Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
15217 | 1xrd RC | 6349 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1H MET 1 6.094 -29.476 -5.162
2 HA MET 1 HA MET 1 6.262 -32.012 -3.898
3 1HB MET 1 2HB MET 1 5.030 -29.928 -2.094
4 2HB MET 1 1HB MET 1 5.325 -31.622 -1.730
5 1HG MET 1 2HG MET 1 7.662 -31.284 -1.608
6 2HG MET 1 1HG MET 1 7.532 -29.667 -2.296
7 1HE MET 1 1HE MET 1 9.211 -29.416 -0.561
8 2HE MET 1 2HE MET 1 9.006 -29.910 1.120
9 3HE MET 1 3HE MET 1 8.683 -28.242 0.646
10 H TRP 2 H TRP 2 5.033 -32.142 -5.922
11 HA TRP 2 HA TRP 2 3.129 -32.210 -7.188
12 1HB TRP 2 2HB TRP 2 1.766 -32.724 -4.545
13 2HB TRP 2 1HB TRP 2 1.304 -33.328 -6.134
14 HD1 TRP 2 HD TRP 2 2.713 -35.386 -7.125
15 HE1 TRP 2 1HE TRP 2 4.212 -37.140 -5.983
16 HE3 TRP 2 3HE TRP 2 3.416 -33.051 -2.631
17 HZ2 TRP 2 2HZ TRP 2 5.520 -37.487 -3.506
18 HZ3 TRP 2 3HZ TRP 2 4.804 -34.162 -0.929
19 HH2 TRP 2 HH TRP 2 5.833 -36.334 -1.360
20 H ARG 3 H ARG 3 3.801 -29.559 -6.121
21 HA ARG 3 HA ARG 3 2.913 -27.474 -5.810
22 1HB ARG 3 2HB ARG 3 1.317 -28.763 -7.976
23 2HB ARG 3 1HB ARG 3 0.809 -27.185 -7.390
24 1HG ARG 3 2HG ARG 3 3.159 -26.392 -7.832
25 2HG ARG 3 1HG ARG 3 3.428 -27.925 -8.663
26 1HD ARG 3 2HD ARG 3 1.106 -27.106 -9.807
27 2HD ARG 3 1HD ARG 3 1.896 -25.560 -9.498
28 HE ARG 3 HE ARG 3 3.848 -27.018 -10.663
29 1HH1 ARG 3 1HH1 ARG 3 0.547 -26.324 -11.557
30 2HH1 ARG 3 2HH1 ARG 3 0.858 -26.415 -13.258
31 1HH2 ARG 3 1HH2 ARG 3 4.258 -27.138 -12.900
32 2HH2 ARG 3 2HH2 ARG 3 2.964 -26.878 -14.021
33 H ILE 4 H ILE 4 1.945 -29.509 -3.932
34 HA ILE 4 HA ILE 4 0.356 -29.826 -2.327
35 HB ILE 4 HB ILE 4 -0.277 -26.908 -2.766
36 1HG1 ILE 4 2HG1 ILE 4 2.163 -27.266 -2.563
37 2HG1 ILE 4 1HG1 ILE 4 1.502 -26.399 -1.180
38 1HG2 ILE 4 1HG2 ILE 4 -0.412 -27.308 -0.112
39 2HG2 ILE 4 2HG2 ILE 4 -0.894 -28.905 -0.687
40 3HG2 ILE 4 3HG2 ILE 4 -1.794 -27.476 -1.195
41 1HD1 ILE 4 1HD1 ILE 4 2.868 -27.888 -0.131
42 2HD1 ILE 4 2HD1 ILE 4 2.620 -29.143 -1.344
43 3HD1 ILE 4 3HD1 ILE 4 1.365 -28.809 -0.150
44 H TRP 5 H TRP 5 -0.552 -30.715 -4.715
45 HA TRP 5 HA TRP 5 -2.372 -30.971 -6.119
46 1HB TRP 5 2HB TRP 5 -3.745 -31.099 -3.430
47 2HB TRP 5 1HB TRP 5 -4.244 -31.907 -4.913
48 HD1 TRP 5 HD TRP 5 -0.922 -31.882 -2.877
49 HE1 TRP 5 1HE TRP 5 -0.139 -34.322 -2.631
50 HE3 TRP 5 3HE TRP 5 -4.720 -34.212 -5.386
51 HZ2 TRP 5 2HZ TRP 5 -1.015 -36.893 -3.399
52 HZ3 TRP 5 3HZ TRP 5 -4.672 -36.664 -5.585
53 HH2 TRP 5 HH TRP 5 -2.856 -37.975 -4.612
54 H GLN 6 H GLN 6 -1.850 -28.214 -5.797
55 HA GLN 6 HA GLN 6 -2.817 -26.115 -5.752
56 1HB GLN 6 2HB GLN 6 -3.034 -26.995 -8.060
57 2HB GLN 6 1HB GLN 6 -4.649 -27.570 -7.664
58 1HG GLN 6 2HG GLN 6 -5.550 -25.567 -7.987
59 2HG GLN 6 1HG GLN 6 -4.304 -24.762 -7.034
60 1HE2 GLN 6 1HE2 GLN 6 -4.852 -26.251 -10.198
61 2HE2 GLN 6 2HE2 GLN 6 -3.845 -25.159 -11.082
62 H LEU 7 H LEU 7 -3.818 -27.632 -3.567
63 HA LEU 7 HA LEU 7 -6.681 -27.196 -3.472
64 1HB LEU 7 2HB LEU 7 -4.666 -28.312 -1.540
65 2HB LEU 7 1HB LEU 7 -6.310 -27.959 -1.041
66 HG LEU 7 HG LEU 7 -5.560 -29.864 -3.259
67 1HD1 LEU 7 1HD1 LEU 7 -6.654 -30.587 -0.559
68 2HD1 LEU 7 2HD1 LEU 7 -4.922 -30.522 -0.887
69 3HD1 LEU 7 3HD1 LEU 7 -5.948 -31.644 -1.781
70 1HD2 LEU 7 1HD2 LEU 7 -8.146 -28.916 -2.113
71 2HD2 LEU 7 2HD2 LEU 7 -8.019 -30.564 -2.730
72 3HD2 LEU 7 3HD2 LEU 7 -7.696 -29.195 -3.795
73 H PHE 8 H PHE 8 -4.067 -26.251 -1.241
74 HA PHE 8 HA PHE 8 -5.151 -23.534 -1.168
75 1HB PHE 8 2HB PHE 8 -4.936 -25.421 1.148
76 2HB PHE 8 1HB PHE 8 -4.709 -23.696 1.415
77 HD1 PHE 8 1HD PHE 8 -6.543 -22.169 1.298
78 HD2 PHE 8 2HD PHE 8 -7.095 -26.291 0.396
79 HE1 PHE 8 1HE PHE 8 -8.982 -21.864 1.408
80 HE2 PHE 8 2HE PHE 8 -9.534 -25.993 0.503
81 HZ PHE 8 HZ PHE 8 -10.481 -23.777 1.010
82 H ASP 9 H ASP 9 -3.227 -23.095 -2.409
83 HA ASP 9 HA ASP 9 -1.054 -22.263 -0.776
84 1HB ASP 9 2HB ASP 9 -0.873 -24.874 -2.058
85 2HB ASP 9 1HB ASP 9 0.437 -23.801 -2.542
86 HA PRO 10 HA PRO 10 -0.103 -21.280 -5.498
87 1HB PRO 10 2HB PRO 10 -2.771 -21.989 -6.610
88 2HB PRO 10 1HB PRO 10 -1.166 -22.179 -7.324
89 1HG PRO 10 2HG PRO 10 -2.485 -24.286 -6.373
90 2HG PRO 10 1HG PRO 10 -0.731 -24.135 -6.155
91 1HD PRO 10 2HD PRO 10 -2.935 -23.676 -4.190
92 2HD PRO 10 1HD PRO 10 -1.332 -24.399 -3.941
93 H ARG 11 H ARG 11 -3.629 -21.052 -4.957
94 HA ARG 11 HA ARG 11 -3.913 -18.421 -5.828
95 1HB ARG 11 2HB ARG 11 -6.038 -18.424 -4.533
96 2HB ARG 11 1HB ARG 11 -5.842 -19.836 -5.561
97 1HG ARG 11 2HG ARG 11 -5.045 -21.088 -3.551
98 2HG ARG 11 1HG ARG 11 -5.488 -19.683 -2.579
99 1HD ARG 11 2HD ARG 11 -7.424 -21.089 -4.404
100 2HD ARG 11 1HD ARG 11 -7.202 -21.541 -2.714
101 HE ARG 11 HE ARG 11 -8.657 -19.302 -3.711
102 1HH1 ARG 11 1HH1 ARG 11 -6.712 -20.399 -1.029
103 2HH1 ARG 11 2HH1 ARG 11 -7.440 -19.312 0.105
104 1HH2 ARG 11 1HH2 ARG 11 -9.616 -17.872 -2.221
105 2HH2 ARG 11 2HH2 ARG 11 -9.089 -17.878 -0.570
106 H GLN 12 H GLN 12 -3.499 -19.642 -2.508
107 HA GLN 12 HA GLN 12 -3.564 -17.166 -1.211
108 1HB GLN 12 2HB GLN 12 -3.622 -19.517 -0.196
109 2HB GLN 12 1HB GLN 12 -1.867 -19.484 -0.308
110 1HG GLN 12 2HG GLN 12 -2.716 -18.863 1.919
111 2HG GLN 12 1HG GLN 12 -1.750 -17.595 1.164
112 1HE2 GLN 12 1HE2 GLN 12 -4.740 -18.421 2.539
113 2HE2 GLN 12 2HE2 GLN 12 -5.558 -16.927 2.251
114 H ALA 13 H ALA 13 -0.941 -18.881 -2.794
115 HA ALA 13 HA ALA 13 1.186 -17.284 -1.864
116 1HB ALA 13 1HB ALA 13 2.483 -18.250 -3.659
117 2HB ALA 13 2HB ALA 13 1.014 -18.781 -4.478
118 3HB ALA 13 3HB ALA 13 1.469 -19.495 -2.930
119 H LEU 14 H LEU 14 -0.794 -17.094 -4.811
120 HA LEU 14 HA LEU 14 0.536 -14.834 -5.884
121 1HB LEU 14 2HB LEU 14 -2.314 -15.693 -6.378
122 2HB LEU 14 1HB LEU 14 -1.335 -14.668 -7.410
123 HG LEU 14 HG LEU 14 -0.422 -17.456 -6.825
124 1HD1 LEU 14 1HD1 LEU 14 -2.903 -17.304 -7.613
125 2HD1 LEU 14 2HD1 LEU 14 -1.798 -18.445 -8.380
126 3HD1 LEU 14 3HD1 LEU 14 -2.180 -16.917 -9.174
127 1HD2 LEU 14 1HD2 LEU 14 1.209 -16.495 -8.065
128 2HD2 LEU 14 2HD2 LEU 14 0.116 -15.318 -8.793
129 3HD2 LEU 14 3HD2 LEU 14 0.152 -16.976 -9.392
130 H VAL 15 H VAL 15 -2.182 -15.248 -3.708
131 HA VAL 15 HA VAL 15 -2.994 -12.519 -3.704
132 HB VAL 15 HB VAL 15 -3.450 -14.563 -1.527
133 1HG1 VAL 15 1HG1 VAL 15 -4.246 -12.692 -0.546
134 2HG1 VAL 15 2HG1 VAL 15 -5.652 -13.024 -1.558
135 3HG1 VAL 15 3HG1 VAL 15 -4.449 -11.843 -2.079
136 1HG2 VAL 15 1HG2 VAL 15 -4.219 -14.852 -4.141
137 2HG2 VAL 15 2HG2 VAL 15 -5.628 -14.081 -3.413
138 3HG2 VAL 15 3HG2 VAL 15 -5.013 -15.596 -2.753
139 H GLY 16 H GLY 16 -0.558 -14.354 -2.033
140 1HA GLY 16 2HA GLY 16 -0.146 -12.477 0.093
141 2HA GLY 16 1HA GLY 16 0.920 -13.803 -0.349
142 H LEU 17 H LEU 17 1.604 -13.230 -2.898
143 HA LEU 17 HA LEU 17 3.596 -11.248 -2.596
144 1HB LEU 17 2HB LEU 17 2.621 -12.047 -5.305
145 2HB LEU 17 1HB LEU 17 4.258 -11.737 -4.766
146 HG LEU 17 HG LEU 17 2.965 -14.077 -3.553
147 1HD1 LEU 17 1HD1 LEU 17 3.967 -14.468 -6.318
148 2HD1 LEU 17 2HD1 LEU 17 2.313 -13.897 -6.089
149 3HD1 LEU 17 3HD1 LEU 17 2.822 -15.431 -5.384
150 1HD2 LEU 17 1HD2 LEU 17 5.596 -13.976 -4.960
151 2HD2 LEU 17 2HD2 LEU 17 5.108 -14.952 -3.575
152 3HD2 LEU 17 3HD2 LEU 17 5.397 -13.224 -3.378
153 H ALA 18 H ALA 18 0.751 -11.353 -4.668
154 HA ALA 18 HA ALA 18 0.824 -8.769 -5.659
155 1HB ALA 18 1HB ALA 18 -1.511 -9.030 -6.201
156 2HB ALA 18 2HB ALA 18 -1.671 -10.338 -5.029
157 3HB ALA 18 3HB ALA 18 -0.673 -10.558 -6.467
158 H THR 19 H THR 19 -0.885 -9.909 -2.740
159 HA THR 19 HA THR 19 -1.888 -7.346 -2.052
160 HB THR 19 HB THR 19 -1.456 -9.787 -0.321
161 HG1 THR 19 1HG THR 19 -3.800 -8.836 -1.602
162 1HG2 THR 19 1HG2 THR 19 -2.900 -7.224 0.202
163 2HG2 THR 19 2HG2 THR 19 -1.788 -8.112 1.243
164 3HG2 THR 19 3HG2 THR 19 -3.415 -8.732 0.957
165 H PHE 20 H PHE 20 1.032 -9.109 -1.184
166 HA PHE 20 HA PHE 20 1.920 -7.468 0.899
167 1HB PHE 20 2HB PHE 20 2.910 -9.658 0.413
168 2HB PHE 20 1HB PHE 20 3.567 -9.036 -1.096
169 HD1 PHE 20 1HD PHE 20 5.342 -7.292 -1.032
170 HD2 PHE 20 2HD PHE 20 4.011 -9.312 2.470
171 HE1 PHE 20 1HE PHE 20 7.383 -6.586 0.146
172 HE2 PHE 20 2HE PHE 20 6.049 -8.607 3.655
173 HZ PHE 20 HZ PHE 20 7.739 -7.243 2.493
174 H LEU 21 H LEU 21 2.787 -7.350 -2.564
175 HA LEU 21 HA LEU 21 4.364 -5.013 -2.323
176 1HB LEU 21 2HB LEU 21 4.160 -4.888 -4.793
177 2HB LEU 21 1HB LEU 21 4.695 -6.450 -4.205
178 HG LEU 21 HG LEU 21 2.072 -6.956 -4.367
179 1HD1 LEU 21 1HD1 LEU 21 0.941 -5.361 -5.418
180 2HD1 LEU 21 2HD1 LEU 21 1.867 -5.738 -6.870
181 3HD1 LEU 21 3HD1 LEU 21 2.419 -4.469 -5.777
182 1HD2 LEU 21 1HD2 LEU 21 3.485 -8.426 -5.442
183 2HD2 LEU 21 2HD2 LEU 21 4.266 -7.156 -6.382
184 3HD2 LEU 21 3HD2 LEU 21 2.638 -7.689 -6.802
185 H PHE 22 H PHE 22 1.031 -5.521 -3.435
186 HA PHE 22 HA PHE 22 0.372 -2.915 -4.085
187 1HB PHE 22 2HB PHE 22 -0.980 -5.118 -4.332
188 2HB PHE 22 1HB PHE 22 -1.615 -4.717 -2.740
189 HD1 PHE 22 1HD PHE 22 -3.670 -3.722 -2.765
190 HD2 PHE 22 2HD PHE 22 -0.948 -2.889 -5.929
191 HE1 PHE 22 1HE PHE 22 -5.336 -2.238 -3.802
192 HE2 PHE 22 2HE PHE 22 -2.609 -1.401 -6.971
193 HZ PHE 22 HZ PHE 22 -4.806 -1.075 -5.908
194 H VAL 23 H VAL 23 -0.016 -4.526 -0.926
195 HA VAL 23 HA VAL 23 -1.119 -2.294 0.383
196 HB VAL 23 HB VAL 23 -0.672 -3.462 2.449
197 1HG1 VAL 23 1HG1 VAL 23 -1.807 -4.897 0.128
198 2HG1 VAL 23 2HG1 VAL 23 -2.570 -4.407 1.640
199 3HG1 VAL 23 3HG1 VAL 23 -1.538 -5.836 1.596
200 1HG2 VAL 23 1HG2 VAL 23 0.498 -5.710 2.327
201 2HG2 VAL 23 2HG2 VAL 23 1.521 -4.276 2.233
202 3HG2 VAL 23 3HG2 VAL 23 1.123 -5.173 0.770
203 H LEU 24 H LEU 24 2.204 -3.549 0.313
204 HA LEU 24 HA LEU 24 3.413 -1.765 2.033
205 1HB LEU 24 2HB LEU 24 4.301 -3.805 0.561
206 2HB LEU 24 1HB LEU 24 4.880 -2.492 -0.446
207 HG LEU 24 HG LEU 24 6.574 -3.327 1.156
208 1HD1 LEU 24 1HD1 LEU 24 7.331 -1.159 1.878
209 2HD1 LEU 24 2HD1 LEU 24 5.708 -0.492 1.704
210 3HD1 LEU 24 3HD1 LEU 24 6.605 -1.013 0.278
211 1HD2 LEU 24 1HD2 LEU 24 4.951 -2.040 3.326
212 2HD2 LEU 24 2HD2 LEU 24 6.347 -3.108 3.472
213 3HD2 LEU 24 3HD2 LEU 24 4.793 -3.755 2.946
214 H ALA 25 H ALA 25 3.504 -1.458 -1.518
215 HA ALA 25 HA ALA 25 4.474 1.153 -1.584
216 1HB ALA 25 1HB ALA 25 2.847 -0.404 -3.577
217 2HB ALA 25 2HB ALA 25 4.590 -0.138 -3.564
218 3HB ALA 25 3HB ALA 25 3.496 1.201 -3.911
219 H LEU 26 H LEU 26 1.210 -0.051 -1.213
220 HA LEU 26 HA LEU 26 -0.172 2.342 -1.772
221 1HB LEU 26 2HB LEU 26 -0.791 -0.196 -0.357
222 2HB LEU 26 1HB LEU 26 -1.835 1.175 -0.036
223 HG LEU 26 HG LEU 26 -1.264 0.150 -2.814
224 1HD1 LEU 26 1HD1 LEU 26 -3.282 -0.686 -0.788
225 2HD1 LEU 26 2HD1 LEU 26 -2.395 -1.656 -1.964
226 3HD1 LEU 26 3HD1 LEU 26 -3.739 -0.643 -2.491
227 1HD2 LEU 26 1HD2 LEU 26 -2.064 2.270 -3.127
228 2HD2 LEU 26 2HD2 LEU 26 -3.005 2.254 -1.635
229 3HD2 LEU 26 3HD2 LEU 26 -3.581 1.373 -3.049
230 H LEU 27 H LEU 27 0.931 0.936 1.301
231 HA LEU 27 HA LEU 27 0.029 3.020 2.954
232 1HB LEU 27 2HB LEU 27 2.475 1.396 3.566
233 2HB LEU 27 1HB LEU 27 1.270 2.025 4.675
234 1HD1 LEU 27 1HD1 LEU 27 0.920 -1.595 4.780
235 2HD1 LEU 27 2HD1 LEU 27 2.193 -0.409 5.072
236 3HD1 LEU 27 3HD1 LEU 27 2.165 -1.319 3.561
237 1HD2 LEU 27 1HD2 LEU 27 -0.999 -0.657 4.644
238 2HD2 LEU 27 2HD2 LEU 27 -1.364 0.808 3.732
239 3HD2 LEU 27 3HD2 LEU 27 -0.541 0.919 5.289
240 H ILE 28 H ILE 28 3.054 2.537 1.205
241 HA ILE 28 HA ILE 28 4.501 4.648 2.378
242 HB ILE 28 HB ILE 28 4.792 3.591 -0.438
243 1HG1 ILE 28 2HG1 ILE 28 6.506 2.708 1.847
244 2HG1 ILE 28 1HG1 ILE 28 4.909 1.991 1.665
245 1HG2 ILE 28 1HG2 ILE 28 6.107 5.473 -0.422
246 2HG2 ILE 28 2HG2 ILE 28 7.252 4.267 0.167
247 3HG2 ILE 28 3HG2 ILE 28 6.450 5.351 1.303
248 1HD1 ILE 28 1HD1 ILE 28 5.581 0.702 -0.014
249 2HD1 ILE 28 2HD1 ILE 28 7.222 1.143 0.455
250 3HD1 ILE 28 3HD1 ILE 28 6.399 2.036 -0.824
251 H HIS 29 H HIS 29 2.978 4.587 -0.854
252 HA HIS 29 HA HIS 29 3.221 7.334 -1.333
253 1HB HIS 29 2HB HIS 29 1.650 5.105 -2.504
254 2HB HIS 29 1HB HIS 29 1.087 6.736 -2.854
255 HD1 HIS 29 1HD HIS 29 2.620 4.497 -4.738
256 HD2 HIS 29 2HD HIS 29 4.048 8.127 -3.307
257 HE1 HIS 29 1HE HIS 29 4.471 5.158 -6.307
258 HE2 HIS 29 2HE HIS 29 5.259 7.401 -5.473
259 H PHE 30 H PHE 30 0.655 5.480 0.186
260 HA PHE 30 HA PHE 30 -1.260 7.527 0.343
261 1HB PHE 30 2HB PHE 30 -1.795 5.143 0.650
262 2HB PHE 30 1HB PHE 30 -0.898 5.141 2.164
263 HD1 PHE 30 1HD PHE 30 -3.387 7.505 0.707
264 HD2 PHE 30 2HD PHE 30 -2.361 4.905 3.915
265 HE1 PHE 30 1HE PHE 30 -5.422 8.192 1.907
266 HE2 PHE 30 2HE PHE 30 -4.396 5.585 5.121
267 HZ PHE 30 HZ PHE 30 -5.929 7.229 4.117
268 H ILE 31 H ILE 31 1.210 6.458 2.681
269 HA ILE 31 HA ILE 31 0.423 8.308 4.679
270 HB ILE 31 HB ILE 31 2.004 6.150 4.761
271 1HG1 ILE 31 2HG1 ILE 31 2.914 7.315 6.974
272 2HG1 ILE 31 1HG1 ILE 31 1.697 8.514 6.544
273 1HG2 ILE 31 1HG2 ILE 31 4.316 6.772 5.182
274 2HG2 ILE 31 2HG2 ILE 31 3.951 8.449 4.782
275 3HG2 ILE 31 3HG2 ILE 31 3.841 7.203 3.540
276 1HD1 ILE 31 1HD1 ILE 31 1.386 5.784 7.568
277 2HD1 ILE 31 2HD1 ILE 31 0.266 6.244 6.285
278 3HD1 ILE 31 3HD1 ILE 31 0.355 7.202 7.763
279 H LEU 32 H LEU 32 3.046 8.382 2.264
280 HA LEU 32 HA LEU 32 4.041 10.908 3.059
281 1HB LEU 32 2HB LEU 32 5.204 10.926 0.895
282 2HB LEU 32 1HB LEU 32 5.414 9.413 1.753
283 HG LEU 32 HG LEU 32 3.362 8.679 0.233
284 1HD1 LEU 32 1HD1 LEU 32 3.664 11.196 -0.717
285 2HD1 LEU 32 2HD1 LEU 32 2.985 9.857 -1.643
286 3HD1 LEU 32 3HD1 LEU 32 4.684 10.291 -1.835
287 1HD2 LEU 32 1HD2 LEU 32 6.279 8.805 -0.476
288 2HD2 LEU 32 2HD2 LEU 32 5.102 7.958 -1.480
289 3HD2 LEU 32 3HD2 LEU 32 5.366 7.450 0.189
290 H LEU 33 H LEU 33 1.816 9.927 0.483
291 HA LEU 33 HA LEU 33 1.343 12.497 -0.539
292 1HB LEU 33 2HB LEU 33 -0.236 11.520 -1.890
293 2HB LEU 33 1HB LEU 33 0.733 10.130 -1.472
294 HG LEU 33 HG LEU 33 -1.015 9.707 0.375
295 1HD1 LEU 33 1HD1 LEU 33 -2.555 11.309 0.587
296 2HD1 LEU 33 2HD1 LEU 33 -3.260 10.667 -0.896
297 3HD1 LEU 33 3HD1 LEU 33 -2.142 12.029 -0.969
298 1HD2 LEU 33 1HD2 LEU 33 -1.579 9.389 -2.564
299 2HD2 LEU 33 2HD2 LEU 33 -2.533 8.615 -1.299
300 3HD2 LEU 33 3HD2 LEU 33 -0.822 8.228 -1.474
301 H SER 34 H SER 34 -0.356 10.600 1.914
302 HA SER 34 HA SER 34 -2.428 12.417 2.427
303 1HB SER 34 2HB SER 34 -2.610 10.148 3.209
304 2HB SER 34 1HB SER 34 -1.158 10.319 4.195
305 HG SER 34 HG SER 34 -2.263 11.387 5.667
306 H THR 35 H THR 35 0.599 11.883 4.250
307 HA THR 35 HA THR 35 0.218 14.010 6.046
308 HB THR 35 HB THR 35 2.874 12.902 5.128
309 HG1 THR 35 1HG THR 35 1.980 11.111 5.821
310 1HG2 THR 35 1HG2 THR 35 1.987 14.406 7.543
311 2HG2 THR 35 2HG2 THR 35 3.424 14.625 6.545
312 3HG2 THR 35 3HG2 THR 35 3.319 13.257 7.653
313 H GLU 36 H GLU 36 1.823 13.869 2.910
314 HA GLU 36 HA GLU 36 2.966 16.442 2.977
315 1HB GLU 36 2HB GLU 36 3.658 14.695 1.388
316 2HB GLU 36 1HB GLU 36 2.097 14.810 0.585
317 1HG GLU 36 2HG GLU 36 2.620 17.196 0.078
318 2HG GLU 36 1HG GLU 36 4.240 16.914 0.714
319 H ARG 37 H ARG 37 0.037 15.320 1.276
320 HA ARG 37 HA ARG 37 -0.814 17.890 0.500
321 1HB ARG 37 2HB ARG 37 -1.548 15.536 -0.336
322 2HB ARG 37 1HB ARG 37 -2.725 15.622 0.967
323 1HG ARG 37 2HG ARG 37 -3.815 16.365 -0.991
324 2HG ARG 37 1HG ARG 37 -3.502 17.799 -0.011
325 1HD ARG 37 2HD ARG 37 -2.872 18.484 -2.132
326 2HD ARG 37 1HD ARG 37 -1.339 17.996 -1.414
327 HE ARG 37 HE ARG 37 -2.785 16.647 -3.548
328 1HH1 ARG 37 1HH1 ARG 37 -0.124 16.572 -1.283
329 2HH1 ARG 37 2HH1 ARG 37 0.746 15.361 -2.161
330 1HH2 ARG 37 1HH2 ARG 37 -1.638 15.054 -4.695
331 2HH2 ARG 37 2HH2 ARG 37 -0.110 14.500 -4.094
332 H PHE 38 H PHE 38 -1.479 15.935 3.346
333 HA PHE 38 HA PHE 38 -3.578 17.461 4.412
334 1HB PHE 38 2HB PHE 38 -2.999 15.211 5.223
335 2HB PHE 38 1HB PHE 38 -1.491 15.835 5.883
336 HD1 PHE 38 1HD PHE 38 -1.414 16.664 8.050
337 HD2 PHE 38 2HD PHE 38 -5.179 16.199 6.122
338 HE1 PHE 38 1HE PHE 38 -2.557 17.189 10.165
339 HE2 PHE 38 2HE PHE 38 -6.329 16.723 8.234
340 HZ PHE 38 HZ PHE 38 -5.017 17.219 10.258
341 H ASN 39 H ASN 39 -0.210 17.414 5.597
342 HA ASN 39 HA ASN 39 -0.402 19.726 7.138
343 1HB ASN 39 2HB ASN 39 1.500 17.854 6.811
344 2HB ASN 39 1HB ASN 39 2.216 19.159 5.870
345 1HD2 ASN 39 1HD2 ASN 39 2.429 17.798 8.719
346 2HD2 ASN 39 2HD2 ASN 39 2.762 19.158 9.730
347 H TRP 40 H TRP 40 -0.165 19.367 3.750
348 HA TRP 40 HA TRP 40 1.028 21.863 3.091
349 1HB TRP 40 2HB TRP 40 0.989 20.031 1.469
350 2HB TRP 40 1HB TRP 40 -0.771 20.051 1.457
351 HD1 TRP 40 HD TRP 40 1.637 23.072 1.109
352 HE1 TRP 40 1HE TRP 40 1.096 24.264 -1.107
353 HE3 TRP 40 3HE TRP 40 -1.933 19.879 -0.683
354 HZ2 TRP 40 2HZ TRP 40 -0.618 23.900 -3.321
355 HZ3 TRP 40 3HZ TRP 40 -2.973 20.374 -2.856
356 HH2 TRP 40 HH TRP 40 -2.329 22.343 -4.147
357 H LEU 41 H LEU 41 -2.301 20.797 2.478
358 HA LEU 41 HA LEU 41 -3.345 23.420 2.360
359 1HB LEU 41 2HB LEU 41 -4.463 21.472 1.346
360 2HB LEU 41 1HB LEU 41 -4.752 20.808 2.942
361 HG LEU 41 HG LEU 41 -5.943 23.231 3.201
362 1HD1 LEU 41 1HD1 LEU 41 -5.379 23.356 0.604
363 2HD1 LEU 41 2HD1 LEU 41 -6.847 24.051 1.290
364 3HD1 LEU 41 3HD1 LEU 41 -6.903 22.473 0.505
365 1HD2 LEU 41 1HD2 LEU 41 -8.052 21.858 2.417
366 2HD2 LEU 41 2HD2 LEU 41 -7.196 21.453 3.904
367 3HD2 LEU 41 3HD2 LEU 41 -6.901 20.521 2.436
368 H GLU 42 H GLU 42 -2.381 21.393 4.921
369 HA GLU 42 HA GLU 42 -4.094 22.222 6.958
370 1HB GLU 42 2HB GLU 42 -2.656 20.277 7.214
371 2HB GLU 42 1HB GLU 42 -1.233 21.306 7.133
372 1HG GLU 42 2HG GLU 42 -1.604 20.738 9.409
373 2HG GLU 42 1HG GLU 42 -2.016 22.440 9.200
374 H GLY 43 H GLY 43 -0.833 23.334 6.097
375 1HA GLY 43 2HA GLY 43 -0.085 25.561 6.091
376 2HA GLY 43 1HA GLY 43 -1.517 26.023 6.998
377 H ALA 44 H ALA 44 1.763 25.521 7.153
378 HA ALA 44 HA ALA 44 1.919 26.156 9.905
379 1HB ALA 44 1HB ALA 44 2.637 24.166 10.897
380 2HB ALA 44 2HB ALA 44 2.905 23.379 9.341
381 3HB ALA 44 3HB ALA 44 1.262 23.677 9.907
382 H SER 45 H SER 45 3.144 27.703 8.565
383 HA SER 45 HA SER 45 5.212 28.654 8.270
384 1HB SER 45 2HB SER 45 5.977 26.630 9.823
385 2HB SER 45 1HB SER 45 6.680 26.057 8.312
386 H THR 46 H THR 46 3.426 27.421 6.253
387 HA THR 46 HA THR 46 5.292 27.576 4.032
388 HB THR 46 HB THR 46 4.822 25.505 3.071
389 HG1 THR 46 1HG THR 46 2.731 25.005 4.904
390 1HG2 THR 46 1HG2 THR 46 4.645 24.788 5.981
391 2HG2 THR 46 2HG2 THR 46 6.143 25.250 5.173
392 3HG2 THR 46 3HG2 THR 46 5.272 23.806 4.658
393 H LYS 47 H LYS 47 1.885 26.774 4.754
394 HA LYS 47 HA LYS 47 0.969 28.155 2.405
395 1HB LYS 47 2HB LYS 47 -0.104 26.265 4.242
396 2HB LYS 47 1HB LYS 47 -1.174 27.660 4.225
397 1HG LYS 47 2HG LYS 47 -0.815 27.345 1.588
398 2HG LYS 47 1HG LYS 47 -0.606 25.675 2.121
399 1HD LYS 47 2HD LYS 47 -2.897 25.847 1.698
400 2HD LYS 47 1HD LYS 47 -2.775 26.041 3.450
401 1HE LYS 47 2HE LYS 47 -4.309 27.663 2.315
402 2HE LYS 47 1HE LYS 47 -3.034 28.402 3.285
403 1HZ LYS 47 1HZ LYS 47 -3.563 29.212 0.856
404 2HZ LYS 47 2HZ LYS 47 -2.504 27.959 0.443
405 3HZ LYS 47 3HZ LYS 47 -1.981 29.208 1.458
406 HA PRO 48 HA PRO 48 -0.737 31.340 5.542
407 1HB PRO 48 2HB PRO 48 -0.294 31.031 8.176
408 2HB PRO 48 1HB PRO 48 -1.624 30.210 7.351
409 1HG PRO 48 2HG PRO 48 1.058 29.144 8.147
410 2HG PRO 48 1HG PRO 48 -0.536 28.379 8.284
411 1HD PRO 48 2HD PRO 48 1.237 27.831 6.278
412 2HD PRO 48 1HD PRO 48 -0.521 27.677 6.101
413 H VAL 49 H VAL 49 1.226 32.167 4.346
414 HA VAL 49 HA VAL 49 3.517 32.741 6.055
415 HB VAL 49 HB VAL 49 4.383 33.836 3.907
416 1HG1 VAL 49 1HG1 VAL 49 4.881 31.495 4.892
417 2HG1 VAL 49 2HG1 VAL 49 5.356 31.847 3.230
418 3HG1 VAL 49 3HG1 VAL 49 3.897 30.909 3.551
419 1HG2 VAL 49 1HG2 VAL 49 3.371 33.309 1.846
420 2HG2 VAL 49 2HG2 VAL 49 2.065 33.888 2.880
421 3HG2 VAL 49 3HG2 VAL 49 2.265 32.158 2.596
422 H GLN 50 H GLN 50 3.775 34.614 7.062
423 HA GLN 50 HA GLN 50 3.202 36.651 7.930
424 1HB GLN 50 2HB GLN 50 3.144 38.385 5.858
425 2HB GLN 50 1HB GLN 50 4.621 37.744 6.560
426 1HG GLN 50 2HG GLN 50 4.679 36.009 4.834
427 2HG GLN 50 1HG GLN 50 3.208 36.674 4.126
428 1HE2 GLN 50 1HE2 GLN 50 3.298 38.818 3.248
429 2HE2 GLN 50 2HE2 GLN 50 4.789 39.439 2.637
430 H THR 51 H THR 51 1.591 37.482 4.915
431 HA THR 51 HA THR 51 -1.046 36.986 5.941
432 HB THR 51 HB THR 51 -1.505 39.589 5.548
433 HG1 THR 51 1HG THR 51 1.101 39.554 6.658
434 1HG2 THR 51 1HG2 THR 51 -0.396 39.371 8.195
435 2HG2 THR 51 2HG2 THR 51 -1.370 37.958 7.789
436 3HG2 THR 51 3HG2 THR 51 -2.072 39.572 7.685
437 H SER 52 H SER 52 -2.300 36.511 4.266
438 HA SER 52 HA SER 52 -2.030 37.949 1.756
439 1HB SER 52 2HB SER 52 -0.566 35.700 1.945
440 2HB SER 52 1HB SER 52 -2.101 34.999 1.435
441 HG SER 52 HG SER 52 -0.880 35.545 -0.374
Start of MODEL 2
1 1H MET 1 1H MET 1 0.314 -36.338 -1.518
2 HA MET 1 HA MET 1 -0.515 -36.310 1.197
3 1HB MET 1 2HB MET 1 1.813 -37.699 1.003
4 2HB MET 1 1HB MET 1 2.431 -36.073 1.257
5 1HG MET 1 2HG MET 1 2.253 -36.679 3.417
6 2HG MET 1 1HG MET 1 0.595 -36.125 3.189
7 1HE MET 1 1HE MET 1 -0.961 -38.976 4.958
8 2HE MET 1 2HE MET 1 -1.232 -37.419 4.174
9 3HE MET 1 3HE MET 1 0.008 -37.577 5.419
10 H TRP 2 H TRP 2 1.090 -34.405 2.320
11 HA TRP 2 HA TRP 2 1.083 -32.108 2.406
12 1HB TRP 2 2HB TRP 2 2.883 -32.990 0.214
13 2HB TRP 2 1HB TRP 2 2.565 -31.263 0.342
14 HD1 TRP 2 HD TRP 2 3.409 -30.026 2.598
15 HE1 TRP 2 1HE TRP 2 5.278 -30.639 4.257
16 HE3 TRP 2 3HE TRP 2 4.069 -34.929 1.305
17 HZ2 TRP 2 2HZ TRP 2 6.828 -32.901 4.928
18 HZ3 TRP 2 3HZ TRP 2 5.765 -36.246 2.504
19 HH2 TRP 2 HH TRP 2 7.117 -35.252 4.277
20 H ARG 3 H ARG 3 -1.265 -33.119 1.089
21 HA ARG 3 HA ARG 3 -3.009 -32.458 -0.217
22 1HB ARG 3 2HB ARG 3 -1.971 -29.649 -0.118
23 2HB ARG 3 1HB ARG 3 -3.628 -30.227 -0.008
24 1HG ARG 3 2HG ARG 3 -3.334 -30.929 2.232
25 2HG ARG 3 1HG ARG 3 -1.585 -30.714 2.140
26 1HD ARG 3 2HD ARG 3 -2.268 -28.820 3.284
27 2HD ARG 3 1HD ARG 3 -2.155 -28.246 1.621
28 HE ARG 3 HE ARG 3 -4.422 -27.921 1.610
29 1HH1 ARG 3 1HH1 ARG 3 -3.574 -29.901 4.357
30 2HH1 ARG 3 2HH1 ARG 3 -5.156 -29.828 5.056
31 1HH2 ARG 3 1HH2 ARG 3 -6.503 -27.823 2.530
32 2HH2 ARG 3 2HH2 ARG 3 -6.819 -28.649 4.019
33 H ILE 4 H ILE 4 -1.353 -33.581 -1.838
34 HA ILE 4 HA ILE 4 -0.427 -33.680 -3.921
35 HB ILE 4 HB ILE 4 -2.565 -31.664 -4.597
36 1HG1 ILE 4 2HG1 ILE 4 -3.659 -34.046 -5.244
37 2HG1 ILE 4 1HG1 ILE 4 -2.700 -34.530 -3.849
38 1HG2 ILE 4 1HG2 ILE 4 -0.765 -33.397 -6.164
39 2HG2 ILE 4 2HG2 ILE 4 -1.502 -31.850 -6.582
40 3HG2 ILE 4 3HG2 ILE 4 -2.445 -33.337 -6.698
41 1HD1 ILE 4 1HD1 ILE 4 -4.813 -32.391 -3.913
42 2HD1 ILE 4 2HD1 ILE 4 -3.818 -32.796 -2.515
43 3HD1 ILE 4 3HD1 ILE 4 -4.943 -33.985 -3.171
44 H TRP 5 H TRP 5 0.669 -31.644 -2.119
45 HA TRP 5 HA TRP 5 1.875 -29.679 -2.110
46 1HB TRP 5 2HB TRP 5 3.068 -31.741 -3.565
47 2HB TRP 5 1HB TRP 5 3.325 -30.301 -4.545
48 HD1 TRP 5 HD TRP 5 5.347 -32.113 -2.431
49 HE1 TRP 5 1HE TRP 5 6.907 -30.689 -0.959
50 HE3 TRP 5 3HE TRP 5 2.940 -27.618 -2.802
51 HZ2 TRP 5 2HZ TRP 5 7.093 -28.017 -0.073
52 HZ3 TRP 5 3HZ TRP 5 3.873 -25.677 -1.611
53 HH2 TRP 5 HH TRP 5 5.907 -25.874 -0.275
54 H GLN 6 H GLN 6 -0.618 -29.343 -3.545
55 HA GLN 6 HA GLN 6 -0.074 -26.863 -4.795
56 1HB GLN 6 2HB GLN 6 -0.286 -29.256 -6.518
57 2HB GLN 6 1HB GLN 6 -1.211 -27.855 -7.036
58 1HG GLN 6 2HG GLN 6 1.137 -26.673 -6.515
59 2HG GLN 6 1HG GLN 6 1.702 -28.283 -6.956
60 1HE2 GLN 6 1HE2 GLN 6 2.699 -27.218 -8.769
61 2HE2 GLN 6 2HE2 GLN 6 1.764 -26.869 -10.179
62 H LEU 7 H LEU 7 -1.963 -28.389 -2.906
63 HA LEU 7 HA LEU 7 -4.553 -27.961 -4.120
64 1HB LEU 7 2HB LEU 7 -3.585 -28.950 -1.469
65 2HB LEU 7 1HB LEU 7 -5.251 -28.431 -1.635
66 HG LEU 7 HG LEU 7 -3.890 -30.697 -3.079
67 1HD1 LEU 7 1HD1 LEU 7 -5.863 -30.443 -0.878
68 2HD1 LEU 7 2HD1 LEU 7 -4.560 -31.610 -1.105
69 3HD1 LEU 7 3HD1 LEU 7 -6.060 -31.776 -2.015
70 1HD2 LEU 7 1HD2 LEU 7 -6.472 -29.295 -3.640
71 2HD2 LEU 7 2HD2 LEU 7 -6.301 -31.018 -3.974
72 3HD2 LEU 7 3HD2 LEU 7 -5.237 -29.856 -4.767
73 H PHE 8 H PHE 8 -2.924 -26.688 -1.220
74 HA PHE 8 HA PHE 8 -4.126 -24.069 -1.758
75 1HB PHE 8 2HB PHE 8 -4.430 -25.712 0.731
76 2HB PHE 8 1HB PHE 8 -4.415 -23.955 0.843
77 HD1 PHE 8 1HD PHE 8 -6.095 -26.732 -0.981
78 HD2 PHE 8 2HD PHE 8 -6.384 -22.782 0.577
79 HE1 PHE 8 1HE PHE 8 -8.484 -26.679 -1.567
80 HE2 PHE 8 2HE PHE 8 -8.773 -22.722 -0.006
81 HZ PHE 8 HZ PHE 8 -9.827 -24.673 -1.079
82 H ASP 9 H ASP 9 -2.000 -23.516 -2.466
83 HA ASP 9 HA ASP 9 -0.383 -22.420 -0.388
84 1HB ASP 9 2HB ASP 9 1.519 -23.975 -1.862
85 2HB ASP 9 1HB ASP 9 1.206 -23.974 -0.133
86 HA PRO 10 HA PRO 10 1.717 -21.415 -4.699
87 1HB PRO 10 2HB PRO 10 0.125 -22.290 -6.818
88 2HB PRO 10 1HB PRO 10 1.637 -23.033 -6.290
89 1HG PRO 10 2HG PRO 10 -1.176 -23.808 -5.667
90 2HG PRO 10 1HG PRO 10 0.235 -24.839 -5.968
91 1HD PRO 10 2HD PRO 10 -0.685 -24.450 -3.491
92 2HD PRO 10 1HD PRO 10 1.058 -24.554 -3.814
93 H ARG 11 H ARG 11 -1.817 -21.814 -5.059
94 HA ARG 11 HA ARG 11 -2.329 -19.390 -6.317
95 1HB ARG 11 2HB ARG 11 -3.980 -21.199 -6.129
96 2HB ARG 11 1HB ARG 11 -4.113 -20.905 -4.401
97 1HG ARG 11 2HG ARG 11 -4.792 -18.513 -5.089
98 2HG ARG 11 1HG ARG 11 -5.079 -19.226 -6.678
99 1HD ARG 11 2HD ARG 11 -7.154 -19.416 -5.688
100 2HD ARG 11 1HD ARG 11 -6.442 -20.992 -5.346
101 HE ARG 11 HE ARG 11 -6.491 -20.486 -3.118
102 1HH1 ARG 11 1HH1 ARG 11 -6.864 -17.534 -4.942
103 2HH1 ARG 11 2HH1 ARG 11 -7.203 -16.566 -3.546
104 1HH2 ARG 11 1HH2 ARG 11 -6.937 -19.216 -1.281
105 2HH2 ARG 11 2HH2 ARG 11 -7.244 -17.521 -1.467
106 H GLN 12 H GLN 12 -2.658 -20.132 -2.843
107 HA GLN 12 HA GLN 12 -3.240 -17.529 -2.004
108 1HB GLN 12 2HB GLN 12 -2.248 -20.006 -0.696
109 2HB GLN 12 1HB GLN 12 -2.045 -18.499 0.186
110 1HG GLN 12 2HG GLN 12 -4.394 -18.089 0.170
111 2HG GLN 12 1HG GLN 12 -4.674 -19.440 -0.928
112 1HE2 GLN 12 1HE2 GLN 12 -2.814 -19.047 2.070
113 2HE2 GLN 12 2HE2 GLN 12 -3.552 -20.368 2.903
114 H ALA 13 H ALA 13 -0.208 -19.089 -2.742
115 HA ALA 13 HA ALA 13 1.530 -17.277 -1.469
116 1HB ALA 13 1HB ALA 13 2.749 -19.073 -2.078
117 2HB ALA 13 2HB ALA 13 3.019 -18.138 -3.549
118 3HB ALA 13 3HB ALA 13 1.770 -19.383 -3.512
119 H LEU 14 H LEU 14 0.336 -17.408 -4.821
120 HA LEU 14 HA LEU 14 1.664 -15.063 -5.679
121 1HB LEU 14 2HB LEU 14 -0.684 -16.624 -6.714
122 2HB LEU 14 1HB LEU 14 -0.191 -15.127 -7.478
123 HG LEU 14 HG LEU 14 0.660 -17.471 -8.342
124 1HD1 LEU 14 1HD1 LEU 14 2.095 -16.296 -9.626
125 2HD1 LEU 14 2HD1 LEU 14 2.843 -15.490 -8.246
126 3HD1 LEU 14 3HD1 LEU 14 1.293 -14.922 -8.867
127 1HD2 LEU 14 1HD2 LEU 14 1.655 -18.202 -6.256
128 2HD2 LEU 14 2HD2 LEU 14 2.680 -16.769 -6.216
129 3HD2 LEU 14 3HD2 LEU 14 2.905 -17.979 -7.479
130 H VAL 15 H VAL 15 -1.470 -15.677 -4.218
131 HA VAL 15 HA VAL 15 -2.527 -13.069 -4.593
132 HB VAL 15 HB VAL 15 -3.237 -15.032 -2.406
133 1HG1 VAL 15 1HG1 VAL 15 -4.660 -12.660 -3.589
134 2HG1 VAL 15 2HG1 VAL 15 -4.169 -12.909 -1.914
135 3HG1 VAL 15 3HG1 VAL 15 -5.470 -13.879 -2.605
136 1HG2 VAL 15 1HG2 VAL 15 -4.912 -14.840 -4.828
137 2HG2 VAL 15 2HG2 VAL 15 -4.511 -16.239 -3.831
138 3HG2 VAL 15 3HG2 VAL 15 -3.354 -15.643 -5.021
139 H GLY 16 H GLY 16 -0.353 -14.514 -2.301
140 1HA GLY 16 2HA GLY 16 -0.583 -12.474 -0.301
141 2HA GLY 16 1HA GLY 16 0.679 -13.694 -0.408
142 H LEU 17 H LEU 17 1.648 -13.149 -2.956
143 HA LEU 17 HA LEU 17 3.444 -11.033 -2.430
144 1HB LEU 17 2HB LEU 17 2.993 -11.782 -5.256
145 2HB LEU 17 1HB LEU 17 4.492 -11.612 -4.368
146 HG LEU 17 HG LEU 17 2.638 -13.981 -4.383
147 1HD1 LEU 17 1HD1 LEU 17 5.523 -13.713 -5.192
148 2HD1 LEU 17 2HD1 LEU 17 4.157 -13.709 -6.307
149 3HD1 LEU 17 3HD1 LEU 17 4.506 -15.146 -5.346
150 1HD2 LEU 17 1HD2 LEU 17 3.325 -13.953 -2.168
151 2HD2 LEU 17 2HD2 LEU 17 4.902 -13.271 -2.562
152 3HD2 LEU 17 3HD2 LEU 17 4.550 -14.957 -2.943
153 H ALA 18 H ALA 18 0.970 -11.289 -4.959
154 HA ALA 18 HA ALA 18 1.042 -8.665 -5.845
155 1HB ALA 18 1HB ALA 18 -1.274 -10.591 -5.802
156 2HB ALA 18 2HB ALA 18 -0.099 -10.363 -7.098
157 3HB ALA 18 3HB ALA 18 -1.246 -9.080 -6.711
158 H THR 19 H THR 19 -1.017 -10.062 -3.299
159 HA THR 19 HA THR 19 -2.423 -7.658 -2.770
160 HB THR 19 HB THR 19 -1.984 -10.085 -1.021
161 HG1 THR 19 1HG THR 19 -4.062 -10.635 -1.778
162 1HG2 THR 19 1HG2 THR 19 -3.879 -7.780 -0.720
163 2HG2 THR 19 2HG2 THR 19 -2.721 -8.406 0.453
164 3HG2 THR 19 3HG2 THR 19 -4.149 -9.352 0.031
165 H PHE 20 H PHE 20 0.420 -9.153 -1.297
166 HA PHE 20 HA PHE 20 0.753 -7.372 0.833
167 1HB PHE 20 2HB PHE 20 1.937 -9.513 0.691
168 2HB PHE 20 1HB PHE 20 2.864 -8.919 -0.683
169 HD1 PHE 20 1HD PHE 20 4.424 -6.968 -0.326
170 HD2 PHE 20 2HD PHE 20 2.629 -9.106 2.885
171 HE1 PHE 20 1HE PHE 20 6.132 -6.086 1.211
172 HE2 PHE 20 2HE PHE 20 4.332 -8.228 4.428
173 HZ PHE 20 HZ PHE 20 6.087 -6.715 3.592
174 H LEU 21 H LEU 21 2.226 -7.311 -2.414
175 HA LEU 21 HA LEU 21 3.675 -4.926 -1.981
176 1HB LEU 21 2HB LEU 21 3.836 -4.836 -4.467
177 2HB LEU 21 1HB LEU 21 4.354 -6.354 -3.761
178 HG LEU 21 HG LEU 21 1.811 -6.999 -4.304
179 1HD1 LEU 21 1HD1 LEU 21 0.800 -5.819 -5.920
180 2HD1 LEU 21 2HD1 LEU 21 2.306 -5.538 -6.795
181 3HD1 LEU 21 3HD1 LEU 21 1.885 -4.522 -5.417
182 1HD2 LEU 21 1HD2 LEU 21 2.727 -7.847 -6.534
183 2HD2 LEU 21 2HD2 LEU 21 3.543 -8.375 -5.063
184 3HD2 LEU 21 3HD2 LEU 21 4.247 -7.095 -6.051
185 H PHE 22 H PHE 22 0.587 -5.521 -3.639
186 HA PHE 22 HA PHE 22 -0.003 -2.911 -4.368
187 1HB PHE 22 2HB PHE 22 -1.226 -5.164 -4.877
188 2HB PHE 22 1HB PHE 22 -2.179 -4.757 -3.454
189 HD1 PHE 22 1HD PHE 22 -2.995 -2.191 -3.471
190 HD2 PHE 22 2HD PHE 22 -2.094 -4.546 -6.900
191 HE1 PHE 22 1HE PHE 22 -4.427 -0.735 -4.844
192 HE2 PHE 22 2HE PHE 22 -3.524 -3.095 -8.278
193 HZ PHE 22 HZ PHE 22 -4.692 -1.186 -7.251
194 H VAL 23 H VAL 23 -0.955 -4.613 -1.377
195 HA VAL 23 HA VAL 23 -2.347 -2.459 -0.249
196 HB VAL 23 HB VAL 23 -2.220 -3.648 1.851
197 1HG1 VAL 23 1HG1 VAL 23 -2.811 -6.039 0.832
198 2HG1 VAL 23 2HG1 VAL 23 -2.855 -5.085 -0.651
199 3HG1 VAL 23 3HG1 VAL 23 -3.897 -4.655 0.704
200 1HG2 VAL 23 1HG2 VAL 23 0.022 -4.358 2.006
201 2HG2 VAL 23 2HG2 VAL 23 -0.087 -5.263 0.499
202 3HG2 VAL 23 3HG2 VAL 23 -0.945 -5.831 1.929
203 H LEU 24 H LEU 24 0.996 -3.572 0.318
204 HA LEU 24 HA LEU 24 1.687 -1.579 2.156
205 1HB LEU 24 2HB LEU 24 3.293 -3.177 2.162
206 2HB LEU 24 1HB LEU 24 3.113 -3.516 0.453
207 HG LEU 24 HG LEU 24 4.470 -0.996 1.337
208 1HD1 LEU 24 1HD1 LEU 24 6.588 -2.519 0.939
209 2HD1 LEU 24 2HD1 LEU 24 5.496 -3.775 1.523
210 3HD1 LEU 24 3HD1 LEU 24 5.841 -2.369 2.530
211 1HD2 LEU 24 1HD2 LEU 24 4.200 -2.614 -1.122
212 2HD2 LEU 24 2HD2 LEU 24 5.770 -1.862 -0.837
213 3HD2 LEU 24 3HD2 LEU 24 4.316 -0.867 -0.919
214 H ALA 25 H ALA 25 1.627 -1.619 -1.344
215 HA ALA 25 HA ALA 25 3.085 0.728 -1.836
216 1HB ALA 25 1HB ALA 25 1.697 0.758 -3.989
217 2HB ALA 25 2HB ALA 25 0.979 -0.738 -3.393
218 3HB ALA 25 3HB ALA 25 2.716 -0.650 -3.689
219 H LEU 26 H LEU 26 -0.449 0.243 -1.624
220 HA LEU 26 HA LEU 26 -1.094 2.968 -1.876
221 1HB LEU 26 2HB LEU 26 -3.290 2.381 -1.421
222 2HB LEU 26 1HB LEU 26 -2.619 0.917 -2.107
223 HG LEU 26 HG LEU 26 -2.203 0.409 0.500
224 1HD1 LEU 26 1HD1 LEU 26 -3.554 2.711 0.759
225 2HD1 LEU 26 2HD1 LEU 26 -3.626 1.402 1.940
226 3HD1 LEU 26 3HD1 LEU 26 -4.900 1.573 0.733
227 1HD2 LEU 26 1HD2 LEU 26 -3.466 -0.874 -1.320
228 2HD2 LEU 26 2HD2 LEU 26 -4.907 -0.066 -0.706
229 3HD2 LEU 26 3HD2 LEU 26 -3.967 -1.117 0.353
230 H LEU 27 H LEU 27 -0.237 1.002 0.910
231 HA LEU 27 HA LEU 27 -1.064 2.786 2.921
232 1HB LEU 27 2HB LEU 27 0.774 0.475 2.732
233 2HB LEU 27 1HB LEU 27 1.065 1.575 4.065
234 1HD1 LEU 27 1HD2 LEU 27 -1.962 1.105 5.874
235 2HD1 LEU 27 2HD2 LEU 27 -2.446 1.855 4.352
236 3HD1 LEU 27 3HD2 LEU 27 -0.989 2.404 5.182
237 1HD2 LEU 27 1HD1 LEU 27 -1.879 0.239 2.376
238 2HD2 LEU 27 2HD1 LEU 27 -2.599 -0.532 3.787
239 3HD2 LEU 27 3HD1 LEU 27 -1.168 -1.234 3.031
240 H ILE 28 H ILE 28 2.075 2.387 1.302
241 HA ILE 28 HA ILE 28 3.417 4.428 2.699
242 HB ILE 28 HB ILE 28 3.986 3.483 -0.113
243 1HG1 ILE 28 2HG1 ILE 28 5.477 2.449 2.250
244 2HG1 ILE 28 1HG1 ILE 28 3.859 1.813 1.967
245 1HG2 ILE 28 1HG2 ILE 28 6.384 4.062 0.939
246 2HG2 ILE 28 2HG2 ILE 28 5.390 5.228 1.810
247 3HG2 ILE 28 3HG2 ILE 28 5.411 5.231 0.047
248 1HD1 ILE 28 1HD1 ILE 28 5.747 0.492 0.979
249 2HD1 ILE 28 2HD1 ILE 28 5.999 1.834 -0.138
250 3HD1 ILE 28 3HD1 ILE 28 4.470 0.954 -0.146
251 H HIS 29 H HIS 29 1.964 4.469 -0.563
252 HA HIS 29 HA HIS 29 2.419 7.176 -1.093
253 1HB HIS 29 2HB HIS 29 1.417 5.130 -2.535
254 2HB HIS 29 1HB HIS 29 -0.076 5.986 -2.166
255 HD1 HIS 29 1HD HIS 29 3.237 7.650 -2.900
256 HD2 HIS 29 2HD HIS 29 -0.502 7.114 -4.631
257 HE1 HIS 29 1HE HIS 29 3.214 9.140 -4.925
258 HE2 HIS 29 2HE HIS 29 0.974 8.733 -6.005
259 H PHE 30 H PHE 30 -0.269 5.571 0.499
260 HA PHE 30 HA PHE 30 -1.963 7.797 0.731
261 1HB PHE 30 2HB PHE 30 -2.737 5.479 1.013
262 2HB PHE 30 1HB PHE 30 -1.801 5.351 2.498
263 HD1 PHE 30 1HD PHE 30 -2.387 6.922 4.410
264 HD2 PHE 30 2HD PHE 30 -4.913 6.303 1.043
265 HE1 PHE 30 1HE PHE 30 -4.301 7.786 5.693
266 HE2 PHE 30 2HE PHE 30 -6.832 7.165 2.318
267 HZ PHE 30 HZ PHE 30 -6.528 7.909 4.646
268 H ILE 31 H ILE 31 0.462 6.443 2.960
269 HA ILE 31 HA ILE 31 -0.075 8.310 5.025
270 HB ILE 31 HB ILE 31 1.305 6.007 4.982
271 1HG1 ILE 31 2HG1 ILE 31 2.173 6.681 7.243
272 2HG1 ILE 31 1HG1 ILE 31 1.631 8.321 6.898
273 1HG2 ILE 31 1HG2 ILE 31 3.195 6.939 3.748
274 2HG2 ILE 31 2HG2 ILE 31 3.673 6.420 5.364
275 3HG2 ILE 31 3HG2 ILE 31 3.442 8.134 5.021
276 1HD1 ILE 31 1HD1 ILE 31 -0.627 7.683 6.906
277 2HD1 ILE 31 2HD1 ILE 31 0.101 6.878 8.296
278 3HD1 ILE 31 3HD1 ILE 31 -0.227 5.968 6.821
279 H LEU 32 H LEU 32 2.460 8.194 2.514
280 HA LEU 32 HA LEU 32 3.711 10.598 3.318
281 1HB LEU 32 2HB LEU 32 4.789 10.564 1.112
282 2HB LEU 32 1HB LEU 32 4.890 9.015 1.924
283 HG LEU 32 HG LEU 32 2.725 8.515 0.467
284 1HD1 LEU 32 1HD1 LEU 32 4.112 10.053 -1.614
285 2HD1 LEU 32 2HD1 LEU 32 3.229 11.020 -0.434
286 3HD1 LEU 32 3HD1 LEU 32 2.389 9.776 -1.361
287 1HD2 LEU 32 1HD2 LEU 32 5.624 8.252 -0.049
288 2HD2 LEU 32 2HD2 LEU 32 4.544 7.927 -1.405
289 3HD2 LEU 32 3HD2 LEU 32 4.379 7.012 0.093
290 H LEU 33 H LEU 33 1.329 9.891 0.794
291 HA LEU 33 HA LEU 33 1.033 12.517 -0.142
292 1HB LEU 33 2HB LEU 33 -0.660 11.706 -1.456
293 2HB LEU 33 1HB LEU 33 0.180 10.220 -1.086
294 HG LEU 33 HG LEU 33 -1.542 9.957 0.820
295 1HD1 LEU 33 1HD1 LEU 33 -3.186 11.435 1.030
296 2HD1 LEU 33 2HD1 LEU 33 -3.586 11.313 -0.684
297 3HD1 LEU 33 3HD1 LEU 33 -2.354 12.454 -0.145
298 1HD2 LEU 33 1HD2 LEU 33 -3.178 8.973 -0.776
299 2HD2 LEU 33 2HD2 LEU 33 -1.508 8.498 -1.085
300 3HD2 LEU 33 3HD2 LEU 33 -2.278 9.723 -2.094
301 H SER 34 H SER 34 -0.620 10.720 2.405
302 HA SER 34 HA SER 34 -2.563 12.652 3.033
303 1HB SER 34 2HB SER 34 -2.780 10.373 3.834
304 2HB SER 34 1HB SER 34 -1.294 10.524 4.770
305 HG SER 34 HG SER 34 -2.500 11.254 6.313
306 H THR 35 H THR 35 0.468 11.904 4.773
307 HA THR 35 HA THR 35 0.359 14.083 6.521
308 HB THR 35 HB THR 35 2.885 12.794 5.489
309 HG1 THR 35 1HG THR 35 2.363 11.059 6.530
310 1HG2 THR 35 1HG2 THR 35 2.320 13.778 8.264
311 2HG2 THR 35 2HG2 THR 35 3.062 14.791 7.026
312 3HG2 THR 35 3HG2 THR 35 3.866 13.313 7.555
313 H GLU 36 H GLU 36 2.072 13.768 3.421
314 HA GLU 36 HA GLU 36 3.229 16.323 3.436
315 1HB GLU 36 2HB GLU 36 3.763 15.957 1.149
316 2HB GLU 36 1HB GLU 36 3.857 14.393 1.939
317 1HG GLU 36 2HG GLU 36 2.763 13.887 -0.012
318 2HG GLU 36 1HG GLU 36 1.424 14.105 1.109
319 H ARG 37 H ARG 37 0.155 15.168 2.102
320 HA ARG 37 HA ARG 37 -0.599 17.630 0.925
321 1HB ARG 37 2HB ARG 37 -1.633 15.510 0.275
322 2HB ARG 37 1HB ARG 37 -2.312 15.330 1.887
323 1HG ARG 37 2HG ARG 37 -3.973 16.103 0.271
324 2HG ARG 37 1HG ARG 37 -3.703 17.285 1.554
325 1HD ARG 37 2HD ARG 37 -2.847 18.815 0.139
326 2HD ARG 37 1HD ARG 37 -1.995 17.603 -0.818
327 HE ARG 37 HE ARG 37 -4.580 17.189 -1.479
328 1HH1 ARG 37 1HH1 ARG 37 -2.578 20.046 -1.408
329 2HH1 ARG 37 2HH1 ARG 37 -3.423 20.823 -2.704
330 1HH2 ARG 37 1HH2 ARG 37 -5.693 18.208 -3.183
331 2HH2 ARG 37 2HH2 ARG 37 -5.193 19.780 -3.712
332 H PHE 38 H PHE 38 -1.050 16.222 4.110
333 HA PHE 38 HA PHE 38 -2.918 18.058 5.119
334 1HB PHE 38 2HB PHE 38 -2.044 15.815 6.115
335 2HB PHE 38 1HB PHE 38 -0.795 16.819 6.846
336 HD1 PHE 38 1HD PHE 38 -4.497 16.601 6.503
337 HD2 PHE 38 2HD PHE 38 -1.187 17.783 8.902
338 HE1 PHE 38 1HE PHE 38 -6.034 17.162 8.341
339 HE2 PHE 38 2HE PHE 38 -2.718 18.345 10.744
340 HZ PHE 38 HZ PHE 38 -5.145 18.035 10.465
341 H ASN 39 H ASN 39 0.568 17.935 5.884
342 HA ASN 39 HA ASN 39 0.719 20.459 7.050
343 1HB ASN 39 2HB ASN 39 2.772 18.705 5.728
344 2HB ASN 39 1HB ASN 39 3.205 20.275 6.396
345 1HD2 ASN 39 1HD2 ASN 39 2.777 17.020 7.040
346 2HD2 ASN 39 2HD2 ASN 39 2.840 17.086 8.765
347 H TRP 40 H TRP 40 0.514 19.562 3.753
348 HA TRP 40 HA TRP 40 1.717 21.839 2.561
349 1HB TRP 40 2HB TRP 40 1.359 19.778 1.281
350 2HB TRP 40 1HB TRP 40 -0.382 19.945 1.469
351 HD1 TRP 40 HD TRP 40 0.991 23.284 0.793
352 HE1 TRP 40 1HE TRP 40 0.698 23.914 -1.685
353 HE3 TRP 40 3HE TRP 40 -0.211 18.680 -1.078
354 HZ2 TRP 40 2HZ TRP 40 0.044 22.630 -4.111
355 HZ3 TRP 40 3HZ TRP 40 -0.655 18.467 -3.489
356 HH2 TRP 40 HH TRP 40 -0.531 20.401 -4.972
357 H LEU 41 H LEU 41 -1.715 20.932 2.552
358 HA LEU 41 HA LEU 41 -2.618 23.584 2.157
359 1HB LEU 41 2HB LEU 41 -4.834 22.716 2.614
360 2HB LEU 41 1HB LEU 41 -3.964 21.601 1.578
361 HG LEU 41 HG LEU 41 -3.397 20.390 3.832
362 1HD1 LEU 41 1HD1 LEU 41 -4.232 21.610 5.548
363 2HD1 LEU 41 2HD1 LEU 41 -5.673 20.658 5.190
364 3HD1 LEU 41 3HD1 LEU 41 -5.528 22.304 4.572
365 1HD2 LEU 41 1HD2 LEU 41 -4.989 18.850 3.291
366 2HD2 LEU 41 2HD2 LEU 41 -5.005 19.812 1.813
367 3HD2 LEU 41 3HD2 LEU 41 -6.242 20.066 3.044
368 H GLU 42 H GLU 42 -1.384 21.931 4.850
369 HA GLU 42 HA GLU 42 -2.811 23.106 6.938
370 1HB GLU 42 2HB GLU 42 -1.360 21.179 7.293
371 2HB GLU 42 1HB GLU 42 0.045 22.158 6.901
372 1HG GLU 42 2HG GLU 42 -1.114 23.589 8.917
373 2HG GLU 42 1HG GLU 42 -1.449 21.924 9.391
374 H GLY 43 H GLY 43 0.516 23.885 5.936
375 1HA GLY 43 2HA GLY 43 0.003 26.696 5.822
376 2HA GLY 43 1HA GLY 43 0.825 26.247 7.309
377 H ALA 44 H ALA 44 2.767 24.738 6.901
378 HA ALA 44 HA ALA 44 4.971 24.819 6.271
379 1HB ALA 44 1HB ALA 44 5.239 24.168 3.844
380 2HB ALA 44 2HB ALA 44 3.483 24.272 3.720
381 3HB ALA 44 3HB ALA 44 4.223 23.117 4.830
382 H SER 45 H SER 45 3.911 26.187 3.191
383 HA SER 45 HA SER 45 5.949 28.167 3.266
384 1HB SER 45 2HB SER 45 4.779 29.010 1.173
385 2HB SER 45 1HB SER 45 5.328 27.335 1.125
386 H THR 46 H THR 46 2.580 28.143 4.149
387 HA THR 46 HA THR 46 2.428 31.035 4.306
388 HB THR 46 HB THR 46 0.138 30.762 4.795
389 HG1 THR 46 1HG THR 46 -0.678 28.646 5.374
390 1HG2 THR 46 1HG2 THR 46 -0.646 29.717 2.963
391 2HG2 THR 46 2HG2 THR 46 0.303 28.258 3.250
392 3HG2 THR 46 3HG2 THR 46 1.065 29.681 2.536
393 H LYS 47 H LYS 47 3.445 28.494 6.312
394 HA LYS 47 HA LYS 47 2.700 29.667 8.822
395 1HB LYS 47 2HB LYS 47 3.022 27.249 8.605
396 2HB LYS 47 1HB LYS 47 4.709 27.501 8.176
397 1HG LYS 47 2HG LYS 47 4.934 28.641 10.450
398 2HG LYS 47 1HG LYS 47 3.371 27.914 10.826
399 1HD LYS 47 2HD LYS 47 4.227 25.825 10.969
400 2HD LYS 47 1HD LYS 47 5.389 26.101 9.669
401 1HE LYS 47 2HE LYS 47 6.405 27.737 11.538
402 2HE LYS 47 1HE LYS 47 5.650 26.533 12.582
403 1HZ LYS 47 1HZ LYS 47 8.099 26.280 11.604
404 2HZ LYS 47 2HZ LYS 47 7.238 25.505 10.373
405 3HZ LYS 47 3HZ LYS 47 7.114 24.953 11.967
406 HA PRO 48 HA PRO 48 5.825 32.749 9.310
407 1HB PRO 48 2HB PRO 48 6.057 31.689 12.087
408 2HB PRO 48 1HB PRO 48 5.795 33.346 11.533
409 1HG PRO 48 2HG PRO 48 3.789 31.930 12.555
410 2HG PRO 48 1HG PRO 48 3.528 33.008 11.173
411 1HD PRO 48 2HD PRO 48 3.739 30.032 11.245
412 2HD PRO 48 1HD PRO 48 2.719 31.068 10.227
413 H VAL 49 H VAL 49 7.882 32.668 8.697
414 HA VAL 49 HA VAL 49 9.676 30.672 9.863
415 HB VAL 49 HB VAL 49 9.567 31.129 6.881
416 1HG1 VAL 49 1HG1 VAL 49 11.331 29.639 8.713
417 2HG1 VAL 49 2HG1 VAL 49 11.674 30.366 7.143
418 3HG1 VAL 49 3HG1 VAL 49 10.867 28.800 7.232
419 1HG2 VAL 49 1HG2 VAL 49 8.867 28.534 7.201
420 2HG2 VAL 49 2HG2 VAL 49 7.717 29.851 6.975
421 3HG2 VAL 49 3HG2 VAL 49 8.076 29.264 8.598
422 H GLN 50 H GLN 50 9.415 33.420 7.620
423 HA GLN 50 HA GLN 50 11.422 34.890 9.026
424 1HB GLN 50 2HB GLN 50 12.976 35.077 7.066
425 2HB GLN 50 1HB GLN 50 12.965 33.499 7.842
426 1HG GLN 50 2HG GLN 50 12.230 32.469 6.006
427 2HG GLN 50 1HG GLN 50 11.057 33.735 5.649
428 1HE2 GLN 50 1HE2 GLN 50 11.470 35.095 4.036
429 2HE2 GLN 50 2HE2 GLN 50 12.971 35.214 3.187
430 H THR 51 H THR 51 9.646 36.346 9.081
431 HA THR 51 HA THR 51 8.351 38.082 8.377
432 HB THR 51 HB THR 51 9.414 39.693 6.956
433 HG1 THR 51 1HG THR 51 10.062 38.414 5.247
434 1HG2 THR 51 1HG2 THR 51 10.883 38.429 9.059
435 2HG2 THR 51 2HG2 THR 51 10.849 40.125 8.575
436 3HG2 THR 51 3HG2 THR 51 11.987 39.012 7.814
437 H SER 52 H SER 52 6.612 36.805 7.642
438 HA SER 52 HA SER 52 6.157 37.029 4.780
439 1HB SER 52 2HB SER 52 7.082 34.829 4.816
440 2HB SER 52 1HB SER 52 6.154 34.389 6.250
441 HG SER 52 HG SER 52 4.676 33.729 4.929
Start of MODEL 3
1 1H MET 1 1H MET 1 0.411 -26.114 -15.666
2 HA MET 1 HA MET 1 0.731 -28.510 -14.180
3 1HB MET 1 2HB MET 1 3.199 -28.173 -13.596
4 2HB MET 1 1HB MET 1 2.839 -28.891 -15.160
5 1HG MET 1 2HG MET 1 3.027 -26.497 -16.070
6 2HG MET 1 1HG MET 1 3.821 -26.135 -14.538
7 1HE MET 1 1HE MET 1 6.083 -25.499 -16.693
8 2HE MET 1 2HE MET 1 7.223 -26.391 -15.686
9 3HE MET 1 3HE MET 1 5.894 -25.504 -14.940
10 H TRP 2 H TRP 2 2.087 -25.211 -14.285
11 HA TRP 2 HA TRP 2 2.320 -23.636 -12.632
12 1HB TRP 2 2HB TRP 2 -0.240 -23.837 -13.469
13 2HB TRP 2 1HB TRP 2 -0.464 -24.099 -11.743
14 HD1 TRP 2 HD TRP 2 -1.048 -21.923 -10.553
15 HE1 TRP 2 1HE TRP 2 -0.421 -19.441 -10.811
16 HE3 TRP 2 3HE TRP 2 2.077 -22.291 -14.583
17 HZ2 TRP 2 2HZ TRP 2 1.187 -17.849 -12.500
18 HZ3 TRP 2 3HZ TRP 2 3.118 -20.241 -15.458
19 HH2 TRP 2 HH TRP 2 2.681 -18.066 -14.438
20 H ARG 3 H ARG 3 3.677 -25.369 -11.475
21 HA ARG 3 HA ARG 3 4.335 -26.401 -9.553
22 1HB ARG 3 2HB ARG 3 2.402 -24.632 -8.080
23 2HB ARG 3 1HB ARG 3 3.987 -25.197 -7.566
24 1HG ARG 3 2HG ARG 3 3.607 -23.313 -9.874
25 2HG ARG 3 1HG ARG 3 3.813 -22.764 -8.210
26 1HD ARG 3 2HD ARG 3 5.881 -24.498 -8.438
27 2HD ARG 3 1HD ARG 3 5.771 -23.898 -10.091
28 HE ARG 3 HE ARG 3 6.802 -22.502 -7.864
29 1HH1 ARG 3 1HH1 ARG 3 4.876 -22.011 -10.731
30 2HH1 ARG 3 2HH1 ARG 3 5.314 -20.344 -10.893
31 1HH2 ARG 3 1HH2 ARG 3 7.379 -20.309 -8.074
32 2HH2 ARG 3 2HH2 ARG 3 6.735 -19.377 -9.384
33 H ILE 4 H ILE 4 1.900 -27.406 -10.950
34 HA ILE 4 HA ILE 4 0.148 -28.850 -10.652
35 HB ILE 4 HB ILE 4 1.764 -30.002 -8.392
36 1HG1 ILE 4 2HG1 ILE 4 3.345 -29.498 -10.184
37 2HG1 ILE 4 1HG1 ILE 4 3.076 -31.235 -10.084
38 1HG2 ILE 4 1HG2 ILE 4 0.652 -31.941 -8.779
39 2HG2 ILE 4 2HG2 ILE 4 0.503 -31.641 -10.510
40 3HG2 ILE 4 3HG2 ILE 4 -0.573 -30.822 -9.378
41 1HD1 ILE 4 1HD1 ILE 4 3.126 -30.033 -12.390
42 2HD1 ILE 4 2HD1 ILE 4 1.459 -29.620 -11.990
43 3HD1 ILE 4 3HD1 ILE 4 1.951 -31.310 -12.079
44 H TRP 5 H TRP 5 -0.011 -26.388 -9.094
45 HA TRP 5 HA TRP 5 -0.954 -25.486 -7.182
46 1HB TRP 5 2HB TRP 5 -3.068 -27.401 -8.187
47 2HB TRP 5 1HB TRP 5 -3.368 -26.053 -7.095
48 HD1 TRP 5 HD TRP 5 -1.602 -26.365 -10.553
49 HE1 TRP 5 1HE TRP 5 -2.447 -24.439 -12.037
50 HE3 TRP 5 3HE TRP 5 -4.805 -24.137 -7.249
51 HZ2 TRP 5 2HZ TRP 5 -4.234 -22.264 -11.834
52 HZ3 TRP 5 3HZ TRP 5 -6.044 -22.138 -7.973
53 HH2 TRP 5 HH TRP 5 -5.762 -21.221 -10.217
54 H GLN 6 H GLN 6 0.785 -27.232 -6.162
55 HA GLN 6 HA GLN 6 -0.391 -27.963 -3.696
56 1HB GLN 6 2HB GLN 6 -0.205 -30.372 -3.788
57 2HB GLN 6 1HB GLN 6 -1.271 -29.816 -5.071
58 1HG GLN 6 2HG GLN 6 0.943 -29.876 -6.485
59 2HG GLN 6 1HG GLN 6 1.439 -31.021 -5.239
60 1HE2 GLN 6 1HE2 GLN 6 1.356 -32.920 -6.254
61 2HE2 GLN 6 2HE2 GLN 6 -0.035 -33.565 -7.049
62 H LEU 7 H LEU 7 2.310 -28.163 -5.914
63 HA LEU 7 HA LEU 7 4.184 -28.948 -3.871
64 1HB LEU 7 2HB LEU 7 4.503 -28.062 -6.731
65 2HB LEU 7 1HB LEU 7 5.873 -28.414 -5.694
66 HG LEU 7 HG LEU 7 3.725 -30.465 -6.117
67 1HD1 LEU 7 1HD1 LEU 7 4.550 -29.635 -8.332
68 2HD1 LEU 7 2HD1 LEU 7 4.854 -31.343 -8.017
69 3HD1 LEU 7 3HD1 LEU 7 6.162 -30.170 -7.858
70 1HD2 LEU 7 1HD2 LEU 7 6.471 -30.355 -5.021
71 2HD2 LEU 7 2HD2 LEU 7 6.025 -31.806 -5.919
72 3HD2 LEU 7 3HD2 LEU 7 5.081 -31.315 -4.512
73 H PHE 8 H PHE 8 3.599 -25.993 -5.775
74 HA PHE 8 HA PHE 8 5.236 -24.502 -3.845
75 1HB PHE 8 2HB PHE 8 5.478 -24.435 -6.488
76 2HB PHE 8 1HB PHE 8 4.198 -23.235 -6.338
77 HD1 PHE 8 1HD PHE 8 4.605 -21.101 -5.297
78 HD2 PHE 8 2HD PHE 8 7.693 -24.015 -5.598
79 HE1 PHE 8 1HE PHE 8 6.276 -19.383 -4.741
80 HE2 PHE 8 2HE PHE 8 9.369 -22.302 -5.041
81 HZ PHE 8 HZ PHE 8 8.662 -19.982 -4.613
82 H ASP 9 H ASP 9 2.062 -24.576 -5.378
83 HA ASP 9 HA ASP 9 0.033 -23.861 -4.602
84 1HB ASP 9 2HB ASP 9 1.408 -24.059 -2.266
85 2HB ASP 9 1HB ASP 9 1.049 -22.336 -2.286
86 HA PRO 10 HA PRO 10 1.443 -19.857 -6.606
87 1HB PRO 10 2HB PRO 10 -0.799 -20.645 -8.380
88 2HB PRO 10 1HB PRO 10 0.810 -20.050 -8.797
89 1HG PRO 10 2HG PRO 10 0.173 -22.618 -9.128
90 2HG PRO 10 1HG PRO 10 1.787 -22.139 -8.570
91 1HD PRO 10 2HD PRO 10 -0.512 -23.242 -7.006
92 2HD PRO 10 1HD PRO 10 1.225 -23.575 -6.848
93 H ARG 11 H ARG 11 -1.799 -21.158 -5.986
94 HA ARG 11 HA ARG 11 -3.247 -18.796 -6.068
95 1HB ARG 11 2HB ARG 11 -4.661 -20.048 -4.208
96 2HB ARG 11 1HB ARG 11 -4.659 -20.580 -5.882
97 1HG ARG 11 2HG ARG 11 -3.663 -22.523 -5.394
98 2HG ARG 11 1HG ARG 11 -2.558 -21.785 -4.235
99 1HD ARG 11 2HD ARG 11 -5.454 -22.478 -3.749
100 2HD ARG 11 1HD ARG 11 -4.057 -23.357 -3.131
101 HE ARG 11 HE ARG 11 -4.111 -20.581 -2.381
102 1HH1 ARG 11 1HH1 ARG 11 -5.180 -23.796 -1.544
103 2HH1 ARG 11 2HH1 ARG 11 -5.383 -23.426 0.135
104 1HH2 ARG 11 1HH2 ARG 11 -4.379 -20.093 -0.173
105 2HH2 ARG 11 2HH2 ARG 11 -4.930 -21.324 0.913
106 H GLN 12 H GLN 12 -2.187 -20.360 -3.036
107 HA GLN 12 HA GLN 12 -2.718 -18.181 -1.384
108 1HB GLN 12 2HB GLN 12 -1.186 -19.269 0.225
109 2HB GLN 12 1HB GLN 12 -2.366 -20.374 -0.464
110 1HG GLN 12 2HG GLN 12 -0.530 -21.673 -0.637
111 2HG GLN 12 1HG GLN 12 -0.394 -20.815 -2.171
112 1HE2 GLN 12 1HE2 GLN 12 1.682 -20.473 -2.533
113 2HE2 GLN 12 2HE2 GLN 12 2.819 -19.844 -1.396
114 H ALA 13 H ALA 13 0.287 -19.128 -2.980
115 HA ALA 13 HA ALA 13 1.937 -17.156 -1.882
116 1HB ALA 13 1HB ALA 13 3.265 -18.641 -2.917
117 2HB ALA 13 2HB ALA 13 3.080 -17.562 -4.299
118 3HB ALA 13 3HB ALA 13 2.070 -19.002 -4.163
119 H LEU 14 H LEU 14 -0.209 -17.049 -4.683
120 HA LEU 14 HA LEU 14 0.760 -14.533 -5.620
121 1HB LEU 14 2HB LEU 14 -0.733 -14.712 -7.330
122 2HB LEU 14 1HB LEU 14 -0.610 -16.394 -6.866
123 HG LEU 14 HG LEU 14 -2.708 -15.749 -5.358
124 1HD1 LEU 14 1HD1 LEU 14 -3.146 -13.553 -5.751
125 2HD1 LEU 14 2HD1 LEU 14 -4.095 -14.265 -7.054
126 3HD1 LEU 14 3HD1 LEU 14 -2.496 -13.601 -7.389
127 1HD2 LEU 14 1HD2 LEU 14 -2.351 -17.346 -7.425
128 2HD2 LEU 14 2HD2 LEU 14 -3.302 -16.109 -8.248
129 3HD2 LEU 14 3HD2 LEU 14 -3.967 -16.944 -6.843
130 H VAL 15 H VAL 15 -1.955 -15.518 -3.582
131 HA VAL 15 HA VAL 15 -3.046 -12.899 -3.347
132 HB VAL 15 HB VAL 15 -4.421 -14.865 -2.900
133 1HG1 VAL 15 1HG1 VAL 15 -2.828 -16.371 -1.966
134 2HG1 VAL 15 2HG1 VAL 15 -4.093 -16.114 -0.765
135 3HG1 VAL 15 3HG1 VAL 15 -2.536 -15.303 -0.594
136 1HG2 VAL 15 1HG2 VAL 15 -4.656 -12.566 -1.665
137 2HG2 VAL 15 2HG2 VAL 15 -4.240 -13.522 -0.243
138 3HG2 VAL 15 3HG2 VAL 15 -5.661 -13.938 -1.200
139 H GLY 16 H GLY 16 -0.486 -14.626 -1.757
140 1HA GLY 16 2HA GLY 16 -0.372 -12.952 0.567
141 2HA GLY 16 1HA GLY 16 0.857 -14.096 0.042
142 H LEU 17 H LEU 17 1.712 -13.266 -2.304
143 HA LEU 17 HA LEU 17 3.324 -11.044 -1.709
144 1HB LEU 17 2HB LEU 17 3.934 -11.170 -4.127
145 2HB LEU 17 1HB LEU 17 4.118 -12.670 -3.240
146 HG LEU 17 HG LEU 17 1.653 -13.063 -4.207
147 1HD1 LEU 17 1HD1 LEU 17 1.102 -11.914 -6.043
148 2HD1 LEU 17 2HD1 LEU 17 2.756 -11.900 -6.653
149 3HD1 LEU 17 3HD1 LEU 17 2.252 -10.719 -5.445
150 1HD2 LEU 17 1HD2 LEU 17 2.672 -14.433 -5.915
151 2HD2 LEU 17 2HD2 LEU 17 3.630 -14.523 -4.438
152 3HD2 LEU 17 3HD2 LEU 17 4.179 -13.527 -5.785
153 H ALA 18 H ALA 18 0.540 -11.393 -3.880
154 HA ALA 18 HA ALA 18 0.463 -8.768 -4.828
155 1HB ALA 18 1HB ALA 18 -1.733 -9.247 -5.607
156 2HB ALA 18 2HB ALA 18 -1.938 -10.538 -4.423
157 3HB ALA 18 3HB ALA 18 -0.790 -10.731 -5.748
158 H THR 19 H THR 19 -1.251 -10.221 -2.062
159 HA THR 19 HA THR 19 -2.632 -7.863 -1.341
160 HB THR 19 HB THR 19 -1.911 -10.297 0.299
161 HG1 THR 19 1HG THR 19 -4.013 -10.915 -0.187
162 1HG2 THR 19 1HG2 THR 19 -2.443 -8.711 1.928
163 2HG2 THR 19 2HG2 THR 19 -3.946 -9.589 1.646
164 3HG2 THR 19 3HG2 THR 19 -3.712 -7.990 0.939
165 H PHE 20 H PHE 20 0.315 -9.344 0.006
166 HA PHE 20 HA PHE 20 0.822 -7.401 1.950
167 1HB PHE 20 2HB PHE 20 1.935 -9.610 1.859
168 2HB PHE 20 1HB PHE 20 2.843 -9.077 0.448
169 HD1 PHE 20 1HD PHE 20 2.365 -8.606 4.065
170 HD2 PHE 20 2HD PHE 20 4.741 -7.661 0.663
171 HE1 PHE 20 1HE PHE 20 4.107 -7.690 5.541
172 HE2 PHE 20 2HE PHE 20 6.488 -6.744 2.133
173 HZ PHE 20 HZ PHE 20 6.171 -6.757 4.576
174 H LEU 21 H LEU 21 1.939 -7.613 -1.414
175 HA LEU 21 HA LEU 21 3.559 -5.306 -1.324
176 1HB LEU 21 2HB LEU 21 4.032 -6.804 -3.047
177 2HB LEU 21 1HB LEU 21 2.347 -6.980 -3.490
178 HG LEU 21 HG LEU 21 3.904 -5.710 -5.080
179 1HD1 LEU 21 1HD1 LEU 21 1.262 -5.722 -4.800
180 2HD1 LEU 21 2HD1 LEU 21 2.084 -4.712 -5.989
181 3HD1 LEU 21 3HD1 LEU 21 1.558 -4.018 -4.455
182 1HD2 LEU 21 1HD2 LEU 21 3.277 -3.259 -3.558
183 2HD2 LEU 21 2HD2 LEU 21 4.666 -3.641 -4.575
184 3HD2 LEU 21 3HD2 LEU 21 4.581 -4.264 -2.927
185 H PHE 22 H PHE 22 0.321 -5.846 -2.703
186 HA PHE 22 HA PHE 22 -0.232 -3.262 -3.509
187 1HB PHE 22 2HB PHE 22 -1.620 -5.224 -4.065
188 2HB PHE 22 1HB PHE 22 -2.196 -5.276 -2.403
189 HD1 PHE 22 1HD PHE 22 -4.205 -4.275 -1.926
190 HD2 PHE 22 2HD PHE 22 -1.946 -2.882 -5.252
191 HE1 PHE 22 1HE PHE 22 -6.026 -2.727 -2.509
192 HE2 PHE 22 2HE PHE 22 -3.763 -1.330 -5.841
193 HZ PHE 22 HZ PHE 22 -5.806 -1.251 -4.469
194 H VAL 23 H VAL 23 -0.952 -4.746 -0.347
195 HA VAL 23 HA VAL 23 -2.210 -2.493 0.756
196 HB VAL 23 HB VAL 23 -1.915 -3.557 2.908
197 1HG1 VAL 23 1HG1 VAL 23 -3.711 -4.570 1.944
198 2HG1 VAL 23 2HG1 VAL 23 -2.661 -5.976 2.119
199 3HG1 VAL 23 3HG1 VAL 23 -2.779 -5.151 0.565
200 1HG2 VAL 23 1HG2 VAL 23 0.318 -4.310 2.903
201 2HG2 VAL 23 2HG2 VAL 23 0.057 -5.295 1.467
202 3HG2 VAL 23 3HG2 VAL 23 -0.677 -5.763 2.998
203 H LEU 24 H LEU 24 1.144 -3.640 1.069
204 HA LEU 24 HA LEU 24 2.075 -1.640 2.762
205 1HB LEU 24 2HB LEU 24 3.176 -3.833 1.880
206 2HB LEU 24 1HB LEU 24 3.788 -2.802 0.599
207 HG LEU 24 HG LEU 24 5.436 -3.069 2.368
208 1HD1 LEU 24 1HD1 LEU 24 5.088 -0.894 1.073
209 2HD1 LEU 24 2HD1 LEU 24 6.055 -0.821 2.547
210 3HD1 LEU 24 3HD1 LEU 24 4.380 -0.269 2.563
211 1HD2 LEU 24 1HD2 LEU 24 3.481 -3.263 4.113
212 2HD2 LEU 24 2HD2 LEU 24 3.740 -1.526 4.267
213 3HD2 LEU 24 3HD2 LEU 24 5.063 -2.645 4.591
214 H ALA 25 H ALA 25 2.444 -1.836 -0.771
215 HA ALA 25 HA ALA 25 3.576 0.675 -1.152
216 1HB ALA 25 1HB ALA 25 2.411 0.366 -3.507
217 2HB ALA 25 2HB ALA 25 2.161 -1.267 -2.892
218 3HB ALA 25 3HB ALA 25 3.794 -0.612 -3.016
219 H LEU 26 H LEU 26 0.135 -0.260 -1.444
220 HA LEU 26 HA LEU 26 -0.787 2.310 -2.097
221 1HB LEU 26 2HB LEU 26 -2.916 1.465 -1.943
222 2HB LEU 26 1HB LEU 26 -1.987 0.003 -2.200
223 HG LEU 26 HG LEU 26 -2.013 -0.161 0.407
224 1HD1 LEU 26 1HD1 LEU 26 -4.436 0.742 1.026
225 2HD1 LEU 26 2HD1 LEU 26 -4.003 1.958 -0.174
226 3HD1 LEU 26 3HD1 LEU 26 -2.984 1.717 1.244
227 1HD2 LEU 26 1HD2 LEU 26 -4.264 -1.296 0.254
228 2HD2 LEU 26 2HD2 LEU 26 -3.055 -1.829 -0.912
229 3HD2 LEU 26 3HD2 LEU 26 -4.339 -0.732 -1.415
230 H LEU 27 H LEU 27 -0.239 0.749 1.012
231 HA LEU 27 HA LEU 27 -1.508 2.626 2.657
232 1HB LEU 27 2HB LEU 27 0.543 0.530 2.988
233 2HB LEU 27 1HB LEU 27 0.567 1.793 4.200
234 1HD1 LEU 27 1HD1 LEU 27 -2.683 -0.760 3.498
235 2HD1 LEU 27 2HD1 LEU 27 -2.032 0.344 2.288
236 3HD1 LEU 27 3HD1 LEU 27 -3.161 0.937 3.504
237 1HD2 LEU 27 1HD2 LEU 27 0.301 -0.480 5.359
238 2HD2 LEU 27 2HD2 LEU 27 -0.558 -1.467 4.178
239 3HD2 LEU 27 3HD2 LEU 27 -1.355 -0.996 5.680
240 H ILE 28 H ILE 28 1.955 2.382 1.817
241 HA ILE 28 HA ILE 28 2.694 4.821 3.018
242 HB ILE 28 HB ILE 28 4.074 3.495 0.683
243 1HG1 ILE 28 2HG1 ILE 28 3.764 1.838 2.420
244 2HG1 ILE 28 1HG1 ILE 28 5.447 2.353 2.423
245 1HG2 ILE 28 1HG2 ILE 28 5.657 4.820 2.757
246 2HG2 ILE 28 2HG2 ILE 28 4.606 5.903 1.845
247 3HG2 ILE 28 3HG2 ILE 28 5.788 4.903 1.000
248 1HD1 ILE 28 1HD1 ILE 28 3.385 2.622 4.481
249 2HD1 ILE 28 2HD1 ILE 28 4.374 4.060 4.231
250 3HD1 ILE 28 3HD1 ILE 28 5.139 2.522 4.629
251 H HIS 29 H HIS 29 1.328 4.044 -0.086
252 HA HIS 29 HA HIS 29 2.000 6.390 -1.480
253 1HB HIS 29 2HB HIS 29 0.841 4.122 -2.236
254 2HB HIS 29 1HB HIS 29 -0.622 5.070 -1.999
255 HD1 HIS 29 1HD HIS 29 -1.370 6.248 -4.031
256 HD2 HIS 29 2HD HIS 29 2.743 5.654 -4.025
257 HE1 HIS 29 1HE HIS 29 -0.554 7.171 -6.223
258 HE2 HIS 29 2HE HIS 29 1.948 6.881 -6.159
259 H PHE 30 H PHE 30 -1.189 5.578 -0.098
260 HA PHE 30 HA PHE 30 -2.202 8.179 -0.308
261 1HB PHE 30 2HB PHE 30 -4.126 7.354 0.630
262 2HB PHE 30 1HB PHE 30 -3.372 5.845 0.134
263 HD1 PHE 30 1HD PHE 30 -4.664 7.758 2.863
264 HD2 PHE 30 2HD PHE 30 -2.087 4.521 1.871
265 HE1 PHE 30 1HE PHE 30 -4.802 6.942 5.181
266 HE2 PHE 30 2HE PHE 30 -2.220 3.698 4.184
267 HZ PHE 30 HZ PHE 30 -3.579 4.910 5.844
268 H ILE 31 H ILE 31 -0.338 6.634 2.236
269 HA ILE 31 HA ILE 31 -0.892 8.599 4.211
270 HB ILE 31 HB ILE 31 0.235 6.169 4.366
271 1HG1 ILE 31 2HG1 ILE 31 1.093 6.991 6.675
272 2HG1 ILE 31 1HG1 ILE 31 0.414 8.542 6.194
273 1HG2 ILE 31 1HG2 ILE 31 2.329 6.772 3.328
274 2HG2 ILE 31 2HG2 ILE 31 2.595 6.396 5.028
275 3HG2 ILE 31 3HG2 ILE 31 2.567 8.075 4.492
276 1HD1 ILE 31 1HD1 ILE 31 -1.028 5.940 6.591
277 2HD1 ILE 31 2HD1 ILE 31 -1.761 7.344 5.814
278 3HD1 ILE 31 3HD1 ILE 31 -1.222 7.444 7.490
279 H LEU 32 H LEU 32 1.923 8.110 2.060
280 HA LEU 32 HA LEU 32 3.271 10.447 2.888
281 1HB LEU 32 2HB LEU 32 4.786 10.055 1.154
282 2HB LEU 32 1HB LEU 32 4.220 8.458 1.598
283 HG LEU 32 HG LEU 32 2.526 8.831 -0.372
284 1HD1 LEU 32 1HD1 LEU 32 2.884 10.510 -1.792
285 2HD1 LEU 32 2HD1 LEU 32 4.629 10.255 -1.786
286 3HD1 LEU 32 3HD1 LEU 32 3.876 11.225 -0.520
287 1HD2 LEU 32 1HD2 LEU 32 3.855 7.041 -0.751
288 2HD2 LEU 32 2HD2 LEU 32 5.330 7.908 -0.325
289 3HD2 LEU 32 3HD2 LEU 32 4.600 8.138 -1.914
290 H LEU 33 H LEU 33 0.984 9.786 0.289
291 HA LEU 33 HA LEU 33 1.087 12.289 -0.982
292 1HB LEU 33 2HB LEU 33 -1.197 10.327 -0.710
293 2HB LEU 33 1HB LEU 33 -1.193 11.698 -1.806
294 HG LEU 33 HG LEU 33 1.018 9.710 -1.977
295 1HD1 LEU 33 1HD1 LEU 33 -1.203 9.130 -3.766
296 2HD1 LEU 33 2HD1 LEU 33 -1.596 8.848 -2.071
297 3HD1 LEU 33 3HD1 LEU 33 -0.210 8.038 -2.802
298 1HD2 LEU 33 1HD2 LEU 33 0.552 11.994 -3.300
299 2HD2 LEU 33 2HD2 LEU 33 -0.320 10.868 -4.341
300 3HD2 LEU 33 3HD2 LEU 33 1.395 10.618 -4.013
301 H SER 34 H SER 34 -1.292 11.047 1.350
302 HA SER 34 HA SER 34 -2.580 13.489 1.821
303 1HB SER 34 2HB SER 34 -3.244 11.048 2.498
304 2HB SER 34 1HB SER 34 -2.339 11.406 3.969
305 HG SER 34 HG SER 34 -4.201 12.224 4.552
306 H THR 35 H THR 35 0.388 12.128 3.051
307 HA THR 35 HA THR 35 0.647 13.783 5.342
308 HB THR 35 HB THR 35 2.616 12.234 3.671
309 HG1 THR 35 1HG THR 35 1.969 10.784 5.021
310 1HG2 THR 35 1HG2 THR 35 4.045 13.921 4.422
311 2HG2 THR 35 2HG2 THR 35 4.221 12.626 5.605
312 3HG2 THR 35 3HG2 THR 35 3.232 14.037 5.983
313 H GLU 36 H GLU 36 2.049 14.055 2.078
314 HA GLU 36 HA GLU 36 3.301 16.538 2.492
315 1HB GLU 36 2HB GLU 36 3.349 14.729 0.494
316 2HB GLU 36 1HB GLU 36 2.283 15.928 -0.225
317 1HG GLU 36 2HG GLU 36 3.947 17.623 -0.049
318 2HG GLU 36 1HG GLU 36 4.990 16.575 0.912
319 H ARG 37 H ARG 37 0.120 15.704 1.164
320 HA ARG 37 HA ARG 37 -0.670 18.347 0.564
321 1HB ARG 37 2HB ARG 37 -1.982 15.708 0.775
322 2HB ARG 37 1HB ARG 37 -3.036 17.095 1.021
323 1HG ARG 37 2HG ARG 37 -1.323 16.549 -1.394
324 2HG ARG 37 1HG ARG 37 -3.081 16.422 -1.291
325 1HD ARG 37 2HD ARG 37 -3.011 18.897 -0.603
326 2HD ARG 37 1HD ARG 37 -1.364 18.881 -1.229
327 HE ARG 37 HE ARG 37 -3.768 18.934 -2.751
328 1HH1 ARG 37 1HH1 ARG 37 -0.488 17.744 -2.767
329 2HH1 ARG 37 2HH1 ARG 37 -0.380 17.698 -4.494
330 1HH2 ARG 37 1HH2 ARG 37 -3.629 18.875 -5.024
331 2HH2 ARG 37 2HH2 ARG 37 -2.162 18.341 -5.776
332 H PHE 38 H PHE 38 -0.891 16.369 3.458
333 HA PHE 38 HA PHE 38 -2.638 17.991 4.940
334 1HB PHE 38 2HB PHE 38 -0.725 15.822 5.526
335 2HB PHE 38 1HB PHE 38 -1.041 16.914 6.868
336 HD1 PHE 38 1HD PHE 38 -2.347 15.682 8.332
337 HD2 PHE 38 2HD PHE 38 -3.347 15.751 4.196
338 HE1 PHE 38 1HE PHE 38 -4.439 14.482 8.822
339 HE2 PHE 38 2HE PHE 38 -5.440 14.551 4.678
340 HZ PHE 38 HZ PHE 38 -5.989 13.915 6.993
341 H ASN 39 H ASN 39 0.900 17.744 5.378
342 HA ASN 39 HA ASN 39 1.139 20.074 6.909
343 1HB ASN 39 2HB ASN 39 3.089 18.486 5.265
344 2HB ASN 39 1HB ASN 39 3.588 19.967 6.074
345 1HD2 ASN 39 1HD2 ASN 39 2.188 16.784 6.591
346 2HD2 ASN 39 2HD2 ASN 39 2.729 16.609 8.223
347 H TRP 40 H TRP 40 0.646 19.680 3.560
348 HA TRP 40 HA TRP 40 1.871 22.052 2.598
349 1HB TRP 40 2HB TRP 40 1.347 20.253 1.052
350 2HB TRP 40 1HB TRP 40 -0.365 20.371 1.440
351 HD1 TRP 40 HD TRP 40 -1.782 22.018 0.026
352 HE1 TRP 40 1HE TRP 40 -1.260 23.702 -1.848
353 HE3 TRP 40 3HE TRP 40 3.324 21.958 0.275
354 HZ2 TRP 40 2HZ TRP 40 1.014 24.853 -3.061
355 HZ3 TRP 40 3HZ TRP 40 4.598 23.379 -1.277
356 HH2 TRP 40 HH TRP 40 3.465 24.796 -2.911
357 H LEU 41 H LEU 41 -1.616 21.363 2.604
358 HA LEU 41 HA LEU 41 -2.311 24.097 2.717
359 1HB LEU 41 2HB LEU 41 -4.479 23.410 2.592
360 2HB LEU 41 1HB LEU 41 -3.699 21.945 2.040
361 HG LEU 41 HG LEU 41 -5.360 21.224 3.522
362 1HD1 LEU 41 1HD1 LEU 41 -4.110 19.851 4.740
363 2HD1 LEU 41 2HD1 LEU 41 -3.385 21.175 5.650
364 3HD1 LEU 41 3HD1 LEU 41 -2.725 20.720 4.080
365 1HD2 LEU 41 1HD2 LEU 41 -5.326 23.712 4.560
366 2HD2 LEU 41 2HD2 LEU 41 -4.562 22.808 5.867
367 3HD2 LEU 41 3HD2 LEU 41 -6.165 22.346 5.297
368 H GLU 42 H GLU 42 -1.153 21.933 5.048
369 HA GLU 42 HA GLU 42 -2.403 22.860 7.360
370 1HB GLU 42 2HB GLU 42 -1.144 20.811 7.422
371 2HB GLU 42 1HB GLU 42 0.326 21.662 6.975
372 1HG GLU 42 2HG GLU 42 0.740 22.307 9.073
373 2HG GLU 42 1HG GLU 42 -0.956 22.665 9.403
374 H GLY 43 H GLY 43 0.888 23.588 6.213
375 1HA GLY 43 2HA GLY 43 1.901 25.698 6.069
376 2HA GLY 43 1HA GLY 43 0.539 26.388 6.941
377 H ALA 44 H ALA 44 2.711 23.702 7.780
378 HA ALA 44 HA ALA 44 2.944 24.519 10.478
379 1HB ALA 44 1HB ALA 44 4.316 22.487 8.774
380 2HB ALA 44 2HB ALA 44 3.299 22.259 10.197
381 3HB ALA 44 3HB ALA 44 4.949 22.857 10.378
382 H SER 45 H SER 45 5.168 24.768 7.716
383 HA SER 45 HA SER 45 7.197 26.118 9.196
384 1HB SER 45 2HB SER 45 7.189 24.819 6.826
385 2HB SER 45 1HB SER 45 7.101 26.486 6.257
386 H THR 46 H THR 46 4.430 27.128 7.315
387 HA THR 46 HA THR 46 5.230 29.919 7.365
388 HB THR 46 HB THR 46 3.117 30.309 6.152
389 HG1 THR 46 1HG THR 46 1.771 28.614 5.678
390 1HG2 THR 46 1HG2 THR 46 5.067 28.309 5.175
391 2HG2 THR 46 2HG2 THR 46 4.647 29.898 4.534
392 3HG2 THR 46 3HG2 THR 46 3.575 28.525 4.259
393 H LYS 47 H LYS 47 2.105 28.433 8.188
394 HA LYS 47 HA LYS 47 0.740 28.657 10.001
395 1HB LYS 47 2HB LYS 47 3.280 28.820 11.113
396 2HB LYS 47 1HB LYS 47 2.470 30.259 11.717
397 1HG LYS 47 2HG LYS 47 1.031 29.080 13.002
398 2HG LYS 47 1HG LYS 47 0.957 27.726 11.872
399 1HD LYS 47 2HD LYS 47 3.295 27.138 12.578
400 2HD LYS 47 1HD LYS 47 3.147 28.360 13.843
401 1HE LYS 47 2HE LYS 47 1.594 27.144 15.025
402 2HE LYS 47 1HE LYS 47 1.034 26.272 13.598
403 1HZ LYS 47 1HZ LYS 47 2.236 24.739 14.893
404 2HZ LYS 47 2HZ LYS 47 3.517 25.813 15.146
405 3HZ LYS 47 3HZ LYS 47 3.265 25.147 13.612
406 HA PRO 48 HA PRO 48 -0.987 32.654 9.267
407 1HB PRO 48 2HB PRO 48 -2.837 32.762 11.245
408 2HB PRO 48 1HB PRO 48 -3.018 31.728 9.823
409 1HG PRO 48 2HG PRO 48 -2.080 31.016 12.575
410 2HG PRO 48 1HG PRO 48 -3.194 30.137 11.511
411 1HD PRO 48 2HD PRO 48 -0.587 29.449 11.791
412 2HD PRO 48 1HD PRO 48 -1.483 29.213 10.276
413 H VAL 49 H VAL 49 -0.287 34.633 9.741
414 HA VAL 49 HA VAL 49 0.590 36.418 10.834
415 HB VAL 49 HB VAL 49 -0.590 35.053 13.254
416 1HG1 VAL 49 1HG1 VAL 49 0.743 37.710 12.911
417 2HG1 VAL 49 2HG1 VAL 49 0.928 36.525 14.204
418 3HG1 VAL 49 3HG1 VAL 49 -0.536 37.503 14.108
419 1HG2 VAL 49 1HG2 VAL 49 -2.351 36.817 12.967
420 2HG2 VAL 49 2HG2 VAL 49 -2.311 35.587 11.703
421 3HG2 VAL 49 3HG2 VAL 49 -1.628 37.185 11.401
422 H GLN 50 H GLN 50 1.051 34.041 13.438
423 HA GLN 50 HA GLN 50 2.928 33.069 14.301
424 1HB GLN 50 2HB GLN 50 3.578 33.078 11.726
425 2HB GLN 50 1HB GLN 50 4.733 34.290 12.263
426 1HG GLN 50 2HG GLN 50 5.263 32.466 14.094
427 2HG GLN 50 1HG GLN 50 4.604 31.388 12.864
428 1HE2 GLN 50 1HE2 GLN 50 7.196 31.137 13.656
429 2HE2 GLN 50 2HE2 GLN 50 8.254 31.636 12.385
430 H THR 51 H THR 51 4.722 33.664 15.629
431 HA THR 51 HA THR 51 4.543 36.387 16.551
432 HB THR 51 HB THR 51 6.499 34.319 17.537
433 HG1 THR 51 1HG THR 51 4.884 33.549 18.876
434 1HG2 THR 51 1HG2 THR 51 6.374 36.793 18.364
435 2HG2 THR 51 2HG2 THR 51 6.575 35.466 19.509
436 3HG2 THR 51 3HG2 THR 51 4.987 36.196 19.275
437 H SER 52 H SER 52 7.364 34.364 15.720
438 HA SER 52 HA SER 52 8.875 36.766 15.072
439 1HB SER 52 2HB SER 52 10.655 34.834 14.606
440 2HB SER 52 1HB SER 52 10.298 35.395 16.240
441 HG SER 52 HG SER 52 10.102 33.229 16.356
Start of MODEL 4
1 1H MET 1 1H MET 1 -1.856 -32.712 -3.095
2 HA MET 1 HA MET 1 -4.066 -33.524 -1.513
3 1HB MET 1 2HB MET 1 -2.191 -35.546 -1.675
4 2HB MET 1 1HB MET 1 -1.772 -34.746 -0.165
5 1HG MET 1 2HG MET 1 -4.010 -35.070 0.674
6 2HG MET 1 1HG MET 1 -4.516 -35.763 -0.866
7 1HE MET 1 1HE MET 1 -4.633 -37.696 2.252
8 2HE MET 1 2HE MET 1 -3.766 -36.169 2.418
9 3HE MET 1 3HE MET 1 -2.935 -37.694 2.727
10 H TRP 2 H TRP 2 -3.007 -33.390 1.044
11 HA TRP 2 HA TRP 2 -2.559 -31.803 2.618
12 1HB TRP 2 2HB TRP 2 -0.201 -32.043 0.873
13 2HB TRP 2 1HB TRP 2 -0.234 -30.594 1.873
14 HD1 TRP 2 HD TRP 2 -0.719 -31.175 4.624
15 HE1 TRP 2 1HE TRP 2 0.363 -33.048 6.020
16 HE3 TRP 2 3HE TRP 2 0.793 -34.248 0.828
17 HZ2 TRP 2 2HZ TRP 2 1.683 -35.503 5.571
18 HZ3 TRP 2 3HZ TRP 2 1.959 -36.339 1.396
19 HH2 TRP 2 HH TRP 2 2.394 -36.952 3.720
20 H ARG 3 H ARG 3 -1.157 -30.028 -0.123
21 HA ARG 3 HA ARG 3 -2.292 -27.575 0.731
22 1HB ARG 3 2HB ARG 3 -1.471 -26.753 -1.522
23 2HB ARG 3 1HB ARG 3 -0.253 -27.449 -0.462
24 1HG ARG 3 2HG ARG 3 -1.514 -29.357 -2.297
25 2HG ARG 3 1HG ARG 3 -0.574 -28.083 -3.076
26 1HD ARG 3 2HD ARG 3 1.068 -28.836 -1.024
27 2HD ARG 3 1HD ARG 3 0.308 -30.365 -1.466
28 HE ARG 3 HE ARG 3 1.486 -30.346 -3.429
29 1HH1 ARG 3 1HH1 ARG 3 1.618 -27.164 -2.000
30 2HH1 ARG 3 2HH1 ARG 3 2.788 -26.569 -3.130
31 1HH2 ARG 3 1HH2 ARG 3 3.025 -29.563 -4.916
32 2HH2 ARG 3 2HH2 ARG 3 3.586 -27.930 -4.785
33 H ILE 4 H ILE 4 -3.694 -30.165 -0.891
34 HA ILE 4 HA ILE 4 -5.405 -28.697 -2.648
35 HB ILE 4 HB ILE 4 -6.646 -30.750 -2.938
36 1HG1 ILE 4 2HG1 ILE 4 -4.962 -31.986 -0.752
37 2HG1 ILE 4 1HG1 ILE 4 -6.592 -31.379 -0.487
38 1HG2 ILE 4 1HG2 ILE 4 -4.865 -30.988 -4.311
39 2HG2 ILE 4 2HG2 ILE 4 -4.511 -32.332 -3.226
40 3HG2 ILE 4 3HG2 ILE 4 -3.693 -30.784 -3.009
41 1HD1 ILE 4 1HD1 ILE 4 -7.510 -32.996 -1.979
42 2HD1 ILE 4 2HD1 ILE 4 -6.453 -33.829 -0.839
43 3HD1 ILE 4 3HD1 ILE 4 -5.902 -33.515 -2.484
44 H TRP 5 H TRP 5 -5.358 -29.420 0.713
45 HA TRP 5 HA TRP 5 -8.135 -29.157 1.243
46 1HB TRP 5 2HB TRP 5 -5.666 -29.400 2.793
47 2HB TRP 5 1HB TRP 5 -6.852 -28.348 3.557
48 HD1 TRP 5 HD TRP 5 -7.038 -31.835 1.832
49 HE1 TRP 5 1HE TRP 5 -8.487 -33.362 3.314
50 HE3 TRP 5 3HE TRP 5 -8.162 -28.523 5.561
51 HZ2 TRP 5 2HZ TRP 5 -9.916 -33.186 5.741
52 HZ3 TRP 5 3HZ TRP 5 -9.575 -29.281 7.427
53 HH2 TRP 5 HH TRP 5 -10.435 -31.565 7.513
54 H GLN 6 H GLN 6 -5.770 -26.941 0.279
55 HA GLN 6 HA GLN 6 -6.103 -24.730 -0.306
56 1HB GLN 6 2HB GLN 6 -8.639 -25.262 0.350
57 2HB GLN 6 1HB GLN 6 -8.224 -24.248 1.725
58 1HG GLN 6 2HG GLN 6 -8.137 -22.373 0.489
59 2HG GLN 6 1HG GLN 6 -7.448 -23.196 -0.909
60 1HE2 GLN 6 1HE2 GLN 6 -9.815 -21.320 -0.368
61 2HE2 GLN 6 2HE2 GLN 6 -11.117 -22.064 -1.228
62 H LEU 7 H LEU 7 -4.065 -24.457 0.614
63 HA LEU 7 HA LEU 7 -4.066 -22.811 2.991
64 1HB LEU 7 2HB LEU 7 -2.098 -24.269 3.892
65 2HB LEU 7 1HB LEU 7 -3.759 -24.708 4.245
66 HG LEU 7 HG LEU 7 -2.531 -25.920 1.828
67 1HD1 LEU 7 1HD1 LEU 7 -1.770 -27.763 3.575
68 2HD1 LEU 7 2HD1 LEU 7 -1.557 -26.340 4.596
69 3HD1 LEU 7 3HD1 LEU 7 -0.699 -26.459 3.060
70 1HD2 LEU 7 1HD2 LEU 7 -4.562 -26.858 2.037
71 2HD2 LEU 7 2HD2 LEU 7 -4.685 -26.453 3.749
72 3HD2 LEU 7 3HD2 LEU 7 -3.774 -27.874 3.242
73 H PHE 8 H PHE 8 -2.140 -24.468 0.520
74 HA PHE 8 HA PHE 8 -0.532 -22.023 0.265
75 1HB PHE 8 2HB PHE 8 0.408 -24.797 0.769
76 2HB PHE 8 1HB PHE 8 1.332 -23.838 -0.384
77 HD1 PHE 8 1HD PHE 8 1.191 -24.786 2.914
78 HD2 PHE 8 2HD PHE 8 1.708 -21.304 0.522
79 HE1 PHE 8 1HE PHE 8 2.361 -23.685 4.777
80 HE2 PHE 8 2HE PHE 8 2.880 -20.197 2.381
81 HZ PHE 8 HZ PHE 8 3.207 -21.388 4.512
82 H ASP 9 H ASP 9 -2.801 -22.972 -1.255
83 HA ASP 9 HA ASP 9 -1.892 -24.111 -3.709
84 1HB ASP 9 2HB ASP 9 -4.184 -23.315 -4.532
85 2HB ASP 9 1HB ASP 9 -4.169 -24.484 -3.218
86 HA PRO 10 HA PRO 10 -0.387 -20.833 -6.213
87 1HB PRO 10 2HB PRO 10 -2.795 -21.166 -7.953
88 2HB PRO 10 1HB PRO 10 -1.085 -21.095 -8.398
89 1HG PRO 10 2HG PRO 10 -2.362 -23.425 -8.338
90 2HG PRO 10 1HG PRO 10 -0.691 -23.293 -7.762
91 1HD PRO 10 2HD PRO 10 -3.217 -23.559 -6.208
92 2HD PRO 10 1HD PRO 10 -1.594 -24.177 -5.842
93 H ARG 11 H ARG 11 -3.946 -20.671 -5.954
94 HA ARG 11 HA ARG 11 -4.254 -17.950 -6.381
95 1HB ARG 11 2HB ARG 11 -6.356 -18.188 -5.001
96 2HB ARG 11 1HB ARG 11 -6.198 -19.311 -6.343
97 1HG ARG 11 2HG ARG 11 -6.773 -20.849 -4.827
98 2HG ARG 11 1HG ARG 11 -5.081 -20.748 -4.336
99 1HD ARG 11 2HD ARG 11 -6.085 -20.433 -2.311
100 2HD ARG 11 1HD ARG 11 -5.995 -18.760 -2.859
101 HE ARG 11 HE ARG 11 -8.434 -20.095 -3.593
102 1HH1 ARG 11 1HH1 ARG 11 -6.807 -18.265 -1.106
103 2HH1 ARG 11 2HH1 ARG 11 -8.278 -17.695 -0.390
104 1HH2 ARG 11 1HH2 ARG 11 -10.368 -19.345 -2.653
105 2HH2 ARG 11 2HH2 ARG 11 -10.298 -18.307 -1.267
106 H GLN 12 H GLN 12 -3.855 -19.638 -3.266
107 HA GLN 12 HA GLN 12 -3.902 -17.366 -1.636
108 1HB GLN 12 2HB GLN 12 -4.058 -19.733 -0.850
109 2HB GLN 12 1HB GLN 12 -2.332 -19.901 -1.143
110 1HG GLN 12 2HG GLN 12 -3.445 -17.803 0.689
111 2HG GLN 12 1HG GLN 12 -3.074 -19.436 1.239
112 1HE2 GLN 12 1HE2 GLN 12 -0.780 -20.067 0.078
113 2HE2 GLN 12 2HE2 GLN 12 0.478 -18.967 0.514
114 H ALA 13 H ALA 13 -1.248 -18.939 -3.344
115 HA ALA 13 HA ALA 13 0.849 -17.422 -2.219
116 1HB ALA 13 1HB ALA 13 1.164 -19.550 -3.431
117 2HB ALA 13 2HB ALA 13 2.209 -18.260 -4.026
118 3HB ALA 13 3HB ALA 13 0.772 -18.722 -4.938
119 H LEU 14 H LEU 14 -1.175 -16.930 -5.079
120 HA LEU 14 HA LEU 14 0.240 -14.703 -6.093
121 1HB LEU 14 2HB LEU 14 -2.520 -15.796 -6.490
122 2HB LEU 14 1HB LEU 14 -2.100 -14.231 -7.159
123 HG LEU 14 HG LEU 14 -0.386 -16.615 -7.752
124 1HD1 LEU 14 1HD1 LEU 14 -2.492 -15.938 -9.698
125 2HD1 LEU 14 2HD1 LEU 14 -3.023 -16.787 -8.246
126 3HD1 LEU 14 3HD1 LEU 14 -1.786 -17.499 -9.282
127 1HD2 LEU 14 1HD2 LEU 14 -0.787 -13.877 -8.790
128 2HD2 LEU 14 2HD2 LEU 14 -0.453 -15.135 -9.980
129 3HD2 LEU 14 3HD2 LEU 14 0.684 -14.842 -8.664
130 H VAL 15 H VAL 15 -2.561 -14.987 -3.942
131 HA VAL 15 HA VAL 15 -2.968 -12.184 -3.681
132 HB VAL 15 HB VAL 15 -4.341 -12.772 -1.699
133 1HG1 VAL 15 1HG1 VAL 15 -5.000 -13.025 -4.238
134 2HG1 VAL 15 2HG1 VAL 15 -6.098 -13.528 -2.952
135 3HG1 VAL 15 3HG1 VAL 15 -5.122 -14.728 -3.799
136 1HG2 VAL 15 1HG2 VAL 15 -2.999 -14.662 -0.908
137 2HG2 VAL 15 2HG2 VAL 15 -3.494 -15.599 -2.317
138 3HG2 VAL 15 3HG2 VAL 15 -4.691 -15.111 -1.119
139 H GLY 16 H GLY 16 -0.751 -14.419 -2.271
140 1HA GLY 16 2HA GLY 16 -0.196 -12.918 0.107
141 2HA GLY 16 1HA GLY 16 0.772 -14.233 -0.547
142 H LEU 17 H LEU 17 1.501 -13.360 -2.976
143 HA LEU 17 HA LEU 17 3.605 -11.549 -2.424
144 1HB LEU 17 2HB LEU 17 2.609 -11.926 -5.213
145 2HB LEU 17 1HB LEU 17 4.257 -11.807 -4.632
146 HG LEU 17 HG LEU 17 2.829 -14.191 -3.716
147 1HD1 LEU 17 1HD1 LEU 17 2.056 -13.676 -6.145
148 2HD1 LEU 17 2HD1 LEU 17 2.572 -15.304 -5.708
149 3HD1 LEU 17 3HD1 LEU 17 3.675 -14.233 -6.570
150 1HD2 LEU 17 1HD2 LEU 17 5.047 -15.112 -4.798
151 2HD2 LEU 17 2HD2 LEU 17 5.058 -14.295 -3.236
152 3HD2 LEU 17 3HD2 LEU 17 5.522 -13.417 -4.693
153 H ALA 18 H ALA 18 0.724 -11.251 -4.421
154 HA ALA 18 HA ALA 18 0.923 -8.569 -5.103
155 1HB ALA 18 1HB ALA 18 -1.313 -8.674 -5.784
156 2HB ALA 18 2HB ALA 18 -1.724 -9.875 -4.560
157 3HB ALA 18 3HB ALA 18 -0.726 -10.329 -5.942
158 H THR 19 H THR 19 -0.437 -10.014 -2.178
159 HA THR 19 HA THR 19 -1.542 -7.614 -1.149
160 HB THR 19 HB THR 19 -0.810 -10.260 0.081
161 HG1 THR 19 1HG THR 19 -2.716 -10.151 -1.128
162 1HG2 THR 19 1HG2 THR 19 -1.911 -7.869 1.532
163 2HG2 THR 19 2HG2 THR 19 -0.447 -8.777 1.907
164 3HG2 THR 19 3HG2 THR 19 -2.029 -9.527 2.122
165 H PHE 20 H PHE 20 1.571 -9.233 -0.679
166 HA PHE 20 HA PHE 20 2.594 -7.536 1.302
167 1HB PHE 20 2HB PHE 20 3.612 -9.698 0.706
168 2HB PHE 20 1HB PHE 20 4.107 -9.034 -0.847
169 HD1 PHE 20 1HD PHE 20 5.673 -7.002 -0.803
170 HD2 PHE 20 2HD PHE 20 5.006 -9.536 2.550
171 HE1 PHE 20 1HE PHE 20 7.777 -6.220 0.202
172 HE2 PHE 20 2HE PHE 20 7.109 -8.757 3.562
173 HZ PHE 20 HZ PHE 20 8.498 -7.097 2.388
174 H LEU 21 H LEU 21 3.057 -7.427 -2.232
175 HA LEU 21 HA LEU 21 4.561 -5.030 -2.208
176 1HB LEU 21 2HB LEU 21 4.055 -4.949 -4.633
177 2HB LEU 21 1HB LEU 21 4.699 -6.491 -4.103
178 HG LEU 21 HG LEU 21 2.094 -7.069 -3.935
179 1HD1 LEU 21 1HD1 LEU 21 0.703 -5.859 -5.223
180 2HD1 LEU 21 2HD1 LEU 21 1.941 -5.530 -6.435
181 3HD1 LEU 21 3HD1 LEU 21 1.884 -4.578 -4.951
182 1HD2 LEU 21 1HD2 LEU 21 2.330 -7.880 -6.351
183 2HD2 LEU 21 2HD2 LEU 21 3.503 -8.465 -5.172
184 3HD2 LEU 21 3HD2 LEU 21 3.947 -7.177 -6.292
185 H PHE 22 H PHE 22 1.137 -5.690 -2.850
186 HA PHE 22 HA PHE 22 0.297 -3.115 -3.443
187 1HB PHE 22 2HB PHE 22 -1.101 -5.112 -3.745
188 2HB PHE 22 1HB PHE 22 -1.248 -5.277 -1.999
189 HD1 PHE 22 1HD PHE 22 -1.872 -2.807 -4.719
190 HD2 PHE 22 2HD PHE 22 -3.076 -4.363 -0.945
191 HE1 PHE 22 1HE PHE 22 -3.853 -1.348 -4.754
192 HE2 PHE 22 2HE PHE 22 -5.060 -2.907 -0.974
193 HZ PHE 22 HZ PHE 22 -5.450 -1.397 -2.880
194 H VAL 23 H VAL 23 0.390 -4.714 -0.256
195 HA VAL 23 HA VAL 23 -0.661 -2.541 1.181
196 HB VAL 23 HB VAL 23 0.132 -3.659 3.176
197 1HG1 VAL 23 1HG1 VAL 23 -1.252 -5.151 1.038
198 2HG1 VAL 23 2HG1 VAL 23 -1.806 -4.706 2.652
199 3HG1 VAL 23 3HG1 VAL 23 -0.723 -6.081 2.440
200 1HG2 VAL 23 1HG2 VAL 23 2.324 -4.352 2.603
201 2HG2 VAL 23 2HG2 VAL 23 1.727 -5.345 1.275
202 3HG2 VAL 23 3HG2 VAL 23 1.401 -5.815 2.941
203 H LEU 24 H LEU 24 2.712 -3.585 0.701
204 HA LEU 24 HA LEU 24 3.908 -1.581 2.235
205 1HB LEU 24 2HB LEU 24 5.435 -3.180 1.720
206 2HB LEU 24 1HB LEU 24 4.759 -3.467 0.130
207 HG LEU 24 HG LEU 24 6.311 -0.961 0.659
208 1HD1 LEU 24 1HD1 LEU 24 8.361 -2.058 0.072
209 2HD1 LEU 24 2HD1 LEU 24 7.526 -3.596 -0.147
210 3HD1 LEU 24 3HD1 LEU 24 7.658 -2.885 1.461
211 1HD2 LEU 24 1HD2 LEU 24 5.247 -2.436 -1.643
212 2HD2 LEU 24 2HD2 LEU 24 6.897 -1.847 -1.843
213 3HD2 LEU 24 3HD2 LEU 24 5.599 -0.717 -1.457
214 H ALA 25 H ALA 25 3.077 -1.660 -1.207
215 HA ALA 25 HA ALA 25 4.168 0.821 -1.920
216 1HB ALA 25 1HB ALA 25 3.562 -0.729 -3.630
217 2HB ALA 25 2HB ALA 25 2.566 0.711 -3.838
218 3HB ALA 25 3HB ALA 25 1.880 -0.738 -3.105
219 H LEU 26 H LEU 26 0.763 0.014 -1.191
220 HA LEU 26 HA LEU 26 -0.140 2.677 -1.237
221 1HB LEU 26 2HB LEU 26 -2.187 1.877 -0.463
222 2HB LEU 26 1HB LEU 26 -1.512 0.520 -1.343
223 HG LEU 26 HG LEU 26 -0.640 -0.113 1.109
224 1HD1 LEU 26 1HD1 LEU 26 -3.320 1.032 1.763
225 2HD1 LEU 26 2HD1 LEU 26 -1.874 2.032 1.897
226 3HD1 LEU 26 3HD1 LEU 26 -2.012 0.549 2.843
227 1HD2 LEU 26 1HD2 LEU 26 -2.454 -1.669 1.237
228 2HD2 LEU 26 2HD2 LEU 26 -2.030 -1.462 -0.462
229 3HD2 LEU 26 3HD2 LEU 26 -3.458 -0.662 0.196
230 H LEU 27 H LEU 27 1.406 0.777 1.235
231 HA LEU 27 HA LEU 27 0.688 2.311 3.483
232 1HB LEU 27 2HB LEU 27 2.746 0.304 2.817
233 2HB LEU 27 1HB LEU 27 3.148 1.377 4.142
234 1HD1 LEU 27 1HD1 LEU 27 -0.557 0.612 4.654
235 2HD1 LEU 27 2HD1 LEU 27 -0.272 -1.074 4.225
236 3HD1 LEU 27 3HD1 LEU 27 -0.004 0.196 3.032
237 1HD2 LEU 27 1HD2 LEU 27 1.806 -1.949 3.899
238 2HD2 LEU 27 2HD2 LEU 27 1.881 -1.725 5.647
239 3HD2 LEU 27 3HD2 LEU 27 3.227 -1.205 4.632
240 H ILE 28 H ILE 28 3.760 2.332 1.661
241 HA ILE 28 HA ILE 28 4.776 4.653 2.884
242 HB ILE 28 HB ILE 28 5.453 3.650 0.117
243 1HG1 ILE 28 2HG1 ILE 28 7.183 2.934 2.403
244 2HG1 ILE 28 1HG1 ILE 28 5.612 2.138 2.376
245 1HG2 ILE 28 1HG2 ILE 28 6.538 5.657 0.248
246 2HG2 ILE 28 2HG2 ILE 28 7.746 4.611 0.995
247 3HG2 ILE 28 3HG2 ILE 28 6.682 5.591 2.004
248 1HD1 ILE 28 1HD1 ILE 28 7.678 2.088 0.190
249 2HD1 ILE 28 2HD1 ILE 28 6.083 1.338 0.103
250 3HD1 ILE 28 3HD1 ILE 28 7.264 0.768 1.283
251 H HIS 29 H HIS 29 3.025 4.185 -0.164
252 HA HIS 29 HA HIS 29 3.126 6.831 -1.068
253 1HB HIS 29 2HB HIS 29 1.047 4.687 -1.536
254 2HB HIS 29 1HB HIS 29 1.107 6.213 -2.413
255 HD1 HIS 29 1HD HIS 29 1.489 3.264 -3.617
256 HD2 HIS 29 2HD HIS 29 4.472 6.048 -2.835
257 HE1 HIS 29 1HE HIS 29 3.406 2.635 -5.118
258 HE2 HIS 29 2HE HIS 29 5.229 4.286 -4.571
259 H PHE 30 H PHE 30 0.790 5.180 0.998
260 HA PHE 30 HA PHE 30 -1.052 7.286 1.210
261 1HB PHE 30 2HB PHE 30 -1.625 4.987 1.807
262 2HB PHE 30 1HB PHE 30 -0.484 5.035 3.146
263 HD1 PHE 30 1HD PHE 30 -0.903 6.744 4.993
264 HD2 PHE 30 2HD PHE 30 -3.829 5.656 2.102
265 HE1 PHE 30 1HE PHE 30 -2.675 7.596 6.473
266 HE2 PHE 30 2HE PHE 30 -5.608 6.507 3.576
267 HZ PHE 30 HZ PHE 30 -5.031 7.478 5.764
268 H ILE 31 H ILE 31 1.822 6.471 3.125
269 HA ILE 31 HA ILE 31 1.311 8.420 5.130
270 HB ILE 31 HB ILE 31 3.010 6.329 5.010
271 1HG1 ILE 31 2HG1 ILE 31 2.197 7.515 7.021
272 2HG1 ILE 31 1HG1 ILE 31 3.909 7.115 7.128
273 1HG2 ILE 31 1HG2 ILE 31 5.311 7.120 5.036
274 2HG2 ILE 31 2HG2 ILE 31 4.767 8.750 4.640
275 3HG2 ILE 31 3HG2 ILE 31 4.552 7.441 3.478
276 1HD1 ILE 31 1HD1 ILE 31 2.640 9.788 6.674
277 2HD1 ILE 31 2HD1 ILE 31 4.339 9.487 6.312
278 3HD1 ILE 31 3HD1 ILE 31 3.739 9.286 7.958
279 H LEU 32 H LEU 32 3.435 8.398 2.268
280 HA LEU 32 HA LEU 32 4.443 11.005 2.661
281 1HB LEU 32 2HB LEU 32 5.082 10.878 0.253
282 2HB LEU 32 1HB LEU 32 5.652 9.541 1.231
283 HG LEU 32 HG LEU 32 3.404 8.427 0.313
284 1HD1 LEU 32 1HD1 LEU 32 2.535 9.297 -1.554
285 2HD1 LEU 32 2HD1 LEU 32 4.119 9.693 -2.220
286 3HD1 LEU 32 3HD1 LEU 32 3.348 10.785 -1.070
287 1HD2 LEU 32 1HD2 LEU 32 5.023 7.057 -0.349
288 2HD2 LEU 32 2HD2 LEU 32 6.197 8.372 -0.372
289 3HD2 LEU 32 3HD2 LEU 32 5.207 8.048 -1.795
290 H LEU 33 H LEU 33 1.860 9.793 0.531
291 HA LEU 33 HA LEU 33 1.086 12.284 -0.488
292 1HB LEU 33 2HB LEU 33 -0.166 10.920 -1.725
293 2HB LEU 33 1HB LEU 33 0.198 9.589 -0.657
294 HG LEU 33 HG LEU 33 -2.050 11.493 -0.060
295 1HD1 LEU 33 1HD1 LEU 33 -2.664 8.896 -1.318
296 2HD1 LEU 33 2HD1 LEU 33 -2.013 10.145 -2.381
297 3HD1 LEU 33 3HD1 LEU 33 -3.485 10.451 -1.458
298 1HD2 LEU 33 1HD2 LEU 33 -2.196 10.233 1.765
299 2HD2 LEU 33 2HD2 LEU 33 -0.901 9.185 1.189
300 3HD2 LEU 33 3HD2 LEU 33 -2.572 8.849 0.739
301 H SER 34 H SER 34 0.111 10.526 2.406
302 HA SER 34 HA SER 34 -1.974 12.223 3.220
303 1HB SER 34 2HB SER 34 -1.759 10.079 4.271
304 2HB SER 34 1HB SER 34 -0.118 10.439 4.805
305 HG SER 34 HG SER 34 -1.387 10.803 6.551
306 H THR 35 H THR 35 1.476 12.190 4.112
307 HA THR 35 HA THR 35 1.411 14.399 5.830
308 HB THR 35 HB THR 35 3.716 13.558 4.066
309 HG1 THR 35 1HG THR 35 3.426 11.765 5.151
310 1HG2 THR 35 1HG2 THR 35 3.595 15.076 6.651
311 2HG2 THR 35 2HG2 THR 35 4.304 15.582 5.117
312 3HG2 THR 35 3HG2 THR 35 5.060 14.295 6.055
313 H GLU 36 H GLU 36 1.998 14.223 2.338
314 HA GLU 36 HA GLU 36 2.576 16.945 1.944
315 1HB GLU 36 2HB GLU 36 2.680 14.785 0.358
316 2HB GLU 36 1HB GLU 36 1.162 15.466 -0.210
317 1HG GLU 36 2HG GLU 36 2.533 17.671 -0.381
318 2HG GLU 36 1HG GLU 36 3.920 16.583 -0.381
319 H ARG 37 H ARG 37 -0.476 15.149 1.591
320 HA ARG 37 HA ARG 37 -2.045 17.388 0.888
321 1HB ARG 37 2HB ARG 37 -2.491 14.733 0.894
322 2HB ARG 37 1HB ARG 37 -3.331 15.167 2.377
323 1HG ARG 37 2HG ARG 37 -4.314 17.048 0.732
324 2HG ARG 37 1HG ARG 37 -4.008 15.754 -0.429
325 1HD ARG 37 2HD ARG 37 -5.757 15.688 2.016
326 2HD ARG 37 1HD ARG 37 -6.227 15.454 0.333
327 HE ARG 37 HE ARG 37 -5.127 13.489 2.118
328 1HH1 ARG 37 1HH1 ARG 37 -5.556 14.396 -1.224
329 2HH1 ARG 37 2HH1 ARG 37 -5.405 12.774 -1.814
330 1HH2 ARG 37 1HH2 ARG 37 -4.929 11.355 1.344
331 2HH2 ARG 37 2HH2 ARG 37 -5.050 11.048 -0.356
332 H PHE 38 H PHE 38 -1.047 16.027 3.944
333 HA PHE 38 HA PHE 38 -2.866 17.349 5.628
334 1HB PHE 38 2HB PHE 38 -0.311 15.918 5.936
335 2HB PHE 38 1HB PHE 38 -0.617 17.136 7.170
336 HD1 PHE 38 1HD PHE 38 -3.290 17.045 7.886
337 HD2 PHE 38 2HD PHE 38 -0.859 13.801 6.591
338 HE1 PHE 38 1HE PHE 38 -4.764 15.472 9.072
339 HE2 PHE 38 2HE PHE 38 -2.329 12.222 7.774
340 HZ PHE 38 HZ PHE 38 -4.286 13.058 9.016
341 H ASN 39 H ASN 39 0.565 18.169 5.075
342 HA ASN 39 HA ASN 39 0.467 20.699 6.252
343 1HB ASN 39 2HB ASN 39 2.309 19.317 4.369
344 2HB ASN 39 1HB ASN 39 2.468 21.064 4.526
345 1HD2 ASN 39 1HD2 ASN 39 1.954 18.278 6.670
346 2HD2 ASN 39 2HD2 ASN 39 3.143 18.741 7.834
347 H TRP 40 H TRP 40 -0.674 19.615 3.215
348 HA TRP 40 HA TRP 40 -0.611 22.062 1.780
349 1HB TRP 40 2HB TRP 40 -1.406 19.391 1.254
350 2HB TRP 40 1HB TRP 40 -2.813 20.403 0.947
351 HD1 TRP 40 HD TRP 40 -0.603 22.845 -0.018
352 HE1 TRP 40 1HE TRP 40 0.167 22.699 -2.469
353 HE3 TRP 40 3HE TRP 40 -1.846 17.977 -0.976
354 HZ2 TRP 40 2HZ TRP 40 0.237 20.779 -4.534
355 HZ3 TRP 40 3HZ TRP 40 -1.395 17.064 -3.215
356 HH2 TRP 40 HH TRP 40 -0.375 18.438 -4.956
357 H LEU 41 H LEU 41 -3.455 20.302 2.970
358 HA LEU 41 HA LEU 41 -5.102 22.595 3.047
359 1HB LEU 41 2HB LEU 41 -5.450 20.111 4.723
360 2HB LEU 41 1HB LEU 41 -6.695 21.227 4.198
361 HG LEU 41 HG LEU 41 -5.168 19.848 2.064
362 1HD1 LEU 41 1HD1 LEU 41 -5.957 17.754 2.386
363 2HD1 LEU 41 2HD1 LEU 41 -7.424 18.311 3.189
364 3HD1 LEU 41 3HD1 LEU 41 -5.903 18.248 4.078
365 1HD2 LEU 41 1HD2 LEU 41 -7.036 20.225 0.828
366 2HD2 LEU 41 2HD2 LEU 41 -7.238 21.512 2.015
367 3HD2 LEU 41 3HD2 LEU 41 -8.125 19.998 2.196
368 H GLU 42 H GLU 42 -2.575 21.490 5.027
369 HA GLU 42 HA GLU 42 -3.380 22.424 7.529
370 1HB GLU 42 2HB GLU 42 -1.468 20.927 7.253
371 2HB GLU 42 1HB GLU 42 -0.593 22.201 6.417
372 1HG GLU 42 2HG GLU 42 0.246 22.157 8.609
373 2HG GLU 42 1HG GLU 42 -0.806 23.569 8.517
374 H GLY 43 H GLY 43 -1.382 23.952 5.013
375 1HA GLY 43 2HA GLY 43 -2.430 26.547 5.624
376 2HA GLY 43 1HA GLY 43 -0.797 26.343 6.231
377 H ALA 44 H ALA 44 0.015 24.617 3.989
378 HA ALA 44 HA ALA 44 0.974 26.621 2.258
379 1HB ALA 44 1HB ALA 44 1.717 24.088 2.772
380 2HB ALA 44 2HB ALA 44 2.248 24.992 1.353
381 3HB ALA 44 3HB ALA 44 0.903 23.859 1.225
382 H SER 45 H SER 45 -1.611 24.219 1.864
383 HA SER 45 HA SER 45 -2.274 25.036 -0.786
384 1HB SER 45 2HB SER 45 -2.771 22.779 0.371
385 2HB SER 45 1HB SER 45 -4.167 23.602 1.064
386 H THR 46 H THR 46 -3.170 26.114 2.385
387 HA THR 46 HA THR 46 -5.490 27.575 1.441
388 HB THR 46 HB THR 46 -5.791 28.245 3.744
389 HG1 THR 46 1HG THR 46 -4.229 27.656 5.307
390 1HG2 THR 46 1HG2 THR 46 -5.888 26.114 4.912
391 2HG2 THR 46 2HG2 THR 46 -4.892 25.376 3.657
392 3HG2 THR 46 3HG2 THR 46 -6.505 25.973 3.266
393 H LYS 47 H LYS 47 -2.126 28.136 2.028
394 HA LYS 47 HA LYS 47 -2.290 30.747 0.855
395 1HB LYS 47 2HB LYS 47 -1.773 30.421 3.794
396 2HB LYS 47 1HB LYS 47 -1.030 31.745 2.908
397 1HG LYS 47 2HG LYS 47 -3.480 32.179 2.098
398 2HG LYS 47 1HG LYS 47 -3.896 31.265 3.549
399 1HD LYS 47 2HD LYS 47 -2.085 33.677 3.513
400 2HD LYS 47 1HD LYS 47 -3.806 33.729 3.900
401 1HE LYS 47 2HE LYS 47 -2.184 31.764 5.394
402 2HE LYS 47 1HE LYS 47 -1.872 33.462 5.749
403 1HZ LYS 47 1HZ LYS 47 -4.657 32.567 5.668
404 2HZ LYS 47 2HZ LYS 47 -3.933 33.755 6.630
405 3HZ LYS 47 3HZ LYS 47 -3.723 32.119 7.006
406 HA PRO 48 HA PRO 48 1.696 28.409 0.288
407 1HB PRO 48 2HB PRO 48 1.685 28.425 -2.413
408 2HB PRO 48 1HB PRO 48 0.833 27.195 -1.471
409 1HG PRO 48 2HG PRO 48 -0.247 29.653 -2.796
410 2HG PRO 48 1HG PRO 48 -0.925 28.015 -2.755
411 1HD PRO 48 2HD PRO 48 -1.794 30.020 -1.136
412 2HD PRO 48 1HD PRO 48 -1.838 28.310 -0.666
413 H VAL 49 H VAL 49 0.476 31.131 -1.660
414 HA VAL 49 HA VAL 49 2.903 32.626 -1.034
415 HB VAL 49 HB VAL 49 1.940 32.385 -3.884
416 1HG1 VAL 49 1HG1 VAL 49 4.642 33.348 -3.120
417 2HG1 VAL 49 2HG1 VAL 49 3.273 34.428 -2.857
418 3HG1 VAL 49 3HG1 VAL 49 3.615 33.815 -4.474
419 1HG2 VAL 49 1HG2 VAL 49 4.230 31.182 -4.108
420 2HG2 VAL 49 2HG2 VAL 49 2.829 30.278 -3.536
421 3HG2 VAL 49 3HG2 VAL 49 4.032 30.862 -2.386
422 H GLN 50 H GLN 50 2.516 34.731 -0.681
423 HA GLN 50 HA GLN 50 1.268 36.585 -0.192
424 1HB GLN 50 2HB GLN 50 0.223 36.221 -2.998
425 2HB GLN 50 1HB GLN 50 0.429 37.728 -2.115
426 1HG GLN 50 2HG GLN 50 2.961 36.767 -2.090
427 2HG GLN 50 1HG GLN 50 2.374 36.143 -3.630
428 1HE2 GLN 50 1HE2 GLN 50 2.901 39.041 -1.734
429 2HE2 GLN 50 2HE2 GLN 50 2.942 40.137 -3.068
430 H THR 51 H THR 51 0.004 34.220 0.678
431 HA THR 51 HA THR 51 -1.993 33.397 1.397
432 HB THR 51 HB THR 51 -3.555 34.978 2.209
433 HG1 THR 51 1HG THR 51 -2.483 36.935 0.469
434 1HG2 THR 51 1HG2 THR 51 -0.820 35.455 2.605
435 2HG2 THR 51 2HG2 THR 51 -2.168 35.925 3.639
436 3HG2 THR 51 3HG2 THR 51 -1.584 37.030 2.396
437 H SER 52 H SER 52 -1.718 32.620 -1.077
438 HA SER 52 HA SER 52 -3.982 33.479 -2.691
439 1HB SER 52 2HB SER 52 -1.672 33.007 -3.650
440 2HB SER 52 1HB SER 52 -2.001 31.298 -3.359
441 HG SER 52 HG SER 52 -3.937 31.635 -4.663
Start of MODEL 5
1 1H MET 1 1H MET 1 -1.664 -35.486 -4.679
2 HA MET 1 HA MET 1 -2.664 -36.049 -2.083
3 1HB MET 1 2HB MET 1 -0.467 -36.392 -0.905
4 2HB MET 1 1HB MET 1 -0.998 -37.754 -1.881
5 1HG MET 1 2HG MET 1 0.507 -36.976 -3.689
6 2HG MET 1 1HG MET 1 1.099 -35.722 -2.603
7 1HE MET 1 1HE MET 1 0.143 -39.283 -1.150
8 2HE MET 1 2HE MET 1 1.542 -40.216 -1.677
9 3HE MET 1 3HE MET 1 0.433 -39.539 -2.870
10 H TRP 2 H TRP 2 -1.691 -34.515 -0.412
11 HA TRP 2 HA TRP 2 -1.607 -32.280 0.123
12 1HB TRP 2 2HB TRP 2 0.908 -33.082 -1.223
13 2HB TRP 2 1HB TRP 2 0.677 -31.354 -0.974
14 HD1 TRP 2 HD TRP 2 1.796 -34.430 0.784
15 HE1 TRP 2 1HE TRP 2 2.217 -33.930 3.274
16 HE3 TRP 2 3HE TRP 2 -0.390 -29.817 1.067
17 HZ2 TRP 2 2HZ TRP 2 1.690 -31.856 5.114
18 HZ3 TRP 2 3HZ TRP 2 -0.389 -28.642 3.228
19 HH2 TRP 2 HH TRP 2 0.630 -29.641 5.209
20 H ARG 3 H ARG 3 -3.493 -32.251 -1.654
21 HA ARG 3 HA ARG 3 -4.591 -31.037 -3.235
22 1HB ARG 3 2HB ARG 3 -2.506 -29.115 -2.260
23 2HB ARG 3 1HB ARG 3 -3.567 -28.661 -3.586
24 1HG ARG 3 2HG ARG 3 -5.510 -29.185 -2.104
25 2HG ARG 3 1HG ARG 3 -4.362 -29.400 -0.782
26 1HD ARG 3 2HD ARG 3 -4.869 -27.206 -0.457
27 2HD ARG 3 1HD ARG 3 -3.547 -27.014 -1.607
28 HE ARG 3 HE ARG 3 -5.040 -26.139 -3.086
29 1HH1 ARG 3 1HH1 ARG 3 -6.809 -27.998 -0.721
30 2HH1 ARG 3 2HH1 ARG 3 -8.361 -27.537 -1.338
31 1HH2 ARG 3 1HH2 ARG 3 -7.079 -25.531 -3.897
32 2HH2 ARG 3 2HH2 ARG 3 -8.514 -26.137 -3.140
33 H ILE 4 H ILE 4 -2.727 -32.902 -4.214
34 HA ILE 4 HA ILE 4 -1.555 -33.502 -6.079
35 HB ILE 4 HB ILE 4 -3.052 -31.274 -7.450
36 1HG1 ILE 4 2HG1 ILE 4 -4.613 -32.597 -6.077
37 2HG1 ILE 4 1HG1 ILE 4 -4.884 -32.860 -7.797
38 1HG2 ILE 4 1HG2 ILE 4 -2.467 -32.232 -9.392
39 2HG2 ILE 4 2HG2 ILE 4 -2.685 -33.867 -8.768
40 3HG2 ILE 4 3HG2 ILE 4 -1.190 -32.990 -8.441
41 1HD1 ILE 4 1HD1 ILE 4 -5.028 -34.930 -6.522
42 2HD1 ILE 4 2HD1 ILE 4 -3.371 -34.704 -5.964
43 3HD1 ILE 4 3HD1 ILE 4 -3.696 -34.973 -7.676
44 H TRP 5 H TRP 5 -0.210 -31.680 -4.407
45 HA TRP 5 HA TRP 5 1.376 -30.006 -4.343
46 1HB TRP 5 2HB TRP 5 3.341 -30.618 -5.656
47 2HB TRP 5 1HB TRP 5 2.586 -32.052 -4.969
48 HD1 TRP 5 HD TRP 5 3.228 -30.315 -8.313
49 HE1 TRP 5 1HE TRP 5 2.774 -31.992 -10.214
50 HE3 TRP 5 3HE TRP 5 1.230 -34.135 -5.567
51 HZ2 TRP 5 2HZ TRP 5 1.710 -34.590 -10.509
52 HZ3 TRP 5 3HZ TRP 5 0.518 -36.182 -6.733
53 HH2 TRP 5 HH TRP 5 0.754 -36.402 -9.154
54 H GLN 6 H GLN 6 -0.884 -29.146 -5.871
55 HA GLN 6 HA GLN 6 0.220 -26.883 -7.129
56 1HB GLN 6 2HB GLN 6 0.791 -28.395 -8.931
57 2HB GLN 6 1HB GLN 6 -0.852 -29.018 -8.983
58 1HG GLN 6 2HG GLN 6 -1.567 -26.648 -9.556
59 2HG GLN 6 1HG GLN 6 0.144 -26.317 -9.824
60 1HE2 GLN 6 1HE2 GLN 6 -2.518 -28.405 -10.811
61 2HE2 GLN 6 2HE2 GLN 6 -1.936 -28.694 -12.412
62 H LEU 7 H LEU 7 -2.615 -28.604 -8.358
63 HA LEU 7 HA LEU 7 -4.822 -28.075 -8.367
64 1HB LEU 7 2HB LEU 7 -3.928 -27.657 -5.586
65 2HB LEU 7 1HB LEU 7 -5.456 -26.904 -6.004
66 HG LEU 7 HG LEU 7 -4.781 -29.838 -6.159
67 1HD1 LEU 7 1HD1 LEU 7 -6.010 -30.125 -4.283
68 2HD1 LEU 7 2HD1 LEU 7 -7.099 -28.791 -4.658
69 3HD1 LEU 7 3HD1 LEU 7 -5.503 -28.463 -3.985
70 1HD2 LEU 7 1HD2 LEU 7 -7.292 -29.963 -6.733
71 2HD2 LEU 7 2HD2 LEU 7 -6.152 -29.552 -8.014
72 3HD2 LEU 7 3HD2 LEU 7 -7.102 -28.284 -7.239
73 H PHE 8 H PHE 8 -3.956 -25.393 -6.236
74 HA PHE 8 HA PHE 8 -4.397 -23.509 -8.440
75 1HB PHE 8 2HB PHE 8 -5.964 -23.752 -5.918
76 2HB PHE 8 1HB PHE 8 -5.611 -22.128 -6.505
77 HD1 PHE 8 1HD PHE 8 -6.878 -25.398 -7.782
78 HD2 PHE 8 2HD PHE 8 -7.115 -21.152 -7.934
79 HE1 PHE 8 1HE PHE 8 -8.761 -25.563 -9.357
80 HE2 PHE 8 2HE PHE 8 -8.999 -21.309 -9.508
81 HZ PHE 8 HZ PHE 8 -9.825 -23.517 -10.221
82 H ASP 9 H ASP 9 -2.079 -23.321 -8.336
83 HA ASP 9 HA ASP 9 -0.764 -22.410 -5.980
84 1HB ASP 9 2HB ASP 9 0.246 -22.100 -8.807
85 2HB ASP 9 1HB ASP 9 1.192 -22.205 -7.326
86 HA PRO 10 HA PRO 10 -0.993 -18.146 -8.497
87 1HB PRO 10 2HB PRO 10 -3.779 -18.558 -9.462
88 2HB PRO 10 1HB PRO 10 -2.429 -17.727 -10.242
89 1HG PRO 10 2HG PRO 10 -3.195 -20.138 -11.068
90 2HG PRO 10 1HG PRO 10 -1.477 -19.703 -10.999
91 1HD PRO 10 2HD PRO 10 -3.076 -21.416 -9.148
92 2HD PRO 10 1HD PRO 10 -1.396 -21.601 -9.690
93 H ARG 11 H ARG 11 -3.826 -19.733 -7.080
94 HA ARG 11 HA ARG 11 -5.067 -17.509 -5.959
95 1HB ARG 11 2HB ARG 11 -6.100 -19.733 -6.069
96 2HB ARG 11 1HB ARG 11 -4.959 -20.326 -4.870
97 1HG ARG 11 2HG ARG 11 -6.716 -17.999 -4.233
98 2HG ARG 11 1HG ARG 11 -7.351 -19.644 -4.147
99 1HD ARG 11 2HD ARG 11 -5.010 -19.917 -2.805
100 2HD ARG 11 1HD ARG 11 -5.437 -18.255 -2.399
101 HE ARG 11 HE ARG 11 -7.723 -19.739 -1.999
102 1HH1 ARG 11 1HH1 ARG 11 -4.467 -19.725 -0.741
103 2HH1 ARG 11 2HH1 ARG 11 -4.930 -20.343 0.808
104 1HH2 ARG 11 1HH2 ARG 11 -8.334 -20.552 0.038
105 2HH2 ARG 11 2HH2 ARG 11 -7.124 -20.814 1.251
106 H GLN 12 H GLN 12 -3.177 -19.868 -4.066
107 HA GLN 12 HA GLN 12 -2.871 -18.284 -1.807
108 1HB GLN 12 2HB GLN 12 -0.805 -19.745 -1.393
109 2HB GLN 12 1HB GLN 12 -2.359 -20.554 -1.543
110 1HG GLN 12 2HG GLN 12 -1.446 -21.865 -3.068
111 2HG GLN 12 1HG GLN 12 -1.336 -20.464 -4.131
112 1HE2 GLN 12 1HE2 GLN 12 0.574 -20.600 -5.087
113 2HE2 GLN 12 2HE2 GLN 12 2.088 -20.828 -4.286
114 H ALA 13 H ALA 13 -0.690 -18.655 -4.574
115 HA ALA 13 HA ALA 13 1.341 -16.954 -3.641
116 1HB ALA 13 1HB ALA 13 0.657 -17.350 -6.542
117 2HB ALA 13 2HB ALA 13 1.450 -18.592 -5.573
118 3HB ALA 13 3HB ALA 13 2.235 -17.032 -5.821
119 H LEU 14 H LEU 14 -1.702 -16.310 -5.226
120 HA LEU 14 HA LEU 14 -1.134 -13.634 -6.003
121 1HB LEU 14 2HB LEU 14 -3.565 -15.329 -5.794
122 2HB LEU 14 1HB LEU 14 -3.799 -13.592 -5.820
123 HG LEU 14 HG LEU 14 -2.149 -14.941 -7.932
124 1HD1 LEU 14 1HD1 LEU 14 -4.450 -14.665 -9.218
125 2HD1 LEU 14 2HD1 LEU 14 -5.095 -14.963 -7.604
126 3HD1 LEU 14 3HD1 LEU 14 -4.029 -16.147 -8.358
127 1HD2 LEU 14 1HD2 LEU 14 -2.755 -13.002 -9.235
128 2HD2 LEU 14 2HD2 LEU 14 -2.076 -12.485 -7.692
129 3HD2 LEU 14 3HD2 LEU 14 -3.819 -12.431 -7.951
130 H VAL 15 H VAL 15 -2.748 -15.065 -3.188
131 HA VAL 15 HA VAL 15 -3.370 -12.577 -1.967
132 HB VAL 15 HB VAL 15 -4.561 -14.639 -1.374
133 1HG1 VAL 15 1HG1 VAL 15 -3.325 -16.159 0.303
134 2HG1 VAL 15 2HG1 VAL 15 -1.857 -15.479 -0.398
135 3HG1 VAL 15 3HG1 VAL 15 -2.996 -16.355 -1.419
136 1HG2 VAL 15 1HG2 VAL 15 -4.412 -14.377 1.133
137 2HG2 VAL 15 2HG2 VAL 15 -4.715 -12.895 0.224
138 3HG2 VAL 15 3HG2 VAL 15 -3.101 -13.232 0.851
139 H GLY 16 H GLY 16 -0.526 -14.582 -2.041
140 1HA GLY 16 2HA GLY 16 0.719 -13.452 0.276
141 2HA GLY 16 1HA GLY 16 1.507 -14.419 -0.965
142 H LEU 17 H LEU 17 1.319 -13.078 -3.211
143 HA LEU 17 HA LEU 17 3.190 -11.003 -2.958
144 1HB LEU 17 2HB LEU 17 2.627 -10.558 -5.354
145 2HB LEU 17 1HB LEU 17 3.076 -12.214 -4.993
146 HG LEU 17 HG LEU 17 0.422 -12.461 -4.783
147 1HD1 LEU 17 1HD1 LEU 17 -0.819 -10.940 -5.849
148 2HD1 LEU 17 2HD1 LEU 17 0.368 -10.725 -7.134
149 3HD1 LEU 17 3HD1 LEU 17 0.563 -9.872 -5.603
150 1HD2 LEU 17 1HD2 LEU 17 0.444 -13.329 -7.053
151 2HD2 LEU 17 2HD2 LEU 17 1.927 -13.773 -6.208
152 3HD2 LEU 17 3HD2 LEU 17 1.943 -12.462 -7.387
153 H ALA 18 H ALA 18 -0.295 -10.947 -3.594
154 HA ALA 18 HA ALA 18 -0.615 -8.187 -3.839
155 1HB ALA 18 1HB ALA 18 -2.532 -10.301 -2.877
156 2HB ALA 18 2HB ALA 18 -2.382 -9.641 -4.506
157 3HB ALA 18 3HB ALA 18 -2.994 -8.629 -3.198
158 H THR 19 H THR 19 -0.540 -10.237 -0.964
159 HA THR 19 HA THR 19 -1.391 -8.248 0.862
160 HB THR 19 HB THR 19 0.147 -10.819 1.213
161 HG1 THR 19 1HG THR 19 -1.796 -11.553 1.974
162 1HG2 THR 19 1HG2 THR 19 0.837 -9.479 3.071
163 2HG2 THR 19 2HG2 THR 19 -0.364 -10.642 3.629
164 3HG2 THR 19 3HG2 THR 19 -0.821 -8.959 3.370
165 H PHE 20 H PHE 20 1.873 -9.514 0.169
166 HA PHE 20 HA PHE 20 3.271 -7.722 1.797
167 1HB PHE 20 2HB PHE 20 4.021 -9.875 0.440
168 2HB PHE 20 1HB PHE 20 4.524 -8.668 -0.739
169 HD1 PHE 20 1HD PHE 20 5.022 -9.899 2.692
170 HD2 PHE 20 2HD PHE 20 6.426 -7.296 -0.367
171 HE1 PHE 20 1HE PHE 20 7.099 -9.536 3.960
172 HE2 PHE 20 2HE PHE 20 8.506 -6.929 0.894
173 HZ PHE 20 HZ PHE 20 8.845 -8.050 3.061
174 H LEU 21 H LEU 21 2.413 -7.491 -1.638
175 HA LEU 21 HA LEU 21 3.749 -5.041 -2.098
176 1HB LEU 21 2HB LEU 21 3.324 -6.002 -4.100
177 2HB LEU 21 1HB LEU 21 1.866 -6.786 -3.533
178 HG LEU 21 HG LEU 21 1.740 -3.848 -3.958
179 1HD1 LEU 21 1HD1 LEU 21 1.101 -4.517 -6.405
180 2HD1 LEU 21 2HD1 LEU 21 2.201 -5.862 -6.103
181 3HD1 LEU 21 3HD1 LEU 21 2.781 -4.202 -5.970
182 1HD2 LEU 21 1HD2 LEU 21 -0.046 -6.103 -3.680
183 2HD2 LEU 21 2HD2 LEU 21 -0.409 -5.176 -5.135
184 3HD2 LEU 21 3HD2 LEU 21 -0.386 -4.377 -3.564
185 H PHE 22 H PHE 22 0.282 -5.745 -1.714
186 HA PHE 22 HA PHE 22 -0.705 -3.183 -1.694
187 1HB PHE 22 2HB PHE 22 -2.105 -5.208 -1.693
188 2HB PHE 22 1HB PHE 22 -1.680 -5.496 -0.009
189 HD1 PHE 22 1HD PHE 22 -2.710 -4.273 1.757
190 HD2 PHE 22 2HD PHE 22 -3.537 -3.312 -2.306
191 HE1 PHE 22 1HE PHE 22 -4.610 -2.884 2.476
192 HE2 PHE 22 2HE PHE 22 -5.438 -1.921 -1.594
193 HZ PHE 22 HZ PHE 22 -5.975 -1.705 0.800
194 H VAL 23 H VAL 23 0.420 -5.032 1.144
195 HA VAL 23 HA VAL 23 -0.098 -3.014 3.024
196 HB VAL 23 HB VAL 23 1.295 -4.262 4.546
197 1HG1 VAL 23 1HG1 VAL 23 0.327 -6.662 3.892
198 2HG1 VAL 23 2HG1 VAL 23 -0.637 -5.663 2.806
199 3HG1 VAL 23 3HG1 VAL 23 -0.681 -5.371 4.544
200 1HG2 VAL 23 1HG2 VAL 23 2.469 -6.337 3.703
201 2HG2 VAL 23 2HG2 VAL 23 3.222 -4.795 3.298
202 3HG2 VAL 23 3HG2 VAL 23 2.283 -5.663 2.086
203 H LEU 24 H LEU 24 2.942 -3.916 1.393
204 HA LEU 24 HA LEU 24 4.641 -2.083 2.540
205 1HB LEU 24 2HB LEU 24 5.262 -3.925 1.003
206 2HB LEU 24 1HB LEU 24 4.615 -2.993 -0.334
207 HG LEU 24 HG LEU 24 6.329 -1.388 -0.193
208 1HD1 LEU 24 1HD1 LEU 24 6.588 -0.824 2.019
209 2HD1 LEU 24 2HD1 LEU 24 8.075 -1.726 1.722
210 3HD1 LEU 24 3HD1 LEU 24 6.721 -2.502 2.544
211 1HD2 LEU 24 1HD2 LEU 24 8.117 -2.656 -0.830
212 2HD2 LEU 24 2HD2 LEU 24 6.842 -3.874 -0.895
213 3HD2 LEU 24 3HD2 LEU 24 7.921 -3.799 0.499
214 H ALA 25 H ALA 25 3.142 -1.695 -0.661
215 HA ALA 25 HA ALA 25 3.744 0.996 -0.998
216 1HB ALA 25 1HB ALA 25 2.241 0.998 -2.805
217 2HB ALA 25 2HB ALA 25 1.239 -0.261 -2.082
218 3HB ALA 25 3HB ALA 25 2.838 -0.659 -2.712
219 H LEU 26 H LEU 26 1.348 -0.513 0.980
220 HA LEU 26 HA LEU 26 -0.452 1.656 1.214
221 1HB LEU 26 2HB LEU 26 -0.163 -0.952 2.322
222 2HB LEU 26 1HB LEU 26 -0.382 0.176 3.644
223 HG LEU 26 HG LEU 26 -2.518 -0.710 2.972
224 1HD1 LEU 26 1HD1 LEU 26 -2.916 1.401 3.734
225 2HD1 LEU 26 2HD1 LEU 26 -3.527 1.560 2.087
226 3HD1 LEU 26 3HD1 LEU 26 -1.917 2.157 2.493
227 1HD2 LEU 26 1HD2 LEU 26 -3.296 0.118 0.599
228 2HD2 LEU 26 2HD2 LEU 26 -2.427 -1.404 0.794
229 3HD2 LEU 26 3HD2 LEU 26 -1.567 0.039 0.255
230 H LEU 27 H LEU 27 2.191 0.547 3.344
231 HA LEU 27 HA LEU 27 2.001 2.701 5.147
232 1HB LEU 27 2HB LEU 27 4.369 2.060 5.750
233 2HB LEU 27 1HB LEU 27 3.164 0.795 5.891
234 1HD1 LEU 27 1HD1 LEU 27 6.020 2.062 4.325
235 2HD1 LEU 27 2HD1 LEU 27 6.456 0.670 3.333
236 3HD1 LEU 27 3HD1 LEU 27 6.553 0.564 5.090
237 1HD2 LEU 27 1HD2 LEU 27 5.294 -1.514 4.349
238 2HD2 LEU 27 2HD2 LEU 27 3.545 -1.375 4.519
239 3HD2 LEU 27 3HD2 LEU 27 4.597 -0.964 5.873
240 H ILE 28 H ILE 28 4.089 2.178 2.324
241 HA ILE 28 HA ILE 28 5.517 4.598 2.530
242 HB ILE 28 HB ILE 28 4.909 3.085 -0.012
243 1HG1 ILE 28 2HG1 ILE 28 5.839 1.564 1.656
244 2HG1 ILE 28 1HG1 ILE 28 7.035 1.899 0.407
245 1HG2 ILE 28 1HG2 ILE 28 6.100 5.503 0.242
246 2HG2 ILE 28 2HG2 ILE 28 6.443 4.357 -1.053
247 3HG2 ILE 28 3HG2 ILE 28 7.494 4.430 0.360
248 1HD1 ILE 28 1HD1 ILE 28 8.228 3.371 1.848
249 2HD1 ILE 28 2HD1 ILE 28 7.930 1.869 2.723
250 3HD1 ILE 28 3HD1 ILE 28 6.954 3.297 3.065
251 H HIS 29 H HIS 29 2.912 3.763 0.239
252 HA HIS 29 HA HIS 29 2.517 6.303 -0.796
253 1HB HIS 29 2HB HIS 29 1.549 4.232 -1.747
254 2HB HIS 29 1HB HIS 29 0.414 4.164 -0.402
255 HD1 HIS 29 1HD HIS 29 -1.808 5.011 -1.037
256 HD2 HIS 29 2HD HIS 29 1.221 6.967 -3.100
257 HE1 HIS 29 1HE HIS 29 -2.973 6.657 -2.539
258 HE2 HIS 29 2HE HIS 29 -1.117 7.886 -3.718
259 H PHE 30 H PHE 30 0.980 4.788 2.024
260 HA PHE 30 HA PHE 30 -0.831 6.845 2.582
261 1HB PHE 30 2HB PHE 30 -0.976 4.621 3.613
262 2HB PHE 30 1HB PHE 30 0.502 4.938 4.516
263 HD1 PHE 30 1HD PHE 30 -3.069 5.578 4.271
264 HD2 PHE 30 2HD PHE 30 0.511 6.534 6.363
265 HE1 PHE 30 1HE PHE 30 -4.401 6.563 6.090
266 HE2 PHE 30 2HE PHE 30 -0.813 7.518 8.187
267 HZ PHE 30 HZ PHE 30 -3.272 7.534 8.053
268 H ILE 31 H ILE 31 2.596 6.511 3.324
269 HA ILE 31 HA ILE 31 2.634 8.637 5.227
270 HB ILE 31 HB ILE 31 4.410 6.670 4.589
271 1HG1 ILE 31 2HG1 ILE 31 5.043 9.267 6.004
272 2HG1 ILE 31 1HG1 ILE 31 4.208 7.893 6.722
273 1HG2 ILE 31 1HG2 ILE 31 6.450 7.692 3.766
274 2HG2 ILE 31 2HG2 ILE 31 5.614 9.231 3.559
275 3HG2 ILE 31 3HG2 ILE 31 5.159 7.840 2.577
276 1HD1 ILE 31 1HD1 ILE 31 6.194 6.525 6.448
277 2HD1 ILE 31 2HD1 ILE 31 6.552 7.981 7.377
278 3HD1 ILE 31 3HD1 ILE 31 7.031 7.875 5.683
279 H LEU 32 H LEU 32 3.510 8.388 1.783
280 HA LEU 32 HA LEU 32 4.296 11.088 1.485
281 1HB LEU 32 2HB LEU 32 3.067 9.584 -0.785
282 2HB LEU 32 1HB LEU 32 4.431 10.685 -0.794
283 HG LEU 32 HG LEU 32 4.415 7.837 0.186
284 1HD1 LEU 32 1HD1 LEU 32 6.351 7.951 -1.647
285 2HD1 LEU 32 2HD1 LEU 32 5.287 9.206 -2.282
286 3HD1 LEU 32 3HD1 LEU 32 4.676 7.569 -2.044
287 1HD2 LEU 32 1HD2 LEU 32 6.615 8.072 0.910
288 2HD2 LEU 32 2HD2 LEU 32 5.835 9.539 1.498
289 3HD2 LEU 32 3HD2 LEU 32 6.837 9.595 0.049
290 H LEU 33 H LEU 33 1.290 9.426 0.608
291 HA LEU 33 HA LEU 33 -0.151 11.654 -0.230
292 1HB LEU 33 2HB LEU 33 -1.553 9.992 -0.722
293 2HB LEU 33 1HB LEU 33 -0.652 8.893 0.296
294 HG LEU 33 HG LEU 33 -2.748 10.709 1.456
295 1HD1 LEU 33 1HD1 LEU 33 -4.096 9.618 -0.054
296 2HD1 LEU 33 2HD1 LEU 33 -4.136 8.497 1.307
297 3HD1 LEU 33 3HD1 LEU 33 -3.089 8.171 -0.073
298 1HD2 LEU 33 1HD2 LEU 33 -2.114 9.730 3.345
299 2HD2 LEU 33 2HD2 LEU 33 -0.931 8.764 2.465
300 3HD2 LEU 33 3HD2 LEU 33 -2.574 8.162 2.680
301 H SER 34 H SER 34 0.334 10.296 2.983
302 HA SER 34 HA SER 34 -1.512 11.882 4.383
303 1HB SER 34 2HB SER 34 0.970 10.387 5.145
304 2HB SER 34 1HB SER 34 0.235 11.483 6.315
305 HG SER 34 HG SER 34 -0.464 9.037 5.890
306 H THR 35 H THR 35 1.972 12.350 3.815
307 HA THR 35 HA THR 35 2.155 14.848 5.106
308 HB THR 35 HB THR 35 3.839 13.764 2.839
309 HG1 THR 35 1HG THR 35 4.010 12.352 4.499
310 1HG2 THR 35 1HG2 THR 35 4.421 16.025 3.023
311 2HG2 THR 35 2HG2 THR 35 5.630 15.150 3.962
312 3HG2 THR 35 3HG2 THR 35 4.317 15.993 4.782
313 H GLU 36 H GLU 36 1.385 13.952 1.790
314 HA GLU 36 HA GLU 36 1.466 16.534 0.669
315 1HB GLU 36 2HB GLU 36 1.419 14.385 -0.615
316 2HB GLU 36 1HB GLU 36 -0.281 14.225 -0.196
317 1HG GLU 36 2HG GLU 36 -0.929 15.925 -1.589
318 2HG GLU 36 1HG GLU 36 0.643 16.721 -1.527
319 H ARG 37 H ARG 37 -1.198 14.654 2.072
320 HA ARG 37 HA ARG 37 -3.217 16.566 1.598
321 1HB ARG 37 2HB ARG 37 -3.328 14.049 2.385
322 2HB ARG 37 1HB ARG 37 -3.322 14.770 3.988
323 1HG ARG 37 2HG ARG 37 -5.534 14.873 3.758
324 2HG ARG 37 1HG ARG 37 -5.226 16.250 2.700
325 1HD ARG 37 2HD ARG 37 -5.723 13.385 1.935
326 2HD ARG 37 1HD ARG 37 -6.669 14.810 1.504
327 HE ARG 37 HE ARG 37 -4.258 15.332 0.408
328 1HH1 ARG 37 1HH1 ARG 37 -6.394 12.576 0.240
329 2HH1 ARG 37 2HH1 ARG 37 -5.892 12.127 -1.356
330 1HH2 ARG 37 1HH2 ARG 37 -3.596 14.742 -1.690
331 2HH2 ARG 37 2HH2 ARG 37 -4.303 13.356 -2.451
332 H PHE 38 H PHE 38 -0.934 16.093 4.226
333 HA PHE 38 HA PHE 38 -2.039 17.900 6.068
334 1HB PHE 38 2HB PHE 38 0.638 16.666 5.648
335 2HB PHE 38 1HB PHE 38 0.552 18.077 6.698
336 HD1 PHE 38 1HD PHE 38 0.773 17.345 8.869
337 HD2 PHE 38 2HD PHE 38 -1.790 15.219 6.218
338 HE1 PHE 38 1HE PHE 38 0.039 15.914 10.732
339 HE2 PHE 38 2HE PHE 38 -2.529 13.785 8.076
340 HZ PHE 38 HZ PHE 38 -1.615 14.132 10.337
341 H ASN 39 H ASN 39 0.818 18.421 3.993
342 HA ASN 39 HA ASN 39 0.929 21.199 4.353
343 1HB ASN 39 2HB ASN 39 1.892 19.689 1.921
344 2HB ASN 39 1HB ASN 39 2.497 21.226 2.533
345 1HD2 ASN 39 1HD2 ASN 39 4.196 19.145 2.041
346 2HD2 ASN 39 2HD2 ASN 39 4.819 18.536 3.533
347 H TRP 40 H TRP 40 -1.187 19.296 2.491
348 HA TRP 40 HA TRP 40 -1.824 21.147 0.428
349 1HB TRP 40 2HB TRP 40 -2.317 18.783 0.131
350 2HB TRP 40 1HB TRP 40 -3.384 18.797 1.529
351 HD1 TRP 40 HD TRP 40 -5.685 20.337 1.229
352 HE1 TRP 40 1HE TRP 40 -7.118 20.697 -0.878
353 HE3 TRP 40 3HE TRP 40 -2.279 18.937 -2.317
354 HZ2 TRP 40 2HZ TRP 40 -6.842 20.423 -3.674
355 HZ3 TRP 40 3HZ TRP 40 -2.944 19.014 -4.685
356 HH2 TRP 40 HH TRP 40 -5.179 19.741 -5.348
357 H LEU 41 H LEU 41 -3.986 19.981 2.988
358 HA LEU 41 HA LEU 41 -5.619 22.281 2.930
359 1HB LEU 41 2HB LEU 41 -6.548 21.427 5.046
360 2HB LEU 41 1HB LEU 41 -6.456 20.185 3.811
361 HG LEU 41 HG LEU 41 -4.143 19.673 5.020
362 1HD1 LEU 41 1HD1 LEU 41 -4.012 21.224 6.710
363 2HD1 LEU 41 2HD1 LEU 41 -4.762 19.866 7.548
364 3HD1 LEU 41 3HD1 LEU 41 -5.752 21.217 6.998
365 1HD2 LEU 41 1HD2 LEU 41 -6.768 18.778 6.195
366 2HD2 LEU 41 2HD2 LEU 41 -5.237 17.902 6.191
367 3HD2 LEU 41 3HD2 LEU 41 -6.106 18.166 4.678
368 H GLU 42 H GLU 42 -2.538 21.664 4.240
369 HA GLU 42 HA GLU 42 -2.550 23.375 6.445
370 1HB GLU 42 2HB GLU 42 -0.518 22.030 4.826
371 2HB GLU 42 1HB GLU 42 0.032 23.489 5.627
372 1HG GLU 42 2HG GLU 42 -1.427 21.366 7.144
373 2HG GLU 42 1HG GLU 42 0.301 21.230 6.824
374 H GLY 43 H GLY 43 -0.901 23.942 3.345
375 1HA GLY 43 2HA GLY 43 -2.070 26.528 2.986
376 2HA GLY 43 1HA GLY 43 -0.433 26.638 3.614
377 H ALA 44 H ALA 44 -1.555 24.139 1.413
378 HA ALA 44 HA ALA 44 0.591 24.556 -0.381
379 1HB ALA 44 1HB ALA 44 -0.256 22.377 -0.313
380 2HB ALA 44 2HB ALA 44 -0.791 23.002 -1.873
381 3HB ALA 44 3HB ALA 44 -1.920 22.920 -0.521
382 H SER 45 H SER 45 0.807 26.234 -1.690
383 HA SER 45 HA SER 45 0.371 27.646 -3.439
384 1HB SER 45 2HB SER 45 -1.499 25.772 -3.929
385 2HB SER 45 1HB SER 45 -2.551 27.130 -3.533
386 H THR 46 H THR 46 0.020 28.177 -0.543
387 HA THR 46 HA THR 46 -1.260 30.769 -0.831
388 HB THR 46 HB THR 46 -2.799 30.516 0.934
389 HG1 THR 46 1HG THR 46 -1.497 29.409 2.403
390 1HG2 THR 46 1HG2 THR 46 -3.476 29.285 -1.120
391 2HG2 THR 46 2HG2 THR 46 -4.212 28.691 0.369
392 3HG2 THR 46 3HG2 THR 46 -2.874 27.809 -0.365
393 H LYS 47 H LYS 47 0.371 28.520 1.383
394 HA LYS 47 HA LYS 47 2.067 28.800 2.864
395 1HB LYS 47 2HB LYS 47 2.557 30.742 0.769
396 2HB LYS 47 1HB LYS 47 3.169 31.307 2.318
397 1HG LYS 47 2HG LYS 47 3.803 28.588 1.208
398 2HG LYS 47 1HG LYS 47 4.786 30.018 0.886
399 1HD LYS 47 2HD LYS 47 5.882 29.585 2.776
400 2HD LYS 47 1HD LYS 47 4.410 30.013 3.651
401 1HE LYS 47 2HE LYS 47 3.669 27.643 3.417
402 2HE LYS 47 1HE LYS 47 5.246 27.268 2.723
403 1HZ LYS 47 1HZ LYS 47 6.264 27.429 4.716
404 2HZ LYS 47 2HZ LYS 47 4.724 27.044 5.301
405 3HZ LYS 47 3HZ LYS 47 5.244 28.654 5.285
406 HA PRO 48 HA PRO 48 -0.036 30.920 6.168
407 1HB PRO 48 2HB PRO 48 2.656 30.785 7.438
408 2HB PRO 48 1HB PRO 48 1.085 30.279 8.072
409 1HG PRO 48 2HG PRO 48 2.844 28.475 7.218
410 2HG PRO 48 1HG PRO 48 1.110 28.276 6.903
411 1HD PRO 48 2HD PRO 48 3.289 29.138 5.052
412 2HD PRO 48 1HD PRO 48 1.856 28.141 4.724
413 H VAL 49 H VAL 49 -0.437 33.001 5.668
414 HA VAL 49 HA VAL 49 -0.191 35.235 5.404
415 HB VAL 49 HB VAL 49 0.881 34.645 7.820
416 1HG1 VAL 49 1HG1 VAL 49 3.185 34.734 6.580
417 2HG1 VAL 49 2HG1 VAL 49 3.001 35.450 8.179
418 3HG1 VAL 49 3HG1 VAL 49 2.973 36.475 6.744
419 1HG2 VAL 49 1HG2 VAL 49 1.135 37.314 7.874
420 2HG2 VAL 49 2HG2 VAL 49 -0.422 36.484 7.885
421 3HG2 VAL 49 3HG2 VAL 49 0.223 37.128 6.375
422 H GLN 50 H GLN 50 1.767 37.007 5.116
423 HA GLN 50 HA GLN 50 3.493 37.766 3.823
424 1HB GLN 50 2HB GLN 50 4.043 34.956 2.887
425 2HB GLN 50 1HB GLN 50 5.146 36.323 2.938
426 1HG GLN 50 2HG GLN 50 4.518 36.102 5.552
427 2HG GLN 50 1HG GLN 50 4.390 34.420 5.042
428 1HE2 GLN 50 1HE2 GLN 50 6.240 33.459 4.008
429 2HE2 GLN 50 2HE2 GLN 50 7.827 34.017 4.399
430 H THR 51 H THR 51 1.562 38.598 2.702
431 HA THR 51 HA THR 51 0.701 37.258 0.303
432 HB THR 51 HB THR 51 -0.875 38.615 1.590
433 HG1 THR 51 1HG THR 51 -0.326 39.809 -0.921
434 1HG2 THR 51 1HG2 THR 51 0.832 40.968 0.813
435 2HG2 THR 51 2HG2 THR 51 0.596 40.341 2.445
436 3HG2 THR 51 3HG2 THR 51 -0.760 41.051 1.568
437 H SER 52 H SER 52 1.237 37.714 -1.783
438 HA SER 52 HA SER 52 2.495 38.426 -3.538
439 1HB SER 52 2HB SER 52 2.560 40.952 -1.875
440 2HB SER 52 1HB SER 52 3.177 40.847 -3.524
441 HG SER 52 HG SER 52 0.707 41.309 -2.778
Start of MODEL 6
1 1H MET 1 1H MET 1 -0.778 -30.647 -13.726
2 HA MET 1 HA MET 1 0.573 -33.142 -13.822
3 1HB MET 1 2HB MET 1 2.382 -30.721 -13.675
4 2HB MET 1 1HB MET 1 2.889 -32.358 -13.281
5 1HG MET 1 2HG MET 1 1.634 -32.029 -15.917
6 2HG MET 1 1HG MET 1 3.182 -31.213 -15.701
7 1HE MET 1 1HE MET 1 4.882 -32.329 -16.998
8 2HE MET 1 2HE MET 1 3.597 -33.097 -17.931
9 3HE MET 1 3HE MET 1 4.960 -34.056 -17.351
10 H TRP 2 H TRP 2 -1.211 -32.900 -12.162
11 HA TRP 2 HA TRP 2 -1.985 -32.538 -10.026
12 1HB TRP 2 2HB TRP 2 0.759 -33.731 -9.711
13 2HB TRP 2 1HB TRP 2 -0.277 -33.437 -8.319
14 HD1 TRP 2 HD TRP 2 -2.718 -34.771 -8.370
15 HE1 TRP 2 1HE TRP 2 -3.251 -37.120 -9.280
16 HE3 TRP 2 3HE TRP 2 1.348 -35.410 -11.404
17 HZ2 TRP 2 2HZ TRP 2 -2.100 -38.994 -11.049
18 HZ3 TRP 2 3HZ TRP 2 1.556 -37.509 -12.670
19 HH2 TRP 2 HH TRP 2 -0.132 -39.263 -12.494
20 H ARG 3 H ARG 3 -1.819 -30.129 -10.551
21 HA ARG 3 HA ARG 3 -1.360 -27.995 -9.903
22 1HB ARG 3 2HB ARG 3 -0.591 -29.325 -7.303
23 2HB ARG 3 1HB ARG 3 -1.021 -27.634 -7.520
24 1HG ARG 3 2HG ARG 3 -2.948 -29.791 -8.272
25 2HG ARG 3 1HG ARG 3 -2.779 -29.279 -6.592
26 1HD ARG 3 2HD ARG 3 -4.071 -27.516 -6.980
27 2HD ARG 3 1HD ARG 3 -2.963 -26.957 -8.231
28 HE ARG 3 HE ARG 3 -4.518 -27.590 -9.760
29 1HH1 ARG 3 1HH1 ARG 3 -4.988 -29.523 -6.893
30 2HH1 ARG 3 2HH1 ARG 3 -6.370 -30.352 -7.527
31 1HH2 ARG 3 1HH2 ARG 3 -6.336 -28.678 -10.595
32 2HH2 ARG 3 2HH2 ARG 3 -7.135 -29.872 -9.629
33 H ILE 4 H ILE 4 0.808 -29.629 -11.071
34 HA ILE 4 HA ILE 4 3.003 -29.439 -11.587
35 HB ILE 4 HB ILE 4 2.962 -26.749 -10.247
36 1HG1 ILE 4 2HG1 ILE 4 1.016 -26.865 -11.703
37 2HG1 ILE 4 1HG1 ILE 4 2.242 -25.837 -12.438
38 1HG2 ILE 4 1HG2 ILE 4 4.468 -26.402 -12.401
39 2HG2 ILE 4 2HG2 ILE 4 4.709 -28.137 -12.200
40 3HG2 ILE 4 3HG2 ILE 4 5.126 -27.031 -10.891
41 1HD1 ILE 4 1HD1 ILE 4 1.671 -28.700 -13.165
42 2HD1 ILE 4 2HD1 ILE 4 2.902 -27.673 -13.902
43 3HD1 ILE 4 3HD1 ILE 4 1.194 -27.273 -14.085
44 H TRP 5 H TRP 5 2.124 -30.290 -8.775
45 HA TRP 5 HA TRP 5 3.318 -31.354 -7.121
46 1HB TRP 5 2HB TRP 5 5.361 -30.869 -8.829
47 2HB TRP 5 1HB TRP 5 5.834 -29.840 -7.482
48 HD1 TRP 5 HD TRP 5 6.815 -31.002 -5.359
49 HE1 TRP 5 1HE TRP 5 7.391 -33.439 -4.763
50 HE3 TRP 5 3HE TRP 5 4.508 -33.360 -9.265
51 HZ2 TRP 5 2HZ TRP 5 6.929 -36.019 -5.811
52 HZ3 TRP 5 3HZ TRP 5 4.623 -35.815 -9.395
53 HH2 TRP 5 HH TRP 5 5.809 -37.115 -7.703
54 H GLN 6 H GLN 6 3.297 -27.941 -7.641
55 HA GLN 6 HA GLN 6 4.130 -27.119 -5.065
56 1HB GLN 6 2HB GLN 6 2.203 -25.556 -6.761
57 2HB GLN 6 1HB GLN 6 3.463 -24.959 -5.690
58 1HG GLN 6 2HG GLN 6 4.702 -26.526 -7.700
59 2HG GLN 6 1HG GLN 6 3.577 -25.416 -8.483
60 1HE2 GLN 6 1HE2 GLN 6 3.719 -23.256 -6.788
61 2HE2 GLN 6 2HE2 GLN 6 5.303 -22.569 -6.862
62 H LEU 7 H LEU 7 1.093 -28.167 -6.426
63 HA LEU 7 HA LEU 7 -0.931 -28.626 -5.492
64 1HB LEU 7 2HB LEU 7 1.049 -29.325 -3.550
65 2HB LEU 7 1HB LEU 7 -0.380 -28.729 -2.726
66 HG LEU 7 HG LEU 7 -0.689 -30.776 -4.879
67 1HD1 LEU 7 1HD1 LEU 7 0.038 -32.523 -3.646
68 2HD1 LEU 7 2HD1 LEU 7 -0.386 -31.762 -2.113
69 3HD1 LEU 7 3HD1 LEU 7 1.097 -31.297 -2.949
70 1HD2 LEU 7 1HD2 LEU 7 -2.763 -30.111 -4.171
71 2HD2 LEU 7 2HD2 LEU 7 -2.219 -29.783 -2.525
72 3HD2 LEU 7 3HD2 LEU 7 -2.461 -31.446 -3.059
73 H PHE 8 H PHE 8 -1.683 -26.521 -6.040
74 HA PHE 8 HA PHE 8 -2.704 -24.528 -5.645
75 1HB PHE 8 2HB PHE 8 -3.055 -25.714 -2.887
76 2HB PHE 8 1HB PHE 8 -3.969 -24.361 -3.546
77 HD1 PHE 8 1HD PHE 8 -5.588 -24.722 -5.353
78 HD2 PHE 8 2HD PHE 8 -3.552 -27.964 -3.495
79 HE1 PHE 8 1HE PHE 8 -7.239 -26.290 -6.288
80 HE2 PHE 8 2HE PHE 8 -5.198 -29.538 -4.426
81 HZ PHE 8 HZ PHE 8 -7.044 -28.701 -5.826
82 H ASP 9 H ASP 9 0.247 -24.825 -4.921
83 HA ASP 9 HA ASP 9 0.683 -23.047 -2.728
84 1HB ASP 9 2HB ASP 9 2.260 -24.812 -4.135
85 2HB ASP 9 1HB ASP 9 2.872 -23.248 -4.663
86 HA PRO 10 HA PRO 10 1.779 -19.957 -6.419
87 1HB PRO 10 2HB PRO 10 -0.176 -21.050 -8.377
88 2HB PRO 10 1HB PRO 10 1.428 -20.363 -8.652
89 1HG PRO 10 2HG PRO 10 1.032 -22.991 -8.806
90 2HG PRO 10 1HG PRO 10 2.514 -22.333 -8.090
91 1HD PRO 10 2HD PRO 10 0.116 -23.505 -6.748
92 2HD PRO 10 1HD PRO 10 1.831 -23.643 -6.315
93 H ARG 11 H ARG 11 -1.385 -21.359 -5.816
94 HA ARG 11 HA ARG 11 -2.944 -19.085 -6.388
95 1HB ARG 11 2HB ARG 11 -3.919 -21.315 -6.168
96 2HB ARG 11 1HB ARG 11 -3.483 -21.356 -4.466
97 1HG ARG 11 2HG ARG 11 -5.082 -19.746 -3.898
98 2HG ARG 11 1HG ARG 11 -5.286 -19.234 -5.574
99 1HD ARG 11 2HD ARG 11 -6.457 -21.202 -6.138
100 2HD ARG 11 1HD ARG 11 -5.973 -22.008 -4.646
101 HE ARG 11 HE ARG 11 -8.198 -20.248 -5.008
102 1HH1 ARG 11 1HH1 ARG 11 -5.866 -21.407 -2.684
103 2HH1 ARG 11 2HH1 ARG 11 -6.877 -21.077 -1.319
104 1HH2 ARG 11 1HH2 ARG 11 -9.529 -19.812 -3.213
105 2HH2 ARG 11 2HH2 ARG 11 -8.957 -20.172 -1.617
106 H GLN 12 H GLN 12 -2.398 -20.393 -3.120
107 HA GLN 12 HA GLN 12 -3.048 -18.028 -1.783
108 1HB GLN 12 2HB GLN 12 -1.127 -20.092 -0.720
109 2HB GLN 12 1HB GLN 12 -2.224 -19.064 0.191
110 1HG GLN 12 2HG GLN 12 -4.074 -20.315 -1.134
111 2HG GLN 12 1HG GLN 12 -2.811 -21.516 -1.401
112 1HE2 GLN 12 1HE2 GLN 12 -5.146 -20.331 0.733
113 2HE2 GLN 12 2HE2 GLN 12 -4.751 -21.310 2.099
114 H ALA 13 H ALA 13 0.023 -19.204 -3.024
115 HA ALA 13 HA ALA 13 1.697 -17.326 -1.756
116 1HB ALA 13 1HB ALA 13 2.391 -19.453 -2.935
117 2HB ALA 13 2HB ALA 13 3.394 -18.035 -3.240
118 3HB ALA 13 3HB ALA 13 2.221 -18.562 -4.447
119 H LEU 14 H LEU 14 0.121 -17.301 -4.941
120 HA LEU 14 HA LEU 14 1.184 -14.815 -5.770
121 1HB LEU 14 2HB LEU 14 -1.191 -16.443 -6.627
122 2HB LEU 14 1HB LEU 14 -0.877 -14.866 -7.325
123 HG LEU 14 HG LEU 14 1.178 -17.063 -7.362
124 1HD1 LEU 14 1HD1 LEU 14 -1.157 -16.596 -9.158
125 2HD1 LEU 14 2HD1 LEU 14 -0.475 -18.112 -8.570
126 3HD1 LEU 14 3HD1 LEU 14 0.355 -17.203 -9.832
127 1HD2 LEU 14 1HD2 LEU 14 0.903 -14.872 -9.367
128 2HD2 LEU 14 2HD2 LEU 14 2.343 -15.746 -8.842
129 3HD2 LEU 14 3HD2 LEU 14 1.624 -14.521 -7.796
130 H VAL 15 H VAL 15 -1.647 -15.734 -3.924
131 HA VAL 15 HA VAL 15 -2.927 -13.198 -3.982
132 HB VAL 15 HB VAL 15 -3.167 -15.316 -1.839
133 1HG1 VAL 15 1HG1 VAL 15 -5.557 -14.276 -1.843
134 2HG1 VAL 15 2HG1 VAL 15 -4.746 -12.891 -2.574
135 3HG1 VAL 15 3HG1 VAL 15 -4.246 -13.468 -0.984
136 1HG2 VAL 15 1HG2 VAL 15 -4.431 -16.593 -3.178
137 2HG2 VAL 15 2HG2 VAL 15 -3.681 -15.701 -4.502
138 3HG2 VAL 15 3HG2 VAL 15 -5.254 -15.200 -3.882
139 H GLY 16 H GLY 16 -0.361 -14.601 -2.096
140 1HA GLY 16 2HA GLY 16 -0.429 -12.664 0.017
141 2HA GLY 16 1HA GLY 16 0.871 -13.802 -0.316
142 H LEU 17 H LEU 17 1.478 -13.102 -2.926
143 HA LEU 17 HA LEU 17 3.202 -10.903 -2.538
144 1HB LEU 17 2HB LEU 17 2.437 -11.560 -5.318
145 2HB LEU 17 1HB LEU 17 4.025 -11.346 -4.612
146 HG LEU 17 HG LEU 17 2.306 -13.810 -4.527
147 1HD1 LEU 17 1HD1 LEU 17 3.422 -13.701 -6.579
148 2HD1 LEU 17 2HD1 LEU 17 4.416 -14.757 -5.577
149 3HD1 LEU 17 3HD1 LEU 17 4.898 -13.081 -5.841
150 1HD2 LEU 17 1HD2 LEU 17 4.704 -13.038 -2.923
151 2HD2 LEU 17 2HD2 LEU 17 4.450 -14.724 -3.376
152 3HD2 LEU 17 3HD2 LEU 17 3.239 -13.877 -2.414
153 H ALA 18 H ALA 18 0.434 -11.208 -4.732
154 HA ALA 18 HA ALA 18 0.256 -8.547 -5.497
155 1HB ALA 18 1HB ALA 18 -1.050 -9.824 -6.833
156 2HB ALA 18 2HB ALA 18 -2.303 -9.257 -5.730
157 3HB ALA 18 3HB ALA 18 -1.591 -10.856 -5.509
158 H THR 19 H THR 19 -1.472 -10.172 -2.830
159 HA THR 19 HA THR 19 -2.917 -7.880 -2.027
160 HB THR 19 HB THR 19 -2.138 -10.321 -0.422
161 HG1 THR 19 1HG THR 19 -4.563 -9.735 -1.765
162 1HG2 THR 19 1HG2 THR 19 -2.975 -9.187 1.308
163 2HG2 THR 19 2HG2 THR 19 -4.536 -9.520 0.556
164 3HG2 THR 19 3HG2 THR 19 -3.734 -7.974 0.277
165 H PHE 20 H PHE 20 0.037 -9.351 -0.689
166 HA PHE 20 HA PHE 20 0.481 -7.466 1.325
167 1HB PHE 20 2HB PHE 20 1.639 -9.650 1.175
168 2HB PHE 20 1HB PHE 20 2.555 -9.052 -0.205
169 HD1 PHE 20 1HD PHE 20 2.492 -9.415 3.307
170 HD2 PHE 20 2HD PHE 20 3.951 -6.905 0.195
171 HE1 PHE 20 1HE PHE 20 4.196 -8.517 4.837
172 HE2 PHE 20 2HE PHE 20 5.659 -6.003 1.720
173 HZ PHE 20 HZ PHE 20 5.783 -6.809 4.043
174 H LEU 21 H LEU 21 1.349 -7.449 -2.080
175 HA LEU 21 HA LEU 21 3.094 -5.223 -1.966
176 1HB LEU 21 2HB LEU 21 3.434 -6.357 -3.901
177 2HB LEU 21 1HB LEU 21 1.755 -6.832 -4.048
178 HG LEU 21 HG LEU 21 2.350 -3.969 -4.529
179 1HD1 LEU 21 1HD1 LEU 21 4.183 -5.462 -5.610
180 2HD1 LEU 21 2HD1 LEU 21 3.391 -4.211 -6.568
181 3HD1 LEU 21 3HD1 LEU 21 2.901 -5.897 -6.739
182 1HD2 LEU 21 1HD2 LEU 21 0.847 -5.066 -6.590
183 2HD2 LEU 21 2HD2 LEU 21 0.233 -4.189 -5.189
184 3HD2 LEU 21 3HD2 LEU 21 0.328 -5.949 -5.153
185 H PHE 22 H PHE 22 -0.225 -5.450 -3.245
186 HA PHE 22 HA PHE 22 -0.686 -2.752 -3.621
187 1HB PHE 22 2HB PHE 22 -2.131 -4.683 -4.370
188 2HB PHE 22 1HB PHE 22 -2.793 -4.724 -2.739
189 HD1 PHE 22 1HD PHE 22 -4.840 -3.736 -2.516
190 HD2 PHE 22 2HD PHE 22 -2.076 -2.116 -5.316
191 HE1 PHE 22 1HE PHE 22 -6.487 -2.017 -3.140
192 HE2 PHE 22 2HE PHE 22 -3.717 -0.393 -5.945
193 HZ PHE 22 HZ PHE 22 -5.926 -0.342 -4.857
194 H VAL 23 H VAL 23 -1.292 -4.678 -0.690
195 HA VAL 23 HA VAL 23 -2.523 -2.618 0.772
196 HB VAL 23 HB VAL 23 -2.117 -3.975 2.742
197 1HG1 VAL 23 1HG1 VAL 23 -3.161 -5.167 0.247
198 2HG1 VAL 23 2HG1 VAL 23 -3.978 -4.843 1.777
199 3HG1 VAL 23 3HG1 VAL 23 -2.928 -6.252 1.617
200 1HG2 VAL 23 1HG2 VAL 23 0.074 -4.761 2.549
201 2HG2 VAL 23 2HG2 VAL 23 -0.224 -5.441 0.950
202 3HG2 VAL 23 3HG2 VAL 23 -0.924 -6.205 2.375
203 H LEU 24 H LEU 24 0.851 -3.769 0.784
204 HA LEU 24 HA LEU 24 1.802 -1.976 2.709
205 1HB LEU 24 2HB LEU 24 3.299 -3.656 2.324
206 2HB LEU 24 1HB LEU 24 2.989 -3.688 0.601
207 HG LEU 24 HG LEU 24 4.481 -1.386 1.796
208 1HD1 LEU 24 1HD1 LEU 24 5.604 -4.092 1.104
209 2HD1 LEU 24 2HD1 LEU 24 5.647 -3.284 2.671
210 3HD1 LEU 24 3HD1 LEU 24 6.575 -2.636 1.319
211 1HD2 LEU 24 1HD2 LEU 24 5.598 -1.949 -0.593
212 2HD2 LEU 24 2HD2 LEU 24 4.225 -0.862 -0.383
213 3HD2 LEU 24 3HD2 LEU 24 3.957 -2.536 -0.866
214 H ALA 25 H ALA 25 1.665 -1.727 -0.828
215 HA ALA 25 HA ALA 25 2.977 0.733 -1.085
216 1HB ALA 25 1HB ALA 25 1.311 0.817 -3.184
217 2HB ALA 25 2HB ALA 25 1.173 -0.892 -2.770
218 3HB ALA 25 3HB ALA 25 2.752 -0.199 -3.137
219 H LEU 26 H LEU 26 -0.411 -0.051 -0.493
220 HA LEU 26 HA LEU 26 -1.428 2.568 -0.744
221 1HB LEU 26 2HB LEU 26 -2.391 0.086 0.641
222 2HB LEU 26 1HB LEU 26 -3.260 1.598 0.814
223 HG LEU 26 HG LEU 26 -2.649 0.456 -1.897
224 1HD1 LEU 26 1HD1 LEU 26 -5.034 -0.407 -1.787
225 2HD1 LEU 26 2HD1 LEU 26 -4.904 -0.233 -0.037
226 3HD1 LEU 26 3HD1 LEU 26 -3.816 -1.322 -0.898
227 1HD2 LEU 26 1HD2 LEU 26 -4.404 1.864 -2.638
228 2HD2 LEU 26 2HD2 LEU 26 -3.389 2.846 -1.580
229 3HD2 LEU 26 3HD2 LEU 26 -4.921 2.206 -0.988
230 H LEU 27 H LEU 27 -0.170 0.748 2.017
231 HA LEU 27 HA LEU 27 -0.796 2.636 4.006
232 1HB LEU 27 2HB LEU 27 1.035 0.316 3.762
233 2HB LEU 27 1HB LEU 27 1.377 1.459 5.047
234 1HD1 LEU 27 1HD2 LEU 27 -1.465 0.045 3.444
235 2HD1 LEU 27 2HD2 LEU 27 -2.454 0.811 4.687
236 3HD1 LEU 27 3HD2 LEU 27 -2.077 -0.909 4.796
237 1HD2 LEU 27 1HD1 LEU 27 1.203 -0.784 5.992
238 2HD2 LEU 27 2HD1 LEU 27 -0.133 -1.729 5.335
239 3HD2 LEU 27 3HD1 LEU 27 -0.278 -0.986 6.928
240 H ILE 28 H ILE 28 2.336 2.022 2.401
241 HA ILE 28 HA ILE 28 3.671 4.206 3.515
242 HB ILE 28 HB ILE 28 5.238 3.964 1.567
243 1HG1 ILE 28 2HG1 ILE 28 4.639 1.543 0.478
244 2HG1 ILE 28 1HG1 ILE 28 3.030 2.233 0.654
245 1HG2 ILE 28 1HG2 ILE 28 4.526 1.860 3.512
246 2HG2 ILE 28 2HG2 ILE 28 6.032 2.754 3.304
247 3HG2 ILE 28 3HG2 ILE 28 5.649 1.411 2.229
248 1HD1 ILE 28 1HD1 ILE 28 3.393 3.222 -1.296
249 2HD1 ILE 28 2HD1 ILE 28 5.115 2.847 -1.250
250 3HD1 ILE 28 3HD1 ILE 28 4.506 4.290 -0.440
251 H HIS 29 H HIS 29 2.105 3.903 0.319
252 HA HIS 29 HA HIS 29 2.635 6.482 -0.590
253 1HB HIS 29 2HB HIS 29 1.654 4.540 -1.907
254 2HB HIS 29 1HB HIS 29 0.100 4.951 -1.187
255 HD1 HIS 29 1HD HIS 29 -1.246 6.662 -2.388
256 HD2 HIS 29 2HD HIS 29 2.755 6.750 -3.506
257 HE1 HIS 29 1HE HIS 29 -1.113 8.313 -4.281
258 HE2 HIS 29 2HE HIS 29 1.331 8.417 -4.880
259 H PHE 30 H PHE 30 0.058 5.256 1.457
260 HA PHE 30 HA PHE 30 -1.521 7.576 1.524
261 1HB PHE 30 2HB PHE 30 -2.368 5.395 2.243
262 2HB PHE 30 1HB PHE 30 -1.234 5.385 3.589
263 HD1 PHE 30 1HD PHE 30 -1.519 6.987 5.452
264 HD2 PHE 30 2HD PHE 30 -4.411 6.587 2.355
265 HE1 PHE 30 1HE PHE 30 -3.182 8.127 6.863
266 HE2 PHE 30 2HE PHE 30 -6.079 7.726 3.760
267 HZ PHE 30 HZ PHE 30 -5.465 8.498 6.017
268 H ILE 31 H ILE 31 1.312 6.571 3.372
269 HA ILE 31 HA ILE 31 1.061 8.613 5.342
270 HB ILE 31 HB ILE 31 2.574 6.367 5.192
271 1HG1 ILE 31 2HG1 ILE 31 3.625 8.540 6.932
272 2HG1 ILE 31 1HG1 ILE 31 1.923 8.116 7.097
273 1HG2 ILE 31 1HG2 ILE 31 4.515 8.634 4.790
274 2HG2 ILE 31 2HG2 ILE 31 4.134 7.399 3.593
275 3HG2 ILE 31 3HG2 ILE 31 4.915 6.947 5.105
276 1HD1 ILE 31 1HD1 ILE 31 3.787 5.847 7.074
277 2HD1 ILE 31 2HD1 ILE 31 2.379 6.159 8.092
278 3HD1 ILE 31 3HD1 ILE 31 3.921 6.934 8.456
279 H LEU 32 H LEU 32 2.960 8.297 2.355
280 HA LEU 32 HA LEU 32 4.271 10.799 2.572
281 1HB LEU 32 2HB LEU 32 3.625 9.620 -0.096
282 2HB LEU 32 1HB LEU 32 5.086 10.429 0.435
283 HG LEU 32 HG LEU 32 4.232 7.621 1.105
284 1HD1 LEU 32 1HD1 LEU 32 6.618 7.334 0.000
285 2HD1 LEU 32 2HD1 LEU 32 6.158 8.840 -0.793
286 3HD1 LEU 32 3HD1 LEU 32 5.145 7.406 -0.969
287 1HD2 LEU 32 1HD2 LEU 32 6.836 8.869 1.905
288 2HD2 LEU 32 2HD2 LEU 32 6.079 7.395 2.508
289 3HD2 LEU 32 3HD2 LEU 32 5.417 8.970 2.946
290 H LEU 33 H LEU 33 1.484 9.767 0.638
291 HA LEU 33 HA LEU 33 0.821 12.260 -0.416
292 1HB LEU 33 2HB LEU 33 -0.575 10.916 -1.515
293 2HB LEU 33 1HB LEU 33 -0.270 9.627 -0.374
294 HG LEU 33 HG LEU 33 -2.325 11.746 0.196
295 1HD1 LEU 33 1HD1 LEU 33 -2.843 10.757 -1.990
296 2HD1 LEU 33 2HD1 LEU 33 -4.012 10.281 -0.759
297 3HD1 LEU 33 3HD1 LEU 33 -2.762 9.148 -1.273
298 1HD2 LEU 33 1HD2 LEU 33 -2.557 10.587 2.076
299 2HD2 LEU 33 2HD2 LEU 33 -1.301 9.466 1.556
300 3HD2 LEU 33 3HD2 LEU 33 -2.984 9.155 1.138
301 H SER 34 H SER 34 -0.140 10.703 2.606
302 HA SER 34 HA SER 34 -2.024 12.631 3.424
303 1HB SER 34 2HB SER 34 -1.653 11.726 5.713
304 2HB SER 34 1HB SER 34 -1.929 10.463 4.514
305 HG SER 34 HG SER 34 -0.128 10.119 6.004
306 H THR 35 H THR 35 1.432 12.280 4.198
307 HA THR 35 HA THR 35 1.631 14.561 5.825
308 HB THR 35 HB THR 35 3.833 13.427 4.098
309 HG1 THR 35 1HG THR 35 4.139 11.899 5.624
310 1HG2 THR 35 1HG2 THR 35 5.260 14.642 5.269
311 2HG2 THR 35 2HG2 THR 35 4.533 14.143 6.797
312 3HG2 THR 35 3HG2 THR 35 3.875 15.522 5.915
313 H GLU 36 H GLU 36 2.053 14.134 2.344
314 HA GLU 36 HA GLU 36 2.993 16.726 1.776
315 1HB GLU 36 2HB GLU 36 2.737 14.489 0.315
316 2HB GLU 36 1HB GLU 36 1.311 15.350 -0.246
317 1HG GLU 36 2HG GLU 36 3.258 15.728 -1.679
318 2HG GLU 36 1HG GLU 36 2.664 17.218 -0.949
319 H ARG 37 H ARG 37 -0.286 15.357 1.495
320 HA ARG 37 HA ARG 37 -1.538 17.775 0.774
321 1HB ARG 37 2HB ARG 37 -2.414 15.340 0.631
322 2HB ARG 37 1HB ARG 37 -2.934 15.588 2.292
323 1HG ARG 37 2HG ARG 37 -4.556 17.092 1.707
324 2HG ARG 37 1HG ARG 37 -3.710 17.600 0.244
325 1HD ARG 37 2HD ARG 37 -5.219 15.029 0.691
326 2HD ARG 37 1HD ARG 37 -5.653 16.349 -0.396
327 HE ARG 37 HE ARG 37 -3.190 15.549 -1.252
328 1HH1 ARG 37 1HH1 ARG 37 -6.249 13.948 -0.740
329 2HH1 ARG 37 2HH1 ARG 37 -5.985 12.774 -1.985
330 1HH2 ARG 37 1HH2 ARG 37 -2.841 14.006 -2.890
331 2HH2 ARG 37 2HH2 ARG 37 -4.051 12.806 -3.205
332 H PHE 38 H PHE 38 -0.794 16.308 3.870
333 HA PHE 38 HA PHE 38 -2.375 17.922 5.524
334 1HB PHE 38 2HB PHE 38 -1.137 15.843 6.217
335 2HB PHE 38 1HB PHE 38 0.345 16.793 6.212
336 HD1 PHE 38 1HD PHE 38 1.026 17.806 8.163
337 HD2 PHE 38 2HD PHE 38 -3.082 16.808 7.676
338 HE1 PHE 38 1HE PHE 38 0.586 18.505 10.480
339 HE2 PHE 38 2HE PHE 38 -3.530 17.506 9.992
340 HZ PHE 38 HZ PHE 38 -1.695 18.357 11.397
341 H ASN 39 H ASN 39 1.148 18.223 5.043
342 HA ASN 39 HA ASN 39 1.367 20.798 6.121
343 1HB ASN 39 2HB ASN 39 3.090 19.214 4.232
344 2HB ASN 39 1HB ASN 39 3.524 20.854 4.708
345 1HD2 ASN 39 1HD2 ASN 39 2.844 17.627 5.919
346 2HD2 ASN 39 2HD2 ASN 39 3.772 17.775 7.369
347 H TRP 40 H TRP 40 0.107 19.762 3.141
348 HA TRP 40 HA TRP 40 0.655 22.033 1.531
349 1HB TRP 40 2HB TRP 40 -0.739 19.537 1.246
350 2HB TRP 40 1HB TRP 40 -1.775 20.840 0.678
351 HD1 TRP 40 HD TRP 40 0.889 18.613 -0.499
352 HE1 TRP 40 1HE TRP 40 1.869 19.444 -2.728
353 HE3 TRP 40 3HE TRP 40 -1.080 23.331 -0.542
354 HZ2 TRP 40 2HZ TRP 40 1.814 21.790 -4.298
355 HZ3 TRP 40 3HZ TRP 40 -0.568 24.806 -2.445
356 HH2 TRP 40 HH TRP 40 0.849 24.049 -4.283
357 H LEU 41 H LEU 41 -2.554 20.969 2.586
358 HA LEU 41 HA LEU 41 -3.655 23.566 2.505
359 1HB LEU 41 2HB LEU 41 -5.591 22.610 3.577
360 2HB LEU 41 1HB LEU 41 -4.995 21.490 2.367
361 HG LEU 41 HG LEU 41 -3.731 20.460 4.465
362 1HD1 LEU 41 1HD1 LEU 41 -5.836 22.196 5.596
363 2HD1 LEU 41 2HD1 LEU 41 -4.307 21.662 6.292
364 3HD1 LEU 41 3HD1 LEU 41 -5.695 20.574 6.274
365 1HD2 LEU 41 1HD2 LEU 41 -5.574 19.543 2.874
366 2HD2 LEU 41 2HD2 LEU 41 -6.647 19.856 4.239
367 3HD2 LEU 41 3HD2 LEU 41 -5.283 18.753 4.425
368 H GLU 42 H GLU 42 -1.623 21.995 4.735
369 HA GLU 42 HA GLU 42 -2.431 23.195 7.124
370 1HB GLU 42 2HB GLU 42 -0.058 21.764 6.178
371 2HB GLU 42 1HB GLU 42 0.224 22.853 7.521
372 1HG GLU 42 2HG GLU 42 -1.939 20.770 7.535
373 2HG GLU 42 1HG GLU 42 -0.302 20.463 8.111
374 H GLY 43 H GLY 43 0.234 24.046 4.926
375 1HA GLY 43 2HA GLY 43 -0.245 26.853 5.243
376 2HA GLY 43 1HA GLY 43 1.155 26.322 6.158
377 H ALA 44 H ALA 44 1.589 24.232 3.926
378 HA ALA 44 HA ALA 44 3.531 25.688 2.508
379 1HB ALA 44 1HB ALA 44 3.524 23.621 1.002
380 2HB ALA 44 2HB ALA 44 2.313 22.975 2.110
381 3HB ALA 44 3HB ALA 44 3.921 23.392 2.704
382 H SER 45 H SER 45 0.151 25.205 1.945
383 HA SER 45 HA SER 45 0.170 25.756 -0.853
384 1HB SER 45 2HB SER 45 -1.689 24.701 0.760
385 2HB SER 45 1HB SER 45 -2.253 26.371 0.763
386 H THR 46 H THR 46 -0.169 27.693 2.061
387 HA THR 46 HA THR 46 -0.666 30.115 0.536
388 HB THR 46 HB THR 46 -1.038 31.191 2.612
389 HG1 THR 46 1HG THR 46 0.738 30.530 3.776
390 1HG2 THR 46 1HG2 THR 46 -1.945 28.364 3.086
391 2HG2 THR 46 2HG2 THR 46 -2.782 29.531 2.064
392 3HG2 THR 46 3HG2 THR 46 -2.616 29.835 3.793
393 H LYS 47 H LYS 47 1.943 28.530 2.234
394 HA LYS 47 HA LYS 47 4.197 28.877 2.162
395 1HB LYS 47 2HB LYS 47 3.493 29.847 -0.213
396 2HB LYS 47 1HB LYS 47 3.964 31.366 0.538
397 1HG LYS 47 2HG LYS 47 6.169 30.375 1.061
398 2HG LYS 47 1HG LYS 47 5.685 28.922 0.184
399 1HD LYS 47 2HD LYS 47 5.154 30.691 -1.715
400 2HD LYS 47 1HD LYS 47 6.366 31.630 -0.841
401 1HE LYS 47 2HE LYS 47 6.698 28.884 -2.036
402 2HE LYS 47 1HE LYS 47 7.459 30.380 -2.578
403 1HZ LYS 47 1HZ LYS 47 8.576 30.479 -0.383
404 2HZ LYS 47 2HZ LYS 47 9.035 29.143 -1.313
405 3HZ LYS 47 3HZ LYS 47 7.954 28.945 -0.027
406 HA PRO 48 HA PRO 48 3.631 32.023 5.464
407 1HB PRO 48 2HB PRO 48 5.099 30.700 7.318
408 2HB PRO 48 1HB PRO 48 3.396 30.338 7.013
409 1HG PRO 48 2HG PRO 48 5.840 28.920 6.023
410 2HG PRO 48 1HG PRO 48 4.332 28.238 6.659
411 1HD PRO 48 2HD PRO 48 4.861 28.395 4.005
412 2HD PRO 48 1HD PRO 48 3.217 28.518 4.662
413 H VAL 49 H VAL 49 5.627 32.614 7.136
414 HA VAL 49 HA VAL 49 7.544 33.810 7.319
415 HB VAL 49 HB VAL 49 8.286 31.338 6.380
416 1HG1 VAL 49 1HG1 VAL 49 9.863 31.497 4.659
417 2HG1 VAL 49 2HG1 VAL 49 9.912 33.257 4.743
418 3HG1 VAL 49 3HG1 VAL 49 8.494 32.445 4.081
419 1HG2 VAL 49 1HG2 VAL 49 10.688 32.398 6.886
420 2HG2 VAL 49 2HG2 VAL 49 9.517 32.020 8.149
421 3HG2 VAL 49 3HG2 VAL 49 9.665 33.673 7.551
422 H GLN 50 H GLN 50 9.256 35.076 5.994
423 HA GLN 50 HA GLN 50 8.538 35.847 3.337
424 1HB GLN 50 2HB GLN 50 7.676 37.516 5.661
425 2HB GLN 50 1HB GLN 50 8.210 38.323 4.192
426 1HG GLN 50 2HG GLN 50 6.111 38.130 3.499
427 2HG GLN 50 1HG GLN 50 6.470 36.423 3.247
428 1HE2 GLN 50 1HE2 GLN 50 5.936 38.352 6.173
429 2HE2 GLN 50 2HE2 GLN 50 4.640 37.385 6.782
430 H THR 51 H THR 51 10.212 36.795 6.315
431 HA THR 51 HA THR 51 12.275 38.204 4.883
432 HB THR 51 HB THR 51 12.347 37.343 7.774
433 HG1 THR 51 1HG THR 51 10.875 38.759 8.203
434 1HG2 THR 51 1HG2 THR 51 13.946 38.894 8.131
435 2HG2 THR 51 2HG2 THR 51 13.351 39.965 6.862
436 3HG2 THR 51 3HG2 THR 51 14.306 38.544 6.440
437 H SER 52 H SER 52 13.100 36.597 3.489
438 HA SER 52 HA SER 52 14.346 34.251 4.678
439 1HB SER 52 2HB SER 52 15.020 34.038 2.092
440 2HB SER 52 1HB SER 52 13.441 33.542 2.700
441 HG SER 52 HG SER 52 12.561 35.416 1.945
Start of MODEL 7
1 1H MET 1 1H MET 1 -5.703 -27.077 8.314
2 HA MET 1 HA MET 1 -5.237 -29.842 7.875
3 1HB MET 1 2HB MET 1 -7.452 -28.616 6.235
4 2HB MET 1 1HB MET 1 -6.554 -30.027 5.694
5 1HG MET 1 2HG MET 1 -7.603 -31.407 7.117
6 2HG MET 1 1HG MET 1 -7.640 -30.213 8.414
7 1HE MET 1 1HE MET 1 -9.060 -30.821 4.820
8 2HE MET 1 2HE MET 1 -8.990 -29.063 4.934
9 3HE MET 1 3HE MET 1 -10.551 -29.880 4.860
10 H TRP 2 H TRP 2 -3.978 -27.187 7.840
11 HA TRP 2 HA TRP 2 -2.573 -25.865 6.594
12 1HB TRP 2 2HB TRP 2 -1.707 -28.518 5.446
13 2HB TRP 2 1HB TRP 2 -0.720 -27.084 5.708
14 HD1 TRP 2 HD TRP 2 -1.098 -26.386 8.643
15 HE1 TRP 2 1HE TRP 2 -0.431 -27.994 10.540
16 HE3 TRP 2 3HE TRP 2 -1.146 -30.784 6.035
17 HZ2 TRP 2 2HZ TRP 2 0.014 -30.760 10.884
18 HZ3 TRP 2 3HZ TRP 2 -0.587 -32.865 7.222
19 HH2 TRP 2 HH TRP 2 -0.018 -32.852 9.597
20 H ARG 3 H ARG 3 -5.141 -26.226 5.322
21 HA ARG 3 HA ARG 3 -6.203 -25.907 3.331
22 1HB ARG 3 2HB ARG 3 -3.591 -24.728 2.392
23 2HB ARG 3 1HB ARG 3 -5.213 -24.318 1.851
24 1HG ARG 3 2HG ARG 3 -5.629 -22.986 3.641
25 2HG ARG 3 1HG ARG 3 -4.602 -23.928 4.723
26 1HD ARG 3 2HD ARG 3 -2.614 -22.997 3.686
27 2HD ARG 3 1HD ARG 3 -3.608 -22.109 2.532
28 HE ARG 3 HE ARG 3 -4.012 -20.532 4.142
29 1HH1 ARG 3 1HH1 ARG 3 -2.693 -23.384 5.660
30 2HH1 ARG 3 2HH1 ARG 3 -2.503 -22.626 7.205
31 1HH2 ARG 3 1HH2 ARG 3 -3.761 -19.532 6.174
32 2HH2 ARG 3 2HH2 ARG 3 -3.109 -20.440 7.497
33 H ILE 4 H ILE 4 -5.303 -28.464 3.558
34 HA ILE 4 HA ILE 4 -4.647 -30.343 2.428
35 HB ILE 4 HB ILE 4 -5.665 -28.945 -0.033
36 1HG1 ILE 4 2HG1 ILE 4 -7.275 -28.498 1.737
37 2HG1 ILE 4 1HG1 ILE 4 -7.931 -29.697 0.627
38 1HG2 ILE 4 1HG2 ILE 4 -6.401 -31.724 0.537
39 2HG2 ILE 4 2HG2 ILE 4 -4.673 -31.454 0.304
40 3HG2 ILE 4 3HG2 ILE 4 -5.817 -30.985 -0.953
41 1HD1 ILE 4 1HD1 ILE 4 -8.489 -30.639 2.618
42 2HD1 ILE 4 2HD1 ILE 4 -7.077 -29.988 3.451
43 3HD1 ILE 4 3HD1 ILE 4 -6.904 -31.375 2.375
44 H TRP 5 H TRP 5 -2.655 -28.187 2.587
45 HA TRP 5 HA TRP 5 -0.421 -28.190 1.996
46 1HB TRP 5 2HB TRP 5 -0.916 -30.440 0.810
47 2HB TRP 5 1HB TRP 5 -1.042 -29.468 -0.653
48 HD1 TRP 5 HD TRP 5 1.563 -29.856 2.215
49 HE1 TRP 5 1HE TRP 5 3.907 -29.818 1.153
50 HE3 TRP 5 3HE TRP 5 0.230 -29.169 -2.673
51 HZ2 TRP 5 2HZ TRP 5 5.041 -29.535 -1.417
52 HZ3 TRP 5 3HZ TRP 5 2.005 -29.024 -4.371
53 HH2 TRP 5 HH TRP 5 4.360 -29.203 -3.753
54 H GLN 6 H GLN 6 -2.841 -27.559 -0.510
55 HA GLN 6 HA GLN 6 -2.186 -24.838 -0.727
56 1HB GLN 6 2HB GLN 6 -0.297 -26.358 -2.001
57 2HB GLN 6 1HB GLN 6 -1.415 -26.006 -3.312
58 1HG GLN 6 2HG GLN 6 0.189 -24.302 -3.375
59 2HG GLN 6 1HG GLN 6 -1.236 -23.577 -2.635
60 1HE2 GLN 6 1HE2 GLN 6 2.060 -24.347 -2.276
61 2HE2 GLN 6 2HE2 GLN 6 2.266 -23.756 -0.666
62 H LEU 7 H LEU 7 -3.515 -27.696 -2.289
63 HA LEU 7 HA LEU 7 -5.513 -28.069 -3.314
64 1HB LEU 7 2HB LEU 7 -6.390 -25.255 -2.785
65 2HB LEU 7 1HB LEU 7 -7.354 -26.717 -2.859
66 HG LEU 7 HG LEU 7 -5.603 -27.101 -0.704
67 1HD1 LEU 7 1HD1 LEU 7 -4.996 -25.001 -0.163
68 2HD1 LEU 7 2HD1 LEU 7 -6.604 -24.945 0.558
69 3HD1 LEU 7 3HD1 LEU 7 -6.334 -24.270 -1.048
70 1HD2 LEU 7 1HD2 LEU 7 -7.830 -27.965 -0.764
71 2HD2 LEU 7 2HD2 LEU 7 -8.514 -26.341 -0.843
72 3HD2 LEU 7 3HD2 LEU 7 -7.702 -26.886 0.625
73 H PHE 8 H PHE 8 -4.934 -24.602 -3.932
74 HA PHE 8 HA PHE 8 -5.130 -25.173 -6.805
75 1HB PHE 8 2HB PHE 8 -5.744 -22.793 -5.116
76 2HB PHE 8 1HB PHE 8 -5.228 -22.515 -6.777
77 HD1 PHE 8 1HD PHE 8 -7.117 -21.834 -7.920
78 HD2 PHE 8 2HD PHE 8 -7.352 -25.212 -5.344
79 HE1 PHE 8 1HE PHE 8 -9.409 -22.266 -8.704
80 HE2 PHE 8 2HE PHE 8 -9.645 -25.652 -6.122
81 HZ PHE 8 HZ PHE 8 -10.676 -24.178 -7.805
82 H ASP 9 H ASP 9 -3.351 -22.970 -4.658
83 HA ASP 9 HA ASP 9 -1.037 -22.777 -4.460
84 1HB ASP 9 2HB ASP 9 -0.927 -24.763 -6.236
85 2HB ASP 9 1HB ASP 9 -0.453 -23.441 -7.298
86 HA PRO 10 HA PRO 10 -0.674 -19.507 -8.087
87 1HB PRO 10 2HB PRO 10 -3.469 -19.650 -9.099
88 2HB PRO 10 1HB PRO 10 -1.965 -19.358 -9.981
89 1HG PRO 10 2HG PRO 10 -3.196 -21.711 -10.141
90 2HG PRO 10 1HG PRO 10 -1.426 -21.611 -10.069
91 1HD PRO 10 2HD PRO 10 -3.374 -22.357 -7.932
92 2HD PRO 10 1HD PRO 10 -1.766 -23.021 -8.278
93 H ARG 11 H ARG 11 -3.742 -20.089 -6.437
94 HA ARG 11 HA ARG 11 -4.390 -17.352 -6.040
95 1HB ARG 11 2HB ARG 11 -5.815 -19.598 -5.821
96 2HB ARG 11 1HB ARG 11 -5.375 -19.408 -4.129
97 1HG ARG 11 2HG ARG 11 -7.228 -18.162 -4.023
98 2HG ARG 11 1HG ARG 11 -6.212 -16.902 -4.728
99 1HD ARG 11 2HD ARG 11 -7.825 -18.842 -6.369
100 2HD ARG 11 1HD ARG 11 -8.436 -17.271 -5.854
101 HE ARG 11 HE ARG 11 -6.029 -16.770 -7.095
102 1HH1 ARG 11 1HH1 ARG 11 -9.074 -18.222 -7.989
103 2HH1 ARG 11 2HH1 ARG 11 -8.949 -17.757 -9.652
104 1HH2 ARG 11 1HH2 ARG 11 -5.864 -16.157 -9.281
105 2HH2 ARG 11 2HH2 ARG 11 -7.127 -16.584 -10.386
106 H GLN 12 H GLN 12 -2.927 -19.819 -3.939
107 HA GLN 12 HA GLN 12 -2.630 -18.239 -1.655
108 1HB GLN 12 2HB GLN 12 -2.136 -20.822 -2.213
109 2HB GLN 12 1HB GLN 12 -0.491 -20.205 -2.249
110 1HG GLN 12 2HG GLN 12 -2.247 -19.525 0.056
111 2HG GLN 12 1HG GLN 12 -1.528 -21.131 -0.040
112 1HE2 GLN 12 1HE2 GLN 12 0.723 -21.339 0.056
113 2HE2 GLN 12 2HE2 GLN 12 1.725 -20.082 0.690
114 H ALA 13 H ALA 13 -0.255 -18.911 -4.226
115 HA ALA 13 HA ALA 13 1.750 -17.209 -3.225
116 1HB ALA 13 1HB ALA 13 1.241 -18.184 -6.033
117 2HB ALA 13 2HB ALA 13 2.293 -18.921 -4.824
118 3HB ALA 13 3HB ALA 13 2.706 -17.350 -5.512
119 H LEU 14 H LEU 14 -1.018 -16.636 -5.295
120 HA LEU 14 HA LEU 14 -0.238 -14.051 -6.185
121 1HB LEU 14 2HB LEU 14 -2.752 -15.647 -6.194
122 2HB LEU 14 1HB LEU 14 -2.878 -13.918 -6.459
123 HG LEU 14 HG LEU 14 -1.113 -15.725 -8.107
124 1HD1 LEU 14 1HD1 LEU 14 -2.816 -15.706 -9.798
125 2HD1 LEU 14 2HD1 LEU 14 -3.849 -14.677 -8.806
126 3HD1 LEU 14 3HD1 LEU 14 -3.508 -16.332 -8.301
127 1HD2 LEU 14 1HD2 LEU 14 -2.115 -12.920 -8.577
128 2HD2 LEU 14 2HD2 LEU 14 -1.071 -13.852 -9.651
129 3HD2 LEU 14 3HD2 LEU 14 -0.484 -13.353 -8.064
130 H VAL 15 H VAL 15 -2.162 -15.241 -3.479
131 HA VAL 15 HA VAL 15 -2.993 -12.680 -2.567
132 HB VAL 15 HB VAL 15 -2.744 -15.221 -0.950
133 1HG1 VAL 15 1HG1 VAL 15 -3.027 -13.279 0.451
134 2HG1 VAL 15 2HG1 VAL 15 -4.537 -14.190 0.414
135 3HG1 VAL 15 3HG1 VAL 15 -4.373 -12.716 -0.540
136 1HG2 VAL 15 1HG2 VAL 15 -5.406 -14.498 -1.874
137 2HG2 VAL 15 2HG2 VAL 15 -4.570 -16.050 -1.931
138 3HG2 VAL 15 3HG2 VAL 15 -4.300 -14.856 -3.200
139 H GLY 16 H GLY 16 -0.129 -14.616 -2.125
140 1HA GLY 16 2HA GLY 16 0.832 -13.217 0.184
141 2HA GLY 16 1HA GLY 16 1.762 -14.303 -0.841
142 H LEU 17 H LEU 17 1.864 -13.246 -3.220
143 HA LEU 17 HA LEU 17 3.655 -11.094 -2.990
144 1HB LEU 17 2HB LEU 17 3.425 -10.988 -5.478
145 2HB LEU 17 1HB LEU 17 3.844 -12.566 -4.839
146 HG LEU 17 HG LEU 17 1.168 -12.828 -4.956
147 1HD1 LEU 17 1HD1 LEU 17 1.547 -11.478 -7.540
148 2HD1 LEU 17 2HD1 LEU 17 1.409 -10.420 -6.135
149 3HD1 LEU 17 3HD1 LEU 17 0.126 -11.573 -6.500
150 1HD2 LEU 17 1HD2 LEU 17 1.524 -14.074 -7.011
151 2HD2 LEU 17 2HD2 LEU 17 2.857 -14.343 -5.889
152 3HD2 LEU 17 3HD2 LEU 17 3.065 -13.254 -7.261
153 H ALA 18 H ALA 18 0.299 -11.235 -4.133
154 HA ALA 18 HA ALA 18 -0.026 -8.548 -4.785
155 1HB ALA 18 1HB ALA 18 -2.407 -8.942 -4.634
156 2HB ALA 18 2HB ALA 18 -2.133 -10.408 -3.693
157 3HB ALA 18 3HB ALA 18 -1.618 -10.332 -5.379
158 H THR 19 H THR 19 -0.671 -10.202 -1.696
159 HA THR 19 HA THR 19 -1.577 -7.888 -0.344
160 HB THR 19 HB THR 19 -0.403 -10.464 0.720
161 HG1 THR 19 1HG THR 19 -2.407 -10.604 -0.427
162 1HG2 THR 19 1HG2 THR 19 -2.056 -9.543 2.673
163 2HG2 THR 19 2HG2 THR 19 -1.262 -8.062 2.137
164 3HG2 THR 19 3HG2 THR 19 -0.296 -9.431 2.691
165 H PHE 20 H PHE 20 1.592 -9.295 -0.836
166 HA PHE 20 HA PHE 20 3.032 -7.833 1.070
167 1HB PHE 20 2HB PHE 20 3.675 -9.796 -0.674
168 2HB PHE 20 1HB PHE 20 4.394 -8.415 -1.493
169 HD1 PHE 20 1HD PHE 20 6.392 -7.442 -0.719
170 HD2 PHE 20 2HD PHE 20 4.374 -10.336 1.659
171 HE1 PHE 20 1HE PHE 20 8.347 -7.576 0.770
172 HE2 PHE 20 2HE PHE 20 6.325 -10.476 3.152
173 HZ PHE 20 HZ PHE 20 8.315 -9.094 2.708
174 H LEU 21 H LEU 21 2.654 -7.176 -2.426
175 HA LEU 21 HA LEU 21 3.927 -4.651 -2.287
176 1HB LEU 21 2HB LEU 21 3.195 -4.310 -4.541
177 2HB LEU 21 1HB LEU 21 3.700 -5.978 -4.364
178 HG LEU 21 HG LEU 21 1.068 -6.275 -3.912
179 1HD1 LEU 21 1HD1 LEU 21 -0.156 -4.880 -5.534
180 2HD1 LEU 21 2HD1 LEU 21 1.305 -3.925 -5.783
181 3HD1 LEU 21 3HD1 LEU 21 0.520 -3.941 -4.204
182 1HD2 LEU 21 1HD2 LEU 21 2.784 -6.420 -6.313
183 2HD2 LEU 21 2HD2 LEU 21 1.042 -6.511 -6.575
184 3HD2 LEU 21 3HD2 LEU 21 1.837 -7.675 -5.515
185 H PHE 22 H PHE 22 0.528 -5.637 -2.215
186 HA PHE 22 HA PHE 22 -0.661 -3.125 -2.304
187 1HB PHE 22 2HB PHE 22 -1.460 -5.813 -1.393
188 2HB PHE 22 1HB PHE 22 -2.355 -4.486 -0.663
189 HD1 PHE 22 1HD PHE 22 -4.228 -3.711 -1.738
190 HD2 PHE 22 2HD PHE 22 -1.196 -5.643 -4.015
191 HE1 PHE 22 1HE PHE 22 -5.641 -3.554 -3.746
192 HE2 PHE 22 2HE PHE 22 -2.604 -5.489 -6.027
193 HZ PHE 22 HZ PHE 22 -4.829 -4.442 -5.894
194 H VAL 23 H VAL 23 0.292 -5.012 0.570
195 HA VAL 23 HA VAL 23 -0.486 -3.069 2.443
196 HB VAL 23 HB VAL 23 0.757 -4.331 4.069
197 1HG1 VAL 23 1HG1 VAL 23 -0.919 -5.715 2.078
198 2HG1 VAL 23 2HG1 VAL 23 -1.146 -5.526 3.816
199 3HG1 VAL 23 3HG1 VAL 23 -0.028 -6.743 3.198
200 1HG2 VAL 23 1HG2 VAL 23 2.126 -6.302 3.358
201 2HG2 VAL 23 2HG2 VAL 23 2.837 -4.732 2.986
202 3HG2 VAL 23 3HG2 VAL 23 2.054 -5.670 1.716
203 H LEU 24 H LEU 24 2.722 -3.838 1.108
204 HA LEU 24 HA LEU 24 4.207 -1.947 2.490
205 1HB LEU 24 2HB LEU 24 4.872 -3.846 0.796
206 2HB LEU 24 1HB LEU 24 4.816 -2.540 -0.373
207 HG LEU 24 HG LEU 24 7.088 -2.926 0.457
208 1HD1 LEU 24 1HD1 LEU 24 6.124 -0.305 1.556
209 2HD1 LEU 24 2HD1 LEU 24 6.156 -0.634 -0.177
210 3HD1 LEU 24 3HD1 LEU 24 7.652 -0.674 0.756
211 1HD2 LEU 24 1HD2 LEU 24 6.388 -1.828 3.123
212 2HD2 LEU 24 2HD2 LEU 24 7.684 -2.930 2.655
213 3HD2 LEU 24 3HD2 LEU 24 6.032 -3.528 2.815
214 H ALA 25 H ALA 25 2.973 -1.640 -0.836
215 HA ALA 25 HA ALA 25 3.582 1.062 -1.168
216 1HB ALA 25 1HB ALA 25 1.953 1.015 -3.016
217 2HB ALA 25 2HB ALA 25 1.396 -0.563 -2.462
218 3HB ALA 25 3HB ALA 25 3.048 -0.366 -3.047
219 H LEU 26 H LEU 26 0.825 -0.503 0.325
220 HA LEU 26 HA LEU 26 -0.882 1.745 0.425
221 1HB LEU 26 2HB LEU 26 -0.725 -0.875 1.823
222 2HB LEU 26 1HB LEU 26 -1.709 0.375 2.559
223 HG LEU 26 HG LEU 26 -2.075 -0.462 -0.308
224 1HD1 LEU 26 1HD1 LEU 26 -3.868 -1.918 0.418
225 2HD1 LEU 26 2HD1 LEU 26 -3.526 -1.537 2.106
226 3HD1 LEU 26 3HD1 LEU 26 -2.343 -2.425 1.145
227 1HD2 LEU 26 1HD2 LEU 26 -4.258 0.544 -0.041
228 2HD2 LEU 26 2HD2 LEU 26 -3.007 1.708 0.398
229 3HD2 LEU 26 3HD2 LEU 26 -3.925 0.882 1.657
230 H LEU 27 H LEU 27 1.441 0.415 2.753
231 HA LEU 27 HA LEU 27 0.995 2.282 4.799
232 1HB LEU 27 2HB LEU 27 3.160 0.374 4.096
233 2HB LEU 27 1HB LEU 27 3.543 1.632 5.255
234 1HD1 LEU 27 1HD2 LEU 27 1.187 -1.403 4.896
235 2HD1 LEU 27 2HD2 LEU 27 0.311 0.125 4.801
236 3HD1 LEU 27 3HD2 LEU 27 0.273 -0.822 6.288
237 1HD2 LEU 27 1HD1 LEU 27 3.831 -1.048 5.744
238 2HD2 LEU 27 2HD1 LEU 27 2.621 -1.647 6.879
239 3HD2 LEU 27 3HD1 LEU 27 3.664 -0.299 7.332
240 H ILE 28 H ILE 28 3.614 2.202 2.361
241 HA ILE 28 HA ILE 28 4.730 4.671 3.070
242 HB ILE 28 HB ILE 28 5.809 4.622 0.857
243 1HG1 ILE 28 2HG1 ILE 28 4.031 2.219 0.415
244 2HG1 ILE 28 1HG1 ILE 28 4.018 3.721 -0.501
245 1HG2 ILE 28 1HG2 ILE 28 7.175 2.736 1.272
246 2HG2 ILE 28 2HG2 ILE 28 5.869 1.888 2.099
247 3HG2 ILE 28 3HG2 ILE 28 6.613 3.304 2.845
248 1HD1 ILE 28 1HD1 ILE 28 5.252 2.523 -1.940
249 2HD1 ILE 28 2HD1 ILE 28 5.803 1.398 -0.699
250 3HD1 ILE 28 3HD1 ILE 28 6.573 2.976 -0.863
251 H HIS 29 H HIS 29 2.347 3.836 0.575
252 HA HIS 29 HA HIS 29 2.066 6.410 -0.510
253 1HB HIS 29 2HB HIS 29 1.236 4.311 -1.571
254 2HB HIS 29 1HB HIS 29 -0.048 4.253 -0.367
255 HD1 HIS 29 1HD HIS 29 1.191 7.104 -2.574
256 HD2 HIS 29 2HD HIS 29 -2.295 5.047 -1.634
257 HE1 HIS 29 1HE HIS 29 -0.635 8.252 -3.867
258 HE2 HIS 29 2HE HIS 29 -2.748 7.045 -3.213
259 H PHE 30 H PHE 30 0.527 4.820 2.211
260 HA PHE 30 HA PHE 30 -1.483 6.742 2.677
261 1HB PHE 30 2HB PHE 30 -1.555 4.470 3.618
262 2HB PHE 30 1HB PHE 30 -0.170 4.847 4.636
263 HD1 PHE 30 1HD PHE 30 -3.747 5.286 4.139
264 HD2 PHE 30 2HD PHE 30 -0.397 6.361 6.533
265 HE1 PHE 30 1HE PHE 30 -5.267 6.122 5.885
266 HE2 PHE 30 2HE PHE 30 -1.910 7.198 8.282
267 HZ PHE 30 HZ PHE 30 -4.349 7.079 7.960
268 H ILE 31 H ILE 31 1.821 6.392 3.961
269 HA ILE 31 HA ILE 31 1.606 8.548 5.779
270 HB ILE 31 HB ILE 31 3.474 6.619 5.397
271 1HG1 ILE 31 2HG1 ILE 31 3.067 7.845 7.469
272 2HG1 ILE 31 1HG1 ILE 31 4.791 7.784 7.118
273 1HG2 ILE 31 1HG2 ILE 31 4.450 7.688 3.453
274 2HG2 ILE 31 2HG2 ILE 31 5.590 7.691 4.795
275 3HG2 ILE 31 3HG2 ILE 31 4.720 9.165 4.376
276 1HD1 ILE 31 1HD1 ILE 31 4.358 9.965 7.861
277 2HD1 ILE 31 2HD1 ILE 31 2.920 10.111 6.848
278 3HD1 ILE 31 3HD1 ILE 31 4.522 10.087 6.109
279 H LEU 32 H LEU 32 3.004 8.328 2.497
280 HA LEU 32 HA LEU 32 3.688 11.059 2.320
281 1HB LEU 32 2HB LEU 32 3.825 10.706 -0.091
282 2HB LEU 32 1HB LEU 32 4.617 9.410 0.782
283 HG LEU 32 HG LEU 32 2.410 8.114 0.456
284 1HD1 LEU 32 1HD1 LEU 32 1.601 9.059 -1.964
285 2HD1 LEU 32 2HD1 LEU 32 1.918 10.556 -1.088
286 3HD1 LEU 32 3HD1 LEU 32 0.784 9.375 -0.435
287 1HD2 LEU 32 1HD2 LEU 32 3.168 7.780 -2.075
288 2HD2 LEU 32 2HD2 LEU 32 4.115 7.173 -0.717
289 3HD2 LEU 32 3HD2 LEU 32 4.564 8.689 -1.497
290 H LEU 33 H LEU 33 0.740 9.304 1.996
291 HA LEU 33 HA LEU 33 -0.799 11.155 0.549
292 1HB LEU 33 2HB LEU 33 -1.214 8.712 1.926
293 2HB LEU 33 1HB LEU 33 -2.373 9.862 2.565
294 HG LEU 33 HG LEU 33 -2.734 10.350 -0.012
295 1HD1 LEU 33 1HD1 LEU 33 -1.820 7.477 0.087
296 2HD1 LEU 33 2HD1 LEU 33 -1.078 8.795 -0.819
297 3HD1 LEU 33 3HD1 LEU 33 -2.681 8.214 -1.264
298 1HD2 LEU 33 1HD2 LEU 33 -4.619 8.740 0.067
299 2HD2 LEU 33 2HD2 LEU 33 -4.495 9.734 1.518
300 3HD2 LEU 33 3HD2 LEU 33 -3.935 8.062 1.544
301 H SER 34 H SER 34 -0.857 10.524 4.042
302 HA SER 34 HA SER 34 -2.182 12.886 4.749
303 1HB SER 34 2HB SER 34 -0.431 10.967 6.272
304 2HB SER 34 1HB SER 34 -1.064 12.422 7.042
305 HG SER 34 HG SER 34 -2.317 10.092 6.491
306 H THR 35 H THR 35 1.063 12.313 3.765
307 HA THR 35 HA THR 35 2.255 14.545 5.112
308 HB THR 35 HB THR 35 3.164 13.004 2.673
309 HG1 THR 35 1HG THR 35 3.660 12.743 5.436
310 1HG2 THR 35 1HG2 THR 35 4.975 14.260 2.509
311 2HG2 THR 35 2HG2 THR 35 5.270 14.169 4.246
312 3HG2 THR 35 3HG2 THR 35 4.198 15.410 3.597
313 H GLU 36 H GLU 36 1.588 14.036 1.646
314 HA GLU 36 HA GLU 36 1.951 16.711 0.894
315 1HB GLU 36 2HB GLU 36 1.796 14.562 -0.558
316 2HB GLU 36 1HB GLU 36 0.065 14.871 -0.550
317 1HG GLU 36 2HG GLU 36 0.230 16.599 -1.968
318 2HG GLU 36 1HG GLU 36 1.732 17.181 -1.250
319 H ARG 37 H ARG 37 -0.914 14.932 1.927
320 HA ARG 37 HA ARG 37 -2.799 16.961 1.370
321 1HB ARG 37 2HB ARG 37 -2.953 14.374 2.237
322 2HB ARG 37 1HB ARG 37 -3.356 15.252 3.706
323 1HG ARG 37 2HG ARG 37 -5.439 15.141 2.876
324 2HG ARG 37 1HG ARG 37 -4.922 16.549 1.946
325 1HD ARG 37 2HD ARG 37 -4.919 15.417 0.003
326 2HD ARG 37 1HD ARG 37 -4.234 13.967 0.736
327 HE ARG 37 HE ARG 37 -6.984 14.436 1.436
328 1HH1 ARG 37 1HH1 ARG 37 -4.828 13.001 -0.904
329 2HH1 ARG 37 2HH1 ARG 37 -6.001 11.862 -1.473
330 1HH2 ARG 37 1HH2 ARG 37 -8.529 12.939 0.688
331 2HH2 ARG 37 2HH2 ARG 37 -8.103 11.827 -0.570
332 H PHE 38 H PHE 38 -0.730 16.272 4.121
333 HA PHE 38 HA PHE 38 -1.864 18.084 5.950
334 1HB PHE 38 2HB PHE 38 0.627 16.542 5.729
335 2HB PHE 38 1HB PHE 38 0.803 18.051 6.617
336 HD1 PHE 38 1HD PHE 38 1.050 17.362 8.821
337 HD2 PHE 38 2HD PHE 38 -2.134 15.782 6.480
338 HE1 PHE 38 1HE PHE 38 0.109 16.295 10.828
339 HE2 PHE 38 2HE PHE 38 -3.080 14.712 8.484
340 HZ PHE 38 HZ PHE 38 -1.958 14.968 10.660
341 H ASN 39 H ASN 39 1.146 18.470 4.065
342 HA ASN 39 HA ASN 39 1.421 21.221 4.547
343 1HB ASN 39 2HB ASN 39 2.921 21.157 2.500
344 2HB ASN 39 1HB ASN 39 3.335 20.039 3.796
345 1HD2 ASN 39 1HD2 ASN 39 1.498 20.231 0.777
346 2HD2 ASN 39 2HD2 ASN 39 1.826 18.613 0.273
347 H TRP 40 H TRP 40 -0.686 19.530 2.480
348 HA TRP 40 HA TRP 40 -1.088 21.508 0.473
349 1HB TRP 40 2HB TRP 40 -1.686 19.185 0.041
350 2HB TRP 40 1HB TRP 40 -2.847 19.208 1.363
351 HD1 TRP 40 HD TRP 40 -4.982 21.003 0.971
352 HE1 TRP 40 1HE TRP 40 -6.257 21.488 -1.211
353 HE3 TRP 40 3HE TRP 40 -1.531 19.284 -2.387
354 HZ2 TRP 40 2HZ TRP 40 -5.854 21.184 -3.989
355 HZ3 TRP 40 3HZ TRP 40 -2.054 19.416 -4.788
356 HH2 TRP 40 HH TRP 40 -4.172 20.346 -5.570
357 H LEU 41 H LEU 41 -3.445 20.350 2.858
358 HA LEU 41 HA LEU 41 -4.972 22.719 2.812
359 1HB LEU 41 2HB LEU 41 -5.958 20.652 3.571
360 2HB LEU 41 1HB LEU 41 -4.773 20.503 4.855
361 HG LEU 41 HG LEU 41 -6.315 22.984 5.003
362 1HD1 LEU 41 1HD1 LEU 41 -7.700 20.346 4.893
363 2HD1 LEU 41 2HD1 LEU 41 -8.220 21.918 4.285
364 3HD1 LEU 41 3HD1 LEU 41 -8.272 21.581 6.016
365 1HD2 LEU 41 1HD2 LEU 41 -4.750 21.859 6.711
366 2HD2 LEU 41 2HD2 LEU 41 -6.129 20.818 7.063
367 3HD2 LEU 41 3HD2 LEU 41 -6.262 22.561 7.289
368 H GLU 42 H GLU 42 -1.996 21.908 4.255
369 HA GLU 42 HA GLU 42 -2.038 23.544 6.513
370 1HB GLU 42 2HB GLU 42 0.003 22.154 4.951
371 2HB GLU 42 1HB GLU 42 0.586 23.568 5.807
372 1HG GLU 42 2HG GLU 42 -0.080 22.677 7.903
373 2HG GLU 42 1HG GLU 42 -0.965 21.361 7.131
374 H GLY 43 H GLY 43 -0.300 24.134 3.463
375 1HA GLY 43 2HA GLY 43 -1.307 26.797 3.208
376 2HA GLY 43 1HA GLY 43 0.334 26.781 3.835
377 H ALA 44 H ALA 44 -1.704 26.052 1.085
378 HA ALA 44 HA ALA 44 0.329 25.033 -0.597
379 1HB ALA 44 1HB ALA 44 -2.345 25.145 -0.798
380 2HB ALA 44 2HB ALA 44 -1.281 24.870 -2.177
381 3HB ALA 44 3HB ALA 44 -1.911 26.485 -1.859
382 H SER 45 H SER 45 2.049 26.536 -0.115
383 HA SER 45 HA SER 45 3.496 28.100 -0.955
384 1HB SER 45 2HB SER 45 2.067 27.895 -3.105
385 2HB SER 45 1HB SER 45 1.292 29.381 -2.557
386 H THR 46 H THR 46 1.943 28.351 1.428
387 HA THR 46 HA THR 46 2.167 31.234 1.784
388 HB THR 46 HB THR 46 0.003 31.548 2.663
389 HG1 THR 46 1HG THR 46 -0.189 29.678 3.895
390 1HG2 THR 46 1HG2 THR 46 -1.550 30.807 0.965
391 2HG2 THR 46 2HG2 THR 46 -0.370 29.639 0.370
392 3HG2 THR 46 3HG2 THR 46 -0.049 31.367 0.228
393 H LYS 47 H LYS 47 3.185 28.367 2.795
394 HA LYS 47 HA LYS 47 3.919 29.361 5.375
395 1HB LYS 47 2HB LYS 47 1.865 28.620 6.187
396 2HB LYS 47 1HB LYS 47 1.840 27.211 5.142
397 1HG LYS 47 2HG LYS 47 3.289 26.015 6.513
398 2HG LYS 47 1HG LYS 47 3.883 27.471 7.315
399 1HD LYS 47 2HD LYS 47 2.448 26.327 8.846
400 2HD LYS 47 1HD LYS 47 1.598 27.769 8.288
401 1HE LYS 47 2HE LYS 47 0.734 26.016 6.457
402 2HE LYS 47 1HE LYS 47 1.023 24.908 7.798
403 1HZ LYS 47 1HZ LYS 47 -0.300 26.752 9.095
404 2HZ LYS 47 2HZ LYS 47 -1.103 25.530 8.245
405 3HZ LYS 47 3HZ LYS 47 -0.936 27.067 7.558
406 HA PRO 48 HA PRO 48 5.948 24.949 4.832
407 1HB PRO 48 2HB PRO 48 5.408 23.838 2.340
408 2HB PRO 48 1HB PRO 48 4.653 23.351 3.861
409 1HG PRO 48 2HG PRO 48 3.631 25.189 1.739
410 2HG PRO 48 1HG PRO 48 2.754 23.986 2.702
411 1HD PRO 48 2HD PRO 48 2.582 26.594 3.264
412 2HD PRO 48 1HD PRO 48 2.631 25.379 4.559
413 H VAL 49 H VAL 49 5.471 25.862 1.430
414 HA VAL 49 HA VAL 49 8.343 26.371 1.215
415 HB VAL 49 HB VAL 49 6.391 26.395 -1.076
416 1HG1 VAL 49 1HG1 VAL 49 9.322 26.371 -0.741
417 2HG1 VAL 49 2HG1 VAL 49 8.328 27.080 -2.014
418 3HG1 VAL 49 3HG1 VAL 49 8.679 25.351 -2.027
419 1HG2 VAL 49 1HG2 VAL 49 7.416 24.087 0.472
420 2HG2 VAL 49 2HG2 VAL 49 7.408 23.938 -1.285
421 3HG2 VAL 49 3HG2 VAL 49 5.907 24.273 -0.421
422 H GLN 50 H GLN 50 9.070 28.238 -0.079
423 HA GLN 50 HA GLN 50 9.297 30.511 -0.184
424 1HB GLN 50 2HB GLN 50 6.393 30.557 -0.965
425 2HB GLN 50 1HB GLN 50 7.696 31.583 -1.543
426 1HG GLN 50 2HG GLN 50 7.211 28.692 -2.197
427 2HG GLN 50 1HG GLN 50 7.123 30.077 -3.284
428 1HE2 GLN 50 1HE2 GLN 50 8.631 27.970 -4.010
429 2HE2 GLN 50 2HE2 GLN 50 10.311 28.357 -3.904
430 H THR 51 H THR 51 7.608 32.636 0.202
431 HA THR 51 HA THR 51 6.773 34.012 1.809
432 HB THR 51 HB THR 51 5.805 31.850 3.568
433 HG1 THR 51 1HG THR 51 4.259 31.165 2.064
434 1HG2 THR 51 1HG2 THR 51 3.608 33.134 2.776
435 2HG2 THR 51 2HG2 THR 51 4.804 34.391 2.461
436 3HG2 THR 51 3HG2 THR 51 4.645 33.710 4.080
437 H SER 52 H SER 52 9.473 33.040 2.028
438 HA SER 52 HA SER 52 9.921 32.688 4.883
439 1HB SER 52 2HB SER 52 11.786 32.687 2.504
440 2HB SER 52 1HB SER 52 12.345 32.543 4.170
441 HG SER 52 HG SER 52 10.786 30.711 4.261
Start of MODEL 8
1 1H MET 1 1H MET 1 8.356 -31.383 -13.426
2 HA MET 1 HA MET 1 9.732 -29.846 -11.478
3 1HB MET 1 2HB MET 1 11.094 -29.089 -13.369
4 2HB MET 1 1HB MET 1 9.643 -28.586 -14.228
5 1HG MET 1 2HG MET 1 10.092 -26.575 -13.382
6 2HG MET 1 1HG MET 1 9.380 -27.215 -11.902
7 1HE MET 1 1HE MET 1 12.843 -25.055 -12.403
8 2HE MET 1 2HE MET 1 11.945 -24.852 -10.899
9 3HE MET 1 3HE MET 1 11.089 -24.887 -12.440
10 H TRP 2 H TRP 2 7.602 -28.990 -14.208
11 HA TRP 2 HA TRP 2 5.621 -27.823 -14.226
12 1HB TRP 2 2HB TRP 2 5.232 -30.259 -12.537
13 2HB TRP 2 1HB TRP 2 3.900 -29.120 -12.703
14 HD1 TRP 2 HD TRP 2 5.654 -31.906 -14.500
15 HE1 TRP 2 1HE TRP 2 4.541 -32.300 -16.788
16 HE3 TRP 2 3HE TRP 2 2.688 -27.745 -14.690
17 HZ2 TRP 2 2HZ TRP 2 2.657 -31.017 -18.452
18 HZ3 TRP 2 3HZ TRP 2 1.261 -27.403 -16.665
19 HH2 TRP 2 HH TRP 2 1.247 -29.006 -18.507
20 H ARG 3 H ARG 3 7.492 -26.702 -12.347
21 HA ARG 3 HA ARG 3 7.616 -25.251 -10.594
22 1HB ARG 3 2HB ARG 3 4.687 -24.747 -11.095
23 2HB ARG 3 1HB ARG 3 5.883 -23.624 -10.464
24 1HG ARG 3 2HG ARG 3 7.045 -23.835 -12.711
25 2HG ARG 3 1HG ARG 3 5.573 -24.629 -13.274
26 1HD ARG 3 2HD ARG 3 4.515 -22.451 -12.098
27 2HD ARG 3 1HD ARG 3 6.073 -21.797 -12.601
28 HE ARG 3 HE ARG 3 5.379 -21.902 -14.782
29 1HH1 ARG 3 1HH1 ARG 3 3.204 -23.785 -12.806
30 2HH1 ARG 3 2HH1 ARG 3 2.060 -24.034 -14.081
31 1HH2 ARG 3 1HH2 ARG 3 3.874 -22.226 -16.460
32 2HH2 ARG 3 2HH2 ARG 3 2.439 -23.149 -16.156
33 H ILE 4 H ILE 4 7.366 -27.778 -9.672
34 HA ILE 4 HA ILE 4 6.670 -29.100 -7.940
35 HB ILE 4 HB ILE 4 6.288 -26.496 -6.473
36 1HG1 ILE 4 2HG1 ILE 4 8.420 -26.384 -7.639
37 2HG1 ILE 4 1HG1 ILE 4 8.700 -26.636 -5.919
38 1HG2 ILE 4 1HG2 ILE 4 7.422 -28.105 -4.695
39 2HG2 ILE 4 2HG2 ILE 4 6.670 -29.336 -5.709
40 3HG2 ILE 4 3HG2 ILE 4 5.679 -28.083 -4.960
41 1HD1 ILE 4 1HD1 ILE 4 8.596 -29.194 -6.962
42 2HD1 ILE 4 2HD1 ILE 4 10.044 -28.294 -6.511
43 3HD1 ILE 4 3HD1 ILE 4 9.468 -28.262 -8.177
44 H TRP 5 H TRP 5 4.575 -28.176 -9.763
45 HA TRP 5 HA TRP 5 2.349 -28.809 -9.886
46 1HB TRP 5 2HB TRP 5 2.758 -29.776 -7.450
47 2HB TRP 5 1HB TRP 5 1.839 -28.350 -6.980
48 HD1 TRP 5 HD TRP 5 0.990 -30.243 -10.195
49 HE1 TRP 5 1HE TRP 5 -1.332 -31.321 -9.926
50 HE3 TRP 5 3HE TRP 5 0.198 -29.244 -5.244
51 HZ2 TRP 5 2HZ TRP 5 -3.246 -31.696 -7.886
52 HZ3 TRP 5 3HZ TRP 5 -1.905 -29.996 -4.211
53 HH2 TRP 5 HH TRP 5 -3.591 -31.196 -5.507
54 H GLN 6 H GLN 6 3.247 -26.225 -7.630
55 HA GLN 6 HA GLN 6 2.066 -24.210 -9.207
56 1HB GLN 6 2HB GLN 6 0.258 -23.560 -7.555
57 2HB GLN 6 1HB GLN 6 -0.067 -24.984 -8.534
58 1HG GLN 6 2HG GLN 6 1.000 -26.211 -6.450
59 2HG GLN 6 1HG GLN 6 0.450 -24.754 -5.625
60 1HE2 GLN 6 1HE2 GLN 6 -1.354 -25.221 -4.594
61 2HE2 GLN 6 2HE2 GLN 6 -2.702 -26.085 -5.243
62 H LEU 7 H LEU 7 4.486 -24.802 -7.669
63 HA LEU 7 HA LEU 7 6.018 -23.733 -6.379
64 1HB LEU 7 2HB LEU 7 4.163 -21.444 -6.999
65 2HB LEU 7 1HB LEU 7 5.637 -21.232 -6.074
66 HG LEU 7 HG LEU 7 5.858 -22.564 -8.725
67 1HD1 LEU 7 1HD1 LEU 7 6.140 -20.190 -9.676
68 2HD1 LEU 7 2HD1 LEU 7 5.160 -19.683 -8.301
69 3HD1 LEU 7 3HD1 LEU 7 4.509 -20.827 -9.474
70 1HD2 LEU 7 1HD2 LEU 7 7.994 -21.494 -8.754
71 2HD2 LEU 7 2HD2 LEU 7 7.774 -22.217 -7.160
72 3HD2 LEU 7 3HD2 LEU 7 7.565 -20.479 -7.377
73 H PHE 8 H PHE 8 3.301 -21.776 -5.235
74 HA PHE 8 HA PHE 8 3.303 -23.233 -2.696
75 1HB PHE 8 2HB PHE 8 3.425 -20.219 -2.772
76 2HB PHE 8 1HB PHE 8 3.577 -21.272 -1.370
77 HD1 PHE 8 1HD PHE 8 5.278 -19.841 -4.255
78 HD2 PHE 8 2HD PHE 8 5.640 -22.481 -0.938
79 HE1 PHE 8 1HE PHE 8 7.725 -19.827 -4.516
80 HE2 PHE 8 2HE PHE 8 8.087 -22.471 -1.191
81 HZ PHE 8 HZ PHE 8 9.133 -21.143 -2.982
82 H ASP 9 H ASP 9 1.434 -23.189 -4.861
83 HA ASP 9 HA ASP 9 -0.850 -23.327 -4.988
84 1HB ASP 9 2HB ASP 9 -0.609 -23.119 -2.324
85 2HB ASP 9 1HB ASP 9 -1.373 -21.567 -2.651
86 HA PRO 10 HA PRO 10 -1.204 -19.577 -7.365
87 1HB PRO 10 2HB PRO 10 -4.031 -20.410 -7.676
88 2HB PRO 10 1HB PRO 10 -2.816 -20.068 -8.912
89 1HG PRO 10 2HG PRO 10 -3.586 -22.571 -8.390
90 2HG PRO 10 1HG PRO 10 -1.900 -22.190 -8.786
91 1HD PRO 10 2HD PRO 10 -3.140 -22.767 -6.126
92 2HD PRO 10 1HD PRO 10 -1.560 -23.263 -6.767
93 H ARG 11 H ARG 11 -3.647 -20.483 -4.975
94 HA ARG 11 HA ARG 11 -4.788 -17.878 -4.771
95 1HB ARG 11 2HB ARG 11 -5.669 -20.289 -4.046
96 2HB ARG 11 1HB ARG 11 -4.989 -19.793 -2.502
97 1HG ARG 11 2HG ARG 11 -6.858 -17.992 -3.986
98 2HG ARG 11 1HG ARG 11 -7.473 -19.318 -2.997
99 1HD ARG 11 2HD ARG 11 -5.429 -17.635 -1.715
100 2HD ARG 11 1HD ARG 11 -6.953 -16.822 -2.072
101 HE ARG 11 HE ARG 11 -7.452 -19.305 -0.827
102 1HH1 ARG 11 1HH1 ARG 11 -6.266 -16.101 -0.119
103 2HH1 ARG 11 2HH1 ARG 11 -6.761 -16.148 1.538
104 1HH2 ARG 11 1HH2 ARG 11 -8.106 -19.369 1.354
105 2HH2 ARG 11 2HH2 ARG 11 -7.805 -18.003 2.376
106 H GLN 12 H GLN 12 -2.850 -19.741 -2.419
107 HA GLN 12 HA GLN 12 -2.388 -17.623 -0.660
108 1HB GLN 12 2HB GLN 12 -0.579 -19.989 -1.169
109 2HB GLN 12 1HB GLN 12 -0.603 -18.988 0.276
110 1HG GLN 12 2HG GLN 12 -3.009 -20.532 -0.628
111 2HG GLN 12 1HG GLN 12 -1.759 -21.247 0.388
112 1HE2 GLN 12 1HE2 GLN 12 -1.128 -19.524 2.211
113 2HE2 GLN 12 2HE2 GLN 12 -2.487 -18.982 3.130
114 H ALA 13 H ALA 13 -0.497 -18.749 -3.423
115 HA ALA 13 HA ALA 13 1.706 -17.030 -3.051
116 1HB ALA 13 1HB ALA 13 1.736 -19.046 -4.479
117 2HB ALA 13 2HB ALA 13 2.335 -17.609 -5.307
118 3HB ALA 13 3HB ALA 13 0.710 -18.207 -5.642
119 H LEU 14 H LEU 14 -1.257 -16.692 -4.976
120 HA LEU 14 HA LEU 14 -0.544 -14.217 -6.152
121 1HB LEU 14 2HB LEU 14 -3.141 -15.668 -5.764
122 2HB LEU 14 1HB LEU 14 -3.113 -14.051 -6.440
123 HG LEU 14 HG LEU 14 -1.552 -16.341 -7.623
124 1HD1 LEU 14 1HD1 LEU 14 -3.297 -16.844 -9.064
125 2HD1 LEU 14 2HD1 LEU 14 -4.141 -15.331 -8.732
126 3HD1 LEU 14 3HD1 LEU 14 -4.117 -16.613 -7.519
127 1HD2 LEU 14 1HD2 LEU 14 -2.502 -13.909 -9.070
128 2HD2 LEU 14 2HD2 LEU 14 -1.120 -14.951 -9.409
129 3HD2 LEU 14 3HD2 LEU 14 -1.059 -13.818 -8.059
130 H VAL 15 H VAL 15 -2.523 -15.030 -3.316
131 HA VAL 15 HA VAL 15 -3.138 -12.330 -2.678
132 HB VAL 15 HB VAL 15 -3.894 -13.195 -0.506
133 1HG1 VAL 15 1HG1 VAL 15 -4.750 -14.332 -3.088
134 2HG1 VAL 15 2HG1 VAL 15 -5.668 -13.429 -1.882
135 3HG1 VAL 15 3HG1 VAL 15 -5.352 -15.148 -1.646
136 1HG2 VAL 15 1HG2 VAL 15 -3.833 -15.810 -0.382
137 2HG2 VAL 15 2HG2 VAL 15 -2.456 -14.858 0.176
138 3HG2 VAL 15 3HG2 VAL 15 -2.415 -15.622 -1.413
139 H GLY 16 H GLY 16 -0.405 -14.373 -2.063
140 1HA GLY 16 2HA GLY 16 0.589 -12.919 0.199
141 2HA GLY 16 1HA GLY 16 1.480 -14.093 -0.760
142 H LEU 17 H LEU 17 1.680 -13.143 -3.169
143 HA LEU 17 HA LEU 17 3.570 -11.048 -2.993
144 1HB LEU 17 2HB LEU 17 2.150 -11.650 -5.552
145 2HB LEU 17 1HB LEU 17 3.836 -11.257 -5.291
146 HG LEU 17 HG LEU 17 2.960 -13.806 -4.130
147 1HD1 LEU 17 1HD1 LEU 17 3.437 -13.897 -7.047
148 2HD1 LEU 17 2HD1 LEU 17 1.840 -13.391 -6.497
149 3HD1 LEU 17 3HD1 LEU 17 2.480 -14.964 -6.020
150 1HD2 LEU 17 1HD2 LEU 17 5.248 -13.321 -5.990
151 2HD2 LEU 17 2HD2 LEU 17 5.105 -14.496 -4.683
152 3HD2 LEU 17 3HD2 LEU 17 5.315 -12.785 -4.312
153 H ALA 18 H ALA 18 0.368 -11.202 -4.431
154 HA ALA 18 HA ALA 18 0.059 -8.563 -5.196
155 1HB ALA 18 1HB ALA 18 -2.196 -10.221 -4.102
156 2HB ALA 18 2HB ALA 18 -1.472 -10.508 -5.683
157 3HB ALA 18 3HB ALA 18 -2.263 -8.969 -5.342
158 H THR 19 H THR 19 -1.037 -9.978 -2.089
159 HA THR 19 HA THR 19 -1.900 -7.502 -1.028
160 HB THR 19 HB THR 19 -1.074 -9.993 0.470
161 HG1 THR 19 1HG THR 19 -3.599 -9.186 -0.536
162 1HG2 THR 19 1HG2 THR 19 -1.299 -8.419 2.138
163 2HG2 THR 19 2HG2 THR 19 -2.920 -9.108 2.036
164 3HG2 THR 19 3HG2 THR 19 -2.576 -7.548 1.287
165 H PHE 20 H PHE 20 1.156 -9.242 -0.833
166 HA PHE 20 HA PHE 20 2.393 -7.710 1.152
167 1HB PHE 20 2HB PHE 20 3.300 -9.842 0.333
168 2HB PHE 20 1HB PHE 20 3.671 -9.093 -1.215
169 HD1 PHE 20 1HD PHE 20 4.299 -8.443 2.408
170 HD2 PHE 20 2HD PHE 20 5.851 -8.491 -1.554
171 HE1 PHE 20 1HE PHE 20 6.504 -7.773 3.269
172 HE2 PHE 20 2HE PHE 20 8.060 -7.821 -0.701
173 HZ PHE 20 HZ PHE 20 8.389 -7.462 1.714
174 H LEU 21 H LEU 21 2.668 -7.378 -2.393
175 HA LEU 21 HA LEU 21 4.189 -4.999 -2.290
176 1HB LEU 21 2HB LEU 21 3.575 -4.760 -4.679
177 2HB LEU 21 1HB LEU 21 4.223 -6.339 -4.277
178 HG LEU 21 HG LEU 21 1.618 -6.897 -4.025
179 1HD1 LEU 21 1HD1 LEU 21 1.383 -5.202 -6.418
180 2HD1 LEU 21 2HD1 LEU 21 1.394 -4.349 -4.876
181 3HD1 LEU 21 3HD1 LEU 21 0.190 -5.599 -5.183
182 1HD2 LEU 21 1HD2 LEU 21 3.596 -7.649 -5.677
183 2HD2 LEU 21 2HD2 LEU 21 2.531 -6.845 -6.830
184 3HD2 LEU 21 3HD2 LEU 21 1.925 -8.183 -5.855
185 H PHE 22 H PHE 22 0.727 -5.581 -2.819
186 HA PHE 22 HA PHE 22 -0.116 -2.981 -3.226
187 1HB PHE 22 2HB PHE 22 -1.416 -5.437 -2.141
188 2HB PHE 22 1HB PHE 22 -2.269 -3.906 -1.986
189 HD1 PHE 22 1HD PHE 22 -1.590 -2.549 -4.478
190 HD2 PHE 22 2HD PHE 22 -2.544 -6.634 -3.763
191 HE1 PHE 22 1HE PHE 22 -2.395 -2.762 -6.794
192 HE2 PHE 22 2HE PHE 22 -3.349 -6.855 -6.077
193 HZ PHE 22 HZ PHE 22 -3.274 -4.918 -7.595
194 H VAL 23 H VAL 23 -0.078 -4.717 -0.106
195 HA VAL 23 HA VAL 23 -0.882 -2.571 1.472
196 HB VAL 23 HB VAL 23 -0.085 -3.824 3.364
197 1HG1 VAL 23 1HG1 VAL 23 -2.045 -4.828 2.829
198 2HG1 VAL 23 2HG1 VAL 23 -0.979 -6.200 2.524
199 3HG1 VAL 23 3HG1 VAL 23 -1.528 -5.193 1.184
200 1HG2 VAL 23 1HG2 VAL 23 2.076 -4.528 2.773
201 2HG2 VAL 23 2HG2 VAL 23 1.488 -5.380 1.347
202 3HG2 VAL 23 3HG2 VAL 23 1.133 -6.009 2.954
203 H LEU 24 H LEU 24 2.409 -3.730 0.753
204 HA LEU 24 HA LEU 24 3.852 -1.982 2.330
205 1HB LEU 24 2HB LEU 24 4.539 -3.905 0.610
206 2HB LEU 24 1HB LEU 24 4.879 -2.519 -0.407
207 HG LEU 24 HG LEU 24 6.882 -3.286 0.769
208 1HD1 LEU 24 1HD1 LEU 24 7.572 -1.142 1.690
209 2HD1 LEU 24 2HD1 LEU 24 5.889 -0.620 1.765
210 3HD1 LEU 24 3HD1 LEU 24 6.651 -0.918 0.204
211 1HD2 LEU 24 1HD2 LEU 24 5.790 -2.355 3.374
212 2HD2 LEU 24 2HD2 LEU 24 7.056 -3.534 3.035
213 3HD2 LEU 24 3HD2 LEU 24 5.362 -3.971 2.812
214 H ALA 25 H ALA 25 3.379 -1.500 -1.171
215 HA ALA 25 HA ALA 25 4.129 1.198 -1.177
216 1HB ALA 25 1HB ALA 25 2.159 0.348 -3.204
217 2HB ALA 25 2HB ALA 25 3.643 -0.602 -3.108
218 3HB ALA 25 3HB ALA 25 3.726 1.136 -3.400
219 H LEU 26 H LEU 26 1.143 -0.337 -0.326
220 HA LEU 26 HA LEU 26 -0.604 1.838 -0.702
221 1HB LEU 26 2HB LEU 26 -1.623 -0.237 -0.475
222 2HB LEU 26 1HB LEU 26 -0.642 -0.685 0.901
223 HG LEU 26 HG LEU 26 -3.101 -0.244 1.311
224 1HD1 LEU 26 1HD1 LEU 26 -1.712 1.574 3.129
225 2HD1 LEU 26 2HD1 LEU 26 -0.911 0.021 2.900
226 3HD1 LEU 26 3HD1 LEU 26 -2.581 0.076 3.461
227 1HD2 LEU 26 1HD2 LEU 26 -2.482 2.636 1.553
228 2HD2 LEU 26 2HD2 LEU 26 -3.998 1.829 1.152
229 3HD2 LEU 26 3HD2 LEU 26 -2.746 2.017 -0.077
230 H LEU 27 H LEU 27 1.013 0.634 2.247
231 HA LEU 27 HA LEU 27 0.172 2.728 3.918
232 1HB LEU 27 2HB LEU 27 2.222 0.593 4.031
233 2HB LEU 27 1HB LEU 27 2.489 1.967 5.083
234 1HD1 LEU 27 1HD1 LEU 27 0.158 2.800 5.981
235 2HD1 LEU 27 2HD1 LEU 27 -0.502 1.606 7.098
236 3HD1 LEU 27 3HD1 LEU 27 -1.135 1.722 5.455
237 1HD2 LEU 27 1HD2 LEU 27 0.307 -1.290 5.727
238 2HD2 LEU 27 2HD2 LEU 27 0.522 -0.698 4.081
239 3HD2 LEU 27 3HD2 LEU 27 -0.946 -0.304 4.975
240 H ILE 28 H ILE 28 3.141 2.281 2.023
241 HA ILE 28 HA ILE 28 4.456 4.606 2.902
242 HB ILE 28 HB ILE 28 4.737 3.238 0.224
243 1HG1 ILE 28 2HG1 ILE 28 5.059 1.714 2.151
244 2HG1 ILE 28 1HG1 ILE 28 6.545 1.969 1.243
245 1HG2 ILE 28 1HG2 ILE 28 5.865 5.226 -0.058
246 2HG2 ILE 28 2HG2 ILE 28 7.141 4.190 0.583
247 3HG2 ILE 28 3HG2 ILE 28 6.318 5.333 1.643
248 1HD1 ILE 28 1HD1 ILE 28 5.813 3.317 3.831
249 2HD1 ILE 28 2HD1 ILE 28 7.308 3.552 2.927
250 3HD1 ILE 28 3HD1 ILE 28 6.947 1.980 3.639
251 H HIS 29 H HIS 29 2.683 4.057 -0.140
252 HA HIS 29 HA HIS 29 2.787 6.713 -1.028
253 1HB HIS 29 2HB HIS 29 0.908 4.441 -1.653
254 2HB HIS 29 1HB HIS 29 0.780 6.011 -2.439
255 HD1 HIS 29 1HD HIS 29 4.260 5.251 -1.879
256 HD2 HIS 29 2HD HIS 29 1.421 4.253 -4.744
257 HE1 HIS 29 1HE HIS 29 5.568 4.441 -3.868
258 HE2 HIS 29 2HE HIS 29 3.826 3.760 -5.557
259 H PHE 30 H PHE 30 0.410 5.023 0.942
260 HA PHE 30 HA PHE 30 -1.582 6.969 0.969
261 1HB PHE 30 2HB PHE 30 -1.947 4.683 1.757
262 2HB PHE 30 1HB PHE 30 -0.874 4.971 3.123
263 HD1 PHE 30 1HD PHE 30 -3.931 6.425 1.554
264 HD2 PHE 30 2HD PHE 30 -1.825 5.515 5.137
265 HE1 PHE 30 1HE PHE 30 -5.844 7.226 2.876
266 HE2 PHE 30 2HE PHE 30 -3.735 6.313 6.467
267 HZ PHE 30 HZ PHE 30 -5.749 7.170 5.336
268 H ILE 31 H ILE 31 1.033 6.440 3.363
269 HA ILE 31 HA ILE 31 0.309 8.669 4.940
270 HB ILE 31 HB ILE 31 2.612 8.450 5.900
271 1HG1 ILE 31 2HG1 ILE 31 3.466 5.986 5.150
272 2HG1 ILE 31 1HG1 ILE 31 2.844 6.589 3.621
273 1HG2 ILE 31 1HG2 ILE 31 0.531 7.282 6.670
274 2HG2 ILE 31 2HG2 ILE 31 2.055 6.526 7.135
275 3HG2 ILE 31 3HG2 ILE 31 1.111 5.861 5.802
276 1HD1 ILE 31 1HD1 ILE 31 4.296 8.711 4.451
277 2HD1 ILE 31 2HD1 ILE 31 4.901 7.432 3.399
278 3HD1 ILE 31 3HD1 ILE 31 5.223 7.374 5.131
279 H LEU 32 H LEU 32 2.920 8.245 2.557
280 HA LEU 32 HA LEU 32 3.918 10.856 2.775
281 1HB LEU 32 2HB LEU 32 5.034 10.482 0.656
282 2HB LEU 32 1HB LEU 32 5.170 9.069 1.681
283 HG LEU 32 HG LEU 32 3.077 8.258 0.284
284 1HD1 LEU 32 1HD1 LEU 32 3.482 10.666 -0.946
285 2HD1 LEU 32 2HD1 LEU 32 2.642 9.287 -1.656
286 3HD1 LEU 32 3HD1 LEU 32 4.350 9.556 -2.006
287 1HD2 LEU 32 1HD2 LEU 32 4.652 7.178 -1.284
288 2HD2 LEU 32 2HD2 LEU 32 5.190 7.087 0.393
289 3HD2 LEU 32 3HD2 LEU 32 5.925 8.251 -0.707
290 H LEU 33 H LEU 33 1.596 9.520 0.414
291 HA LEU 33 HA LEU 33 1.114 11.971 -0.884
292 1HB LEU 33 2HB LEU 33 0.033 10.604 -2.260
293 2HB LEU 33 1HB LEU 33 0.232 9.300 -1.122
294 HG LEU 33 HG LEU 33 -2.078 11.157 -0.758
295 1HD1 LEU 33 1HD1 LEU 33 -2.495 8.794 -2.482
296 2HD1 LEU 33 2HD1 LEU 33 -1.712 10.191 -3.223
297 3HD1 LEU 33 3HD1 LEU 33 -3.304 10.361 -2.483
298 1HD2 LEU 33 1HD2 LEU 33 -2.742 9.592 0.678
299 2HD2 LEU 33 2HD2 LEU 33 -1.165 8.833 0.472
300 3HD2 LEU 33 3HD2 LEU 33 -2.528 8.313 -0.515
301 H SER 34 H SER 34 -0.719 10.309 1.680
302 HA SER 34 HA SER 34 -2.666 12.304 2.024
303 1HB SER 34 2HB SER 34 -1.616 10.291 4.026
304 2HB SER 34 1HB SER 34 -3.073 11.259 4.238
305 HG SER 34 HG SER 34 -4.092 10.090 2.756
306 H THR 35 H THR 35 -0.086 11.547 4.364
307 HA THR 35 HA THR 35 -0.197 13.756 5.930
308 HB THR 35 HB THR 35 2.393 12.505 5.007
309 HG1 THR 35 1HG THR 35 1.969 10.864 6.286
310 1HG2 THR 35 1HG2 THR 35 1.761 13.602 7.724
311 2HG2 THR 35 2HG2 THR 35 2.523 14.566 6.459
312 3HG2 THR 35 3HG2 THR 35 3.325 13.119 7.070
313 H GLU 36 H GLU 36 1.494 13.545 2.821
314 HA GLU 36 HA GLU 36 2.688 16.089 2.910
315 1HB GLU 36 2HB GLU 36 3.391 14.370 1.321
316 2HB GLU 36 1HB GLU 36 1.833 14.458 0.513
317 1HG GLU 36 2HG GLU 36 3.408 16.958 0.745
318 2HG GLU 36 1HG GLU 36 3.969 15.728 -0.387
319 H ARG 37 H ARG 37 -0.377 15.011 1.463
320 HA ARG 37 HA ARG 37 -1.139 17.541 0.472
321 1HB ARG 37 2HB ARG 37 -2.111 15.033 0.184
322 2HB ARG 37 1HB ARG 37 -3.286 15.686 1.318
323 1HG ARG 37 2HG ARG 37 -4.128 16.012 -0.881
324 2HG ARG 37 1HG ARG 37 -3.641 17.587 -0.253
325 1HD ARG 37 2HD ARG 37 -1.797 17.718 -1.640
326 2HD ARG 37 1HD ARG 37 -1.711 15.971 -1.860
327 HE ARG 37 HE ARG 37 -3.270 17.841 -3.392
328 1HH1 ARG 37 1HH1 ARG 37 -2.957 14.510 -2.398
329 2HH1 ARG 37 2HH1 ARG 37 -3.842 13.893 -3.752
330 1HH2 ARG 37 1HH2 ARG 37 -4.434 17.030 -5.173
331 2HH2 ARG 37 2HH2 ARG 37 -4.680 15.323 -5.327
332 H PHE 38 H PHE 38 -1.580 15.959 3.573
333 HA PHE 38 HA PHE 38 -3.484 17.707 4.668
334 1HB PHE 38 2HB PHE 38 -1.496 15.778 5.772
335 2HB PHE 38 1HB PHE 38 -2.222 16.937 6.880
336 HD1 PHE 38 1HD PHE 38 -2.443 13.720 6.157
337 HD2 PHE 38 2HD PHE 38 -4.950 17.156 6.001
338 HE1 PHE 38 1HE PHE 38 -4.426 12.278 6.357
339 HE2 PHE 38 2HE PHE 38 -6.938 15.719 6.201
340 HZ PHE 38 HZ PHE 38 -6.676 13.277 6.380
341 H ASN 39 H ASN 39 -0.004 17.598 5.452
342 HA ASN 39 HA ASN 39 0.088 20.089 6.711
343 1HB ASN 39 2HB ASN 39 2.121 18.261 5.519
344 2HB ASN 39 1HB ASN 39 2.617 19.897 5.941
345 1HD2 ASN 39 1HD2 ASN 39 3.572 17.501 7.117
346 2HD2 ASN 39 2HD2 ASN 39 3.138 17.530 8.789
347 H TRP 40 H TRP 40 -0.078 19.297 3.395
348 HA TRP 40 HA TRP 40 1.166 21.591 2.279
349 1HB TRP 40 2HB TRP 40 0.819 19.585 0.929
350 2HB TRP 40 1HB TRP 40 -0.925 19.728 1.121
351 HD1 TRP 40 HD TRP 40 1.695 22.372 -0.004
352 HE1 TRP 40 1HE TRP 40 0.900 23.361 -2.244
353 HE3 TRP 40 3HE TRP 40 -2.512 19.549 -0.692
354 HZ2 TRP 40 2HZ TRP 40 -1.228 22.994 -4.061
355 HZ3 TRP 40 3HZ TRP 40 -3.872 19.931 -2.707
356 HH2 TRP 40 HH TRP 40 -3.243 21.618 -4.355
357 H LEU 41 H LEU 41 -2.273 20.722 2.189
358 HA LEU 41 HA LEU 41 -3.152 23.386 1.847
359 1HB LEU 41 2HB LEU 41 -4.502 21.416 1.224
360 2HB LEU 41 1HB LEU 41 -4.653 20.990 2.917
361 HG LEU 41 HG LEU 41 -5.608 23.567 2.880
362 1HD1 LEU 41 1HD1 LEU 41 -5.542 23.614 0.437
363 2HD1 LEU 41 2HD1 LEU 41 -7.196 23.694 1.044
364 3HD1 LEU 41 3HD1 LEU 41 -6.571 22.183 0.382
365 1HD2 LEU 41 1HD2 LEU 41 -7.771 22.559 3.231
366 2HD2 LEU 41 2HD2 LEU 41 -6.539 21.595 4.043
367 3HD2 LEU 41 3HD2 LEU 41 -7.220 21.046 2.511
368 H GLU 42 H GLU 42 -1.995 21.641 4.523
369 HA GLU 42 HA GLU 42 -3.411 22.811 6.615
370 1HB GLU 42 2HB GLU 42 -2.022 20.840 6.953
371 2HB GLU 42 1HB GLU 42 -0.584 21.781 6.586
372 1HG GLU 42 2HG GLU 42 -0.395 22.092 8.772
373 2HG GLU 42 1HG GLU 42 -1.757 23.201 8.627
374 H GLY 43 H GLY 43 -0.023 23.502 5.795
375 1HA GLY 43 2HA GLY 43 -0.099 26.058 7.075
376 2HA GLY 43 1HA GLY 43 1.225 25.414 6.117
377 H ALA 44 H ALA 44 1.427 25.979 3.996
378 HA ALA 44 HA ALA 44 0.933 26.928 1.965
379 1HB ALA 44 1HB ALA 44 -1.181 27.357 1.366
380 2HB ALA 44 2HB ALA 44 -1.484 28.377 2.773
381 3HB ALA 44 3HB ALA 44 -1.585 26.622 2.916
382 H SER 45 H SER 45 -0.528 29.226 4.258
383 HA SER 45 HA SER 45 0.976 31.404 3.190
384 1HB SER 45 2HB SER 45 -0.105 32.744 4.921
385 2HB SER 45 1HB SER 45 -1.289 31.684 4.159
386 H THR 46 H THR 46 1.167 29.444 6.123
387 HA THR 46 HA THR 46 3.501 30.902 7.055
388 HB THR 46 HB THR 46 3.304 29.692 9.066
389 HG1 THR 46 1HG THR 46 3.178 27.606 8.318
390 1HG2 THR 46 1HG2 THR 46 1.362 30.495 9.761
391 2HG2 THR 46 2HG2 THR 46 0.454 29.415 8.702
392 3HG2 THR 46 3HG2 THR 46 1.050 30.958 8.087
393 H LYS 47 H LYS 47 2.674 27.710 5.801
394 HA LYS 47 HA LYS 47 3.916 25.960 5.064
395 1HB LYS 47 2HB LYS 47 5.618 26.471 3.498
396 2HB LYS 47 1HB LYS 47 4.456 27.783 3.402
397 1HG LYS 47 2HG LYS 47 5.890 29.301 4.399
398 2HG LYS 47 1HG LYS 47 6.879 28.039 5.136
399 1HD LYS 47 2HD LYS 47 8.058 29.088 3.280
400 2HD LYS 47 1HD LYS 47 7.703 27.398 2.919
401 1HE LYS 47 2HE LYS 47 5.706 29.413 2.067
402 2HE LYS 47 1HE LYS 47 7.235 29.379 1.190
403 1HZ LYS 47 1HZ LYS 47 6.848 26.942 0.892
404 2HZ LYS 47 2HZ LYS 47 5.752 27.938 0.074
405 3HZ LYS 47 3HZ LYS 47 5.287 27.167 1.506
406 HA PRO 48 HA PRO 48 6.899 24.423 7.893
407 1HB PRO 48 2HB PRO 48 8.803 23.811 5.703
408 2HB PRO 48 1HB PRO 48 8.079 22.731 6.899
409 1HG PRO 48 2HG PRO 48 7.270 22.693 4.360
410 2HG PRO 48 1HG PRO 48 6.114 22.496 5.691
411 1HD PRO 48 2HD PRO 48 6.669 24.903 4.000
412 2HD PRO 48 1HD PRO 48 5.117 24.281 4.601
413 H VAL 49 H VAL 49 9.430 24.426 8.324
414 HA VAL 49 HA VAL 49 11.211 25.666 8.990
415 HB VAL 49 HB VAL 49 10.739 27.183 6.428
416 1HG1 VAL 49 1HG1 VAL 49 13.387 27.158 6.691
417 2HG1 VAL 49 2HG1 VAL 49 12.952 27.071 8.397
418 3HG1 VAL 49 3HG1 VAL 49 12.383 28.417 7.410
419 1HG2 VAL 49 1HG2 VAL 49 11.884 24.497 6.968
420 2HG2 VAL 49 2HG2 VAL 49 12.631 25.488 5.716
421 3HG2 VAL 49 3HG2 VAL 49 10.924 25.063 5.601
422 H GLN 50 H GLN 50 8.477 26.533 9.722
423 HA GLN 50 HA GLN 50 7.341 28.309 10.615
424 1HB GLN 50 2HB GLN 50 10.143 28.457 11.604
425 2HB GLN 50 1HB GLN 50 9.081 29.810 11.969
426 1HG GLN 50 2HG GLN 50 7.517 27.683 12.632
427 2HG GLN 50 1HG GLN 50 9.125 27.101 13.060
428 1HE2 GLN 50 1HE2 GLN 50 10.416 29.194 14.015
429 2HE2 GLN 50 2HE2 GLN 50 9.615 29.873 15.387
430 H THR 51 H THR 51 6.846 29.209 8.497
431 HA THR 51 HA THR 51 6.692 30.905 6.986
432 HB THR 51 HB THR 51 7.969 32.860 8.814
433 HG1 THR 51 1HG THR 51 6.496 32.661 10.375
434 1HG2 THR 51 1HG2 THR 51 6.789 33.792 6.999
435 2HG2 THR 51 2HG2 THR 51 5.785 34.037 8.428
436 3HG2 THR 51 3HG2 THR 51 5.390 32.756 7.282
437 H SER 52 H SER 52 9.171 29.352 7.060
438 HA SER 52 HA SER 52 11.211 29.308 6.058
439 1HB SER 52 2HB SER 52 10.865 31.923 4.710
440 2HB SER 52 1HB SER 52 11.328 30.360 4.039
441 HG SER 52 HG SER 52 9.328 30.635 3.274
Start of MODEL 9
1 1H MET 1 1H MET 1 3.889 -36.470 -7.328
2 HA MET 1 HA MET 1 5.361 -36.855 -4.932
3 1HB MET 1 2HB MET 1 5.614 -34.141 -6.211
4 2HB MET 1 1HB MET 1 5.734 -34.341 -4.468
5 1HG MET 1 2HG MET 1 7.416 -36.145 -6.065
6 2HG MET 1 1HG MET 1 7.827 -34.434 -6.161
7 1HE MET 1 1HE MET 1 8.523 -37.405 -2.903
8 2HE MET 1 2HE MET 1 9.569 -37.214 -4.311
9 3HE MET 1 3HE MET 1 7.861 -37.599 -4.526
10 H TRP 2 H TRP 2 2.681 -37.016 -6.099
11 HA TRP 2 HA TRP 2 0.487 -36.446 -5.703
12 1HB TRP 2 2HB TRP 2 1.764 -36.897 -3.025
13 2HB TRP 2 1HB TRP 2 0.051 -36.506 -3.137
14 HD1 TRP 2 HD TRP 2 2.552 -39.232 -4.219
15 HE1 TRP 2 1HE TRP 2 1.247 -41.418 -4.595
16 HE3 TRP 2 3HE TRP 2 -2.203 -37.456 -3.605
17 HZ2 TRP 2 2HZ TRP 2 -1.443 -42.277 -4.627
18 HZ3 TRP 2 3HZ TRP 2 -4.085 -39.025 -3.826
19 HH2 TRP 2 HH TRP 2 -3.711 -41.385 -4.326
20 H ARG 3 H ARG 3 0.915 -34.239 -6.612
21 HA ARG 3 HA ARG 3 0.590 -31.988 -6.587
22 1HB ARG 3 2HB ARG 3 -0.820 -32.582 -3.978
23 2HB ARG 3 1HB ARG 3 -0.974 -31.101 -4.913
24 1HG ARG 3 2HG ARG 3 -1.851 -33.859 -5.739
25 2HG ARG 3 1HG ARG 3 -2.886 -32.496 -5.306
26 1HD ARG 3 2HD ARG 3 -1.264 -31.490 -7.312
27 2HD ARG 3 1HD ARG 3 -1.608 -33.138 -7.835
28 HE ARG 3 HE ARG 3 -3.398 -30.955 -7.875
29 1HH1 ARG 3 1HH1 ARG 3 -3.294 -34.376 -7.187
30 2HH1 ARG 3 2HH1 ARG 3 -4.958 -34.635 -7.595
31 1HH2 ARG 3 1HH2 ARG 3 -5.586 -31.294 -8.410
32 2HH2 ARG 3 2HH2 ARG 3 -6.259 -32.887 -8.288
33 H ILE 4 H ILE 4 2.924 -33.243 -5.109
34 HA ILE 4 HA ILE 4 4.743 -32.536 -3.945
35 HB ILE 4 HB ILE 4 3.619 -29.750 -4.171
36 1HG1 ILE 4 2HG1 ILE 4 5.341 -29.884 -6.230
37 2HG1 ILE 4 1HG1 ILE 4 4.790 -31.557 -6.220
38 1HG2 ILE 4 1HG2 ILE 4 6.279 -29.508 -4.461
39 2HG2 ILE 4 2HG2 ILE 4 6.215 -30.929 -3.419
40 3HG2 ILE 4 3HG2 ILE 4 5.457 -29.423 -2.903
41 1HD1 ILE 4 1HD1 ILE 4 2.566 -29.746 -6.005
42 2HD1 ILE 4 2HD1 ILE 4 2.888 -31.000 -7.202
43 3HD1 ILE 4 3HD1 ILE 4 3.552 -29.381 -7.420
44 H TRP 5 H TRP 5 1.864 -32.751 -2.645
45 HA TRP 5 HA TRP 5 1.300 -33.055 -0.442
46 1HB TRP 5 2HB TRP 5 3.958 -32.715 -0.116
47 2HB TRP 5 1HB TRP 5 3.366 -31.268 0.693
48 HD1 TRP 5 HD TRP 5 1.172 -31.982 2.504
49 HE1 TRP 5 1HE TRP 5 1.283 -33.823 4.298
50 HE3 TRP 5 3HE TRP 5 5.020 -34.750 0.589
51 HZ2 TRP 5 2HZ TRP 5 2.800 -36.143 4.830
52 HZ3 TRP 5 3HZ TRP 5 5.741 -36.765 1.802
53 HH2 TRP 5 HH TRP 5 4.654 -37.445 3.880
54 H GLN 6 H GLN 6 1.664 -30.118 -2.083
55 HA GLN 6 HA GLN 6 -0.647 -29.008 -0.901
56 1HB GLN 6 2HB GLN 6 0.473 -26.988 0.123
57 2HB GLN 6 1HB GLN 6 0.645 -28.495 1.012
58 1HG GLN 6 2HG GLN 6 2.867 -28.534 0.766
59 2HG GLN 6 1HG GLN 6 2.792 -27.978 -0.906
60 1HE2 GLN 6 1HE2 GLN 6 1.502 -26.421 1.980
61 2HE2 GLN 6 2HE2 GLN 6 2.482 -25.002 1.875
62 H LEU 7 H LEU 7 2.182 -28.619 -2.910
63 HA LEU 7 HA LEU 7 2.458 -27.557 -4.912
64 1HB LEU 7 2HB LEU 7 -0.261 -26.367 -4.930
65 2HB LEU 7 1HB LEU 7 0.658 -27.080 -6.239
66 HG LEU 7 HG LEU 7 -0.009 -29.147 -4.383
67 1HD1 LEU 7 1HD1 LEU 7 -1.945 -28.409 -3.551
68 2HD1 LEU 7 2HD1 LEU 7 -2.591 -28.756 -5.154
69 3HD1 LEU 7 3HD1 LEU 7 -2.079 -27.118 -4.746
70 1HD2 LEU 7 1HD2 LEU 7 -0.343 -28.489 -7.232
71 2HD2 LEU 7 2HD2 LEU 7 -1.489 -29.654 -6.568
72 3HD2 LEU 7 3HD2 LEU 7 0.245 -29.965 -6.465
73 H PHE 8 H PHE 8 2.150 -26.201 -2.056
74 HA PHE 8 HA PHE 8 2.677 -24.184 -1.156
75 1HB PHE 8 2HB PHE 8 4.019 -24.251 -3.699
76 2HB PHE 8 1HB PHE 8 3.480 -22.610 -3.364
77 HD1 PHE 8 1HD PHE 8 4.009 -21.736 -0.952
78 HD2 PHE 8 2HD PHE 8 6.036 -24.958 -2.853
79 HE1 PHE 8 1HE PHE 8 5.930 -21.410 0.552
80 HE2 PHE 8 2HE PHE 8 7.960 -24.640 -1.352
81 HZ PHE 8 HZ PHE 8 7.908 -22.864 0.353
82 H ASP 9 H ASP 9 0.024 -24.727 -2.218
83 HA ASP 9 HA ASP 9 -1.916 -23.695 -2.905
84 1HB ASP 9 2HB ASP 9 -0.741 -21.920 -0.781
85 2HB ASP 9 1HB ASP 9 -2.341 -21.622 -1.452
86 HA PRO 10 HA PRO 10 -0.211 -21.035 -6.245
87 1HB PRO 10 2HB PRO 10 -2.608 -21.255 -7.668
88 2HB PRO 10 1HB PRO 10 -1.172 -22.256 -7.897
89 1HG PRO 10 2HG PRO 10 -3.657 -22.827 -6.353
90 2HG PRO 10 1HG PRO 10 -2.650 -23.926 -7.314
91 1HD PRO 10 2HD PRO 10 -2.554 -23.927 -4.640
92 2HD PRO 10 1HD PRO 10 -1.090 -24.182 -5.612
93 H ARG 11 H ARG 11 -3.646 -20.904 -5.264
94 HA ARG 11 HA ARG 11 -4.047 -18.202 -5.838
95 1HB ARG 11 2HB ARG 11 -5.883 -19.771 -5.399
96 2HB ARG 11 1HB ARG 11 -5.385 -19.895 -3.718
97 1HG ARG 11 2HG ARG 11 -6.287 -17.898 -3.157
98 2HG ARG 11 1HG ARG 11 -5.953 -17.179 -4.733
99 1HD ARG 11 2HD ARG 11 -7.880 -18.011 -5.673
100 2HD ARG 11 1HD ARG 11 -7.978 -19.356 -4.538
101 HE ARG 11 HE ARG 11 -9.249 -18.042 -3.178
102 1HH1 ARG 11 1HH1 ARG 11 -7.479 -15.972 -5.361
103 2HH1 ARG 11 2HH1 ARG 11 -8.267 -14.526 -4.827
104 1HH2 ARG 11 1HH2 ARG 11 -10.287 -16.141 -2.475
105 2HH2 ARG 11 2HH2 ARG 11 -9.862 -14.621 -3.188
106 H GLN 12 H GLN 12 -2.935 -19.785 -2.884
107 HA GLN 12 HA GLN 12 -2.892 -17.537 -1.211
108 1HB GLN 12 2HB GLN 12 -2.660 -19.834 -0.385
109 2HB GLN 12 1HB GLN 12 -1.100 -19.970 -1.182
110 1HG GLN 12 2HG GLN 12 -0.946 -19.564 1.247
111 2HG GLN 12 1HG GLN 12 -0.136 -18.339 0.271
112 1HE2 GLN 12 1HE2 GLN 12 -2.237 -18.870 2.791
113 2HE2 GLN 12 2HE2 GLN 12 -2.938 -17.294 2.899
114 H ALA 13 H ALA 13 -0.466 -18.853 -3.415
115 HA ALA 13 HA ALA 13 1.631 -17.108 -2.719
116 1HB ALA 13 1HB ALA 13 1.491 -19.305 -4.236
117 2HB ALA 13 2HB ALA 13 2.819 -18.147 -4.339
118 3HB ALA 13 3HB ALA 13 1.498 -18.080 -5.506
119 H LEU 14 H LEU 14 -0.818 -16.914 -5.296
120 HA LEU 14 HA LEU 14 0.185 -14.486 -6.372
121 1HB LEU 14 2HB LEU 14 -1.563 -14.561 -7.864
122 2HB LEU 14 1HB LEU 14 -1.396 -16.251 -7.435
123 HG LEU 14 HG LEU 14 -3.251 -15.639 -5.652
124 1HD1 LEU 14 1HD1 LEU 14 -4.304 -13.880 -7.762
125 2HD1 LEU 14 2HD1 LEU 14 -3.026 -13.196 -6.758
126 3HD1 LEU 14 3HD1 LEU 14 -4.504 -13.804 -6.012
127 1HD2 LEU 14 1HD2 LEU 14 -4.768 -16.702 -7.014
128 2HD2 LEU 14 2HD2 LEU 14 -3.243 -17.170 -7.767
129 3HD2 LEU 14 3HD2 LEU 14 -4.210 -15.871 -8.466
130 H VAL 15 H VAL 15 -2.307 -15.236 -3.992
131 HA VAL 15 HA VAL 15 -3.220 -12.550 -3.712
132 HB VAL 15 HB VAL 15 -3.463 -14.822 -1.733
133 1HG1 VAL 15 1HG1 VAL 15 -3.976 -12.825 -0.599
134 2HG1 VAL 15 2HG1 VAL 15 -5.534 -13.499 -1.075
135 3HG1 VAL 15 3HG1 VAL 15 -4.838 -12.161 -1.987
136 1HG2 VAL 15 1HG2 VAL 15 -4.437 -14.852 -4.262
137 2HG2 VAL 15 2HG2 VAL 15 -5.773 -14.089 -3.397
138 3HG2 VAL 15 3HG2 VAL 15 -5.190 -15.677 -2.896
139 H GLY 16 H GLY 16 -0.605 -14.405 -2.363
140 1HA GLY 16 2HA GLY 16 -0.126 -12.689 -0.118
141 2HA GLY 16 1HA GLY 16 0.963 -13.921 -0.744
142 H LEU 17 H LEU 17 1.582 -13.188 -3.201
143 HA LEU 17 HA LEU 17 3.410 -11.089 -2.856
144 1HB LEU 17 2HB LEU 17 3.665 -11.259 -5.344
145 2HB LEU 17 1HB LEU 17 3.889 -12.756 -4.461
146 HG LEU 17 HG LEU 17 1.289 -13.011 -5.066
147 1HD1 LEU 17 1HD1 LEU 17 0.560 -11.854 -6.833
148 2HD1 LEU 17 2HD1 LEU 17 2.107 -11.968 -7.671
149 3HD1 LEU 17 3HD1 LEU 17 1.861 -10.730 -6.439
150 1HD2 LEU 17 1HD2 LEU 17 2.980 -14.666 -5.531
151 2HD2 LEU 17 2HD2 LEU 17 3.635 -13.679 -6.837
152 3HD2 LEU 17 3HD2 LEU 17 2.026 -14.383 -6.987
153 H ALA 18 H ALA 18 0.351 -11.228 -4.658
154 HA ALA 18 HA ALA 18 0.328 -8.609 -5.609
155 1HB ALA 18 1HB ALA 18 -1.209 -10.309 -6.419
156 2HB ALA 18 2HB ALA 18 -2.098 -8.895 -5.850
157 3HB ALA 18 3HB ALA 18 -2.018 -10.348 -4.853
158 H THR 19 H THR 19 -1.130 -9.922 -2.634
159 HA THR 19 HA THR 19 -2.070 -7.416 -1.699
160 HB THR 19 HB THR 19 -1.460 -9.950 -0.161
161 HG1 THR 19 1HG THR 19 -3.935 -8.993 -1.153
162 1HG2 THR 19 1HG2 THR 19 -3.227 -9.071 1.396
163 2HG2 THR 19 2HG2 THR 19 -3.022 -7.507 0.611
164 3HG2 THR 19 3HG2 THR 19 -1.667 -8.252 1.459
165 H PHE 20 H PHE 20 0.955 -9.115 -1.424
166 HA PHE 20 HA PHE 20 2.090 -7.748 0.736
167 1HB PHE 20 2HB PHE 20 3.061 -9.794 -0.206
168 2HB PHE 20 1HB PHE 20 3.469 -8.929 -1.685
169 HD1 PHE 20 1HD PHE 20 4.448 -9.701 1.694
170 HD2 PHE 20 2HD PHE 20 5.177 -7.116 -1.607
171 HE1 PHE 20 1HE PHE 20 6.617 -9.074 2.669
172 HE2 PHE 20 2HE PHE 20 7.349 -6.485 -0.639
173 HZ PHE 20 HZ PHE 20 8.072 -7.464 1.503
174 H LEU 21 H LEU 21 2.710 -7.164 -2.746
175 HA LEU 21 HA LEU 21 4.063 -4.730 -2.272
176 1HB LEU 21 2HB LEU 21 4.326 -4.568 -4.539
177 2HB LEU 21 1HB LEU 21 4.039 -6.286 -4.371
178 HG LEU 21 HG LEU 21 1.753 -4.450 -5.000
179 1HD1 LEU 21 1HD1 LEU 21 2.174 -4.770 -7.375
180 2HD1 LEU 21 2HD1 LEU 21 3.683 -5.605 -7.003
181 3HD1 LEU 21 3HD1 LEU 21 3.500 -3.896 -6.609
182 1HD2 LEU 21 1HD2 LEU 21 2.169 -7.190 -6.088
183 2HD2 LEU 21 2HD2 LEU 21 0.671 -6.351 -5.684
184 3HD2 LEU 21 3HD2 LEU 21 1.688 -7.004 -4.402
185 H PHE 22 H PHE 22 0.711 -5.469 -3.102
186 HA PHE 22 HA PHE 22 -0.233 -2.900 -3.553
187 1HB PHE 22 2HB PHE 22 -1.462 -5.459 -2.670
188 2HB PHE 22 1HB PHE 22 -2.411 -3.992 -2.452
189 HD1 PHE 22 1HD PHE 22 -2.480 -6.592 -4.410
190 HD2 PHE 22 2HD PHE 22 -1.673 -2.434 -4.821
191 HE1 PHE 22 1HE PHE 22 -3.172 -6.696 -6.769
192 HE2 PHE 22 2HE PHE 22 -2.363 -2.530 -7.181
193 HZ PHE 22 HZ PHE 22 -3.114 -4.663 -8.158
194 H VAL 23 H VAL 23 -0.257 -4.704 -0.473
195 HA VAL 23 HA VAL 23 -1.287 -2.583 1.058
196 HB VAL 23 HB VAL 23 -0.727 -3.874 2.991
197 1HG1 VAL 23 1HG1 VAL 23 -1.458 -6.254 1.995
198 2HG1 VAL 23 2HG1 VAL 23 -1.869 -5.217 0.629
199 3HG1 VAL 23 3HG1 VAL 23 -2.581 -4.911 2.213
200 1HG2 VAL 23 1HG2 VAL 23 0.581 -6.009 2.757
201 2HG2 VAL 23 2HG2 VAL 23 1.520 -4.523 2.621
202 3HG2 VAL 23 3HG2 VAL 23 1.085 -5.427 1.173
203 H LEU 24 H LEU 24 2.039 -3.764 0.676
204 HA LEU 24 HA LEU 24 3.320 -2.013 2.387
205 1HB LEU 24 2HB LEU 24 4.175 -4.035 0.974
206 2HB LEU 24 1HB LEU 24 4.565 -2.805 -0.213
207 HG LEU 24 HG LEU 24 6.500 -3.370 1.168
208 1HD1 LEU 24 1HD1 LEU 24 5.523 -0.606 1.844
209 2HD1 LEU 24 2HD1 LEU 24 6.127 -1.067 0.253
210 3HD1 LEU 24 3HD1 LEU 24 7.190 -1.149 1.656
211 1HD2 LEU 24 1HD2 LEU 24 6.546 -3.276 3.456
212 2HD2 LEU 24 2HD2 LEU 24 4.876 -3.780 3.198
213 3HD2 LEU 24 3HD2 LEU 24 5.243 -2.090 3.542
214 H ALA 25 H ALA 25 3.023 -1.658 -1.142
215 HA ALA 25 HA ALA 25 4.111 0.896 -1.323
216 1HB ALA 25 1HB ALA 25 3.981 -0.199 -3.341
217 2HB ALA 25 2HB ALA 25 2.668 0.970 -3.486
218 3HB ALA 25 3HB ALA 25 2.315 -0.710 -3.080
219 H LEU 26 H LEU 26 0.665 -0.031 -1.085
220 HA LEU 26 HA LEU 26 -0.322 2.593 -1.254
221 1HB LEU 26 2HB LEU 26 -2.404 1.726 -0.824
222 2HB LEU 26 1HB LEU 26 -1.558 0.323 -1.442
223 HG LEU 26 HG LEU 26 -1.123 -0.200 1.077
224 1HD1 LEU 26 1HD1 LEU 26 -1.896 1.514 2.342
225 2HD1 LEU 26 2HD1 LEU 26 -3.396 0.594 2.224
226 3HD1 LEU 26 3HD1 LEU 26 -3.123 1.976 1.163
227 1HD2 LEU 26 1HD2 LEU 26 -3.932 -0.509 0.056
228 2HD2 LEU 26 2HD2 LEU 26 -3.022 -1.599 1.102
229 3HD2 LEU 26 3HD2 LEU 26 -2.576 -1.428 -0.595
230 H LEU 27 H LEU 27 0.577 0.639 1.572
231 HA LEU 27 HA LEU 27 -0.314 2.416 3.541
232 1HB LEU 27 2HB LEU 27 1.578 0.151 3.407
233 2HB LEU 27 1HB LEU 27 1.834 1.270 4.733
234 1HD1 LEU 27 1HD2 LEU 27 -1.705 1.461 4.999
235 2HD1 LEU 27 2HD2 LEU 27 -0.255 2.087 5.786
236 3HD1 LEU 27 3HD2 LEU 27 -1.168 0.776 6.533
237 1HD2 LEU 27 1HD1 LEU 27 -1.815 -0.852 4.409
238 2HD2 LEU 27 2HD1 LEU 27 -0.368 -1.612 3.747
239 3HD2 LEU 27 3HD1 LEU 27 -1.020 -0.156 3.000
240 H ILE 28 H ILE 28 2.984 2.024 2.220
241 HA ILE 28 HA ILE 28 4.097 4.207 3.592
242 HB ILE 28 HB ILE 28 4.984 3.086 0.931
243 1HG1 ILE 28 2HG1 ILE 28 5.747 2.310 3.754
244 2HG1 ILE 28 1HG1 ILE 28 4.837 1.325 2.614
245 1HG2 ILE 28 1HG2 ILE 28 5.880 5.342 2.255
246 2HG2 ILE 28 2HG2 ILE 28 6.754 4.441 1.016
247 3HG2 ILE 28 3HG2 ILE 28 7.036 4.094 2.722
248 1HD1 ILE 28 1HD1 ILE 28 7.169 0.620 2.802
249 2HD1 ILE 28 2HD1 ILE 28 7.689 2.214 2.253
250 3HD1 ILE 28 3HD1 ILE 28 6.773 1.163 1.172
251 H HIS 29 H HIS 29 3.008 4.002 0.194
252 HA HIS 29 HA HIS 29 3.434 6.658 -0.491
253 1HB HIS 29 2HB HIS 29 1.481 4.594 -1.474
254 2HB HIS 29 1HB HIS 29 1.474 6.228 -2.131
255 HD1 HIS 29 1HD HIS 29 3.679 3.177 -1.885
256 HD2 HIS 29 2HD HIS 29 3.446 6.760 -3.978
257 HE1 HIS 29 1HE HIS 29 5.429 3.020 -3.683
258 HE2 HIS 29 2HE HIS 29 5.328 5.234 -4.883
259 H PHE 30 H PHE 30 0.681 5.161 1.106
260 HA PHE 30 HA PHE 30 -1.031 7.385 1.063
261 1HB PHE 30 2HB PHE 30 -1.848 5.131 1.534
262 2HB PHE 30 1HB PHE 30 -0.910 5.085 3.023
263 HD1 PHE 30 1HD PHE 30 -4.015 5.978 1.519
264 HD2 PHE 30 2HD PHE 30 -1.472 6.782 4.834
265 HE1 PHE 30 1HE PHE 30 -5.921 6.941 2.741
266 HE2 PHE 30 2HE PHE 30 -3.373 7.746 6.063
267 HZ PHE 30 HZ PHE 30 -5.600 7.827 5.016
268 H ILE 31 H ILE 31 1.577 6.439 3.235
269 HA ILE 31 HA ILE 31 0.915 8.333 5.259
270 HB ILE 31 HB ILE 31 2.584 6.194 5.205
271 1HG1 ILE 31 2HG1 ILE 31 2.768 8.543 7.101
272 2HG1 ILE 31 1HG1 ILE 31 1.566 7.259 7.179
273 1HG2 ILE 31 1HG2 ILE 31 4.399 8.598 5.201
274 2HG2 ILE 31 2HG2 ILE 31 4.283 7.404 3.910
275 3HG2 ILE 31 3HG2 ILE 31 4.869 6.927 5.501
276 1HD1 ILE 31 1HD1 ILE 31 4.527 6.807 7.421
277 2HD1 ILE 31 2HD1 ILE 31 3.237 5.640 7.707
278 3HD1 ILE 31 3HD1 ILE 31 3.435 7.018 8.790
279 H LEU 32 H LEU 32 3.247 8.311 2.575
280 HA LEU 32 HA LEU 32 4.332 10.872 3.102
281 1HB LEU 32 2HB LEU 32 4.162 9.808 0.316
282 2HB LEU 32 1HB LEU 32 5.470 10.678 1.092
283 HG LEU 32 HG LEU 32 4.735 7.786 1.496
284 1HD1 LEU 32 1HD1 LEU 32 6.803 9.237 -0.049
285 2HD1 LEU 32 2HD1 LEU 32 5.962 7.729 -0.412
286 3HD1 LEU 32 3HD1 LEU 32 7.284 7.744 0.756
287 1HD2 LEU 32 1HD2 LEU 32 6.362 7.603 3.152
288 2HD2 LEU 32 2HD2 LEU 32 5.536 9.107 3.556
289 3HD2 LEU 32 3HD2 LEU 32 7.096 9.151 2.735
290 H LEU 33 H LEU 33 1.941 9.790 0.714
291 HA LEU 33 HA LEU 33 1.263 12.295 -0.299
292 1HB LEU 33 2HB LEU 33 0.123 10.934 -1.646
293 2HB LEU 33 1HB LEU 33 0.347 9.605 -0.535
294 HG LEU 33 HG LEU 33 -1.896 11.571 -0.165
295 1HD1 LEU 33 1HD1 LEU 33 -1.621 9.399 -2.155
296 2HD1 LEU 33 2HD1 LEU 33 -2.577 10.880 -2.214
297 3HD1 LEU 33 3HD1 LEU 33 -3.150 9.497 -1.281
298 1HD2 LEU 33 1HD2 LEU 33 -0.927 9.295 1.231
299 2HD2 LEU 33 2HD2 LEU 33 -2.505 8.896 0.557
300 3HD2 LEU 33 3HD2 LEU 33 -2.322 10.302 1.607
301 H SER 34 H SER 34 0.027 10.523 2.489
302 HA SER 34 HA SER 34 -2.092 12.257 3.139
303 1HB SER 34 2HB SER 34 -2.047 10.108 4.179
304 2HB SER 34 1HB SER 34 -0.434 10.386 4.834
305 HG SER 34 HG SER 34 -1.261 11.793 6.298
306 H THR 35 H THR 35 1.259 12.124 4.330
307 HA THR 35 HA THR 35 1.093 14.309 6.076
308 HB THR 35 HB THR 35 3.519 13.379 4.530
309 HG1 THR 35 1HG THR 35 2.900 11.624 5.617
310 1HG2 THR 35 1HG2 THR 35 3.359 14.755 7.199
311 2HG2 THR 35 2HG2 THR 35 3.861 15.512 5.688
312 3HG2 THR 35 3HG2 THR 35 4.822 14.205 6.381
313 H GLU 36 H GLU 36 2.081 14.168 2.669
314 HA GLU 36 HA GLU 36 2.727 16.891 2.400
315 1HB GLU 36 2HB GLU 36 3.026 14.754 0.806
316 2HB GLU 36 1HB GLU 36 1.603 15.461 0.054
317 1HG GLU 36 2HG GLU 36 2.725 17.357 -0.609
318 2HG GLU 36 1HG GLU 36 3.969 17.179 0.627
319 H ARG 37 H ARG 37 -0.286 15.121 1.820
320 HA ARG 37 HA ARG 37 -1.754 17.313 0.815
321 1HB ARG 37 2HB ARG 37 -2.293 14.569 1.644
322 2HB ARG 37 1HB ARG 37 -3.617 15.656 2.039
323 1HG ARG 37 2HG ARG 37 -3.438 16.451 -0.388
324 2HG ARG 37 1HG ARG 37 -2.469 14.999 -0.647
325 1HD ARG 37 2HD ARG 37 -4.440 14.006 -1.047
326 2HD ARG 37 1HD ARG 37 -4.607 13.996 0.709
327 HE ARG 37 HE ARG 37 -6.245 15.590 0.532
328 1HH1 ARG 37 1HH1 ARG 37 -4.546 15.364 -2.508
329 2HH1 ARG 37 2HH1 ARG 37 -5.664 16.382 -3.350
330 1HH2 ARG 37 1HH2 ARG 37 -7.716 16.929 -0.575
331 2HH2 ARG 37 2HH2 ARG 37 -7.463 17.271 -2.254
332 H PHE 38 H PHE 38 -1.287 16.031 4.070
333 HA PHE 38 HA PHE 38 -3.159 17.636 5.404
334 1HB PHE 38 2HB PHE 38 -0.753 16.076 6.191
335 2HB PHE 38 1HB PHE 38 -1.332 17.287 7.332
336 HD1 PHE 38 1HD PHE 38 -2.437 16.240 9.049
337 HD2 PHE 38 2HD PHE 38 -3.099 14.915 5.059
338 HE1 PHE 38 1HE PHE 38 -4.140 14.661 9.860
339 HE2 PHE 38 2HE PHE 38 -4.804 13.334 5.863
340 HZ PHE 38 HZ PHE 38 -5.327 13.206 8.266
341 H ASN 39 H ASN 39 0.385 18.068 5.399
342 HA ASN 39 HA ASN 39 0.361 20.671 6.414
343 1HB ASN 39 2HB ASN 39 2.446 19.482 4.580
344 2HB ASN 39 1HB ASN 39 2.672 20.810 5.714
345 1HD2 ASN 39 1HD2 ASN 39 4.453 19.232 6.282
346 2HD2 ASN 39 2HD2 ASN 39 4.095 18.085 7.523
347 H TRP 40 H TRP 40 -0.400 19.507 3.305
348 HA TRP 40 HA TRP 40 0.227 21.788 1.739
349 1HB TRP 40 2HB TRP 40 -1.253 19.264 1.366
350 2HB TRP 40 1HB TRP 40 -1.850 20.610 0.400
351 HD1 TRP 40 HD TRP 40 1.866 20.622 1.037
352 HE1 TRP 40 1HE TRP 40 3.107 19.984 -1.126
353 HE3 TRP 40 3HE TRP 40 -2.123 19.081 -1.766
354 HZ2 TRP 40 2HZ TRP 40 2.480 18.963 -3.681
355 HZ3 TRP 40 3HZ TRP 40 -1.716 18.289 -4.061
356 HH2 TRP 40 HH TRP 40 0.538 18.232 -4.996
357 H LEU 41 H LEU 41 -2.993 20.523 2.526
358 HA LEU 41 HA LEU 41 -4.282 23.015 2.186
359 1HB LEU 41 2HB LEU 41 -5.454 20.849 2.046
360 2HB LEU 41 1HB LEU 41 -5.168 20.588 3.756
361 HG LEU 41 HG LEU 41 -6.455 23.034 3.708
362 1HD1 LEU 41 1HD1 LEU 41 -8.126 21.302 1.958
363 2HD1 LEU 41 2HD1 LEU 41 -6.885 22.318 1.225
364 3HD1 LEU 41 3HD1 LEU 41 -8.168 23.050 2.190
365 1HD2 LEU 41 1HD2 LEU 41 -6.721 20.720 5.014
366 2HD2 LEU 41 2HD2 LEU 41 -8.127 20.608 3.954
367 3HD2 LEU 41 3HD2 LEU 41 -7.951 21.983 5.045
368 H GLU 42 H GLU 42 -2.333 21.724 4.648
369 HA GLU 42 HA GLU 42 -3.407 22.928 6.918
370 1HB GLU 42 2HB GLU 42 -1.705 21.186 7.055
371 2HB GLU 42 1HB GLU 42 -0.534 22.269 6.317
372 1HG GLU 42 2HG GLU 42 -0.311 23.545 8.211
373 2HG GLU 42 1HG GLU 42 -1.900 23.094 8.829
374 H GLY 43 H GLY 43 -0.448 23.939 5.221
375 1HA GLY 43 2HA GLY 43 -1.280 26.666 5.009
376 2HA GLY 43 1HA GLY 43 -0.157 26.432 6.340
377 H ALA 44 H ALA 44 1.753 24.888 5.570
378 HA ALA 44 HA ALA 44 3.467 24.431 4.113
379 1HB ALA 44 1HB ALA 44 1.614 24.968 2.303
380 2HB ALA 44 2HB ALA 44 3.318 24.794 1.881
381 3HB ALA 44 3HB ALA 44 2.616 26.401 2.074
382 H SER 45 H SER 45 3.005 26.826 5.993
383 HA SER 45 HA SER 45 4.337 28.456 6.862
384 1HB SER 45 2HB SER 45 6.146 26.756 5.784
385 2HB SER 45 1HB SER 45 6.479 28.201 4.829
386 H THR 46 H THR 46 2.406 28.954 4.783
387 HA THR 46 HA THR 46 3.335 31.588 3.979
388 HB THR 46 HB THR 46 3.041 31.347 1.681
389 HG1 THR 46 1HG THR 46 1.732 28.872 2.122
390 1HG2 THR 46 1HG2 THR 46 4.356 29.543 0.924
391 2HG2 THR 46 2HG2 THR 46 3.970 28.572 2.344
392 3HG2 THR 46 3HG2 THR 46 4.993 30.000 2.503
393 H LYS 47 H LYS 47 0.715 29.240 4.220
394 HA LYS 47 HA LYS 47 -1.348 31.156 3.697
395 1HB LYS 47 2HB LYS 47 -1.174 28.345 3.979
396 2HB LYS 47 1HB LYS 47 -2.327 28.907 5.181
397 1HG LYS 47 2HG LYS 47 -3.700 29.904 3.525
398 2HG LYS 47 1HG LYS 47 -2.469 29.679 2.279
399 1HD LYS 47 2HD LYS 47 -2.710 27.245 2.498
400 2HD LYS 47 1HD LYS 47 -3.960 27.485 3.722
401 1HE LYS 47 2HE LYS 47 -4.054 28.172 0.796
402 2HE LYS 47 1HE LYS 47 -5.099 27.072 1.694
403 1HZ LYS 47 1HZ LYS 47 -5.177 29.983 1.519
404 2HZ LYS 47 2HZ LYS 47 -5.584 29.299 3.011
405 3HZ LYS 47 3HZ LYS 47 -6.448 28.870 1.621
406 HA PRO 48 HA PRO 48 -2.096 31.024 8.451
407 1HB PRO 48 2HB PRO 48 -0.291 29.732 10.011
408 2HB PRO 48 1HB PRO 48 -1.699 28.928 9.307
409 1HG PRO 48 2HG PRO 48 1.142 28.944 8.362
410 2HG PRO 48 1HG PRO 48 0.003 27.587 8.461
411 1HD PRO 48 2HD PRO 48 0.527 28.880 6.142
412 2HD PRO 48 1HD PRO 48 -1.063 28.176 6.503
413 H VAL 49 H VAL 49 -1.607 33.164 8.559
414 HA VAL 49 HA VAL 49 1.009 33.858 9.648
415 HB VAL 49 HB VAL 49 1.216 34.185 7.207
416 1HG1 VAL 49 1HG1 VAL 49 -0.572 36.528 7.205
417 2HG1 VAL 49 2HG1 VAL 49 -1.364 34.952 7.228
418 3HG1 VAL 49 3HG1 VAL 49 -0.235 35.353 5.934
419 1HG2 VAL 49 1HG2 VAL 49 2.419 36.114 7.406
420 2HG2 VAL 49 2HG2 VAL 49 2.171 35.750 9.113
421 3HG2 VAL 49 3HG2 VAL 49 1.152 36.943 8.309
422 H GLN 50 H GLN 50 -1.533 33.696 10.881
423 HA GLN 50 HA GLN 50 -3.069 34.880 12.097
424 1HB GLN 50 2HB GLN 50 -0.604 35.416 12.990
425 2HB GLN 50 1HB GLN 50 -1.087 37.046 12.544
426 1HG GLN 50 2HG GLN 50 -2.907 35.383 14.216
427 2HG GLN 50 1HG GLN 50 -1.504 36.155 14.953
428 1HE2 GLN 50 1HE2 GLN 50 -1.699 38.189 15.591
429 2HE2 GLN 50 2HE2 GLN 50 -2.985 39.261 15.164
430 H THR 51 H THR 51 -4.349 35.411 10.201
431 HA THR 51 HA THR 51 -4.764 38.247 9.981
432 HB THR 51 HB THR 51 -3.689 36.622 7.691
433 HG1 THR 51 1HG THR 51 -2.222 38.211 7.600
434 1HG2 THR 51 1HG2 THR 51 -5.565 38.910 7.533
435 2HG2 THR 51 2HG2 THR 51 -5.384 37.513 6.472
436 3HG2 THR 51 3HG2 THR 51 -4.221 38.836 6.394
437 H SER 52 H SER 52 -5.540 35.576 7.767
438 HA SER 52 HA SER 52 -8.269 35.466 8.763
439 1HB SER 52 2HB SER 52 -8.291 37.290 7.076
440 2HB SER 52 1HB SER 52 -7.697 36.150 5.868
441 HG SER 52 HG SER 52 -10.076 36.539 6.046
Start of MODEL 10
1 1H MET 1 1H MET 1 3.647 -32.468 -4.277
2 HA MET 1 HA MET 1 4.424 -34.037 -2.043
3 1HB MET 1 2HB MET 1 6.081 -31.566 -2.542
4 2HB MET 1 1HB MET 1 5.913 -32.278 -0.943
5 1HG MET 1 2HG MET 1 6.867 -33.874 -3.292
6 2HG MET 1 1HG MET 1 7.964 -32.902 -2.314
7 1HE MET 1 1HE MET 1 6.283 -36.070 -2.926
8 2HE MET 1 2HE MET 1 6.842 -37.099 -1.609
9 3HE MET 1 3HE MET 1 8.009 -36.348 -2.697
10 H TRP 2 H TRP 2 2.154 -33.710 -1.814
11 HA TRP 2 HA TRP 2 0.221 -32.613 -1.225
12 1HB TRP 2 2HB TRP 2 2.272 -32.206 0.874
13 2HB TRP 2 1HB TRP 2 0.808 -31.238 1.015
14 HD1 TRP 2 HD TRP 2 2.137 -34.693 1.607
15 HE1 TRP 2 1HE TRP 2 0.263 -36.201 2.520
16 HE3 TRP 2 3HE TRP 2 -1.861 -31.616 0.773
17 HZ2 TRP 2 2HZ TRP 2 -2.540 -36.101 2.844
18 HZ3 TRP 2 3HZ TRP 2 -4.104 -32.399 1.412
19 HH2 TRP 2 HH TRP 2 -4.435 -34.595 2.426
20 H ARG 3 H ARG 3 0.452 -31.233 -3.217
21 HA ARG 3 HA ARG 3 0.401 -29.223 -4.297
22 1HB ARG 3 2HB ARG 3 -0.835 -28.649 -1.624
23 2HB ARG 3 1HB ARG 3 -0.653 -27.365 -2.811
24 1HG ARG 3 2HG ARG 3 -2.669 -28.018 -3.516
25 2HG ARG 3 1HG ARG 3 -1.791 -29.326 -4.312
26 1HD ARG 3 2HD ARG 3 -3.636 -30.257 -3.082
27 2HD ARG 3 1HD ARG 3 -2.129 -30.720 -2.293
28 HE ARG 3 HE ARG 3 -2.853 -28.486 -0.958
29 1HH1 ARG 3 1HH1 ARG 3 -4.545 -31.435 -1.749
30 2HH1 ARG 3 2HH1 ARG 3 -5.546 -31.385 -0.337
31 1HH2 ARG 3 1HH2 ARG 3 -4.169 -28.420 0.899
32 2HH2 ARG 3 2HH2 ARG 3 -5.334 -29.674 1.166
33 H ILE 4 H ILE 4 2.910 -29.872 -3.005
34 HA ILE 4 HA ILE 4 4.908 -28.940 -2.418
35 HB ILE 4 HB ILE 4 3.882 -26.505 -3.873
36 1HG1 ILE 4 2HG1 ILE 4 3.535 -28.531 -5.229
37 2HG1 ILE 4 1HG1 ILE 4 4.796 -27.509 -5.912
38 1HG2 ILE 4 1HG2 ILE 4 6.008 -25.750 -3.937
39 2HG2 ILE 4 2HG2 ILE 4 6.693 -27.369 -4.073
40 3HG2 ILE 4 3HG2 ILE 4 6.182 -26.758 -2.500
41 1HD1 ILE 4 1HD1 ILE 4 6.076 -29.312 -5.986
42 2HD1 ILE 4 2HD1 ILE 4 4.921 -30.244 -5.033
43 3HD1 ILE 4 3HD1 ILE 4 6.140 -29.258 -4.224
44 H TRP 5 H TRP 5 3.389 -28.886 -0.279
45 HA TRP 5 HA TRP 5 2.653 -27.737 1.589
46 1HB TRP 5 2HB TRP 5 5.553 -27.189 1.147
47 2HB TRP 5 1HB TRP 5 4.743 -26.383 2.486
48 HD1 TRP 5 HD TRP 5 4.379 -30.055 1.274
49 HE1 TRP 5 1HE TRP 5 4.854 -31.597 3.279
50 HE3 TRP 5 3HE TRP 5 5.601 -26.512 4.752
51 HZ2 TRP 5 2HZ TRP 5 5.643 -31.345 5.978
52 HZ3 TRP 5 3HZ TRP 5 6.203 -27.246 7.022
53 HH2 TRP 5 HH TRP 5 6.223 -29.613 7.621
54 H GLN 6 H GLN 6 1.776 -26.353 -0.690
55 HA GLN 6 HA GLN 6 1.259 -24.268 -1.542
56 1HB GLN 6 2HB GLN 6 0.459 -24.381 1.331
57 2HB GLN 6 1HB GLN 6 0.213 -22.881 0.446
58 1HG GLN 6 2HG GLN 6 -1.069 -24.170 -1.251
59 2HG GLN 6 1HG GLN 6 -0.928 -25.586 -0.212
60 1HE2 GLN 6 1HE2 GLN 6 -1.361 -24.633 2.252
61 2HE2 GLN 6 2HE2 GLN 6 -2.943 -23.953 2.384
62 H LEU 7 H LEU 7 4.044 -24.376 -0.949
63 HA LEU 7 HA LEU 7 4.723 -21.894 0.382
64 1HB LEU 7 2HB LEU 7 6.414 -23.946 -1.047
65 2HB LEU 7 1HB LEU 7 7.059 -22.520 -0.257
66 HG LEU 7 HG LEU 7 5.603 -24.796 1.089
67 1HD1 LEU 7 1HD1 LEU 7 8.486 -23.965 0.969
68 2HD1 LEU 7 2HD1 LEU 7 7.774 -25.527 0.563
69 3HD1 LEU 7 3HD1 LEU 7 7.851 -25.004 2.245
70 1HD2 LEU 7 1HD2 LEU 7 5.074 -22.701 2.185
71 2HD2 LEU 7 2HD2 LEU 7 6.785 -22.274 2.244
72 3HD2 LEU 7 3HD2 LEU 7 6.184 -23.640 3.182
73 H PHE 8 H PHE 8 4.489 -23.156 -2.881
74 HA PHE 8 HA PHE 8 4.784 -20.424 -3.898
75 1HB PHE 8 2HB PHE 8 6.850 -22.155 -4.143
76 2HB PHE 8 1HB PHE 8 5.946 -22.544 -5.604
77 HD1 PHE 8 1HD PHE 8 5.808 -21.002 -7.425
78 HD2 PHE 8 2HD PHE 8 7.778 -19.915 -3.813
79 HE1 PHE 8 1HE PHE 8 6.787 -19.048 -8.552
80 HE2 PHE 8 2HE PHE 8 8.761 -17.957 -4.933
81 HZ PHE 8 HZ PHE 8 8.266 -17.522 -7.306
82 H ASP 9 H ASP 9 2.411 -21.864 -3.438
83 HA ASP 9 HA ASP 9 1.483 -23.114 -5.828
84 1HB ASP 9 2HB ASP 9 0.282 -22.271 -3.241
85 2HB ASP 9 1HB ASP 9 -0.814 -22.481 -4.603
86 HA PRO 10 HA PRO 10 0.187 -19.734 -8.322
87 1HB PRO 10 2HB PRO 10 -2.334 -20.460 -9.105
88 2HB PRO 10 1HB PRO 10 -0.856 -21.154 -9.779
89 1HG PRO 10 2HG PRO 10 -2.670 -22.245 -7.665
90 2HG PRO 10 1HG PRO 10 -1.886 -23.089 -9.013
91 1HD PRO 10 2HD PRO 10 -0.931 -23.222 -6.499
92 2HD PRO 10 1HD PRO 10 0.143 -23.227 -7.913
93 H ARG 11 H ARG 11 -2.565 -20.796 -6.306
94 HA ARG 11 HA ARG 11 -3.698 -18.182 -6.175
95 1HB ARG 11 2HB ARG 11 -4.260 -20.526 -4.354
96 2HB ARG 11 1HB ARG 11 -5.299 -19.139 -4.646
97 1HG ARG 11 2HG ARG 11 -4.525 -21.150 -6.746
98 2HG ARG 11 1HG ARG 11 -6.020 -21.200 -5.810
99 1HD ARG 11 2HD ARG 11 -6.956 -19.507 -6.971
100 2HD ARG 11 1HD ARG 11 -5.432 -18.635 -7.130
101 HE ARG 11 HE ARG 11 -5.210 -20.849 -8.755
102 1HH1 ARG 11 1HH1 ARG 11 -7.322 -18.080 -8.529
103 2HH1 ARG 11 2HH1 ARG 11 -7.655 -18.038 -10.228
104 1HH2 ARG 11 1HH2 ARG 11 -5.646 -20.794 -10.991
105 2HH2 ARG 11 2HH2 ARG 11 -6.704 -19.578 -11.625
106 H GLN 12 H GLN 12 -1.933 -20.198 -3.834
107 HA GLN 12 HA GLN 12 -1.964 -18.402 -1.699
108 1HB GLN 12 2HB GLN 12 0.250 -20.345 -2.368
109 2HB GLN 12 1HB GLN 12 -0.121 -19.677 -0.785
110 1HG GLN 12 2HG GLN 12 -1.804 -21.585 -2.386
111 2HG GLN 12 1HG GLN 12 -0.925 -21.927 -0.898
112 1HE2 GLN 12 1HE2 GLN 12 -1.526 -20.003 0.780
113 2HE2 GLN 12 2HE2 GLN 12 -3.226 -19.891 1.064
114 H ALA 13 H ALA 13 0.578 -18.897 -4.150
115 HA ALA 13 HA ALA 13 2.257 -16.830 -3.251
116 1HB ALA 13 1HB ALA 13 3.411 -17.056 -5.355
117 2HB ALA 13 2HB ALA 13 2.036 -17.907 -6.058
118 3HB ALA 13 3HB ALA 13 2.966 -18.655 -4.760
119 H LEU 14 H LEU 14 -0.438 -16.856 -5.521
120 HA LEU 14 HA LEU 14 -0.036 -14.249 -6.551
121 1HB LEU 14 2HB LEU 14 -2.304 -16.186 -6.493
122 2HB LEU 14 1HB LEU 14 -2.644 -14.520 -6.922
123 HG LEU 14 HG LEU 14 -0.533 -16.129 -8.338
124 1HD1 LEU 14 1HD1 LEU 14 -2.935 -17.105 -8.370
125 2HD1 LEU 14 2HD1 LEU 14 -2.051 -16.923 -9.885
126 3HD1 LEU 14 3HD1 LEU 14 -3.284 -15.744 -9.435
127 1HD2 LEU 14 1HD2 LEU 14 -0.489 -14.432 -9.884
128 2HD2 LEU 14 2HD2 LEU 14 -0.809 -13.524 -8.406
129 3HD2 LEU 14 3HD2 LEU 14 -2.130 -13.903 -9.512
130 H VAL 15 H VAL 15 -1.899 -15.520 -3.833
131 HA VAL 15 HA VAL 15 -3.110 -13.049 -3.125
132 HB VAL 15 HB VAL 15 -2.536 -15.409 -1.322
133 1HG1 VAL 15 1HG1 VAL 15 -4.480 -13.115 -1.106
134 2HG1 VAL 15 2HG1 VAL 15 -3.120 -13.470 -0.041
135 3HG1 VAL 15 3HG1 VAL 15 -4.516 -14.547 -0.077
136 1HG2 VAL 15 1HG2 VAL 15 -4.061 -15.452 -3.606
137 2HG2 VAL 15 2HG2 VAL 15 -5.251 -15.115 -2.350
138 3HG2 VAL 15 3HG2 VAL 15 -4.231 -16.548 -2.235
139 H GLY 16 H GLY 16 0.019 -14.430 -2.629
140 1HA GLY 16 2HA GLY 16 0.749 -12.833 -0.364
141 2HA GLY 16 1HA GLY 16 1.842 -13.760 -1.386
142 H LEU 17 H LEU 17 1.440 -12.690 -3.837
143 HA LEU 17 HA LEU 17 2.985 -10.336 -3.771
144 1HB LEU 17 2HB LEU 17 1.299 -10.752 -6.157
145 2HB LEU 17 1HB LEU 17 3.021 -10.455 -6.039
146 HG LEU 17 HG LEU 17 1.596 -13.084 -5.721
147 1HD1 LEU 17 1HD1 LEU 17 3.077 -13.703 -7.622
148 2HD1 LEU 17 2HD1 LEU 17 3.553 -12.008 -7.732
149 3HD1 LEU 17 3HD1 LEU 17 1.873 -12.472 -8.005
150 1HD2 LEU 17 1HD2 LEU 17 3.260 -13.321 -4.139
151 2HD2 LEU 17 2HD2 LEU 17 4.368 -12.250 -4.993
152 3HD2 LEU 17 3HD2 LEU 17 4.076 -13.881 -5.598
153 H ALA 18 H ALA 18 -0.395 -10.812 -4.717
154 HA ALA 18 HA ALA 18 -1.127 -8.168 -5.056
155 1HB ALA 18 1HB ALA 18 -2.974 -10.233 -3.889
156 2HB ALA 18 2HB ALA 18 -2.475 -10.248 -5.580
157 3HB ALA 18 3HB ALA 18 -3.375 -8.873 -4.939
158 H THR 19 H THR 19 -1.408 -10.112 -2.074
159 HA THR 19 HA THR 19 -2.406 -7.982 -0.496
160 HB THR 19 HB THR 19 -0.941 -10.483 0.375
161 HG1 THR 19 1HG THR 19 -2.856 -11.455 0.356
162 1HG2 THR 19 1HG2 THR 19 -0.973 -9.249 2.311
163 2HG2 THR 19 2HG2 THR 19 -2.505 -10.118 2.409
164 3HG2 THR 19 3HG2 THR 19 -2.479 -8.432 1.893
165 H PHE 20 H PHE 20 0.798 -9.065 -1.326
166 HA PHE 20 HA PHE 20 2.290 -7.746 0.633
167 1HB PHE 20 2HB PHE 20 2.817 -8.977 -1.978
168 2HB PHE 20 1HB PHE 20 3.928 -7.675 -1.571
169 HD1 PHE 20 1HD PHE 20 5.912 -8.798 -1.119
170 HD2 PHE 20 2HD PHE 20 2.304 -10.100 0.724
171 HE1 PHE 20 1HE PHE 20 7.200 -10.337 0.305
172 HE2 PHE 20 2HE PHE 20 3.586 -11.640 2.153
173 HZ PHE 20 HZ PHE 20 6.036 -11.759 1.944
174 H LEU 21 H LEU 21 2.052 -6.674 -2.772
175 HA LEU 21 HA LEU 21 2.928 -4.071 -2.176
176 1HB LEU 21 2HB LEU 21 2.766 -3.625 -4.405
177 2HB LEU 21 1HB LEU 21 2.812 -5.372 -4.447
178 HG LEU 21 HG LEU 21 1.186 -4.667 -6.022
179 1HD1 LEU 21 1HD1 LEU 21 -0.888 -5.303 -4.148
180 2HD1 LEU 21 2HD1 LEU 21 0.531 -6.310 -3.861
181 3HD1 LEU 21 3HD1 LEU 21 -0.217 -6.275 -5.458
182 1HD2 LEU 21 1HD2 LEU 21 -0.228 -2.934 -5.819
183 2HD2 LEU 21 2HD2 LEU 21 0.881 -2.437 -4.540
184 3HD2 LEU 21 3HD2 LEU 21 -0.606 -3.297 -4.135
185 H PHE 22 H PHE 22 -0.257 -5.506 -2.221
186 HA PHE 22 HA PHE 22 -1.808 -3.175 -2.261
187 1HB PHE 22 2HB PHE 22 -2.827 -5.357 -2.548
188 2HB PHE 22 1HB PHE 22 -2.342 -5.837 -0.926
189 HD1 PHE 22 1HD PHE 22 -4.095 -5.965 0.535
190 HD2 PHE 22 2HD PHE 22 -4.111 -2.906 -2.423
191 HE1 PHE 22 1HE PHE 22 -6.233 -5.127 1.418
192 HE2 PHE 22 2HE PHE 22 -6.248 -2.061 -1.544
193 HZ PHE 22 HZ PHE 22 -7.312 -3.172 0.380
194 H VAL 23 H VAL 23 -0.800 -5.110 0.555
195 HA VAL 23 HA VAL 23 -1.685 -3.253 2.469
196 HB VAL 23 HB VAL 23 -0.603 -4.596 4.094
197 1HG1 VAL 23 1HG1 VAL 23 -2.231 -6.061 3.692
198 2HG1 VAL 23 2HG1 VAL 23 -1.060 -6.984 2.752
199 3HG1 VAL 23 3HG1 VAL 23 -2.108 -5.815 1.950
200 1HG2 VAL 23 1HG2 VAL 23 0.986 -6.413 3.485
201 2HG2 VAL 23 2HG2 VAL 23 1.619 -4.788 3.231
202 3HG2 VAL 23 3HG2 VAL 23 1.052 -5.740 1.859
203 H LEU 24 H LEU 24 1.594 -3.968 1.287
204 HA LEU 24 HA LEU 24 3.028 -2.147 2.768
205 1HB LEU 24 2HB LEU 24 3.764 -3.932 1.026
206 2HB LEU 24 1HB LEU 24 3.642 -2.617 -0.128
207 HG LEU 24 HG LEU 24 5.932 -2.896 0.635
208 1HD1 LEU 24 1HD1 LEU 24 5.023 -0.644 0.079
209 2HD1 LEU 24 2HD1 LEU 24 6.392 -0.616 1.192
210 3HD1 LEU 24 3HD1 LEU 24 4.753 -0.384 1.803
211 1HD2 LEU 24 1HD2 LEU 24 6.603 -2.868 2.842
212 2HD2 LEU 24 2HD2 LEU 24 5.068 -3.730 2.948
213 3HD2 LEU 24 3HD2 LEU 24 5.152 -2.022 3.382
214 H ALA 25 H ALA 25 1.741 -1.640 -0.506
215 HA ALA 25 HA ALA 25 2.418 1.056 -0.727
216 1HB ALA 25 1HB ALA 25 0.072 -0.303 -2.039
217 2HB ALA 25 2HB ALA 25 1.740 -0.419 -2.601
218 3HB ALA 25 3HB ALA 25 0.917 1.140 -2.597
219 H LEU 26 H LEU 26 -0.408 -0.465 0.743
220 HA LEU 26 HA LEU 26 -1.969 1.876 0.910
221 1HB LEU 26 2HB LEU 26 -3.518 0.601 1.918
222 2HB LEU 26 1HB LEU 26 -2.498 -0.705 1.362
223 HG LEU 26 HG LEU 26 -1.397 -0.589 3.686
224 1HD1 LEU 26 1HD1 LEU 26 -3.429 0.186 5.274
225 2HD1 LEU 26 2HD1 LEU 26 -3.594 1.351 3.959
226 3HD1 LEU 26 3HD1 LEU 26 -2.072 1.225 4.840
227 1HD2 LEU 26 1HD2 LEU 26 -4.195 -1.440 4.034
228 2HD2 LEU 26 2HD2 LEU 26 -2.694 -2.329 4.295
229 3HD2 LEU 26 3HD2 LEU 26 -3.334 -2.138 2.662
230 H LEU 27 H LEU 27 0.135 0.347 3.368
231 HA LEU 27 HA LEU 27 -0.261 2.402 5.275
232 1HB LEU 27 2HB LEU 27 2.081 1.454 6.097
233 2HB LEU 27 1HB LEU 27 0.572 0.612 6.374
234 1HD1 LEU 27 1HD1 LEU 27 3.468 -1.166 5.983
235 2HD1 LEU 27 2HD1 LEU 27 3.722 0.508 5.490
236 3HD1 LEU 27 3HD1 LEU 27 3.819 -0.788 4.297
237 1HD2 LEU 27 1HD2 LEU 27 0.018 -1.358 5.349
238 2HD2 LEU 27 2HD2 LEU 27 1.389 -1.822 6.356
239 3HD2 LEU 27 3HD2 LEU 27 1.303 -2.364 4.681
240 H ILE 28 H ILE 28 2.386 1.798 2.977
241 HA ILE 28 HA ILE 28 3.943 4.023 3.671
242 HB ILE 28 HB ILE 28 3.782 2.256 1.273
243 1HG1 ILE 28 2HG1 ILE 28 6.133 1.863 1.824
244 2HG1 ILE 28 1HG1 ILE 28 6.072 3.125 3.050
245 1HG2 ILE 28 1HG2 ILE 28 5.665 3.606 0.246
246 2HG2 ILE 28 2HG2 ILE 28 5.182 4.917 1.321
247 3HG2 ILE 28 3HG2 ILE 28 4.048 4.299 0.121
248 1HD1 ILE 28 1HD1 ILE 28 5.825 0.560 3.636
249 2HD1 ILE 28 2HD1 ILE 28 4.132 0.905 3.284
250 3HD1 ILE 28 3HD1 ILE 28 4.975 1.815 4.536
251 H HIS 29 H HIS 29 1.731 3.669 0.880
252 HA HIS 29 HA HIS 29 1.851 6.296 -0.003
253 1HB HIS 29 2HB HIS 29 0.775 4.420 -1.236
254 2HB HIS 29 1HB HIS 29 -0.573 4.488 -0.104
255 HD1 HIS 29 1HD HIS 29 -2.497 5.651 -1.106
256 HD2 HIS 29 2HD HIS 29 1.110 7.273 -2.384
257 HE1 HIS 29 1HE HIS 29 -3.117 7.533 -2.655
258 HE2 HIS 29 2HE HIS 29 -0.920 8.549 -3.354
259 H PHE 30 H PHE 30 -0.032 4.886 2.582
260 HA PHE 30 HA PHE 30 -1.795 7.024 3.028
261 1HB PHE 30 2HB PHE 30 -2.180 4.804 3.977
262 2HB PHE 30 1HB PHE 30 -0.738 4.961 4.972
263 HD1 PHE 30 1HD PHE 30 -4.161 6.201 4.436
264 HD2 PHE 30 2HD PHE 30 -0.773 6.174 7.011
265 HE1 PHE 30 1HE PHE 30 -5.516 7.214 6.223
266 HE2 PHE 30 2HE PHE 30 -2.122 7.187 8.802
267 HZ PHE 30 HZ PHE 30 -4.498 7.708 8.409
268 H ILE 31 H ILE 31 1.465 6.333 4.232
269 HA ILE 31 HA ILE 31 1.485 8.512 6.069
270 HB ILE 31 HB ILE 31 3.056 6.331 5.802
271 1HG1 ILE 31 2HG1 ILE 31 4.641 7.598 7.396
272 2HG1 ILE 31 1HG1 ILE 31 3.540 8.957 7.187
273 1HG2 ILE 31 1HG2 ILE 31 5.305 6.984 5.187
274 2HG2 ILE 31 2HG2 ILE 31 4.749 8.609 4.790
275 3HG2 ILE 31 3HG2 ILE 31 4.206 7.233 3.831
276 1HD1 ILE 31 1HD1 ILE 31 3.051 6.316 8.491
277 2HD1 ILE 31 2HD1 ILE 31 1.708 7.279 7.874
278 3HD1 ILE 31 3HD1 ILE 31 2.773 7.943 9.114
279 H LEU 32 H LEU 32 2.820 8.053 2.798
280 HA LEU 32 HA LEU 32 4.007 10.610 2.601
281 1HB LEU 32 2HB LEU 32 2.931 9.253 0.171
282 2HB LEU 32 1HB LEU 32 4.435 10.127 0.382
283 HG LEU 32 HG LEU 32 3.819 7.338 1.335
284 1HD1 LEU 32 1HD1 LEU 32 4.307 7.144 -0.911
285 2HD1 LEU 32 2HD1 LEU 32 5.896 6.951 -0.169
286 3HD1 LEU 32 3HD1 LEU 32 5.440 8.497 -0.888
287 1HD2 LEU 32 1HD2 LEU 32 5.871 7.242 2.414
288 2HD2 LEU 32 2HD2 LEU 32 5.281 8.846 2.845
289 3HD2 LEU 32 3HD2 LEU 32 6.490 8.664 1.574
290 H LEU 33 H LEU 33 0.944 9.371 1.297
291 HA LEU 33 HA LEU 33 0.008 11.775 0.241
292 1HB LEU 33 2HB LEU 33 -1.593 10.386 -0.448
293 2HB LEU 33 1HB LEU 33 -0.958 9.140 0.595
294 HG LEU 33 HG LEU 33 -2.903 11.171 1.646
295 1HD1 LEU 33 1HD1 LEU 33 -3.661 8.520 0.440
296 2HD1 LEU 33 2HD1 LEU 33 -3.808 10.056 -0.413
297 3HD1 LEU 33 3HD1 LEU 33 -4.734 9.773 1.062
298 1HD2 LEU 33 1HD2 LEU 33 -2.560 10.027 3.518
299 2HD2 LEU 33 2HD2 LEU 33 -1.508 8.892 2.674
300 3HD2 LEU 33 3HD2 LEU 33 -3.246 8.602 2.737
301 H SER 34 H SER 34 -0.263 10.409 3.475
302 HA SER 34 HA SER 34 -2.040 12.291 4.563
303 1HB SER 34 2HB SER 34 -1.634 10.269 5.773
304 2HB SER 34 1HB SER 34 0.099 10.586 5.844
305 HG SER 34 HG SER 34 -1.564 11.176 7.683
306 H THR 35 H THR 35 1.515 12.149 4.841
307 HA THR 35 HA THR 35 1.813 14.610 6.151
308 HB THR 35 HB THR 35 3.792 13.248 4.315
309 HG1 THR 35 1HG THR 35 3.181 11.829 5.919
310 1HG2 THR 35 1HG2 THR 35 4.125 15.321 6.454
311 2HG2 THR 35 2HG2 THR 35 4.690 15.358 4.783
312 3HG2 THR 35 3HG2 THR 35 5.443 14.264 5.944
313 H GLU 36 H GLU 36 2.090 13.829 2.699
314 HA GLU 36 HA GLU 36 2.698 16.419 1.816
315 1HB GLU 36 2HB GLU 36 2.902 14.230 0.529
316 2HB GLU 36 1HB GLU 36 1.178 14.369 0.212
317 1HG GLU 36 2HG GLU 36 1.437 16.108 -1.232
318 2HG GLU 36 1HG GLU 36 2.898 16.694 -0.438
319 H ARG 37 H ARG 37 -0.373 14.795 2.392
320 HA ARG 37 HA ARG 37 -2.039 16.724 1.180
321 1HB ARG 37 2HB ARG 37 -2.832 14.479 1.759
322 2HB ARG 37 1HB ARG 37 -2.627 14.835 3.469
323 1HG ARG 37 2HG ARG 37 -4.553 15.981 3.595
324 2HG ARG 37 1HG ARG 37 -4.334 16.724 2.008
325 1HD ARG 37 2HD ARG 37 -6.156 15.360 1.640
326 2HD ARG 37 1HD ARG 37 -4.824 14.329 1.118
327 HE ARG 37 HE ARG 37 -5.429 13.930 3.867
328 1HH1 ARG 37 1HH1 ARG 37 -6.527 13.162 0.645
329 2HH1 ARG 37 2HH1 ARG 37 -7.304 11.690 1.125
330 1HH2 ARG 37 1HH2 ARG 37 -6.450 11.994 4.500
331 2HH2 ARG 37 2HH2 ARG 37 -7.261 11.028 3.314
332 H PHE 38 H PHE 38 -0.899 16.325 4.514
333 HA PHE 38 HA PHE 38 -2.296 18.489 5.630
334 1HB PHE 38 2HB PHE 38 -0.810 16.561 6.707
335 2HB PHE 38 1HB PHE 38 0.425 17.814 6.652
336 HD1 PHE 38 1HD PHE 38 -1.889 16.350 8.707
337 HD2 PHE 38 2HD PHE 38 -0.598 20.211 7.467
338 HE1 PHE 38 1HE PHE 38 -2.784 17.314 10.786
339 HE2 PHE 38 2HE PHE 38 -1.490 21.181 9.545
340 HZ PHE 38 HZ PHE 38 -2.585 19.732 11.207
341 H ASN 39 H ASN 39 1.148 18.337 4.702
342 HA ASN 39 HA ASN 39 1.633 21.086 4.929
343 1HB ASN 39 2HB ASN 39 3.009 18.917 3.353
344 2HB ASN 39 1HB ASN 39 3.596 20.576 3.382
345 1HD2 ASN 39 1HD2 ASN 39 5.283 18.723 4.227
346 2HD2 ASN 39 2HD2 ASN 39 5.450 18.751 5.947
347 H TRP 40 H TRP 40 -0.037 19.313 2.550
348 HA TRP 40 HA TRP 40 0.367 20.998 0.300
349 1HB TRP 40 2HB TRP 40 -1.351 18.707 0.980
350 2HB TRP 40 1HB TRP 40 -2.095 19.853 -0.128
351 HD1 TRP 40 HD TRP 40 1.662 19.359 -0.372
352 HE1 TRP 40 1HE TRP 40 2.204 18.118 -2.561
353 HE3 TRP 40 3HE TRP 40 -3.087 18.110 -1.798
354 HZ2 TRP 40 2HZ TRP 40 0.806 16.787 -4.620
355 HZ3 TRP 40 3HZ TRP 40 -3.398 16.853 -3.891
356 HH2 TRP 40 HH TRP 40 -1.491 16.207 -5.272
357 H LEU 41 H LEU 41 -2.617 20.487 2.153
358 HA LEU 41 HA LEU 41 -3.746 22.970 1.414
359 1HB LEU 41 2HB LEU 41 -5.162 21.158 2.164
360 2HB LEU 41 1HB LEU 41 -4.346 21.108 3.715
361 HG LEU 41 HG LEU 41 -5.229 23.378 4.212
362 1HD1 LEU 41 1HD1 LEU 41 -7.250 23.172 2.081
363 2HD1 LEU 41 2HD1 LEU 41 -5.628 23.628 1.562
364 3HD1 LEU 41 3HD1 LEU 41 -6.469 24.591 2.776
365 1HD2 LEU 41 1HD2 LEU 41 -7.084 21.090 3.650
366 2HD2 LEU 41 2HD2 LEU 41 -7.670 22.597 4.354
367 3HD2 LEU 41 3HD2 LEU 41 -6.445 21.648 5.197
368 H GLU 42 H GLU 42 -1.305 22.087 3.605
369 HA GLU 42 HA GLU 42 -1.616 24.019 5.590
370 1HB GLU 42 2HB GLU 42 -0.115 22.122 5.866
371 2HB GLU 42 1HB GLU 42 0.910 22.736 4.577
372 1HG GLU 42 2HG GLU 42 1.190 24.815 6.019
373 2HG GLU 42 1HG GLU 42 0.490 23.855 7.324
374 H GLY 43 H GLY 43 0.894 24.023 3.076
375 1HA GLY 43 2HA GLY 43 1.291 26.844 3.291
376 2HA GLY 43 1HA GLY 43 2.035 25.775 2.114
377 H ALA 44 H ALA 44 -1.146 25.144 1.786
378 HA ALA 44 HA ALA 44 -1.357 26.519 -0.677
379 1HB ALA 44 1HB ALA 44 -3.786 25.762 -0.529
380 2HB ALA 44 2HB ALA 44 -3.331 24.988 0.990
381 3HB ALA 44 3HB ALA 44 -2.549 24.503 -0.515
382 H SER 45 H SER 45 -2.373 27.255 2.578
383 HA SER 45 HA SER 45 -4.145 29.381 1.862
384 1HB SER 45 2HB SER 45 -2.892 28.548 4.478
385 2HB SER 45 1HB SER 45 -3.988 29.923 4.335
386 H THR 46 H THR 46 -0.873 29.241 1.535
387 HA THR 46 HA THR 46 -0.667 32.143 1.649
388 HB THR 46 HB THR 46 1.228 32.210 3.044
389 HG1 THR 46 1HG THR 46 2.383 30.472 2.228
390 1HG2 THR 46 1HG2 THR 46 0.644 31.040 5.096
391 2HG2 THR 46 2HG2 THR 46 -0.528 30.064 4.210
392 3HG2 THR 46 3HG2 THR 46 -0.769 31.804 4.367
393 H LYS 47 H LYS 47 1.151 29.149 0.982
394 HA LYS 47 HA LYS 47 2.455 28.524 -0.770
395 1HB LYS 47 2HB LYS 47 0.462 30.289 -1.906
396 2HB LYS 47 1HB LYS 47 1.978 30.401 -2.791
397 1HG LYS 47 2HG LYS 47 1.701 27.706 -2.507
398 2HG LYS 47 1HG LYS 47 0.024 28.229 -2.663
399 1HD LYS 47 2HD LYS 47 0.392 29.165 -4.776
400 2HD LYS 47 1HD LYS 47 2.142 29.197 -4.556
401 1HE LYS 47 2HE LYS 47 2.321 26.863 -4.836
402 2HE LYS 47 1HE LYS 47 0.584 26.629 -4.649
403 1HZ LYS 47 1HZ LYS 47 1.571 28.281 -6.867
404 2HZ LYS 47 2HZ LYS 47 0.166 27.345 -6.768
405 3HZ LYS 47 3HZ LYS 47 1.667 26.597 -6.996
406 HA PRO 48 HA PRO 48 6.187 30.840 -0.706
407 1HB PRO 48 2HB PRO 48 7.095 30.678 -3.299
408 2HB PRO 48 1HB PRO 48 7.251 29.387 -2.105
409 1HG PRO 48 2HG PRO 48 5.235 29.720 -4.286
410 2HG PRO 48 1HG PRO 48 6.058 28.250 -3.734
411 1HD PRO 48 2HD PRO 48 3.520 28.805 -3.036
412 2HD PRO 48 1HD PRO 48 4.638 27.980 -1.929
413 H VAL 49 H VAL 49 4.682 31.557 -3.870
414 HA VAL 49 HA VAL 49 4.598 34.387 -3.168
415 HB VAL 49 HB VAL 49 5.892 33.478 -5.739
416 1HG1 VAL 49 1HG1 VAL 49 6.578 35.861 -5.864
417 2HG1 VAL 49 2HG1 VAL 49 5.583 36.183 -4.444
418 3HG1 VAL 49 3HG1 VAL 49 4.832 35.627 -5.939
419 1HG2 VAL 49 1HG2 VAL 49 7.404 32.870 -4.010
420 2HG2 VAL 49 2HG2 VAL 49 7.134 34.386 -3.151
421 3HG2 VAL 49 3HG2 VAL 49 7.993 34.387 -4.691
422 H GLN 50 H GLN 50 4.076 32.111 -5.866
423 HA GLN 50 HA GLN 50 2.203 31.660 -7.096
424 1HB GLN 50 2HB GLN 50 0.672 33.773 -5.599
425 2HB GLN 50 1HB GLN 50 0.057 32.332 -6.400
426 1HG GLN 50 2HG GLN 50 1.534 31.104 -4.609
427 2HG GLN 50 1HG GLN 50 1.344 32.625 -3.736
428 1HE2 GLN 50 1HE2 GLN 50 -0.246 32.576 -2.339
429 2HE2 GLN 50 2HE2 GLN 50 -1.739 31.723 -2.511
430 H THR 51 H THR 51 1.711 32.352 -9.097
431 HA THR 51 HA THR 51 2.715 34.923 -9.924
432 HB THR 51 HB THR 51 1.241 32.862 -11.572
433 HG1 THR 51 1HG THR 51 4.038 33.150 -11.235
434 1HG2 THR 51 1HG2 THR 51 1.356 34.644 -12.989
435 2HG2 THR 51 2HG2 THR 51 2.913 33.879 -13.309
436 3HG2 THR 51 3HG2 THR 51 2.823 35.284 -12.246
437 H SER 52 H SER 52 1.265 36.290 -8.739
438 HA SER 52 HA SER 52 -1.155 36.861 -10.242
439 1HB SER 52 2HB SER 52 -1.140 35.985 -7.371
440 2HB SER 52 1HB SER 52 -2.367 37.115 -7.941
441 HG SER 52 HG SER 52 -1.836 34.659 -9.242