HB3 LYS 30 HB3 LYS 30 -12.843 -11.758 16.662
240 HG2 LYS 30 HG2 LYS 30 -9.866 -11.783 16.900
241 HG3 LYS 30 HG3 LYS 30 -10.764 -10.274 17.074
242 HD2 LYS 30 HD2 LYS 30 -12.099 -11.270 18.862
243 HD3 LYS 30 HD3 LYS 30 -11.222 -12.790 18.678
244 HE2 LYS 30 HE2 LYS 30 -9.788 -10.220 19.259
245 HE3 LYS 30 HE3 LYS 30 -10.506 -11.179 20.553
246 HZ1 LYS 30 HZ1 LYS 30 -8.483 -12.160 18.613
247 HZ2 LYS 30 HZ2 LYS 30 -9.151 -13.052 19.885
248 HZ3 LYS 30 HZ3 LYS 30 -8.168 -11.716 20.214
249 H GLN 31 H GLN 31 -12.746 -13.552 13.512
250 HA GLN 31 HA GLN 31 -15.419 -14.042 14.243
251 HB2 GLN 31 HB2 GLN 31 -15.828 -14.465 11.937
252 HB3 GLN 31 HB3 GLN 31 -14.602 -13.207 12.011
253 HG2 GLN 31 HG2 GLN 31 -12.904 -15.093 11.749
254 HG3 GLN 31 HG3 GLN 31 -14.278 -16.093 11.279
255 HE21 GLN 31 HE21 GLN 31 -12.371 -15.856 9.471
256 HE22 GLN 31 HE22 GLN 31 -12.830 -14.794 8.188
257 H SER 32 H SER 32 -12.686 -16.155 13.761
258 HA SER 32 HA SER 32 -14.009 -18.593 13.425
259 HB2 SER 32 HB2 SER 32 -11.358 -18.023 14.773
260 HB3 SER 32 HB3 SER 32 -11.915 -19.623 14.283
261 HG SER 32 HG SER 32 -11.119 -17.448 12.699
262 H HIS 33 H HIS 33 -12.733 -17.153 16.428
263 HA HIS 33 HA HIS 33 -13.801 -19.122 18.142
264 HB2 HIS 33 HB2 HIS 33 -11.975 -17.664 18.844
265 HB3 HIS 33 HB3 HIS 33 -13.027 -16.256 18.727
266 HD1 HIS 33 HD1 HIS 33 -12.469 -19.340 20.818
267 HD2 HIS 33 HD2 HIS 33 -14.612 -15.782 20.934
268 HE1 HIS 33 HE1 HIS 33 -13.399 -19.190 23.150
Start of MODEL 2
1 H1 ASN 1 H ASN 1 1.721 -4.663 -2.032
2 HA ASN 1 HA ASN 1 2.623 -2.236 -0.694
3 HB2 ASN 1 HB2 ASN 1 3.047 -3.236 -3.519
4 HB3 ASN 1 HB3 ASN 1 3.734 -1.750 -2.868
5 HD21 ASN 1 HD21 ASN 1 4.340 -4.910 -3.495
6 HD22 ASN 1 HD22 ASN 1 5.644 -5.181 -2.393
7 H VAL 2 H VAL 2 0.749 -1.079 -0.322
8 HA VAL 2 HA VAL 2 -0.898 0.426 -0.776
9 HB VAL 2 HB VAL 2 0.050 0.442 -3.637
10 HG11 VAL 2 HG11 VAL 2 -0.656 2.993 -2.587
11 HG12 VAL 2 HG12 VAL 2 -1.425 2.081 -3.887
12 HG13 VAL 2 HG13 VAL 2 -1.950 1.854 -2.218
13 HG21 VAL 2 HG21 VAL 2 2.045 0.776 -2.452
14 HG22 VAL 2 HG22 VAL 2 1.477 2.403 -2.827
15 HG23 VAL 2 HG23 VAL 2 1.249 1.741 -1.209
16 H ASP 3 H ASP 3 -1.852 -2.021 -0.626
17 HA ASP 3 HA ASP 3 -3.498 -3.465 -1.263
18 HB2 ASP 3 HB2 ASP 3 -4.488 -0.890 -2.494
19 HB3 ASP 3 HB3 ASP 3 -5.450 -2.365 -2.432
20 H VAL 4 H VAL 4 -1.727 -4.436 -2.633
21 HA VAL 4 HA VAL 4 -2.654 -4.539 -5.418
22 HB VAL 4 HB VAL 4 -0.319 -4.721 -6.204
23 HG11 VAL 4 HG11 VAL 4 0.295 -2.286 -5.731
24 HG12 VAL 4 HG12 VAL 4 -1.263 -2.595 -6.500
25 HG13 VAL 4 HG13 VAL 4 -1.186 -2.226 -4.776
26 HG21 VAL 4 HG21 VAL 4 0.932 -5.467 -4.392
27 HG22 VAL 4 HG22 VAL 4 1.419 -3.779 -4.543
28 HG23 VAL 4 HG23 VAL 4 0.260 -4.254 -3.302
29 H ARG 5 H ARG 5 -2.963 -6.264 -3.002
30 HA ARG 5 HA ARG 5 -2.283 -8.765 -4.304
31 HB2 ARG 5 HB2 ARG 5 -1.303 -8.134 -1.513
32 HB3 ARG 5 HB3 ARG 5 -1.198 -9.703 -2.300
33 HG2 ARG 5 HG2 ARG 5 0.166 -8.541 -4.100
34 HG3 ARG 5 HG3 ARG 5 0.265 -7.176 -2.986
35 HD2 ARG 5 HD2 ARG 5 0.997 -9.117 -1.315
36 HD3 ARG 5 HD3 ARG 5 1.512 -9.862 -2.828
37 HE ARG 5 HE ARG 5 2.447 -7.215 -2.740
38 HH11 ARG 5 HH11 ARG 5 2.968 -10.299 -1.210
39 HH12 ARG 5 HH12 ARG 5 4.630 -9.981 -0.839
40 HH21 ARG 5 HH21 ARG 5 4.635 -6.784 -2.257
41 HH22 ARG 5 HH22 ARG 5 5.577 -7.981 -1.434
42 H TYR 6 H TYR 6 -4.485 -9.129 -4.486
43 HA TYR 6 HA TYR 6 -5.764 -10.096 -2.066
44 HB2 TYR 6 HB2 TYR 6 -7.835 -8.816 -2.464
45 HB3 TYR 6 HB3 TYR 6 -6.472 -7.763 -2.104
46 HD1 TYR 6 HD1 TYR 6 -5.557 -6.287 -3.796
47 HD2 TYR 6 HD2 TYR 6 -8.819 -8.867 -4.692
48 HE1 TYR 6 HE1 TYR 6 -5.986 -5.018 -5.858
49 HE2 TYR 6 HE2 TYR 6 -9.257 -7.606 -6.757
50 HH TYR 6 HH TYR 6 -8.811 -5.631 -7.838
51 H THR 7 H THR 7 -7.764 -11.297 -2.536
52 HA THR 7 HA THR 7 -7.988 -12.199 -5.320
53 HB THR 7 HB THR 7 -8.292 -14.566 -4.398
54 HG1 THR 7 HG1 THR 7 -6.634 -13.750 -2.277
55 HG21 THR 7 HG21 THR 7 -5.862 -14.997 -4.392
56 HG22 THR 7 HG22 THR 7 -5.570 -13.261 -4.276
57 HG23 THR 7 HG23 THR 7 -6.346 -13.931 -5.711
58 H TYR 8 H TYR 8 -9.610 -10.514 -3.455
59 HA TYR 8 HA TYR 8 -12.161 -11.443 -4.203
60 HB2 TYR 8 HB2 TYR 8 -13.097 -12.071 -2.060
61 HB3 TYR 8 HB3 TYR 8 -11.707 -13.095 -2.403
62 HD1 TYR 8 HD1 TYR 8 -13.267 -11.083 0.025
63 HD2 TYR 8 HD2 TYR 8 -9.428 -12.247 -1.391
64 HE1 TYR 8 HE1 TYR 8 -12.286 -10.463 2.194
65 HE2 TYR 8 HE2 TYR 8 -8.436 -11.631 0.773
66 HH TYR 8 HH TYR 8 -10.417 -10.244 3.374
67 H ARG 9 H ARG 9 -13.804 -10.283 -2.376
68 HA ARG 9 HA ARG 9 -12.933 -7.472 -2.441
69 HB2 ARG 9 HB2 ARG 9 -15.448 -7.021 -2.307
70 HB3 ARG 9 HB3 ARG 9 -14.825 -7.658 -3.823
71 HG2 ARG 9 HG2 ARG 9 -15.554 -9.910 -3.151
72 HG3 ARG 9 HG3 ARG 9 -16.234 -9.226 -1.673
73 HD2 ARG 9 HD2 ARG 9 -17.089 -8.746 -4.516
74 HD3 ARG 9 HD3 ARG 9 -18.031 -9.439 -3.197
75 HE ARG 9 HE ARG 9 -17.595 -6.645 -3.742
76 HH11 ARG 9 HH11 ARG 9 -18.447 -9.011 -1.334
77 HH12 ARG 9 HH12 ARG 9 -19.294 -7.878 -0.333
78 HH21 ARG 9 HH21 ARG 9 -18.707 -5.144 -2.432
79 HH22 ARG 9 HH22 ARG 9 -19.441 -5.679 -0.959
80 HA PRO 10 HA PRO 10 -13.093 -8.496 2.041
81 HB2 PRO 10 HB2 PRO 10 -11.033 -6.856 2.703
82 HB3 PRO 10 HB3 PRO 10 -10.797 -8.510 2.125
83 HG2 PRO 10 HG2 PRO 10 -10.596 -5.930 0.620
84 HG3 PRO 10 HG3 PRO 10 -9.533 -7.348 0.557
85 HD2 PRO 10 HD2 PRO 10 -11.420 -6.857 -1.322
86 HD3 PRO 10 HD3 PRO 10 -10.947 -8.502 -0.851
87 H SER 11 H SER 11 -13.447 -7.065 3.893
88 HA SER 11 HA SER 11 -15.200 -4.904 3.209
89 HB2 SER 11 HB2 SER 11 -15.701 -6.358 5.113
90 HB3 SER 11 HB3 SER 11 -14.210 -5.854 5.909
91 HG SER 11 HG SER 11 -16.501 -4.289 5.340
92 H VAL 12 H VAL 12 -12.005 -5.185 4.698
93 HA VAL 12 HA VAL 12 -11.407 -2.452 3.929
94 HB VAL 12 HB VAL 12 -10.506 -1.947 6.246
95 HG11 VAL 12 HG11 VAL 12 -12.651 -1.065 5.192
96 HG12 VAL 12 HG12 VAL 12 -13.496 -2.238 6.205
97 HG13 VAL 12 HG13 VAL 12 -12.523 -0.968 6.948
98 HG21 VAL 12 HG21 VAL 12 -12.502 -3.801 7.393
99 HG22 VAL 12 HG22 VAL 12 -11.003 -4.521 6.806
100 HG23 VAL 12 HG23 VAL 12 -10.952 -3.260 8.038
101 HA PRO 13 HA PRO 13 -7.384 -4.094 3.298
102 HB2 PRO 13 HB2 PRO 13 -5.851 -1.889 3.692
103 HB3 PRO 13 HB3 PRO 13 -6.868 -2.109 2.263
104 HG2 PRO 13 HG2 PRO 13 -7.407 -0.524 4.745
105 HG3 PRO 13 HG3 PRO 13 -7.710 -0.090 3.053
106 HD2 PRO 13 HD2 PRO 13 -9.663 -0.989 4.699
107 HD3 PRO 13 HD3 PRO 13 -9.657 -1.321 2.955
108 H ALA 14 H ALA 14 -6.223 -5.365 4.588
109 HA ALA 14 HA ALA 14 -6.224 -5.280 7.365
110 HB1 ALA 14 HB1 ALA 14 -5.006 -7.167 7.246
111 HB2 ALA 14 HB2 ALA 14 -5.353 -7.057 5.520
112 HB3 ALA 14 HB3 ALA 14 -3.819 -6.457 6.151
113 H HIS 15 H HIS 15 -3.886 -3.946 5.068
114 HA HIS 15 HA HIS 15 -3.104 -1.842 6.743
115 HB2 HIS 15 HB2 HIS 15 -0.715 -2.648 7.149
116 HB3 HIS 15 HB3 HIS 15 -1.969 -3.353 8.163
117 HD1 HIS 15 HD1 HIS 15 -0.987 -4.415 4.655
118 HD2 HIS 15 HD2 HIS 15 -0.998 -5.865 8.549
119 HE1 HIS 15 HE1 HIS 15 -0.278 -6.821 4.478
120 H ARG 16 H ARG 16 -1.384 -0.539 5.823
121 HA ARG 16 HA ARG 16 -0.672 -1.257 3.065
122 HB2 ARG 16 HB2 ARG 16 -2.665 0.412 3.367
123 HB3 ARG 16 HB3 ARG 16 -1.397 1.570 3.744
124 HG2 ARG 16 HG2 ARG 16 -0.390 1.253 1.586
125 HG3 ARG 16 HG3 ARG 16 -1.524 -0.046 1.209
126 HD2 ARG 16 HD2 ARG 16 -2.277 1.930 0.100
127 HD3 ARG 16 HD3 ARG 16 -3.378 1.607 1.439
128 HE ARG 16 HE ARG 16 -2.781 3.616 2.332
129 HH11 ARG 16 HH11 ARG 16 -0.290 2.605 0.120
130 HH12 ARG 16 HH12 ARG 16 0.616 4.074 0.264
131 HH21 ARG 16 HH21 ARG 16 -1.596 5.555 2.531
132 HH22 ARG 16 HH22 ARG 16 -0.127 5.751 1.637
133 H ARG 17 H ARG 17 0.983 -1.539 5.290
134 HA ARG 17 HA ARG 17 3.172 0.178 4.510
135 HB2 ARG 17 HB2 ARG 17 1.724 0.514 7.068
136 HB3 ARG 17 HB3 ARG 17 3.479 0.488 7.179
137 HG2 ARG 17 HG2 ARG 17 3.606 2.311 5.553
138 HG3 ARG 17 HG3 ARG 17 1.844 2.341 5.457
139 HD2 ARG 17 HD2 ARG 17 1.614 3.187 7.603
140 HD3 ARG 17 HD3 ARG 17 3.210 2.626 8.101
141 HE ARG 17 HE ARG 17 4.081 4.600 7.358
142 HH11 ARG 17 HH11 ARG 17 0.951 4.139 5.904
143 HH12 ARG 17 HH12 ARG 17 0.919 5.707 5.167
144 HH21 ARG 17 HH21 ARG 17 4.050 6.666 6.392
145 HH22 ARG 17 HH22 ARG 17 2.682 7.143 5.444
146 H VAL 18 H VAL 18 5.155 -0.386 5.982
147 HA VAL 18 HA VAL 18 5.396 -3.278 5.900
148 HB VAL 18 HB VAL 18 7.189 -1.890 4.952
149 HG11 VAL 18 HG11 VAL 18 6.814 -0.241 7.062
150 HG12 VAL 18 HG12 VAL 18 8.262 -1.108 7.576
151 HG13 VAL 18 HG13 VAL 18 8.253 -0.234 6.044
152 HG21 VAL 18 HG21 VAL 18 8.832 -3.330 5.565
153 HG22 VAL 18 HG22 VAL 18 8.518 -3.131 7.289
154 HG23 VAL 18 HG23 VAL 18 7.475 -4.169 6.317
155 H ARG 19 H ARG 19 5.082 -0.744 8.245
156 HA ARG 19 HA ARG 19 5.121 -2.756 10.375
157 HB2 ARG 19 HB2 ARG 19 6.257 -0.991 11.837
158 HB3 ARG 19 HB3 ARG 19 7.261 -1.827 10.661
159 HG2 ARG 19 HG2 ARG 19 7.389 0.036 9.265
160 HG3 ARG 19 HG3 ARG 19 6.001 0.814 10.028
161 HD2 ARG 19 HD2 ARG 19 7.292 1.151 12.065
162 HD3 ARG 19 HD3 ARG 19 8.672 0.325 11.341
163 HE ARG 19 HE ARG 19 8.171 2.342 9.606
164 HH11 ARG 19 HH11 ARG 19 8.670 2.205 13.049
165 HH12 ARG 19 HH12 ARG 19 9.372 3.787 13.142
166 HH21 ARG 19 HH21 ARG 19 9.094 4.425 9.715
167 HH22 ARG 19 HH22 ARG 19 9.612 5.049 11.245
168 H GLU 20 H GLU 20 2.802 -2.539 10.130
169 HA GLU 20 HA GLU 20 1.777 -0.316 11.730
170 HB2 GLU 20 HB2 GLU 20 1.520 -0.199 9.034
171 HB3 GLU 20 HB3 GLU 20 0.061 -1.088 9.451
172 HG2 GLU 20 HG2 GLU 20 0.875 1.663 10.325
173 HG3 GLU 20 HG3 GLU 20 -0.545 1.181 9.398
174 H SER 21 H SER 21 0.441 -1.008 13.266
175 HA SER 21 HA SER 21 -0.772 -3.676 12.953
176 HB2 SER 21 HB2 SER 21 -0.694 -3.810 15.452
177 HB3 SER 21 HB3 SER 21 0.899 -3.735 14.699
178 HG SER 21 HG SER 21 0.333 -2.283 16.597
179 HA PRO 22 HA PRO 22 -4.173 -0.516 13.302
180 HB2 PRO 22 HB2 PRO 22 -5.632 -1.504 11.236
181 HB3 PRO 22 HB3 PRO 22 -4.345 -0.312 11.020
182 HG2 PRO 22 HG2 PRO 22 -4.268 -3.278 10.618
183 HG3 PRO 22 HG3 PRO 22 -3.583 -1.993 9.605
184 HD2 PRO 22 HD2 PRO 22 -2.084 -3.441 11.333
185 HD3 PRO 22 HD3 PRO 22 -1.732 -1.742 10.955
186 H LEU 23 H LEU 23 -6.690 -1.248 13.001
187 HA LEU 23 HA LEU 23 -7.056 -3.259 15.043
188 HB2 LEU 23 HB2 LEU 23 -8.871 -1.353 13.611
189 HB3 LEU 23 HB3 LEU 23 -9.526 -2.649 14.609
190 HG LEU 23 HG LEU 23 -9.494 -0.608 15.876
191 HD11 LEU 23 HD11 LEU 23 -8.935 -2.744 17.013
192 HD12 LEU 23 HD12 LEU 23 -8.262 -1.319 17.804
193 HD13 LEU 23 HD13 LEU 23 -7.227 -2.353 16.820
194 HD21 LEU 23 HD21 LEU 23 -7.263 0.035 14.422
195 HD22 LEU 23 HD22 LEU 23 -6.594 -0.300 16.020
196 HD23 LEU 23 HD23 LEU 23 -7.858 0.916 15.830
197 H SER 24 H SER 24 -8.309 -2.764 11.740
198 HA SER 24 HA SER 24 -9.646 -5.157 11.430
199 HB2 SER 24 HB2 SER 24 -9.181 -4.875 8.968
200 HB3 SER 24 HB3 SER 24 -9.856 -3.448 9.755
201 HG SER 24 HG SER 24 -8.180 -2.638 8.662
202 H SER 25 H SER 25 -6.218 -4.520 11.311
203 HA SER 25 HA SER 25 -5.264 -6.748 9.985
204 HB2 SER 25 HB2 SER 25 -4.200 -4.848 11.955
205 HB3 SER 25 HB3 SER 25 -3.413 -6.426 11.990
206 HG SER 25 HG SER 25 -2.340 -5.232 10.481
207 H ASP 26 H ASP 26 -6.597 -6.487 13.195
208 HA ASP 26 HA ASP 26 -5.758 -9.158 13.950
209 HB2 ASP 26 HB2 ASP 26 -7.490 -7.112 15.347
210 HB3 ASP 26 HB3 ASP 26 -7.076 -8.683 16.027
211 H ALA 27 H ALA 27 -8.587 -7.542 12.709
212 HA ALA 27 HA ALA 27 -10.538 -9.458 13.307
213 HB1 ALA 27 HB1 ALA 27 -10.802 -8.086 10.715
214 HB2 ALA 27 HB2 ALA 27 -11.924 -8.179 12.073
215 HB3 ALA 27 HB3 ALA 27 -10.579 -7.039 12.117
216 H ILE 28 H ILE 28 -8.001 -9.446 10.952
217 HA ILE 28 HA ILE 28 -8.944 -11.165 9.008
218 HB ILE 28 HB ILE 28 -6.147 -11.118 10.148
219 HG12 ILE 28 HG12 ILE 28 -6.951 -8.901 9.397
220 HG13 ILE 28 HG13 ILE 28 -5.647 -9.513 8.384
221 HG21 ILE 28 HG21 ILE 28 -7.141 -12.060 7.462
222 HG22 ILE 28 HG22 ILE 28 -5.460 -12.008 7.988
223 HG23 ILE 28 HG23 ILE 28 -6.598 -13.097 8.781
224 HD11 ILE 28 HD11 ILE 28 -7.388 -8.466 7.056
225 HD12 ILE 28 HD12 ILE 28 -7.273 -10.190 6.700
226 HD13 ILE 28 HD13 ILE 28 -8.580 -9.584 7.717
227 H PHE 29 H PHE 29 -7.856 -11.887 12.255
228 HA PHE 29 HA PHE 29 -7.861 -14.745 11.816
229 HB2 PHE 29 HB2 PHE 29 -6.345 -13.445 13.445
230 HB3 PHE 29 HB3 PHE 29 -7.752 -13.389 14.502
231 HD1 PHE 29 HD1 PHE 29 -5.041 -15.397 13.236
232 HD2 PHE 29 HD2 PHE 29 -8.739 -15.515 15.341
233 HE1 PHE 29 HE1 PHE 29 -4.480 -17.635 14.090
234 HE2 PHE 29 HE2 PHE 29 -8.183 -17.753 16.199
235 HZ PHE 29 HZ PHE 29 -6.051 -18.816 15.575
236 H LYS 30 H LYS 30 -10.024 -12.302 13.009
237 HA LYS 30 HA LYS 30 -11.793 -13.785 14.537
238 HB2 LYS 30 HB2 LYS 30 -11.881 -11.326 14.262
239 HB3 LYS 30 HB3 LYS 30 -12.486 -11.546 12.625
240 HG2 LYS 30 HG2 LYS 30 -14.467 -12.687 13.535
241 HG3 LYS 30 HG3 LYS 30 -13.866 -12.385 15.167
242 HD2 LYS 30 HD2 LYS 30 -13.780 -9.898 14.343
243 HD3 LYS 30 HD3 LYS 30 -14.955 -10.467 13.155
244 HE2 LYS 30 HE2 LYS 30 -15.389 -11.175 16.009
245 HE3 LYS 30 HE3 LYS 30 -15.693 -9.511 15.514
246 HZ1 LYS 30 HZ1 LYS 30 -16.894 -11.068 13.597
247 HZ2 LYS 30 HZ2 LYS 30 -17.669 -10.208 14.830
248 HZ3 LYS 30 HZ3 LYS 30 -17.266 -11.835 15.058
249 H GLN 31 H GLN 31 -11.342 -13.741 11.091
250 HA GLN 31 HA GLN 31 -13.746 -14.720 10.157
251 HB2 GLN 31 HB2 GLN 31 -12.560 -15.526 8.244
252 HB3 GLN 31 HB3 GLN 31 -11.769 -14.047 8.771
253 HG2 GLN 31 HG2 GLN 31 -10.075 -15.433 9.939
254 HG3 GLN 31 HG3 GLN 31 -10.830 -16.865 9.240
255 HE21 GLN 31 HE21 GLN 31 -9.794 -17.602 7.545
256 HE22 GLN 31 HE22 GLN 31 -8.944 -16.661 6.373
257 H SER 32 H SER 32 -11.172 -16.408 11.829
258 HA SER 32 HA SER 32 -12.407 -19.000 11.402
259 HB2 SER 32 HB2 SER 32 -9.963 -18.849 11.390
260 HB3 SER 32 HB3 SER 32 -9.981 -18.208 13.033
261 HG SER 32 HG SER 32 -9.595 -20.384 13.185
262 H HIS 33 H HIS 33 -12.079 -16.598 13.932
263 HA HIS 33 HA HIS 33 -13.312 -18.301 15.926
264 HB2 HIS 33 HB2 HIS 33 -11.500 -16.458 16.294
265 HB3 HIS 33 HB3 HIS 33 -12.871 -15.353 16.275
266 HD1 HIS 33 HD1 HIS 33 -12.431 -14.788 18.779
267 HD2 HIS 33 HD2 HIS 33 -13.392 -18.764 18.049
268 HE1 HIS 33 HE1 HIS 33 -12.970 -15.773 21.029
Start of MODEL 3
1 H1 ASN 1 H ASN 1 1.058 -4.413 -3.969
2 HA ASN 1 HA ASN 1 -0.304 -4.236 -1.374
3 HB2 ASN 1 HB2 ASN 1 2.132 -5.203 -1.811
4 HB3 ASN 1 HB3 ASN 1 2.570 -3.501 -1.700
5 HD21 ASN 1 HD21 ASN 1 2.539 -6.177 0.025
6 HD22 ASN 1 HD22 ASN 1 2.217 -5.556 1.605
7 H VAL 2 H VAL 2 -0.935 -2.336 -0.559
8 HA VAL 2 HA VAL 2 -1.470 -0.120 -0.475
9 HB VAL 2 HB VAL 2 1.387 0.258 -1.381
10 HG11 VAL 2 HG11 VAL 2 1.120 2.443 -1.046
11 HG12 VAL 2 HG12 VAL 2 -0.617 2.135 -0.990
12 HG13 VAL 2 HG13 VAL 2 0.321 2.179 0.504
13 HG21 VAL 2 HG21 VAL 2 0.189 -0.445 1.260
14 HG22 VAL 2 HG22 VAL 2 1.659 -1.050 0.495
15 HG23 VAL 2 HG23 VAL 2 1.635 0.564 1.205
16 H ASP 3 H ASP 3 -2.859 -0.588 -2.391
17 HA ASP 3 HA ASP 3 -2.138 1.240 -4.560
18 HB2 ASP 3 HB2 ASP 3 -3.002 -1.630 -4.908
19 HB3 ASP 3 HB3 ASP 3 -3.139 -0.436 -6.196
20 H VAL 4 H VAL 4 -3.860 2.309 -5.489
21 HA VAL 4 HA VAL 4 -6.445 1.933 -4.131
22 HB VAL 4 HB VAL 4 -6.941 4.269 -4.774
23 HG11 VAL 4 HG11 VAL 4 -5.835 5.192 -2.984
24 HG12 VAL 4 HG12 VAL 4 -5.658 3.472 -2.632
25 HG13 VAL 4 HG13 VAL 4 -4.321 4.368 -3.354
26 HG21 VAL 4 HG21 VAL 4 -4.055 4.452 -5.614
27 HG22 VAL 4 HG22 VAL 4 -5.389 4.265 -6.752
28 HG23 VAL 4 HG23 VAL 4 -5.296 5.699 -5.731
29 H ARG 5 H ARG 5 -5.443 0.484 -6.523
30 HA ARG 5 HA ARG 5 -7.799 0.887 -8.168
31 HB2 ARG 5 HB2 ARG 5 -6.325 0.836 -10.261
32 HB3 ARG 5 HB3 ARG 5 -6.410 2.350 -9.370
33 HG2 ARG 5 HG2 ARG 5 -4.268 1.871 -8.320
34 HG3 ARG 5 HG3 ARG 5 -4.187 0.329 -9.174
35 HD2 ARG 5 HD2 ARG 5 -2.865 2.222 -10.190
36 HD3 ARG 5 HD3 ARG 5 -3.981 1.394 -11.274
37 HE ARG 5 HE ARG 5 -5.081 3.736 -10.008
38 HH11 ARG 5 HH11 ARG 5 -3.291 2.502 -12.727
39 HH12 ARG 5 HH12 ARG 5 -3.692 3.832 -13.762
40 HH21 ARG 5 HH21 ARG 5 -5.616 5.493 -11.361
41 HH22 ARG 5 HH22 ARG 5 -5.014 5.533 -12.983
42 H TYR 6 H TYR 6 -8.603 -1.114 -7.999
43 HA TYR 6 HA TYR 6 -6.989 -3.326 -9.011
44 HB2 TYR 6 HB2 TYR 6 -7.722 -4.788 -7.133
45 HB3 TYR 6 HB3 TYR 6 -6.648 -3.489 -6.624
46 HD1 TYR 6 HD1 TYR 6 -7.296 -2.004 -4.932
47 HD2 TYR 6 HD2 TYR 6 -10.231 -4.466 -6.784
48 HE1 TYR 6 HE1 TYR 6 -8.945 -1.293 -3.251
49 HE2 TYR 6 HE2 TYR 6 -11.888 -3.761 -5.109
50 HH TYR 6 HH TYR 6 -11.017 -2.023 -2.281
51 H THR 7 H THR 7 -8.296 -5.242 -9.517
52 HA THR 7 HA THR 7 -11.152 -4.663 -9.891
53 HB THR 7 HB THR 7 -10.971 -5.803 -12.158
54 HG1 THR 7 HG1 THR 7 -9.042 -6.316 -12.874
55 HG21 THR 7 HG21 THR 7 -9.455 -3.206 -12.033
56 HG22 THR 7 HG22 THR 7 -11.186 -3.300 -11.707
57 HG23 THR 7 HG23 THR 7 -10.559 -3.774 -13.286
58 H TYR 8 H TYR 8 -9.518 -6.405 -8.078
59 HA TYR 8 HA TYR 8 -11.220 -8.649 -8.059
60 HB2 TYR 8 HB2 TYR 8 -9.694 -10.422 -8.684
61 HB3 TYR 8 HB3 TYR 8 -9.833 -9.285 -10.020
62 HD1 TYR 8 HD1 TYR 8 -7.587 -11.105 -8.015
63 HD2 TYR 8 HD2 TYR 8 -7.992 -7.402 -10.070
64 HE1 TYR 8 HE1 TYR 8 -5.139 -10.868 -8.058
65 HE2 TYR 8 HE2 TYR 8 -5.546 -7.154 -10.119
66 HH TYR 8 HH TYR 8 -3.586 -8.154 -9.722
67 H ARG 9 H ARG 9 -9.762 -10.524 -6.738
68 HA ARG 9 HA ARG 9 -8.860 -9.054 -4.352
69 HB2 ARG 9 HB2 ARG 9 -9.402 -11.261 -3.178
70 HB3 ARG 9 HB3 ARG 9 -10.760 -10.298 -3.745
71 HG2 ARG 9 HG2 ARG 9 -10.919 -11.733 -5.736
72 HG3 ARG 9 HG3 ARG 9 -9.601 -12.721 -5.103
73 HD2 ARG 9 HD2 ARG 9 -11.433 -13.912 -4.388
74 HD3 ARG 9 HD3 ARG 9 -11.129 -12.881 -2.990
75 HE ARG 9 HE ARG 9 -12.951 -11.671 -4.812
76 HH11 ARG 9 HH11 ARG 9 -12.696 -14.074 -2.305
77 HH12 ARG 9 HH12 ARG 9 -14.362 -13.957 -1.843
78 HH21 ARG 9 HH21 ARG 9 -15.146 -11.509 -4.213
79 HH22 ARG 9 HH22 ARG 9 -15.755 -12.498 -2.930
80 HA PRO 10 HA PRO 10 -5.044 -11.078 -5.937
81 HB2 PRO 10 HB2 PRO 10 -3.396 -9.079 -5.125
82 HB3 PRO 10 HB3 PRO 10 -4.263 -9.044 -6.665
83 HG2 PRO 10 HG2 PRO 10 -4.946 -7.706 -4.076
84 HG3 PRO 10 HG3 PRO 10 -5.026 -7.059 -5.725
85 HD2 PRO 10 HD2 PRO 10 -7.213 -7.956 -4.405
86 HD3 PRO 10 HD3 PRO 10 -7.040 -8.089 -6.167
87 H SER 11 H SER 11 -3.098 -11.736 -4.761
88 HA SER 11 HA SER 11 -3.722 -12.637 -2.134
89 HB2 SER 11 HB2 SER 11 -0.917 -12.694 -3.167
90 HB3 SER 11 HB3 SER 11 -1.811 -13.929 -2.282
91 HG SER 11 HG SER 11 -2.367 -14.757 -4.120
92 H VAL 12 H VAL 12 -4.104 -10.648 -1.020
93 HA VAL 12 HA VAL 12 -1.631 -9.218 -0.289
94 HB VAL 12 HB VAL 12 -3.177 -7.316 0.352
95 HG11 VAL 12 HG11 VAL 12 -1.786 -7.573 -1.794
96 HG12 VAL 12 HG12 VAL 12 -3.329 -7.903 -2.584
97 HG13 VAL 12 HG13 VAL 12 -3.065 -6.360 -1.771
98 HG21 VAL 12 HG21 VAL 12 -5.391 -7.355 -0.070
99 HG22 VAL 12 HG22 VAL 12 -5.199 -8.280 -1.559
100 HG23 VAL 12 HG23 VAL 12 -5.173 -9.103 0.000
101 HA PRO 13 HA PRO 13 -2.209 -10.413 3.896
102 HB2 PRO 13 HB2 PRO 13 -1.216 -8.248 5.200
103 HB3 PRO 13 HB3 PRO 13 -0.193 -9.402 4.336
104 HG2 PRO 13 HG2 PRO 13 -1.193 -6.724 3.449
105 HG3 PRO 13 HG3 PRO 13 0.421 -7.433 3.263
106 HD2 PRO 13 HD2 PRO 13 -1.392 -7.389 1.252
107 HD3 PRO 13 HD3 PRO 13 -0.207 -8.698 1.441
108 H ALA 14 H ALA 14 -3.267 -9.812 5.935
109 HA ALA 14 HA ALA 14 -5.879 -8.922 5.589
110 HB1 ALA 14 HB1 ALA 14 -6.125 -9.074 7.936
111 HB2 ALA 14 HB2 ALA 14 -4.960 -10.319 7.482
112 HB3 ALA 14 HB3 ALA 14 -4.402 -8.811 8.207
113 H HIS 15 H HIS 15 -2.970 -7.133 6.155
114 HA HIS 15 HA HIS 15 -4.550 -4.668 6.488
115 HB2 HIS 15 HB2 HIS 15 -1.653 -5.024 7.257
116 HB3 HIS 15 HB3 HIS 15 -2.729 -3.701 7.695
117 HD1 HIS 15 HD1 HIS 15 -5.126 -5.591 8.584
118 HD2 HIS 15 HD2 HIS 15 -1.178 -5.861 9.848
119 HE1 HIS 15 HE1 HIS 15 -5.209 -6.782 10.798
120 H ARG 16 H ARG 16 -2.692 -2.779 5.898
121 HA ARG 16 HA ARG 16 -1.970 -3.368 3.102
122 HB2 ARG 16 HB2 ARG 16 -3.034 -0.797 4.282
123 HB3 ARG 16 HB3 ARG 16 -2.402 -0.948 2.648
124 HG2 ARG 16 HG2 ARG 16 -4.153 -2.592 2.138
125 HG3 ARG 16 HG3 ARG 16 -4.799 -2.385 3.768
126 HD2 ARG 16 HD2 ARG 16 -5.616 -0.288 3.325
127 HD3 ARG 16 HD3 ARG 16 -4.418 0.029 2.071
128 HE ARG 16 HE ARG 16 -6.150 -2.039 1.246
129 HH11 ARG 16 HH11 ARG 16 -6.078 1.402 1.767
130 HH12 ARG 16 HH12 ARG 16 -7.301 1.738 0.587
131 HH21 ARG 16 HH21 ARG 16 -7.760 -1.610 -0.311
132 HH22 ARG 16 HH22 ARG 16 -8.258 0.024 -0.594
133 H ARG 17 H ARG 17 -0.204 -3.801 5.231
134 HA ARG 17 HA ARG 17 2.084 -2.455 4.361
135 HB2 ARG 17 HB2 ARG 17 0.531 -0.903 6.148
136 HB3 ARG 17 HB3 ARG 17 1.940 -1.456 7.045
137 HG2 ARG 17 HG2 ARG 17 3.093 0.194 6.129
138 HG3 ARG 17 HG3 ARG 17 2.914 -0.607 4.566
139 HD2 ARG 17 HD2 ARG 17 1.286 0.808 3.875
140 HD3 ARG 17 HD3 ARG 17 0.610 0.990 5.493
141 HE ARG 17 HE ARG 17 3.055 2.271 5.529
142 HH11 ARG 17 HH11 ARG 17 0.051 2.558 3.794
143 HH12 ARG 17 HH12 ARG 17 0.201 4.268 3.557
144 HH21 ARG 17 HH21 ARG 17 3.264 4.521 5.223
145 HH22 ARG 17 HH22 ARG 17 2.029 5.383 4.370
146 H VAL 18 H VAL 18 3.778 -2.527 6.437
147 HA VAL 18 HA VAL 18 3.580 -5.311 7.380
148 HB VAL 18 HB VAL 18 5.452 -4.882 5.823
149 HG11 VAL 18 HG11 VAL 18 7.252 -3.434 6.359
150 HG12 VAL 18 HG12 VAL 18 5.772 -2.497 6.575
151 HG13 VAL 18 HG13 VAL 18 6.623 -3.141 7.980
152 HG21 VAL 18 HG21 VAL 18 5.495 -6.247 8.230
153 HG22 VAL 18 HG22 VAL 18 6.635 -6.437 6.898
154 HG23 VAL 18 HG23 VAL 18 7.007 -5.339 8.228
155 H ARG 19 H ARG 19 4.020 -2.005 8.309
156 HA ARG 19 HA ARG 19 4.471 -2.835 11.098
157 HB2 ARG 19 HB2 ARG 19 5.259 -0.370 9.575
158 HB3 ARG 19 HB3 ARG 19 5.127 -0.333 11.328
159 HG2 ARG 19 HG2 ARG 19 6.821 -2.009 11.555
160 HG3 ARG 19 HG3 ARG 19 6.862 -2.266 9.810
161 HD2 ARG 19 HD2 ARG 19 7.521 0.170 9.606
162 HD3 ARG 19 HD3 ARG 19 7.758 0.155 11.353
163 HE ARG 19 HE ARG 19 9.198 -1.976 10.281
164 HH11 ARG 19 HH11 ARG 19 9.205 1.504 10.194
165 HH12 ARG 19 HH12 ARG 19 10.913 1.625 9.935
166 HH21 ARG 19 HH21 ARG 19 11.449 -1.831 9.940
167 HH22 ARG 19 HH22 ARG 19 12.189 -0.273 9.790
168 H GLU 20 H GLU 20 1.907 -3.044 10.142
169 HA GLU 20 HA GLU 20 0.551 -0.722 11.350
170 HB2 GLU 20 HB2 GLU 20 0.193 -1.367 8.835
171 HB3 GLU 20 HB3 GLU 20 -0.847 -2.618 9.500
172 HG2 GLU 20 HG2 GLU 20 -2.138 -0.669 8.883
173 HG3 GLU 20 HG3 GLU 20 -2.183 -0.916 10.628
174 H SER 21 H SER 21 -1.371 -1.153 12.584
175 HA SER 21 HA SER 21 -1.916 -3.876 13.395
176 HB2 SER 21 HB2 SER 21 0.050 -3.007 14.804
177 HB3 SER 21 HB3 SER 21 -1.125 -1.927 15.555
178 HG SER 21 HG SER 21 -1.184 -3.695 16.810
179 HA PRO 22 HA PRO 22 -5.544 -0.976 13.377
180 HB2 PRO 22 HB2 PRO 22 -7.140 -2.611 11.911
181 HB3 PRO 22 HB3 PRO 22 -6.014 -1.460 11.181
182 HG2 PRO 22 HG2 PRO 22 -5.692 -4.403 11.624
183 HG3 PRO 22 HG3 PRO 22 -5.269 -3.433 10.202
184 HD2 PRO 22 HD2 PRO 22 -3.431 -4.219 12.028
185 HD3 PRO 22 HD3 PRO 22 -3.300 -2.687 11.139
186 H LEU 23 H LEU 23 -7.995 -1.924 13.658
187 HA LEU 23 HA LEU 23 -7.928 -3.204 16.236
188 HB2 LEU 23 HB2 LEU 23 -10.097 -2.082 14.498
189 HB3 LEU 23 HB3 LEU 23 -10.481 -3.018 15.941
190 HG LEU 23 HG LEU 23 -10.619 -0.681 16.463
191 HD11 LEU 23 HD11 LEU 23 -9.371 -2.434 17.983
192 HD12 LEU 23 HD12 LEU 23 -9.454 -0.729 18.425
193 HD13 LEU 23 HD13 LEU 23 -7.995 -1.375 17.674
194 HD21 LEU 23 HD21 LEU 23 -7.800 -0.028 16.109
195 HD22 LEU 23 HD22 LEU 23 -9.241 0.897 15.688
196 HD23 LEU 23 HD23 LEU 23 -8.640 -0.348 14.592
197 H SER 24 H SER 24 -9.373 -3.981 13.075
198 HA SER 24 HA SER 24 -10.489 -6.429 13.681
199 HB2 SER 24 HB2 SER 24 -10.835 -5.338 11.525
200 HB3 SER 24 HB3 SER 24 -9.142 -5.587 11.102
201 HG SER 24 HG SER 24 -10.519 -7.180 10.188
202 H SER 25 H SER 25 -7.140 -5.603 13.180
203 HA SER 25 HA SER 25 -6.002 -8.054 12.627
204 HB2 SER 25 HB2 SER 25 -4.875 -5.753 12.848
205 HB3 SER 25 HB3 SER 25 -4.748 -6.119 14.569
206 HG SER 25 HG SER 25 -2.991 -7.118 13.994
207 H ASP 26 H ASP 26 -7.109 -6.776 15.713
208 HA ASP 26 HA ASP 26 -6.206 -9.165 17.117
209 HB2 ASP 26 HB2 ASP 26 -7.228 -6.484 17.933
210 HB3 ASP 26 HB3 ASP 26 -7.450 -7.829 19.048
211 H ALA 27 H ALA 27 -9.073 -7.805 15.754
212 HA ALA 27 HA ALA 27 -11.045 -9.128 17.233
213 HB1 ALA 27 HB1 ALA 27 -12.463 -8.825 15.202
214 HB2 ALA 27 HB2 ALA 27 -11.658 -7.355 15.752
215 HB3 ALA 27 HB3 ALA 27 -11.033 -8.234 14.356
216 H ILE 28 H ILE 28 -8.816 -10.307 14.882
217 HA ILE 28 HA ILE 28 -10.160 -12.524 13.869
218 HB ILE 28 HB ILE 28 -8.010 -13.472 13.348
219 HG12 ILE 28 HG12 ILE 28 -6.855 -11.409 15.238
220 HG13 ILE 28 HG13 ILE 28 -6.943 -13.141 15.540
221 HG21 ILE 28 HG21 ILE 28 -6.992 -10.889 12.834
222 HG22 ILE 28 HG22 ILE 28 -7.881 -11.948 11.742
223 HG23 ILE 28 HG23 ILE 28 -8.750 -10.786 12.744
224 HD11 ILE 28 HD11 ILE 28 -5.623 -13.069 13.167
225 HD12 ILE 28 HD12 ILE 28 -5.039 -11.602 13.951
226 HD13 ILE 28 HD13 ILE 28 -4.858 -13.162 14.753
227 H PHE 29 H PHE 29 -8.647 -12.016 16.971
228 HA PHE 29 HA PHE 29 -8.985 -14.830 17.688
229 HB2 PHE 29 HB2 PHE 29 -6.920 -13.282 18.243
230 HB3 PHE 29 HB3 PHE 29 -7.929 -12.786 19.598
231 HD1 PHE 29 HD1 PHE 29 -5.794 -15.348 18.247
232 HD2 PHE 29 HD2 PHE 29 -8.699 -14.500 21.240
233 HE1 PHE 29 HE1 PHE 29 -5.073 -17.336 19.505
234 HE2 PHE 29 HE2 PHE 29 -7.982 -16.486 22.503
235 HZ PHE 29 HZ PHE 29 -6.167 -17.907 21.636
236 H LYS 30 H LYS 30 -10.724 -11.989 17.785
237 HA LYS 30 HA LYS 30 -11.974 -12.175 20.322
238 HB2 LYS 30 HB2 LYS 30 -11.945 -10.139 18.861
239 HB3 LYS 30 HB3 LYS 30 -13.099 -10.940 17.803
240 HG2 LYS 30 HG2 LYS 30 -14.764 -10.955 19.507
241 HG3 LYS 30 HG3 LYS 30 -13.606 -10.401 20.719
242 HD2 LYS 30 HD2 LYS 30 -13.320 -8.323 19.298
243 HD3 LYS 30 HD3 LYS 30 -14.726 -8.869 18.381
244 HE2 LYS 30 HE2 LYS 30 -15.753 -7.523 19.918
245 HE3 LYS 30 HE3 LYS 30 -15.793 -9.058 20.784
246 HZ1 LYS 30 HZ1 LYS 30 -13.897 -8.413 22.054
247 HZ2 LYS 30 HZ2 LYS 30 -15.027 -7.157 22.143
248 HZ3 LYS 30 HZ3 LYS 30 -13.675 -7.009 21.136
249 H GLN 31 H GLN 31 -12.465 -13.792 17.299
250 HA GLN 31 HA GLN 31 -15.138 -14.638 17.726
251 HB2 GLN 31 HB2 GLN 31 -14.000 -14.625 15.512
252 HB3 GLN 31 HB3 GLN 31 -13.003 -15.969 16.053
253 HG2 GLN 31 HG2 GLN 31 -15.980 -16.187 16.117
254 HG3 GLN 31 HG3 GLN 31 -15.099 -16.423 14.609
255 HE21 GLN 31 HE21 GLN 31 -16.588 -18.136 16.751
256 HE22 GLN 31 HE22 GLN 31 -15.556 -19.512 16.907
257 H SER 32 H SER 32 -12.014 -15.902 18.668
258 HA SER 32 HA SER 32 -12.751 -18.505 19.370
259 HB2 SER 32 HB2 SER 32 -10.407 -17.706 19.239
260 HB3 SER 32 HB3 SER 32 -10.665 -16.764 20.708
261 HG SER 32 HG SER 32 -11.071 -18.720 21.806
262 H HIS 33 H HIS 33 -13.307 -15.474 20.959
263 HA HIS 33 HA HIS 33 -14.437 -16.897 23.278
264 HB2 HIS 33 HB2 HIS 33 -12.509 -15.135 23.520
265 HB3 HIS 33 HB3 HIS 33 -13.814 -13.967 23.329
266 HD1 HIS 33 HD1 HIS 33 -12.158 -16.051 25.808
267 HD2 HIS 33 HD2 HIS 33 -15.875 -14.243 25.390
268 HE1 HIS 33 HE1 HIS 33 -13.160 -16.032 28.115
Start of MODEL 4
1 H1 ASN 1 H ASN 1 -0.191 4.462 0.869
2 HA ASN 1 HA ASN 1 -0.656 1.895 0.294
3 HB2 ASN 1 HB2 ASN 1 -0.401 2.582 -2.206
4 HB3 ASN 1 HB3 ASN 1 -1.605 3.398 -1.213
5 HD21 ASN 1 HD21 ASN 1 -1.652 5.503 -1.436
6 HD22 ASN 1 HD22 ASN 1 -0.322 6.516 -1.872
7 H VAL 2 H VAL 2 0.507 0.115 0.036
8 HA VAL 2 HA VAL 2 2.804 -0.045 -1.614
9 HB VAL 2 HB VAL 2 3.939 1.046 0.229
10 HG11 VAL 2 HG11 VAL 2 2.285 0.327 1.968
11 HG12 VAL 2 HG12 VAL 2 3.082 -1.247 1.985
12 HG13 VAL 2 HG13 VAL 2 3.975 0.200 2.457
13 HG21 VAL 2 HG21 VAL 2 4.956 -0.929 -1.055
14 HG22 VAL 2 HG22 VAL 2 5.742 -0.429 0.443
15 HG23 VAL 2 HG23 VAL 2 4.699 -1.851 0.426
16 H ASP 3 H ASP 3 2.794 -2.038 -2.405
17 HA ASP 3 HA ASP 3 2.456 -4.275 -2.643
18 HB2 ASP 3 HB2 ASP 3 3.837 -4.166 -0.426
19 HB3 ASP 3 HB3 ASP 3 2.310 -4.603 0.335
20 H VAL 4 H VAL 4 0.226 -2.786 -2.930
21 HA VAL 4 HA VAL 4 -1.884 -4.089 -1.366
22 HB VAL 4 HB VAL 4 -3.399 -2.416 -2.401
23 HG11 VAL 4 HG11 VAL 4 -2.945 -0.927 -0.774
24 HG12 VAL 4 HG12 VAL 4 -1.717 -2.104 -0.304
25 HG13 VAL 4 HG13 VAL 4 -1.274 -0.712 -1.292
26 HG21 VAL 4 HG21 VAL 4 -1.513 -0.509 -3.297
27 HG22 VAL 4 HG22 VAL 4 -1.159 -2.026 -4.123
28 HG23 VAL 4 HG23 VAL 4 -2.772 -1.320 -4.229
29 H ARG 5 H ARG 5 -0.641 -5.786 -3.127
30 HA ARG 5 HA ARG 5 -2.301 -5.913 -5.524
31 HB2 ARG 5 HB2 ARG 5 0.258 -7.151 -4.651
32 HB3 ARG 5 HB3 ARG 5 -0.740 -8.069 -5.770
33 HG2 ARG 5 HG2 ARG 5 -0.061 -5.212 -6.331
34 HG3 ARG 5 HG3 ARG 5 1.079 -6.506 -6.705
35 HD2 ARG 5 HD2 ARG 5 -1.774 -6.440 -7.671
36 HD3 ARG 5 HD3 ARG 5 -0.405 -5.836 -8.604
37 HE ARG 5 HE ARG 5 -0.079 -8.548 -7.721
38 HH11 ARG 5 HH11 ARG 5 -1.420 -6.491 -10.189
39 HH12 ARG 5 HH12 ARG 5 -1.411 -7.724 -11.406
40 HH21 ARG 5 HH21 ARG 5 -0.062 -10.180 -9.314
41 HH22 ARG 5 HH22 ARG 5 -0.639 -9.823 -10.907
42 H TYR 6 H TYR 6 -4.175 -6.945 -5.422
43 HA TYR 6 HA TYR 6 -4.373 -9.333 -3.707
44 HB2 TYR 6 HB2 TYR 6 -6.817 -8.727 -3.468
45 HB3 TYR 6 HB3 TYR 6 -5.690 -7.653 -2.648
46 HD1 TYR 6 HD1 TYR 6 -5.605 -5.350 -3.172
47 HD2 TYR 6 HD2 TYR 6 -7.825 -7.998 -5.655
48 HE1 TYR 6 HE1 TYR 6 -6.588 -3.422 -4.340
49 HE2 TYR 6 HE2 TYR 6 -8.813 -6.077 -6.831
50 HH TYR 6 HH TYR 6 -7.881 -3.443 -7.161
51 H THR 7 H THR 7 -6.273 -10.749 -4.384
52 HA THR 7 HA THR 7 -6.613 -10.750 -7.305
53 HB THR 7 HB THR 7 -6.545 -13.453 -6.349
54 HG1 THR 7 HG1 THR 7 -4.717 -13.532 -5.259
55 HG21 THR 7 HG21 THR 7 -4.409 -12.280 -8.067
56 HG22 THR 7 HG22 THR 7 -6.069 -12.286 -8.664
57 HG23 THR 7 HG23 THR 7 -5.280 -13.803 -8.235
58 H TYR 8 H TYR 8 -8.309 -10.063 -4.903
59 HA TYR 8 HA TYR 8 -10.742 -11.140 -5.866
60 HB2 TYR 8 HB2 TYR 8 -11.381 -12.431 -3.843
61 HB3 TYR 8 HB3 TYR 8 -10.046 -13.163 -4.727
62 HD1 TYR 8 HD1 TYR 8 -11.167 -11.922 -1.568
63 HD2 TYR 8 HD2 TYR 8 -7.678 -12.745 -3.860
64 HE1 TYR 8 HE1 TYR 8 -9.825 -11.944 0.494
65 HE2 TYR 8 HE2 TYR 8 -6.327 -12.770 -1.805
66 HH TYR 8 HH TYR 8 -6.333 -12.138 0.411
67 H ARG 9 H ARG 9 -12.447 -10.833 -3.823
68 HA ARG 9 HA ARG 9 -12.005 -8.043 -2.995
69 HB2 ARG 9 HB2 ARG 9 -14.402 -9.550 -3.901
70 HB3 ARG 9 HB3 ARG 9 -14.646 -8.321 -2.667
71 HG2 ARG 9 HG2 ARG 9 -14.954 -7.038 -4.506
72 HG3 ARG 9 HG3 ARG 9 -13.203 -6.877 -4.359
73 HD2 ARG 9 HD2 ARG 9 -13.633 -7.365 -6.632
74 HD3 ARG 9 HD3 ARG 9 -13.012 -8.852 -5.916
75 HE ARG 9 HE ARG 9 -15.813 -8.878 -5.773
76 HH11 ARG 9 HH11 ARG 9 -13.254 -9.052 -8.127
77 HH12 ARG 9 HH12 ARG 9 -14.174 -10.001 -9.248
78 HH21 ARG 9 HH21 ARG 9 -17.034 -10.126 -7.240
79 HH22 ARG 9 HH22 ARG 9 -16.324 -10.610 -8.743
80 HA PRO 10 HA PRO 10 -11.841 -10.396 0.950
81 HB2 PRO 10 HB2 PRO 10 -10.058 -8.715 2.119
82 HB3 PRO 10 HB3 PRO 10 -9.573 -10.046 1.062
83 HG2 PRO 10 HG2 PRO 10 -9.858 -7.133 0.431
84 HG3 PRO 10 HG3 PRO 10 -8.578 -8.262 -0.050
85 HD2 PRO 10 HD2 PRO 10 -10.589 -7.545 -1.716
86 HD3 PRO 10 HD3 PRO 10 -9.832 -9.150 -1.768
87 H SER 11 H SER 11 -12.357 -9.684 3.147
88 HA SER 11 HA SER 11 -14.565 -7.944 3.215
89 HB2 SER 11 HB2 SER 11 -14.579 -9.582 4.884
90 HB3 SER 11 HB3 SER 11 -12.900 -9.280 5.330
91 HG SER 11 HG SER 11 -15.209 -8.013 6.156
92 H VAL 12 H VAL 12 -11.230 -7.526 4.367
93 HA VAL 12 HA VAL 12 -11.449 -4.661 3.971
94 HB VAL 12 HB VAL 12 -10.510 -4.215 6.284
95 HG11 VAL 12 HG11 VAL 12 -12.940 -3.927 5.440
96 HG12 VAL 12 HG12 VAL 12 -13.287 -5.317 6.469
97 HG13 VAL 12 HG13 VAL 12 -12.620 -3.843 7.172
98 HG21 VAL 12 HG21 VAL 12 -11.703 -6.898 6.946
99 HG22 VAL 12 HG22 VAL 12 -9.976 -6.645 6.696
100 HG23 VAL 12 HG23 VAL 12 -10.807 -5.815 8.011
101 HA PRO 13 HA PRO 13 -7.209 -5.050 2.897
102 HB2 PRO 13 HB2 PRO 13 -6.283 -2.576 3.520
103 HB3 PRO 13 HB3 PRO 13 -7.330 -2.888 2.130
104 HG2 PRO 13 HG2 PRO 13 -8.041 -1.829 4.839
105 HG3 PRO 13 HG3 PRO 13 -8.600 -1.290 3.244
106 HD2 PRO 13 HD2 PRO 13 -10.090 -2.884 4.848
107 HD3 PRO 13 HD3 PRO 13 -10.153 -2.984 3.076
108 H ALA 14 H ALA 14 -5.629 -6.091 3.922
109 HA ALA 14 HA ALA 14 -5.403 -6.371 6.675
110 HB1 ALA 14 HB1 ALA 14 -3.590 -7.699 6.265
111 HB2 ALA 14 HB2 ALA 14 -4.318 -7.679 4.658
112 HB3 ALA 14 HB3 ALA 14 -2.948 -6.629 5.018
113 H HIS 15 H HIS 15 -3.721 -4.146 4.495
114 HA HIS 15 HA HIS 15 -3.421 -2.127 6.406
115 HB2 HIS 15 HB2 HIS 15 -0.882 -2.278 6.635
116 HB3 HIS 15 HB3 HIS 15 -1.829 -3.422 7.582
117 HD1 HIS 15 HD1 HIS 15 -0.759 -3.704 3.948
118 HD2 HIS 15 HD2 HIS 15 -0.245 -5.626 7.595
119 HE1 HIS 15 HE1 HIS 15 0.553 -5.786 3.432
120 H ARG 16 H ARG 16 -2.031 -0.340 5.635
121 HA ARG 16 HA ARG 16 -1.585 -0.468 2.727
122 HB2 ARG 16 HB2 ARG 16 -2.574 1.981 4.183
123 HB3 ARG 16 HB3 ARG 16 -2.479 1.726 2.446
124 HG2 ARG 16 HG2 ARG 16 -4.178 -0.104 2.728
125 HG3 ARG 16 HG3 ARG 16 -4.377 0.448 4.392
126 HD2 ARG 16 HD2 ARG 16 -4.877 2.730 3.463
127 HD3 ARG 16 HD3 ARG 16 -4.910 1.992 1.862
128 HE ARG 16 HE ARG 16 -6.997 1.207 2.331
129 HH11 ARG 16 HH11 ARG 16 -5.390 1.948 5.329
130 HH12 ARG 16 HH12 ARG 16 -6.786 1.631 6.306
131 HH21 ARG 16 HH21 ARG 16 -8.841 0.787 3.606
132 HH22 ARG 16 HH22 ARG 16 -8.748 0.970 5.325
133 H ARG 17 H ARG 17 0.403 -0.956 4.636
134 HA ARG 17 HA ARG 17 2.314 1.061 3.890
135 HB2 ARG 17 HB2 ARG 17 1.134 1.004 6.586
136 HB3 ARG 17 HB3 ARG 17 2.892 1.034 6.558
137 HG2 ARG 17 HG2 ARG 17 2.791 3.035 5.104
138 HG3 ARG 17 HG3 ARG 17 1.035 3.028 5.280
139 HD2 ARG 17 HD2 ARG 17 1.113 3.710 7.460
140 HD3 ARG 17 HD3 ARG 17 2.683 2.962 7.750
141 HE ARG 17 HE ARG 17 2.189 5.639 6.879
142 HH11 ARG 17 HH11 ARG 17 4.455 3.000 6.740
143 HH12 ARG 17 HH12 ARG 17 5.826 4.021 6.454
144 HH21 ARG 17 HH21 ARG 17 3.985 6.993 6.503
145 HH22 ARG 17 HH22 ARG 17 5.557 6.292 6.321
146 H VAL 18 H VAL 18 4.489 0.521 5.142
147 HA VAL 18 HA VAL 18 5.018 -2.260 4.547
148 HB VAL 18 HB VAL 18 6.601 -0.485 3.862
149 HG11 VAL 18 HG11 VAL 18 7.781 0.841 5.336
150 HG12 VAL 18 HG12 VAL 18 6.203 0.754 6.121
151 HG13 VAL 18 HG13 VAL 18 7.531 -0.259 6.691
152 HG21 VAL 18 HG21 VAL 18 8.271 -1.993 5.734
153 HG22 VAL 18 HG22 VAL 18 7.159 -2.988 4.795
154 HG23 VAL 18 HG23 VAL 18 8.309 -1.935 3.972
155 H ARG 19 H ARG 19 4.583 -0.256 7.350
156 HA ARG 19 HA ARG 19 4.857 -2.626 9.046
157 HB2 ARG 19 HB2 ARG 19 6.233 0.020 9.501
158 HB3 ARG 19 HB3 ARG 19 6.001 -1.169 10.775
159 HG2 ARG 19 HG2 ARG 19 7.389 -1.859 8.209
160 HG3 ARG 19 HG3 ARG 19 8.246 -1.141 9.575
161 HD2 ARG 19 HD2 ARG 19 7.997 -3.006 10.887
162 HD3 ARG 19 HD3 ARG 19 6.523 -3.518 10.066
163 HE ARG 19 HE ARG 19 8.404 -3.820 8.158
164 HH11 ARG 19 HH11 ARG 19 8.198 -4.873 11.470
165 HH12 ARG 19 HH12 ARG 19 9.142 -6.303 11.211
166 HH21 ARG 19 HH21 ARG 19 9.648 -5.699 7.804
167 HH22 ARG 19 HH22 ARG 19 9.968 -6.771 9.126
168 H GLU 20 H GLU 20 2.482 -2.371 8.772
169 HA GLU 20 HA GLU 20 1.430 -0.448 10.741
170 HB2 GLU 20 HB2 GLU 20 0.876 -0.327 8.091
171 HB3 GLU 20 HB3 GLU 20 -0.412 -1.394 8.633
172 HG2 GLU 20 HG2 GLU 20 0.168 1.292 9.852
173 HG3 GLU 20 HG3 GLU 20 -1.014 1.018 8.574
174 H SER 21 H SER 21 0.626 -1.430 12.462
175 HA SER 21 HA SER 21 -0.479 -4.145 12.149
176 HB2 SER 21 HB2 SER 21 1.187 -2.895 14.290
177 HB3 SER 21 HB3 SER 21 0.019 -4.132 14.754
178 HG SER 21 HG SER 21 2.281 -4.766 14.094
179 HA PRO 22 HA PRO 22 -3.959 -1.332 13.392
180 HB2 PRO 22 HB2 PRO 22 -5.741 -2.376 11.630
181 HB3 PRO 22 HB3 PRO 22 -4.626 -1.071 11.209
182 HG2 PRO 22 HG2 PRO 22 -4.405 -4.004 10.653
183 HG3 PRO 22 HG3 PRO 22 -4.053 -2.633 9.584
184 HD2 PRO 22 HD2 PRO 22 -2.113 -4.000 10.888
185 HD3 PRO 22 HD3 PRO 22 -1.983 -2.266 10.529
186 H LEU 23 H LEU 23 -6.082 -1.949 14.256
187 HA LEU 23 HA LEU 23 -5.993 -4.646 15.415
188 HB2 LEU 23 HB2 LEU 23 -7.196 -2.056 16.315
189 HB3 LEU 23 HB3 LEU 23 -7.763 -3.588 16.975
190 HG LEU 23 HG LEU 23 -6.174 -2.597 18.487
191 HD11 LEU 23 HD11 LEU 23 -6.174 -5.117 17.918
192 HD12 LEU 23 HD12 LEU 23 -4.841 -4.454 18.863
193 HD13 LEU 23 HD13 LEU 23 -4.627 -4.777 17.143
194 HD21 LEU 23 HD21 LEU 23 -3.833 -2.831 16.755
195 HD22 LEU 23 HD22 LEU 23 -4.290 -1.553 17.882
196 HD23 LEU 23 HD23 LEU 23 -4.967 -1.578 16.253
197 H SER 24 H SER 24 -8.434 -2.286 14.314
198 HA SER 24 HA SER 24 -10.602 -3.987 14.158
199 HB2 SER 24 HB2 SER 24 -10.291 -1.952 12.000
200 HB3 SER 24 HB3 SER 24 -11.680 -2.297 13.029
201 HG SER 24 HG SER 24 -10.665 -0.303 13.554
202 H SER 25 H SER 25 -7.894 -3.666 11.989
203 HA SER 25 HA SER 25 -9.019 -5.009 9.763
204 HB2 SER 25 HB2 SER 25 -6.865 -3.560 9.911
205 HB3 SER 25 HB3 SER 25 -6.080 -5.063 10.393
206 HG SER 25 HG SER 25 -7.702 -5.011 8.100
207 H ASP 26 H ASP 26 -7.286 -6.096 12.622
208 HA ASP 26 HA ASP 26 -7.232 -8.847 11.690
209 HB2 ASP 26 HB2 ASP 26 -6.357 -7.644 14.325
210 HB3 ASP 26 HB3 ASP 26 -6.088 -9.311 13.825
211 H ALA 27 H ALA 27 -9.185 -6.797 13.661
212 HA ALA 27 HA ALA 27 -10.403 -8.638 15.363
213 HB1 ALA 27 HB1 ALA 27 -12.308 -6.688 14.453
214 HB2 ALA 27 HB2 ALA 27 -11.517 -6.834 16.023
215 HB3 ALA 27 HB3 ALA 27 -10.736 -5.935 14.722
216 H ILE 28 H ILE 28 -10.739 -8.185 11.960
217 HA ILE 28 HA ILE 28 -13.297 -9.177 11.493
218 HB ILE 28 HB ILE 28 -12.583 -9.703 9.255
219 HG12 ILE 28 HG12 ILE 28 -9.756 -9.383 10.287
220 HG13 ILE 28 HG13 ILE 28 -10.512 -10.902 9.821
221 HG21 ILE 28 HG21 ILE 28 -10.884 -7.445 9.267
222 HG22 ILE 28 HG22 ILE 28 -12.602 -7.518 8.877
223 HG23 ILE 28 HG23 ILE 28 -12.086 -7.207 10.535
224 HD11 ILE 28 HD11 ILE 28 -10.843 -9.346 7.588
225 HD12 ILE 28 HD12 ILE 28 -9.255 -8.862 8.184
226 HD13 ILE 28 HD13 ILE 28 -9.585 -10.558 7.833
227 H PHE 29 H PHE 29 -10.339 -10.839 12.309
228 HA PHE 29 HA PHE 29 -11.574 -13.445 11.829
229 HB2 PHE 29 HB2 PHE 29 -9.173 -12.867 11.139
230 HB3 PHE 29 HB3 PHE 29 -8.781 -12.965 12.852
231 HD1 PHE 29 HD1 PHE 29 -9.804 -14.850 9.886
232 HD2 PHE 29 HD2 PHE 29 -8.737 -15.077 14.001
233 HE1 PHE 29 HE1 PHE 29 -9.535 -17.287 9.679
234 HE2 PHE 29 HE2 PHE 29 -8.466 -17.514 13.799
235 HZ PHE 29 HZ PHE 29 -8.864 -18.622 11.636
236 H LYS 30 H LYS 30 -11.299 -11.213 14.289
237 HA LYS 30 HA LYS 30 -10.756 -12.680 16.576
238 HB2 LYS 30 HB2 LYS 30 -11.098 -10.199 16.440
239 HB3 LYS 30 HB3 LYS 30 -12.830 -10.494 16.350
240 HG2 LYS 30 HG2 LYS 30 -12.899 -11.351 18.545
241 HG3 LYS 30 HG3 LYS 30 -11.140 -11.478 18.630
242 HD2 LYS 30 HD2 LYS 30 -12.344 -8.801 18.135
243 HD3 LYS 30 HD3 LYS 30 -12.440 -9.474 19.764
244 HE2 LYS 30 HE2 LYS 30 -10.449 -8.335 19.878
245 HE3 LYS 30 HE3 LYS 30 -9.890 -9.936 19.395
246 HZ1 LYS 30 HZ1 LYS 30 -9.157 -7.735 18.145
247 HZ2 LYS 30 HZ2 LYS 30 -10.555 -8.073 17.255
248 HZ3 LYS 30 HZ3 LYS 30 -9.313 -9.219 17.347
249 H GLN 31 H GLN 31 -13.604 -12.649 14.578
250 HA GLN 31 HA GLN 31 -15.503 -13.684 16.323
251 HB2 GLN 31 HB2 GLN 31 -16.672 -14.493 14.342
252 HB3 GLN 31 HB3 GLN 31 -16.028 -12.881 14.062
253 HG2 GLN 31 HG2 GLN 31 -14.174 -13.820 12.804
254 HG3 GLN 31 HG3 GLN 31 -14.775 -15.448 13.114
255 HE21 GLN 31 HE21 GLN 31 -14.813 -12.848 11.013
256 HE22 GLN 31 HE22 GLN 31 -16.139 -13.333 10.018
257 H SER 32 H SER 32 -12.892 -15.276 14.617
258 HA SER 32 HA SER 32 -13.801 -17.934 15.231
259 HB2 SER 32 HB2 SER 32 -12.472 -17.595 13.233
260 HB3 SER 32 HB3 SER 32 -11.154 -16.907 14.181
261 HG SER 32 HG SER 32 -11.124 -19.269 13.519
262 H HIS 33 H HIS 33 -11.443 -15.668 16.550
263 HA HIS 33 HA HIS 33 -10.615 -17.575 18.586
264 HB2 HIS 33 HB2 HIS 33 -9.133 -15.802 17.328
265 HB3 HIS 33 HB3 HIS 33 -9.742 -14.712 18.570
266 HD1 HIS 33 HD1 HIS 33 -6.772 -15.302 18.502
267 HD2 HIS 33 HD2 HIS 33 -9.487 -17.535 20.717
268 HE1 HIS 33 HE1 HIS 33 -5.421 -16.393 20.321
Start of MODEL 5
1 H1 ASN 1 H ASN 1 2.701 2.113 -2.724
2 HA ASN 1 HA ASN 1 1.460 0.549 -0.710
3 HB2 ASN 1 HB2 ASN 1 0.403 -1.149 -2.133
4 HB3 ASN 1 HB3 ASN 1 -0.353 0.425 -2.362
5 HD21 ASN 1 HD21 ASN 1 0.429 1.697 -4.220
6 HD22 ASN 1 HD22 ASN 1 0.844 0.849 -5.667
7 H VAL 2 H VAL 2 2.599 -1.328 -0.271
8 HA VAL 2 HA VAL 2 4.889 -1.907 -2.031
9 HB VAL 2 HB VAL 2 5.517 -0.621 0.061
10 HG11 VAL 2 HG11 VAL 2 5.146 -3.216 1.512
11 HG12 VAL 2 HG12 VAL 2 5.406 -1.599 2.169
12 HG13 VAL 2 HG13 VAL 2 3.852 -2.021 1.448
13 HG21 VAL 2 HG21 VAL 2 7.554 -1.559 -0.058
14 HG22 VAL 2 HG22 VAL 2 6.946 -3.168 0.334
15 HG23 VAL 2 HG23 VAL 2 6.837 -2.562 -1.319
16 H ASP 3 H ASP 3 2.102 -3.095 -1.103
17 HA ASP 3 HA ASP 3 2.842 -5.807 -1.548
18 HB2 ASP 3 HB2 ASP 3 2.005 -6.687 0.639
19 HB3 ASP 3 HB3 ASP 3 3.509 -5.780 0.766
20 H VAL 4 H VAL 4 1.294 -5.661 -3.168
21 HA VAL 4 HA VAL 4 -1.494 -5.596 -2.214
22 HB VAL 4 HB VAL 4 -1.161 -3.579 -3.464
23 HG11 VAL 4 HG11 VAL 4 0.415 -3.446 -5.021
24 HG12 VAL 4 HG12 VAL 4 0.615 -5.199 -5.003
25 HG13 VAL 4 HG13 VAL 4 -0.568 -4.456 -6.080
26 HG21 VAL 4 HG21 VAL 4 -2.480 -5.445 -5.412
27 HG22 VAL 4 HG22 VAL 4 -3.221 -5.036 -3.865
28 HG23 VAL 4 HG23 VAL 4 -2.886 -3.768 -5.044
29 H ARG 5 H ARG 5 -2.315 -7.572 -2.355
30 HA ARG 5 HA ARG 5 -2.262 -9.008 -4.843
31 HB2 ARG 5 HB2 ARG 5 -1.364 -11.115 -3.702
32 HB3 ARG 5 HB3 ARG 5 -0.195 -9.874 -4.135
33 HG2 ARG 5 HG2 ARG 5 -0.173 -9.078 -1.831
34 HG3 ARG 5 HG3 ARG 5 -1.361 -10.306 -1.393
35 HD2 ARG 5 HD2 ARG 5 0.933 -10.966 -0.797
36 HD3 ARG 5 HD3 ARG 5 0.199 -12.066 -1.964
37 HE ARG 5 HE ARG 5 1.600 -10.182 -3.427
38 HH11 ARG 5 HH11 ARG 5 2.299 -12.624 -1.047
39 HH12 ARG 5 HH12 ARG 5 3.898 -12.930 -1.640
40 HH21 ARG 5 HH21 ARG 5 3.703 -10.576 -4.218
41 HH22 ARG 5 HH22 ARG 5 4.696 -11.764 -3.443
42 H TYR 6 H TYR 6 -4.397 -9.320 -4.965
43 HA TYR 6 HA TYR 6 -5.674 -10.911 -2.878
44 HB2 TYR 6 HB2 TYR 6 -7.667 -9.423 -2.877
45 HB3 TYR 6 HB3 TYR 6 -6.229 -8.648 -2.221
46 HD1 TYR 6 HD1 TYR 6 -5.330 -6.692 -3.218
47 HD2 TYR 6 HD2 TYR 6 -8.433 -8.838 -5.186
48 HE1 TYR 6 HE1 TYR 6 -5.608 -4.828 -4.798
49 HE2 TYR 6 HE2 TYR 6 -8.719 -6.980 -6.772
50 HH TYR 6 HH TYR 6 -8.276 -4.592 -6.908
51 H THR 7 H THR 7 -7.918 -11.601 -3.602
52 HA THR 7 HA THR 7 -8.077 -11.867 -6.525
53 HB THR 7 HB THR 7 -9.045 -14.263 -5.244
54 HG1 THR 7 HG1 THR 7 -7.005 -15.017 -4.507
55 HG21 THR 7 HG21 THR 7 -7.785 -15.345 -6.928
56 HG22 THR 7 HG22 THR 7 -6.688 -13.974 -7.095
57 HG23 THR 7 HG23 THR 7 -8.355 -13.844 -7.656
58 H TYR 8 H TYR 8 -9.520 -10.277 -4.437
59 HA TYR 8 HA TYR 8 -12.125 -10.535 -5.490
60 HB2 TYR 8 HB2 TYR 8 -13.341 -11.328 -3.552
61 HB3 TYR 8 HB3 TYR 8 -12.138 -12.529 -4.008
62 HD1 TYR 8 HD1 TYR 8 -13.506 -10.702 -1.331
63 HD2 TYR 8 HD2 TYR 8 -9.838 -12.331 -2.740
64 HE1 TYR 8 HE1 TYR 8 -12.619 -10.670 0.962
65 HE2 TYR 8 HE2 TYR 8 -8.940 -12.306 -0.451
66 HH TYR 8 HH TYR 8 -9.780 -12.301 1.856
67 H ARG 9 H ARG 9 -13.678 -9.408 -3.566
68 HA ARG 9 HA ARG 9 -12.303 -6.855 -3.061
69 HB2 ARG 9 HB2 ARG 9 -14.240 -6.826 -4.650
70 HB3 ARG 9 HB3 ARG 9 -15.275 -7.328 -3.320
71 HG2 ARG 9 HG2 ARG 9 -14.682 -5.278 -2.106
72 HG3 ARG 9 HG3 ARG 9 -13.694 -4.771 -3.478
73 HD2 ARG 9 HD2 ARG 9 -15.721 -3.652 -3.788
74 HD3 ARG 9 HD3 ARG 9 -15.824 -5.039 -4.870
75 HE ARG 9 HE ARG 9 -16.962 -5.816 -2.468
76 HH11 ARG 9 HH11 ARG 9 -17.545 -3.439 -4.943
77 HH12 ARG 9 HH12 ARG 9 -19.259 -3.409 -4.694
78 HH21 ARG 9 HH21 ARG 9 -19.217 -5.786 -2.130
79 HH22 ARG 9 HH22 ARG 9 -20.209 -4.744 -3.093
80 HA PRO 10 HA PRO 10 -13.035 -8.587 1.137
81 HB2 PRO 10 HB2 PRO 10 -10.774 -7.523 2.199
82 HB3 PRO 10 HB3 PRO 10 -10.797 -9.065 1.335
83 HG2 PRO 10 HG2 PRO 10 -9.996 -6.354 0.350
84 HG3 PRO 10 HG3 PRO 10 -9.210 -7.920 0.079
85 HD2 PRO 10 HD2 PRO 10 -10.805 -6.751 -1.771
86 HD3 PRO 10 HD3 PRO 10 -10.685 -8.513 -1.590
87 H SER 11 H SER 11 -13.278 -7.457 3.203
88 HA SER 11 HA SER 11 -14.679 -5.024 2.923
89 HB2 SER 11 HB2 SER 11 -13.826 -6.741 5.204
90 HB3 SER 11 HB3 SER 11 -14.298 -5.081 5.566
91 HG SER 11 HG SER 11 -15.897 -7.092 5.244
92 H VAL 12 H VAL 12 -11.528 -5.738 4.424
93 HA VAL 12 HA VAL 12 -10.554 -3.119 3.648
94 HB VAL 12 HB VAL 12 -9.716 -2.676 6.002
95 HG11 VAL 12 HG11 VAL 12 -11.840 -1.731 4.735
96 HG12 VAL 12 HG12 VAL 12 -12.684 -2.548 6.052
97 HG13 VAL 12 HG13 VAL 12 -11.489 -1.300 6.409
98 HG21 VAL 12 HG21 VAL 12 -11.952 -4.096 7.209
99 HG22 VAL 12 HG22 VAL 12 -10.750 -5.180 6.508
100 HG23 VAL 12 HG23 VAL 12 -10.267 -3.994 7.721
101 HA PRO 13 HA PRO 13 -6.744 -5.268 3.264
102 HB2 PRO 13 HB2 PRO 13 -4.967 -3.263 3.703
103 HB3 PRO 13 HB3 PRO 13 -5.928 -3.388 2.225
104 HG2 PRO 13 HG2 PRO 13 -6.389 -1.689 4.646
105 HG3 PRO 13 HG3 PRO 13 -6.548 -1.261 2.933
106 HD2 PRO 13 HD2 PRO 13 -8.681 -1.869 4.486
107 HD3 PRO 13 HD3 PRO 13 -8.627 -2.240 2.751
108 H ALA 14 H ALA 14 -4.741 -5.841 4.403
109 HA ALA 14 HA ALA 14 -5.215 -6.019 7.274
110 HB1 ALA 14 HB1 ALA 14 -4.644 -8.031 5.892
111 HB2 ALA 14 HB2 ALA 14 -3.029 -7.350 5.688
112 HB3 ALA 14 HB3 ALA 14 -3.610 -7.776 7.298
113 H HIS 15 H HIS 15 -2.778 -4.825 5.007
114 HA HIS 15 HA HIS 15 -1.945 -2.727 6.666
115 HB2 HIS 15 HB2 HIS 15 0.373 -3.576 7.187
116 HB3 HIS 15 HB3 HIS 15 -0.923 -4.334 8.108
117 HD1 HIS 15 HD1 HIS 15 -1.430 -6.823 7.616
118 HD2 HIS 15 HD2 HIS 15 1.734 -5.263 5.421
119 HE1 HIS 15 HE1 HIS 15 -0.264 -8.812 6.612
120 H ARG 16 H ARG 16 -0.842 -1.259 5.487
121 HA ARG 16 HA ARG 16 0.482 -2.152 3.023
122 HB2 ARG 16 HB2 ARG 16 -1.385 0.220 3.189
123 HB3 ARG 16 HB3 ARG 16 -0.517 -0.326 1.761
124 HG2 ARG 16 HG2 ARG 16 -1.869 -2.199 1.501
125 HG3 ARG 16 HG3 ARG 16 -2.445 -2.131 3.167
126 HD2 ARG 16 HD2 ARG 16 -4.267 -1.307 2.034
127 HD3 ARG 16 HD3 ARG 16 -3.409 0.183 2.426
128 HE ARG 16 HE ARG 16 -2.710 -0.933 -0.133
129 HH11 ARG 16 HH11 ARG 16 -4.903 1.149 1.593
130 HH12 ARG 16 HH12 ARG 16 -5.338 2.070 0.192
131 HH21 ARG 16 HH21 ARG 16 -3.274 0.273 -1.985
132 HH22 ARG 16 HH22 ARG 16 -4.412 1.570 -1.843
133 H ARG 17 H ARG 17 1.732 -1.510 5.442
134 HA ARG 17 HA ARG 17 3.474 0.605 4.556
135 HB2 ARG 17 HB2 ARG 17 1.469 1.053 6.667
136 HB3 ARG 17 HB3 ARG 17 3.107 1.528 7.095
137 HG2 ARG 17 HG2 ARG 17 3.197 2.901 5.036
138 HG3 ARG 17 HG3 ARG 17 1.505 2.495 4.738
139 HD2 ARG 17 HD2 ARG 17 0.748 3.793 6.463
140 HD3 ARG 17 HD3 ARG 17 2.231 3.605 7.397
141 HE ARG 17 HE ARG 17 3.101 5.448 6.338
142 HH11 ARG 17 HH11 ARG 17 0.223 4.400 4.683
143 HH12 ARG 17 HH12 ARG 17 0.136 5.805 3.671
144 HH21 ARG 17 HH21 ARG 17 2.998 7.301 5.012
145 HH22 ARG 17 HH22 ARG 17 1.716 7.454 3.859
146 H VAL 18 H VAL 18 5.116 1.045 6.505
147 HA VAL 18 HA VAL 18 6.159 -1.589 7.180
148 HB VAL 18 HB VAL 18 7.654 0.110 6.171
149 HG11 VAL 18 HG11 VAL 18 8.432 1.990 7.537
150 HG12 VAL 18 HG12 VAL 18 6.703 2.102 7.202
151 HG13 VAL 18 HG13 VAL 18 7.262 1.563 8.786
152 HG21 VAL 18 HG21 VAL 18 8.537 -0.529 8.976
153 HG22 VAL 18 HG22 VAL 18 8.433 -1.747 7.705
154 HG23 VAL 18 HG23 VAL 18 9.532 -0.379 7.527
155 H ARG 19 H ARG 19 4.676 1.151 8.703
156 HA ARG 19 HA ARG 19 4.954 -0.193 11.307
157 HB2 ARG 19 HB2 ARG 19 4.864 2.139 12.312
158 HB3 ARG 19 HB3 ARG 19 6.358 1.700 11.494
159 HG2 ARG 19 HG2 ARG 19 5.924 3.091 9.684
160 HG3 ARG 19 HG3 ARG 19 4.201 3.188 10.051
161 HD2 ARG 19 HD2 ARG 19 4.574 4.617 11.892
162 HD3 ARG 19 HD3 ARG 19 6.305 4.282 11.897
163 HE ARG 19 HE ARG 19 5.823 5.406 9.453
164 HH11 ARG 19 HH11 ARG 19 5.286 6.350 12.761
165 HH12 ARG 19 HH12 ARG 19 5.446 8.045 12.440
166 HH21 ARG 19 HH21 ARG 19 6.036 7.635 9.018
167 HH22 ARG 19 HH22 ARG 19 5.872 8.775 10.311
168 H GLU 20 H GLU 20 2.836 -0.782 9.728
169 HA GLU 20 HA GLU 20 0.630 0.560 11.129
170 HB2 GLU 20 HB2 GLU 20 1.026 1.231 8.624
171 HB3 GLU 20 HB3 GLU 20 0.271 -0.321 8.290
172 HG2 GLU 20 HG2 GLU 20 -1.106 1.506 10.175
173 HG3 GLU 20 HG3 GLU 20 -1.119 1.921 8.462
174 H SER 21 H SER 21 0.845 -1.351 12.499
175 HA SER 21 HA SER 21 -0.378 -3.741 11.281
176 HB2 SER 21 HB2 SER 21 0.737 -5.070 13.017
177 HB3 SER 21 HB3 SER 21 1.917 -4.144 12.089
178 HG SER 21 HG SER 21 1.722 -2.548 13.845
179 HA PRO 22 HA PRO 22 -3.399 -1.965 14.329
180 HB2 PRO 22 HB2 PRO 22 -5.560 -2.264 12.713
181 HB3 PRO 22 HB3 PRO 22 -4.519 -0.835 12.672
182 HG2 PRO 22 HG2 PRO 22 -4.529 -3.225 10.868
183 HG3 PRO 22 HG3 PRO 22 -4.373 -1.508 10.451
184 HD2 PRO 22 HD2 PRO 22 -2.242 -3.174 10.588
185 HD3 PRO 22 HD3 PRO 22 -2.134 -1.450 10.997
186 H LEU 23 H LEU 23 -5.241 -3.035 15.325
187 HA LEU 23 HA LEU 23 -5.037 -5.957 15.101
188 HB2 LEU 23 HB2 LEU 23 -5.833 -4.115 17.327
189 HB3 LEU 23 HB3 LEU 23 -6.287 -5.817 17.353
190 HG LEU 23 HG LEU 23 -4.324 -5.500 18.700
191 HD11 LEU 23 HD11 LEU 23 -4.584 -7.434 16.914
192 HD12 LEU 23 HD12 LEU 23 -3.144 -7.284 17.920
193 HD13 LEU 23 HD13 LEU 23 -3.125 -6.690 16.260
194 HD21 LEU 23 HD21 LEU 23 -3.681 -3.495 16.947
195 HD22 LEU 23 HD22 LEU 23 -2.502 -4.745 16.549
196 HD23 LEU 23 HD23 LEU 23 -2.622 -4.140 18.201
197 H SER 24 H SER 24 -7.489 -3.437 15.694
198 HA SER 24 HA SER 24 -9.761 -4.980 15.424
199 HB2 SER 24 HB2 SER 24 -9.538 -2.159 14.367
200 HB3 SER 24 HB3 SER 24 -10.965 -2.956 15.030
201 HG SER 24 HG SER 24 -9.301 -1.469 16.338
202 H SER 25 H SER 25 -7.616 -3.769 12.958
203 HA SER 25 HA SER 25 -9.324 -4.139 10.734
204 HB2 SER 25 HB2 SER 25 -6.300 -4.148 10.880
205 HB3 SER 25 HB3 SER 25 -7.242 -4.043 9.393
206 HG SER 25 HG SER 25 -6.570 -1.984 10.176
207 H ASP 26 H ASP 26 -7.089 -6.253 12.435
208 HA ASP 26 HA ASP 26 -7.471 -8.404 10.523
209 HB2 ASP 26 HB2 ASP 26 -5.894 -8.213 13.094
210 HB3 ASP 26 HB3 ASP 26 -5.992 -9.678 12.121
211 H ALA 27 H ALA 27 -8.783 -7.330 13.526
212 HA ALA 27 HA ALA 27 -9.752 -9.710 14.607
213 HB1 ALA 27 HB1 ALA 27 -10.109 -6.915 15.056
214 HB2 ALA 27 HB2 ALA 27 -11.682 -7.712 15.099
215 HB3 ALA 27 HB3 ALA 27 -10.386 -8.261 16.161
216 H ILE 28 H ILE 28 -10.768 -7.949 11.823
217 HA ILE 28 HA ILE 28 -13.441 -8.695 11.607
218 HB ILE 28 HB ILE 28 -13.268 -8.282 9.243
219 HG12 ILE 28 HG12 ILE 28 -10.269 -8.381 9.637
220 HG13 ILE 28 HG13 ILE 28 -11.235 -9.595 8.806
221 HG21 ILE 28 HG21 ILE 28 -11.417 -6.205 9.739
222 HG22 ILE 28 HG22 ILE 28 -13.178 -6.127 9.754
223 HG23 ILE 28 HG23 ILE 28 -12.299 -6.496 11.238
224 HD11 ILE 28 HD11 ILE 28 -10.306 -6.958 7.892
225 HD12 ILE 28 HD12 ILE 28 -10.572 -8.451 6.990
226 HD13 ILE 28 HD13 ILE 28 -11.938 -7.418 7.409
227 H PHE 29 H PHE 29 -10.527 -10.519 11.014
228 HA PHE 29 HA PHE 29 -12.049 -12.732 9.859
229 HB2 PHE 29 HB2 PHE 29 -9.816 -11.914 8.909
230 HB3 PHE 29 HB3 PHE 29 -9.071 -12.664 10.316
231 HD1 PHE 29 HD1 PHE 29 -10.872 -13.267 7.186
232 HD2 PHE 29 HD2 PHE 29 -8.933 -15.052 10.528
233 HE1 PHE 29 HE1 PHE 29 -10.849 -15.429 6.013
234 HE2 PHE 29 HE2 PHE 29 -8.906 -17.217 9.360
235 HZ PHE 29 HZ PHE 29 -9.864 -17.408 7.099
236 H LYS 30 H LYS 30 -11.071 -11.655 12.857
237 HA LYS 30 HA LYS 30 -10.187 -13.922 14.197
238 HB2 LYS 30 HB2 LYS 30 -10.212 -11.665 15.180
239 HB3 LYS 30 HB3 LYS 30 -11.968 -11.721 15.261
240 HG2 LYS 30 HG2 LYS 30 -11.689 -13.770 16.730
241 HG3 LYS 30 HG3 LYS 30 -9.982 -13.334 16.829
242 HD2 LYS 30 HD2 LYS 30 -12.270 -11.519 17.585
243 HD3 LYS 30 HD3 LYS 30 -11.324 -12.476 18.728
244 HE2 LYS 30 HE2 LYS 30 -9.337 -11.262 18.210
245 HE3 LYS 30 HE3 LYS 30 -10.116 -10.453 16.851
246 HZ1 LYS 30 HZ1 LYS 30 -11.703 -9.832 18.968
247 HZ2 LYS 30 HZ2 LYS 30 -10.528 -8.824 18.288
248 HZ3 LYS 30 HZ3 LYS 30 -10.149 -9.776 19.634
249 H GLN 31 H GLN 31 -13.352 -13.108 13.043
250 HA GLN 31 HA GLN 31 -15.001 -14.633 14.648
251 HB2 GLN 31 HB2 GLN 31 -15.717 -13.109 12.790
252 HB3 GLN 31 HB3 GLN 31 -15.265 -14.370 11.651
253 HG2 GLN 31 HG2 GLN 31 -17.466 -14.843 11.827
254 HG3 GLN 31 HG3 GLN 31 -16.882 -15.805 13.184
255 HE21 GLN 31 HE21 GLN 31 -19.487 -15.017 13.079
256 HE22 GLN 31 HE22 GLN 31 -19.794 -13.831 14.298
257 H SER 32 H SER 32 -12.764 -15.660 12.180
258 HA SER 32 HA SER 32 -13.788 -18.350 12.042
259 HB2 SER 32 HB2 SER 32 -12.699 -17.331 10.089
260 HB3 SER 32 HB3 SER 32 -11.195 -17.182 10.998
261 HG SER 32 HG SER 32 -12.236 -19.340 9.710
262 H HIS 33 H HIS 33 -11.251 -16.648 13.752
263 HA HIS 33 HA HIS 33 -10.003 -19.038 14.754
264 HB2 HIS 33 HB2 HIS 33 -8.797 -16.863 14.391
265 HB3 HIS 33 HB3 HIS 33 -9.681 -16.208 15.766
266 HD1 HIS 33 HD1 HIS 33 -7.828 -19.512 15.362
267 HD2 HIS 33 HD2 HIS 33 -7.902 -16.146 17.796
268 HE1 HIS 33 HE1 HIS 33 -6.140 -19.954 17.173
Start of MODEL 6
1 H1 ASN 1 H ASN 1 1.619 -3.757 4.125
2 HA ASN 1 HA ASN 1 3.664 -2.704 2.318
3 HB2 ASN 1 HB2 ASN 1 4.023 -5.025 1.406
4 HB3 ASN 1 HB3 ASN 1 4.662 -4.764 3.026
5 HD21 ASN 1 HD21 ASN 1 3.907 -5.954 4.687
6 HD22 ASN 1 HD22 ASN 1 2.709 -7.188 4.532
7 H VAL 2 H VAL 2 2.723 -1.981 0.535
8 HA VAL 2 HA VAL 2 -0.005 -2.274 -0.027
9 HB VAL 2 HB VAL 2 2.162 -1.543 -1.999
10 HG11 VAL 2 HG11 VAL 2 0.410 -0.359 -3.178
11 HG12 VAL 2 HG12 VAL 2 -0.040 -2.054 -2.984
12 HG13 VAL 2 HG13 VAL 2 -0.766 -0.824 -1.950
13 HG21 VAL 2 HG21 VAL 2 1.456 0.821 -1.345
14 HG22 VAL 2 HG22 VAL 2 0.732 0.083 0.083
15 HG23 VAL 2 HG23 VAL 2 2.466 -0.064 -0.202
16 H ASP 3 H ASP 3 -0.824 -4.273 -0.319
17 HA ASP 3 HA ASP 3 0.538 -6.156 -2.084
18 HB2 ASP 3 HB2 ASP 3 -0.342 -6.952 0.088
19 HB3 ASP 3 HB3 ASP 3 -1.970 -6.522 -0.430
20 H VAL 4 H VAL 4 -0.157 -6.716 -4.070
21 HA VAL 4 HA VAL 4 -2.609 -5.408 -5.053
22 HB VAL 4 HB VAL 4 -0.391 -4.688 -6.065
23 HG11 VAL 4 HG11 VAL 4 0.889 -6.092 -7.314
24 HG12 VAL 4 HG12 VAL 4 0.232 -7.272 -6.178
25 HG13 VAL 4 HG13 VAL 4 -0.479 -7.101 -7.784
26 HG21 VAL 4 HG21 VAL 4 -1.485 -5.289 -8.491
27 HG22 VAL 4 HG22 VAL 4 -2.871 -5.464 -7.414
28 HG23 VAL 4 HG23 VAL 4 -1.979 -3.943 -7.464
29 H ARG 5 H ARG 5 -2.229 -8.094 -3.773
30 HA ARG 5 HA ARG 5 -3.253 -9.743 -5.990
31 HB2 ARG 5 HB2 ARG 5 -1.533 -10.455 -3.632
32 HB3 ARG 5 HB3 ARG 5 -2.511 -11.678 -4.432
33 HG2 ARG 5 HG2 ARG 5 -1.296 -11.542 -6.405
34 HG3 ARG 5 HG3 ARG 5 -0.641 -9.954 -6.004
35 HD2 ARG 5 HD2 ARG 5 1.029 -11.765 -5.809
36 HD3 ARG 5 HD3 ARG 5 0.756 -10.912 -4.290
37 HE ARG 5 HE ARG 5 -0.843 -13.283 -4.603
38 HH11 ARG 5 HH11 ARG 5 2.213 -12.000 -3.539
39 HH12 ARG 5 HH12 ARG 5 2.534 -13.311 -2.453
40 HH21 ARG 5 HH21 ARG 5 -0.432 -15.015 -3.177
41 HH22 ARG 5 HH22 ARG 5 1.029 -15.026 -2.248
42 H TYR 6 H TYR 6 -5.419 -9.360 -5.733
43 HA TYR 6 HA TYR 6 -6.588 -10.254 -3.180
44 HB2 TYR 6 HB2 TYR 6 -8.429 -8.641 -3.564
45 HB3 TYR 6 HB3 TYR 6 -6.869 -7.849 -3.368
46 HD1 TYR 6 HD1 TYR 6 -5.857 -6.634 -5.182
47 HD2 TYR 6 HD2 TYR 6 -9.520 -8.719 -5.763
48 HE1 TYR 6 HE1 TYR 6 -6.185 -5.451 -7.313
49 HE2 TYR 6 HE2 TYR 6 -9.858 -7.543 -7.896
50 HH TYR 6 HH TYR 6 -8.793 -6.291 -9.498
51 H THR 7 H THR 7 -8.820 -11.072 -3.380
52 HA THR 7 HA THR 7 -9.451 -12.153 -6.035
53 HB THR 7 HB THR 7 -10.182 -14.137 -4.149
54 HG1 THR 7 HG1 THR 7 -8.548 -14.231 -2.815
55 HG21 THR 7 HG21 THR 7 -7.820 -14.351 -5.985
56 HG22 THR 7 HG22 THR 7 -9.455 -14.225 -6.634
57 HG23 THR 7 HG23 THR 7 -9.026 -15.570 -5.577
58 H TYR 8 H TYR 8 -10.524 -10.066 -4.085
59 HA TYR 8 HA TYR 8 -13.267 -10.463 -4.640
60 HB2 TYR 8 HB2 TYR 8 -14.144 -10.802 -2.408
61 HB3 TYR 8 HB3 TYR 8 -13.023 -12.103 -2.789
62 HD1 TYR 8 HD1 TYR 8 -13.949 -9.722 -0.371
63 HD2 TYR 8 HD2 TYR 8 -10.547 -11.708 -1.980
64 HE1 TYR 8 HE1 TYR 8 -12.699 -9.238 1.691
65 HE2 TYR 8 HE2 TYR 8 -9.288 -11.230 0.078
66 HH TYR 8 HH TYR 8 -10.645 -9.222 2.638
67 H ARG 9 H ARG 9 -14.493 -8.918 -2.771
68 HA ARG 9 HA ARG 9 -13.073 -6.354 -3.042
69 HB2 ARG 9 HB2 ARG 9 -15.424 -5.385 -2.766
70 HB3 ARG 9 HB3 ARG 9 -15.064 -6.199 -4.283
71 HG2 ARG 9 HG2 ARG 9 -16.201 -8.208 -3.471
72 HG3 ARG 9 HG3 ARG 9 -16.572 -7.378 -1.958
73 HD2 ARG 9 HD2 ARG 9 -18.524 -7.085 -3.154
74 HD3 ARG 9 HD3 ARG 9 -17.652 -5.595 -3.511
75 HE ARG 9 HE ARG 9 -17.142 -7.647 -5.433
76 HH11 ARG 9 HH11 ARG 9 -19.398 -5.172 -4.482
77 HH12 ARG 9 HH12 ARG 9 -20.039 -4.960 -6.078
78 HH21 ARG 9 HH21 ARG 9 -17.978 -7.378 -7.539
79 HH22 ARG 9 HH22 ARG 9 -19.231 -6.216 -7.815
80 HA PRO 10 HA PRO 10 -13.096 -7.152 1.488
81 HB2 PRO 10 HB2 PRO 10 -10.700 -5.953 1.923
82 HB3 PRO 10 HB3 PRO 10 -10.852 -7.640 1.418
83 HG2 PRO 10 HG2 PRO 10 -10.243 -5.217 -0.230
84 HG3 PRO 10 HG3 PRO 10 -9.500 -6.826 -0.290
85 HD2 PRO 10 HD2 PRO 10 -11.385 -6.025 -2.061
86 HD3 PRO 10 HD3 PRO 10 -11.224 -7.714 -1.537
87 H SER 11 H SER 11 -13.007 -5.611 3.282
88 HA SER 11 HA SER 11 -14.329 -3.160 2.605
89 HB2 SER 11 HB2 SER 11 -14.865 -4.521 4.639
90 HB3 SER 11 HB3 SER 11 -13.307 -4.044 5.313
91 HG SER 11 HG SER 11 -15.208 -2.739 5.916
92 H VAL 12 H VAL 12 -11.495 -3.650 4.709
93 HA VAL 12 HA VAL 12 -10.234 -1.319 3.429
94 HB VAL 12 HB VAL 12 -9.301 -0.744 5.714
95 HG11 VAL 12 HG11 VAL 12 -10.806 0.881 5.600
96 HG12 VAL 12 HG12 VAL 12 -11.772 -0.101 4.497
97 HG13 VAL 12 HG13 VAL 12 -12.046 -0.199 6.237
98 HG21 VAL 12 HG21 VAL 12 -11.617 -2.017 7.010
99 HG22 VAL 12 HG22 VAL 12 -10.337 -3.117 6.495
100 HG23 VAL 12 HG23 VAL 12 -9.969 -1.790 7.597
101 HA PRO 13 HA PRO 13 -6.596 -3.759 3.131
102 HB2 PRO 13 HB2 PRO 13 -4.671 -1.859 3.362
103 HB3 PRO 13 HB3 PRO 13 -5.683 -2.032 1.922
104 HG2 PRO 13 HG2 PRO 13 -5.952 -0.117 4.208
105 HG3 PRO 13 HG3 PRO 13 -6.131 0.183 2.469
106 HD2 PRO 13 HD2 PRO 13 -8.254 -0.143 4.118
107 HD3 PRO 13 HD3 PRO 13 -8.277 -0.655 2.418
108 H ALA 14 H ALA 14 -5.677 -5.071 4.568
109 HA ALA 14 HA ALA 14 -5.762 -4.788 7.311
110 HB1 ALA 14 HB1 ALA 14 -5.155 -6.827 5.782
111 HB2 ALA 14 HB2 ALA 14 -3.500 -6.306 6.101
112 HB3 ALA 14 HB3 ALA 14 -4.562 -6.740 7.441
113 H HIS 15 H HIS 15 -3.177 -3.867 5.079
114 HA HIS 15 HA HIS 15 -2.247 -1.759 6.669
115 HB2 HIS 15 HB2 HIS 15 0.011 -2.794 7.265
116 HB3 HIS 15 HB3 HIS 15 -1.368 -3.289 8.242
117 HD1 HIS 15 HD1 HIS 15 -0.123 -4.647 4.911
118 HD2 HIS 15 HD2 HIS 15 -0.914 -5.896 8.794
119 HE1 HIS 15 HE1 HIS 15 0.266 -7.132 4.910
120 H ARG 16 H ARG 16 -0.508 -0.618 5.705
121 HA ARG 16 HA ARG 16 0.693 -1.672 3.288
122 HB2 ARG 16 HB2 ARG 16 -0.055 0.306 1.938
123 HB3 ARG 16 HB3 ARG 16 -1.334 -0.833 2.337
124 HG2 ARG 16 HG2 ARG 16 -2.295 0.610 3.899
125 HG3 ARG 16 HG3 ARG 16 -0.841 1.604 4.008
126 HD2 ARG 16 HD2 ARG 16 -1.198 2.424 1.757
127 HD3 ARG 16 HD3 ARG 16 -2.592 1.362 1.565
128 HE ARG 16 HE ARG 16 -3.850 2.921 2.649
129 HH11 ARG 16 HH11 ARG 16 -0.504 3.444 3.455
130 HH12 ARG 16 HH12 ARG 16 -0.812 4.889 4.359
131 HH21 ARG 16 HH21 ARG 16 -4.268 4.823 3.837
132 HH22 ARG 16 HH22 ARG 16 -2.954 5.673 4.576
133 H ARG 17 H ARG 17 1.831 -0.967 5.736
134 HA ARG 17 HA ARG 17 3.694 1.071 4.852
135 HB2 ARG 17 HB2 ARG 17 1.748 1.482 7.053
136 HB3 ARG 17 HB3 ARG 17 3.400 2.004 7.357
137 HG2 ARG 17 HG2 ARG 17 3.330 3.416 5.371
138 HG3 ARG 17 HG3 ARG 17 1.680 2.881 5.046
139 HD2 ARG 17 HD2 ARG 17 0.826 3.994 6.913
140 HD3 ARG 17 HD3 ARG 17 2.413 4.137 7.666
141 HE ARG 17 HE ARG 17 2.574 5.574 5.329
142 HH11 ARG 17 HH11 ARG 17 0.608 5.649 8.201
143 HH12 ARG 17 HH12 ARG 17 0.344 7.360 8.133
144 HH21 ARG 17 HH21 ARG 17 2.233 7.828 5.228
145 HH22 ARG 17 HH22 ARG 17 1.267 8.598 6.441
146 H VAL 18 H VAL 18 5.362 1.403 6.785
147 HA VAL 18 HA VAL 18 6.340 -1.266 7.380
148 HB VAL 18 HB VAL 18 7.911 0.377 6.480
149 HG11 VAL 18 HG11 VAL 18 8.627 2.291 7.844
150 HG12 VAL 18 HG12 VAL 18 6.926 2.403 7.390
151 HG13 VAL 18 HG13 VAL 18 7.374 1.908 9.023
152 HG21 VAL 18 HG21 VAL 18 9.716 -0.087 7.924
153 HG22 VAL 18 HG22 VAL 18 8.668 -0.160 9.341
154 HG23 VAL 18 HG23 VAL 18 8.594 -1.434 8.124
155 H ARG 19 H ARG 19 4.898 1.434 9.018
156 HA ARG 19 HA ARG 19 5.115 -0.043 11.557
157 HB2 ARG 19 HB2 ARG 19 5.393 2.917 11.063
158 HB3 ARG 19 HB3 ARG 19 5.021 2.263 12.652
159 HG2 ARG 19 HG2 ARG 19 7.107 0.931 12.539
160 HG3 ARG 19 HG3 ARG 19 7.490 1.734 11.015
161 HD2 ARG 19 HD2 ARG 19 6.901 3.309 13.498
162 HD3 ARG 19 HD3 ARG 19 8.512 2.662 13.190
163 HE ARG 19 HE ARG 19 7.819 3.996 10.895
164 HH11 ARG 19 HH11 ARG 19 8.141 4.811 14.264
165 HH12 ARG 19 HH12 ARG 19 8.588 6.457 13.958
166 HH21 ARG 19 HH21 ARG 19 8.406 6.160 10.479
167 HH22 ARG 19 HH22 ARG 19 8.737 7.223 11.804
168 H GLU 20 H GLU 20 3.016 -0.750 10.264
169 HA GLU 20 HA GLU 20 0.813 0.772 11.469
170 HB2 GLU 20 HB2 GLU 20 1.143 1.167 8.935
171 HB3 GLU 20 HB3 GLU 20 0.529 -0.470 8.747
172 HG2 GLU 20 HG2 GLU 20 -1.415 0.669 8.540
173 HG3 GLU 20 HG3 GLU 20 -1.402 0.462 10.290
174 H SER 21 H SER 21 -0.676 -0.444 12.480
175 HA SER 21 HA SER 21 -1.130 -3.201 11.800
176 HB2 SER 21 HB2 SER 21 -0.529 -4.061 14.073
177 HB3 SER 21 HB3 SER 21 0.862 -3.522 13.131
178 HG SER 21 HG SER 21 1.121 -2.618 15.107
179 HA PRO 22 HA PRO 22 -4.687 -0.875 13.677
180 HB2 PRO 22 HB2 PRO 22 -6.445 -1.508 11.707
181 HB3 PRO 22 HB3 PRO 22 -5.370 -0.108 11.621
182 HG2 PRO 22 HG2 PRO 22 -5.066 -2.808 10.366
183 HG3 PRO 22 HG3 PRO 22 -4.758 -1.208 9.666
184 HD2 PRO 22 HD2 PRO 22 -2.774 -2.795 10.603
185 HD3 PRO 22 HD3 PRO 22 -2.696 -1.023 10.679
186 H LEU 23 H LEU 23 -7.117 -1.904 13.625
187 HA LEU 23 HA LEU 23 -6.818 -4.409 15.032
188 HB2 LEU 23 HB2 LEU 23 -9.112 -2.544 14.526
189 HB3 LEU 23 HB3 LEU 23 -9.364 -4.134 15.244
190 HG LEU 23 HG LEU 23 -9.302 -2.497 16.992
191 HD11 LEU 23 HD11 LEU 23 -8.044 -4.747 17.176
192 HD12 LEU 23 HD12 LEU 23 -7.787 -3.517 18.413
193 HD13 LEU 23 HD13 LEU 23 -6.590 -3.749 17.139
194 HD21 LEU 23 HD21 LEU 23 -6.527 -1.666 16.678
195 HD22 LEU 23 HD22 LEU 23 -7.965 -0.708 17.034
196 HD23 LEU 23 HD23 LEU 23 -7.570 -1.118 15.365
197 H SER 24 H SER 24 -8.623 -3.269 12.185
198 HA SER 24 HA SER 24 -9.838 -5.630 11.439
199 HB2 SER 24 HB2 SER 24 -10.461 -3.715 10.222
200 HB3 SER 24 HB3 SER 24 -8.790 -3.315 9.824
201 HG SER 24 HG SER 24 -8.849 -4.659 8.190
202 H SER 25 H SER 25 -6.504 -4.670 11.096
203 HA SER 25 HA SER 25 -5.593 -6.393 9.143
204 HB2 SER 25 HB2 SER 25 -3.406 -6.164 10.112
205 HB3 SER 25 HB3 SER 25 -4.249 -4.632 10.343
206 HG SER 25 HG SER 25 -3.634 -6.628 12.229
207 H ASP 26 H ASP 26 -5.894 -7.034 12.629
208 HA ASP 26 HA ASP 26 -5.278 -9.846 12.206
209 HB2 ASP 26 HB2 ASP 26 -5.707 -8.139 14.646
210 HB3 ASP 26 HB3 ASP 26 -5.676 -9.897 14.759
211 H ALA 27 H ALA 27 -8.014 -7.785 12.647
212 HA ALA 27 HA ALA 27 -9.897 -9.564 13.675
213 HB1 ALA 27 HB1 ALA 27 -10.018 -6.999 13.090
214 HB2 ALA 27 HB2 ALA 27 -10.743 -7.607 11.600
215 HB3 ALA 27 HB3 ALA 27 -11.475 -7.992 13.158
216 H ILE 28 H ILE 28 -8.437 -9.418 10.554
217 HA ILE 28 HA ILE 28 -10.364 -10.637 8.957
218 HB ILE 28 HB ILE 28 -8.587 -11.284 7.469
219 HG12 ILE 28 HG12 ILE 28 -6.703 -10.660 9.754
220 HG13 ILE 28 HG13 ILE 28 -7.073 -12.267 9.139
221 HG21 ILE 28 HG21 ILE 28 -7.195 -8.908 8.093
222 HG22 ILE 28 HG22 ILE 28 -8.470 -9.144 6.900
223 HG23 ILE 28 HG23 ILE 28 -8.881 -8.661 8.545
224 HD11 ILE 28 HD11 ILE 28 -6.200 -11.361 6.893
225 HD12 ILE 28 HD12 ILE 28 -5.473 -10.088 7.874
226 HD13 ILE 28 HD13 ILE 28 -5.043 -11.775 8.157
227 H PHE 29 H PHE 29 -8.209 -11.994 11.342
228 HA PHE 29 HA PHE 29 -8.953 -14.718 10.585
229 HB2 PHE 29 HB2 PHE 29 -6.556 -14.019 11.154
230 HB3 PHE 29 HB3 PHE 29 -7.097 -13.937 12.827
231 HD1 PHE 29 HD1 PHE 29 -6.425 -16.150 9.988
232 HD2 PHE 29 HD2 PHE 29 -7.581 -15.927 14.078
233 HE1 PHE 29 HE1 PHE 29 -6.031 -18.567 10.227
234 HE2 PHE 29 HE2 PHE 29 -7.188 -18.343 14.324
235 HZ PHE 29 HZ PHE 29 -6.411 -19.667 12.398
236 H LYS 30 H LYS 30 -10.041 -12.282 12.583
237 HA LYS 30 HA LYS 30 -10.713 -13.497 14.974
238 HB2 LYS 30 HB2 LYS 30 -11.037 -11.104 14.520
239 HB3 LYS 30 HB3 LYS 30 -12.343 -11.489 13.407
240 HG2 LYS 30 HG2 LYS 30 -13.760 -12.192 15.134
241 HG3 LYS 30 HG3 LYS 30 -12.431 -12.311 16.289
242 HD2 LYS 30 HD2 LYS 30 -13.074 -9.674 15.040
243 HD3 LYS 30 HD3 LYS 30 -14.064 -10.274 16.373
244 HE2 LYS 30 HE2 LYS 30 -11.062 -10.060 16.493
245 HE3 LYS 30 HE3 LYS 30 -12.149 -8.781 17.032
246 HZ1 LYS 30 HZ1 LYS 30 -11.913 -9.867 18.980
247 HZ2 LYS 30 HZ2 LYS 30 -11.560 -11.355 18.258
248 HZ3 LYS 30 HZ3 LYS 30 -13.163 -10.824 18.361
249 H GLN 31 H GLN 31 -12.120 -13.903 11.817
250 HA GLN 31 HA GLN 31 -14.592 -15.009 12.523
251 HB2 GLN 31 HB2 GLN 31 -12.830 -15.151 10.121
252 HB3 GLN 31 HB3 GLN 31 -14.165 -16.290 10.240
253 HG2 GLN 31 HG2 GLN 31 -14.386 -13.289 10.336
254 HG3 GLN 31 HG3 GLN 31 -14.790 -14.320 8.964
255 HE21 GLN 31 HE21 GLN 31 -16.186 -16.329 10.009
256 HE22 GLN 31 HE22 GLN 31 -17.621 -15.761 10.786
257 H SER 32 H SER 32 -11.389 -16.426 12.324
258 HA SER 32 HA SER 32 -12.371 -19.118 12.721
259 HB2 SER 32 HB2 SER 32 -9.590 -17.944 12.581
260 HB3 SER 32 HB3 SER 32 -9.898 -19.653 12.887
261 HG SER 32 HG SER 32 -10.711 -18.179 10.600
262 H HIS 33 H HIS 33 -10.435 -16.786 14.588
263 HA HIS 33 HA HIS 33 -10.110 -18.291 16.900
264 HB2 HIS 33 HB2 HIS 33 -9.182 -15.929 16.195
265 HB3 HIS 33 HB3 HIS 33 -10.571 -15.342 17.106
266 HD1 HIS 33 HD1 HIS 33 -7.168 -15.819 17.602
267 HD2 HIS 33 HD2 HIS 33 -10.517 -16.914 19.803
268 HE1 HIS 33 HE1 HIS 33 -6.338 -16.198 19.946
Start of MODEL 7
1 H1 ASN 1 H ASN 1 2.754 -4.316 0.245
2 HA ASN 1 HA ASN 1 1.489 -2.007 0.334
3 HB2 ASN 1 HB2 ASN 1 2.111 -1.640 -2.138
4 HB3 ASN 1 HB3 ASN 1 3.408 -2.055 -1.022
5 HD21 ASN 1 HD21 ASN 1 4.693 -3.666 -1.566
6 HD22 ASN 1 HD22 ASN 1 4.362 -4.863 -2.767
7 H VAL 2 H VAL 2 -0.594 -3.899 0.491
8 HA VAL 2 HA VAL 2 -2.175 -3.953 -1.867
9 HB VAL 2 HB VAL 2 -2.534 -5.600 -0.126
10 HG11 VAL 2 HG11 VAL 2 -3.976 -3.955 1.766
11 HG12 VAL 2 HG12 VAL 2 -2.676 -5.115 2.043
12 HG13 VAL 2 HG13 VAL 2 -2.294 -3.447 1.615
13 HG21 VAL 2 HG21 VAL 2 -4.425 -4.819 -1.605
14 HG22 VAL 2 HG22 VAL 2 -4.905 -5.617 -0.107
15 HG23 VAL 2 HG23 VAL 2 -4.988 -3.861 -0.236
16 H ASP 3 H ASP 3 -3.610 -2.535 -2.659
17 HA ASP 3 HA ASP 3 -3.851 0.046 -1.333
18 HB2 ASP 3 HB2 ASP 3 -5.085 -0.646 -3.985
19 HB3 ASP 3 HB3 ASP 3 -4.531 0.921 -3.400
20 H VAL 4 H VAL 4 -6.213 1.037 -2.014
21 HA VAL 4 HA VAL 4 -8.089 -0.635 -0.509
22 HB VAL 4 HB VAL 4 -7.615 1.773 0.153
23 HG11 VAL 4 HG11 VAL 4 -8.179 3.520 -1.156
24 HG12 VAL 4 HG12 VAL 4 -8.004 2.340 -2.457
25 HG13 VAL 4 HG13 VAL 4 -9.602 2.708 -1.808
26 HG21 VAL 4 HG21 VAL 4 -9.444 1.169 1.300
27 HG22 VAL 4 HG22 VAL 4 -10.320 2.145 0.121
28 HG23 VAL 4 HG23 VAL 4 -10.188 0.401 -0.103
29 H ARG 5 H ARG 5 -7.397 -0.966 -3.409
30 HA ARG 5 HA ARG 5 -10.158 -0.979 -4.392
31 HB2 ARG 5 HB2 ARG 5 -7.786 0.293 -5.708
32 HB3 ARG 5 HB3 ARG 5 -9.060 -0.404 -6.700
33 HG2 ARG 5 HG2 ARG 5 -10.666 1.038 -5.335
34 HG3 ARG 5 HG3 ARG 5 -9.224 1.896 -4.788
35 HD2 ARG 5 HD2 ARG 5 -9.676 1.444 -7.708
36 HD3 ARG 5 HD3 ARG 5 -10.535 2.741 -6.877
37 HE ARG 5 HE ARG 5 -7.764 2.855 -6.306
38 HH11 ARG 5 HH11 ARG 5 -10.079 3.511 -8.822
39 HH12 ARG 5 HH12 ARG 5 -9.122 4.752 -9.559
40 HH21 ARG 5 HH21 ARG 5 -6.494 4.488 -7.267
41 HH22 ARG 5 HH22 ARG 5 -7.082 5.306 -8.674
42 H TYR 6 H TYR 6 -10.544 -3.097 -4.545
43 HA TYR 6 HA TYR 6 -8.780 -4.700 -6.236
44 HB2 TYR 6 HB2 TYR 6 -8.908 -6.598 -4.624
45 HB3 TYR 6 HB3 TYR 6 -7.994 -5.223 -4.015
46 HD1 TYR 6 HD1 TYR 6 -8.589 -4.187 -1.992
47 HD2 TYR 6 HD2 TYR 6 -11.305 -6.892 -3.839
48 HE1 TYR 6 HE1 TYR 6 -10.002 -4.134 0.021
49 HE2 TYR 6 HE2 TYR 6 -12.726 -6.844 -1.832
50 HH TYR 6 HH TYR 6 -12.653 -4.595 0.421
51 H THR 7 H THR 7 -9.823 -6.871 -6.721
52 HA THR 7 HA THR 7 -12.757 -6.664 -6.765
53 HB THR 7 HB THR 7 -12.573 -7.755 -9.107
54 HG1 THR 7 HG1 THR 7 -10.645 -7.795 -9.977
55 HG21 THR 7 HG21 THR 7 -13.555 -5.656 -9.082
56 HG22 THR 7 HG22 THR 7 -12.147 -5.386 -10.109
57 HG23 THR 7 HG23 THR 7 -12.117 -4.878 -8.421
58 H TYR 8 H TYR 8 -10.825 -8.246 -5.160
59 HA TYR 8 HA TYR 8 -12.200 -10.704 -5.168
60 HB2 TYR 8 HB2 TYR 8 -10.480 -12.219 -5.949
61 HB3 TYR 8 HB3 TYR 8 -10.844 -11.058 -7.220
62 HD1 TYR 8 HD1 TYR 8 -8.267 -12.628 -5.411
63 HD2 TYR 8 HD2 TYR 8 -9.285 -8.936 -7.266
64 HE1 TYR 8 HE1 TYR 8 -5.881 -12.049 -5.556
65 HE2 TYR 8 HE2 TYR 8 -6.902 -8.348 -7.417
66 HH TYR 8 HH TYR 8 -4.587 -10.044 -7.456
67 H ARG 9 H ARG 9 -10.431 -12.409 -4.009
68 HA ARG 9 HA ARG 9 -9.614 -10.927 -1.600
69 HB2 ARG 9 HB2 ARG 9 -10.847 -13.599 -2.032
70 HB3 ARG 9 HB3 ARG 9 -9.704 -13.444 -0.704
71 HG2 ARG 9 HG2 ARG 9 -11.030 -11.665 0.269
72 HG3 ARG 9 HG3 ARG 9 -12.151 -11.733 -1.092
73 HD2 ARG 9 HD2 ARG 9 -11.590 -14.057 0.740
74 HD3 ARG 9 HD3 ARG 9 -12.920 -12.924 0.974
75 HE ARG 9 HE ARG 9 -13.242 -13.798 -1.581
76 HH11 ARG 9 HH11 ARG 9 -12.934 -15.367 1.511
77 HH12 ARG 9 HH12 ARG 9 -13.909 -16.728 1.065
78 HH21 ARG 9 HH21 ARG 9 -14.528 -15.584 -2.181
79 HH22 ARG 9 HH22 ARG 9 -14.815 -16.851 -1.036
80 HA PRO 10 HA PRO 10 -5.646 -12.331 -3.456
81 HB2 PRO 10 HB2 PRO 10 -4.248 -10.157 -2.626
82 HB3 PRO 10 HB3 PRO 10 -5.191 -10.180 -4.121
83 HG2 PRO 10 HG2 PRO 10 -5.914 -9.058 -1.441
84 HG3 PRO 10 HG3 PRO 10 -6.169 -8.361 -3.052
85 HD2 PRO 10 HD2 PRO 10 -8.140 -9.609 -1.676
86 HD3 PRO 10 HD3 PRO 10 -8.043 -9.643 -3.448
87 H SER 11 H SER 11 -3.569 -12.759 -2.405
88 HA SER 11 HA SER 11 -3.965 -13.510 0.385
89 HB2 SER 11 HB2 SER 11 -2.920 -14.941 -1.620
90 HB3 SER 11 HB3 SER 11 -1.440 -14.175 -1.044
91 HG SER 11 HG SER 11 -1.646 -15.175 0.871
92 H VAL 12 H VAL 12 -3.755 -10.803 0.137
93 HA VAL 12 HA VAL 12 -1.079 -9.856 0.433
94 HB VAL 12 HB VAL 12 -2.176 -7.755 1.255
95 HG11 VAL 12 HG11 VAL 12 -1.682 -7.911 -1.062
96 HG12 VAL 12 HG12 VAL 12 -3.061 -8.974 -1.353
97 HG13 VAL 12 HG13 VAL 12 -3.323 -7.280 -0.935
98 HG21 VAL 12 HG21 VAL 12 -4.367 -7.611 1.737
99 HG22 VAL 12 HG22 VAL 12 -4.834 -8.671 0.407
100 HG23 VAL 12 HG23 VAL 12 -4.262 -9.362 1.925
101 HA PRO 13 HA PRO 13 -0.301 -10.596 4.691
102 HB2 PRO 13 HB2 PRO 13 1.207 -8.430 5.326
103 HB3 PRO 13 HB3 PRO 13 1.807 -9.757 4.325
104 HG2 PRO 13 HG2 PRO 13 0.741 -7.087 3.490
105 HG3 PRO 13 HG3 PRO 13 2.152 -7.970 2.877
106 HD2 PRO 13 HD2 PRO 13 -0.223 -7.933 1.576
107 HD3 PRO 13 HD3 PRO 13 0.871 -9.331 1.529
108 H ALA 14 H ALA 14 -0.575 -9.701 6.873
109 HA ALA 14 HA ALA 14 -3.089 -8.461 7.198
110 HB1 ALA 14 HB1 ALA 14 -0.904 -8.798 9.249
111 HB2 ALA 14 HB2 ALA 14 -2.611 -8.494 9.572
112 HB3 ALA 14 HB3 ALA 14 -2.111 -10.016 8.835
113 H HIS 15 H HIS 15 0.144 -7.211 6.980
114 HA HIS 15 HA HIS 15 -0.922 -4.497 7.391
115 HB2 HIS 15 HB2 HIS 15 1.886 -5.332 8.119
116 HB3 HIS 15 HB3 HIS 15 1.077 -3.816 8.506
117 HD1 HIS 15 HD1 HIS 15 -1.582 -5.118 9.584
118 HD2 HIS 15 HD2 HIS 15 2.272 -6.189 10.705
119 HE1 HIS 15 HE1 HIS 15 -1.812 -6.182 11.851
120 H ARG 16 H ARG 16 -0.100 -2.875 6.061
121 HA ARG 16 HA ARG 16 1.491 -3.832 3.771
122 HB2 ARG 16 HB2 ARG 16 0.297 -1.992 2.487
123 HB3 ARG 16 HB3 ARG 16 -0.674 -3.388 2.933
124 HG2 ARG 16 HG2 ARG 16 -1.952 -2.210 4.397
125 HG3 ARG 16 HG3 ARG 16 -0.653 -1.083 4.795
126 HD2 ARG 16 HD2 ARG 16 -0.992 -0.388 2.259
127 HD3 ARG 16 HD3 ARG 16 -2.607 -1.030 2.557
128 HE ARG 16 HE ARG 16 -1.754 0.803 4.582
129 HH11 ARG 16 HH11 ARG 16 -3.149 0.547 1.402
130 HH12 ARG 16 HH12 ARG 16 -3.956 2.078 1.491
131 HH21 ARG 16 HH21 ARG 16 -2.811 2.821 4.710
132 HH22 ARG 16 HH22 ARG 16 -3.762 3.371 3.372
133 H ARG 17 H ARG 17 2.695 -2.824 6.092
134 HA ARG 17 HA ARG 17 4.202 -0.649 4.961
135 HB2 ARG 17 HB2 ARG 17 2.147 -0.167 6.993
136 HB3 ARG 17 HB3 ARG 17 3.732 0.451 7.438
137 HG2 ARG 17 HG2 ARG 17 2.288 1.083 4.872
138 HG3 ARG 17 HG3 ARG 17 2.339 2.122 6.298
139 HD2 ARG 17 HD2 ARG 17 4.984 1.269 5.459
140 HD3 ARG 17 HD3 ARG 17 4.125 2.130 4.182
141 HE ARG 17 HE ARG 17 5.211 3.249 6.565
142 HH11 ARG 17 HH11 ARG 17 2.607 3.548 4.274
143 HH12 ARG 17 HH12 ARG 17 2.371 5.240 4.565
144 HH21 ARG 17 HH21 ARG 17 4.910 5.476 6.958
145 HH22 ARG 17 HH22 ARG 17 3.683 6.335 6.091
146 H VAL 18 H VAL 18 5.790 0.164 6.848
147 HA VAL 18 HA VAL 18 7.175 -2.238 7.691
148 HB VAL 18 HB VAL 18 8.396 -0.328 6.665
149 HG11 VAL 18 HG11 VAL 18 6.991 1.399 7.892
150 HG12 VAL 18 HG12 VAL 18 8.028 1.096 9.287
151 HG13 VAL 18 HG13 VAL 18 8.722 1.715 7.788
152 HG21 VAL 18 HG21 VAL 18 10.258 -0.933 7.759
153 HG22 VAL 18 HG22 VAL 18 9.621 -0.426 9.324
154 HG23 VAL 18 HG23 VAL 18 9.190 -2.005 8.666
155 H ARG 19 H ARG 19 5.207 0.243 9.086
156 HA ARG 19 HA ARG 19 5.322 -1.115 11.657
157 HB2 ARG 19 HB2 ARG 19 5.563 1.110 12.837
158 HB3 ARG 19 HB3 ARG 19 7.010 0.508 12.040
159 HG2 ARG 19 HG2 ARG 19 6.426 1.984 10.092
160 HG3 ARG 19 HG3 ARG 19 5.174 2.698 11.111
161 HD2 ARG 19 HD2 ARG 19 6.686 3.736 12.479
162 HD3 ARG 19 HD3 ARG 19 7.934 2.523 12.198
163 HE ARG 19 HE ARG 19 7.732 3.729 9.798
164 HH11 ARG 19 HH11 ARG 19 8.119 4.954 13.033
165 HH12 ARG 19 HH12 ARG 19 9.005 6.358 12.536
166 HH21 ARG 19 HH21 ARG 19 8.898 5.573 9.130
167 HH22 ARG 19 HH22 ARG 19 9.447 6.709 10.315
168 H GLU 20 H GLU 20 3.180 -1.660 10.735
169 HA GLU 20 HA GLU 20 1.221 0.400 11.476
170 HB2 GLU 20 HB2 GLU 20 1.603 -0.030 8.913
171 HB3 GLU 20 HB3 GLU 20 0.631 -1.465 9.211
172 HG2 GLU 20 HG2 GLU 20 -1.079 0.110 10.247
173 HG3 GLU 20 HG3 GLU 20 -0.153 1.413 9.504
174 H SER 21 H SER 21 -0.759 -0.378 12.293
175 HA SER 21 HA SER 21 -1.355 -3.146 12.529
176 HB2 SER 21 HB2 SER 21 0.056 -1.788 14.798
177 HB3 SER 21 HB3 SER 21 -1.163 -3.013 15.148
178 HG SER 21 HG SER 21 0.033 -4.503 13.994
179 HA PRO 22 HA PRO 22 -4.797 -0.078 13.164
180 HB2 PRO 22 HB2 PRO 22 -6.387 -1.094 11.212
181 HB3 PRO 22 HB3 PRO 22 -5.151 0.132 10.904
182 HG2 PRO 22 HG2 PRO 22 -5.030 -2.829 10.478
183 HG3 PRO 22 HG3 PRO 22 -4.459 -1.523 9.423
184 HD2 PRO 22 HD2 PRO 22 -2.793 -2.939 11.020
185 HD3 PRO 22 HD3 PRO 22 -2.516 -1.230 10.627
186 H LEU 23 H LEU 23 -7.311 -0.876 13.051
187 HA LEU 23 HA LEU 23 -7.470 -2.896 15.109
188 HB2 LEU 23 HB2 LEU 23 -9.456 -1.069 13.802
189 HB3 LEU 23 HB3 LEU 23 -9.973 -2.364 14.878
190 HG LEU 23 HG LEU 23 -9.915 -0.311 16.110
191 HD11 LEU 23 HD11 LEU 23 -8.747 -2.589 16.932
192 HD12 LEU 23 HD12 LEU 23 -8.923 -1.158 17.947
193 HD13 LEU 23 HD13 LEU 23 -7.398 -1.467 17.116
194 HD21 LEU 23 HD21 LEU 23 -7.044 0.165 15.980
195 HD22 LEU 23 HD22 LEU 23 -8.389 1.300 15.858
196 HD23 LEU 23 HD23 LEU 23 -7.859 0.403 14.434
197 H SER 24 H SER 24 -8.794 -2.465 11.834
198 HA SER 24 HA SER 24 -10.187 -4.833 11.591
199 HB2 SER 24 HB2 SER 24 -9.709 -4.632 9.121
200 HB3 SER 24 HB3 SER 24 -10.360 -3.172 9.866
201 HG SER 24 HG SER 24 -8.060 -3.483 8.551
202 H SER 25 H SER 25 -6.747 -4.284 11.477
203 HA SER 25 HA SER 25 -5.830 -6.554 10.205
204 HB2 SER 25 HB2 SER 25 -3.755 -6.241 11.376
205 HB3 SER 25 HB3 SER 25 -4.433 -4.642 11.070
206 HG SER 25 HG SER 25 -3.608 -5.286 13.306
207 H ASP 26 H ASP 26 -6.938 -6.176 13.531
208 HA ASP 26 HA ASP 26 -6.310 -8.914 14.212
209 HB2 ASP 26 HB2 ASP 26 -7.470 -6.567 15.650
210 HB3 ASP 26 HB3 ASP 26 -7.772 -8.178 16.294
211 H ALA 27 H ALA 27 -8.962 -7.178 12.889
212 HA ALA 27 HA ALA 27 -11.135 -8.727 13.698
213 HB1 ALA 27 HB1 ALA 27 -11.036 -7.663 10.917
214 HB2 ALA 27 HB2 ALA 27 -12.354 -7.635 12.090
215 HB3 ALA 27 HB3 ALA 27 -10.988 -6.533 12.271
216 H ILE 28 H ILE 28 -8.562 -9.457 11.526
217 HA ILE 28 HA ILE 28 -9.731 -11.348 9.852
218 HB ILE 28 HB ILE 28 -7.529 -12.245 9.481
219 HG12 ILE 28 HG12 ILE 28 -6.691 -10.699 11.945
220 HG13 ILE 28 HG13 ILE 28 -6.833 -12.449 11.831
221 HG21 ILE 28 HG21 ILE 28 -6.430 -9.653 9.730
222 HG22 ILE 28 HG22 ILE 28 -7.122 -10.414 8.298
223 HG23 ILE 28 HG23 ILE 28 -8.147 -9.467 9.375
224 HD11 ILE 28 HD11 ILE 28 -5.131 -12.084 9.841
225 HD12 ILE 28 HD12 ILE 28 -4.745 -10.639 10.776
226 HD13 ILE 28 HD13 ILE 28 -4.601 -12.233 11.516
227 H PHE 29 H PHE 29 -8.743 -11.583 13.189
228 HA PHE 29 HA PHE 29 -9.206 -14.469 13.210
229 HB2 PHE 29 HB2 PHE 29 -7.234 -13.237 14.392
230 HB3 PHE 29 HB3 PHE 29 -8.433 -12.867 15.626
231 HD1 PHE 29 HD1 PHE 29 -6.466 -15.499 14.034
232 HD2 PHE 29 HD2 PHE 29 -9.358 -14.606 17.027
233 HE1 PHE 29 HE1 PHE 29 -6.093 -17.709 15.050
234 HE2 PHE 29 HE2 PHE 29 -8.988 -16.814 18.047
235 HZ PHE 29 HZ PHE 29 -7.354 -18.368 17.060
236 H LYS 30 H LYS 30 -10.927 -11.650 13.648
237 HA LYS 30 HA LYS 30 -12.532 -12.080 15.863
238 HB2 LYS 30 HB2 LYS 30 -12.493 -10.042 14.376
239 HB3 LYS 30 HB3 LYS 30 -13.496 -10.935 13.240
240 HG2 LYS 30 HG2 LYS 30 -14.438 -10.778 16.042
241 HG3 LYS 30 HG3 LYS 30 -14.507 -9.303 15.074
242 HD2 LYS 30 HD2 LYS 30 -15.550 -11.853 13.924
243 HD3 LYS 30 HD3 LYS 30 -16.526 -10.979 15.108
244 HE2 LYS 30 HE2 LYS 30 -15.353 -9.597 12.716
245 HE3 LYS 30 HE3 LYS 30 -16.883 -10.466 12.614
246 HZ1 LYS 30 HZ1 LYS 30 -17.681 -8.452 13.190
247 HZ2 LYS 30 HZ2 LYS 30 -16.257 -7.963 13.960
248 HZ3 LYS 30 HZ3 LYS 30 -17.340 -8.990 14.757
249 H GLN 31 H GLN 31 -12.579 -13.637 12.751
250 HA GLN 31 HA GLN 31 -15.169 -14.713 12.805
251 HB2 GLN 31 HB2 GLN 31 -14.309 -16.370 11.194
252 HB3 GLN 31 HB3 GLN 31 -13.823 -14.731 10.783
253 HG2 GLN 31 HG2 GLN 31 -11.855 -15.816 10.454
254 HG3 GLN 31 HG3 GLN 31 -11.675 -15.380 12.152
255 HE21 GLN 31 HE21 GLN 31 -10.108 -17.171 12.048
256 HE22 GLN 31 HE22 GLN 31 -10.684 -18.777 12.318
257 H SER 32 H SER 32 -12.164 -15.778 14.270
258 HA SER 32 HA SER 32 -12.881 -18.385 14.961
259 HB2 SER 32 HB2 SER 32 -11.217 -16.738 16.828
260 HB3 SER 32 HB3 SER 32 -10.992 -18.408 16.307
261 HG SER 32 HG SER 32 -10.456 -17.540 14.213
262 H HIS 33 H HIS 33 -13.329 -15.349 16.740
263 HA HIS 33 HA HIS 33 -14.591 -16.586 18.981
264 HB2 HIS 33 HB2 HIS 33 -13.456 -14.440 19.216
265 HB3 HIS 33 HB3 HIS 33 -14.574 -13.700 18.074
266 HD1 HIS 33 HD1 HIS 33 -15.596 -12.024 19.672
267 HD2 HIS 33 HD2 HIS 33 -15.814 -15.934 21.058
268 HE1 HIS 33 HE1 HIS 33 -17.109 -11.942 21.679
Start of MODEL 8
1 H1 ASN 1 H ASN 1 4.321 -3.555 1.129
2 HA ASN 1 HA ASN 1 1.966 -1.960 1.843
3 HB2 ASN 1 HB2 ASN 1 4.070 -0.552 1.301
4 HB3 ASN 1 HB3 ASN 1 3.804 -1.062 -0.363
5 HD21 ASN 1 HD21 ASN 1 1.543 -0.704 -1.173
6 HD22 ASN 1 HD22 ASN 1 0.784 0.785 -0.734
7 H VAL 2 H VAL 2 0.221 -2.433 0.659
8 HA VAL 2 HA VAL 2 0.453 -4.437 -1.420
9 HB VAL 2 HB VAL 2 -1.336 -4.557 0.304
10 HG11 VAL 2 HG11 VAL 2 -3.190 -3.071 0.290
11 HG12 VAL 2 HG12 VAL 2 -1.736 -2.073 0.332
12 HG13 VAL 2 HG13 VAL 2 -2.625 -2.275 -1.178
13 HG21 VAL 2 HG21 VAL 2 -2.265 -4.317 -2.556
14 HG22 VAL 2 HG22 VAL 2 -1.588 -5.754 -1.790
15 HG23 VAL 2 HG23 VAL 2 -3.150 -5.127 -1.263
16 H ASP 3 H ASP 3 -0.002 -4.177 -3.563
17 HA ASP 3 HA ASP 3 0.092 -1.467 -4.578
18 HB2 ASP 3 HB2 ASP 3 0.101 -4.147 -5.979
19 HB3 ASP 3 HB3 ASP 3 0.238 -2.597 -6.805
20 H VAL 4 H VAL 4 -1.309 -1.292 -6.769
21 HA VAL 4 HA VAL 4 -4.073 -1.454 -5.847
22 HB VAL 4 HB VAL 4 -4.608 0.053 -7.684
23 HG11 VAL 4 HG11 VAL 4 -2.536 0.677 -5.690
24 HG12 VAL 4 HG12 VAL 4 -2.699 1.840 -7.007
25 HG13 VAL 4 HG13 VAL 4 -4.090 1.451 -5.995
26 HG21 VAL 4 HG21 VAL 4 -3.313 -0.368 -9.506
27 HG22 VAL 4 HG22 VAL 4 -2.408 0.995 -8.847
28 HG23 VAL 4 HG23 VAL 4 -1.861 -0.654 -8.547
29 H ARG 5 H ARG 5 -2.313 -3.683 -7.088
30 HA ARG 5 HA ARG 5 -4.331 -4.560 -9.045
31 HB2 ARG 5 HB2 ARG 5 -2.189 -3.954 -10.141
32 HB3 ARG 5 HB3 ARG 5 -1.368 -5.150 -9.147
33 HG2 ARG 5 HG2 ARG 5 -1.674 -6.301 -11.108
34 HG3 ARG 5 HG3 ARG 5 -3.091 -6.800 -10.181
35 HD2 ARG 5 HD2 ARG 5 -3.211 -4.425 -12.002
36 HD3 ARG 5 HD3 ARG 5 -3.388 -6.058 -12.643
37 HE ARG 5 HE ARG 5 -5.137 -5.832 -10.502
38 HH11 ARG 5 HH11 ARG 5 -4.669 -4.374 -13.629
39 HH12 ARG 5 HH12 ARG 5 -6.351 -4.031 -13.865
40 HH21 ARG 5 HH21 ARG 5 -7.354 -5.385 -10.802
41 HH22 ARG 5 HH22 ARG 5 -7.877 -4.606 -12.256
42 H TYR 6 H TYR 6 -5.469 -6.128 -8.117
43 HA TYR 6 HA TYR 6 -4.054 -8.083 -6.429
44 HB2 TYR 6 HB2 TYR 6 -6.321 -8.553 -5.457
45 HB3 TYR 6 HB3 TYR 6 -5.716 -6.930 -5.141
46 HD1 TYR 6 HD1 TYR 6 -6.886 -5.014 -5.913
47 HD2 TYR 6 HD2 TYR 6 -8.086 -8.890 -7.194
48 HE1 TYR 6 HE1 TYR 6 -8.947 -4.058 -6.855
49 HE2 TYR 6 HE2 TYR 6 -10.150 -7.945 -8.141
50 HH TYR 6 HH TYR 6 -10.616 -4.621 -8.583
51 H THR 7 H THR 7 -5.243 -10.270 -6.395
52 HA THR 7 HA THR 7 -6.195 -10.980 -9.084
53 HB THR 7 HB THR 7 -3.809 -11.584 -8.942
54 HG1 THR 7 HG1 THR 7 -4.123 -13.654 -9.711
55 HG21 THR 7 HG21 THR 7 -3.785 -11.947 -6.470
56 HG22 THR 7 HG22 THR 7 -3.012 -13.238 -7.391
57 HG23 THR 7 HG23 THR 7 -4.632 -13.471 -6.735
58 H TYR 8 H TYR 8 -7.484 -10.586 -6.421
59 HA TYR 8 HA TYR 8 -9.292 -12.743 -6.531
60 HB2 TYR 8 HB2 TYR 8 -8.807 -13.889 -4.454
61 HB3 TYR 8 HB3 TYR 8 -7.384 -13.944 -5.487
62 HD1 TYR 8 HD1 TYR 8 -8.555 -13.267 -2.240
63 HD2 TYR 8 HD2 TYR 8 -5.635 -12.019 -5.072
64 HE1 TYR 8 HE1 TYR 8 -7.206 -12.311 -0.419
65 HE2 TYR 8 HE2 TYR 8 -4.278 -11.061 -3.259
66 HH TYR 8 HH TYR 8 -4.042 -10.840 -1.054
67 H ARG 9 H ARG 9 -10.359 -12.786 -4.032
68 HA ARG 9 HA ARG 9 -11.099 -9.968 -3.614
69 HB2 ARG 9 HB2 ARG 9 -12.649 -12.529 -3.370
70 HB3 ARG 9 HB3 ARG 9 -13.167 -11.085 -2.510
71 HG2 ARG 9 HG2 ARG 9 -13.158 -9.896 -4.730
72 HG3 ARG 9 HG3 ARG 9 -12.930 -11.478 -5.479
73 HD2 ARG 9 HD2 ARG 9 -15.013 -12.263 -4.666
74 HD3 ARG 9 HD3 ARG 9 -15.188 -10.882 -3.584
75 HE ARG 9 HE ARG 9 -15.030 -9.954 -6.227
76 HH11 ARG 9 HH11 ARG 9 -17.176 -11.725 -4.134
77 HH12 ARG 9 HH12 ARG 9 -18.611 -11.223 -4.965
78 HH21 ARG 9 HH21 ARG 9 -16.912 -9.287 -7.329
79 HH22 ARG 9 HH22 ARG 9 -18.460 -9.837 -6.783
80 HA PRO 10 HA PRO 10 -8.854 -11.124 0.232
81 HB2 PRO 10 HB2 PRO 10 -7.806 -8.649 0.613
82 HB3 PRO 10 HB3 PRO 10 -7.055 -9.859 -0.433
83 HG2 PRO 10 HG2 PRO 10 -8.793 -7.536 -1.169
84 HG3 PRO 10 HG3 PRO 10 -7.310 -8.115 -1.949
85 HD2 PRO 10 HD2 PRO 10 -9.777 -8.669 -2.918
86 HD3 PRO 10 HD3 PRO 10 -8.411 -9.791 -3.085
87 H SER 11 H SER 11 -10.020 -11.166 2.038
88 HA SER 11 HA SER 11 -12.340 -9.738 2.520
89 HB2 SER 11 HB2 SER 11 -10.637 -10.594 4.831
90 HB3 SER 11 HB3 SER 11 -12.381 -10.740 4.614
91 HG SER 11 HG SER 11 -10.394 -12.476 3.939
92 H VAL 12 H VAL 12 -9.048 -9.048 3.656
93 HA VAL 12 HA VAL 12 -9.709 -6.229 3.851
94 HB VAL 12 HB VAL 12 -8.682 -6.102 6.167
95 HG11 VAL 12 HG11 VAL 12 -10.755 -6.257 7.202
96 HG12 VAL 12 HG12 VAL 12 -11.178 -6.025 5.504
97 HG13 VAL 12 HG13 VAL 12 -11.253 -7.635 6.222
98 HG21 VAL 12 HG21 VAL 12 -7.922 -8.598 5.890
99 HG22 VAL 12 HG22 VAL 12 -8.380 -7.969 7.473
100 HG23 VAL 12 HG23 VAL 12 -9.524 -8.937 6.544
101 HA PRO 13 HA PRO 13 -5.546 -5.726 2.550
102 HB2 PRO 13 HB2 PRO 13 -4.950 -3.306 3.627
103 HB3 PRO 13 HB3 PRO 13 -6.037 -3.502 2.246
104 HG2 PRO 13 HG2 PRO 13 -6.701 -3.119 5.140
105 HG3 PRO 13 HG3 PRO 13 -7.444 -2.373 3.713
106 HD2 PRO 13 HD2 PRO 13 -8.567 -4.465 5.016
107 HD3 PRO 13 HD3 PRO 13 -8.741 -4.226 3.266
108 H ALA 14 H ALA 14 -3.765 -6.690 3.278
109 HA ALA 14 HA ALA 14 -3.297 -7.490 5.883
110 HB1 ALA 14 HB1 ALA 14 -0.778 -7.404 4.931
111 HB2 ALA 14 HB2 ALA 14 -1.938 -8.669 4.526
112 HB3 ALA 14 HB3 ALA 14 -1.688 -7.316 3.422
113 H HIS 15 H HIS 15 -1.984 -4.651 4.191
114 HA HIS 15 HA HIS 15 -1.971 -3.033 6.496
115 HB2 HIS 15 HB2 HIS 15 0.444 -2.837 6.884
116 HB3 HIS 15 HB3 HIS 15 -0.114 -4.480 7.188
117 HD1 HIS 15 HD1 HIS 15 0.793 -6.334 5.682
118 HD2 HIS 15 HD2 HIS 15 2.103 -2.539 4.613
119 HE1 HIS 15 HE1 HIS 15 2.638 -6.704 4.013
120 H ARG 16 H ARG 16 -1.967 -0.966 5.861
121 HA ARG 16 HA ARG 16 -0.927 -0.360 3.171
122 HB2 ARG 16 HB2 ARG 16 -2.650 1.481 3.154
123 HB3 ARG 16 HB3 ARG 16 -3.295 -0.153 3.092
124 HG2 ARG 16 HG2 ARG 16 -4.067 -0.063 5.289
125 HG3 ARG 16 HG3 ARG 16 -3.038 1.314 5.689
126 HD2 ARG 16 HD2 ARG 16 -5.320 1.412 3.723
127 HD3 ARG 16 HD3 ARG 16 -5.452 1.879 5.418
128 HE ARG 16 HE ARG 16 -3.385 3.377 4.504
129 HH11 ARG 16 HH11 ARG 16 -6.661 2.878 3.437
130 HH12 ARG 16 HH12 ARG 16 -6.821 4.465 2.761
131 HH21 ARG 16 HH21 ARG 16 -3.583 5.469 3.618
132 HH22 ARG 16 HH22 ARG 16 -5.069 5.938 2.864
133 H ARG 17 H ARG 17 0.720 -0.249 5.431
134 HA ARG 17 HA ARG 17 1.426 2.573 5.385
135 HB2 ARG 17 HB2 ARG 17 0.497 1.110 7.803
136 HB3 ARG 17 HB3 ARG 17 1.860 2.204 7.996
137 HG2 ARG 17 HG2 ARG 17 -0.733 3.042 6.732
138 HG3 ARG 17 HG3 ARG 17 -0.417 3.168 8.464
139 HD2 ARG 17 HD2 ARG 17 1.754 4.401 7.650
140 HD3 ARG 17 HD3 ARG 17 0.800 4.665 6.191
141 HE ARG 17 HE ARG 17 -0.757 5.396 8.392
142 HH11 ARG 17 HH11 ARG 17 2.134 6.421 6.744
143 HH12 ARG 17 HH12 ARG 17 1.948 8.087 7.180
144 HH21 ARG 17 HH21 ARG 17 -1.011 7.587 8.973
145 HH22 ARG 17 HH22 ARG 17 0.160 8.749 8.450
146 H VAL 18 H VAL 18 3.557 2.867 6.690
147 HA VAL 18 HA VAL 18 5.441 0.985 5.598
148 HB VAL 18 HB VAL 18 5.935 3.391 5.614
149 HG11 VAL 18 HG11 VAL 18 6.064 4.693 7.481
150 HG12 VAL 18 HG12 VAL 18 4.847 3.537 8.025
151 HG13 VAL 18 HG13 VAL 18 6.529 3.349 8.523
152 HG21 VAL 18 HG21 VAL 18 8.055 2.740 5.536
153 HG22 VAL 18 HG22 VAL 18 8.126 2.766 7.298
154 HG23 VAL 18 HG23 VAL 18 7.658 1.288 6.456
155 H ARG 19 H ARG 19 4.121 1.744 8.755
156 HA ARG 19 HA ARG 19 5.485 -0.625 9.829
157 HB2 ARG 19 HB2 ARG 19 5.363 2.122 11.060
158 HB3 ARG 19 HB3 ARG 19 5.647 0.681 12.028
159 HG2 ARG 19 HG2 ARG 19 7.545 0.251 10.276
160 HG3 ARG 19 HG3 ARG 19 7.401 1.990 10.012
161 HD2 ARG 19 HD2 ARG 19 7.943 0.615 12.641
162 HD3 ARG 19 HD3 ARG 19 9.111 1.514 11.673
163 HE ARG 19 HE ARG 19 6.835 3.091 12.374
164 HH11 ARG 19 HH11 ARG 19 9.885 1.877 13.533
165 HH12 ARG 19 HH12 ARG 19 10.112 3.163 14.672
166 HH21 ARG 19 HH21 ARG 19 7.123 4.789 13.870
167 HH22 ARG 19 HH22 ARG 19 8.540 4.818 14.864
168 H GLU 20 H GLU 20 3.459 -1.683 9.466
169 HA GLU 20 HA GLU 20 1.590 -1.249 11.666
170 HB2 GLU 20 HB2 GLU 20 0.879 -0.101 9.414
171 HB3 GLU 20 HB3 GLU 20 0.443 -1.738 8.945
172 HG2 GLU 20 HG2 GLU 20 -1.514 -0.736 9.787
173 HG3 GLU 20 HG3 GLU 20 -0.952 -1.854 11.029
174 H SER 21 H SER 21 0.355 -3.088 12.219
175 HA SER 21 HA SER 21 0.730 -5.558 10.768
176 HB2 SER 21 HB2 SER 21 1.728 -6.767 12.678
177 HB3 SER 21 HB3 SER 21 2.790 -5.489 12.089
178 HG SER 21 HG SER 21 2.037 -5.817 14.531
179 HA PRO 22 HA PRO 22 -3.282 -5.068 13.073
180 HB2 PRO 22 HB2 PRO 22 -4.856 -5.614 10.929
181 HB3 PRO 22 HB3 PRO 22 -4.270 -3.989 11.301
182 HG2 PRO 22 HG2 PRO 22 -3.213 -5.979 9.330
183 HG3 PRO 22 HG3 PRO 22 -3.448 -4.231 9.140
184 HD2 PRO 22 HD2 PRO 22 -1.027 -5.327 9.660
185 HD3 PRO 22 HD3 PRO 22 -1.495 -3.720 10.252
186 H LEU 23 H LEU 23 -2.029 -7.151 13.817
187 HA LEU 23 HA LEU 23 -3.298 -9.542 12.678
188 HB2 LEU 23 HB2 LEU 23 -0.811 -9.088 14.278
189 HB3 LEU 23 HB3 LEU 23 -1.566 -10.679 14.240
190 HG LEU 23 HG LEU 23 0.247 -10.589 12.650
191 HD11 LEU 23 HD11 LEU 23 -2.074 -10.415 10.823
192 HD12 LEU 23 HD12 LEU 23 -2.172 -11.584 12.140
193 HD13 LEU 23 HD13 LEU 23 -0.844 -11.669 10.983
194 HD21 LEU 23 HD21 LEU 23 -0.409 -7.958 12.327
195 HD22 LEU 23 HD22 LEU 23 -1.001 -8.672 10.826
196 HD23 LEU 23 HD23 LEU 23 0.690 -8.867 11.290
197 H SER 24 H SER 24 -2.283 -8.420 15.913
198 HA SER 24 HA SER 24 -4.243 -10.054 17.216
199 HB2 SER 24 HB2 SER 24 -2.438 -7.866 18.273
200 HB3 SER 24 HB3 SER 24 -3.461 -8.888 19.283
201 HG SER 24 HG SER 24 -2.233 -10.641 17.996
202 H SER 25 H SER 25 -4.100 -6.793 16.052
203 HA SER 25 HA SER 25 -6.159 -5.672 17.624
204 HB2 SER 25 HB2 SER 25 -4.459 -4.459 16.132
205 HB3 SER 25 HB3 SER 25 -5.539 -4.840 14.792
206 HG SER 25 HG SER 25 -7.187 -3.840 16.344
207 H ASP 26 H ASP 26 -6.182 -7.278 14.467
208 HA ASP 26 HA ASP 26 -8.967 -6.924 14.013
209 HB2 ASP 26 HB2 ASP 26 -6.778 -8.507 12.758
210 HB3 ASP 26 HB3 ASP 26 -8.436 -8.999 12.424
211 H ALA 27 H ALA 27 -7.068 -9.275 15.728
212 HA ALA 27 HA ALA 27 -8.832 -11.431 15.807
213 HB1 ALA 27 HB1 ALA 27 -7.676 -12.073 17.888
214 HB2 ALA 27 HB2 ALA 27 -6.557 -11.620 16.602
215 HB3 ALA 27 HB3 ALA 27 -6.893 -10.493 17.917
216 H ILE 28 H ILE 28 -8.905 -8.385 17.485
217 HA ILE 28 HA ILE 28 -10.514 -8.938 19.660
218 HB ILE 28 HB ILE 28 -10.626 -6.475 17.915
219 HG12 ILE 28 HG12 ILE 28 -9.097 -6.841 20.488
220 HG13 ILE 28 HG13 ILE 28 -8.378 -7.168 18.915
221 HG21 ILE 28 HG21 ILE 28 -11.549 -6.932 20.748
222 HG22 ILE 28 HG22 ILE 28 -11.473 -5.363 19.949
223 HG23 ILE 28 HG23 ILE 28 -12.568 -6.607 19.346
224 HD11 ILE 28 HD11 ILE 28 -7.768 -5.037 18.912
225 HD12 ILE 28 HD12 ILE 28 -9.465 -4.653 18.621
226 HD13 ILE 28 HD13 ILE 28 -8.829 -4.650 20.266
227 H PHE 29 H PHE 29 -11.448 -8.391 16.297
228 HA PHE 29 HA PHE 29 -14.262 -8.788 16.962
229 HB2 PHE 29 HB2 PHE 29 -13.292 -7.030 15.287
230 HB3 PHE 29 HB3 PHE 29 -13.238 -8.391 14.171
231 HD1 PHE 29 HD1 PHE 29 -15.334 -5.974 15.849
232 HD2 PHE 29 HD2 PHE 29 -15.332 -9.544 13.530
233 HE1 PHE 29 HE1 PHE 29 -17.711 -5.627 15.319
234 HE2 PHE 29 HE2 PHE 29 -17.709 -9.202 12.996
235 HZ PHE 29 HZ PHE 29 -18.902 -7.241 13.890
236 H LYS 30 H LYS 30 -11.570 -10.455 15.559
237 HA LYS 30 HA LYS 30 -12.837 -12.401 14.033
238 HB2 LYS 30 HB2 LYS 30 -10.335 -11.955 14.300
239 HB3 LYS 30 HB3 LYS 30 -10.420 -12.942 15.753
240 HG2 LYS 30 HG2 LYS 30 -9.805 -14.535 14.260
241 HG3 LYS 30 HG3 LYS 30 -11.558 -14.654 14.089
242 HD2 LYS 30 HD2 LYS 30 -10.733 -14.583 11.889
243 HD3 LYS 30 HD3 LYS 30 -11.326 -12.951 12.207
244 HE2 LYS 30 HE2 LYS 30 -8.857 -12.529 12.967
245 HE3 LYS 30 HE3 LYS 30 -8.520 -13.944 11.972
246 HZ1 LYS 30 HZ1 LYS 30 -10.212 -12.017 10.677
247 HZ2 LYS 30 HZ2 LYS 30 -8.815 -12.782 10.109
248 HZ3 LYS 30 HZ3 LYS 30 -8.688 -11.397 11.071
249 H GLN 31 H GLN 31 -12.586 -12.069 17.486
250 HA GLN 31 HA GLN 31 -13.153 -14.702 18.262
251 HB2 GLN 31 HB2 GLN 31 -13.412 -12.022 19.537
252 HB3 GLN 31 HB3 GLN 31 -14.242 -13.376 20.292
253 HG2 GLN 31 HG2 GLN 31 -11.304 -13.326 19.647
254 HG3 GLN 31 HG3 GLN 31 -11.993 -12.925 21.219
255 HE21 GLN 31 HE21 GLN 31 -10.229 -15.150 20.083
256 HE22 GLN 31 HE22 GLN 31 -10.944 -16.591 20.711
257 H SER 32 H SER 32 -15.226 -12.091 17.194
258 HA SER 32 HA SER 32 -17.652 -13.514 17.889
259 HB2 SER 32 HB2 SER 32 -17.225 -10.915 17.817
260 HB3 SER 32 HB3 SER 32 -17.633 -11.103 16.112
261 HG SER 32 HG SER 32 -19.631 -11.888 16.692
262 H HIS 33 H HIS 33 -15.592 -13.077 15.135
263 HA HIS 33 HA HIS 33 -17.416 -13.776 13.099
264 HB2 HIS 33 HB2 HIS 33 -15.239 -12.703 12.658
265 HB3 HIS 33 HB3 HIS 33 -14.417 -14.174 13.170
266 HD1 HIS 33 HD1 HIS 33 -17.018 -13.211 10.557
267 HD2 HIS 33 HD2 HIS 33 -13.788 -15.770 11.088
268 HE1 HIS 33 HE1 HIS 33 -16.723 -14.387 8.354
Start of MODEL 9
1 H1 ASN 1 H ASN 1 3.294 -1.608 1.135
2 HA ASN 1 HA ASN 1 1.471 -0.393 0.252
3 HB2 ASN 1 HB2 ASN 1 4.034 0.716 -0.907
4 HB3 ASN 1 HB3 ASN 1 2.501 1.583 -0.917
5 HD21 ASN 1 HD21 ASN 1 5.321 1.030 0.758
6 HD22 ASN 1 HD22 ASN 1 4.858 1.686 2.287
7 H VAL 2 H VAL 2 1.499 -2.716 -1.239
8 HA VAL 2 HA VAL 2 1.166 -1.748 -4.004
9 HB VAL 2 HB VAL 2 1.565 -4.613 -3.140
10 HG11 VAL 2 HG11 VAL 2 0.446 -4.539 -5.225
11 HG12 VAL 2 HG12 VAL 2 1.485 -3.240 -5.817
12 HG13 VAL 2 HG13 VAL 2 2.142 -4.861 -5.586
13 HG21 VAL 2 HG21 VAL 2 3.856 -4.359 -4.050
14 HG22 VAL 2 HG22 VAL 2 3.570 -2.625 -4.201
15 HG23 VAL 2 HG23 VAL 2 3.569 -3.383 -2.609
16 H ASP 3 H ASP 3 -0.964 -0.980 -3.444
17 HA ASP 3 HA ASP 3 -3.005 -2.803 -4.110
18 HB2 ASP 3 HB2 ASP 3 -2.419 -3.335 -1.616
19 HB3 ASP 3 HB3 ASP 3 -3.331 -1.865 -1.280
20 H VAL 4 H VAL 4 -3.074 -0.917 -5.550
21 HA VAL 4 HA VAL 4 -4.779 1.196 -4.414
22 HB VAL 4 HB VAL 4 -2.629 2.218 -4.730
23 HG11 VAL 4 HG11 VAL 4 -1.195 1.480 -6.254
24 HG12 VAL 4 HG12 VAL 4 -2.444 0.434 -6.931
25 HG13 VAL 4 HG13 VAL 4 -2.244 2.077 -7.539
26 HG21 VAL 4 HG21 VAL 4 -3.907 3.204 -7.198
27 HG22 VAL 4 HG22 VAL 4 -4.922 3.193 -5.756
28 HG23 VAL 4 HG23 VAL 4 -3.398 4.079 -5.754
29 H ARG 5 H ARG 5 -6.715 1.083 -5.322
30 HA ARG 5 HA ARG 5 -8.391 0.674 -6.811
31 HB2 ARG 5 HB2 ARG 5 -6.300 1.684 -8.747
32 HB3 ARG 5 HB3 ARG 5 -8.017 1.538 -9.098
33 HG2 ARG 5 HG2 ARG 5 -8.401 3.107 -7.143
34 HG3 ARG 5 HG3 ARG 5 -6.663 3.409 -7.184
35 HD2 ARG 5 HD2 ARG 5 -7.384 5.095 -8.547
36 HD3 ARG 5 HD3 ARG 5 -7.145 3.821 -9.743
37 HE ARG 5 HE ARG 5 -9.756 3.584 -8.901
38 HH11 ARG 5 HH11 ARG 5 -7.793 6.032 -10.409
39 HH12 ARG 5 HH12 ARG 5 -9.116 6.750 -11.267
40 HH21 ARG 5 HH21 ARG 5 -11.507 4.519 -10.026
41 HH22 ARG 5 HH22 ARG 5 -11.228 5.889 -11.048
42 H TYR 6 H TYR 6 -7.423 -1.656 -6.148
43 HA TYR 6 HA TYR 6 -6.273 -3.193 -8.237
44 HB2 TYR 6 HB2 TYR 6 -6.948 -5.146 -6.834
45 HB3 TYR 6 HB3 TYR 6 -6.031 -3.928 -5.955
46 HD1 TYR 6 HD1 TYR 6 -6.989 -2.756 -4.113
47 HD2 TYR 6 HD2 TYR 6 -9.397 -5.350 -6.473
48 HE1 TYR 6 HE1 TYR 6 -8.772 -2.626 -2.424
49 HE2 TYR 6 HE2 TYR 6 -11.188 -5.226 -4.792
50 HH TYR 6 HH TYR 6 -10.869 -3.175 -1.915
51 H THR 7 H THR 7 -7.543 -5.347 -8.826
52 HA THR 7 HA THR 7 -10.322 -4.765 -9.514
53 HB THR 7 HB THR 7 -9.788 -5.710 -11.871
54 HG1 THR 7 HG1 THR 7 -7.676 -5.275 -12.564
55 HG21 THR 7 HG21 THR 7 -8.935 -2.919 -11.089
56 HG22 THR 7 HG22 THR 7 -10.577 -3.435 -11.472
57 HG23 THR 7 HG23 THR 7 -9.334 -3.449 -12.723
58 H TYR 8 H TYR 8 -8.772 -6.662 -7.773
59 HA TYR 8 HA TYR 8 -10.371 -8.945 -8.175
60 HB2 TYR 8 HB2 TYR 8 -8.722 -10.578 -8.868
61 HB3 TYR 8 HB3 TYR 8 -8.795 -9.290 -10.065
62 HD1 TYR 8 HD1 TYR 8 -6.653 -11.269 -8.096
63 HD2 TYR 8 HD2 TYR 8 -7.039 -7.358 -9.727
64 HE1 TYR 8 HE1 TYR 8 -4.223 -10.949 -7.888
65 HE2 TYR 8 HE2 TYR 8 -4.610 -7.028 -9.525
66 HH TYR 8 HH TYR 8 -2.495 -9.619 -8.344
67 H ARG 9 H ARG 9 -8.951 -10.919 -6.962
68 HA ARG 9 HA ARG 9 -8.320 -9.725 -4.347
69 HB2 ARG 9 HB2 ARG 9 -8.865 -12.075 -3.497
70 HB3 ARG 9 HB3 ARG 9 -10.210 -11.095 -4.066
71 HG2 ARG 9 HG2 ARG 9 -10.143 -12.281 -6.216
72 HG3 ARG 9 HG3 ARG 9 -8.833 -13.289 -5.599
73 HD2 ARG 9 HD2 ARG 9 -10.331 -14.052 -3.784
74 HD3 ARG 9 HD3 ARG 9 -11.637 -13.111 -4.503
75 HE ARG 9 HE ARG 9 -10.668 -14.780 -6.490
76 HH11 ARG 9 HH11 ARG 9 -12.188 -15.097 -3.374
77 HH12 ARG 9 HH12 ARG 9 -12.959 -16.601 -3.757
78 HH21 ARG 9 HH21 ARG 9 -11.676 -16.759 -7.007
79 HH22 ARG 9 HH22 ARG 9 -12.666 -17.546 -5.824
80 HA PRO 10 HA PRO 10 -4.299 -11.414 -5.811
81 HB2 PRO 10 HB2 PRO 10 -2.814 -9.478 -4.621
82 HB3 PRO 10 HB3 PRO 10 -3.547 -9.282 -6.218
83 HG2 PRO 10 HG2 PRO 10 -4.506 -8.295 -3.560
84 HG3 PRO 10 HG3 PRO 10 -4.473 -7.453 -5.120
85 HD2 PRO 10 HD2 PRO 10 -6.724 -8.576 -4.119
86 HD3 PRO 10 HD3 PRO 10 -6.395 -8.486 -5.861
87 H SER 11 H SER 11 -2.435 -12.149 -4.552
88 HA SER 11 HA SER 11 -3.277 -13.113 -1.941
89 HB2 SER 11 HB2 SER 11 -2.013 -14.404 -3.910
90 HB3 SER 11 HB3 SER 11 -0.598 -13.796 -3.051
91 HG SER 11 HG SER 11 -0.961 -15.178 -1.510
92 H VAL 12 H VAL 12 -2.950 -10.464 -1.735
93 HA VAL 12 HA VAL 12 -0.304 -9.670 -1.015
94 HB VAL 12 HB VAL 12 -1.441 -7.671 -0.016
95 HG11 VAL 12 HG11 VAL 12 -1.967 -8.499 -2.853
96 HG12 VAL 12 HG12 VAL 12 -2.400 -6.897 -2.253
97 HG13 VAL 12 HG13 VAL 12 -0.716 -7.423 -2.231
98 HG21 VAL 12 HG21 VAL 12 -3.725 -7.413 0.028
99 HG22 VAL 12 HG22 VAL 12 -3.994 -8.602 -1.246
100 HG23 VAL 12 HG23 VAL 12 -3.578 -9.134 0.383
101 HA PRO 13 HA PRO 13 -0.026 -11.051 3.144
102 HB2 PRO 13 HB2 PRO 13 1.447 -9.059 4.254
103 HB3 PRO 13 HB3 PRO 13 2.127 -10.248 3.137
104 HG2 PRO 13 HG2 PRO 13 1.220 -7.447 2.599
105 HG3 PRO 13 HG3 PRO 13 2.671 -8.284 2.017
106 HD2 PRO 13 HD2 PRO 13 0.459 -7.968 0.487
107 HD3 PRO 13 HD3 PRO 13 1.521 -9.385 0.351
108 H ALA 14 H ALA 14 -0.524 -10.473 5.393
109 HA ALA 14 HA ALA 14 -3.046 -9.402 5.734
110 HB1 ALA 14 HB1 ALA 14 -2.429 -9.234 8.164
111 HB2 ALA 14 HB2 ALA 14 -2.148 -10.809 7.422
112 HB3 ALA 14 HB3 ALA 14 -0.795 -9.715 7.707
113 H HIS 15 H HIS 15 0.075 -7.795 5.831
114 HA HIS 15 HA HIS 15 -1.326 -5.223 6.166
115 HB2 HIS 15 HB2 HIS 15 0.921 -4.405 7.064
116 HB3 HIS 15 HB3 HIS 15 -0.004 -5.480 8.108
117 HD1 HIS 15 HD1 HIS 15 0.824 -8.053 8.087
118 HD2 HIS 15 HD2 HIS 15 3.458 -5.242 6.531
119 HE1 HIS 15 HE1 HIS 15 3.069 -9.186 8.045
120 H ARG 16 H ARG 16 -1.147 -3.822 4.542
121 HA ARG 16 HA ARG 16 1.025 -4.221 2.590
122 HB2 ARG 16 HB2 ARG 16 -0.507 -3.501 0.825
123 HB3 ARG 16 HB3 ARG 16 -1.132 -4.919 1.657
124 HG2 ARG 16 HG2 ARG 16 -2.013 -2.254 2.615
125 HG3 ARG 16 HG3 ARG 16 -2.657 -2.842 1.081
126 HD2 ARG 16 HD2 ARG 16 -2.654 -4.706 3.392
127 HD3 ARG 16 HD3 ARG 16 -3.818 -3.382 3.407
128 HE ARG 16 HE ARG 16 -3.796 -4.836 0.936
129 HH11 ARG 16 HH11 ARG 16 -5.054 -4.759 4.181
130 HH12 ARG 16 HH12 ARG 16 -6.458 -5.699 3.799
131 HH21 ARG 16 HH21 ARG 16 -5.640 -6.075 0.420
132 HH22 ARG 16 HH22 ARG 16 -6.790 -6.448 1.659
133 H ARG 17 H ARG 17 1.283 -2.537 4.803
134 HA ARG 17 HA ARG 17 1.669 0.007 3.449
135 HB2 ARG 17 HB2 ARG 17 -0.249 -0.430 5.678
136 HB3 ARG 17 HB3 ARG 17 0.735 1.026 5.741
137 HG2 ARG 17 HG2 ARG 17 -0.077 1.660 3.517
138 HG3 ARG 17 HG3 ARG 17 -1.086 0.213 3.486
139 HD2 ARG 17 HD2 ARG 17 -2.526 1.021 5.096
140 HD3 ARG 17 HD3 ARG 17 -1.320 2.116 5.772
141 HE ARG 17 HE ARG 17 -1.942 2.911 3.145
142 HH11 ARG 17 HH11 ARG 17 -3.333 2.807 6.335
143 HH12 ARG 17 HH12 ARG 17 -4.361 4.177 6.074
144 HH21 ARG 17 HH21 ARG 17 -3.290 4.716 2.789
145 HH22 ARG 17 HH22 ARG 17 -4.336 5.262 4.056
146 H VAL 18 H VAL 18 2.692 1.594 5.209
147 HA VAL 18 HA VAL 18 5.052 0.206 6.155
148 HB VAL 18 HB VAL 18 5.299 2.347 4.985
149 HG11 VAL 18 HG11 VAL 18 4.369 3.949 7.272
150 HG12 VAL 18 HG12 VAL 18 4.238 4.257 5.539
151 HG13 VAL 18 HG13 VAL 18 3.102 3.163 6.331
152 HG21 VAL 18 HG21 VAL 18 6.609 1.528 7.260
153 HG22 VAL 18 HG22 VAL 18 7.141 2.807 6.167
154 HG23 VAL 18 HG23 VAL 18 6.214 3.211 7.613
155 H ARG 19 H ARG 19 2.145 1.559 7.463
156 HA ARG 19 HA ARG 19 3.082 0.868 10.165
157 HB2 ARG 19 HB2 ARG 19 1.628 3.333 9.251
158 HB3 ARG 19 HB3 ARG 19 1.477 2.763 10.907
159 HG2 ARG 19 HG2 ARG 19 4.008 2.828 11.011
160 HG3 ARG 19 HG3 ARG 19 3.943 3.721 9.490
161 HD2 ARG 19 HD2 ARG 19 2.318 5.287 10.698
162 HD3 ARG 19 HD3 ARG 19 2.876 4.516 12.182
163 HE ARG 19 HE ARG 19 5.140 5.304 10.801
164 HH11 ARG 19 HH11 ARG 19 2.348 6.813 12.231
165 HH12 ARG 19 HH12 ARG 19 3.172 8.293 12.594
166 HH21 ARG 19 HH21 ARG 19 6.236 7.248 11.273
167 HH22 ARG 19 HH22 ARG 19 5.383 8.540 12.048
168 H GLU 20 H GLU 20 2.004 -1.181 9.484
169 HA GLU 20 HA GLU 20 -0.770 -1.130 10.375
170 HB2 GLU 20 HB2 GLU 20 -0.503 -1.056 7.760
171 HB3 GLU 20 HB3 GLU 20 -0.153 -2.769 7.950
172 HG2 GLU 20 HG2 GLU 20 -2.423 -2.737 7.530
173 HG3 GLU 20 HG3 GLU 20 -2.344 -2.856 9.287
174 H SER 21 H SER 21 -0.974 -2.600 11.916
175 HA SER 21 HA SER 21 0.558 -5.103 11.701
176 HB2 SER 21 HB2 SER 21 1.371 -3.290 13.432
177 HB3 SER 21 HB3 SER 21 0.028 -3.907 14.395
178 HG SER 21 HG SER 21 2.075 -4.982 14.751
179 HA PRO 22 HA PRO 22 -3.996 -5.870 12.324
180 HB2 PRO 22 HB2 PRO 22 -4.221 -7.663 10.298
181 HB3 PRO 22 HB3 PRO 22 -4.400 -5.921 10.062
182 HG2 PRO 22 HG2 PRO 22 -2.025 -7.668 9.545
183 HG3 PRO 22 HG3 PRO 22 -2.690 -6.361 8.548
184 HD2 PRO 22 HD2 PRO 22 -0.529 -6.021 10.143
185 HD3 PRO 22 HD3 PRO 22 -1.687 -4.716 9.813
186 H LEU 23 H LEU 23 -2.607 -6.833 14.222
187 HA LEU 23 HA LEU 23 -2.430 -9.752 13.950
188 HB2 LEU 23 HB2 LEU 23 -1.169 -7.771 15.804
189 HB3 LEU 23 HB3 LEU 23 -1.289 -9.469 16.262
190 HG LEU 23 HG LEU 23 0.903 -9.011 15.365
191 HD11 LEU 23 HD11 LEU 23 -0.628 -11.096 14.677
192 HD12 LEU 23 HD12 LEU 23 1.041 -10.905 14.142
193 HD13 LEU 23 HD13 LEU 23 -0.285 -10.446 13.074
194 HD21 LEU 23 HD21 LEU 23 0.041 -8.489 12.619
195 HD22 LEU 23 HD22 LEU 23 1.327 -7.743 13.568
196 HD23 LEU 23 HD23 LEU 23 -0.338 -7.191 13.750
197 H SER 24 H SER 24 -3.332 -7.422 16.500
198 HA SER 24 HA SER 24 -5.276 -9.357 17.516
199 HB2 SER 24 HB2 SER 24 -4.395 -6.725 18.726
200 HB3 SER 24 HB3 SER 24 -5.364 -7.971 19.514
201 HG SER 24 HG SER 24 -2.717 -7.770 19.402
202 H SER 25 H SER 25 -5.709 -7.848 15.035
203 HA SER 25 HA SER 25 -7.696 -5.849 15.628
204 HB2 SER 25 HB2 SER 25 -6.094 -6.098 13.533
205 HB3 SER 25 HB3 SER 25 -7.433 -7.060 12.907
206 HG SER 25 HG SER 25 -8.256 -5.200 12.393
207 H ASP 26 H ASP 26 -7.663 -9.197 14.512
208 HA ASP 26 HA ASP 26 -10.504 -9.333 14.151
209 HB2 ASP 26 HB2 ASP 26 -8.682 -10.776 13.019
210 HB3 ASP 26 HB3 ASP 26 -8.706 -11.720 14.506
211 H ALA 27 H ALA 27 -8.286 -9.882 16.768
212 HA ALA 27 HA ALA 27 -9.778 -11.548 18.420
213 HB1 ALA 27 HB1 ALA 27 -7.466 -9.881 18.669
214 HB2 ALA 27 HB2 ALA 27 -8.488 -9.693 20.095
215 HB3 ALA 27 HB3 ALA 27 -7.928 -11.295 19.617
216 H ILE 28 H ILE 28 -10.240 -8.213 17.619
217 HA ILE 28 HA ILE 28 -11.661 -7.238 19.772
218 HB ILE 28 HB ILE 28 -12.237 -6.710 16.854
219 HG12 ILE 28 HG12 ILE 28 -10.477 -5.191 18.791
220 HG13 ILE 28 HG13 ILE 28 -9.884 -6.289 17.549
221 HG21 ILE 28 HG21 ILE 28 -12.922 -5.091 19.305
222 HG22 ILE 28 HG22 ILE 28 -13.206 -4.605 17.634
223 HG23 ILE 28 HG23 ILE 28 -14.061 -5.993 18.306
224 HD11 ILE 28 HD11 ILE 28 -11.331 -3.687 17.146
225 HD12 ILE 28 HD12 ILE 28 -9.655 -4.065 16.745
226 HD13 ILE 28 HD13 ILE 28 -10.970 -4.827 15.850
227 H PHE 29 H PHE 29 -12.770 -9.324 17.156
228 HA PHE 29 HA PHE 29 -15.474 -9.361 18.250
229 HB2 PHE 29 HB2 PHE 29 -14.862 -9.253 15.730
230 HB3 PHE 29 HB3 PHE 29 -14.556 -10.979 15.891
231 HD1 PHE 29 HD1 PHE 29 -17.014 -8.463 15.367
232 HD2 PHE 29 HD2 PHE 29 -16.452 -12.432 16.799
233 HE1 PHE 29 HE1 PHE 29 -19.414 -8.910 15.059
234 HE2 PHE 29 HE2 PHE 29 -18.851 -12.886 16.493
235 HZ PHE 29 HZ PHE 29 -20.335 -11.124 15.621
236 H LYS 30 H LYS 30 -12.601 -11.292 18.118
237 HA LYS 30 HA LYS 30 -13.635 -13.833 18.622
238 HB2 LYS 30 HB2 LYS 30 -11.221 -13.140 18.099
239 HB3 LYS 30 HB3 LYS 30 -11.064 -12.821 19.821
240 HG2 LYS 30 HG2 LYS 30 -10.217 -14.983 19.496
241 HG3 LYS 30 HG3 LYS 30 -11.823 -15.207 20.193
242 HD2 LYS 30 HD2 LYS 30 -12.738 -15.897 18.157
243 HD3 LYS 30 HD3 LYS 30 -11.406 -15.213 17.222
244 HE2 LYS 30 HE2 LYS 30 -11.216 -17.584 19.078
245 HE3 LYS 30 HE3 LYS 30 -11.307 -17.666 17.319
246 HZ1 LYS 30 HZ1 LYS 30 -9.090 -16.756 19.022
247 HZ2 LYS 30 HZ2 LYS 30 -9.240 -16.129 17.458
248 HZ3 LYS 30 HZ3 LYS 30 -9.060 -17.796 17.687
249 H GLN 31 H GLN 31 -13.282 -11.081 20.704
250 HA GLN 31 HA GLN 31 -13.435 -12.458 23.183
251 HB2 GLN 31 HB2 GLN 31 -12.665 -10.040 22.712
252 HB3 GLN 31 HB3 GLN 31 -14.376 -9.634 22.758
253 HG2 GLN 31 HG2 GLN 31 -14.536 -10.474 25.029
254 HG3 GLN 31 HG3 GLN 31 -12.838 -10.947 24.988
255 HE21 GLN 31 HE21 GLN 31 -12.302 -9.635 26.717
256 HE22 GLN 31 HE22 GLN 31 -12.231 -7.914 26.589
257 H SER 32 H SER 32 -15.797 -11.312 20.891
258 HA SER 32 HA SER 32 -18.080 -11.221 22.472
259 HB2 SER 32 HB2 SER 32 -18.088 -10.441 20.166
260 HB3 SER 32 HB3 SER 32 -17.805 -12.081 19.581
261 HG SER 32 HG SER 32 -20.095 -11.157 20.984
262 H HIS 33 H HIS 33 -16.335 -13.956 21.191
263 HA HIS 33 HA HIS 33 -18.311 -15.755 22.434
264 HB2 HIS 33 HB2 HIS 33 -18.261 -16.090 20.031
265 HB3 HIS 33 HB3 HIS 33 -16.508 -16.257 20.058
266 HD1 HIS 33 HD1 HIS 33 -19.659 -18.122 20.715
267 HD2 HIS 33 HD2 HIS 33 -15.561 -18.738 21.016
268 HE1 HIS 33 HE1 HIS 33 -19.375 -20.597 21.058
Start of MODEL 10
1 H1 ASN 1 H ASN 1 2.013 -7.182 -0.279
2 HA ASN 1 HA ASN 1 1.915 -4.402 0.614
3 HB2 ASN 1 HB2 ASN 1 4.129 -4.816 -0.526
4 HB3 ASN 1 HB3 ASN 1 3.229 -5.166 -1.998
5 HD21 ASN 1 HD21 ASN 1 4.625 -3.355 -2.733
6 HD22 ASN 1 HD22 ASN 1 4.016 -1.749 -2.545
7 H VAL 2 H VAL 2 0.022 -3.544 0.088
8 HA VAL 2 HA VAL 2 -1.946 -4.895 -1.372
9 HB VAL 2 HB VAL 2 -3.201 -2.763 -1.345
10 HG11 VAL 2 HG11 VAL 2 -3.023 -2.448 1.222
11 HG12 VAL 2 HG12 VAL 2 -3.552 -4.005 0.580
12 HG13 VAL 2 HG13 VAL 2 -1.891 -3.798 1.138
13 HG21 VAL 2 HG21 VAL 2 -1.528 -1.196 0.316
14 HG22 VAL 2 HG22 VAL 2 -0.587 -1.659 -1.102
15 HG23 VAL 2 HG23 VAL 2 -2.126 -0.820 -1.300
16 H ASP 3 H ASP 3 -3.149 -3.433 -3.182
17 HA ASP 3 HA ASP 3 -1.243 -2.445 -5.147
18 HB2 ASP 3 HB2 ASP 3 -2.280 -3.929 -6.919
19 HB3 ASP 3 HB3 ASP 3 -1.235 -4.746 -5.759
20 H VAL 4 H VAL 4 -2.416 -1.608 -7.123
21 HA VAL 4 HA VAL 4 -4.721 -0.082 -6.218
22 HB VAL 4 HB VAL 4 -3.440 0.151 -8.928
23 HG11 VAL 4 HG11 VAL 4 -4.123 2.650 -7.983
24 HG12 VAL 4 HG12 VAL 4 -5.064 1.672 -9.110
25 HG13 VAL 4 HG13 VAL 4 -5.419 1.616 -7.382
26 HG21 VAL 4 HG21 VAL 4 -2.514 1.454 -6.369
27 HG22 VAL 4 HG22 VAL 4 -1.630 0.248 -7.306
28 HG23 VAL 4 HG23 VAL 4 -1.932 1.847 -7.987
29 H ARG 5 H ARG 5 -4.514 -3.052 -7.307
30 HA ARG 5 HA ARG 5 -6.458 -2.945 -9.457
31 HB2 ARG 5 HB2 ARG 5 -5.055 -5.227 -8.067
32 HB3 ARG 5 HB3 ARG 5 -6.275 -5.467 -9.310
33 HG2 ARG 5 HG2 ARG 5 -3.704 -3.947 -9.686
34 HG3 ARG 5 HG3 ARG 5 -3.982 -5.619 -10.177
35 HD2 ARG 5 HD2 ARG 5 -5.911 -4.763 -11.560
36 HD3 ARG 5 HD3 ARG 5 -5.325 -3.136 -11.221
37 HE ARG 5 HE ARG 5 -3.620 -3.470 -12.717
38 HH11 ARG 5 HH11 ARG 5 -5.108 -6.525 -11.962
39 HH12 ARG 5 HH12 ARG 5 -4.250 -7.395 -13.190
40 HH21 ARG 5 HH21 ARG 5 -2.484 -4.604 -14.337
41 HH22 ARG 5 HH22 ARG 5 -2.756 -6.301 -14.540
42 H TYR 6 H TYR 6 -8.553 -2.774 -9.054
43 HA TYR 6 HA TYR 6 -9.625 -4.028 -6.612
44 HB2 TYR 6 HB2 TYR 6 -11.397 -2.222 -6.706
45 HB3 TYR 6 HB3 TYR 6 -9.779 -1.674 -6.283
46 HD1 TYR 6 HD1 TYR 6 -8.507 -0.265 -7.788
47 HD2 TYR 6 HD2 TYR 6 -12.388 -1.643 -8.857
48 HE1 TYR 6 HE1 TYR 6 -8.584 1.385 -9.611
49 HE2 TYR 6 HE2 TYR 6 -12.476 0.002 -10.683
50 HH TYR 6 HH TYR 6 -11.492 1.975 -11.432
51 H THR 7 H THR 7 -9.392 -5.375 -9.067
52 HA THR 7 HA THR 7 -12.163 -5.456 -10.054
53 HB THR 7 HB THR 7 -10.904 -7.015 -11.827
54 HG1 THR 7 HG1 THR 7 -8.810 -6.769 -11.760
55 HG21 THR 7 HG21 THR 7 -10.643 -4.983 -13.251
56 HG22 THR 7 HG22 THR 7 -10.978 -3.998 -11.827
57 HG23 THR 7 HG23 THR 7 -12.210 -5.094 -12.451
58 H TYR 8 H TYR 8 -10.812 -6.770 -7.621
59 HA TYR 8 HA TYR 8 -12.321 -9.148 -7.644
60 HB2 TYR 8 HB2 TYR 8 -10.578 -10.829 -7.708
61 HB3 TYR 8 HB3 TYR 8 -10.511 -9.874 -9.184
62 HD1 TYR 8 HD1 TYR 8 -8.618 -11.223 -6.543
63 HD2 TYR 8 HD2 TYR 8 -8.835 -7.844 -9.120
64 HE1 TYR 8 HE1 TYR 8 -6.238 -10.759 -6.126
65 HE2 TYR 8 HE2 TYR 8 -6.456 -7.372 -8.712
66 HH TYR 8 HH TYR 8 -4.380 -8.877 -7.980
67 H ARG 9 H ARG 9 -11.047 -10.709 -5.820
68 HA ARG 9 HA ARG 9 -10.773 -8.892 -3.519
69 HB2 ARG 9 HB2 ARG 9 -12.054 -11.551 -3.878
70 HB3 ARG 9 HB3 ARG 9 -11.280 -11.234 -2.331
71 HG2 ARG 9 HG2 ARG 9 -13.446 -10.561 -1.943
72 HG3 ARG 9 HG3 ARG 9 -12.660 -9.041 -2.375
73 HD2 ARG 9 HD2 ARG 9 -13.908 -10.682 -4.526
74 HD3 ARG 9 HD3 ARG 9 -14.952 -9.745 -3.457
75 HE ARG 9 HE ARG 9 -13.008 -7.998 -4.303
76 HH11 ARG 9 HH11 ARG 9 -15.424 -9.996 -5.816
77 HH12 ARG 9 HH12 ARG 9 -15.639 -8.937 -7.171
78 HH21 ARG 9 HH21 ARG 9 -13.281 -6.596 -6.082
79 HH22 ARG 9 HH22 ARG 9 -14.418 -7.004 -7.321
80 HA PRO 10 HA PRO 10 -6.577 -10.712 -4.023
81 HB2 PRO 10 HB2 PRO 10 -5.280 -8.483 -3.174
82 HB3 PRO 10 HB3 PRO 10 -5.804 -8.711 -4.847
83 HG2 PRO 10 HG2 PRO 10 -7.109 -7.152 -2.650
84 HG3 PRO 10 HG3 PRO 10 -6.885 -6.712 -4.354
85 HD2 PRO 10 HD2 PRO 10 -9.233 -7.655 -3.389
86 HD3 PRO 10 HD3 PRO 10 -8.684 -7.976 -5.047
87 H SER 11 H SER 11 -5.900 -11.995 -2.436
88 HA SER 11 HA SER 11 -6.678 -11.617 0.279
89 HB2 SER 11 HB2 SER 11 -5.031 -13.616 -1.211
90 HB3 SER 11 HB3 SER 11 -4.883 -13.550 0.545
91 HG SER 11 HG SER 11 -6.673 -14.855 -0.717
92 H VAL 12 H VAL 12 -5.803 -9.516 0.715
93 HA VAL 12 HA VAL 12 -2.992 -9.024 0.634
94 HB VAL 12 HB VAL 12 -3.552 -7.018 2.030
95 HG11 VAL 12 HG11 VAL 12 -3.494 -6.745 -0.329
96 HG12 VAL 12 HG12 VAL 12 -5.068 -7.521 -0.523
97 HG13 VAL 12 HG13 VAL 12 -4.953 -5.935 0.242
98 HG21 VAL 12 HG21 VAL 12 -5.459 -6.927 3.162
99 HG22 VAL 12 HG22 VAL 12 -6.375 -7.043 1.659
100 HG23 VAL 12 HG23 VAL 12 -5.910 -8.508 2.524
101 HA PRO 13 HA PRO 13 -1.646 -10.754 4.440
102 HB2 PRO 13 HB2 PRO 13 0.300 -8.998 5.147
103 HB3 PRO 13 HB3 PRO 13 0.483 -10.151 3.819
104 HG2 PRO 13 HG2 PRO 13 -0.229 -7.244 3.721
105 HG3 PRO 13 HG3 PRO 13 0.883 -8.160 2.686
106 HD2 PRO 13 HD2 PRO 13 -1.634 -7.524 1.916
107 HD3 PRO 13 HD3 PRO 13 -0.824 -9.015 1.395
108 H ALA 14 H ALA 14 -1.390 -10.317 6.759
109 HA ALA 14 HA ALA 14 -3.562 -8.873 7.815
110 HB1 ALA 14 HB1 ALA 14 -1.894 -10.807 8.762
111 HB2 ALA 14 HB2 ALA 14 -1.368 -9.397 9.683
112 HB3 ALA 14 HB3 ALA 14 -3.055 -9.907 9.739
113 H HIS 15 H HIS 15 -0.312 -7.954 7.070
114 HA HIS 15 HA HIS 15 -0.827 -5.298 8.234
115 HB2 HIS 15 HB2 HIS 15 1.912 -6.547 8.014
116 HB3 HIS 15 HB3 HIS 15 1.461 -5.081 8.880
117 HD1 HIS 15 HD1 HIS 15 2.476 -8.299 9.648
118 HD2 HIS 15 HD2 HIS 15 -0.740 -5.995 10.918
119 HE1 HIS 15 HE1 HIS 15 1.751 -9.304 11.837
120 H ARG 16 H ARG 16 -1.036 -3.839 6.682
121 HA ARG 16 HA ARG 16 0.314 -4.281 4.115
122 HB2 ARG 16 HB2 ARG 16 -1.274 -2.636 3.208
123 HB3 ARG 16 HB3 ARG 16 -2.099 -3.982 3.981
124 HG2 ARG 16 HG2 ARG 16 -2.344 -2.548 6.018
125 HG3 ARG 16 HG3 ARG 16 -1.722 -1.202 5.061
126 HD2 ARG 16 HD2 ARG 16 -3.565 -1.348 3.540
127 HD3 ARG 16 HD3 ARG 16 -4.127 -2.843 4.286
128 HE ARG 16 HE ARG 16 -4.019 -0.600 6.086
129 HH11 ARG 16 HH11 ARG 16 -5.942 -2.329 3.755
130 HH12 ARG 16 HH12 ARG 16 -7.452 -1.755 4.381
131 HH21 ARG 16 HH21 ARG 16 -6.001 0.163 6.919
132 HH22 ARG 16 HH22 ARG 16 -7.485 -0.337 6.180
133 H ARG 17 H ARG 17 1.884 -3.393 6.264
134 HA ARG 17 HA ARG 17 3.149 -1.151 5.117
135 HB2 ARG 17 HB2 ARG 17 1.063 -0.591 7.062
136 HB3 ARG 17 HB3 ARG 17 2.623 0.034 7.580
137 HG2 ARG 17 HG2 ARG 17 2.670 1.618 5.983
138 HG3 ARG 17 HG3 ARG 17 1.905 0.578 4.780
139 HD2 ARG 17 HD2 ARG 17 -0.255 1.001 5.658
140 HD3 ARG 17 HD3 ARG 17 0.407 1.752 7.109
141 HE ARG 17 HE ARG 17 -0.085 3.014 4.603
142 HH11 ARG 17 HH11 ARG 17 2.023 3.028 7.373
143 HH12 ARG 17 HH12 ARG 17 2.454 4.697 7.200
144 HH21 ARG 17 HH21 ARG 17 0.474 5.212 4.365
145 HH22 ARG 17 HH22 ARG 17 1.572 5.939 5.489
146 H VAL 18 H VAL 18 4.693 -0.138 6.976
147 HA VAL 18 HA VAL 18 6.196 -2.429 7.936
148 HB VAL 18 HB VAL 18 7.339 -0.555 6.777
149 HG11 VAL 18 HG11 VAL 18 5.781 1.097 8.209
150 HG12 VAL 18 HG12 VAL 18 7.247 1.145 9.189
151 HG13 VAL 18 HG13 VAL 18 7.310 1.592 7.484
152 HG21 VAL 18 HG21 VAL 18 9.260 -0.726 8.034
153 HG22 VAL 18 HG22 VAL 18 8.399 -0.593 9.567
154 HG23 VAL 18 HG23 VAL 18 8.331 -2.095 8.645
155 H ARG 19 H ARG 19 4.106 0.018 9.186
156 HA ARG 19 HA ARG 19 4.349 -1.137 11.847
157 HB2 ARG 19 HB2 ARG 19 4.841 1.773 11.226
158 HB3 ARG 19 HB3 ARG 19 4.395 1.210 12.831
159 HG2 ARG 19 HG2 ARG 19 6.392 -0.084 13.012
160 HG3 ARG 19 HG3 ARG 19 6.801 0.220 11.322
161 HD2 ARG 19 HD2 ARG 19 6.994 2.626 11.835
162 HD3 ARG 19 HD3 ARG 19 6.661 2.271 13.529
163 HE ARG 19 HE ARG 19 8.885 0.797 12.473
164 HH11 ARG 19 HH11 ARG 19 7.877 3.806 13.904
165 HH12 ARG 19 HH12 ARG 19 9.448 4.185 14.529
166 HH21 ARG 19 HH21 ARG 19 10.958 1.285 13.291
167 HH22 ARG 19 HH22 ARG 19 11.200 2.751 14.179
168 H GLU 20 H GLU 20 2.294 -1.429 10.000
169 HA GLU 20 HA GLU 20 0.193 0.383 10.150
170 HB2 GLU 20 HB2 GLU 20 -1.256 -1.441 9.489
171 HB3 GLU 20 HB3 GLU 20 0.267 -1.558 8.619
172 HG2 GLU 20 HG2 GLU 20 0.026 -3.728 9.216
173 HG3 GLU 20 HG3 GLU 20 0.886 -3.144 10.639
174 H SER 21 H SER 21 -1.888 0.096 11.309
175 HA SER 21 HA SER 21 -2.004 -1.374 13.738
176 HB2 SER 21 HB2 SER 21 -0.492 0.235 14.641
177 HB3 SER 21 HB3 SER 21 -1.367 1.575 13.898
178 HG SER 21 HG SER 21 -2.213 1.635 15.849
179 HA PRO 22 HA PRO 22 -5.984 0.158 11.844
180 HB2 PRO 22 HB2 PRO 22 -7.082 -2.307 11.546
181 HB3 PRO 22 HB3 PRO 22 -6.049 -1.561 10.321
182 HG2 PRO 22 HG2 PRO 22 -5.354 -3.602 12.398
183 HG3 PRO 22 HG3 PRO 22 -4.878 -3.536 10.691
184 HD2 PRO 22 HD2 PRO 22 -3.230 -2.757 12.693
185 HD3 PRO 22 HD3 PRO 22 -3.203 -2.003 11.087
186 H LEU 23 H LEU 23 -8.265 -0.546 12.596
187 HA LEU 23 HA LEU 23 -8.235 -0.527 15.496
188 HB2 LEU 23 HB2 LEU 23 -10.394 -0.162 13.438
189 HB3 LEU 23 HB3 LEU 23 -10.744 -0.267 15.162
190 HG LEU 23 HG LEU 23 -10.732 2.035 14.568
191 HD11 LEU 23 HD11 LEU 23 -9.360 1.116 16.622
192 HD12 LEU 23 HD12 LEU 23 -9.363 2.831 16.211
193 HD13 LEU 23 HD13 LEU 23 -8.006 1.813 15.732
194 HD21 LEU 23 HD21 LEU 23 -8.908 1.293 12.624
195 HD22 LEU 23 HD22 LEU 23 -7.971 2.309 13.720
196 HD23 LEU 23 HD23 LEU 23 -9.448 2.933 12.984
197 H SER 24 H SER 24 -9.385 -2.587 12.871
198 HA SER 24 HA SER 24 -10.395 -4.555 14.769
199 HB2 SER 24 HB2 SER 24 -10.934 -5.791 12.548
200 HB3 SER 24 HB3 SER 24 -11.862 -4.348 12.956
201 HG SER 24 HG SER 24 -11.103 -4.336 10.784
202 H SER 25 H SER 25 -7.689 -4.209 15.038
203 HA SER 25 HA SER 25 -6.287 -6.215 13.501
204 HB2 SER 25 HB2 SER 25 -5.263 -4.041 14.346
205 HB3 SER 25 HB3 SER 25 -5.262 -4.775 15.950
206 HG SER 25 HG SER 25 -3.293 -5.214 15.053
207 H ASP 26 H ASP 26 -7.447 -5.817 16.819
208 HA ASP 26 HA ASP 26 -6.513 -8.450 17.583
209 HB2 ASP 26 HB2 ASP 26 -7.165 -7.906 19.774
210 HB3 ASP 26 HB3 ASP 26 -6.609 -6.376 19.101
211 H ALA 27 H ALA 27 -9.423 -6.962 16.441
212 HA ALA 27 HA ALA 27 -11.334 -8.788 17.361
213 HB1 ALA 27 HB1 ALA 27 -11.253 -7.056 14.903
214 HB2 ALA 27 HB2 ALA 27 -12.653 -8.034 15.345
215 HB3 ALA 27 HB3 ALA 27 -12.096 -6.754 16.423
216 H ILE 28 H ILE 28 -8.891 -9.111 14.966
217 HA ILE 28 HA ILE 28 -10.078 -11.121 13.367
218 HB ILE 28 HB ILE 28 -7.150 -10.575 13.872
219 HG12 ILE 28 HG12 ILE 28 -8.328 -8.641 12.941
220 HG13 ILE 28 HG13 ILE 28 -7.253 -9.347 11.740
221 HG21 ILE 28 HG21 ILE 28 -8.486 -12.154 11.678
222 HG22 ILE 28 HG22 ILE 28 -6.766 -11.780 11.776
223 HG23 ILE 28 HG23 ILE 28 -7.514 -12.816 12.992
224 HD11 ILE 28 HD11 ILE 28 -9.300 -8.766 10.674
225 HD12 ILE 28 HD12 ILE 28 -9.221 -10.525 10.779
226 HD13 ILE 28 HD13 ILE 28 -10.241 -9.620 11.896
227 H PHE 29 H PHE 29 -8.511 -11.166 16.456
228 HA PHE 29 HA PHE 29 -8.277 -14.082 16.411
229 HB2 PHE 29 HB2 PHE 29 -6.444 -12.506 17.301
230 HB3 PHE 29 HB3 PHE 29 -7.489 -12.294 18.702
231 HD1 PHE 29 HD1 PHE 29 -5.084 -14.401 17.075
232 HD2 PHE 29 HD2 PHE 29 -8.108 -14.308 20.068
233 HE1 PHE 29 HE1 PHE 29 -4.161 -16.455 18.066
234 HE2 PHE 29 HE2 PHE 29 -7.190 -16.361 21.065
235 HZ PHE 29 HZ PHE 29 -5.213 -17.437 20.065
236 H LYS 30 H LYS 30 -10.288 -11.567 17.599
237 HA LYS 30 HA LYS 30 -11.411 -12.768 19.862
238 HB2 LYS 30 HB2 LYS 30 -13.000 -11.094 19.797
239 HB3 LYS 30 HB3 LYS 30 -11.708 -10.373 18.846
240 HG2 LYS 30 HG2 LYS 30 -13.371 -9.947 17.401
241 HG3 LYS 30 HG3 LYS 30 -13.089 -11.616 16.898
242 HD2 LYS 30 HD2 LYS 30 -14.798 -12.067 18.900
243 HD3 LYS 30 HD3 LYS 30 -15.327 -10.444 18.450
244 HE2 LYS 30 HE2 LYS 30 -14.942 -12.577 16.379
245 HE3 LYS 30 HE3 LYS 30 -16.436 -12.478 17.310
246 HZ1 LYS 30 HZ1 LYS 30 -17.090 -10.641 16.225
247 HZ2 LYS 30 HZ2 LYS 30 -16.020 -11.168 15.027
248 HZ3 LYS 30 HZ3 LYS 30 -15.533 -9.986 16.134
249 H GLN 31 H GLN 31 -11.741 -13.528 16.535
250 HA GLN 31 HA GLN 31 -14.292 -14.662 16.459
251 HB2 GLN 31 HB2 GLN 31 -12.964 -14.252 14.447
252 HB3 GLN 31 HB3 GLN 31 -11.807 -15.480 14.944
253 HG2 GLN 31 HG2 GLN 31 -13.592 -17.175 14.794
254 HG3 GLN 31 HG3 GLN 31 -14.688 -15.929 14.201
255 HE21 GLN 31 HE21 GLN 31 -14.553 -17.889 12.560
256 HE22 GLN 31 HE22 GLN 31 -13.511 -17.595 11.214
257 H SER 32 H SER 32 -11.341 -15.808 17.860
258 HA SER 32 HA SER 32 -12.264 -18.542 18.098
259 HB2 SER 32 HB2 SER 32 -9.849 -17.962 17.767
260 HB3 SER 32 HB3 SER 32 -9.845 -17.251 19.380
261 HG SER 32 HG SER 32 -9.873 -19.909 18.608
262 H HIS 33 H HIS 33 -11.772 -15.744 20.206
263 HA HIS 33 HA HIS 33 -12.489 -17.056 22.614
264 HB2 HIS 33 HB2 HIS 33 -11.262 -14.780 22.223
265 HB3 HIS 33 HB3 HIS 33 -12.891 -14.112 22.205
266 HD1 HIS 33 HD1 HIS 33 -11.541 -16.811 24.506
267 HD2 HIS 33 HD2 HIS 33 -13.011 -12.928 24.652
268 HE1 HIS 33 HE1 HIS 33 -11.725 -16.253 26.951
Start of MODEL 11
1 H1 ASN 1 H ASN 1 -2.798 -4.200 4.262
2 HA ASN 1 HA ASN 1 -2.224 -2.970 1.892
3 HB2 ASN 1 HB2 ASN 1 -3.155 -5.119 1.737
4 HB3 ASN 1 HB3 ASN 1 -4.550 -4.686 2.721
5 HD21 ASN 1 HD21 ASN 1 -6.363 -4.107 1.731
6 HD22 ASN 1 HD22 ASN 1 -6.519 -3.782 0.041
7 H VAL 2 H VAL 2 -2.478 -0.848 1.532
8 HA VAL 2 HA VAL 2 -4.965 0.472 2.318
9 HB VAL 2 HB VAL 2 -2.676 1.486 2.772
10 HG11 VAL 2 HG11 VAL 2 -2.664 2.629 0.053
11 HG12 VAL 2 HG12 VAL 2 -1.320 2.199 1.113
12 HG13 VAL 2 HG13 VAL 2 -2.150 0.947 0.188
13 HG21 VAL 2 HG21 VAL 2 -3.988 3.245 3.120
14 HG22 VAL 2 HG22 VAL 2 -3.761 3.702 1.432
15 HG23 VAL 2 HG23 VAL 2 -5.129 2.691 1.895
16 H ASP 3 H ASP 3 -4.677 -1.446 0.020
17 HA ASP 3 HA ASP 3 -5.151 0.254 -2.294
18 HB2 ASP 3 HB2 ASP 3 -3.856 -2.040 -2.196
19 HB3 ASP 3 HB3 ASP 3 -5.472 -2.720 -2.362
20 H VAL 4 H VAL 4 -7.033 -0.544 -3.756
21 HA VAL 4 HA VAL 4 -9.444 -0.622 -2.073
22 HB VAL 4 HB VAL 4 -10.641 0.293 -4.030
23 HG11 VAL 4 HG11 VAL 4 -9.358 2.542 -4.043
24 HG12 VAL 4 HG12 VAL 4 -10.034 1.950 -2.524
25 HG13 VAL 4 HG13 VAL 4 -8.312 1.762 -2.856
26 HG21 VAL 4 HG21 VAL 4 -8.430 -0.578 -5.452
27 HG22 VAL 4 HG22 VAL 4 -9.752 0.410 -6.073
28 HG23 VAL 4 HG23 VAL 4 -8.285 1.179 -5.470
29 H ARG 5 H ARG 5 -7.848 -2.961 -2.896
30 HA ARG 5 HA ARG 5 -9.683 -4.320 -4.733
31 HB2 ARG 5 HB2 ARG 5 -7.129 -4.363 -5.008
32 HB3 ARG 5 HB3 ARG 5 -7.124 -5.459 -3.632
33 HG2 ARG 5 HG2 ARG 5 -7.561 -7.163 -4.969
34 HG3 ARG 5 HG3 ARG 5 -9.053 -6.384 -5.501
35 HD2 ARG 5 HD2 ARG 5 -6.582 -5.312 -6.683
36 HD3 ARG 5 HD3 ARG 5 -6.964 -6.976 -7.124
37 HE ARG 5 HE ARG 5 -9.281 -5.447 -7.425
38 HH11 ARG 5 HH11 ARG 5 -6.109 -5.734 -8.832
39 HH12 ARG 5 HH12 ARG 5 -6.612 -5.186 -10.397
40 HH21 ARG 5 HH21 ARG 5 -9.954 -4.724 -9.481
41 HH22 ARG 5 HH22 ARG 5 -8.799 -4.611 -10.765
42 H TYR 6 H TYR 6 -11.342 -5.315 -3.806
43 HA TYR 6 HA TYR 6 -10.845 -6.975 -1.443
44 HB2 TYR 6 HB2 TYR 6 -13.091 -6.200 -0.541
45 HB3 TYR 6 HB3 TYR 6 -11.777 -5.032 -0.446
46 HD1 TYR 6 HD1 TYR 6 -11.855 -2.979 -1.676
47 HD2 TYR 6 HD2 TYR 6 -14.891 -5.912 -2.207
48 HE1 TYR 6 HE1 TYR 6 -13.229 -1.331 -2.879
49 HE2 TYR 6 HE2 TYR 6 -16.273 -4.273 -3.413
50 HH TYR 6 HH TYR 6 -16.526 -2.053 -3.859
51 H THR 7 H THR 7 -11.100 -7.715 -4.177
52 HA THR 7 HA THR 7 -13.764 -8.928 -4.333
53 HB THR 7 HB THR 7 -12.620 -9.666 -6.659
54 HG1 THR 7 HG1 THR 7 -11.589 -7.063 -6.377
55 HG21 THR 7 HG21 THR 7 -13.592 -6.864 -6.597
56 HG22 THR 7 HG22 THR 7 -14.675 -8.107 -5.972
57 HG23 THR 7 HG23 THR 7 -14.079 -8.208 -7.628
58 H TYR 8 H TYR 8 -10.978 -9.708 -2.938
59 HA TYR 8 HA TYR 8 -11.536 -12.460 -2.757
60 HB2 TYR 8 HB2 TYR 8 -9.673 -13.418 -3.976
61 HB3 TYR 8 HB3 TYR 8 -10.650 -12.452 -5.076
62 HD1 TYR 8 HD1 TYR 8 -7.375 -13.088 -3.887
63 HD2 TYR 8 HD2 TYR 8 -9.845 -10.012 -5.481
64 HE1 TYR 8 HE1 TYR 8 -5.369 -11.830 -4.553
65 HE2 TYR 8 HE2 TYR 8 -7.846 -8.746 -6.152
66 HH TYR 8 HH TYR 8 -4.594 -10.073 -5.702
67 H ARG 9 H ARG 9 -9.112 -13.536 -2.127
68 HA ARG 9 HA ARG 9 -8.243 -11.837 0.114
69 HB2 ARG 9 HB2 ARG 9 -8.404 -14.828 -0.198
70 HB3 ARG 9 HB3 ARG 9 -7.443 -14.078 1.069
71 HG2 ARG 9 HG2 ARG 9 -9.348 -13.139 2.096
72 HG3 ARG 9 HG3 ARG 9 -10.366 -13.501 0.700
73 HD2 ARG 9 HD2 ARG 9 -9.820 -15.952 1.160
74 HD3 ARG 9 HD3 ARG 9 -9.211 -15.400 2.720
75 HE ARG 9 HE ARG 9 -11.369 -15.154 3.425
76 HH11 ARG 9 HH11 ARG 9 -11.332 -15.311 -0.053
77 HH12 ARG 9 HH12 ARG 9 -13.058 -15.357 -0.199
78 HH21 ARG 9 HH21 ARG 9 -13.642 -15.214 3.245
79 HH22 ARG 9 HH22 ARG 9 -14.371 -15.301 1.677
80 HA PRO 10 HA PRO 10 -4.580 -11.982 -2.665
81 HB2 PRO 10 HB2 PRO 10 -3.750 -9.472 -2.046
82 HB3 PRO 10 HB3 PRO 10 -4.962 -9.804 -3.288
83 HG2 PRO 10 HG2 PRO 10 -5.347 -8.922 -0.454
84 HG3 PRO 10 HG3 PRO 10 -6.167 -8.359 -1.922
85 HD2 PRO 10 HD2 PRO 10 -7.294 -10.132 -0.213
86 HD3 PRO 10 HD3 PRO 10 -7.605 -10.159 -1.961
87 H SER 11 H SER 11 -2.286 -11.737 -2.135
88 HA SER 11 HA SER 11 -1.775 -12.559 0.612
89 HB2 SER 11 HB2 SER 11 -0.269 -12.733 -1.967
90 HB3 SER 11 HB3 SER 11 0.631 -12.808 -0.453
91 HG SER 11 HG SER 11 0.109 -14.864 -0.696
92 H VAL 12 H VAL 12 -2.453 -10.080 0.896
93 HA VAL 12 HA VAL 12 0.061 -8.543 1.039
94 HB VAL 12 HB VAL 12 -1.446 -6.501 1.073
95 HG11 VAL 12 HG11 VAL 12 -0.270 -6.685 -0.888
96 HG12 VAL 12 HG12 VAL 12 -0.964 -8.258 -1.285
97 HG13 VAL 12 HG13 VAL 12 -1.923 -6.792 -1.492
98 HG21 VAL 12 HG21 VAL 12 -3.663 -6.756 0.053
99 HG22 VAL 12 HG22 VAL 12 -3.458 -8.507 0.055
100 HG23 VAL 12 HG23 VAL 12 -3.544 -7.628 1.581
101 HA PRO 13 HA PRO 13 -0.394 -8.292 5.399
102 HB2 PRO 13 HB2 PRO 13 0.664 -5.842 5.896
103 HB3 PRO 13 HB3 PRO 13 1.646 -7.235 5.430
104 HG2 PRO 13 HG2 PRO 13 0.646 -4.972 3.744
105 HG3 PRO 13 HG3 PRO 13 2.246 -5.737 3.755
106 HD2 PRO 13 HD2 PRO 13 0.369 -6.314 1.891
107 HD3 PRO 13 HD3 PRO 13 1.545 -7.514 2.465
108 H ALA 14 H ALA 14 -1.378 -7.036 7.158
109 HA ALA 14 HA ALA 14 -3.971 -6.132 6.482
110 HB1 ALA 14 HB1 ALA 14 -4.196 -5.604 8.862
111 HB2 ALA 14 HB2 ALA 14 -3.493 -7.203 8.615
112 HB3 ALA 14 HB3 ALA 14 -2.463 -5.849 9.079
113 H HIS 15 H HIS 15 -0.935 -4.500 6.987
114 HA HIS 15 HA HIS 15 -2.277 -1.937 6.438
115 HB2 HIS 15 HB2 HIS 15 -0.365 -0.904 7.796
116 HB3 HIS 15 HB3 HIS 15 -1.632 -1.733 8.696
117 HD1 HIS 15 HD1 HIS 15 -0.996 -4.230 9.498
118 HD2 HIS 15 HD2 HIS 15 2.158 -1.821 8.269
119 HE1 HIS 15 HE1 HIS 15 1.078 -5.324 10.406
120 H ARG 16 H ARG 16 -0.812 -0.296 5.473
121 HA ARG 16 HA ARG 16 1.038 -1.599 3.595
122 HB2 ARG 16 HB2 ARG 16 -0.951 -0.390 2.658
123 HB3 ARG 16 HB3 ARG 16 -0.288 1.101 3.316
124 HG2 ARG 16 HG2 ARG 16 0.689 1.333 1.328
125 HG3 ARG 16 HG3 ARG 16 1.824 0.105 1.892
126 HD2 ARG 16 HD2 ARG 16 0.846 -1.561 0.655
127 HD3 ARG 16 HD3 ARG 16 -0.734 -0.778 0.653
128 HE ARG 16 HE ARG 16 -0.154 0.274 -1.287
129 HH11 ARG 16 HH11 ARG 16 2.741 -0.852 0.285
130 HH12 ARG 16 HH12 ARG 16 3.781 -0.416 -1.031
131 HH21 ARG 16 HH21 ARG 16 1.204 0.852 -3.026
132 HH22 ARG 16 HH22 ARG 16 2.906 0.554 -2.913
133 H ARG 17 H ARG 17 2.253 -1.300 5.898
134 HA ARG 17 HA ARG 17 4.331 0.575 5.348
135 HB2 ARG 17 HB2 ARG 17 2.176 1.387 7.112
136 HB3 ARG 17 HB3 ARG 17 3.721 1.377 7.952
137 HG2 ARG 17 HG2 ARG 17 3.143 2.829 5.378
138 HG3 ARG 17 HG3 ARG 17 3.209 3.562 6.982
139 HD2 ARG 17 HD2 ARG 17 5.576 2.604 7.121
140 HD3 ARG 17 HD3 ARG 17 5.440 2.347 5.382
141 HE ARG 17 HE ARG 17 4.764 5.013 6.050
142 HH11 ARG 17 HH11 ARG 17 7.488 2.870 5.728
143 HH12 ARG 17 HH12 ARG 17 8.608 4.138 5.354
144 HH21 ARG 17 HH21 ARG 17 6.228 6.691 5.558
145 HH22 ARG 17 HH22 ARG 17 7.890 6.311 5.258
146 H VAL 18 H VAL 18 5.757 0.709 7.539
147 HA VAL 18 HA VAL 18 6.204 -2.097 8.262
148 HB VAL 18 HB VAL 18 8.086 -0.817 7.253
149 HG11 VAL 18 HG11 VAL 18 9.054 1.026 8.235
150 HG12 VAL 18 HG12 VAL 18 7.349 1.300 8.598
151 HG13 VAL 18 HG13 VAL 18 8.419 0.641 9.835
152 HG21 VAL 18 HG21 VAL 18 9.700 -1.832 8.560
153 HG22 VAL 18 HG22 VAL 18 8.852 -1.482 10.066
154 HG23 VAL 18 HG23 VAL 18 8.254 -2.745 8.991
155 H ARG 19 H ARG 19 5.352 0.990 9.592
156 HA ARG 19 HA ARG 19 5.286 -0.220 12.279
157 HB2 ARG 19 HB2 ARG 19 6.067 2.552 11.421
158 HB3 ARG 19 HB3 ARG 19 5.478 2.244 13.049
159 HG2 ARG 19 HG2 ARG 19 7.324 0.979 13.622
160 HG3 ARG 19 HG3 ARG 19 7.724 0.619 11.941
161 HD2 ARG 19 HD2 ARG 19 8.344 2.981 11.612
162 HD3 ARG 19 HD3 ARG 19 7.999 3.292 13.312
163 HE ARG 19 HE ARG 19 10.361 2.122 12.234
164 HH11 ARG 19 HH11 ARG 19 8.242 2.098 14.996
165 HH12 ARG 19 HH12 ARG 19 9.471 1.573 16.098
166 HH21 ARG 19 HH21 ARG 19 11.988 1.431 13.675
167 HH22 ARG 19 HH22 ARG 19 11.602 1.194 15.346
168 H GLU 20 H GLU 20 3.120 -0.706 10.895
169 HA GLU 20 HA GLU 20 1.163 1.302 11.802
170 HB2 GLU 20 HB2 GLU 20 1.462 -0.056 9.194
171 HB3 GLU 20 HB3 GLU 20 -0.179 0.033 9.819
172 HG2 GLU 20 HG2 GLU 20 0.179 2.503 10.110
173 HG3 GLU 20 HG3 GLU 20 1.684 2.310 9.212
174 H SER 21 H SER 21 -0.913 0.478 12.437
175 HA SER 21 HA SER 21 -1.314 -2.347 12.754
176 HB2 SER 21 HB2 SER 21 0.276 -1.479 14.666
177 HB3 SER 21 HB3 SER 21 -1.226 -0.865 15.356
178 HG SER 21 HG SER 21 -0.484 -3.115 15.897
179 HA PRO 22 HA PRO 22 -5.111 0.316 12.508
180 HB2 PRO 22 HB2 PRO 22 -6.270 -1.119 10.516
181 HB3 PRO 22 HB3 PRO 22 -5.132 0.199 10.214
182 HG2 PRO 22 HG2 PRO 22 -4.648 -2.755 10.228
183 HG3 PRO 22 HG3 PRO 22 -4.057 -1.530 9.090
184 HD2 PRO 22 HD2 PRO 22 -2.521 -2.525 11.086
185 HD3 PRO 22 HD3 PRO 22 -2.361 -0.857 10.499
186 H LEU 23 H LEU 23 -7.483 -0.785 12.164
187 HA LEU 23 HA LEU 23 -7.723 -2.588 14.420
188 HB2 LEU 23 HB2 LEU 23 -9.688 -1.085 12.722
189 HB3 LEU 23 HB3 LEU 23 -10.213 -2.305 13.880
190 HG LEU 23 HG LEU 23 -10.462 -0.149 14.882
191 HD11 LEU 23 HD11 LEU 23 -9.484 -2.093 16.208
192 HD12 LEU 23 HD12 LEU 23 -9.300 -0.477 16.889
193 HD13 LEU 23 HD13 LEU 23 -7.939 -1.252 16.078
194 HD21 LEU 23 HD21 LEU 23 -8.311 0.590 13.332
195 HD22 LEU 23 HD22 LEU 23 -7.654 0.614 14.969
196 HD23 LEU 23 HD23 LEU 23 -9.080 1.576 14.576
197 H SER 24 H SER 24 -8.591 -2.581 10.975
198 HA SER 24 HA SER 24 -9.807 -5.051 10.791
199 HB2 SER 24 HB2 SER 24 -9.923 -3.874 8.808
200 HB3 SER 24 HB3 SER 24 -8.234 -3.372 8.884
201 HG SER 24 HG SER 24 -8.623 -4.963 7.266
202 H SER 25 H SER 25 -6.425 -4.284 11.132
203 HA SER 25 HA SER 25 -5.211 -6.608 10.263
204 HB2 SER 25 HB2 SER 25 -4.192 -4.418 11.253
205 HB3 SER 25 HB3 SER 25 -4.284 -5.276 12.790
206 HG SER 25 HG SER 25 -3.146 -7.022 11.551
207 H ASP 26 H ASP 26 -6.785 -5.947 13.353
208 HA ASP 26 HA ASP 26 -6.170 -8.597 14.362
209 HB2 ASP 26 HB2 ASP 26 -6.165 -6.672 15.895
210 HB3 ASP 26 HB3 ASP 26 -7.870 -6.394 15.551
211 H ALA 27 H ALA 27 -8.770 -6.947 12.775
212 HA ALA 27 HA ALA 27 -10.930 -8.574 13.502
213 HB1 ALA 27 HB1 ALA 27 -10.466 -7.122 10.900
214 HB2 ALA 27 HB2 ALA 27 -12.012 -7.751 11.469
215 HB3 ALA 27 HB3 ALA 27 -11.214 -6.448 12.348
216 H ILE 28 H ILE 28 -8.234 -9.192 11.460
217 HA ILE 28 HA ILE 28 -9.257 -11.088 9.694
218 HB ILE 28 HB ILE 28 -6.514 -11.054 10.959
219 HG12 ILE 28 HG12 ILE 28 -7.039 -8.946 9.834
220 HG13 ILE 28 HG13 ILE 28 -5.839 -9.849 8.917
221 HG21 ILE 28 HG21 ILE 28 -6.268 -12.087 8.427
222 HG22 ILE 28 HG22 ILE 28 -6.289 -13.020 9.923
223 HG23 ILE 28 HG23 ILE 28 -7.775 -12.802 8.999
224 HD11 ILE 28 HD11 ILE 28 -8.774 -9.622 8.301
225 HD12 ILE 28 HD12 ILE 28 -7.441 -8.875 7.420
226 HD13 ILE 28 HD13 ILE 28 -7.629 -10.628 7.414
227 H PHE 29 H PHE 29 -8.595 -11.306 13.085
228 HA PHE 29 HA PHE 29 -8.846 -14.220 13.056
229 HB2 PHE 29 HB2 PHE 29 -7.114 -12.839 14.452
230 HB3 PHE 29 HB3 PHE 29 -8.467 -12.605 15.553
231 HD1 PHE 29 HD1 PHE 29 -6.137 -15.033 14.121
232 HD2 PHE 29 HD2 PHE 29 -9.356 -14.436 16.840
233 HE1 PHE 29 HE1 PHE 29 -5.681 -17.227 15.137
234 HE2 PHE 29 HE2 PHE 29 -8.905 -16.629 17.861
235 HZ PHE 29 HZ PHE 29 -7.065 -18.027 17.010
236 H LYS 30 H LYS 30 -10.807 -11.545 13.272
237 HA LYS 30 HA LYS 30 -12.609 -12.095 15.307
238 HB2 LYS 30 HB2 LYS 30 -14.014 -10.554 14.313
239 HB3 LYS 30 HB3 LYS 30 -12.465 -10.109 13.608
240 HG2 LYS 30 HG2 LYS 30 -13.687 -10.141 11.711
241 HG3 LYS 30 HG3 LYS 30 -13.267 -11.855 11.761
242 HD2 LYS 30 HD2 LYS 30 -15.527 -12.016 11.452
243 HD3 LYS 30 HD3 LYS 30 -15.468 -11.991 13.216
244 HE2 LYS 30 HE2 LYS 30 -15.979 -9.636 13.243
245 HE3 LYS 30 HE3 LYS 30 -15.883 -9.556 11.485
246 HZ1 LYS 30 HZ1 LYS 30 -18.168 -9.803 12.732
247 HZ2 LYS 30 HZ2 LYS 30 -17.778 -11.447 12.663
248 HZ3 LYS 30 HZ3 LYS 30 -17.898 -10.546 11.237
249 H GLN 31 H GLN 31 -12.105 -13.732 12.310
250 HA GLN 31 HA GLN 31 -14.585 -14.925 11.892
251 HB2 GLN 31 HB2 GLN 31 -13.362 -16.663 10.663
252 HB3 GLN 31 HB3 GLN 31 -12.774 -15.055 10.263
253 HG2 GLN 31 HG2 GLN 31 -10.838 -15.356 11.647
254 HG3 GLN 31 HG3 GLN 31 -11.453 -16.898 12.238
255 HE21 GLN 31 HE21 GLN 31 -10.075 -18.359 11.483
256 HE22 GLN 31 HE22 GLN 31 -9.615 -18.543 9.828
257 H SER 32 H SER 32 -12.160 -15.565 14.279
258 HA SER 32 HA SER 32 -12.754 -18.195 14.976
259 HB2 SER 32 HB2 SER 32 -10.815 -17.085 15.900
260 HB3 SER 32 HB3 SER 32 -11.831 -15.894 16.711
261 HG SER 32 HG SER 32 -11.116 -18.383 17.515
262 H HIS 33 H HIS 33 -14.506 -15.264 15.559
263 HA HIS 33 HA HIS 33 -16.049 -15.900 17.760
264 HB2 HIS 33 HB2 HIS 33 -17.617 -14.269 17.004
265 HB3 HIS 33 HB3 HIS 33 -16.026 -13.717 16.488
266 HD1 HIS 33 HD1 HIS 33 -16.065 -15.809 13.986
267 HD2 HIS 33 HD2 HIS 33 -18.843 -12.859 14.904
268 HE1 HIS 33 HE1 HIS 33 -17.217 -15.271 11.816
Start of MODEL 12
1 H1 ASN 1 H ASN 1 -0.301 -3.758 -0.181
2 HA ASN 1 HA ASN 1 -0.560 -0.827 -0.250
3 HB2 ASN 1 HB2 ASN 1 0.156 -2.226 -2.335
4 HB3 ASN 1 HB3 ASN 1 -1.556 -2.628 -2.434
5 HD21 ASN 1 HD21 ASN 1 -2.912 -1.216 -3.335
6 HD22 ASN 1 HD22 ASN 1 -2.487 0.379 -3.846
7 H VAL 2 H VAL 2 -2.738 0.007 -0.779
8 HA VAL 2 HA VAL 2 -4.664 -0.955 1.035
9 HB VAL 2 HB VAL 2 -6.196 0.669 0.044
10 HG11 VAL 2 HG11 VAL 2 -3.460 1.329 0.868
11 HG12 VAL 2 HG12 VAL 2 -4.301 2.620 0.008
12 HG13 VAL 2 HG13 VAL 2 -5.005 1.929 1.471
13 HG21 VAL 2 HG21 VAL 2 -5.257 2.096 -1.855
14 HG22 VAL 2 HG22 VAL 2 -4.121 0.775 -2.126
15 HG23 VAL 2 HG23 VAL 2 -5.855 0.490 -2.272
16 H ASP 3 H ASP 3 -6.633 -2.000 0.715
17 HA ASP 3 HA ASP 3 -6.799 -3.549 -1.784
18 HB2 ASP 3 HB2 ASP 3 -8.306 -5.053 -0.292
19 HB3 ASP 3 HB3 ASP 3 -6.559 -5.126 -0.085
20 H VAL 4 H VAL 4 -7.815 -1.311 -2.382
21 HA VAL 4 HA VAL 4 -10.724 -1.536 -1.956
22 HB VAL 4 HB VAL 4 -9.135 1.011 -2.300
23 HG11 VAL 4 HG11 VAL 4 -11.442 1.996 -1.682
24 HG12 VAL 4 HG12 VAL 4 -11.165 1.457 -3.339
25 HG13 VAL 4 HG13 VAL 4 -12.073 0.440 -2.219
26 HG21 VAL 4 HG21 VAL 4 -8.788 0.640 -0.096
27 HG22 VAL 4 HG22 VAL 4 -10.419 1.295 0.044
28 HG23 VAL 4 HG23 VAL 4 -10.166 -0.451 0.049
29 H ARG 5 H ARG 5 -11.501 -2.371 -3.792
30 HA ARG 5 HA ARG 5 -11.990 -2.659 -5.994
31 HB2 ARG 5 HB2 ARG 5 -11.082 0.221 -6.139
32 HB3 ARG 5 HB3 ARG 5 -11.920 -0.630 -7.429
33 HG2 ARG 5 HG2 ARG 5 -13.684 -1.065 -5.509
34 HG3 ARG 5 HG3 ARG 5 -12.953 0.400 -4.848
35 HD2 ARG 5 HD2 ARG 5 -14.599 1.326 -6.135
36 HD3 ARG 5 HD3 ARG 5 -13.288 1.269 -7.312
37 HE ARG 5 HE ARG 5 -14.853 -1.104 -7.382
38 HH11 ARG 5 HH11 ARG 5 -14.813 2.231 -8.380
39 HH12 ARG 5 HH12 ARG 5 -15.857 1.973 -9.738
40 HH21 ARG 5 HH21 ARG 5 -16.228 -1.457 -9.167
41 HH22 ARG 5 HH22 ARG 5 -16.662 -0.125 -10.184
42 H TYR 6 H TYR 6 -9.652 -3.794 -5.355
43 HA TYR 6 HA TYR 6 -7.378 -2.958 -6.765
44 HB2 TYR 6 HB2 TYR 6 -6.691 -5.390 -6.573
45 HB3 TYR 6 HB3 TYR 6 -7.094 -4.589 -5.058
46 HD1 TYR 6 HD1 TYR 6 -8.862 -5.377 -3.693
47 HD2 TYR 6 HD2 TYR 6 -8.352 -6.955 -7.611
48 HE1 TYR 6 HE1 TYR 6 -10.493 -7.147 -3.186
49 HE2 TYR 6 HE2 TYR 6 -9.983 -8.728 -7.116
50 HH TYR 6 HH TYR 6 -11.706 -9.287 -5.646
51 H THR 7 H THR 7 -6.423 -4.718 -8.437
52 HA THR 7 HA THR 7 -8.443 -5.260 -10.494
53 HB THR 7 HB THR 7 -6.561 -4.477 -12.159
54 HG1 THR 7 HG1 THR 7 -5.163 -3.039 -11.351
55 HG21 THR 7 HG21 THR 7 -8.758 -3.495 -12.138
56 HG22 THR 7 HG22 THR 7 -7.568 -2.193 -12.158
57 HG23 THR 7 HG23 THR 7 -8.396 -2.609 -10.657
58 H TYR 8 H TYR 8 -6.661 -6.800 -8.567
59 HA TYR 8 HA TYR 8 -6.111 -8.983 -10.276
60 HB2 TYR 8 HB2 TYR 8 -3.642 -9.036 -10.014
61 HB3 TYR 8 HB3 TYR 8 -4.197 -7.679 -10.988
62 HD1 TYR 8 HD1 TYR 8 -2.290 -8.680 -8.135
63 HD2 TYR 8 HD2 TYR 8 -4.390 -5.399 -9.847
64 HE1 TYR 8 HE1 TYR 8 -1.058 -7.135 -6.670
65 HE2 TYR 8 HE2 TYR 8 -3.164 -3.845 -8.387
66 HH TYR 8 HH TYR 8 -0.527 -4.275 -7.045
67 H ARG 9 H ARG 9 -4.337 -10.457 -8.918
68 HA ARG 9 HA ARG 9 -5.516 -10.616 -6.226
69 HB2 ARG 9 HB2 ARG 9 -5.932 -12.534 -7.778
70 HB3 ARG 9 HB3 ARG 9 -4.199 -12.830 -7.805
71 HG2 ARG 9 HG2 ARG 9 -4.939 -14.339 -6.231
72 HG3 ARG 9 HG3 ARG 9 -4.430 -12.976 -5.232
73 HD2 ARG 9 HD2 ARG 9 -6.533 -13.691 -4.398
74 HD3 ARG 9 HD3 ARG 9 -6.816 -12.189 -5.277
75 HE ARG 9 HE ARG 9 -7.219 -14.327 -7.033
76 HH11 ARG 9 HH11 ARG 9 -8.649 -12.932 -4.182
77 HH12 ARG 9 HH12 ARG 9 -10.253 -13.463 -4.568
78 HH21 ARG 9 HH21 ARG 9 -9.326 -15.031 -7.553
79 HH22 ARG 9 HH22 ARG 9 -10.636 -14.657 -6.485
80 HA PRO 10 HA PRO 10 -1.151 -9.413 -5.437
81 HB2 PRO 10 HB2 PRO 10 -1.732 -7.974 -3.210
82 HB3 PRO 10 HB3 PRO 10 -1.842 -7.304 -4.842
83 HG2 PRO 10 HG2 PRO 10 -4.016 -8.371 -3.082
84 HG3 PRO 10 HG3 PRO 10 -4.012 -6.918 -4.098
85 HD2 PRO 10 HD2 PRO 10 -5.204 -9.227 -4.861
86 HD3 PRO 10 HD3 PRO 10 -4.457 -8.109 -6.021
87 H SER 11 H SER 11 0.204 -9.825 -3.541
88 HA SER 11 HA SER 11 -0.856 -12.047 -1.923
89 HB2 SER 11 HB2 SER 11 1.746 -11.594 -3.271
90 HB3 SER 11 HB3 SER 11 1.816 -12.349 -1.679
91 HG SER 11 HG SER 11 1.277 -13.521 -3.949
92 H VAL 12 H VAL 12 -0.883 -9.076 -1.424
93 HA VAL 12 HA VAL 12 0.813 -8.891 0.955
94 HB VAL 12 HB VAL 12 0.045 -6.506 1.011
95 HG11 VAL 12 HG11 VAL 12 2.085 -6.478 0.064
96 HG12 VAL 12 HG12 VAL 12 1.689 -7.769 -1.073
97 HG13 VAL 12 HG13 VAL 12 1.190 -6.110 -1.410
98 HG21 VAL 12 HG21 VAL 12 -1.628 -5.796 -0.266
99 HG22 VAL 12 HG22 VAL 12 -0.804 -6.352 -1.723
100 HG23 VAL 12 HG23 VAL 12 -1.855 -7.451 -0.831
101 HA PRO 13 HA PRO 13 -2.452 -9.560 3.814
102 HB2 PRO 13 HB2 PRO 13 -1.696 -7.933 5.852
103 HB3 PRO 13 HB3 PRO 13 -0.861 -9.444 5.468
104 HG2 PRO 13 HG2 PRO 13 -0.123 -6.635 4.743
105 HG3 PRO 13 HG3 PRO 13 0.915 -7.951 5.321
106 HD2 PRO 13 HD2 PRO 13 0.756 -7.262 2.708
107 HD3 PRO 13 HD3 PRO 13 1.047 -8.930 3.239
108 H ALA 14 H ALA 14 -4.173 -8.470 5.050
109 HA ALA 14 HA ALA 14 -5.643 -6.680 3.553
110 HB1 ALA 14 HB1 ALA 14 -5.788 -6.959 6.551
111 HB2 ALA 14 HB2 ALA 14 -7.067 -6.408 5.469
112 HB3 ALA 14 HB3 ALA 14 -6.519 -8.082 5.404
113 H HIS 15 H HIS 15 -3.071 -6.050 5.800
114 HA HIS 15 HA HIS 15 -3.606 -3.342 6.356
115 HB2 HIS 15 HB2 HIS 15 -0.856 -4.572 6.181
116 HB3 HIS 15 HB3 HIS 15 -1.370 -3.215 7.179
117 HD1 HIS 15 HD1 HIS 15 -4.022 -4.823 8.143
118 HD2 HIS 15 HD2 HIS 15 -0.062 -6.044 8.429
119 HE1 HIS 15 HE1 HIS 15 -3.970 -6.501 10.015
120 H ARG 16 H ARG 16 -2.191 -1.513 5.616
121 HA ARG 16 HA ARG 16 -1.516 -1.759 2.762
122 HB2 ARG 16 HB2 ARG 16 -2.453 0.475 2.372
123 HB3 ARG 16 HB3 ARG 16 -3.680 -0.643 2.953
124 HG2 ARG 16 HG2 ARG 16 -3.268 0.312 5.258
125 HG3 ARG 16 HG3 ARG 16 -2.331 1.576 4.459
126 HD2 ARG 16 HD2 ARG 16 -4.209 2.392 3.310
127 HD3 ARG 16 HD3 ARG 16 -5.145 0.934 3.635
128 HE ARG 16 HE ARG 16 -4.525 2.092 6.087
129 HH11 ARG 16 HH11 ARG 16 -6.371 2.848 3.234
130 HH12 ARG 16 HH12 ARG 16 -7.524 3.826 4.081
131 HH21 ARG 16 HH21 ARG 16 -6.036 3.378 7.213
132 HH22 ARG 16 HH22 ARG 16 -7.331 4.127 6.344
133 H ARG 17 H ARG 17 0.351 -2.000 4.795
134 HA ARG 17 HA ARG 17 2.138 0.151 4.124
135 HB2 ARG 17 HB2 ARG 17 0.713 0.144 6.672
136 HB3 ARG 17 HB3 ARG 17 2.460 0.176 6.872
137 HG2 ARG 17 HG2 ARG 17 0.892 2.105 5.174
138 HG3 ARG 17 HG3 ARG 17 1.442 2.419 6.822
139 HD2 ARG 17 HD2 ARG 17 3.778 1.753 5.827
140 HD3 ARG 17 HD3 ARG 17 3.015 2.190 4.299
141 HE ARG 17 HE ARG 17 2.687 4.191 6.320
142 HH11 ARG 17 HH11 ARG 17 4.846 2.943 3.891
143 HH12 ARG 17 HH12 ARG 17 5.678 4.447 3.672
144 HH21 ARG 17 HH21 ARG 17 3.774 6.177 6.040
145 HH22 ARG 17 HH22 ARG 17 5.068 6.285 4.895
146 H VAL 18 H VAL 18 4.222 -0.169 5.650
147 HA VAL 18 HA VAL 18 5.029 -2.915 5.168
148 HB VAL 18 HB VAL 18 6.525 -1.074 4.513
149 HG11 VAL 18 HG11 VAL 18 7.364 -0.528 7.286
150 HG12 VAL 18 HG12 VAL 18 7.256 0.553 5.896
151 HG13 VAL 18 HG13 VAL 18 5.804 0.140 6.808
152 HG21 VAL 18 HG21 VAL 18 8.556 -2.041 5.313
153 HG22 VAL 18 HG22 VAL 18 7.752 -2.692 6.741
154 HG23 VAL 18 HG23 VAL 18 7.379 -3.344 5.145
155 H ARG 19 H ARG 19 4.298 -0.819 7.857
156 HA ARG 19 HA ARG 19 4.510 -3.109 9.659
157 HB2 ARG 19 HB2 ARG 19 5.901 -0.463 10.062
158 HB3 ARG 19 HB3 ARG 19 5.576 -1.577 11.384
159 HG2 ARG 19 HG2 ARG 19 7.112 -3.114 10.654
160 HG3 ARG 19 HG3 ARG 19 7.008 -2.579 8.975
161 HD2 ARG 19 HD2 ARG 19 8.044 -0.383 9.854
162 HD3 ARG 19 HD3 ARG 19 8.490 -1.341 11.265
163 HE ARG 19 HE ARG 19 9.720 -1.405 8.693
164 HH11 ARG 19 HH11 ARG 19 8.948 -3.345 11.479
165 HH12 ARG 19 HH12 ARG 19 10.251 -4.458 11.227
166 HH21 ARG 19 HH21 ARG 19 11.439 -2.864 8.350
167 HH22 ARG 19 HH22 ARG 19 11.668 -4.184 9.447
168 H GLU 20 H GLU 20 2.173 -2.938 9.390
169 HA GLU 20 HA GLU 20 1.026 -0.806 11.070
170 HB2 GLU 20 HB2 GLU 20 0.463 -1.237 8.424
171 HB3 GLU 20 HB3 GLU 20 -0.810 -2.156 9.215
172 HG2 GLU 20 HG2 GLU 20 -0.331 0.568 10.240
173 HG3 GLU 20 HG3 GLU 20 -1.013 0.442 8.620
174 H SER 21 H SER 21 -0.765 -1.376 12.400
175 HA SER 21 HA SER 21 -1.297 -4.227 12.754
176 HB2 SER 21 HB2 SER 21 -0.618 -2.534 15.153
177 HB3 SER 21 HB3 SER 21 -0.727 -4.291 15.044
178 HG SER 21 HG SER 21 1.188 -4.356 13.990
179 HA PRO 22 HA PRO 22 -5.044 -1.487 13.077
180 HB2 PRO 22 HB2 PRO 22 -6.547 -2.932 11.338
181 HB3 PRO 22 HB3 PRO 22 -5.459 -1.638 10.822
182 HG2 PRO 22 HG2 PRO 22 -5.021 -4.599 10.807
183 HG3 PRO 22 HG3 PRO 22 -4.617 -3.402 9.563
184 HD2 PRO 22 HD2 PRO 22 -2.776 -4.392 11.285
185 HD3 PRO 22 HD3 PRO 22 -2.696 -2.736 10.650
186 H LEU 23 H LEU 23 -7.313 -2.208 13.619
187 HA LEU 23 HA LEU 23 -7.263 -3.984 15.800
188 HB2 LEU 23 HB2 LEU 23 -8.864 -2.080 15.412
189 HB3 LEU 23 HB3 LEU 23 -9.708 -3.122 14.269
190 HG LEU 23 HG LEU 23 -9.357 -4.356 16.887
191 HD11 LEU 23 HD11 LEU 23 -9.881 -2.622 18.174
192 HD12 LEU 23 HD12 LEU 23 -11.472 -2.641 17.416
193 HD13 LEU 23 HD13 LEU 23 -10.205 -1.594 16.779
194 HD21 LEU 23 HD21 LEU 23 -11.155 -5.431 16.155
195 HD22 LEU 23 HD22 LEU 23 -11.092 -4.464 14.681
196 HD23 LEU 23 HD23 LEU 23 -12.064 -3.923 16.050
197 H SER 24 H SER 24 -8.169 -4.404 12.433
198 HA SER 24 HA SER 24 -9.503 -6.837 12.577
199 HB2 SER 24 HB2 SER 24 -8.482 -7.162 10.204
200 HB3 SER 24 HB3 SER 24 -9.577 -5.807 10.481
201 HG SER 24 HG SER 24 -8.003 -4.501 10.033
202 H SER 25 H SER 25 -6.138 -6.115 12.937
203 HA SER 25 HA SER 25 -5.043 -8.639 12.351
204 HB2 SER 25 HB2 SER 25 -3.848 -6.376 12.752
205 HB3 SER 25 HB3 SER 25 -3.908 -6.814 14.459
206 HG SER 25 HG SER 25 -2.388 -8.233 14.137
207 H ASP 26 H ASP 26 -6.390 -7.280 15.313
208 HA ASP 26 HA ASP 26 -5.840 -9.743 16.773
209 HB2 ASP 26 HB2 ASP 26 -6.926 -8.454 18.683
210 HB3 ASP 26 HB3 ASP 26 -5.410 -7.805 18.065
211 H ALA 27 H ALA 27 -8.442 -8.098 15.187
212 HA ALA 27 HA ALA 27 -10.680 -9.167 16.406
213 HB1 ALA 27 HB1 ALA 27 -11.775 -8.932 14.162
214 HB2 ALA 27 HB2 ALA 27 -10.943 -7.488 14.741
215 HB3 ALA 27 HB3 ALA 27 -10.193 -8.504 13.510
216 H ILE 28 H ILE 28 -8.384 -10.697 14.278
217 HA ILE 28 HA ILE 28 -9.796 -12.871 13.336
218 HB ILE 28 HB ILE 28 -6.926 -12.863 14.281
219 HG12 ILE 28 HG12 ILE 28 -7.328 -11.129 12.620
220 HG13 ILE 28 HG13 ILE 28 -6.407 -12.443 11.895
221 HG21 ILE 28 HG21 ILE 28 -8.436 -14.753 12.487
222 HG22 ILE 28 HG22 ILE 28 -6.679 -14.715 12.624
223 HG23 ILE 28 HG23 ILE 28 -7.664 -15.121 14.029
224 HD11 ILE 28 HD11 ILE 28 -8.800 -13.274 11.190
225 HD12 ILE 28 HD12 ILE 28 -9.192 -11.565 11.381
226 HD13 ILE 28 HD13 ILE 28 -7.930 -12.059 10.253
227 H PHE 29 H PHE 29 -8.297 -12.417 16.501
228 HA PHE 29 HA PHE 29 -9.121 -15.066 17.370
229 HB2 PHE 29 HB2 PHE 29 -6.912 -13.998 18.019
230 HB3 PHE 29 HB3 PHE 29 -7.837 -12.908 19.047
231 HD1 PHE 29 HD1 PHE 29 -6.371 -16.168 18.720
232 HD2 PHE 29 HD2 PHE 29 -9.203 -13.873 20.917
233 HE1 PHE 29 HE1 PHE 29 -6.322 -17.840 20.525
234 HE2 PHE 29 HE2 PHE 29 -9.157 -15.540 22.725
235 HZ PHE 29 HZ PHE 29 -7.715 -17.527 22.531
236 H LYS 30 H LYS 30 -10.158 -11.769 17.602
237 HA LYS 30 HA LYS 30 -11.851 -12.068 19.871
238 HB2 LYS 30 HB2 LYS 30 -10.913 -9.916 18.660
239 HB3 LYS 30 HB3 LYS 30 -12.413 -10.039 17.749
240 HG2 LYS 30 HG2 LYS 30 -12.532 -10.156 20.719
241 HG3 LYS 30 HG3 LYS 30 -12.263 -8.599 19.933
242 HD2 LYS 30 HD2 LYS 30 -14.295 -9.347 18.453
243 HD3 LYS 30 HD3 LYS 30 -14.642 -10.400 19.827
244 HE2 LYS 30 HE2 LYS 30 -14.284 -7.406 19.953
245 HE3 LYS 30 HE3 LYS 30 -15.829 -8.254 19.978
246 HZ1 LYS 30 HZ1 LYS 30 -13.679 -8.516 22.011
247 HZ2 LYS 30 HZ2 LYS 30 -15.159 -9.335 22.035
248 HZ3 LYS 30 HZ3 LYS 30 -15.121 -7.652 22.204
249 H GLN 31 H GLN 31 -12.179 -12.770 16.495
250 HA GLN 31 HA GLN 31 -15.028 -12.832 16.418
251 HB2 GLN 31 HB2 GLN 31 -13.355 -12.657 14.455
252 HB3 GLN 31 HB3 GLN 31 -13.248 -14.408 14.578
253 HG2 GLN 31 HG2 GLN 31 -15.589 -14.641 14.119
254 HG3 GLN 31 HG3 GLN 31 -15.814 -12.893 14.169
255 HE21 GLN 31 HE21 GLN 31 -16.432 -14.723 12.024
256 HE22 GLN 31 HE22 GLN 31 -15.511 -14.209 10.655
257 H SER 32 H SER 32 -12.523 -15.170 17.157
258 HA SER 32 HA SER 32 -14.253 -17.446 17.132
259 HB2 SER 32 HB2 SER 32 -12.350 -18.607 18.222
260 HB3 SER 32 HB3 SER 32 -11.857 -17.722 16.778
261 HG SER 32 HG SER 32 -10.796 -16.299 17.986
262 H HIS 33 H HIS 33 -13.162 -15.162 19.563
263 HA HIS 33 HA HIS 33 -14.341 -16.641 21.745
264 HB2 HIS 33 HB2 HIS 33 -12.274 -15.056 21.806
265 HB3 HIS 33 HB3 HIS 33 -13.473 -13.773 21.929
266 HD1 HIS 33 HD1 HIS 33 -12.023 -16.649 23.831
267 HD2 HIS 33 HD2 HIS 33 -14.799 -13.608 24.384
268 HE1 HIS 33 HE1 HIS 33 -12.527 -16.639 26.295
Start of MODEL 13
1 H1 ASN 1 H ASN 1 -3.061 -3.739 1.202
2 HA ASN 1 HA ASN 1 -4.419 -3.266 -0.566
3 HB2 ASN 1 HB2 ASN 1 -5.252 -0.887 1.110
4 HB3 ASN 1 HB3 ASN 1 -6.049 -1.411 -0.371
5 HD21 ASN 1 HD21 ASN 1 -7.497 -1.185 1.894
6 HD22 ASN 1 HD22 ASN 1 -7.939 -2.747 2.486
7 H VAL 2 H VAL 2 -1.673 -2.247 -0.291
8 HA VAL 2 HA VAL 2 -1.815 0.142 -2.004
9 HB VAL 2 HB VAL 2 -0.506 0.548 -0.028
10 HG11 VAL 2 HG11 VAL 2 0.280 -2.162 -0.367
11 HG12 VAL 2 HG12 VAL 2 1.733 -1.160 -0.362
12 HG13 VAL 2 HG13 VAL 2 0.602 -1.083 0.990
13 HG21 VAL 2 HG21 VAL 2 1.647 0.118 -2.034
14 HG22 VAL 2 HG22 VAL 2 0.303 1.176 -2.463
15 HG23 VAL 2 HG23 VAL 2 1.289 1.535 -1.046
16 H ASP 3 H ASP 3 -1.513 -0.177 -4.098
17 HA ASP 3 HA ASP 3 0.657 -1.538 -5.213
18 HB2 ASP 3 HB2 ASP 3 -1.211 -3.358 -4.331
19 HB3 ASP 3 HB3 ASP 3 -1.646 -3.158 -6.026
20 H VAL 4 H VAL 4 0.633 -1.534 -7.543
21 HA VAL 4 HA VAL 4 -1.354 0.354 -8.624
22 HB VAL 4 HB VAL 4 0.293 1.032 -10.262
23 HG11 VAL 4 HG11 VAL 4 1.301 2.458 -8.857
24 HG12 VAL 4 HG12 VAL 4 0.374 1.635 -7.600
25 HG13 VAL 4 HG13 VAL 4 2.043 1.161 -7.921
26 HG21 VAL 4 HG21 VAL 4 1.790 -0.498 -10.895
27 HG22 VAL 4 HG22 VAL 4 2.713 -0.026 -9.469
28 HG23 VAL 4 HG23 VAL 4 1.619 -1.406 -9.394
29 H ARG 5 H ARG 5 -1.458 -2.649 -8.438
30 HA ARG 5 HA ARG 5 -2.300 -3.090 -11.183
31 HB2 ARG 5 HB2 ARG 5 -0.296 -4.901 -9.823
32 HB3 ARG 5 HB3 ARG 5 -1.083 -5.228 -11.361
33 HG2 ARG 5 HG2 ARG 5 0.002 -3.311 -12.363
34 HG3 ARG 5 HG3 ARG 5 0.734 -2.891 -10.812
35 HD2 ARG 5 HD2 ARG 5 1.527 -5.471 -11.085
36 HD3 ARG 5 HD3 ARG 5 1.486 -4.952 -12.769
37 HE ARG 5 HE ARG 5 3.331 -4.094 -10.729
38 HH11 ARG 5 HH11 ARG 5 1.876 -3.345 -13.802
39 HH12 ARG 5 HH12 ARG 5 3.166 -2.303 -14.306
40 HH21 ARG 5 HH21 ARG 5 5.035 -2.725 -11.381
41 HH22 ARG 5 HH22 ARG 5 4.962 -1.952 -12.928
42 H TYR 6 H TYR 6 -4.381 -3.518 -10.755
43 HA TYR 6 HA TYR 6 -5.005 -5.917 -9.251
44 HB2 TYR 6 HB2 TYR 6 -6.668 -4.818 -7.820
45 HB3 TYR 6 HB3 TYR 6 -5.053 -4.188 -7.513
46 HD1 TYR 6 HD1 TYR 6 -4.509 -1.897 -7.966
47 HD2 TYR 6 HD2 TYR 6 -8.332 -3.444 -9.015
48 HE1 TYR 6 HE1 TYR 6 -5.326 0.392 -8.341
49 HE2 TYR 6 HE2 TYR 6 -9.159 -1.159 -9.394
50 HH TYR 6 HH TYR 6 -8.653 1.000 -9.430
51 H THR 7 H THR 7 -6.909 -6.879 -9.881
52 HA THR 7 HA THR 7 -8.669 -5.455 -11.725
53 HB THR 7 HB THR 7 -8.634 -7.600 -13.190
54 HG1 THR 7 HG1 THR 7 -6.668 -8.703 -13.145
55 HG21 THR 7 HG21 THR 7 -7.210 -6.551 -14.695
56 HG22 THR 7 HG22 THR 7 -6.133 -5.968 -13.425
57 HG23 THR 7 HG23 THR 7 -7.710 -5.214 -13.659
58 H TYR 8 H TYR 8 -8.778 -6.635 -8.972
59 HA TYR 8 HA TYR 8 -11.397 -7.670 -9.099
60 HB2 TYR 8 HB2 TYR 8 -11.036 -9.974 -8.445
61 HB3 TYR 8 HB3 TYR 8 -10.191 -9.666 -9.958
62 HD1 TYR 8 HD1 TYR 8 -9.907 -11.051 -6.736
63 HD2 TYR 8 HD2 TYR 8 -7.662 -8.980 -9.698
64 HE1 TYR 8 HE1 TYR 8 -7.823 -11.890 -5.734
65 HE2 TYR 8 HE2 TYR 8 -5.572 -9.814 -8.705
66 HH TYR 8 HH TYR 8 -5.593 -12.144 -6.065
67 H ARG 9 H ARG 9 -11.606 -9.103 -6.798
68 HA ARG 9 HA ARG 9 -10.632 -7.195 -4.779
69 HB2 ARG 9 HB2 ARG 9 -13.097 -7.318 -5.078
70 HB3 ARG 9 HB3 ARG 9 -13.039 -9.017 -4.629
71 HG2 ARG 9 HG2 ARG 9 -12.230 -8.436 -2.420
72 HG3 ARG 9 HG3 ARG 9 -12.198 -6.728 -2.864
73 HD2 ARG 9 HD2 ARG 9 -14.200 -6.980 -1.684
74 HD3 ARG 9 HD3 ARG 9 -14.687 -7.002 -3.378
75 HE ARG 9 HE ARG 9 -14.202 -9.615 -2.287
76 HH11 ARG 9 HH11 ARG 9 -16.545 -7.071 -2.682
77 HH12 ARG 9 HH12 ARG 9 -17.911 -8.125 -2.521
78 HH21 ARG 9 HH21 ARG 9 -15.991 -11.013 -2.073
79 HH22 ARG 9 HH22 ARG 9 -17.594 -10.367 -2.174
80 HA PRO 10 HA PRO 10 -8.366 -11.086 -3.836
81 HB2 PRO 10 HB2 PRO 10 -6.129 -9.818 -2.964
82 HB3 PRO 10 HB3 PRO 10 -6.432 -10.167 -4.670
83 HG2 PRO 10 HG2 PRO 10 -6.837 -7.615 -3.158
84 HG3 PRO 10 HG3 PRO 10 -6.147 -7.861 -4.772
85 HD2 PRO 10 HD2 PRO 10 -8.697 -7.038 -4.389
86 HD3 PRO 10 HD3 PRO 10 -8.217 -8.049 -5.767
87 H SER 11 H SER 11 -7.470 -11.837 -1.778
88 HA SER 11 HA SER 11 -9.030 -10.846 0.441
89 HB2 SER 11 HB2 SER 11 -7.340 -13.245 -0.088
90 HB3 SER 11 HB3 SER 11 -7.588 -12.771 1.593
91 HG SER 11 HG SER 11 -9.200 -14.221 0.878
92 H VAL 12 H VAL 12 -8.005 -8.745 0.584
93 HA VAL 12 HA VAL 12 -5.239 -8.547 1.328
94 HB VAL 12 HB VAL 12 -5.798 -6.156 1.812
95 HG11 VAL 12 HG11 VAL 12 -6.068 -5.528 -0.490
96 HG12 VAL 12 HG12 VAL 12 -5.060 -6.975 -0.418
97 HG13 VAL 12 HG13 VAL 12 -6.756 -7.103 -0.885
98 HG21 VAL 12 HG21 VAL 12 -7.902 -5.531 2.142
99 HG22 VAL 12 HG22 VAL 12 -8.325 -6.045 0.509
100 HG23 VAL 12 HG23 VAL 12 -8.438 -7.185 1.850
101 HA PRO 13 HA PRO 13 -5.516 -9.059 5.680
102 HB2 PRO 13 HB2 PRO 13 -3.584 -7.349 6.526
103 HB3 PRO 13 HB3 PRO 13 -3.226 -8.882 5.723
104 HG2 PRO 13 HG2 PRO 13 -3.287 -6.115 4.582
105 HG3 PRO 13 HG3 PRO 13 -2.110 -7.412 4.308
106 HD2 PRO 13 HD2 PRO 13 -4.085 -6.840 2.546
107 HD3 PRO 13 HD3 PRO 13 -3.460 -8.486 2.779
108 H ALA 14 H ALA 14 -5.906 -7.909 7.725
109 HA ALA 14 HA ALA 14 -8.043 -6.172 7.636
110 HB1 ALA 14 HB1 ALA 14 -6.014 -6.690 9.789
111 HB2 ALA 14 HB2 ALA 14 -7.387 -5.608 10.030
112 HB3 ALA 14 HB3 ALA 14 -7.661 -7.309 9.655
113 H HIS 15 H HIS 15 -4.635 -5.457 7.475
114 HA HIS 15 HA HIS 15 -5.252 -2.577 7.449
115 HB2 HIS 15 HB2 HIS 15 -2.668 -2.433 7.787
116 HB3 HIS 15 HB3 HIS 15 -3.700 -2.824 9.160
117 HD1 HIS 15 HD1 HIS 15 -3.802 -5.429 9.802
118 HD2 HIS 15 HD2 HIS 15 -0.757 -4.298 7.211
119 HE1 HIS 15 HE1 HIS 15 -2.146 -7.322 9.843
120 H ARG 16 H ARG 16 -3.210 -1.475 6.183
121 HA ARG 16 HA ARG 16 -2.995 -2.842 3.587
122 HB2 ARG 16 HB2 ARG 16 -3.309 -0.681 2.452
123 HB3 ARG 16 HB3 ARG 16 -4.724 -1.139 3.390
124 HG2 ARG 16 HG2 ARG 16 -3.788 0.345 5.232
125 HG3 ARG 16 HG3 ARG 16 -2.682 0.968 4.006
126 HD2 ARG 16 HD2 ARG 16 -4.400 2.472 3.818
127 HD3 ARG 16 HD3 ARG 16 -4.895 1.270 2.626
128 HE ARG 16 HE ARG 16 -6.682 0.719 3.959
129 HH11 ARG 16 HH11 ARG 16 -4.447 2.692 5.758
130 HH12 ARG 16 HH12 ARG 16 -5.522 2.917 7.098
131 HH21 ARG 16 HH21 ARG 16 -8.106 1.009 5.717
132 HH22 ARG 16 HH22 ARG 16 -7.603 1.959 7.074
133 H ARG 17 H ARG 17 -1.046 -2.892 5.592
134 HA ARG 17 HA ARG 17 1.133 -1.546 4.198
135 HB2 ARG 17 HB2 ARG 17 0.297 -1.003 7.008
136 HB3 ARG 17 HB3 ARG 17 2.019 -1.049 6.653
137 HG2 ARG 17 HG2 ARG 17 0.050 0.683 5.178
138 HG3 ARG 17 HG3 ARG 17 0.996 1.219 6.568
139 HD2 ARG 17 HD2 ARG 17 2.477 -0.050 4.341
140 HD3 ARG 17 HD3 ARG 17 1.801 1.550 4.040
141 HE ARG 17 HE ARG 17 3.080 1.817 6.424
142 HH11 ARG 17 HH11 ARG 17 4.024 0.697 3.266
143 HH12 ARG 17 HH12 ARG 17 5.672 1.204 3.435
144 HH21 ARG 17 HH21 ARG 17 5.247 2.489 6.659
145 HH22 ARG 17 HH22 ARG 17 6.367 2.223 5.366
146 H VAL 18 H VAL 18 3.290 -2.212 5.420
147 HA VAL 18 HA VAL 18 3.243 -5.122 5.485
148 HB VAL 18 HB VAL 18 4.945 -3.989 4.115
149 HG11 VAL 18 HG11 VAL 18 6.059 -3.003 6.739
150 HG12 VAL 18 HG12 VAL 18 6.770 -2.766 5.141
151 HG13 VAL 18 HG13 VAL 18 5.230 -2.005 5.545
152 HG21 VAL 18 HG21 VAL 18 5.265 -6.199 5.597
153 HG22 VAL 18 HG22 VAL 18 6.511 -5.578 4.513
154 HG23 VAL 18 HG23 VAL 18 6.588 -5.225 6.240
155 H ARG 19 H ARG 19 3.608 -2.429 7.634
156 HA ARG 19 HA ARG 19 3.945 -4.306 9.868
157 HB2 ARG 19 HB2 ARG 19 5.368 -2.500 10.971
158 HB3 ARG 19 HB3 ARG 19 6.119 -3.416 9.671
159 HG2 ARG 19 HG2 ARG 19 6.051 -1.632 8.197
160 HG3 ARG 19 HG3 ARG 19 4.777 -0.808 9.099
161 HD2 ARG 19 HD2 ARG 19 6.670 0.437 9.607
162 HD3 ARG 19 HD3 ARG 19 6.527 -0.651 10.987
163 HE ARG 19 HE ARG 19 8.181 -1.824 9.035
164 HH11 ARG 19 HH11 ARG 19 8.162 0.777 11.349
165 HH12 ARG 19 HH12 ARG 19 9.880 0.762 11.576
166 HH21 ARG 19 HH21 ARG 19 10.443 -1.855 9.326
167 HH22 ARG 19 HH22 ARG 19 11.176 -0.735 10.424
168 H GLU 20 H GLU 20 1.554 -3.927 9.794
169 HA GLU 20 HA GLU 20 0.900 -1.627 11.495
170 HB2 GLU 20 HB2 GLU 20 0.263 -1.394 8.971
171 HB3 GLU 20 HB3 GLU 20 -1.030 -2.513 9.379
172 HG2 GLU 20 HG2 GLU 20 -1.772 -0.943 11.141
173 HG3 GLU 20 HG3 GLU 20 -0.539 0.194 10.598
174 H SER 21 H SER 21 -1.040 -1.906 12.766
175 HA SER 21 HA SER 21 -2.269 -4.514 12.888
176 HB2 SER 21 HB2 SER 21 -0.909 -3.620 15.414
177 HB3 SER 21 HB3 SER 21 -1.483 -5.228 14.970
178 HG SER 21 HG SER 21 0.259 -5.507 13.682
179 HA PRO 22 HA PRO 22 -4.900 -0.908 14.176
180 HB2 PRO 22 HB2 PRO 22 -6.977 -1.543 12.547
181 HB3 PRO 22 HB3 PRO 22 -5.608 -0.558 12.018
182 HG2 PRO 22 HG2 PRO 22 -6.126 -3.473 11.576
183 HG3 PRO 22 HG3 PRO 22 -5.518 -2.259 10.435
184 HD2 PRO 22 HD2 PRO 22 -3.889 -4.014 11.700
185 HD3 PRO 22 HD3 PRO 22 -3.370 -2.373 11.263
186 H LEU 23 H LEU 23 -7.421 -1.146 14.664
187 HA LEU 23 HA LEU 23 -7.644 -2.970 16.792
188 HB2 LEU 23 HB2 LEU 23 -8.880 -0.797 16.503
189 HB3 LEU 23 HB3 LEU 23 -9.926 -1.632 15.356
190 HG LEU 23 HG LEU 23 -9.745 -2.993 17.928
191 HD11 LEU 23 HD11 LEU 23 -9.916 -1.236 19.277
192 HD12 LEU 23 HD12 LEU 23 -11.502 -0.942 18.564
193 HD13 LEU 23 HD13 LEU 23 -10.080 -0.121 17.920
194 HD21 LEU 23 HD21 LEU 23 -11.724 -3.701 17.217
195 HD22 LEU 23 HD22 LEU 23 -11.520 -2.714 15.769
196 HD23 LEU 23 HD23 LEU 23 -12.347 -2.052 17.180
197 H SER 24 H SER 24 -9.068 -2.992 13.538
198 HA SER 24 HA SER 24 -10.594 -5.304 13.768
199 HB2 SER 24 HB2 SER 24 -9.978 -5.465 11.190
200 HB3 SER 24 HB3 SER 24 -11.036 -4.192 11.800
201 HG SER 24 HG SER 24 -9.509 -3.189 10.569
202 H SER 25 H SER 25 -7.165 -4.908 13.426
203 HA SER 25 HA SER 25 -6.497 -7.463 12.456
204 HB2 SER 25 HB2 SER 25 -5.004 -5.374 12.686
205 HB3 SER 25 HB3 SER 25 -4.755 -5.897 14.352
206 HG SER 25 HG SER 25 -4.270 -7.519 12.074
207 H ASP 26 H ASP 26 -6.800 -6.214 15.762
208 HA ASP 26 HA ASP 26 -6.123 -8.708 16.988
209 HB2 ASP 26 HB2 ASP 26 -7.485 -6.265 18.143
210 HB3 ASP 26 HB3 ASP 26 -6.860 -7.619 19.080
211 H ALA 27 H ALA 27 -9.050 -7.219 15.855
212 HA ALA 27 HA ALA 27 -10.977 -8.593 17.311
213 HB1 ALA 27 HB1 ALA 27 -11.824 -8.328 14.585
214 HB2 ALA 27 HB2 ALA 27 -12.340 -7.423 16.008
215 HB3 ALA 27 HB3 ALA 27 -10.937 -6.887 15.083
216 H ILE 28 H ILE 28 -8.905 -9.694 14.749
217 HA ILE 28 HA ILE 28 -10.267 -11.875 13.751
218 HB ILE 28 HB ILE 28 -7.307 -11.740 14.340
219 HG12 ILE 28 HG12 ILE 28 -8.068 -9.850 12.976
220 HG13 ILE 28 HG13 ILE 28 -7.097 -10.962 12.016
221 HG21 ILE 28 HG21 ILE 28 -7.976 -13.231 12.000
222 HG22 ILE 28 HG22 ILE 28 -7.135 -13.765 13.454
223 HG23 ILE 28 HG23 ILE 28 -8.894 -13.859 13.369
224 HD11 ILE 28 HD11 ILE 28 -8.732 -11.069 10.539
225 HD12 ILE 28 HD12 ILE 28 -9.786 -11.772 11.766
226 HD13 ILE 28 HD13 ILE 28 -9.735 -10.023 11.544
227 H PHE 29 H PHE 29 -8.382 -11.628 16.730
228 HA PHE 29 HA PHE 29 -8.836 -14.408 17.394
229 HB2 PHE 29 HB2 PHE 29 -6.779 -12.858 17.983
230 HB3 PHE 29 HB3 PHE 29 -7.775 -12.434 19.372
231 HD1 PHE 29 HD1 PHE 29 -5.654 -14.927 17.861
232 HD2 PHE 29 HD2 PHE 29 -8.474 -14.209 20.967
233 HE1 PHE 29 HE1 PHE 29 -4.891 -16.960 19.019
234 HE2 PHE 29 HE2 PHE 29 -7.715 -16.239 22.131
235 HZ PHE 29 HZ PHE 29 -5.921 -17.617 21.158
236 H LYS 30 H LYS 30 -10.260 -11.324 18.056
237 HA LYS 30 HA LYS 30 -11.571 -11.763 20.452
238 HB2 LYS 30 HB2 LYS 30 -11.524 -9.611 19.202
239 HB3 LYS 30 HB3 LYS 30 -12.678 -10.284 18.058
240 HG2 LYS 30 HG2 LYS 30 -14.106 -9.159 19.417
241 HG3 LYS 30 HG3 LYS 30 -14.076 -10.712 20.255
242 HD2 LYS 30 HD2 LYS 30 -11.999 -8.759 21.034
243 HD3 LYS 30 HD3 LYS 30 -13.658 -8.358 21.483
244 HE2 LYS 30 HE2 LYS 30 -12.646 -11.108 22.020
245 HE3 LYS 30 HE3 LYS 30 -12.121 -9.792 23.069
246 HZ1 LYS 30 HZ1 LYS 30 -14.288 -11.153 23.571
247 HZ2 LYS 30 HZ2 LYS 30 -14.981 -10.042 22.500
248 HZ3 LYS 30 HZ3 LYS 30 -14.204 -9.495 23.899
249 H GLN 31 H GLN 31 -12.251 -13.047 17.291
250 HA GLN 31 HA GLN 31 -14.915 -13.827 17.644
251 HB2 GLN 31 HB2 GLN 31 -13.709 -13.853 15.477
252 HB3 GLN 31 HB3 GLN 31 -12.783 -15.240 16.034
253 HG2 GLN 31 HG2 GLN 31 -14.541 -15.997 14.600
254 HG3 GLN 31 HG3 GLN 31 -14.885 -16.513 16.251
255 HE21 GLN 31 HE21 GLN 31 -15.860 -14.516 13.609
256 HE22 GLN 31 HE22 GLN 31 -17.375 -14.014 14.269
257 H SER 32 H SER 32 -11.929 -15.238 18.763
258 HA SER 32 HA SER 32 -13.080 -17.763 19.492
259 HB2 SER 32 HB2 SER 32 -10.435 -16.428 20.025
260 HB3 SER 32 HB3 SER 32 -10.868 -17.940 20.824
261 HG SER 32 HG SER 32 -10.477 -18.958 19.034
262 H HIS 33 H HIS 33 -12.185 -14.802 21.215
263 HA HIS 33 HA HIS 33 -13.208 -15.854 23.722
264 HB2 HIS 33 HB2 HIS 33 -11.825 -13.305 22.926
265 HB3 HIS 33 HB3 HIS 33 -12.598 -13.463 24.500
266 HD1 HIS 33 HD1 HIS 33 -9.426 -13.856 22.964
267 HD2 HIS 33 HD2 HIS 33 -11.530 -15.958 25.866
268 HE1 HIS 33 HE1 HIS 33 -7.701 -15.205 24.201
Start of MODEL 14
1 H1 ASN 1 H ASN 1 -3.467 0.806 0.680
2 HA ASN 1 HA ASN 1 -3.059 -0.973 -1.307
3 HB2 ASN 1 HB2 ASN 1 -2.932 0.860 -2.865
4 HB3 ASN 1 HB3 ASN 1 -4.027 1.322 -1.565
5 HD21 ASN 1 HD21 ASN 1 -2.641 3.060 -3.358
6 HD22 ASN 1 HD22 ASN 1 -1.608 4.061 -2.402
7 H VAL 2 H VAL 2 -0.873 -1.221 0.564
8 HA VAL 2 HA VAL 2 1.484 -0.508 -1.014
9 HB VAL 2 HB VAL 2 2.770 -1.352 0.943
10 HG11 VAL 2 HG11 VAL 2 1.732 1.047 0.601
11 HG12 VAL 2 HG12 VAL 2 0.819 0.605 2.045
12 HG13 VAL 2 HG13 VAL 2 2.582 0.621 2.086
13 HG21 VAL 2 HG21 VAL 2 0.241 -1.406 2.526
14 HG22 VAL 2 HG22 VAL 2 0.727 -2.840 1.622
15 HG23 VAL 2 HG23 VAL 2 1.793 -2.175 2.859
16 H ASP 3 H ASP 3 -0.185 -2.449 -2.158
17 HA ASP 3 HA ASP 3 1.701 -4.550 -2.583
18 HB2 ASP 3 HB2 ASP 3 0.430 -5.167 -0.418
19 HB3 ASP 3 HB3 ASP 3 -0.936 -5.486 -1.482
20 H VAL 4 H VAL 4 1.066 -5.987 -4.309
21 HA VAL 4 HA VAL 4 -1.239 -5.037 -5.874
22 HB VAL 4 HB VAL 4 0.990 -4.164 -6.730
23 HG11 VAL 4 HG11 VAL 4 2.548 -5.566 -7.704
24 HG12 VAL 4 HG12 VAL 4 2.046 -6.499 -6.293
25 HG13 VAL 4 HG13 VAL 4 1.397 -6.890 -7.886
26 HG21 VAL 4 HG21 VAL 4 -0.464 -3.887 -8.413
27 HG22 VAL 4 HG22 VAL 4 0.330 -5.290 -9.128
28 HG23 VAL 4 HG23 VAL 4 -1.159 -5.495 -8.205
29 H ARG 5 H ARG 5 -0.710 -7.407 -4.115
30 HA ARG 5 HA ARG 5 -1.251 -9.500 -6.119
31 HB2 ARG 5 HB2 ARG 5 0.933 -9.619 -4.717
32 HB3 ARG 5 HB3 ARG 5 -0.128 -10.098 -3.399
33 HG2 ARG 5 HG2 ARG 5 -0.995 -11.896 -5.003
34 HG3 ARG 5 HG3 ARG 5 0.439 -11.532 -5.966
35 HD2 ARG 5 HD2 ARG 5 0.471 -12.321 -3.055
36 HD3 ARG 5 HD3 ARG 5 0.753 -13.428 -4.398
37 HE ARG 5 HE ARG 5 2.572 -11.459 -4.805
38 HH11 ARG 5 HH11 ARG 5 1.785 -13.495 -2.093
39 HH12 ARG 5 HH12 ARG 5 3.399 -13.503 -1.464
40 HH21 ARG 5 HH21 ARG 5 4.700 -11.460 -3.986
41 HH22 ARG 5 HH22 ARG 5 5.056 -12.344 -2.540
42 H TYR 6 H TYR 6 -3.447 -9.515 -6.089
43 HA TYR 6 HA TYR 6 -4.703 -10.372 -3.586
44 HB2 TYR 6 HB2 TYR 6 -6.586 -8.843 -3.916
45 HB3 TYR 6 HB3 TYR 6 -5.080 -7.949 -3.743
46 HD1 TYR 6 HD1 TYR 6 -4.201 -6.637 -5.551
47 HD2 TYR 6 HD2 TYR 6 -7.697 -8.996 -6.108
48 HE1 TYR 6 HE1 TYR 6 -4.649 -5.462 -7.665
49 HE2 TYR 6 HE2 TYR 6 -8.154 -7.829 -8.224
50 HH TYR 6 HH TYR 6 -6.269 -5.054 -9.237
51 H THR 7 H THR 7 -6.742 -11.456 -3.883
52 HA THR 7 HA THR 7 -7.160 -12.458 -6.623
53 HB THR 7 HB THR 7 -8.031 -14.445 -4.799
54 HG1 THR 7 HG1 THR 7 -5.338 -13.623 -4.340
55 HG21 THR 7 HG21 THR 7 -6.015 -14.158 -6.960
56 HG22 THR 7 HG22 THR 7 -7.359 -15.290 -6.809
57 HG23 THR 7 HG23 THR 7 -5.874 -15.558 -5.898
58 H TYR 8 H TYR 8 -8.484 -10.392 -4.795
59 HA TYR 8 HA TYR 8 -11.134 -10.821 -5.651
60 HB2 TYR 8 HB2 TYR 8 -12.258 -11.252 -3.550
61 HB3 TYR 8 HB3 TYR 8 -11.076 -12.523 -3.842
62 HD1 TYR 8 HD1 TYR 8 -12.315 -10.234 -1.472
63 HD2 TYR 8 HD2 TYR 8 -8.722 -12.132 -2.734
64 HE1 TYR 8 HE1 TYR 8 -11.321 -9.807 0.737
65 HE2 TYR 8 HE2 TYR 8 -7.718 -11.711 -0.528
66 HH TYR 8 HH TYR 8 -9.504 -10.788 2.159
67 H ARG 9 H ARG 9 -12.599 -9.363 -3.888
68 HA ARG 9 HA ARG 9 -11.207 -6.770 -3.904
69 HB2 ARG 9 HB2 ARG 9 -13.231 -7.038 -5.379
70 HB3 ARG 9 HB3 ARG 9 -14.190 -7.239 -3.918
71 HG2 ARG 9 HG2 ARG 9 -14.465 -5.000 -4.477
72 HG3 ARG 9 HG3 ARG 9 -13.240 -4.973 -3.206
73 HD2 ARG 9 HD2 ARG 9 -12.423 -3.518 -4.851
74 HD3 ARG 9 HD3 ARG 9 -11.526 -5.016 -5.094
75 HE ARG 9 HE ARG 9 -12.489 -5.206 -7.157
76 HH11 ARG 9 HH11 ARG 9 -14.336 -2.951 -5.253
77 HH12 ARG 9 HH12 ARG 9 -15.357 -2.475 -6.570
78 HH21 ARG 9 HH21 ARG 9 -13.826 -4.587 -8.898
79 HH22 ARG 9 HH22 ARG 9 -15.066 -3.407 -8.643
80 HA PRO 10 HA PRO 10 -11.743 -7.729 0.563
81 HB2 PRO 10 HB2 PRO 10 -9.438 -6.509 1.316
82 HB3 PRO 10 HB3 PRO 10 -9.497 -8.179 0.740
83 HG2 PRO 10 HG2 PRO 10 -8.748 -5.689 -0.743
84 HG3 PRO 10 HG3 PRO 10 -7.971 -7.283 -0.769
85 HD2 PRO 10 HD2 PRO 10 -9.652 -6.449 -2.722
86 HD3 PRO 10 HD3 PRO 10 -9.520 -8.152 -2.239
87 H SER 11 H SER 11 -11.893 -6.251 2.406
88 HA SER 11 HA SER 11 -12.633 -3.535 1.543
89 HB2 SER 11 HB2 SER 11 -13.846 -5.459 3.443
90 HB3 SER 11 HB3 SER 11 -13.856 -3.768 3.941
91 HG SER 11 HG SER 11 -15.347 -3.390 2.517
92 H VAL 12 H VAL 12 -11.228 -5.352 4.256
93 HA VAL 12 HA VAL 12 -9.494 -3.056 4.813
94 HB VAL 12 HB VAL 12 -9.828 -3.522 7.296
95 HG11 VAL 12 HG11 VAL 12 -10.648 -1.501 6.247
96 HG12 VAL 12 HG12 VAL 12 -12.095 -2.344 5.691
97 HG13 VAL 12 HG13 VAL 12 -11.830 -2.088 7.416
98 HG21 VAL 12 HG21 VAL 12 -12.567 -4.405 6.886
99 HG22 VAL 12 HG22 VAL 12 -11.384 -5.601 6.359
100 HG23 VAL 12 HG23 VAL 12 -11.346 -4.994 8.014
101 HA PRO 13 HA PRO 13 -6.967 -6.854 4.653
102 HB2 PRO 13 HB2 PRO 13 -4.730 -5.571 3.806
103 HB3 PRO 13 HB3 PRO 13 -6.017 -6.083 2.709
104 HG2 PRO 13 HG2 PRO 13 -5.493 -3.379 3.882
105 HG3 PRO 13 HG3 PRO 13 -5.952 -3.809 2.225
106 HD2 PRO 13 HD2 PRO 13 -7.736 -2.876 4.035
107 HD3 PRO 13 HD3 PRO 13 -8.181 -4.036 2.767
108 H ALA 14 H ALA 14 -4.946 -7.413 5.757
109 HA ALA 14 HA ALA 14 -4.886 -6.666 8.420
110 HB1 ALA 14 HB1 ALA 14 -2.562 -7.727 6.817
111 HB2 ALA 14 HB2 ALA 14 -2.760 -7.812 8.568
112 HB3 ALA 14 HB3 ALA 14 -3.851 -8.710 7.513
113 H HIS 15 H HIS 15 -2.838 -5.494 5.762
114 HA HIS 15 HA HIS 15 -2.395 -3.022 7.243
115 HB2 HIS 15 HB2 HIS 15 -0.070 -4.556 6.073
116 HB3 HIS 15 HB3 HIS 15 -0.004 -3.075 7.023
117 HD1 HIS 15 HD1 HIS 15 -0.839 -6.745 7.416
118 HD2 HIS 15 HD2 HIS 15 0.190 -3.448 9.725
119 HE1 HIS 15 HE1 HIS 15 -0.462 -7.640 9.735
120 H ARG 16 H ARG 16 -2.426 -1.279 5.955
121 HA ARG 16 HA ARG 16 -2.033 -1.668 3.066
122 HB2 ARG 16 HB2 ARG 16 -3.905 -0.175 2.597
123 HB3 ARG 16 HB3 ARG 16 -4.442 -1.566 3.530
124 HG2 ARG 16 HG2 ARG 16 -3.689 0.887 5.018
125 HG3 ARG 16 HG3 ARG 16 -5.201 0.898 4.109
126 HD2 ARG 16 HD2 ARG 16 -4.672 -1.474 5.796
127 HD3 ARG 16 HD3 ARG 16 -5.017 0.037 6.637
128 HE ARG 16 HE ARG 16 -6.879 -1.598 5.249
129 HH11 ARG 16 HH11 ARG 16 -6.109 1.716 5.985
130 HH12 ARG 16 HH12 ARG 16 -7.747 2.264 5.844
131 HH21 ARG 16 HH21 ARG 16 -9.038 -0.889 5.060
132 HH22 ARG 16 HH22 ARG 16 -9.412 0.781 5.318
133 H ARG 17 H ARG 17 -0.087 -0.744 4.852
134 HA ARG 17 HA ARG 17 0.380 1.903 3.744
135 HB2 ARG 17 HB2 ARG 17 -0.110 1.356 6.620
136 HB3 ARG 17 HB3 ARG 17 1.213 2.449 6.237
137 HG2 ARG 17 HG2 ARG 17 -1.614 2.786 5.261
138 HG3 ARG 17 HG3 ARG 17 -0.931 3.597 6.671
139 HD2 ARG 17 HD2 ARG 17 0.641 3.845 4.200
140 HD3 ARG 17 HD3 ARG 17 -0.942 4.621 4.159
141 HE ARG 17 HE ARG 17 0.181 5.420 6.526
142 HH11 ARG 17 HH11 ARG 17 1.067 5.599 3.165
143 HH12 ARG 17 HH12 ARG 17 1.956 7.075 3.343
144 HH21 ARG 17 HH21 ARG 17 1.349 7.363 6.774
145 HH22 ARG 17 HH22 ARG 17 2.117 8.077 5.397
146 H VAL 18 H VAL 18 2.647 2.683 4.618
147 HA VAL 18 HA VAL 18 4.505 0.607 3.882
148 HB VAL 18 HB VAL 18 4.810 2.919 3.089
149 HG11 VAL 18 HG11 VAL 18 5.844 3.815 5.714
150 HG12 VAL 18 HG12 VAL 18 5.055 4.733 4.431
151 HG13 VAL 18 HG13 VAL 18 4.092 3.741 5.526
152 HG21 VAL 18 HG21 VAL 18 7.161 2.990 3.330
153 HG22 VAL 18 HG22 VAL 18 7.102 2.168 4.890
154 HG23 VAL 18 HG23 VAL 18 6.716 1.285 3.412
155 H ARG 19 H ARG 19 3.429 2.139 6.811
156 HA ARG 19 HA ARG 19 5.150 0.330 8.345
157 HB2 ARG 19 HB2 ARG 19 4.872 3.301 8.810
158 HB3 ARG 19 HB3 ARG 19 5.542 2.189 9.996
159 HG2 ARG 19 HG2 ARG 19 6.661 2.469 7.223
160 HG3 ARG 19 HG3 ARG 19 7.200 3.457 8.582
161 HD2 ARG 19 HD2 ARG 19 8.181 1.679 9.662
162 HD3 ARG 19 HD3 ARG 19 7.130 0.494 8.887
163 HE ARG 19 HE ARG 19 8.699 1.617 6.893
164 HH11 ARG 19 HH11 ARG 19 9.141 -0.283 9.776
165 HH12 ARG 19 HH12 ARG 19 10.567 -1.075 9.192
166 HH21 ARG 19 HH21 ARG 19 10.575 0.582 6.113
167 HH22 ARG 19 HH22 ARG 19 11.383 -0.582 7.108
168 H GLU 20 H GLU 20 2.457 -0.041 7.750
169 HA GLU 20 HA GLU 20 0.669 0.952 9.672
170 HB2 GLU 20 HB2 GLU 20 0.288 -0.424 7.455
171 HB3 GLU 20 HB3 GLU 20 0.326 -1.798 8.552
172 HG2 GLU 20 HG2 GLU 20 -1.932 -1.257 8.351
173 HG3 GLU 20 HG3 GLU 20 -1.445 -0.570 9.899
174 H SER 21 H SER 21 -0.321 -0.181 11.462
175 HA SER 21 HA SER 21 0.864 -2.497 12.608
176 HB2 SER 21 HB2 SER 21 1.858 -1.437 14.600
177 HB3 SER 21 HB3 SER 21 2.676 -0.926 13.124
178 HG SER 21 HG SER 21 2.261 0.865 14.428
179 HA PRO 22 HA PRO 22 -3.413 -1.246 13.989
180 HB2 PRO 22 HB2 PRO 22 -4.610 -3.556 13.214
181 HB3 PRO 22 HB3 PRO 22 -4.402 -2.172 12.134
182 HG2 PRO 22 HG2 PRO 22 -2.767 -4.671 12.348
183 HG3 PRO 22 HG3 PRO 22 -3.324 -3.819 10.896
184 HD2 PRO 22 HD2 PRO 22 -0.803 -3.573 11.852
185 HD3 PRO 22 HD3 PRO 22 -1.641 -2.249 11.018
186 H LEU 23 H LEU 23 -4.637 -2.146 15.721
187 HA LEU 23 HA LEU 23 -3.086 -4.020 17.366
188 HB2 LEU 23 HB2 LEU 23 -4.922 -1.762 17.960
189 HB3 LEU 23 HB3 LEU 23 -4.856 -3.096 19.110
190 HG LEU 23 HG LEU 23 -3.395 -1.310 19.824
191 HD11 LEU 23 HD11 LEU 23 -2.735 -3.691 20.171
192 HD12 LEU 23 HD12 LEU 23 -1.386 -2.555 20.153
193 HD13 LEU 23 HD13 LEU 23 -1.712 -3.560 18.741
194 HD21 LEU 23 HD21 LEU 23 -2.189 -0.076 18.426
195 HD22 LEU 23 HD22 LEU 23 -2.907 -0.981 17.093
196 HD23 LEU 23 HD23 LEU 23 -1.371 -1.502 17.787
197 H SER 24 H SER 24 -6.517 -3.205 16.808
198 HA SER 24 HA SER 24 -7.258 -5.948 17.459
199 HB2 SER 24 HB2 SER 24 -9.621 -4.984 17.133
200 HB3 SER 24 HB3 SER 24 -8.687 -4.387 18.504
201 HG SER 24 HG SER 24 -9.731 -3.000 16.490
202 H SER 25 H SER 25 -5.782 -5.725 15.112
203 HA SER 25 HA SER 25 -7.596 -5.723 12.861
204 HB2 SER 25 HB2 SER 25 -5.333 -6.633 11.769
205 HB3 SER 25 HB3 SER 25 -5.577 -4.923 12.124
206 HG SER 25 HG SER 25 -3.751 -6.612 13.134
207 H ASP 26 H ASP 26 -5.788 -8.083 14.757
208 HA ASP 26 HA ASP 26 -6.246 -10.347 13.189
209 HB2 ASP 26 HB2 ASP 26 -5.879 -10.045 16.171
210 HB3 ASP 26 HB3 ASP 26 -5.960 -11.609 15.364
211 H ALA 27 H ALA 27 -8.386 -8.540 15.187
212 HA ALA 27 HA ALA 27 -10.280 -10.454 15.898
213 HB1 ALA 27 HB1 ALA 27 -10.064 -7.641 15.982
214 HB2 ALA 27 HB2 ALA 27 -11.613 -8.023 15.230
215 HB3 ALA 27 HB3 ALA 27 -11.222 -8.673 16.822
216 H ILE 28 H ILE 28 -9.660 -8.915 12.835
217 HA ILE 28 HA ILE 28 -12.052 -9.268 11.501
218 HB ILE 28 HB ILE 28 -9.280 -9.639 10.361
219 HG12 ILE 28 HG12 ILE 28 -10.982 -7.156 10.238
220 HG13 ILE 28 HG13 ILE 28 -9.864 -7.445 11.566
221 HG21 ILE 28 HG21 ILE 28 -11.900 -9.040 8.995
222 HG22 ILE 28 HG22 ILE 28 -10.320 -9.053 8.215
223 HG23 ILE 28 HG23 ILE 28 -10.984 -10.542 8.887
224 HD11 ILE 28 HD11 ILE 28 -8.498 -6.248 10.228
225 HD12 ILE 28 HD12 ILE 28 -8.196 -7.840 9.530
226 HD13 ILE 28 HD13 ILE 28 -9.330 -6.737 8.752
227 H PHE 29 H PHE 29 -9.603 -11.633 12.320
228 HA PHE 29 HA PHE 29 -10.862 -13.706 10.727
229 HB2 PHE 29 HB2 PHE 29 -8.327 -13.431 11.174
230 HB3 PHE 29 HB3 PHE 29 -8.672 -14.160 12.739
231 HD1 PHE 29 HD1 PHE 29 -8.259 -14.727 9.193
232 HD2 PHE 29 HD2 PHE 29 -9.549 -16.470 12.856
233 HE1 PHE 29 HE1 PHE 29 -8.118 -16.962 8.175
234 HE2 PHE 29 HE2 PHE 29 -9.409 -18.708 11.844
235 HZ PHE 29 HZ PHE 29 -8.692 -18.956 9.501
236 H LYS 30 H LYS 30 -10.851 -12.562 13.996
237 HA LYS 30 HA LYS 30 -11.728 -14.857 15.341
238 HB2 LYS 30 HB2 LYS 30 -10.923 -12.819 16.474
239 HB3 LYS 30 HB3 LYS 30 -12.372 -11.966 15.955
240 HG2 LYS 30 HG2 LYS 30 -13.742 -13.523 17.264
241 HG3 LYS 30 HG3 LYS 30 -12.275 -14.340 17.808
242 HD2 LYS 30 HD2 LYS 30 -12.573 -11.392 18.209
243 HD3 LYS 30 HD3 LYS 30 -13.383 -12.513 19.306
244 HE2 LYS 30 HE2 LYS 30 -11.413 -13.308 20.167
245 HE3 LYS 30 HE3 LYS 30 -10.503 -12.953 18.699
246 HZ1 LYS 30 HZ1 LYS 30 -10.826 -10.541 19.293
247 HZ2 LYS 30 HZ2 LYS 30 -9.782 -11.414 20.297
248 HZ3 LYS 30 HZ3 LYS 30 -11.355 -11.064 20.813
249 H GLN 31 H GLN 31 -13.413 -12.593 13.310
250 HA GLN 31 HA GLN 31 -16.050 -13.226 14.146
251 HB2 GLN 31 HB2 GLN 31 -15.008 -12.063 11.559
252 HB3 GLN 31 HB3 GLN 31 -16.714 -12.187 11.967
253 HG2 GLN 31 HG2 GLN 31 -14.755 -10.722 13.702
254 HG3 GLN 31 HG3 GLN 31 -15.591 -9.951 12.356
255 HE21 GLN 31 HE21 GLN 31 -15.908 -8.974 14.864
256 HE22 GLN 31 HE22 GLN 31 -17.504 -9.304 15.436
257 H SER 32 H SER 32 -13.815 -14.663 11.887
258 HA SER 32 HA SER 32 -15.553 -16.174 10.325
259 HB2 SER 32 HB2 SER 32 -12.985 -15.864 10.138
260 HB3 SER 32 HB3 SER 32 -12.891 -17.252 11.222
261 HG SER 32 HG SER 32 -13.726 -18.528 9.694
262 H HIS 33 H HIS 33 -14.051 -16.961 13.439
263 HA HIS 33 HA HIS 33 -15.868 -19.270 13.652
264 HB2 HIS 33 HB2 HIS 33 -14.269 -20.240 15.225
265 HB3 HIS 33 HB3 HIS 33 -13.480 -19.871 13.695
266 HD1 HIS 33 HD1 HIS 33 -11.449 -18.419 13.796
267 HD2 HIS 33 HD2 HIS 33 -13.646 -18.315 17.321
268 HE1 HIS 33 HE1 HIS 33 -10.047 -17.112 15.423
Start of MODEL 15
1 H1 ASN 1 H ASN 1 -4.883 -4.326 0.758
2 HA ASN 1 HA ASN 1 -2.985 -2.257 1.320
3 HB2 ASN 1 HB2 ASN 1 -3.258 -4.393 -0.758
4 HB3 ASN 1 HB3 ASN 1 -2.122 -3.075 -1.032
5 HD21 ASN 1 HD21 ASN 1 -0.403 -2.778 0.458
6 HD22 ASN 1 HD22 ASN 1 0.168 -4.098 1.415
7 H VAL 2 H VAL 2 -3.292 -0.195 0.827
8 HA VAL 2 HA VAL 2 -5.208 0.612 -1.172
9 HB VAL 2 HB VAL 2 -3.299 2.374 0.365
10 HG11 VAL 2 HG11 VAL 2 -4.972 4.110 -0.061
11 HG12 VAL 2 HG12 VAL 2 -4.342 3.437 -1.565
12 HG13 VAL 2 HG13 VAL 2 -5.935 2.956 -0.981
13 HG21 VAL 2 HG21 VAL 2 -5.811 2.584 1.523
14 HG22 VAL 2 HG22 VAL 2 -5.588 0.852 1.278
15 HG23 VAL 2 HG23 VAL 2 -4.402 1.771 2.205
16 H ASP 3 H ASP 3 -3.908 -0.578 -2.870
17 HA ASP 3 HA ASP 3 -2.273 1.374 -4.274
18 HB2 ASP 3 HB2 ASP 3 -1.264 -1.287 -3.322
19 HB3 ASP 3 HB3 ASP 3 -0.638 -0.590 -4.814
20 H VAL 4 H VAL 4 -1.662 0.444 -6.512
21 HA VAL 4 HA VAL 4 -4.084 -0.806 -7.599
22 HB VAL 4 HB VAL 4 -3.241 1.422 -8.487
23 HG11 VAL 4 HG11 VAL 4 -1.281 1.621 -9.597
24 HG12 VAL 4 HG12 VAL 4 -0.823 0.255 -8.577
25 HG13 VAL 4 HG13 VAL 4 -1.351 -0.020 -10.238
26 HG21 VAL 4 HG21 VAL 4 -3.352 0.293 -10.970
27 HG22 VAL 4 HG22 VAL 4 -4.112 -0.947 -9.972
28 HG23 VAL 4 HG23 VAL 4 -4.753 0.696 -9.977
29 H ARG 5 H ARG 5 -1.791 -2.227 -6.290
30 HA ARG 5 HA ARG 5 -1.080 -3.980 -8.550
31 HB2 ARG 5 HB2 ARG 5 0.552 -2.877 -6.343
32 HB3 ARG 5 HB3 ARG 5 0.825 -4.572 -6.724
33 HG2 ARG 5 HG2 ARG 5 2.319 -3.700 -8.163
34 HG3 ARG 5 HG3 ARG 5 0.896 -3.553 -9.198
35 HD2 ARG 5 HD2 ARG 5 1.875 -1.446 -9.322
36 HD3 ARG 5 HD3 ARG 5 0.610 -1.239 -8.112
37 HE ARG 5 HE ARG 5 3.027 -1.947 -6.848
38 HH11 ARG 5 HH11 ARG 5 1.516 0.712 -8.513
39 HH12 ARG 5 HH12 ARG 5 2.430 1.924 -7.678
40 HH21 ARG 5 HH21 ARG 5 4.237 -0.360 -5.743
41 HH22 ARG 5 HH22 ARG 5 3.978 1.313 -6.104
42 H TYR 6 H TYR 6 -2.438 -5.660 -8.414
43 HA TYR 6 HA TYR 6 -2.400 -7.255 -5.976
44 HB2 TYR 6 HB2 TYR 6 -4.841 -7.483 -5.921
45 HB3 TYR 6 HB3 TYR 6 -4.361 -5.804 -5.701
46 HD1 TYR 6 HD1 TYR 6 -4.897 -4.131 -7.353
47 HD2 TYR 6 HD2 TYR 6 -5.923 -8.210 -7.995
48 HE1 TYR 6 HE1 TYR 6 -6.368 -3.463 -9.208
49 HE2 TYR 6 HE2 TYR 6 -7.396 -7.553 -9.851
50 HH TYR 6 HH TYR 6 -7.381 -4.392 -11.181
51 H THR 7 H THR 7 -2.727 -9.435 -6.313
52 HA THR 7 HA THR 7 -3.105 -10.275 -9.112
53 HB THR 7 HB THR 7 -1.611 -12.280 -8.394
54 HG1 THR 7 HG1 THR 7 -0.608 -12.071 -6.544
55 HG21 THR 7 HG21 THR 7 0.300 -10.164 -8.588
56 HG22 THR 7 HG22 THR 7 -1.081 -9.785 -9.618
57 HG23 THR 7 HG23 THR 7 -0.214 -11.306 -9.829
58 H TYR 8 H TYR 8 -4.957 -10.077 -6.762
59 HA TYR 8 HA TYR 8 -6.404 -12.451 -7.206
60 HB2 TYR 8 HB2 TYR 8 -6.197 -13.557 -5.061
61 HB3 TYR 8 HB3 TYR 8 -4.601 -13.407 -5.787
62 HD1 TYR 8 HD1 TYR 8 -6.482 -12.935 -2.850
63 HD2 TYR 8 HD2 TYR 8 -3.238 -11.281 -5.050
64 HE1 TYR 8 HE1 TYR 8 -5.664 -11.838 -0.806
65 HE2 TYR 8 HE2 TYR 8 -2.409 -10.181 -3.012
66 HH TYR 8 HH TYR 8 -3.932 -10.735 0.124
67 H ARG 9 H ARG 9 -7.933 -12.674 -4.971
68 HA ARG 9 HA ARG 9 -9.109 -9.985 -4.741
69 HB2 ARG 9 HB2 ARG 9 -10.469 -11.785 -5.863
70 HB3 ARG 9 HB3 ARG 9 -10.508 -12.627 -4.320
71 HG2 ARG 9 HG2 ARG 9 -11.513 -10.482 -3.371
72 HG3 ARG 9 HG3 ARG 9 -11.766 -10.009 -5.052
73 HD2 ARG 9 HD2 ARG 9 -12.773 -12.577 -3.837
74 HD3 ARG 9 HD3 ARG 9 -13.735 -11.107 -3.990
75 HE ARG 9 HE ARG 9 -13.137 -12.991 -6.051
76 HH11 ARG 9 HH11 ARG 9 -13.795 -9.631 -5.416
77 HH12 ARG 9 HH12 ARG 9 -14.411 -9.317 -7.004
78 HH21 ARG 9 HH21 ARG 9 -13.947 -12.589 -8.146
79 HH22 ARG 9 HH22 ARG 9 -14.498 -11.000 -8.556
80 HA PRO 10 HA PRO 10 -7.545 -10.893 -0.511
81 HB2 PRO 10 HB2 PRO 10 -6.934 -8.307 0.044
82 HB3 PRO 10 HB3 PRO 10 -5.834 -9.390 -0.817
83 HG2 PRO 10 HG2 PRO 10 -7.684 -7.307 -1.912
84 HG3 PRO 10 HG3 PRO 10 -6.011 -7.671 -2.373
85 HD2 PRO 10 HD2 PRO 10 -8.138 -8.533 -3.809
86 HD3 PRO 10 HD3 PRO 10 -6.630 -9.461 -3.687
87 H SER 11 H SER 11 -9.034 -11.118 1.024
88 HA SER 11 HA SER 11 -11.440 -9.521 1.008
89 HB2 SER 11 HB2 SER 11 -11.014 -11.296 3.311
90 HB3 SER 11 HB3 SER 11 -12.363 -11.222 2.178
91 HG SER 11 HG SER 11 -10.353 -12.967 2.247
92 H VAL 12 H VAL 12 -9.133 -10.331 3.608
93 HA VAL 12 HA VAL 12 -9.280 -7.546 4.524
94 HB VAL 12 HB VAL 12 -9.401 -9.852 6.459
95 HG11 VAL 12 HG11 VAL 12 -8.613 -7.994 7.599
96 HG12 VAL 12 HG12 VAL 12 -9.603 -6.873 6.663
97 HG13 VAL 12 HG13 VAL 12 -10.351 -7.908 7.880
98 HG21 VAL 12 HG21 VAL 12 -11.656 -8.267 5.249
99 HG22 VAL 12 HG22 VAL 12 -11.431 -10.016 5.233
100 HG23 VAL 12 HG23 VAL 12 -11.814 -9.190 6.743
101 HA PRO 13 HA PRO 13 -4.889 -8.757 4.286
102 HB2 PRO 13 HB2 PRO 13 -4.008 -6.230 3.833
103 HB3 PRO 13 HB3 PRO 13 -4.628 -7.275 2.550
104 HG2 PRO 13 HG2 PRO 13 -6.014 -5.081 4.042
105 HG3 PRO 13 HG3 PRO 13 -6.048 -5.449 2.308
106 HD2 PRO 13 HD2 PRO 13 -8.048 -6.163 3.987
107 HD3 PRO 13 HD3 PRO 13 -7.603 -7.130 2.567
108 H ALA 14 H ALA 14 -3.658 -8.956 6.044
109 HA ALA 14 HA ALA 14 -4.265 -7.959 8.543
110 HB1 ALA 14 HB1 ALA 14 -2.161 -8.767 9.274
111 HB2 ALA 14 HB2 ALA 14 -2.690 -9.844 7.981
112 HB3 ALA 14 HB3 ALA 14 -1.465 -8.617 7.661
113 H HIS 15 H HIS 15 -2.438 -6.474 5.970
114 HA HIS 15 HA HIS 15 -2.470 -3.950 7.389
115 HB2 HIS 15 HB2 HIS 15 0.010 -3.608 6.887
116 HB3 HIS 15 HB3 HIS 15 -0.383 -4.683 8.225
117 HD1 HIS 15 HD1 HIS 15 0.693 -6.919 8.168
118 HD2 HIS 15 HD2 HIS 15 0.659 -5.109 4.428
119 HE1 HIS 15 HE1 HIS 15 2.020 -8.443 6.671
120 H ARG 16 H ARG 16 -2.727 -2.274 6.027
121 HA ARG 16 HA ARG 16 -2.290 -2.771 3.156
122 HB2 ARG 16 HB2 ARG 16 -4.244 -1.399 2.668
123 HB3 ARG 16 HB3 ARG 16 -4.686 -2.746 3.708
124 HG2 ARG 16 HG2 ARG 16 -4.406 -1.089 5.644
125 HG3 ARG 16 HG3 ARG 16 -4.451 0.158 4.396
126 HD2 ARG 16 HD2 ARG 16 -6.574 -1.934 4.864
127 HD3 ARG 16 HD3 ARG 16 -6.663 -0.254 5.388
128 HE ARG 16 HE ARG 16 -6.203 -0.454 2.587
129 HH11 ARG 16 HH11 ARG 16 -8.670 -0.702 5.030
130 HH12 ARG 16 HH12 ARG 16 -9.962 -0.283 3.954
131 HH21 ARG 16 HH21 ARG 16 -7.894 0.100 1.160
132 HH22 ARG 16 HH22 ARG 16 -9.519 0.172 1.753
133 H ARG 17 H ARG 17 -0.316 -1.675 4.784
134 HA ARG 17 HA ARG 17 -0.063 0.964 3.570
135 HB2 ARG 17 HB2 ARG 17 -0.183 0.425 6.500
136 HB3 ARG 17 HB3 ARG 17 0.954 1.639 5.929
137 HG2 ARG 17 HG2 ARG 17 -1.985 1.658 5.288
138 HG3 ARG 17 HG3 ARG 17 -1.255 2.537 6.633
139 HD2 ARG 17 HD2 ARG 17 -0.059 2.931 3.953
140 HD3 ARG 17 HD3 ARG 17 -1.653 3.631 4.229
141 HE ARG 17 HE ARG 17 0.813 4.598 5.231
142 HH11 ARG 17 HH11 ARG 17 -2.537 4.196 6.088
143 HH12 ARG 17 HH12 ARG 17 -2.549 5.530 7.194
144 HH21 ARG 17 HH21 ARG 17 0.810 6.357 6.684
145 HH22 ARG 17 HH22 ARG 17 -0.646 6.759 7.531
146 H VAL 18 H VAL 18 2.233 1.859 4.177
147 HA VAL 18 HA VAL 18 4.107 -0.219 3.410
148 HB VAL 18 HB VAL 18 4.169 1.969 2.278
149 HG11 VAL 18 HG11 VAL 18 4.955 3.949 3.411
150 HG12 VAL 18 HG12 VAL 18 3.526 3.330 4.241
151 HG13 VAL 18 HG13 VAL 18 5.130 3.056 4.921
152 HG21 VAL 18 HG21 VAL 18 6.244 0.423 2.900
153 HG22 VAL 18 HG22 VAL 18 6.427 1.929 2.001
154 HG23 VAL 18 HG23 VAL 18 6.750 1.892 3.734
155 H ARG 19 H ARG 19 3.248 1.606 6.226
156 HA ARG 19 HA ARG 19 5.350 0.210 7.728
157 HB2 ARG 19 HB2 ARG 19 4.624 3.133 7.942
158 HB3 ARG 19 HB3 ARG 19 5.574 2.278 9.150
159 HG2 ARG 19 HG2 ARG 19 6.431 2.258 6.290
160 HG3 ARG 19 HG3 ARG 19 6.767 3.657 7.312
161 HD2 ARG 19 HD2 ARG 19 8.676 2.378 7.578
162 HD3 ARG 19 HD3 ARG 19 7.707 1.907 8.973
163 HE ARG 19 HE ARG 19 7.349 0.227 6.661
164 HH11 ARG 19 HH11 ARG 19 9.196 0.790 9.558
165 HH12 ARG 19 HH12 ARG 19 9.717 -0.856 9.702
166 HH21 ARG 19 HH21 ARG 19 8.028 -1.943 6.839
167 HH22 ARG 19 HH22 ARG 19 9.053 -2.410 8.154
168 H GLU 20 H GLU 20 3.353 -1.170 7.996
169 HA GLU 20 HA GLU 20 1.997 -0.347 10.454
170 HB2 GLU 20 HB2 GLU 20 0.589 0.065 8.315
171 HB3 GLU 20 HB3 GLU 20 0.423 -1.684 8.273
172 HG2 GLU 20 HG2 GLU 20 -0.370 -1.434 10.717
173 HG3 GLU 20 HG3 GLU 20 -0.611 0.260 10.292
174 H SER 21 H SER 21 1.310 -2.061 11.774
175 HA SER 21 HA SER 21 1.586 -4.793 10.989
176 HB2 SER 21 HB2 SER 21 3.759 -3.502 12.624
177 HB3 SER 21 HB3 SER 21 3.405 -5.223 12.777
178 HG SER 21 HG SER 21 4.112 -5.569 10.775
179 HA PRO 22 HA PRO 22 -1.200 -3.854 14.585
180 HB2 PRO 22 HB2 PRO 22 -3.362 -5.122 13.541
181 HB3 PRO 22 HB3 PRO 22 -2.979 -3.432 13.193
182 HG2 PRO 22 HG2 PRO 22 -2.439 -5.873 11.547
183 HG3 PRO 22 HG3 PRO 22 -3.040 -4.287 11.032
184 HD2 PRO 22 HD2 PRO 22 -0.455 -5.034 10.731
185 HD3 PRO 22 HD3 PRO 22 -0.934 -3.350 11.029
186 H LEU 23 H LEU 23 -1.597 -5.229 16.256
187 HA LEU 23 HA LEU 23 -0.836 -8.038 15.855
188 HB2 LEU 23 HB2 LEU 23 -0.801 -6.221 18.240
189 HB3 LEU 23 HB3 LEU 23 -0.724 -7.972 18.424
190 HG LEU 23 HG LEU 23 1.495 -7.075 18.559
191 HD11 LEU 23 HD11 LEU 23 2.590 -8.346 16.846
192 HD12 LEU 23 HD12 LEU 23 1.146 -8.315 15.835
193 HD13 LEU 23 HD13 LEU 23 1.141 -9.217 17.351
194 HD21 LEU 23 HD21 LEU 23 0.603 -5.136 16.834
195 HD22 LEU 23 HD22 LEU 23 1.691 -6.086 15.822
196 HD23 LEU 23 HD23 LEU 23 2.278 -5.382 17.329
197 H SER 24 H SER 24 -3.197 -6.049 17.631
198 HA SER 24 HA SER 24 -4.913 -8.384 17.974
199 HB2 SER 24 HB2 SER 24 -6.239 -6.964 19.452
200 HB3 SER 24 HB3 SER 24 -4.535 -6.866 19.896
201 HG SER 24 HG SER 24 -6.139 -4.878 19.310
202 H SER 25 H SER 25 -4.623 -7.608 15.327
203 HA SER 25 HA SER 25 -6.877 -5.966 14.567
204 HB2 SER 25 HB2 SER 25 -6.093 -6.955 12.219
205 HB3 SER 25 HB3 SER 25 -5.213 -5.650 13.014
206 HG SER 25 HG SER 25 -3.730 -7.198 12.446
207 H ASP 26 H ASP 26 -6.000 -9.387 14.495
208 HA ASP 26 HA ASP 26 -8.186 -10.354 13.051
209 HB2 ASP 26 HB2 ASP 26 -7.670 -12.520 13.993
210 HB3 ASP 26 HB3 ASP 26 -6.162 -11.677 13.647
211 H ALA 27 H ALA 27 -7.986 -9.131 16.260
212 HA ALA 27 HA ALA 27 -10.047 -10.418 17.574
213 HB1 ALA 27 HB1 ALA 27 -9.749 -7.468 17.893
214 HB2 ALA 27 HB2 ALA 27 -9.979 -8.717 19.117
215 HB3 ALA 27 HB3 ALA 27 -8.409 -8.526 18.337
216 H ILE 28 H ILE 28 -10.198 -8.049 15.025
217 HA ILE 28 HA ILE 28 -12.760 -7.056 15.283
218 HB ILE 28 HB ILE 28 -11.370 -7.805 12.708
219 HG12 ILE 28 HG12 ILE 28 -11.492 -5.080 13.990
220 HG13 ILE 28 HG13 ILE 28 -10.199 -6.218 14.354
221 HG21 ILE 28 HG21 ILE 28 -13.045 -5.537 12.435
222 HG22 ILE 28 HG22 ILE 28 -13.188 -7.108 11.649
223 HG23 ILE 28 HG23 ILE 28 -13.990 -6.818 13.192
224 HD11 ILE 28 HD11 ILE 28 -10.205 -4.368 12.333
225 HD12 ILE 28 HD12 ILE 28 -9.141 -5.770 12.451
226 HD13 ILE 28 HD13 ILE 28 -10.624 -5.865 11.502
227 H PHE 29 H PHE 29 -11.710 -10.170 14.029
228 HA PHE 29 HA PHE 29 -14.383 -10.911 13.206
229 HB2 PHE 29 HB2 PHE 29 -12.190 -11.650 12.086
230 HB3 PHE 29 HB3 PHE 29 -12.030 -12.777 13.428
231 HD1 PHE 29 HD1 PHE 29 -13.480 -12.189 10.230
232 HD2 PHE 29 HD2 PHE 29 -13.935 -14.425 13.822
233 HE1 PHE 29 HE1 PHE 29 -14.919 -13.794 9.044
234 HE2 PHE 29 HE2 PHE 29 -15.374 -16.034 12.643
235 HZ PHE 29 HZ PHE 29 -15.868 -15.720 10.250
236 H LYS 30 H LYS 30 -12.342 -11.266 15.979
237 HA LYS 30 HA LYS 30 -13.542 -13.512 17.173
238 HB2 LYS 30 HB2 LYS 30 -11.370 -12.369 17.837
239 HB3 LYS 30 HB3 LYS 30 -12.357 -11.171 18.663
240 HG2 LYS 30 HG2 LYS 30 -13.394 -13.150 19.907
241 HG3 LYS 30 HG3 LYS 30 -12.024 -14.080 19.295
242 HD2 LYS 30 HD2 LYS 30 -11.534 -11.473 20.667
243 HD3 LYS 30 HD3 LYS 30 -11.893 -12.908 21.632
244 HE2 LYS 30 HE2 LYS 30 -9.589 -12.978 21.515
245 HE3 LYS 30 HE3 LYS 30 -10.050 -14.019 20.169
246 HZ1 LYS 30 HZ1 LYS 30 -8.429 -11.790 20.071
247 HZ2 LYS 30 HZ2 LYS 30 -9.874 -11.319 19.328
248 HZ3 LYS 30 HZ3 LYS 30 -9.031 -12.671 18.757
249 H GLN 31 H GLN 31 -14.544 -10.204 16.916
250 HA GLN 31 HA GLN 31 -16.252 -9.910 19.062
251 HB2 GLN 31 HB2 GLN 31 -15.676 -8.176 17.329
252 HB3 GLN 31 HB3 GLN 31 -16.845 -8.944 16.264
253 HG2 GLN 31 HG2 GLN 31 -18.645 -8.412 17.731
254 HG3 GLN 31 HG3 GLN 31 -17.532 -7.853 18.979
255 HE21 GLN 31 HE21 GLN 31 -19.723 -6.441 17.696
256 HE22 GLN 31 HE22 GLN 31 -19.035 -5.031 16.974
257 H SER 32 H SER 32 -16.664 -11.803 16.165
258 HA SER 32 HA SER 32 -19.417 -12.178 16.157
259 HB2 SER 32 HB2 SER 32 -17.515 -14.418 15.505
260 HB3 SER 32 HB3 SER 32 -19.046 -14.008 14.732
261 HG SER 32 HG SER 32 -17.336 -13.351 13.424
262 H HIS 33 H HIS 33 -16.912 -14.026 17.868
263 HA HIS 33 HA HIS 33 -18.860 -15.706 19.171
264 HB2 HIS 33 HB2 HIS 33 -16.403 -16.281 18.509
265 HB3 HIS 33 HB3 HIS 33 -15.992 -15.491 20.029
266 HD1 HIS 33 HD1 HIS 33 -16.301 -18.716 18.880
267 HD2 HIS 33 HD2 HIS 33 -18.028 -16.740 22.101
268 HE1 HIS 33 HE1 HIS 33 -16.994 -20.524 20.485
Start of MODEL 16
1 H1 ASN 1 H ASN 1 1.538 -3.445 1.884
2 HA ASN 1 HA ASN 1 0.558 -0.772 1.542
3 HB2 ASN 1 HB2 ASN 1 2.979 -1.705 0.006
4 HB3 ASN 1 HB3 ASN 1 1.909 -0.451 -0.615
5 HD21 ASN 1 HD21 ASN 1 4.281 0.440 -0.391
6 HD22 ASN 1 HD22 ASN 1 4.547 1.374 1.038
7 H VAL 2 H VAL 2 -1.372 -1.159 0.695
8 HA VAL 2 HA VAL 2 -2.112 -3.522 -0.628
9 HB VAL 2 HB VAL 2 -3.743 -2.080 0.497
10 HG11 VAL 2 HG11 VAL 2 -3.911 -0.182 -1.754
11 HG12 VAL 2 HG12 VAL 2 -4.152 0.079 -0.025
12 HG13 VAL 2 HG13 VAL 2 -2.519 0.004 -0.687
13 HG21 VAL 2 HG21 VAL 2 -4.247 -3.622 -1.546
14 HG22 VAL 2 HG22 VAL 2 -5.498 -2.543 -0.928
15 HG23 VAL 2 HG23 VAL 2 -4.584 -2.099 -2.369
16 H ASP 3 H ASP 3 -2.378 -4.047 -2.762
17 HA ASP 3 HA ASP 3 -1.214 -2.165 -4.710
18 HB2 ASP 3 HB2 ASP 3 -1.071 -5.166 -4.521
19 HB3 ASP 3 HB3 ASP 3 -0.773 -4.330 -6.042
20 H VAL 4 H VAL 4 -1.926 -3.085 -7.059
21 HA VAL 4 HA VAL 4 -4.871 -3.091 -6.985
22 HB VAL 4 HB VAL 4 -4.817 -2.109 -9.224
23 HG11 VAL 4 HG11 VAL 4 -3.616 0.075 -8.559
24 HG12 VAL 4 HG12 VAL 4 -4.977 -0.472 -7.579
25 HG13 VAL 4 HG13 VAL 4 -3.325 -0.734 -7.020
26 HG21 VAL 4 HG21 VAL 4 -2.753 -3.081 -10.043
27 HG22 VAL 4 HG22 VAL 4 -2.687 -1.324 -10.181
28 HG23 VAL 4 HG23 VAL 4 -1.820 -2.139 -8.880
29 H ARG 5 H ARG 5 -3.236 -5.472 -6.762
30 HA ARG 5 HA ARG 5 -4.327 -6.924 -9.050
31 HB2 ARG 5 HB2 ARG 5 -1.455 -7.188 -8.142
32 HB3 ARG 5 HB3 ARG 5 -2.237 -8.177 -9.368
33 HG2 ARG 5 HG2 ARG 5 -2.620 -6.085 -10.686
34 HG3 ARG 5 HG3 ARG 5 -1.611 -5.240 -9.510
35 HD2 ARG 5 HD2 ARG 5 -0.777 -7.571 -11.233
36 HD3 ARG 5 HD3 ARG 5 -0.309 -5.886 -11.462
37 HE ARG 5 HE ARG 5 0.402 -6.812 -8.872
38 HH11 ARG 5 HH11 ARG 5 1.342 -6.945 -12.221
39 HH12 ARG 5 HH12 ARG 5 3.017 -7.225 -11.875
40 HH21 ARG 5 HH21 ARG 5 2.603 -7.180 -8.403
41 HH22 ARG 5 HH22 ARG 5 3.733 -7.360 -9.702
42 H TYR 6 H TYR 6 -5.690 -8.279 -8.078
43 HA TYR 6 HA TYR 6 -4.706 -9.805 -5.757
44 HB2 TYR 6 HB2 TYR 6 -6.989 -9.861 -4.888
45 HB3 TYR 6 HB3 TYR 6 -6.448 -8.198 -5.091
46 HD1 TYR 6 HD1 TYR 6 -7.596 -6.706 -6.532
47 HD2 TYR 6 HD2 TYR 6 -8.581 -10.845 -6.551
48 HE1 TYR 6 HE1 TYR 6 -9.587 -6.219 -7.892
49 HE2 TYR 6 HE2 TYR 6 -10.574 -10.370 -7.912
50 HH TYR 6 HH TYR 6 -11.087 -8.047 -9.676
51 H THR 7 H THR 7 -5.183 -11.985 -5.673
52 HA THR 7 HA THR 7 -6.376 -13.128 -8.115
53 HB THR 7 HB THR 7 -4.896 -15.167 -7.508
54 HG1 THR 7 HG1 THR 7 -3.010 -14.606 -6.368
55 HG21 THR 7 HG21 THR 7 -3.020 -14.257 -8.805
56 HG22 THR 7 HG22 THR 7 -3.652 -12.627 -8.570
57 HG23 THR 7 HG23 THR 7 -4.572 -13.803 -9.508
58 H TYR 8 H TYR 8 -7.593 -12.438 -5.481
59 HA TYR 8 HA TYR 8 -9.232 -14.712 -5.193
60 HB2 TYR 8 HB2 TYR 8 -8.593 -15.490 -2.990
61 HB3 TYR 8 HB3 TYR 8 -7.203 -15.598 -4.065
62 HD1 TYR 8 HD1 TYR 8 -8.319 -14.519 -0.908
63 HD2 TYR 8 HD2 TYR 8 -5.598 -13.510 -4.020
64 HE1 TYR 8 HE1 TYR 8 -6.991 -13.200 0.688
65 HE2 TYR 8 HE2 TYR 8 -4.262 -12.190 -2.432
66 HH TYR 8 HH TYR 8 -4.847 -10.948 -0.124
67 H ARG 9 H ARG 9 -10.211 -14.452 -2.671
68 HA ARG 9 HA ARG 9 -11.158 -11.665 -2.648
69 HB2 ARG 9 HB2 ARG 9 -12.491 -14.266 -1.958
70 HB3 ARG 9 HB3 ARG 9 -13.093 -12.751 -1.298
71 HG2 ARG 9 HG2 ARG 9 -13.263 -11.909 -3.659
72 HG3 ARG 9 HG3 ARG 9 -12.918 -13.558 -4.187
73 HD2 ARG 9 HD2 ARG 9 -14.873 -14.313 -2.822
74 HD3 ARG 9 HD3 ARG 9 -15.255 -12.616 -2.535
75 HE ARG 9 HE ARG 9 -15.009 -13.133 -5.310
76 HH11 ARG 9 HH11 ARG 9 -17.144 -13.604 -2.601
77 HH12 ARG 9 HH12 ARG 9 -18.578 -13.653 -3.572
78 HH21 ARG 9 HH21 ARG 9 -16.890 -13.195 -6.599
79 HH22 ARG 9 HH22 ARG 9 -18.432 -13.421 -5.846
80 HA PRO 10 HA PRO 10 -8.705 -12.052 1.225
81 HB2 PRO 10 HB2 PRO 10 -7.844 -9.478 1.184
82 HB3 PRO 10 HB3 PRO 10 -7.034 -10.776 0.300
83 HG2 PRO 10 HG2 PRO 10 -8.973 -8.726 -0.700
84 HG3 PRO 10 HG3 PRO 10 -7.474 -9.308 -1.449
85 HD2 PRO 10 HD2 PRO 10 -9.920 -10.182 -2.214
86 HD3 PRO 10 HD3 PRO 10 -8.476 -11.214 -2.270
87 H SER 11 H SER 11 -9.806 -11.902 3.067
88 HA SER 11 HA SER 11 -12.200 -10.502 3.395
89 HB2 SER 11 HB2 SER 11 -11.289 -12.452 4.784
90 HB3 SER 11 HB3 SER 11 -10.375 -11.240 5.681
91 HG SER 11 HG SER 11 -12.624 -11.908 6.402
92 H VAL 12 H VAL 12 -9.181 -9.791 5.154
93 HA VAL 12 HA VAL 12 -9.759 -6.923 4.838
94 HB VAL 12 HB VAL 12 -8.838 -6.612 7.179
95 HG11 VAL 12 HG11 VAL 12 -11.478 -7.607 6.377
96 HG12 VAL 12 HG12 VAL 12 -11.133 -7.738 8.103
97 HG13 VAL 12 HG13 VAL 12 -11.036 -6.171 7.299
98 HG21 VAL 12 HG21 VAL 12 -9.688 -9.381 7.814
99 HG22 VAL 12 HG22 VAL 12 -8.100 -9.168 7.077
100 HG23 VAL 12 HG23 VAL 12 -8.483 -8.358 8.596
101 HA PRO 13 HA PRO 13 -5.546 -6.476 3.684
102 HB2 PRO 13 HB2 PRO 13 -5.014 -3.977 4.602
103 HB3 PRO 13 HB3 PRO 13 -6.038 -4.286 3.195
104 HG2 PRO 13 HG2 PRO 13 -6.830 -3.696 6.021
105 HG3 PRO 13 HG3 PRO 13 -7.516 -3.066 4.512
106 HD2 PRO 13 HD2 PRO 13 -8.680 -5.067 5.917
107 HD3 PRO 13 HD3 PRO 13 -8.779 -4.959 4.148
108 H ALA 14 H ALA 14 -3.358 -6.084 4.519
109 HA ALA 14 HA ALA 14 -3.111 -7.091 7.248
110 HB1 ALA 14 HB1 ALA 14 -1.593 -7.361 4.815
111 HB2 ALA 14 HB2 ALA 14 -0.559 -6.845 6.148
112 HB3 ALA 14 HB3 ALA 14 -1.521 -8.316 6.296
113 H HIS 15 H HIS 15 -2.280 -4.289 5.297
114 HA HIS 15 HA HIS 15 -2.197 -2.531 7.477
115 HB2 HIS 15 HB2 HIS 15 0.267 -2.003 7.430
116 HB3 HIS 15 HB3 HIS 15 -0.144 -3.554 8.157
117 HD1 HIS 15 HD1 HIS 15 0.894 -5.607 7.147
118 HD2 HIS 15 HD2 HIS 15 1.414 -2.225 4.790
119 HE1 HIS 15 HE1 HIS 15 2.492 -6.293 5.330
120 H ARG 16 H ARG 16 -1.729 -0.350 6.857
121 HA ARG 16 HA ARG 16 -1.461 0.067 3.958
122 HB2 ARG 16 HB2 ARG 16 -3.159 1.823 4.050
123 HB3 ARG 16 HB3 ARG 16 -3.826 0.279 4.562
124 HG2 ARG 16 HG2 ARG 16 -3.535 0.986 6.917
125 HG3 ARG 16 HG3 ARG 16 -3.003 2.566 6.336
126 HD2 ARG 16 HD2 ARG 16 -5.617 1.429 5.430
127 HD3 ARG 16 HD3 ARG 16 -5.489 2.207 7.008
128 HE ARG 16 HE ARG 16 -4.418 3.807 4.890
129 HH11 ARG 16 HH11 ARG 16 -7.341 2.874 6.534
130 HH12 ARG 16 HH12 ARG 16 -8.195 4.322 6.113
131 HH21 ARG 16 HH21 ARG 16 -5.531 5.718 4.329
132 HH22 ARG 16 HH22 ARG 16 -7.165 5.938 4.858
133 H ARG 17 H ARG 17 0.645 0.237 5.764
134 HA ARG 17 HA ARG 17 1.441 2.983 5.366
135 HB2 ARG 17 HB2 ARG 17 0.710 1.928 8.029
136 HB3 ARG 17 HB3 ARG 17 2.230 2.809 7.952
137 HG2 ARG 17 HG2 ARG 17 1.016 4.707 6.913
138 HG3 ARG 17 HG3 ARG 17 -0.491 3.824 7.165
139 HD2 ARG 17 HD2 ARG 17 -0.424 4.090 9.444
140 HD3 ARG 17 HD3 ARG 17 1.333 4.231 9.482
141 HE ARG 17 HE ARG 17 0.458 6.459 8.142
142 HH11 ARG 17 HH11 ARG 17 -0.090 5.046 11.276
143 HH12 ARG 17 HH12 ARG 17 -0.371 6.567 12.057
144 HH21 ARG 17 HH21 ARG 17 0.090 8.467 9.159
145 HH22 ARG 17 HH22 ARG 17 -0.269 8.512 10.851
146 H VAL 18 H VAL 18 3.745 3.242 6.478
147 HA VAL 18 HA VAL 18 5.350 1.108 5.353
148 HB VAL 18 HB VAL 18 5.959 3.460 4.944
149 HG11 VAL 18 HG11 VAL 18 6.635 3.561 7.882
150 HG12 VAL 18 HG12 VAL 18 6.859 4.851 6.699
151 HG13 VAL 18 HG13 VAL 18 5.232 4.332 7.142
152 HG21 VAL 18 HG21 VAL 18 8.224 2.490 6.581
153 HG22 VAL 18 HG22 VAL 18 7.621 1.399 5.333
154 HG23 VAL 18 HG23 VAL 18 8.183 3.013 4.897
155 H ARG 19 H ARG 19 4.431 2.307 8.491
156 HA ARG 19 HA ARG 19 5.880 0.073 9.720
157 HB2 ARG 19 HB2 ARG 19 6.007 2.969 10.516
158 HB3 ARG 19 HB3 ARG 19 6.293 1.693 11.692
159 HG2 ARG 19 HG2 ARG 19 8.230 0.970 10.618
160 HG3 ARG 19 HG3 ARG 19 7.811 1.792 9.113
161 HD2 ARG 19 HD2 ARG 19 8.067 3.963 10.316
162 HD3 ARG 19 HD3 ARG 19 8.659 3.063 11.712
163 HE ARG 19 HE ARG 19 10.101 3.674 9.309
164 HH11 ARG 19 HH11 ARG 19 9.822 1.456 11.978
165 HH12 ARG 19 HH12 ARG 19 11.473 0.937 11.888
166 HH21 ARG 19 HH21 ARG 19 12.276 2.998 9.180
167 HH22 ARG 19 HH22 ARG 19 12.868 1.815 10.297
168 H GLU 20 H GLU 20 3.655 -0.792 9.555
169 HA GLU 20 HA GLU 20 2.093 0.004 11.913
170 HB2 GLU 20 HB2 GLU 20 1.252 0.554 9.377
171 HB3 GLU 20 HB3 GLU 20 0.524 -1.024 9.643
172 HG2 GLU 20 HG2 GLU 20 0.205 1.320 11.501
173 HG3 GLU 20 HG3 GLU 20 -0.939 0.890 10.231
174 H SER 21 H SER 21 1.931 -1.642 13.268
175 HA SER 21 HA SER 21 1.928 -4.377 12.168
176 HB2 SER 21 HB2 SER 21 3.923 -3.539 13.635
177 HB3 SER 21 HB3 SER 21 2.801 -3.772 14.976
178 HG SER 21 HG SER 21 4.243 -5.602 13.704
179 HA PRO 22 HA PRO 22 -2.125 -3.638 14.317
180 HB2 PRO 22 HB2 PRO 22 -3.634 -4.768 12.364
181 HB3 PRO 22 HB3 PRO 22 -3.155 -3.067 12.345
182 HG2 PRO 22 HG2 PRO 22 -1.951 -5.390 10.891
183 HG3 PRO 22 HG3 PRO 22 -2.292 -3.754 10.298
184 HD2 PRO 22 HD2 PRO 22 0.186 -4.542 11.055
185 HD3 PRO 22 HD3 PRO 22 -0.389 -2.874 11.256
186 H LEU 23 H LEU 23 -0.763 -5.403 15.531
187 HA LEU 23 HA LEU 23 -0.943 -8.102 15.013
188 HB2 LEU 23 HB2 LEU 23 0.362 -7.079 16.840
189 HB3 LEU 23 HB3 LEU 23 -1.137 -6.784 17.717
190 HG LEU 23 HG LEU 23 -1.471 -9.096 18.109
191 HD11 LEU 23 HD11 LEU 23 -0.988 -10.422 16.368
192 HD12 LEU 23 HD12 LEU 23 0.599 -10.553 17.126
193 HD13 LEU 23 HD13 LEU 23 0.338 -9.395 15.821
194 HD21 LEU 23 HD21 LEU 23 1.011 -7.814 18.817
195 HD22 LEU 23 HD22 LEU 23 1.212 -9.564 18.721
196 HD23 LEU 23 HD23 LEU 23 -0.021 -8.874 19.778
197 H SER 24 H SER 24 -3.105 -6.362 17.259
198 HA SER 24 HA SER 24 -5.190 -8.344 16.625
199 HB2 SER 24 HB2 SER 24 -6.108 -7.970 18.826
200 HB3 SER 24 HB3 SER 24 -4.383 -8.288 18.999
201 HG SER 24 HG SER 24 -4.981 -6.504 20.252
202 H SER 25 H SER 25 -4.529 -5.825 15.193
203 HA SER 25 HA SER 25 -6.707 -4.023 15.788
204 HB2 SER 25 HB2 SER 25 -4.283 -3.591 14.706
205 HB3 SER 25 HB3 SER 25 -5.224 -3.775 13.226
206 HG SER 25 HG SER 25 -6.255 -1.963 13.638
207 H ASP 26 H ASP 26 -6.065 -6.658 13.622
208 HA ASP 26 HA ASP 26 -8.370 -6.068 11.952
209 HB2 ASP 26 HB2 ASP 26 -6.486 -8.435 11.897
210 HB3 ASP 26 HB3 ASP 26 -7.700 -8.051 10.680
211 H ALA 27 H ALA 27 -7.537 -8.008 14.684
212 HA ALA 27 HA ALA 27 -9.421 -10.053 14.524
213 HB1 ALA 27 HB1 ALA 27 -7.512 -9.366 16.313
214 HB2 ALA 27 HB2 ALA 27 -8.972 -8.959 17.215
215 HB3 ALA 27 HB3 ALA 27 -8.744 -10.595 16.599
216 H ILE 28 H ILE 28 -9.834 -6.689 15.169
217 HA ILE 28 HA ILE 28 -12.195 -6.670 16.644
218 HB ILE 28 HB ILE 28 -12.573 -4.436 15.833
219 HG12 ILE 28 HG12 ILE 28 -10.494 -5.053 13.722
220 HG13 ILE 28 HG13 ILE 28 -12.221 -4.869 13.437
221 HG21 ILE 28 HG21 ILE 28 -9.788 -3.965 15.817
222 HG22 ILE 28 HG22 ILE 28 -10.914 -3.814 17.165
223 HG23 ILE 28 HG23 ILE 28 -10.082 -5.343 16.878
224 HD11 ILE 28 HD11 ILE 28 -11.358 -2.825 12.801
225 HD12 ILE 28 HD12 ILE 28 -11.898 -2.521 14.452
226 HD13 ILE 28 HD13 ILE 28 -10.188 -2.793 14.120
227 H PHE 29 H PHE 29 -11.648 -7.290 13.254
228 HA PHE 29 HA PHE 29 -14.519 -7.278 12.704
229 HB2 PHE 29 HB2 PHE 29 -12.638 -6.286 11.169
230 HB3 PHE 29 HB3 PHE 29 -12.442 -7.958 10.655
231 HD1 PHE 29 HD1 PHE 29 -14.490 -4.984 10.470
232 HD2 PHE 29 HD2 PHE 29 -14.309 -9.135 9.546
233 HE1 PHE 29 HE1 PHE 29 -16.363 -4.712 8.897
234 HE2 PHE 29 HE2 PHE 29 -16.180 -8.870 7.971
235 HZ PHE 29 HZ PHE 29 -17.209 -6.656 7.644
236 H LYS 30 H LYS 30 -12.167 -9.407 13.731
237 HA LYS 30 HA LYS 30 -12.760 -11.760 12.321
238 HB2 LYS 30 HB2 LYS 30 -10.784 -11.497 13.768
239 HB3 LYS 30 HB3 LYS 30 -11.828 -11.459 15.183
240 HG2 LYS 30 HG2 LYS 30 -12.602 -13.756 14.569
241 HG3 LYS 30 HG3 LYS 30 -11.355 -13.772 13.319
242 HD2 LYS 30 HD2 LYS 30 -10.570 -13.078 16.108
243 HD3 LYS 30 HD3 LYS 30 -10.905 -14.768 15.721
244 HE2 LYS 30 HE2 LYS 30 -8.976 -13.019 14.200
245 HE3 LYS 30 HE3 LYS 30 -8.509 -14.123 15.493
246 HZ1 LYS 30 HZ1 LYS 30 -8.366 -15.697 13.960
247 HZ2 LYS 30 HZ2 LYS 30 -9.003 -14.687 12.763
248 HZ3 LYS 30 HZ3 LYS 30 -10.040 -15.604 13.735
249 H GLN 31 H GLN 31 -14.442 -10.108 14.861
250 HA GLN 31 HA GLN 31 -15.940 -12.117 16.016
251 HB2 GLN 31 HB2 GLN 31 -16.631 -9.253 15.387
252 HB3 GLN 31 HB3 GLN 31 -17.727 -10.307 16.270
253 HG2 GLN 31 HG2 GLN 31 -14.917 -10.023 17.212
254 HG3 GLN 31 HG3 GLN 31 -16.071 -8.728 17.530
255 HE21 GLN 31 HE21 GLN 31 -15.362 -9.506 19.756
256 HE22 GLN 31 HE22 GLN 31 -16.359 -10.709 20.493
257 H SER 32 H SER 32 -16.255 -10.673 12.859
258 HA SER 32 HA SER 32 -18.865 -11.435 12.223
259 HB2 SER 32 HB2 SER 32 -16.410 -11.004 10.527
260 HB3 SER 32 HB3 SER 32 -17.966 -11.437 9.818
261 HG SER 32 HG SER 32 -18.358 -9.380 9.914
262 H HIS 33 H HIS 33 -15.881 -13.257 12.249
263 HA HIS 33 HA HIS 33 -16.839 -15.498 10.785
264 HB2 HIS 33 HB2 HIS 33 -14.452 -15.091 11.002
265 HB3 HIS 33 HB3 HIS 33 -14.554 -15.255 12.753
266 HD1 HIS 33 HD1 HIS 33 -16.020 -17.580 10.136
267 HD2 HIS 33 HD2 HIS 33 -13.172 -17.562 13.162
268 HE1 HIS 33 HE1 HIS 33 -15.220 -19.957 10.321
Start of MODEL 17
1 H1 ASN 1 H ASN 1 -2.175 2.585 0.515
2 HA ASN 1 HA ASN 1 -3.210 -0.014 1.338
3 HB2 ASN 1 HB2 ASN 1 -3.721 1.383 -1.287
4 HB3 ASN 1 HB3 ASN 1 -4.691 0.130 -0.519
5 HD21 ASN 1 HD21 ASN 1 -5.707 0.704 1.547
6 HD22 ASN 1 HD22 ASN 1 -6.266 2.324 1.764
7 H VAL 2 H VAL 2 -1.158 -1.101 1.319
8 HA VAL 2 HA VAL 2 0.311 -1.343 -1.145
9 HB VAL 2 HB VAL 2 0.582 -3.023 1.350
10 HG11 VAL 2 HG11 VAL 2 1.625 -3.891 -0.740
11 HG12 VAL 2 HG12 VAL 2 2.604 -2.424 -0.804
12 HG13 VAL 2 HG13 VAL 2 2.779 -3.543 0.548
13 HG21 VAL 2 HG21 VAL 2 1.339 -0.252 0.792
14 HG22 VAL 2 HG22 VAL 2 1.178 -1.096 2.332
15 HG23 VAL 2 HG23 VAL 2 2.661 -1.254 1.391
16 H ASP 3 H ASP 3 -0.126 -2.693 -2.749
17 HA ASP 3 HA ASP 3 -2.252 -4.594 -2.565
18 HB2 ASP 3 HB2 ASP 3 -1.576 -3.251 -4.626
19 HB3 ASP 3 HB3 ASP 3 -0.247 -4.392 -4.810
20 H VAL 4 H VAL 4 -2.176 -6.711 -2.141
21 HA VAL 4 HA VAL 4 0.480 -7.967 -1.900
22 HB VAL 4 HB VAL 4 -0.535 -9.496 -0.245
23 HG11 VAL 4 HG11 VAL 4 -0.405 -8.019 1.570
24 HG12 VAL 4 HG12 VAL 4 0.592 -7.272 0.319
25 HG13 VAL 4 HG13 VAL 4 -1.036 -6.668 0.629
26 HG21 VAL 4 HG21 VAL 4 -2.945 -8.461 -1.251
27 HG22 VAL 4 HG22 VAL 4 -2.735 -9.645 0.039
28 HG23 VAL 4 HG23 VAL 4 -2.840 -7.928 0.426
29 H ARG 5 H ARG 5 -1.351 -7.804 -4.255
30 HA ARG 5 HA ARG 5 -2.095 -9.131 -5.947
31 HB2 ARG 5 HB2 ARG 5 0.267 -10.021 -5.570
32 HB3 ARG 5 HB3 ARG 5 -0.484 -11.348 -4.694
33 HG2 ARG 5 HG2 ARG 5 -1.818 -11.834 -6.758
34 HG3 ARG 5 HG3 ARG 5 -0.820 -10.644 -7.597
35 HD2 ARG 5 HD2 ARG 5 0.094 -13.195 -6.278
36 HD3 ARG 5 HD3 ARG 5 0.086 -12.829 -8.002
37 HE ARG 5 HE ARG 5 1.658 -10.892 -6.869
38 HH11 ARG 5 HH11 ARG 5 1.669 -14.372 -6.966
39 HH12 ARG 5 HH12 ARG 5 3.393 -14.499 -6.848
40 HH21 ARG 5 HH21 ARG 5 3.928 -11.047 -6.712
41 HH22 ARG 5 HH22 ARG 5 4.677 -12.607 -6.702
42 H TYR 6 H TYR 6 -3.879 -8.908 -3.889
43 HA TYR 6 HA TYR 6 -4.817 -11.275 -2.749
44 HB2 TYR 6 HB2 TYR 6 -7.026 -10.054 -2.621
45 HB3 TYR 6 HB3 TYR 6 -5.653 -9.200 -1.925
46 HD1 TYR 6 HD1 TYR 6 -4.952 -7.097 -2.782
47 HD2 TYR 6 HD2 TYR 6 -7.915 -9.350 -4.844
48 HE1 TYR 6 HE1 TYR 6 -5.446 -5.145 -4.194
49 HE2 TYR 6 HE2 TYR 6 -8.416 -7.405 -6.262
50 HH TYR 6 HH TYR 6 -6.927 -4.269 -5.672
51 H THR 7 H THR 7 -7.286 -11.893 -3.346
52 HA THR 7 HA THR 7 -7.528 -12.301 -6.231
53 HB THR 7 HB THR 7 -8.262 -14.744 -4.895
54 HG1 THR 7 HG1 THR 7 -6.334 -15.329 -4.018
55 HG21 THR 7 HG21 THR 7 -5.931 -14.622 -6.720
56 HG22 THR 7 HG22 THR 7 -7.471 -14.045 -7.357
57 HG23 THR 7 HG23 THR 7 -7.332 -15.692 -6.742
58 H TYR 8 H TYR 8 -8.942 -10.803 -4.043
59 HA TYR 8 HA TYR 8 -11.590 -11.271 -4.938
60 HB2 TYR 8 HB2 TYR 8 -12.570 -11.960 -2.763
61 HB3 TYR 8 HB3 TYR 8 -11.512 -13.185 -3.454
62 HD1 TYR 8 HD1 TYR 8 -12.202 -11.151 -0.595
63 HD2 TYR 8 HD2 TYR 8 -9.124 -13.336 -2.559
64 HE1 TYR 8 HE1 TYR 8 -10.916 -11.212 1.501
65 HE2 TYR 8 HE2 TYR 8 -7.830 -13.404 -0.468
66 HH TYR 8 HH TYR 8 -9.144 -12.113 2.549
67 H ARG 9 H ARG 9 -13.121 -10.143 -3.052
68 HA ARG 9 HA ARG 9 -11.878 -7.502 -2.671
69 HB2 ARG 9 HB2 ARG 9 -14.786 -8.259 -2.998
70 HB3 ARG 9 HB3 ARG 9 -14.211 -6.632 -2.658
71 HG2 ARG 9 HG2 ARG 9 -13.044 -6.559 -4.769
72 HG3 ARG 9 HG3 ARG 9 -13.488 -8.234 -5.101
73 HD2 ARG 9 HD2 ARG 9 -15.795 -7.670 -5.278
74 HD3 ARG 9 HD3 ARG 9 -15.506 -6.045 -4.657
75 HE ARG 9 HE ARG 9 -14.899 -5.392 -6.763
76 HH11 ARG 9 HH11 ARG 9 -14.842 -8.868 -6.593
77 HH12 ARG 9 HH12 ARG 9 -14.572 -9.077 -8.292
78 HH21 ARG 9 HH21 ARG 9 -14.544 -5.653 -9.001
79 HH22 ARG 9 HH22 ARG 9 -14.402 -7.248 -9.660
80 HA PRO 10 HA PRO 10 -12.389 -9.097 1.609
81 HB2 PRO 10 HB2 PRO 10 -10.189 -7.828 2.567
82 HB3 PRO 10 HB3 PRO 10 -10.117 -9.401 1.764
83 HG2 PRO 10 HG2 PRO 10 -9.545 -6.681 0.654
84 HG3 PRO 10 HG3 PRO 10 -8.651 -8.195 0.422
85 HD2 PRO 10 HD2 PRO 10 -10.373 -7.222 -1.427
86 HD3 PRO 10 HD3 PRO 10 -10.117 -8.962 -1.182
87 H SER 11 H SER 11 -12.665 -7.905 3.635
88 HA SER 11 HA SER 11 -14.277 -5.626 3.325
89 HB2 SER 11 HB2 SER 11 -14.539 -7.125 5.231
90 HB3 SER 11 HB3 SER 11 -12.926 -6.710 5.809
91 HG SER 11 HG SER 11 -14.688 -5.556 6.839
92 H VAL 12 H VAL 12 -10.998 -5.936 4.684
93 HA VAL 12 HA VAL 12 -10.374 -3.253 3.737
94 HB VAL 12 HB VAL 12 -9.345 -2.690 5.985
95 HG11 VAL 12 HG11 VAL 12 -11.600 -1.893 4.988
96 HG12 VAL 12 HG12 VAL 12 -12.319 -2.925 6.226
97 HG13 VAL 12 HG13 VAL 12 -11.260 -1.593 6.692
98 HG21 VAL 12 HG21 VAL 12 -9.656 -3.966 7.815
99 HG22 VAL 12 HG22 VAL 12 -11.290 -4.433 7.343
100 HG23 VAL 12 HG23 VAL 12 -9.898 -5.255 6.636
101 HA PRO 13 HA PRO 13 -6.421 -4.994 2.950
102 HB2 PRO 13 HB2 PRO 13 -4.829 -2.808 3.193
103 HB3 PRO 13 HB3 PRO 13 -5.924 -3.052 1.827
104 HG2 PRO 13 HG2 PRO 13 -6.302 -1.381 4.282
105 HG3 PRO 13 HG3 PRO 13 -6.686 -0.994 2.595
106 HD2 PRO 13 HD2 PRO 13 -8.565 -1.802 4.369
107 HD3 PRO 13 HD3 PRO 13 -8.657 -2.188 2.638
108 H ALA 14 H ALA 14 -4.259 -5.339 3.868
109 HA ALA 14 HA ALA 14 -4.394 -5.864 6.668
110 HB1 ALA 14 HB1 ALA 14 -3.181 -7.425 5.402
111 HB2 ALA 14 HB2 ALA 14 -2.222 -6.170 4.616
112 HB3 ALA 14 HB3 ALA 14 -1.964 -6.539 6.321
113 H HIS 15 H HIS 15 -2.866 -3.403 4.680
114 HA HIS 15 HA HIS 15 -2.627 -1.614 6.879
115 HB2 HIS 15 HB2 HIS 15 -0.163 -1.398 6.863
116 HB3 HIS 15 HB3 HIS 15 -0.689 -2.984 7.418
117 HD1 HIS 15 HD1 HIS 15 -0.691 -4.852 5.350
118 HD2 HIS 15 HD2 HIS 15 1.787 -1.536 5.002
119 HE1 HIS 15 HE1 HIS 15 1.039 -5.482 3.637
120 H ARG 16 H ARG 16 -2.612 0.440 6.162
121 HA ARG 16 HA ARG 16 -1.953 0.891 3.325
122 HB2 ARG 16 HB2 ARG 16 -3.726 2.677 3.371
123 HB3 ARG 16 HB3 ARG 16 -4.327 1.029 3.493
124 HG2 ARG 16 HG2 ARG 16 -4.974 1.277 5.679
125 HG3 ARG 16 HG3 ARG 16 -3.808 2.565 5.990
126 HD2 ARG 16 HD2 ARG 16 -6.237 2.840 4.225
127 HD3 ARG 16 HD3 ARG 16 -6.169 3.341 5.914
128 HE ARG 16 HE ARG 16 -5.109 4.743 3.665
129 HH11 ARG 16 HH11 ARG 16 -4.664 4.136 7.064
130 HH12 ARG 16 HH12 ARG 16 -3.840 5.632 7.356
131 HH21 ARG 16 HH21 ARG 16 -4.026 6.716 4.037
132 HH22 ARG 16 HH22 ARG 16 -3.479 7.099 5.634
133 H ARG 17 H ARG 17 -0.089 1.175 5.394
134 HA ARG 17 HA ARG 17 0.468 4.032 5.170
135 HB2 ARG 17 HB2 ARG 17 0.065 2.534 7.721
136 HB3 ARG 17 HB3 ARG 17 1.304 3.781 7.669
137 HG2 ARG 17 HG2 ARG 17 -1.566 4.242 6.899
138 HG3 ARG 17 HG3 ARG 17 -0.913 4.543 8.510
139 HD2 ARG 17 HD2 ARG 17 0.507 5.748 6.200
140 HD3 ARG 17 HD3 ARG 17 -1.052 6.438 6.649
141 HE ARG 17 HE ARG 17 0.511 6.175 8.960
142 HH11 ARG 17 HH11 ARG 17 0.414 8.012 6.004
143 HH12 ARG 17 HH12 ARG 17 1.208 9.393 6.683
144 HH21 ARG 17 HH21 ARG 17 1.558 7.987 9.866
145 HH22 ARG 17 HH22 ARG 17 1.859 9.378 8.880
146 H VAL 18 H VAL 18 2.756 4.422 6.235
147 HA VAL 18 HA VAL 18 4.564 2.694 4.811
148 HB VAL 18 HB VAL 18 4.911 5.140 4.901
149 HG11 VAL 18 HG11 VAL 18 5.996 4.964 7.656
150 HG12 VAL 18 HG12 VAL 18 5.268 6.330 6.808
151 HG13 VAL 18 HG13 VAL 18 4.245 5.056 7.472
152 HG21 VAL 18 HG21 VAL 18 7.250 3.884 6.278
153 HG22 VAL 18 HG22 VAL 18 6.768 3.339 4.671
154 HG23 VAL 18 HG23 VAL 18 7.224 5.023 4.931
155 H ARG 19 H ARG 19 3.553 3.148 8.114
156 HA ARG 19 HA ARG 19 5.252 0.884 8.895
157 HB2 ARG 19 HB2 ARG 19 4.912 3.463 10.434
158 HB3 ARG 19 HB3 ARG 19 5.644 2.007 11.095
159 HG2 ARG 19 HG2 ARG 19 6.704 3.259 8.592
160 HG3 ARG 19 HG3 ARG 19 7.174 3.857 10.184
161 HD2 ARG 19 HD2 ARG 19 8.825 2.321 9.886
162 HD3 ARG 19 HD3 ARG 19 7.603 1.271 10.603
163 HE ARG 19 HE ARG 19 7.365 1.340 7.774
164 HH11 ARG 19 HH11 ARG 19 9.268 -0.003 10.361
165 HH12 ARG 19 HH12 ARG 19 9.754 -1.397 9.454
166 HH21 ARG 19 HH21 ARG 19 7.998 -0.491 6.570
167 HH22 ARG 19 HH22 ARG 19 9.032 -1.673 7.298
168 H GLU 20 H GLU 20 3.055 -0.077 8.419
169 HA GLU 20 HA GLU 20 1.550 -0.196 10.926
170 HB2 GLU 20 HB2 GLU 20 0.508 0.655 8.280
171 HB3 GLU 20 HB3 GLU 20 -0.509 -0.426 9.221
172 HG2 GLU 20 HG2 GLU 20 -0.345 1.168 11.119
173 HG3 GLU 20 HG3 GLU 20 0.522 2.273 10.054
174 H SER 21 H SER 21 0.780 -2.195 11.436
175 HA SER 21 HA SER 21 0.444 -4.298 9.555
176 HB2 SER 21 HB2 SER 21 2.287 -5.760 10.454
177 HB3 SER 21 HB3 SER 21 2.846 -4.390 9.494
178 HG SER 21 HG SER 21 3.576 -3.410 11.281
179 HA PRO 22 HA PRO 22 -1.672 -4.661 13.686
180 HB2 PRO 22 HB2 PRO 22 -4.172 -4.899 12.655
181 HB3 PRO 22 HB3 PRO 22 -3.424 -3.337 13.009
182 HG2 PRO 22 HG2 PRO 22 -3.668 -4.771 10.392
183 HG3 PRO 22 HG3 PRO 22 -3.910 -3.051 10.753
184 HD2 PRO 22 HD2 PRO 22 -1.630 -4.000 9.641
185 HD3 PRO 22 HD3 PRO 22 -1.649 -2.600 10.733
186 H LEU 23 H LEU 23 -0.277 -6.725 13.122
187 HA LEU 23 HA LEU 23 -1.298 -8.945 11.848
188 HB2 LEU 23 HB2 LEU 23 0.972 -8.751 12.803
189 HB3 LEU 23 HB3 LEU 23 0.284 -8.931 14.415
190 HG LEU 23 HG LEU 23 -0.284 -11.197 14.019
191 HD11 LEU 23 HD11 LEU 23 -0.094 -10.397 11.205
192 HD12 LEU 23 HD12 LEU 23 -1.110 -11.614 11.978
193 HD13 LEU 23 HD13 LEU 23 0.563 -11.994 11.567
194 HD21 LEU 23 HD21 LEU 23 2.403 -10.242 13.574
195 HD22 LEU 23 HD22 LEU 23 2.128 -11.778 12.751
196 HD23 LEU 23 HD23 LEU 23 1.843 -11.643 14.487
197 H SER 24 H SER 24 -1.466 -8.424 15.376
198 HA SER 24 HA SER 24 -3.665 -10.311 15.558
199 HB2 SER 24 HB2 SER 24 -2.249 -8.721 17.712
200 HB3 SER 24 HB3 SER 24 -3.447 -9.983 17.996
201 HG SER 24 HG SER 24 -2.015 -11.477 17.504
202 H SER 25 H SER 25 -3.192 -6.923 15.356
203 HA SER 25 HA SER 25 -5.484 -6.015 16.724
204 HB2 SER 25 HB2 SER 25 -3.380 -4.860 15.212
205 HB3 SER 25 HB3 SER 25 -4.894 -4.296 14.505
206 HG SER 25 HG SER 25 -3.975 -3.063 16.346
207 H ASP 26 H ASP 26 -4.986 -7.260 13.498
208 HA ASP 26 HA ASP 26 -7.681 -6.548 12.664
209 HB2 ASP 26 HB2 ASP 26 -5.345 -7.852 11.281
210 HB3 ASP 26 HB3 ASP 26 -6.948 -7.823 10.552
211 H ALA 27 H ALA 27 -5.924 -9.267 13.896
212 HA ALA 27 HA ALA 27 -7.648 -11.333 13.040
213 HB1 ALA 27 HB1 ALA 27 -5.253 -11.268 14.297
214 HB2 ALA 27 HB2 ALA 27 -6.317 -11.713 15.632
215 HB3 ALA 27 HB3 ALA 27 -6.271 -12.703 14.173
216 H ILE 28 H ILE 28 -7.902 -8.963 15.535
217 HA ILE 28 HA ILE 28 -9.594 -10.216 17.355
218 HB ILE 28 HB ILE 28 -10.313 -8.020 18.051
219 HG12 ILE 28 HG12 ILE 28 -9.169 -6.111 16.524
220 HG13 ILE 28 HG13 ILE 28 -9.522 -7.308 15.283
221 HG21 ILE 28 HG21 ILE 28 -7.748 -6.990 17.635
222 HG22 ILE 28 HG22 ILE 28 -8.316 -7.924 19.018
223 HG23 ILE 28 HG23 ILE 28 -7.558 -8.743 17.652
224 HD11 ILE 28 HD11 ILE 28 -11.500 -6.274 15.191
225 HD12 ILE 28 HD12 ILE 28 -11.874 -7.237 16.622
226 HD13 ILE 28 HD13 ILE 28 -11.323 -5.571 16.799
227 H PHE 29 H PHE 29 -10.262 -8.863 14.206
228 HA PHE 29 HA PHE 29 -13.140 -9.195 14.576
229 HB2 PHE 29 HB2 PHE 29 -11.883 -7.209 13.356
230 HB3 PHE 29 HB3 PHE 29 -11.948 -8.311 11.985
231 HD1 PHE 29 HD1 PHE 29 -13.900 -6.244 14.280
232 HD2 PHE 29 HD2 PHE 29 -14.049 -8.881 10.942
233 HE1 PHE 29 HE1 PHE 29 -16.208 -5.527 13.821
234 HE2 PHE 29 HE2 PHE 29 -16.357 -8.168 10.477
235 HZ PHE 29 HZ PHE 29 -17.439 -6.488 11.917
236 H LYS 30 H LYS 30 -10.517 -10.987 13.540
237 HA LYS 30 HA LYS 30 -11.382 -12.354 11.295
238 HB2 LYS 30 HB2 LYS 30 -9.141 -12.537 12.474
239 HB3 LYS 30 HB3 LYS 30 -9.917 -13.650 13.593
240 HG2 LYS 30 HG2 LYS 30 -10.177 -14.214 10.695
241 HG3 LYS 30 HG3 LYS 30 -8.605 -14.481 11.451
242 HD2 LYS 30 HD2 LYS 30 -9.374 -16.187 12.766
243 HD3 LYS 30 HD3 LYS 30 -11.016 -15.543 12.829
244 HE2 LYS 30 HE2 LYS 30 -11.172 -16.146 10.360
245 HE3 LYS 30 HE3 LYS 30 -9.691 -17.071 10.604
246 HZ1 LYS 30 HZ1 LYS 30 -11.819 -17.571 12.513
247 HZ2 LYS 30 HZ2 LYS 30 -10.769 -18.656 11.753
248 HZ3 LYS 30 HZ3 LYS 30 -12.130 -18.080 10.930
249 H GLN 31 H GLN 31 -12.446 -12.622 14.595
250 HA GLN 31 HA GLN 31 -13.608 -15.133 14.622
251 HB2 GLN 31 HB2 GLN 31 -13.418 -13.561 16.564
252 HB3 GLN 31 HB3 GLN 31 -14.772 -12.656 15.901
253 HG2 GLN 31 HG2 GLN 31 -15.519 -14.131 17.659
254 HG3 GLN 31 HG3 GLN 31 -16.195 -14.630 16.109
255 HE21 GLN 31 HE21 GLN 31 -15.876 -16.653 15.436
256 HE22 GLN 31 HE22 GLN 31 -14.855 -17.810 16.213
257 H SER 32 H SER 32 -14.721 -12.178 13.124
258 HA SER 32 HA SER 32 -17.394 -12.722 12.703
259 HB2 SER 32 HB2 SER 32 -17.303 -11.178 10.855
260 HB3 SER 32 HB3 SER 32 -16.193 -10.599 12.098
261 HG SER 32 HG SER 32 -14.575 -11.885 10.804
262 H HIS 33 H HIS 33 -14.594 -14.090 11.142
263 HA HIS 33 HA HIS 33 -16.319 -15.563 9.274
264 HB2 HIS 33 HB2 HIS 33 -13.313 -15.220 9.261
265 HB3 HIS 33 HB3 HIS 33 -14.252 -16.079 8.043
266 HD1 HIS 33 HD1 HIS 33 -12.500 -13.721 7.213
267 HD2 HIS 33 HD2 HIS 33 -16.512 -13.366 8.234
268 HE1 HIS 33 HE1 HIS 33 -13.292 -11.608 6.103
Start of MODEL 18
1 H1 ASN 1 H ASN 1 1.300 -0.695 2.101
2 HA ASN 1 HA ASN 1 1.976 0.190 -0.434
3 HB2 ASN 1 HB2 ASN 1 3.061 -1.919 1.385
4 HB3 ASN 1 HB3 ASN 1 3.667 -1.837 -0.266
5 HD21 ASN 1 HD21 ASN 1 3.015 0.249 2.523
6 HD22 ASN 1 HD22 ASN 1 4.407 1.251 2.316
7 H VAL 2 H VAL 2 -0.610 -1.274 -0.326
8 HA VAL 2 HA VAL 2 -0.323 -3.701 -1.792
9 HB VAL 2 HB VAL 2 -2.310 -3.271 -0.431
10 HG11 VAL 2 HG11 VAL 2 -3.762 -1.535 -0.721
11 HG12 VAL 2 HG12 VAL 2 -2.275 -0.760 -1.270
12 HG13 VAL 2 HG13 VAL 2 -3.426 -1.396 -2.446
13 HG21 VAL 2 HG21 VAL 2 -2.234 -4.540 -2.805
14 HG22 VAL 2 HG22 VAL 2 -3.662 -4.487 -1.771
15 HG23 VAL 2 HG23 VAL 2 -3.511 -3.365 -3.123
16 H ASP 3 H ASP 3 -0.187 -4.047 -3.923
17 HA ASP 3 HA ASP 3 0.261 -1.846 -5.688
18 HB2 ASP 3 HB2 ASP 3 1.161 -4.362 -5.696
19 HB3 ASP 3 HB3 ASP 3 -0.212 -4.575 -6.778
20 H VAL 4 H VAL 4 -0.849 -2.094 -7.987
21 HA VAL 4 HA VAL 4 -3.759 -2.177 -7.511
22 HB VAL 4 HB VAL 4 -2.733 0.103 -7.971
23 HG11 VAL 4 HG11 VAL 4 -1.655 0.569 -9.883
24 HG12 VAL 4 HG12 VAL 4 -1.427 -1.178 -9.989
25 HG13 VAL 4 HG13 VAL 4 -2.755 -0.406 -10.857
26 HG21 VAL 4 HG21 VAL 4 -4.939 0.344 -8.294
27 HG22 VAL 4 HG22 VAL 4 -4.535 0.325 -10.011
28 HG23 VAL 4 HG23 VAL 4 -5.066 -1.156 -9.214
29 H ARG 5 H ARG 5 -1.860 -4.282 -8.488
30 HA ARG 5 HA ARG 5 -3.110 -4.770 -11.112
31 HB2 ARG 5 HB2 ARG 5 -1.054 -6.380 -11.334
32 HB3 ARG 5 HB3 ARG 5 -0.869 -4.661 -11.653
33 HG2 ARG 5 HG2 ARG 5 0.982 -5.459 -10.335
34 HG3 ARG 5 HG3 ARG 5 -0.000 -4.351 -9.375
35 HD2 ARG 5 HD2 ARG 5 0.664 -6.299 -8.066
36 HD3 ARG 5 HD3 ARG 5 -1.084 -6.247 -8.286
37 HE ARG 5 HE ARG 5 0.139 -7.827 -10.297
38 HH11 ARG 5 HH11 ARG 5 -0.764 -7.857 -6.935
39 HH12 ARG 5 HH12 ARG 5 -0.938 -9.579 -6.862
40 HH21 ARG 5 HH21 ARG 5 -0.086 -10.095 -10.214
41 HH22 ARG 5 HH22 ARG 5 -0.551 -10.851 -8.728
42 H TYR 6 H TYR 6 -4.224 -5.425 -8.515
43 HA TYR 6 HA TYR 6 -3.852 -8.039 -7.691
44 HB2 TYR 6 HB2 TYR 6 -6.238 -7.919 -6.904
45 HB3 TYR 6 HB3 TYR 6 -5.228 -6.571 -6.391
46 HD1 TYR 6 HD1 TYR 6 -5.655 -4.336 -7.163
47 HD2 TYR 6 HD2 TYR 6 -7.962 -7.596 -8.628
48 HE1 TYR 6 HE1 TYR 6 -7.275 -2.751 -8.118
49 HE2 TYR 6 HE2 TYR 6 -9.588 -6.021 -9.589
50 HH TYR 6 HH TYR 6 -9.705 -2.775 -8.774
51 H THR 7 H THR 7 -5.659 -9.768 -7.921
52 HA THR 7 HA THR 7 -6.413 -10.021 -10.757
53 HB THR 7 HB THR 7 -5.997 -12.623 -9.685
54 HG1 THR 7 HG1 THR 7 -3.852 -12.517 -9.062
55 HG21 THR 7 HG21 THR 7 -5.745 -12.471 -11.961
56 HG22 THR 7 HG22 THR 7 -4.053 -12.435 -11.464
57 HG23 THR 7 HG23 THR 7 -4.885 -10.935 -11.873
58 H TYR 8 H TYR 8 -7.738 -9.427 -8.002
59 HA TYR 8 HA TYR 8 -10.251 -10.540 -8.617
60 HB2 TYR 8 HB2 TYR 8 -10.530 -12.138 -6.820
61 HB3 TYR 8 HB3 TYR 8 -9.147 -12.611 -7.800
62 HD1 TYR 8 HD1 TYR 8 -10.302 -12.105 -4.518
63 HD2 TYR 8 HD2 TYR 8 -6.821 -11.723 -6.934
64 HE1 TYR 8 HE1 TYR 8 -8.901 -12.168 -2.498
65 HE2 TYR 8 HE2 TYR 8 -5.409 -11.786 -4.921
66 HH TYR 8 HH TYR 8 -6.697 -12.575 -1.798
67 H ARG 9 H ARG 9 -11.525 -10.569 -6.220
68 HA ARG 9 HA ARG 9 -11.069 -7.835 -5.228
69 HB2 ARG 9 HB2 ARG 9 -13.248 -8.355 -6.407
70 HB3 ARG 9 HB3 ARG 9 -13.637 -9.412 -5.056
71 HG2 ARG 9 HG2 ARG 9 -13.751 -7.613 -3.545
72 HG3 ARG 9 HG3 ARG 9 -12.966 -6.512 -4.678
73 HD2 ARG 9 HD2 ARG 9 -15.326 -6.031 -4.604
74 HD3 ARG 9 HD3 ARG 9 -14.919 -6.718 -6.176
75 HE ARG 9 HE ARG 9 -15.745 -8.777 -4.450
76 HH11 ARG 9 HH11 ARG 9 -17.023 -6.031 -6.167
77 HH12 ARG 9 HH12 ARG 9 -18.611 -6.705 -6.326
78 HH21 ARG 9 HH21 ARG 9 -17.832 -9.675 -4.653
79 HH22 ARG 9 HH22 ARG 9 -19.070 -8.778 -5.464
80 HA PRO 10 HA PRO 10 -9.982 -10.522 -1.656
81 HB2 PRO 10 HB2 PRO 10 -8.055 -8.854 -0.720
82 HB3 PRO 10 HB3 PRO 10 -7.755 -10.058 -1.980
83 HG2 PRO 10 HG2 PRO 10 -8.272 -7.122 -2.250
84 HG3 PRO 10 HG3 PRO 10 -7.081 -8.130 -3.092
85 HD2 PRO 10 HD2 PRO 10 -9.422 -7.382 -4.230
86 HD3 PRO 10 HD3 PRO 10 -8.636 -8.932 -4.593
87 H SER 11 H SER 11 -10.052 -10.038 0.660
88 HA SER 11 HA SER 11 -12.216 -8.298 1.296
89 HB2 SER 11 HB2 SER 11 -10.440 -10.147 2.827
90 HB3 SER 11 HB3 SER 11 -11.357 -8.938 3.726
91 HG SER 11 HG SER 11 -12.289 -11.077 2.156
92 H VAL 12 H VAL 12 -8.788 -8.296 2.283
93 HA VAL 12 HA VAL 12 -8.755 -5.397 2.219
94 HB VAL 12 HB VAL 12 -7.753 -5.301 4.546
95 HG11 VAL 12 HG11 VAL 12 -9.827 -4.909 5.548
96 HG12 VAL 12 HG12 VAL 12 -10.130 -4.664 3.827
97 HG13 VAL 12 HG13 VAL 12 -10.624 -6.168 4.606
98 HG21 VAL 12 HG21 VAL 12 -7.515 -7.864 4.584
99 HG22 VAL 12 HG22 VAL 12 -8.034 -7.052 6.060
100 HG23 VAL 12 HG23 VAL 12 -9.218 -7.870 5.040
101 HA PRO 13 HA PRO 13 -4.581 -6.028 1.013
102 HB2 PRO 13 HB2 PRO 13 -3.429 -3.732 1.892
103 HB3 PRO 13 HB3 PRO 13 -4.517 -3.789 0.501
104 HG2 PRO 13 HG2 PRO 13 -5.098 -2.992 3.327
105 HG3 PRO 13 HG3 PRO 13 -5.625 -2.225 1.817
106 HD2 PRO 13 HD2 PRO 13 -7.232 -3.858 3.262
107 HD3 PRO 13 HD3 PRO 13 -7.326 -3.747 1.493
108 H ALA 14 H ALA 14 -2.354 -6.188 1.819
109 HA ALA 14 HA ALA 14 -2.220 -7.575 4.279
110 HB1 ALA 14 HB1 ALA 14 -0.109 -6.556 2.398
111 HB2 ALA 14 HB2 ALA 14 0.282 -7.433 3.878
112 HB3 ALA 14 HB3 ALA 14 -0.677 -8.211 2.619
113 H HIS 15 H HIS 15 -1.234 -4.313 3.313
114 HA HIS 15 HA HIS 15 -1.674 -3.186 5.838
115 HB2 HIS 15 HB2 HIS 15 0.768 -2.686 6.384
116 HB3 HIS 15 HB3 HIS 15 0.209 -4.325 6.705
117 HD1 HIS 15 HD1 HIS 15 1.306 -6.215 5.411
118 HD2 HIS 15 HD2 HIS 15 2.542 -2.447 4.172
119 HE1 HIS 15 HE1 HIS 15 3.266 -6.618 3.888
120 H ARG 16 H ARG 16 -1.988 -1.082 5.512
121 HA ARG 16 HA ARG 16 -0.927 0.109 3.051
122 HB2 ARG 16 HB2 ARG 16 -2.664 1.835 3.382
123 HB3 ARG 16 HB3 ARG 16 -3.339 0.215 3.277
124 HG2 ARG 16 HG2 ARG 16 -3.837 0.145 5.556
125 HG3 ARG 16 HG3 ARG 16 -2.757 1.492 5.923
126 HD2 ARG 16 HD2 ARG 16 -5.157 1.828 4.151
127 HD3 ARG 16 HD3 ARG 16 -5.280 1.943 5.906
128 HE ARG 16 HE ARG 16 -3.224 3.629 5.165
129 HH11 ARG 16 HH11 ARG 16 -6.634 3.333 4.531
130 HH12 ARG 16 HH12 ARG 16 -6.872 5.034 4.303
131 HH21 ARG 16 HH21 ARG 16 -3.525 5.871 4.867
132 HH22 ARG 16 HH22 ARG 16 -5.103 6.477 4.493
133 H ARG 17 H ARG 17 0.869 -0.194 5.174
134 HA ARG 17 HA ARG 17 1.781 2.496 5.462
135 HB2 ARG 17 HB2 ARG 17 0.059 1.544 7.485
136 HB3 ARG 17 HB3 ARG 17 1.681 1.513 8.163
137 HG2 ARG 17 HG2 ARG 17 1.215 3.644 8.688
138 HG3 ARG 17 HG3 ARG 17 1.697 3.948 7.018
139 HD2 ARG 17 HD2 ARG 17 -0.464 4.249 6.306
140 HD3 ARG 17 HD3 ARG 17 -1.137 3.228 7.576
141 HE ARG 17 HE ARG 17 -0.001 5.542 8.717
142 HH11 ARG 17 HH11 ARG 17 -2.727 4.517 6.809
143 HH12 ARG 17 HH12 ARG 17 -3.762 5.789 7.367
144 HH21 ARG 17 HH21 ARG 17 -1.354 7.221 9.459
145 HH22 ARG 17 HH22 ARG 17 -2.980 7.328 8.874
146 H VAL 18 H VAL 18 3.598 2.289 7.452
147 HA VAL 18 HA VAL 18 5.267 0.015 6.596
148 HB VAL 18 HB VAL 18 6.118 2.260 5.935
149 HG11 VAL 18 HG11 VAL 18 6.446 3.957 7.375
150 HG12 VAL 18 HG12 VAL 18 5.276 3.091 8.373
151 HG13 VAL 18 HG13 VAL 18 7.005 2.892 8.664
152 HG21 VAL 18 HG21 VAL 18 8.198 1.456 6.080
153 HG22 VAL 18 HG22 VAL 18 8.175 1.479 7.843
154 HG23 VAL 18 HG23 VAL 18 7.490 0.108 6.970
155 H ARG 19 H ARG 19 3.904 1.726 9.277
156 HA ARG 19 HA ARG 19 5.346 -0.039 11.144
157 HB2 ARG 19 HB2 ARG 19 4.291 2.755 11.431
158 HB3 ARG 19 HB3 ARG 19 4.505 1.740 12.851
159 HG2 ARG 19 HG2 ARG 19 6.893 1.415 12.115
160 HG3 ARG 19 HG3 ARG 19 6.605 2.684 10.923
161 HD2 ARG 19 HD2 ARG 19 6.145 3.028 13.880
162 HD3 ARG 19 HD3 ARG 19 7.652 3.454 13.069
163 HE ARG 19 HE ARG 19 5.335 4.668 11.888
164 HH11 ARG 19 HH11 ARG 19 7.741 4.943 14.389
165 HH12 ARG 19 HH12 ARG 19 7.595 6.664 14.521
166 HH21 ARG 19 HH21 ARG 19 5.133 6.934 12.053
167 HH22 ARG 19 HH22 ARG 19 6.111 7.796 13.192
168 H GLU 20 H GLU 20 3.002 -0.796 9.638
169 HA GLU 20 HA GLU 20 0.993 -0.992 11.781
170 HB2 GLU 20 HB2 GLU 20 0.793 -0.872 8.808
171 HB3 GLU 20 HB3 GLU 20 -0.416 -1.801 9.682
172 HG2 GLU 20 HG2 GLU 20 0.218 1.117 10.039
173 HG3 GLU 20 HG3 GLU 20 -1.227 0.427 9.301
174 H SER 21 H SER 21 -0.240 -3.047 11.840
175 HA SER 21 HA SER 21 0.949 -5.397 10.693
176 HB2 SER 21 HB2 SER 21 1.514 -6.459 12.868
177 HB3 SER 21 HB3 SER 21 2.523 -5.056 12.517
178 HG SER 21 HG SER 21 0.638 -3.987 13.803
179 HA PRO 22 HA PRO 22 -3.577 -5.571 11.788
180 HB2 PRO 22 HB2 PRO 22 -4.403 -6.267 9.297
181 HB3 PRO 22 HB3 PRO 22 -4.196 -4.587 9.806
182 HG2 PRO 22 HG2 PRO 22 -2.350 -6.326 8.215
183 HG3 PRO 22 HG3 PRO 22 -2.788 -4.627 7.956
184 HD2 PRO 22 HD2 PRO 22 -0.464 -5.370 9.130
185 HD3 PRO 22 HD3 PRO 22 -1.314 -3.872 9.559
186 H LEU 23 H LEU 23 -2.269 -7.471 12.860
187 HA LEU 23 HA LEU 23 -2.799 -9.981 11.431
188 HB2 LEU 23 HB2 LEU 23 -0.944 -9.220 13.652
189 HB3 LEU 23 HB3 LEU 23 -1.408 -10.904 13.416
190 HG LEU 23 HG LEU 23 0.735 -10.488 12.388
191 HD11 LEU 23 HD11 LEU 23 -1.300 -11.787 11.224
192 HD12 LEU 23 HD12 LEU 23 0.313 -11.684 10.520
193 HD13 LEU 23 HD13 LEU 23 -0.958 -10.592 9.973
194 HD21 LEU 23 HD21 LEU 23 -0.202 -7.974 11.880
195 HD22 LEU 23 HD22 LEU 23 -0.244 -8.713 10.279
196 HD23 LEU 23 HD23 LEU 23 1.265 -8.671 11.192
197 H SER 24 H SER 24 -2.892 -8.838 14.812
198 HA SER 24 HA SER 24 -5.118 -10.663 15.322
199 HB2 SER 24 HB2 SER 24 -3.675 -8.949 17.348
200 HB3 SER 24 HB3 SER 24 -4.660 -10.381 17.647
201 HG SER 24 HG SER 24 -2.563 -11.047 17.730
202 H SER 25 H SER 25 -5.580 -8.339 13.712
203 HA SER 25 HA SER 25 -6.897 -6.373 15.361
204 HB2 SER 25 HB2 SER 25 -5.759 -5.834 13.181
205 HB3 SER 25 HB3 SER 25 -7.062 -6.690 12.356
206 HG SER 25 HG SER 25 -7.637 -4.628 14.186
207 H ASP 26 H ASP 26 -7.910 -8.884 13.063
208 HA ASP 26 HA ASP 26 -10.706 -8.437 13.596
209 HB2 ASP 26 HB2 ASP 26 -9.184 -10.453 11.957
210 HB3 ASP 26 HB3 ASP 26 -10.921 -10.597 12.211
211 H ALA 27 H ALA 27 -8.186 -10.485 14.808
212 HA ALA 27 HA ALA 27 -9.688 -12.572 15.904
213 HB1 ALA 27 HB1 ALA 27 -7.043 -11.358 16.609
214 HB2 ALA 27 HB2 ALA 27 -7.736 -12.650 17.590
215 HB3 ALA 27 HB3 ALA 27 -7.393 -12.927 15.883
216 H ILE 28 H ILE 28 -9.423 -9.276 16.842
217 HA ILE 28 HA ILE 28 -10.027 -9.498 19.588
218 HB ILE 28 HB ILE 28 -10.617 -7.232 17.681
219 HG12 ILE 28 HG12 ILE 28 -8.363 -7.509 19.674
220 HG13 ILE 28 HG13 ILE 28 -8.207 -7.931 17.972
221 HG21 ILE 28 HG21 ILE 28 -10.598 -7.273 20.696
222 HG22 ILE 28 HG22 ILE 28 -10.780 -5.837 19.690
223 HG23 ILE 28 HG23 ILE 28 -12.017 -7.093 19.665
224 HD11 ILE 28 HD11 ILE 28 -8.831 -5.210 19.091
225 HD12 ILE 28 HD12 ILE 28 -7.310 -5.735 18.367
226 HD13 ILE 28 HD13 ILE 28 -8.764 -5.613 17.376
227 H PHE 29 H PHE 29 -11.980 -9.720 16.737
228 HA PHE 29 HA PHE 29 -14.458 -9.459 18.258
229 HB2 PHE 29 HB2 PHE 29 -14.242 -8.364 16.031
230 HB3 PHE 29 HB3 PHE 29 -14.079 -9.957 15.298
231 HD1 PHE 29 HD1 PHE 29 -16.351 -7.478 16.583
232 HD2 PHE 29 HD2 PHE 29 -15.993 -11.551 15.400
233 HE1 PHE 29 HE1 PHE 29 -18.800 -7.636 16.397
234 HE2 PHE 29 HE2 PHE 29 -18.441 -11.715 15.211
235 HZ PHE 29 HZ PHE 29 -19.847 -9.756 15.709
236 H LYS 30 H LYS 30 -12.409 -11.861 16.837
237 HA LYS 30 HA LYS 30 -14.407 -13.953 16.953
238 HB2 LYS 30 HB2 LYS 30 -12.909 -15.276 15.819
239 HB3 LYS 30 HB3 LYS 30 -12.360 -13.683 15.313
240 HG2 LYS 30 HG2 LYS 30 -10.667 -13.774 17.149
241 HG3 LYS 30 HG3 LYS 30 -11.145 -15.452 17.421
242 HD2 LYS 30 HD2 LYS 30 -10.570 -15.958 15.070
243 HD3 LYS 30 HD3 LYS 30 -10.012 -14.295 14.874
244 HE2 LYS 30 HE2 LYS 30 -8.034 -15.357 15.346
245 HE3 LYS 30 HE3 LYS 30 -8.539 -14.870 16.964
246 HZ1 LYS 30 HZ1 LYS 30 -9.615 -17.409 16.266
247 HZ2 LYS 30 HZ2 LYS 30 -8.658 -16.980 17.593
248 HZ3 LYS 30 HZ3 LYS 30 -7.929 -17.414 16.130
249 H GLN 31 H GLN 31 -11.965 -12.621 18.989
250 HA GLN 31 HA GLN 31 -11.579 -14.905 20.653
251 HB2 GLN 31 HB2 GLN 31 -10.878 -12.005 20.818
252 HB3 GLN 31 HB3 GLN 31 -10.781 -12.983 22.276
253 HG2 GLN 31 HG2 GLN 31 -9.316 -13.472 19.694
254 HG3 GLN 31 HG3 GLN 31 -8.627 -12.865 21.199
255 HE21 GLN 31 HE21 GLN 31 -7.841 -15.197 19.717
256 HE22 GLN 31 HE22 GLN 31 -8.061 -16.554 20.762
257 H SER 32 H SER 32 -13.886 -12.305 20.546
258 HA SER 32 HA SER 32 -14.861 -12.607 23.208
259 HB2 SER 32 HB2 SER 32 -15.220 -10.516 22.044
260 HB3 SER 32 HB3 SER 32 -16.101 -11.338 20.756
261 HG SER 32 HG SER 32 -16.883 -10.968 23.452
262 H HIS 33 H HIS 33 -15.884 -13.831 20.048
263 HA HIS 33 HA HIS 33 -18.216 -15.144 20.982
264 HB2 HIS 33 HB2 HIS 33 -16.560 -15.309 18.489
265 HB3 HIS 33 HB3 HIS 33 -17.822 -16.502 18.779
266 HD1 HIS 33 HD1 HIS 33 -17.758 -12.708 19.154
267 HD2 HIS 33 HD2 HIS 33 -19.988 -15.729 17.376
268 HE1 HIS 33 HE1 HIS 33 -19.697 -11.550 18.047
Start of MODEL 19
1 H1 ASN 1 H ASN 1 1.685 0.724 2.592
2 HA ASN 1 HA ASN 1 0.381 0.334 0.277
3 HB2 ASN 1 HB2 ASN 1 2.598 0.688 -0.905
4 HB3 ASN 1 HB3 ASN 1 2.182 1.890 0.312
5 HD21 ASN 1 HD21 ASN 1 4.476 2.348 0.271
6 HD22 ASN 1 HD22 ASN 1 5.546 1.390 1.232
7 H VAL 2 H VAL 2 0.494 -2.200 1.690
8 HA VAL 2 HA VAL 2 1.466 -3.877 -0.523
9 HB VAL 2 HB VAL 2 1.743 -4.542 2.412
10 HG11 VAL 2 HG11 VAL 2 3.035 -6.502 1.514
11 HG12 VAL 2 HG12 VAL 2 1.296 -6.551 1.221
12 HG13 VAL 2 HG13 VAL 2 2.399 -6.100 -0.080
13 HG21 VAL 2 HG21 VAL 2 4.165 -4.451 1.963
14 HG22 VAL 2 HG22 VAL 2 3.825 -3.876 0.330
15 HG23 VAL 2 HG23 VAL 2 3.379 -2.890 1.722
16 H ASP 3 H ASP 3 0.221 -5.662 -1.022
17 HA ASP 3 HA ASP 3 -1.969 -6.509 0.617
18 HB2 ASP 3 HB2 ASP 3 -3.054 -4.551 -0.256
19 HB3 ASP 3 HB3 ASP 3 -2.531 -4.927 -1.895
20 H VAL 4 H VAL 4 -2.271 -8.607 0.260
21 HA VAL 4 HA VAL 4 -1.507 -9.705 -2.368
22 HB VAL 4 HB VAL 4 0.066 -10.260 -0.449
23 HG11 VAL 4 HG11 VAL 4 -0.569 -11.620 1.288
24 HG12 VAL 4 HG12 VAL 4 -2.040 -10.672 1.062
25 HG13 VAL 4 HG13 VAL 4 -1.931 -12.304 0.400
26 HG21 VAL 4 HG21 VAL 4 -1.160 -12.054 -2.410
27 HG22 VAL 4 HG22 VAL 4 0.541 -11.726 -2.079
28 HG23 VAL 4 HG23 VAL 4 -0.344 -12.883 -1.085
29 H ARG 5 H ARG 5 -4.138 -8.848 -1.212
30 HA ARG 5 HA ARG 5 -5.539 -11.436 -1.335
31 HB2 ARG 5 HB2 ARG 5 -6.133 -8.879 0.106
32 HB3 ARG 5 HB3 ARG 5 -7.458 -9.941 -0.350
33 HG2 ARG 5 HG2 ARG 5 -6.974 -10.616 1.804
34 HG3 ARG 5 HG3 ARG 5 -6.082 -11.782 0.825
35 HD2 ARG 5 HD2 ARG 5 -4.041 -10.883 1.369
36 HD3 ARG 5 HD3 ARG 5 -4.710 -9.280 1.674
37 HE ARG 5 HE ARG 5 -4.962 -9.869 3.861
38 HH11 ARG 5 HH11 ARG 5 -4.738 -12.771 1.951
39 HH12 ARG 5 HH12 ARG 5 -4.733 -13.830 3.322
40 HH21 ARG 5 HH21 ARG 5 -4.957 -11.252 5.674
41 HH22 ARG 5 HH22 ARG 5 -4.858 -12.965 5.440
42 H TYR 6 H TYR 6 -6.512 -11.837 -3.198
43 HA TYR 6 HA TYR 6 -7.915 -9.686 -4.586
44 HB2 TYR 6 HB2 TYR 6 -6.952 -10.425 -6.772
45 HB3 TYR 6 HB3 TYR 6 -5.777 -9.677 -5.695
46 HD1 TYR 6 HD1 TYR 6 -3.988 -10.984 -4.703
47 HD2 TYR 6 HD2 TYR 6 -6.844 -12.802 -7.280
48 HE1 TYR 6 HE1 TYR 6 -2.534 -12.956 -4.912
49 HE2 TYR 6 HE2 TYR 6 -5.398 -14.780 -7.496
50 HH TYR 6 HH TYR 6 -2.649 -15.276 -5.492
51 H THR 7 H THR 7 -8.800 -11.946 -3.032
52 HA THR 7 HA THR 7 -10.193 -13.483 -5.128
53 HB THR 7 HB THR 7 -10.382 -14.956 -2.751
54 HG1 THR 7 HG1 THR 7 -8.490 -14.825 -1.792
55 HG21 THR 7 HG21 THR 7 -8.700 -15.289 -5.231
56 HG22 THR 7 HG22 THR 7 -10.278 -15.999 -4.891
57 HG23 THR 7 HG23 THR 7 -8.858 -16.534 -3.993
58 H TYR 8 H TYR 8 -10.801 -10.954 -3.479
59 HA TYR 8 HA TYR 8 -13.583 -11.348 -3.277
60 HB2 TYR 8 HB2 TYR 8 -13.915 -11.248 -0.880
61 HB3 TYR 8 HB3 TYR 8 -12.906 -12.638 -1.264
62 HD1 TYR 8 HD1 TYR 8 -13.258 -9.831 0.827
63 HD2 TYR 8 HD2 TYR 8 -10.312 -12.194 -1.133
64 HE1 TYR 8 HE1 TYR 8 -11.565 -9.032 2.422
65 HE2 TYR 8 HE2 TYR 8 -8.611 -11.403 0.458
66 HH TYR 8 HH TYR 8 -9.381 -9.787 3.321
67 H ARG 9 H ARG 9 -14.350 -9.449 -1.489
68 HA ARG 9 HA ARG 9 -13.048 -7.029 -2.545
69 HB2 ARG 9 HB2 ARG 9 -15.881 -7.719 -1.929
70 HB3 ARG 9 HB3 ARG 9 -15.371 -6.051 -1.699
71 HG2 ARG 9 HG2 ARG 9 -16.074 -5.931 -3.853
72 HG3 ARG 9 HG3 ARG 9 -14.394 -6.395 -4.131
73 HD2 ARG 9 HD2 ARG 9 -15.558 -7.864 -5.493
74 HD3 ARG 9 HD3 ARG 9 -15.298 -8.816 -4.031
75 HE ARG 9 HE ARG 9 -17.763 -7.472 -3.847
76 HH11 ARG 9 HH11 ARG 9 -16.234 -10.078 -5.576
77 HH12 ARG 9 HH12 ARG 9 -17.709 -10.951 -5.827
78 HH21 ARG 9 HH21 ARG 9 -19.712 -8.612 -4.170
79 HH22 ARG 9 HH22 ARG 9 -19.687 -10.116 -5.028
80 HA PRO 10 HA PRO 10 -12.012 -7.001 1.937
81 HB2 PRO 10 HB2 PRO 10 -9.586 -5.834 1.583
82 HB3 PRO 10 HB3 PRO 10 -9.843 -7.577 1.444
83 HG2 PRO 10 HG2 PRO 10 -9.647 -5.513 -0.715
84 HG3 PRO 10 HG3 PRO 10 -8.930 -7.133 -0.648
85 HD2 PRO 10 HD2 PRO 10 -11.179 -6.593 -2.055
86 HD3 PRO 10 HD3 PRO 10 -10.891 -8.165 -1.281
87 H SER 11 H SER 11 -12.870 -5.410 3.102
88 HA SER 11 HA SER 11 -13.506 -2.868 2.062
89 HB2 SER 11 HB2 SER 11 -13.750 -2.394 4.668
90 HB3 SER 11 HB3 SER 11 -14.907 -3.407 3.805
91 HG SER 11 HG SER 11 -13.783 -4.169 5.882
92 H VAL 12 H VAL 12 -10.970 -3.919 4.318
93 HA VAL 12 HA VAL 12 -9.324 -1.668 3.485
94 HB VAL 12 HB VAL 12 -9.985 -2.134 6.397
95 HG11 VAL 12 HG11 VAL 12 -7.647 -1.461 5.976
96 HG12 VAL 12 HG12 VAL 12 -8.236 -0.026 5.133
97 HG13 VAL 12 HG13 VAL 12 -8.562 -0.236 6.854
98 HG21 VAL 12 HG21 VAL 12 -10.790 0.025 4.463
99 HG22 VAL 12 HG22 VAL 12 -11.834 -1.025 5.421
100 HG23 VAL 12 HG23 VAL 12 -10.877 0.227 6.213
101 HA PRO 13 HA PRO 13 -6.293 -4.879 3.744
102 HB2 PRO 13 HB2 PRO 13 -4.102 -3.319 3.375
103 HB3 PRO 13 HB3 PRO 13 -5.200 -3.758 2.062
104 HG2 PRO 13 HG2 PRO 13 -5.069 -1.227 3.656
105 HG3 PRO 13 HG3 PRO 13 -5.292 -1.439 1.909
106 HD2 PRO 13 HD2 PRO 13 -7.352 -0.923 3.589
107 HD3 PRO 13 HD3 PRO 13 -7.537 -1.911 2.126
108 H ALA 14 H ALA 14 -4.359 -5.434 5.004
109 HA ALA 14 HA ALA 14 -4.695 -4.853 7.754
110 HB1 ALA 14 HB1 ALA 14 -3.239 -6.713 6.191
111 HB2 ALA 14 HB2 ALA 14 -2.106 -5.933 7.296
112 HB3 ALA 14 HB3 ALA 14 -3.542 -6.738 7.929
113 H HIS 15 H HIS 15 -2.093 -3.995 5.472
114 HA HIS 15 HA HIS 15 -1.514 -1.653 7.152
115 HB2 HIS 15 HB2 HIS 15 0.643 -3.281 5.807
116 HB3 HIS 15 HB3 HIS 15 0.844 -1.981 6.979
117 HD1 HIS 15 HD1 HIS 15 -1.082 -2.930 9.168
118 HD2 HIS 15 HD2 HIS 15 1.594 -5.419 7.191
119 HE1 HIS 15 HE1 HIS 15 -0.704 -4.876 10.716
120 H ARG 16 H ARG 16 -1.635 0.171 6.034
121 HA ARG 16 HA ARG 16 -1.114 0.081 3.135
122 HB2 ARG 16 HB2 ARG 16 -2.788 2.009 3.021
123 HB3 ARG 16 HB3 ARG 16 -3.439 0.398 3.291
124 HG2 ARG 16 HG2 ARG 16 -4.022 0.847 5.468
125 HG3 ARG 16 HG3 ARG 16 -2.826 2.135 5.633
126 HD2 ARG 16 HD2 ARG 16 -4.300 3.280 3.776
127 HD3 ARG 16 HD3 ARG 16 -5.541 2.201 4.411
128 HE ARG 16 HE ARG 16 -4.456 4.532 5.687
129 HH11 ARG 16 HH11 ARG 16 -6.007 1.457 6.201
130 HH12 ARG 16 HH12 ARG 16 -6.676 1.904 7.735
131 HH21 ARG 16 HH21 ARG 16 -5.331 5.132 7.706
132 HH22 ARG 16 HH22 ARG 16 -6.292 3.995 8.590
133 H ARG 17 H ARG 17 0.879 0.621 5.017
134 HA ARG 17 HA ARG 17 1.660 3.273 4.164
135 HB2 ARG 17 HB2 ARG 17 0.846 2.661 6.943
136 HB3 ARG 17 HB3 ARG 17 2.340 3.571 6.762
137 HG2 ARG 17 HG2 ARG 17 -0.320 4.352 5.585
138 HG3 ARG 17 HG3 ARG 17 0.383 5.017 7.061
139 HD2 ARG 17 HD2 ARG 17 2.405 5.596 5.572
140 HD3 ARG 17 HD3 ARG 17 1.299 5.334 4.225
141 HE ARG 17 HE ARG 17 1.362 7.584 5.987
142 HH11 ARG 17 HH11 ARG 17 -0.706 5.623 3.987
143 HH12 ARG 17 HH12 ARG 17 -1.869 6.881 3.729
144 HH21 ARG 17 HH21 ARG 17 -0.162 9.249 5.655
145 HH22 ARG 17 HH22 ARG 17 -1.558 8.944 4.677
146 H VAL 18 H VAL 18 3.913 3.769 5.285
147 HA VAL 18 HA VAL 18 5.622 1.580 4.537
148 HB VAL 18 HB VAL 18 6.239 3.889 3.986
149 HG11 VAL 18 HG11 VAL 18 5.339 4.578 6.422
150 HG12 VAL 18 HG12 VAL 18 7.073 4.520 6.746
151 HG13 VAL 18 HG13 VAL 18 6.447 5.574 5.478
152 HG21 VAL 18 HG21 VAL 18 8.497 3.531 5.653
153 HG22 VAL 18 HG22 VAL 18 7.908 1.930 5.208
154 HG23 VAL 18 HG23 VAL 18 8.315 3.101 3.953
155 H ARG 19 H ARG 19 4.576 3.101 7.519
156 HA ARG 19 HA ARG 19 5.913 0.950 9.011
157 HB2 ARG 19 HB2 ARG 19 5.905 3.895 9.666
158 HB3 ARG 19 HB3 ARG 19 6.286 2.656 10.854
159 HG2 ARG 19 HG2 ARG 19 8.125 1.886 9.369
160 HG3 ARG 19 HG3 ARG 19 7.789 3.265 8.321
161 HD2 ARG 19 HD2 ARG 19 8.112 4.714 10.384
162 HD3 ARG 19 HD3 ARG 19 8.772 3.276 11.162
163 HE ARG 19 HE ARG 19 10.132 3.584 8.770
164 HH11 ARG 19 HH11 ARG 19 9.688 5.366 11.727
165 HH12 ARG 19 HH12 ARG 19 11.240 6.131 11.652
166 HH21 ARG 19 HH21 ARG 19 12.179 4.585 8.660
167 HH22 ARG 19 HH22 ARG 19 12.656 5.687 9.907
168 H GLU 20 H GLU 20 3.446 0.447 8.402
169 HA GLU 20 HA GLU 20 1.620 1.543 10.385
170 HB2 GLU 20 HB2 GLU 20 1.154 0.893 7.853
171 HB3 GLU 20 HB3 GLU 20 0.837 -0.684 8.564
172 HG2 GLU 20 HG2 GLU 20 -1.248 0.332 8.488
173 HG3 GLU 20 HG3 GLU 20 -0.730 0.549 10.159
174 H SER 21 H SER 21 0.521 0.287 11.927
175 HA SER 21 HA SER 21 1.038 -2.479 12.326
176 HB2 SER 21 HB2 SER 21 2.672 -0.481 13.846
177 HB3 SER 21 HB3 SER 21 2.174 -1.973 14.644
178 HG SER 21 HG SER 21 4.243 -1.712 13.158
179 HA PRO 22 HA PRO 22 -2.695 -0.589 14.378
180 HB2 PRO 22 HB2 PRO 22 -4.490 -2.241 13.189
181 HB3 PRO 22 HB3 PRO 22 -3.947 -0.727 12.457
182 HG2 PRO 22 HG2 PRO 22 -3.040 -3.527 11.911
183 HG3 PRO 22 HG3 PRO 22 -3.386 -2.219 10.764
184 HD2 PRO 22 HD2 PRO 22 -0.867 -2.875 11.510
185 HD3 PRO 22 HD3 PRO 22 -1.339 -1.214 11.101
186 H LEU 23 H LEU 23 -4.527 -1.947 15.476
187 HA LEU 23 HA LEU 23 -3.198 -4.141 16.905
188 HB2 LEU 23 HB2 LEU 23 -5.466 -2.312 17.648
189 HB3 LEU 23 HB3 LEU 23 -5.060 -3.752 18.581
190 HG LEU 23 HG LEU 23 -4.099 -1.891 19.697
191 HD11 LEU 23 HD11 LEU 23 -1.879 -3.170 18.113
192 HD12 LEU 23 HD12 LEU 23 -2.701 -3.937 19.472
193 HD13 LEU 23 HD13 LEU 23 -1.774 -2.458 19.724
194 HD21 LEU 23 HD21 LEU 23 -3.958 -0.744 17.179
195 HD22 LEU 23 HD22 LEU 23 -2.272 -0.955 17.653
196 HD23 LEU 23 HD23 LEU 23 -3.373 -0.044 18.688
197 H SER 24 H SER 24 -6.126 -3.280 15.158
198 HA SER 24 HA SER 24 -7.229 -5.953 15.516
199 HB2 SER 24 HB2 SER 24 -8.360 -3.606 13.974
200 HB3 SER 24 HB3 SER 24 -9.214 -5.089 14.402
201 HG SER 24 HG SER 24 -9.780 -3.904 16.064
202 H SER 25 H SER 25 -4.853 -6.049 14.164
203 HA SER 25 HA SER 25 -5.340 -6.072 11.315
204 HB2 SER 25 HB2 SER 25 -3.122 -5.466 12.390
205 HB3 SER 25 HB3 SER 25 -2.928 -7.178 12.762
206 HG SER 25 HG SER 25 -1.992 -7.050 10.836
207 H ASP 26 H ASP 26 -4.807 -8.456 13.881
208 HA ASP 26 HA ASP 26 -4.939 -10.730 12.193
209 HB2 ASP 26 HB2 ASP 26 -5.072 -10.258 15.140
210 HB3 ASP 26 HB3 ASP 26 -5.580 -11.825 14.515
211 H ALA 27 H ALA 27 -7.336 -8.730 13.700
212 HA ALA 27 HA ALA 27 -9.503 -10.557 13.614
213 HB1 ALA 27 HB1 ALA 27 -9.854 -7.589 13.413
214 HB2 ALA 27 HB2 ALA 27 -10.859 -8.778 14.242
215 HB3 ALA 27 HB3 ALA 27 -9.286 -8.336 14.907
216 H ILE 28 H ILE 28 -7.984 -8.548 11.237
217 HA ILE 28 HA ILE 28 -10.007 -8.169 9.386
218 HB ILE 28 HB ILE 28 -7.104 -8.769 8.801
219 HG12 ILE 28 HG12 ILE 28 -7.343 -6.868 10.304
220 HG13 ILE 28 HG13 ILE 28 -6.875 -6.305 8.704
221 HG21 ILE 28 HG21 ILE 28 -9.206 -7.431 7.103
222 HG22 ILE 28 HG22 ILE 28 -7.498 -7.582 6.695
223 HG23 ILE 28 HG23 ILE 28 -8.504 -9.025 6.827
224 HD11 ILE 28 HD11 ILE 28 -8.577 -4.901 8.770
225 HD12 ILE 28 HD12 ILE 28 -9.674 -6.282 8.743
226 HD13 ILE 28 HD13 ILE 28 -9.150 -5.601 10.283
227 H PHE 29 H PHE 29 -8.116 -11.041 10.069
228 HA PHE 29 HA PHE 29 -9.224 -12.473 7.799
229 HB2 PHE 29 HB2 PHE 29 -6.831 -12.721 8.764
230 HB3 PHE 29 HB3 PHE 29 -7.595 -13.725 9.992
231 HD1 PHE 29 HD1 PHE 29 -6.292 -13.589 6.668
232 HD2 PHE 29 HD2 PHE 29 -8.914 -15.749 9.233
233 HE1 PHE 29 HE1 PHE 29 -6.183 -15.520 5.148
234 HE2 PHE 29 HE2 PHE 29 -8.808 -17.683 7.717
235 HZ PHE 29 HZ PHE 29 -7.441 -17.571 5.672
236 H LYS 30 H LYS 30 -9.776 -12.107 11.201
237 HA LYS 30 HA LYS 30 -11.213 -14.470 11.706
238 HB2 LYS 30 HB2 LYS 30 -10.986 -11.800 13.001
239 HB3 LYS 30 HB3 LYS 30 -12.352 -12.808 13.459
240 HG2 LYS 30 HG2 LYS 30 -9.703 -14.111 13.450
241 HG3 LYS 30 HG3 LYS 30 -9.984 -12.889 14.693
242 HD2 LYS 30 HD2 LYS 30 -10.797 -14.706 15.799
243 HD3 LYS 30 HD3 LYS 30 -12.266 -14.235 14.942
244 HE2 LYS 30 HE2 LYS 30 -11.928 -16.613 14.712
245 HE3 LYS 30 HE3 LYS 30 -11.690 -15.834 13.149
246 HZ1 LYS 30 HZ1 LYS 30 -9.581 -16.501 13.072
247 HZ2 LYS 30 HZ2 LYS 30 -9.968 -17.563 14.330
248 HZ3 LYS 30 HZ3 LYS 30 -9.271 -16.061 14.676
249 H GLN 31 H GLN 31 -12.105 -11.479 10.167
250 HA GLN 31 HA GLN 31 -14.865 -11.526 10.392
251 HB2 GLN 31 HB2 GLN 31 -13.743 -9.637 9.408
252 HB3 GLN 31 HB3 GLN 31 -13.130 -10.627 8.090
253 HG2 GLN 31 HG2 GLN 31 -15.014 -9.193 7.428
254 HG3 GLN 31 HG3 GLN 31 -15.341 -10.910 7.201
255 HE21 GLN 31 HE21 GLN 31 -17.340 -11.412 7.695
256 HE22 GLN 31 HE22 GLN 31 -18.280 -10.733 8.975
257 H SER 32 H SER 32 -12.756 -13.485 8.429
258 HA SER 32 HA SER 32 -14.614 -14.442 6.559
259 HB2 SER 32 HB2 SER 32 -12.248 -14.812 6.227
260 HB3 SER 32 HB3 SER 32 -12.144 -15.754 7.714
261 HG SER 32 HG SER 32 -12.299 -16.994 5.716
262 H HIS 33 H HIS 33 -13.609 -15.785 9.695
263 HA HIS 33 HA HIS 33 -15.986 -17.522 9.622
264 HB2 HIS 33 HB2 HIS 33 -13.434 -17.891 11.205
265 HB3 HIS 33 HB3 HIS 33 -14.807 -18.994 11.189
266 HD1 HIS 33 HD1 HIS 33 -11.625 -19.107 10.029
267 HD2 HIS 33 HD2 HIS 33 -15.257 -19.415 8.035
268 HE1 HIS 33 HE1 HIS 33 -11.116 -20.324 7.888
Start of MODEL 20
1 H1 ASN 1 H ASN 1 3.248 -6.096 2.035
2 HA ASN 1 HA ASN 1 1.155 -4.235 2.872
3 HB2 ASN 1 HB2 ASN 1 2.692 -2.552 3.609
4 HB3 ASN 1 HB3 ASN 1 3.102 -4.039 4.459
5 HD21 ASN 1 HD21 ASN 1 4.406 -1.465 3.018
6 HD22 ASN 1 HD22 ASN 1 5.907 -2.131 2.479
7 H VAL 2 H VAL 2 0.579 -2.811 1.320
8 HA VAL 2 HA VAL 2 0.378 -1.926 -0.771
9 HB VAL 2 HB VAL 2 3.397 -1.865 -0.668
10 HG11 VAL 2 HG11 VAL 2 3.357 -0.785 -2.611
11 HG12 VAL 2 HG12 VAL 2 1.653 -1.221 -2.748
12 HG13 VAL 2 HG13 VAL 2 2.114 0.325 -2.035
13 HG21 VAL 2 HG21 VAL 2 2.972 -0.602 1.160
14 HG22 VAL 2 HG22 VAL 2 2.654 0.640 -0.051
15 HG23 VAL 2 HG23 VAL 2 1.315 -0.253 0.670
16 H ASP 3 H ASP 3 -0.400 -4.048 -1.492
17 HA ASP 3 HA ASP 3 1.507 -5.428 -3.259
18 HB2 ASP 3 HB2 ASP 3 0.158 -6.631 -1.351
19 HB3 ASP 3 HB3 ASP 3 -1.153 -6.590 -2.526
20 H VAL 4 H VAL 4 0.516 -6.357 -5.268
21 HA VAL 4 HA VAL 4 -1.562 -4.578 -6.361
22 HB VAL 4 HB VAL 4 0.713 -5.604 -8.038
23 HG11 VAL 4 HG11 VAL 4 -0.458 -3.047 -8.724
24 HG12 VAL 4 HG12 VAL 4 -0.280 -4.505 -9.702
25 HG13 VAL 4 HG13 VAL 4 -1.674 -4.321 -8.636
26 HG21 VAL 4 HG21 VAL 4 0.597 -2.981 -6.551
27 HG22 VAL 4 HG22 VAL 4 1.717 -4.308 -6.240
28 HG23 VAL 4 HG23 VAL 4 1.803 -3.420 -7.761
29 H ARG 5 H ARG 5 -1.093 -7.566 -5.407
30 HA ARG 5 HA ARG 5 -2.518 -8.768 -7.691
31 HB2 ARG 5 HB2 ARG 5 -0.133 -9.605 -7.005
32 HB3 ARG 5 HB3 ARG 5 -0.997 -10.418 -5.707
33 HG2 ARG 5 HG2 ARG 5 -0.810 -12.007 -7.412
34 HG3 ARG 5 HG3 ARG 5 -2.470 -11.417 -7.518
35 HD2 ARG 5 HD2 ARG 5 -1.759 -11.436 -9.734
36 HD3 ARG 5 HD3 ARG 5 -1.545 -9.755 -9.248
37 HE ARG 5 HE ARG 5 0.712 -10.000 -9.531
38 HH11 ARG 5 HH11 ARG 5 -0.766 -13.149 -9.390
39 HH12 ARG 5 HH12 ARG 5 0.683 -13.992 -9.824
40 HH21 ARG 5 HH21 ARG 5 2.627 -11.099 -10.103
41 HH22 ARG 5 HH22 ARG 5 2.613 -12.826 -10.228
42 H TYR 6 H TYR 6 -4.603 -8.947 -7.213
43 HA TYR 6 HA TYR 6 -5.343 -9.848 -4.506
44 HB2 TYR 6 HB2 TYR 6 -7.446 -8.562 -4.771
45 HB3 TYR 6 HB3 TYR 6 -6.017 -7.534 -4.786
46 HD1 TYR 6 HD1 TYR 6 -5.426 -6.264 -6.727
47 HD2 TYR 6 HD2 TYR 6 -8.689 -8.992 -6.863
48 HE1 TYR 6 HE1 TYR 6 -6.144 -5.289 -8.868
49 HE2 TYR 6 HE2 TYR 6 -9.415 -8.025 -9.005
50 HH TYR 6 HH TYR 6 -9.039 -5.559 -10.132
51 H THR 7 H THR 7 -7.119 -11.261 -4.334
52 HA THR 7 HA THR 7 -8.060 -12.454 -6.851
53 HB THR 7 HB THR 7 -7.874 -14.461 -4.791
54 HG1 THR 7 HG1 THR 7 -6.070 -13.271 -4.063
55 HG21 THR 7 HG21 THR 7 -8.056 -15.255 -6.958
56 HG22 THR 7 HG22 THR 7 -6.328 -15.441 -6.654
57 HG23 THR 7 HG23 THR 7 -6.916 -14.072 -7.597
58 H TYR 8 H TYR 8 -9.221 -10.595 -4.807
59 HA TYR 8 HA TYR 8 -11.832 -11.651 -4.760
60 HB2 TYR 8 HB2 TYR 8 -12.150 -12.054 -2.393
61 HB3 TYR 8 HB3 TYR 8 -10.848 -13.082 -2.982
62 HD1 TYR 8 HD1 TYR 8 -11.821 -10.844 -0.449
63 HD2 TYR 8 HD2 TYR 8 -8.428 -12.082 -2.698
64 HE1 TYR 8 HE1 TYR 8 -10.343 -9.967 1.310
65 HE2 TYR 8 HE2 TYR 8 -6.940 -11.210 -0.944
66 HH TYR 8 HH TYR 8 -6.897 -10.538 1.268
67 H ARG 9 H ARG 9 -12.999 -10.326 -2.694
68 HA ARG 9 HA ARG 9 -12.310 -7.523 -3.273
69 HB2 ARG 9 HB2 ARG 9 -14.909 -8.927 -2.802
70 HB3 ARG 9 HB3 ARG 9 -14.769 -7.223 -2.389
71 HG2 ARG 9 HG2 ARG 9 -13.865 -6.953 -4.793
72 HG3 ARG 9 HG3 ARG 9 -14.599 -8.534 -5.069
73 HD2 ARG 9 HD2 ARG 9 -16.115 -6.232 -3.868
74 HD3 ARG 9 HD3 ARG 9 -16.021 -6.499 -5.608
75 HE ARG 9 HE ARG 9 -16.863 -8.855 -4.285
76 HH11 ARG 9 HH11 ARG 9 -17.977 -5.702 -5.252
77 HH12 ARG 9 HH12 ARG 9 -19.638 -6.181 -5.369
78 HH21 ARG 9 HH21 ARG 9 -19.046 -9.498 -4.435
79 HH22 ARG 9 HH22 ARG 9 -20.245 -8.340 -4.903
80 HA PRO 10 HA PRO 10 -11.255 -8.045 1.174
81 HB2 PRO 10 HB2 PRO 10 -9.175 -6.303 1.101
82 HB3 PRO 10 HB3 PRO 10 -9.018 -8.005 0.653
83 HG2 PRO 10 HG2 PRO 10 -9.337 -5.605 -1.108
84 HG3 PRO 10 HG3 PRO 10 -8.260 -7.000 -1.302
85 HD2 PRO 10 HD2 PRO 10 -10.590 -6.759 -2.660
86 HD3 PRO 10 HD3 PRO 10 -9.933 -8.331 -2.163
87 H SER 11 H SER 11 -12.447 -6.927 2.572
88 HA SER 11 HA SER 11 -13.602 -4.408 1.949
89 HB2 SER 11 HB2 SER 11 -14.716 -6.045 3.416
90 HB3 SER 11 HB3 SER 11 -13.439 -5.836 4.615
91 HG SER 11 HG SER 11 -15.447 -4.565 4.890
92 H VAL 12 H VAL 12 -11.036 -5.406 4.192
93 HA VAL 12 HA VAL 12 -9.882 -2.738 4.017
94 HB VAL 12 HB VAL 12 -10.549 -3.996 6.682
95 HG11 VAL 12 HG11 VAL 12 -9.261 -1.338 6.076
96 HG12 VAL 12 HG12 VAL 12 -9.603 -2.006 7.673
97 HG13 VAL 12 HG13 VAL 12 -8.402 -2.773 6.633
98 HG21 VAL 12 HG21 VAL 12 -11.766 -1.729 5.141
99 HG22 VAL 12 HG22 VAL 12 -12.564 -3.105 5.903
100 HG23 VAL 12 HG23 VAL 12 -11.889 -1.815 6.898
101 HA PRO 13 HA PRO 13 -6.234 -5.234 3.849
102 HB2 PRO 13 HB2 PRO 13 -4.424 -3.219 4.038
103 HB3 PRO 13 HB3 PRO 13 -5.340 -3.553 2.563
104 HG2 PRO 13 HG2 PRO 13 -5.838 -1.493 4.677
105 HG3 PRO 13 HG3 PRO 13 -5.932 -1.331 2.914
106 HD2 PRO 13 HD2 PRO 13 -8.127 -1.652 4.466
107 HD3 PRO 13 HD3 PRO 13 -8.026 -2.288 2.811
108 H ALA 14 H ALA 14 -4.283 -5.662 5.133
109 HA ALA 14 HA ALA 14 -4.867 -5.463 7.970
110 HB1 ALA 14 HB1 ALA 14 -2.807 -6.995 6.402
111 HB2 ALA 14 HB2 ALA 14 -2.849 -6.969 8.166
112 HB3 ALA 14 HB3 ALA 14 -4.214 -7.622 7.261
113 H HIS 15 H HIS 15 -2.432 -4.359 5.673
114 HA HIS 15 HA HIS 15 -1.745 -2.099 7.205
115 HB2 HIS 15 HB2 HIS 15 0.622 -2.757 7.740
116 HB3 HIS 15 HB3 HIS 15 -0.603 -3.579 8.702
117 HD1 HIS 15 HD1 HIS 15 -1.094 -6.109 8.028
118 HD2 HIS 15 HD2 HIS 15 2.276 -4.403 6.298
119 HE1 HIS 15 HE1 HIS 15 0.262 -8.038 7.154
120 H ARG 16 H ARG 16 -1.286 -0.674 5.675
121 HA ARG 16 HA ARG 16 0.316 -1.555 3.364
122 HB2 ARG 16 HB2 ARG 16 -2.072 0.288 3.431
123 HB3 ARG 16 HB3 ARG 16 -0.965 0.211 2.066
124 HG2 ARG 16 HG2 ARG 16 -1.476 -2.288 2.014
125 HG3 ARG 16 HG3 ARG 16 -2.825 -1.906 3.086
126 HD2 ARG 16 HD2 ARG 16 -2.370 -0.563 0.429
127 HD3 ARG 16 HD3 ARG 16 -3.386 -1.989 0.639
128 HE ARG 16 HE ARG 16 -4.330 -0.169 2.455
129 HH11 ARG 16 HH11 ARG 16 -3.854 -0.230 -0.993
130 HH12 ARG 16 HH12 ARG 16 -5.170 0.847 -1.325
131 HH21 ARG 16 HH21 ARG 16 -6.066 1.249 2.031
132 HH22 ARG 16 HH22 ARG 16 -6.427 1.688 0.396
133 H ARG 17 H ARG 17 1.485 -0.517 5.656
134 HA ARG 17 HA ARG 17 2.677 1.909 4.574
135 HB2 ARG 17 HB2 ARG 17 1.071 1.781 7.070
136 HB3 ARG 17 HB3 ARG 17 2.558 2.718 7.126
137 HG2 ARG 17 HG2 ARG 17 1.792 4.283 5.630
138 HG3 ARG 17 HG3 ARG 17 0.639 3.168 4.893
139 HD2 ARG 17 HD2 ARG 17 -0.817 4.437 6.095
140 HD3 ARG 17 HD3 ARG 17 -0.409 3.245 7.328
141 HE ARG 17 HE ARG 17 0.584 4.906 8.538
142 HH11 ARG 17 HH11 ARG 17 0.252 5.966 5.239
143 HH12 ARG 17 HH12 ARG 17 0.792 7.580 5.566
144 HH21 ARG 17 HH21 ARG 17 1.296 7.027 8.981
145 HH22 ARG 17 HH22 ARG 17 1.387 8.182 7.695
146 H VAL 18 H VAL 18 4.508 2.619 6.214
147 HA VAL 18 HA VAL 18 6.181 0.268 6.538
148 HB VAL 18 HB VAL 18 7.063 2.347 5.487
149 HG11 VAL 18 HG11 VAL 18 7.183 4.349 6.536
150 HG12 VAL 18 HG12 VAL 18 5.811 3.699 7.436
151 HG13 VAL 18 HG13 VAL 18 7.434 3.626 8.124
152 HG21 VAL 18 HG21 VAL 18 9.196 2.055 6.319
153 HG22 VAL 18 HG22 VAL 18 8.638 1.875 7.983
154 HG23 VAL 18 HG23 VAL 18 8.409 0.561 6.829
155 H ARG 19 H ARG 19 4.380 2.488 8.496
156 HA ARG 19 HA ARG 19 5.344 1.092 10.900
157 HB2 ARG 19 HB2 ARG 19 5.046 4.029 10.412
158 HB3 ARG 19 HB3 ARG 19 4.771 3.397 12.030
159 HG2 ARG 19 HG2 ARG 19 6.965 2.823 12.331
160 HG3 ARG 19 HG3 ARG 19 7.264 2.626 10.603
161 HD2 ARG 19 HD2 ARG 19 8.398 4.603 11.508
162 HD3 ARG 19 HD3 ARG 19 7.193 5.034 10.294
163 HE ARG 19 HE ARG 19 5.907 5.195 12.724
164 HH11 ARG 19 HH11 ARG 19 8.663 6.691 11.212
165 HH12 ARG 19 HH12 ARG 19 8.492 8.183 12.077
166 HH21 ARG 19 HH21 ARG 19 5.671 7.154 13.869
167 HH22 ARG 19 HH22 ARG 19 6.791 8.445 13.588
168 H GLU 20 H GLU 20 3.284 -0.067 9.939
169 HA GLU 20 HA GLU 20 1.037 0.864 11.570
170 HB2 GLU 20 HB2 GLU 20 0.867 1.481 9.041
171 HB3 GLU 20 HB3 GLU 20 0.504 -0.226 8.827
172 HG2 GLU 20 HG2 GLU 20 -1.582 0.768 8.988
173 HG3 GLU 20 HG3 GLU 20 -1.300 0.126 10.606
174 H SER 21 H SER 21 -0.186 -0.746 12.476
175 HA SER 21 HA SER 21 -0.114 -3.457 11.626
176 HB2 SER 21 HB2 SER 21 1.116 -4.433 13.487
177 HB3 SER 21 HB3 SER 21 2.153 -3.288 12.635
178 HG SER 21 HG SER 21 1.963 -1.870 14.280
179 HA PRO 22 HA PRO 22 -3.657 -2.111 14.311
180 HB2 PRO 22 HB2 PRO 22 -5.582 -2.940 12.585
181 HB3 PRO 22 HB3 PRO 22 -4.836 -1.340 12.496
182 HG2 PRO 22 HG2 PRO 22 -4.240 -3.800 10.898
183 HG3 PRO 22 HG3 PRO 22 -4.383 -2.119 10.352
184 HD2 PRO 22 HD2 PRO 22 -1.991 -3.318 10.766
185 HD3 PRO 22 HD3 PRO 22 -2.249 -1.583 11.038
186 H LEU 23 H LEU 23 -4.762 -3.429 15.682
187 HA LEU 23 HA LEU 23 -4.345 -6.312 15.352
188 HB2 LEU 23 HB2 LEU 23 -4.875 -4.545 17.709
189 HB3 LEU 23 HB3 LEU 23 -5.180 -6.278 17.804
190 HG LEU 23 HG LEU 23 -3.027 -5.774 18.764
191 HD11 LEU 23 HD11 LEU 23 -3.497 -7.730 16.977
192 HD12 LEU 23 HD12 LEU 23 -1.978 -7.545 17.852
193 HD13 LEU 23 HD13 LEU 23 -2.128 -6.928 16.207
194 HD21 LEU 23 HD21 LEU 23 -1.727 -4.946 16.280
195 HD22 LEU 23 HD22 LEU 23 -1.541 -4.328 17.921
196 HD23 LEU 23 HD23 LEU 23 -2.877 -3.768 16.914
197 H SER 24 H SER 24 -6.902 -4.178 16.640
198 HA SER 24 HA SER 24 -8.978 -5.994 16.619
199 HB2 SER 24 HB2 SER 24 -10.491 -4.050 16.524
200 HB3 SER 24 HB3 SER 24 -9.154 -3.770 17.640
201 HG SER 24 HG SER 24 -8.191 -2.450 16.143
202 H SER 25 H SER 25 -7.568 -4.232 13.960
203 HA SER 25 HA SER 25 -9.546 -4.383 12.041
204 HB2 SER 25 HB2 SER 25 -7.766 -4.278 10.378
205 HB3 SER 25 HB3 SER 25 -7.372 -3.227 11.738
206 HG SER 25 HG SER 25 -6.055 -4.970 12.534
207 H ASP 26 H ASP 26 -7.063 -6.819 12.788
208 HA ASP 26 HA ASP 26 -8.275 -8.730 10.982
209 HB2 ASP 26 HB2 ASP 26 -5.755 -8.457 11.478
210 HB3 ASP 26 HB3 ASP 26 -6.092 -9.351 12.958
211 H ALA 27 H ALA 27 -8.334 -7.965 14.360
212 HA ALA 27 HA ALA 27 -9.111 -10.378 15.489
213 HB1 ALA 27 HB1 ALA 27 -10.257 -7.740 16.354
214 HB2 ALA 27 HB2 ALA 27 -9.866 -9.149 17.341
215 HB3 ALA 27 HB3 ALA 27 -8.572 -8.173 16.646
216 H ILE 28 H ILE 28 -10.891 -8.199 13.463
217 HA ILE 28 HA ILE 28 -13.516 -8.771 14.087
218 HB ILE 28 HB ILE 28 -12.369 -8.385 11.320
219 HG12 ILE 28 HG12 ILE 28 -11.828 -6.554 12.887
220 HG13 ILE 28 HG13 ILE 28 -12.937 -6.031 11.624
221 HG21 ILE 28 HG21 ILE 28 -15.190 -8.049 12.328
222 HG22 ILE 28 HG22 ILE 28 -14.622 -7.655 10.707
223 HG23 ILE 28 HG23 ILE 28 -14.614 -9.329 11.261
224 HD11 ILE 28 HD11 ILE 28 -14.801 -6.214 13.174
225 HD12 ILE 28 HD12 ILE 28 -13.701 -6.762 14.440
226 HD13 ILE 28 HD13 ILE 28 -13.557 -5.128 13.793
227 H PHE 29 H PHE 29 -11.191 -10.719 12.335
228 HA PHE 29 HA PHE 29 -13.199 -12.687 11.599
229 HB2 PHE 29 HB2 PHE 29 -11.278 -12.059 10.089
230 HB3 PHE 29 HB3 PHE 29 -10.205 -12.862 11.231
231 HD1 PHE 29 HD1 PHE 29 -12.550 -13.284 8.526
232 HD2 PHE 29 HD2 PHE 29 -10.422 -15.310 11.606
233 HE1 PHE 29 HE1 PHE 29 -12.964 -15.431 7.396
234 HE2 PHE 29 HE2 PHE 29 -10.832 -17.459 10.481
235 HZ PHE 29 HZ PHE 29 -12.104 -17.521 8.373
236 H LYS 30 H LYS 30 -10.803 -12.154 14.042
237 HA LYS 30 HA LYS 30 -10.462 -14.814 14.922
238 HB2 LYS 30 HB2 LYS 30 -10.166 -12.178 16.366
239 HB3 LYS 30 HB3 LYS 30 -9.724 -13.726 17.073
240 HG2 LYS 30 HG2 LYS 30 -8.236 -14.013 14.997
241 HG3 LYS 30 HG3 LYS 30 -8.460 -12.276 14.781
242 HD2 LYS 30 HD2 LYS 30 -7.663 -11.977 17.142
243 HD3 LYS 30 HD3 LYS 30 -7.250 -13.694 17.151
244 HE2 LYS 30 HE2 LYS 30 -6.202 -11.763 15.093
245 HE3 LYS 30 HE3 LYS 30 -5.367 -12.091 16.611
246 HZ1 LYS 30 HZ1 LYS 30 -4.510 -13.455 14.812
247 HZ2 LYS 30 HZ2 LYS 30 -6.045 -14.112 14.543
248 HZ3 LYS 30 HZ3 LYS 30 -5.236 -14.422 15.996
249 H GLN 31 H GLN 31 -12.942 -12.438 15.478
250 HA GLN 31 HA GLN 31 -14.090 -13.642 17.781
251 HB2 GLN 31 HB2 GLN 31 -15.298 -11.786 15.724
252 HB3 GLN 31 HB3 GLN 31 -16.064 -12.229 17.244
253 HG2 GLN 31 HG2 GLN 31 -14.083 -11.262 18.424
254 HG3 GLN 31 HG3 GLN 31 -13.530 -10.659 16.862
255 HE21 GLN 31 HE21 GLN 31 -15.026 -9.762 19.582
256 HE22 GLN 31 HE22 GLN 31 -16.022 -8.481 18.988
257 H SER 32 H SER 32 -14.427 -14.151 14.348
258 HA SER 32 HA SER 32 -16.835 -15.675 14.488
259 HB2 SER 32 HB2 SER 32 -14.744 -15.744 12.303
260 HB3 SER 32 HB3 SER 32 -16.444 -16.192 12.167
261 HG SER 32 HG SER 32 -17.023 -14.092 12.287
262 H HIS 33 H HIS 33 -13.408 -16.554 14.102
263 HA HIS 33 HA HIS 33 -13.754 -19.327 14.048
264 HB2 HIS 33 HB2 HIS 33 -11.636 -17.809 13.644
265 HB3 HIS 33 HB3 HIS 33 -11.334 -18.141 15.347
266 HD1 HIS 33 HD1 HIS 33 -11.952 -20.074 12.132
267 HD2 HIS 33 HD2 HIS 33 -10.020 -20.471 15.788
268 HE1 HIS 33 HE1 HIS 33 -10.704 -22.253 12.000
Contact the webmaster for help, if required. Friday, May 3, 2024 3:05:47 PM GMT (wattos1)